A0A077Z9E6_TRITR Loading...

Elongator complex protein 1

Component of the elongator complex which is required for multiple tRNA modifications, including mcm5U (5-methoxycarbonylmethyl uridine), mcm5s2U (5-methoxycarbonylmethyl-2-thiouridine), and ncm5U (5-carbamoylmethyl uridine). The elongator complex catalyzes formation of carboxymethyluridine in the wobble base at position 34 in tRNAs.

AlphaFold DB , UniProt , Accession A0A077Z9E6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,275 aa.

						>A0A077Z9E6_TRITR|A0A077Z9E6
MFFRAECEEPLKLKFSLAGFRLTPITGCHPQSDDMVEKQHRQLTDALMAVYNPLIPGIWKTSVNQVCTMKDDRIIEFVYVPVDMMCYFVTKRGSIYSLKEGENLLLEIVSVDLMLAAAAWSPDSVLLALAEHLLAPVSQANTGAVICWDSLGECIAVSVFSPARGRSVHIWNSKLVHLRSLEYSPSIGLPICWRPSGGRIVCCEFSHEDSPTIIIFEEKGLKHHQFSLPKFFTGFEVCFMAWSSQSDVLALHLRSQANDADYVLLYTICNYHWYLKKTLCFVAPKSVTCLKWEAEQPRSLHIVFNDWSCLHLDVIWSTCRKNSTVAVLDEDTVFFTNFSNGVTPPPMYQASIKLDFFVNEVTFGHNEDELYALLSNHMICCISRERDSEIYTTVNLENDTLSENPFWYNLSYVDQHHLLLLLNDRSALFLVVLEVDWATCTVQAKCMHPLPWLSVKVWTFYRASEVLIFLQTATGSILKFTLPDLLNNELDLSQVFHCGSASYCSQVEMLECFNKVHLISLNEFSKLYVDEHLLCSTVTSFMVHCDEYLLFTTISHKLCVIPIKRVVQKRFKYDDEILSATGNILSDYRPVERGSRIVTSFGTSVVFQLPRGNLETVHPLPLLLRSTCDKLDQCDFRKAMLLMRKHSLDMNLVYDYNPDSFQKNVRQFIRQCGNEYLNLFISQLCPANVVCSLYEFYFGKSDSHPVSSALPICNSTKNITAIFRLMLDEIQALPERNSFLLVALLLHIKLEEAEKGLLFLKEHCHEKSKSCSFADGIRHMLYFMSSEELFNAALGTYDLDLVQKVAQSVDRDPKEYLPILNALEPLERDYRKYKIDCILKRPISALKNLALCRLDHFEEVLNHIERHSLYAQAIIMYKDQPEQLMVIQSKFAEFLESRKQFSDAGIHYERCDRFDDALRCYKQSLTWHPAWTLMTTKMKLTEGQIDEVADFFVKRLCEMSRYATACDILRQIGKKQDMLAEILIQGCFWMNAFYQVNSLDDDHPLTQMLRTKVISTAQRIIEEANKQMEDLAACSDRLNVIRQEKLDRQGDFCGYAYEDIALLDRLSDLVLGIERRQEEVAELLRVLAHMNLFEEAKCLQDAFSLLKDAVSCKISVIWPEVIHVNQLPTVSHQGERSCLTEATTNGVVWLAESLVIPRHRNECGWKLPDVYLNHTLAVMNHLNTSIVSLTLTVLLFAAIRLMQTQLSAETSKLPPFLGGFLGSNIFILLLTAVSNLEMEIFDDTFQARFFPEVVCCLFLGALAASTVHRISVTLW
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	41.9	Very low	37.4	Very low	41 Å²	41	85.2 Å²	85.2	20%	0.202	44%	0.444	C	S	.	.				0	140.5	0	-74	169.5	-85.1	0	0	107.8	L17 A18 V111 L113 L129	M1-L17 HydrophobicContact CB-CD1 4.13Å; M1-L17 HydrophobicContact CG-CD1 4.04Å; M1-L17 HydrophobicContact SD-CD1 3.9Å; M1-A18 WeakPolarHBondContact CA-O 3.27Å; M1-V111 HydrophobicContact CE-CG1 3.94Å; M1-V111 HydrophobicContact SD-CG1 4.2Å; M1-L113 HydrophobicContact CE-CD1 3.31Å; M1-L113 HydrophobicContact SD-CD1 4.18Å; M1-L129 HydrophobicContact CB-CB 4.45Å; M1-L129 PolarHBondContact N-O 3.08Å; M1-L129 PolarHBondContact O-N 3.03Å
2	F	42.7	Very low	36.9	Very low	11 Å²	11	90.2 Å²	90.2	5%	0.048	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	144.7	165.8	-80.8	-49.9	0	0	0	110.5	S16 A18 L127 A128 W148 I155 S173 L175	F2-S16 VanDerWaalsContact O-O 3.04Å; F2-A18 PolarHBondContact N-O 3.43Å; F2-A18 VanDerWaalsContact N-O 3.15Å; F2-L127 WeakPolarHBondContact CA-O 3.46Å; F2-A128 HydrophobicContact CD1-CB 4.05Å; F2-A128 HydrophobicContact CE1-CB 3.61Å; F2-W148 HydrophobicContact CD1-CH2 4.14Å; F2-W148 HydrophobicContact CD1-CZ2 4.19Å; F2-W148 AromaticContact CE1-CH2 3.26Å; F2-W148 HydrophobicContact CE1-CH2 3.26Å; F2-W148 AromaticContact CE1-CZ2 3.4Å; F2-W148 HydrophobicContact CE1-CZ2 3.4Å; F2-W148 HydrophobicContact CE1-CZ3 4.31Å; F2-W148 AromaticContact CZ-CH2 3.63Å; F2-W148 HydrophobicContact CZ-CH2 3.63Å; F2-W148 HydrophobicContact CZ-CZ2 4.16Å; F2-W148 HydrophobicContact CZ-CZ3 4.31Å; F2-I155 HydrophobicContact CE1-CD1 4.03Å; F2-I155 HydrophobicContact CZ-CD1 4.16Å; F2-I155 HydrophobicContact CZ-CG2 4.06Å; F2-S173 WeakPolarHBondContact CD2-O 3.38Å; F2-S173 WeakPolarHBondContact CE2-O 3.43Å; F2-L175 HydrophobicContact CD2-CB 4.43Å; F2-L175 HydrophobicContact CD2-CD1 3.71Å; F2-L175 HydrophobicContact CD2-CD2 3.54Å; F2-L175 HydrophobicContact CD2-CG 3.23Å; F2-L175 HydrophobicContact CE1-CD2 4.35Å; F2-L175 HydrophobicContact CE2-CB 4.28Å; F2-L175 HydrophobicContact CE2-CD1 4.17Å; F2-L175 HydrophobicContact CE2-CD2 3.1Å; F2-L175 HydrophobicContact CE2-CG 3.23Å; F2-L175 HydrophobicContact CG-CD1 4.25Å; F2-L175 HydrophobicContact CG-CD2 4.28Å; F2-L175 HydrophobicContact CG-CG 4.16Å; F2-L175 HydrophobicContact CZ-CD2 3.57Å; F2-L175 HydrophobicContact CZ-CG 4.19Å
3	F	43.3	Very low	36.6	Very low	13 Å²	13	87 Å²	87	6%	0.057	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	119.4	167.7	-82.1	-52.2	0	0	0	107.8	F15 L17 I95 V109 V111 L127 L129	F3-F15 HydrophobicContact CB-CD1 3.63Å; F3-F15 HydrophobicContact CB-CE1 4.08Å; F3-F15 HydrophobicContact CD1-CB 3.65Å; F3-F15 AromaticContact CD1-CD1 3.41Å; F3-F15 HydrophobicContact CD1-CD1 3.41Å; F3-F15 VanDerWaalsContact CD1-CD1 3.41Å; F3-F15 HydrophobicContact CD1-CE1 4.42Å; F3-F15 AromaticContact CD1-CG 3.89Å; F3-F15 HydrophobicContact CD1-CG 3.89Å; F3-F15 HydrophobicContact CE1-CB 3.98Å; F3-F15 HydrophobicContact CE1-CD1 4.21Å; F3-F15 HydrophobicContact CE1-CG 4.36Å; F3-F15 AromaticContact CG-CD1 3.65Å; F3-F15 HydrophobicContact CG-CD1 3.65Å; F3-F15 HydrophobicContact CG-CE1 4.28Å; F3-L17 HydrophobicContact CE1-CD1 3.95Å; F3-L17 HydrophobicContact CZ-CD1 4.11Å; F3-I95 HydrophobicContact CD2-CD1 3.87Å; F3-I95 HydrophobicContact CE2-CD1 3.88Å; F3-V109 HydrophobicContact CE1-CG1 4.16Å; F3-V109 HydrophobicContact CE2-CG1 4.32Å; F3-V109 HydrophobicContact CZ-CG1 3.71Å; F3-V111 HydrophobicContact CE2-CG2 3.68Å; F3-V111 HydrophobicContact CZ-CG2 3.74Å; F3-L127 HydrophobicContact CB-CB 4.19Å; F3-L127 HydrophobicContact CD2-CD2 4.38Å; F3-L127 PolarHBondContact N-O 3.02Å; F3-L127 PolarHBondContact O-N 3.24Å; F3-L129 HydrophobicContact CD2-CD1 3.55Å; F3-L129 HydrophobicContact CD2-CG 4.24Å; F3-L129 HydrophobicContact CE2-CD1 3.32Å; F3-L129 HydrophobicContact CE2-CG 4.43Å
4	R	35.4	Very low	36.1	Very low	123 Å²	123	90.9 Å²	90.9	46%	0.464	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	124.6	172	-168.9	179.2	-168.4	-167.7	7.9	109.3	E6 L126	R4-E6 WeakPolarHBondContact CD-OE1 3.28Å; R4-E6 HydrophobicContact CG-CG 4.17Å; R4-E6 IonicContact CZ-OE1 3.35Å; R4-E6 IonicContact NE-OE1 3.57Å; R4-E6 IonicContact NH1-OE1 2.74Å; R4-E6 PolarHBondContact NH1-OE1 2.95Å; R4-E6 PolarHBondContact O-N 3.14Å; R4-L126 HydrophobicContact CB-CD2 3.99Å; R4-L126 HydrophobicContact CG-CD2 3.87Å
5	A	40.2	Very low	36.3	Very low	30 Å²	30	88 Å²	88	25%	0.248	44%	0.44	C	S	.	.			trans	-80.8	105.1	167.5	0	0	0	0	0	109.2	L13 V125	A5-L13 HydrophobicContact CB-CD2 3.41Å; A5-L13 VanDerWaalsContact CB-CD2 3.41Å; A5-V125 PolarHBondContact N-O 3.01Å
6	E	34.3	Very low	36.1	Very low	72 Å²	72	86.4 Å²	86.4	34%	0.336	44%	0.44	S	S	.	.			trans	-103.3	122.4	166.5	-72.3	179.1	179	0	0	108.6	R4	R4-E6 WeakPolarHBondContact CD-OE1 3.28Å; R4-E6 HydrophobicContact CG-CG 4.17Å; R4-E6 IonicContact CZ-OE1 3.35Å; R4-E6 IonicContact NE-OE1 3.57Å; R4-E6 IonicContact NH1-OE1 2.74Å; R4-E6 PolarHBondContact NH1-OE1 2.95Å; R4-E6 PolarHBondContact O-N 3.14Å
7	C	32.9	Very low	36	Very low	94 Å²	94	88.2 Å²	88.2	64%	0.635	45%	0.45	S	S	*	.	B	Isolated β-bridge	trans	-95.4	99.1	179.1	-154	0	0	0	0	108.8
8	E	37.5	Very low	36.3	Very low	162 Å²	162	85.8 Å²	85.8	76%	0.757	45%	0.446	S	S	*	.	S	Bend	trans	-101.4	-18.5	171.6	-80.9	-172.4	149.8	0	0	112.6
9	E	32.2	Very low	36.3	Very low	116 Å²	116	83.7 Å²	83.7	54%	0.542	45%	0.447	S	S	.	.	S	Bend	trans	-153.8	150.9	175	-76.5	-177.6	159.3	0	0	108.8	L11 K12	E9-L11 PolarHBondContact O-N 3.08Å; E9-K12 PolarHBondContact O-N 3.41Å
10	P	36.1	Very low	36.5	Very low	125 Å²	125	87.6 Å²	87.6	81%	0.812	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	8.2	-172.2	23.9	-33.4	0	0	0	116.3
11	L	34.5	Very low	36.2	Very low	150 Å²	150	93.7 Å²	93.7	79%	0.785	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143.7	9.1	-176.5	-76.5	166.4	0	0	0	114.5	E9	E9-L11 PolarHBondContact O-N 3.08Å
12	K	31.7	Very low	35.8	Very low	145 Å²	145	96.7 Å²	96.7	63%	0.63	49%	0.494	S	S	*	.			trans	-136.1	97.8	179	-77.8	178.7	-177.2	161.4	0	111.9	E9	E9-K12 PolarHBondContact O-N 3.41Å
13	L	32.7	Very low	35	Very low	49 Å²	49	102.8 Å²	102.8	26%	0.257	53%	0.532	S	S	.	.	B	Isolated β-bridge	trans	-79.6	116.9	164.5	-79.2	165.1	0	0	0	109.5	A5 F15 Y87	A5-L13 HydrophobicContact CB-CD2 3.41Å; A5-L13 VanDerWaalsContact CB-CD2 3.41Å; L13-F15 HydrophobicContact CB-CD2 4.42Å; L13-F15 HydrophobicContact CB-CE2 3.73Å; L13-F15 HydrophobicContact CB-CZ 4.13Å; L13-F15 HydrophobicContact CD1-CZ 4.39Å; L13-Y87 HydrophobicContact CD1-CE1 3.75Å; L13-Y87 WeakPolarHBondContact CD1-OH 3.37Å
14	K	29.6	Very low	34.3	Very low	142 Å²	142	106.4 Å²	106.4	62%	0.617	56%	0.557	S	S	*	*			trans	-92.7	103.2	176.1	-160.7	179.8	-174	-179	0	109.9	S16	K14-S16 PolarHBondContact O-N 3.13Å
15	F	38.8	Very low	33.9	Very low	47 Å²	47	108.9 Å²	108.9	21%	0.206	58%	0.577	C	S	.	*			trans	-76.3	112	176.6	-69.8	-81.3	0	0	0	110.9	F3 L13 I108 V109	F3-F15 HydrophobicContact CB-CD1 3.63Å; F3-F15 HydrophobicContact CB-CE1 4.08Å; F3-F15 HydrophobicContact CD1-CB 3.65Å; F3-F15 AromaticContact CD1-CD1 3.41Å; F3-F15 HydrophobicContact CD1-CD1 3.41Å; F3-F15 VanDerWaalsContact CD1-CD1 3.41Å; F3-F15 HydrophobicContact CD1-CE1 4.42Å; F3-F15 AromaticContact CD1-CG 3.89Å; F3-F15 HydrophobicContact CD1-CG 3.89Å; F3-F15 HydrophobicContact CE1-CB 3.98Å; F3-F15 HydrophobicContact CE1-CD1 4.21Å; F3-F15 HydrophobicContact CE1-CG 4.36Å; F3-F15 AromaticContact CG-CD1 3.65Å; F3-F15 HydrophobicContact CG-CD1 3.65Å; F3-F15 HydrophobicContact CG-CE1 4.28Å; L13-F15 HydrophobicContact CB-CD2 4.42Å; L13-F15 HydrophobicContact CB-CE2 3.73Å; L13-F15 HydrophobicContact CB-CZ 4.13Å; L13-F15 HydrophobicContact CD1-CZ 4.39Å; F15-I108 HydrophobicContact CD2-CG2 4.39Å; F15-I108 HydrophobicContact CE2-CB 4.31Å; F15-I108 HydrophobicContact CE2-CG2 3.37Å; F15-I108 HydrophobicContact CZ-CG2 3.91Å; F15-V109 HydrophobicContact CB-CG2 4.43Å; F15-V109 HydrophobicContact CD1-CG2 4.11Å; F15-V109 HydrophobicContact CD2-CG2 3.35Å; F15-V109 HydrophobicContact CE1-CG2 4.21Å; F15-V109 HydrophobicContact CE2-CG2 3.52Å; F15-V109 HydrophobicContact CG-CG2 3.68Å; F15-V109 HydrophobicContact CZ-CG2 3.93Å
16	S	33.7	Very low	33.3	Very low	63 Å²	63	114.1 Å²	114.1	44%	0.441	61%	0.606	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.1	129.3	167.3	57	0	0	0	0	110.3	F2 K14	F2-S16 VanDerWaalsContact O-O 3.04Å; K14-S16 PolarHBondContact O-N 3.13Å
17	L	34	Very low	33	Very low	116 Å²	116	114.2 Å²	114.2	61%	0.607	63%	0.626	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-96.1	122	-178.4	-167.7	86	0	0	0	110.5	M1 F3	M1-L17 HydrophobicContact CB-CD1 4.13Å; M1-L17 HydrophobicContact CG-CD1 4.04Å; M1-L17 HydrophobicContact SD-CD1 3.9Å; F3-L17 HydrophobicContact CE1-CD1 3.95Å; F3-L17 HydrophobicContact CZ-CD1 4.11Å
18	A	41.5	Very low	32.6	Very low	46 Å²	46	115.5 Å²	115.5	38%	0.38	64%	0.635	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.3	130.3	161	0	0	0	0	0	109	M1 F2 L175	M1-A18 WeakPolarHBondContact CA-O 3.27Å; F2-A18 PolarHBondContact N-O 3.43Å; F2-A18 VanDerWaalsContact N-O 3.15Å; A18-L175 HydrophobicContact CB-CD1 4.5Å; A18-L175 VanDerWaalsContact O-CD1 3.23Å; A18-L175 WeakPolarHBondContact O-CD1 3.39Å
19	G	37.1	Very low	32.3	Very low	46 Å²	46	116.3 Å²	116.3	47%	0.474	64%	0.638	S	S	.	*			trans	-151.3	143.5	-178	0	0	0	0	0	113
20	F	38.9	Very low	32.2	Very low	160 Å²	160	115.3 Å²	115.3	70%	0.702	64%	0.642	S	S	*	*			trans	-124.7	135	170.4	-75.1	-84.8	0	0	0	109	L175	F20-L175 HydrophobicContact CD2-CB 4.35Å
21	R	32.1	Very low	31.9	Very low	216 Å²	216	118.6 Å²	118.6	82%	0.815	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-89.9	116.4	172.3	-96.4	-178	174.6	173.8	-0.8	109.6
22	L	33.2	Very low	31.9	Very low	105 Å²	105	117.2 Å²	117.2	55%	0.55	65%	0.65	S	S	.	*	P	Polyproline II helix	trans	-76.6	125.3	161.5	-71.7	164.9	0	0	0	107.7	P24 W171	L22-P24 WeakPolarHBondContact O-CD 3.26Å; L22-W171 HydrophobicContact CD1-CZ2 4.33Å
23	T	25.3	Very low	31.9	Very low	139 Å²	139	114.3 Å²	114.3	85%	0.853	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-96.5	117.3	178	32	0	0	0	0	110.1
24	P	28.6	Very low	32.1	Very low	89 Å²	89	118.9 Å²	118.9	58%	0.578	67%	0.666	S	S	*	*			trans	-123.1	157	152.5	26.1	-8.4	0	0	0	112.5	L22	L22-P24 WeakPolarHBondContact O-CD 3.26Å
25	I	27.7	Very low	32.3	Very low	175 Å²	175	119.7 Å²	119.7	90%	0.897	67%	0.674	S	S	*	*			trans	-69.8	140.8	-160.6	-65.8	154.5	0	0	0	113
26	T	26.5	Very low	32.2	Very low	140 Å²	140	119.5 Å²	119.5	86%	0.859	68%	0.676	S	S	*	*			trans	-75.4	137.6	-175.9	47	0	0	0	0	114.7
27	G	27.5	Very low	32.3	Very low	73 Å²	73	121.6 Å²	121.6	75%	0.753	68%	0.679	S	S	*	*			trans	179.5	89.4	165	0	0	0	0	0	116.4
28	C	25.1	Very low	32.5	Very low	122 Å²	122	124.4 Å²	124.4	82%	0.824	69%	0.686	S	S	*	*			trans	65.9	116.4	147.1	-63.6	0	0	0	0	124.7
29	H	31.3	Very low	32.2	Very low	178 Å²	178	128.1 Å²	128.1	82%	0.824	70%	0.696	S	S	*	*			trans	55.6	123.8	142	-69.1	-66.7	0	0	0	123.7
30	P	29.5	Very low	32.2	Very low	96 Å²	96	128.8 Å²	128.8	62%	0.623	69%	0.687	S	S	*	*			trans	-112.1	150.7	164.4	36.8	-24.6	0	0	0	114.6
31	Q	31.1	Very low	32.2	Very low	193 Å²	193	129.3 Å²	129.3	90%	0.902	68%	0.684	S	S	*	*			trans	-127.2	129.4	167.2	-83.5	-173.2	-23.7	0	0	111.1
32	S	33.8	Very low	32.8	Very low	122 Å²	122	123.8 Å²	123.8	85%	0.853	67%	0.667	S	S	*	*			trans	51.5	114.7	157.7	62.9	0	0	0	0	122.6
33	D	32.8	Very low	33	Very low	84 Å²	84	122.3 Å²	122.3	45%	0.449	66%	0.66	S	S	.	*			trans	-117	108.7	169.2	-88.2	-39.2	0	0	0	111.2	V137	D33-V137 VanDerWaalsContact OD2-CB 3.3Å; D33-V137 WeakPolarHBondContact OD2-CB 3.32Å; D33-V137 WeakPolarHBondContact OD2-CG1 3.42Å
34	D	35.5	Very low	33.7	Very low	145 Å²	145	117 Å²	117	78%	0.775	63%	0.627	S	S	*	*	S	Bend	trans	-115.5	-13.2	172.5	-110.8	-12.9	0	0	0	113
35	M	33.3	Very low	34.5	Very low	159 Å²	159	116.3 Å²	116.3	78%	0.783	62%	0.618	S	S	*	*	S	Bend	trans	-91.4	-29.6	-179.8	-104.9	-178.3	75.4	0	0	113.9	E37 K38	M35-E37 PolarHBondContact O-N 3.35Å; M35-K38 PolarHBondContact O-N 3.27Å
36	V	38.5	Very low	35.2	Very low	42 Å²	42	108.1 Å²	108.1	26%	0.255	58%	0.577	S	S	.	*	H	α-helix	trans	-70.8	-21.3	-179	-178.7	0	0	0	0	111.7	H40	V36-H40 WeakPolarHBondContact O-CB 3.12Å; V36-H40 PolarHBondContact O-N 2.64Å; V36-H40 PolarHBondContact O-ND1 3.44Å
37	E	35.3	Very low	36	Very low	108 Å²	108	103.5 Å²	103.5	51%	0.505	55%	0.547	S	S	.	.	H	α-helix	trans	-72.9	-31.8	-179.4	-147.2	175.8	-148.6	0	0	113.6	M35 R41	M35-E37 PolarHBondContact O-N 3.35Å; E37-R41 PolarHBondContact O-N 3.02Å
38	K	37.7	Very low	36.7	Very low	174 Å²	174	101.4 Å²	101.4	76%	0.757	52%	0.518	S	S	*	.	H	α-helix	trans	-73.7	-42.6	178.2	-126.8	179.5	-178.2	-177.5	0	112.5	M35 H40	M35-K38 PolarHBondContact O-N 3.27Å; K38-H40 VanDerWaalsContact C-N 3.34Å
39	Q	35.8	Very low	37.6	Very low	125 Å²	125	96 Å²	96	58%	0.584	48%	0.482	S	S	*	.	H	α-helix	trans	-70.6	-29	178.2	-74	-176.3	-26.8	0	0	112.7	L43	Q39-L43 PolarHBondContact O-N 2.93Å
40	H	37.6	Very low	38.1	Very low	60 Å²	60	88.4 Å²	88.4	28%	0.278	45%	0.448	S	S	.	.	H	α-helix	trans	-84	-26	180	-90.3	75.3	0	0	0	115	V36 K38 Q42 L43 T44 R73	V36-H40 WeakPolarHBondContact O-CB 3.12Å; V36-H40 PolarHBondContact O-N 2.64Å; V36-H40 PolarHBondContact O-ND1 3.44Å; K38-H40 VanDerWaalsContact C-N 3.34Å; H40-Q42 VanDerWaalsContact C-N 3.25Å; H40-L43 PolarHBondContact O-N 3.03Å; H40-T44 PolarHBondContact O-N 2.96Å; H40-T44 PolarHBondContact O-OG1 3.06Å; H40-R73 VanDerWaalsContact CB-NE 3.32Å; H40-R73 VanDerWaalsContact CB-NH1 3.29Å; H40-R73 WeakPolarHBondContact CD2-CD 3.47Å; H40-R73 PolarHBondContact CD2-NH1 3.34Å; H40-R73 PolarHBondContact CE1-NH1 3.45Å; H40-R73 VanDerWaalsContact CG-CZ 3.4Å; H40-R73 PolarHBondContact ND1-NH1 2.93Å; H40-R73 PolarHBondContact NE2-NH1 3.18Å
41	R	39	Very low	38.9	Very low	170 Å²	170	85.3 Å²	85.3	64%	0.642	42%	0.424	S	S	*	.	H	α-helix	trans	-58.8	-43.7	166.8	-102.7	-176.4	-170.5	152.4	10.4	110.5	E37 L43 T44 D45	E37-R41 PolarHBondContact O-N 3.02Å; R41-L43 VanDerWaalsContact C-N 3.27Å; R41-L43 PolarHBondContact O-N 3.2Å; R41-T44 PolarHBondContact O-N 3.25Å; R41-D45 PolarHBondContact O-N 3.19Å; R41-D45 VanDerWaalsContact O-N 3.12Å
42	Q	42.9	Very low	39.3	Very low	100 Å²	100	80.3 Å²	80.3	47%	0.467	40%	0.404	S	S	.	.	H	α-helix	trans	-61	-32.7	176.4	-66.3	174	-27.6	0	0	112.9	H40 A46 W307	H40-Q42 VanDerWaalsContact C-N 3.25Å; Q42-A46 WeakPolarHBondContact O-CB 3.35Å; Q42-A46 PolarHBondContact O-N 3.05Å; Q42-W307 VanDerWaalsContact O-CH2 3.28Å; Q42-W307 WeakPolarHBondContact O-CH2 3.5Å
43	L	38.7	Very low	39.6	Very low	75 Å²	75	79.5 Å²	79.5	39%	0.393	40%	0.396	S	S	.	.	H	α-helix	trans	-75.5	-39.7	178.5	-160	83	0	0	0	113	Q39 H40 R41 A46 L47	Q39-L43 PolarHBondContact O-N 2.93Å; H40-L43 PolarHBondContact O-N 3.03Å; R41-L43 VanDerWaalsContact C-N 3.27Å; R41-L43 PolarHBondContact O-N 3.2Å; L43-A46 VanDerWaalsContact O-CB 3.3Å; L43-A46 WeakPolarHBondContact O-CB 3.38Å; L43-A46 PolarHBondContact O-N 2.94Å; L43-A46 VanDerWaalsContact O-N 3.15Å; L43-L47 PolarHBondContact O-N 3.04Å
44	T	39.9	Very low	40	Very low	28 Å²	28	81.5 Å²	81.5	17%	0.172	41%	0.406	C	S	.	.	H	α-helix	trans	-67.3	-44.5	-178.5	-44.3	0	0	0	0	110	H40 R41 A46 L47 M48 I74	H40-T44 PolarHBondContact O-N 2.96Å; H40-T44 PolarHBondContact O-OG1 3.06Å; R41-T44 PolarHBondContact O-N 3.25Å; T44-A46 PolarHBondContact O-N 3.38Å; T44-L47 PolarHBondContact O-N 2.83Å; T44-M48 WeakPolarHBondContact O-CG 3.47Å; T44-M48 PolarHBondContact O-N 2.93Å; T44-I74 HydrophobicContact CG2-CB 4.17Å; T44-I74 HydrophobicContact CG2-CD1 4.22Å; T44-I74 HydrophobicContact CG2-CG1 4.22Å
45	D	44.9	Very low	40.4	Very low	73 Å²	73	76 Å²	76	39%	0.39	38%	0.376	S	S	.	.	H	α-helix	trans	-66.6	-24.3	175.8	-62.2	-29.1	0	0	0	111.3	R41 M48 A49 W307	R41-D45 PolarHBondContact O-N 3.19Å; R41-D45 VanDerWaalsContact O-N 3.12Å; D45-M48 WeakPolarHBondContact O-CB 3.25Å; D45-M48 PolarHBondContact O-N 3.27Å; D45-A49 PolarHBondContact O-N 3.4Å; D45-A49 VanDerWaalsContact O-N 3.09Å; D45-W307 HydrophobicContact CB-CH2 3.29Å; D45-W307 HydrophobicContact CB-CZ2 2.9Å; D45-W307 HydrophobicContact CB-CZ3 4.36Å; D45-W307 WeakPolarHBondContact O-CH2 3.39Å; D45-W307 WeakPolarHBondContact O-CZ3 3.1Å
46	A	42.1	Very low	40.9	Very low	3 Å²	3	71.2 Å²	71.2	3%	0.025	36%	0.356	C	S	.	.	H	α-helix	trans	-69	-44.5	176	0	0	0	0	0	114.6	Q42 L43 T44 M48 A49 V50 T288 W307	Q42-A46 WeakPolarHBondContact O-CB 3.35Å; Q42-A46 PolarHBondContact O-N 3.05Å; L43-A46 VanDerWaalsContact O-CB 3.3Å; L43-A46 WeakPolarHBondContact O-CB 3.38Å; L43-A46 PolarHBondContact O-N 2.94Å; L43-A46 VanDerWaalsContact O-N 3.15Å; T44-A46 PolarHBondContact O-N 3.38Å; A46-M48 PolarHBondContact O-N 3.26Å; A46-A49 PolarHBondContact O-N 3.4Å; A46-V50 WeakPolarHBondContact O-CG2 3.45Å; A46-V50 PolarHBondContact O-N 3.43Å; A46-T288 HydrophobicContact CB-CG2 3.17Å; A46-W307 VanDerWaalsContact CA-CH2 3.48Å; A46-W307 HydrophobicContact CB-CE3 4.48Å; A46-W307 HydrophobicContact CB-CH2 3.96Å; A46-W307 HydrophobicContact CB-CZ3 3.47Å; A46-W307 VanDerWaalsContact CB-CZ3 3.47Å
47	L	42.9	Very low	41.2	Very low	44 Å²	44	72.5 Å²	72.5	23%	0.23	38%	0.378	C	S	.	.	H	α-helix	trans	-55.4	-42.5	172.1	-73.4	162.2	0	0	0	109.3	L43 T44 A49 V50 Y51	L43-L47 PolarHBondContact O-N 3.04Å; T44-L47 PolarHBondContact O-N 2.83Å; L47-A49 PolarHBondContact O-N 2.8Å; L47-V50 PolarHBondContact O-N 3.34Å; L47-Y51 HydrophobicContact CD2-CE2 4.24Å; L47-Y51 WeakPolarHBondContact O-CD2 3.48Å; L47-Y51 PolarHBondContact O-N 2.8Å
48	M	43.3	Very low	41.7	Very low	28 Å²	28	72.4 Å²	72.4	14%	0.138	38%	0.38	C	S	.	.	H	α-helix	trans	-66.3	-36	-178.8	-56.4	-52.7	-78.4	0	0	113.7	T44 D45 A46 N52 V63	T44-M48 WeakPolarHBondContact O-CG 3.47Å; T44-M48 PolarHBondContact O-N 2.93Å; D45-M48 WeakPolarHBondContact O-CB 3.25Å; D45-M48 PolarHBondContact O-N 3.27Å; A46-M48 PolarHBondContact O-N 3.26Å; M48-N52 VanDerWaalsContact O-CB 3.24Å; M48-N52 WeakPolarHBondContact O-CB 3.3Å; M48-N52 PolarHBondContact O-N 2.76Å; M48-V63 HydrophobicContact CE-CB 4.36Å; M48-V63 HydrophobicContact CE-CG1 3Å
49	A	43.9	Very low	42.3	Very low	9 Å²	9	64.4 Å²	64.4	7%	0.074	35%	0.345	C	S	.	.	H	α-helix	trans	-75.7	-31.2	177.4	0	0	0	0	0	114.4	D45 A46 L47 Y51 P53 V303 W307	D45-A49 PolarHBondContact O-N 3.4Å; D45-A49 VanDerWaalsContact O-N 3.09Å; A46-A49 PolarHBondContact O-N 3.4Å; L47-A49 PolarHBondContact O-N 2.8Å; A49-Y51 VanDerWaalsContact C-N 3.27Å; A49-Y51 PolarHBondContact O-N 3.49Å; A49-P53 WeakPolarHBondContact O-CD 3.43Å; A49-V303 HydrophobicContact CB-CG1 4.16Å; A49-W307 HydrophobicContact CB-CB 3.53Å; A49-W307 HydrophobicContact CB-CD2 3.47Å; A49-W307 VanDerWaalsContact CB-CD2 3.47Å; A49-W307 HydrophobicContact CB-CE3 3.09Å; A49-W307 HydrophobicContact CB-CG 3.7Å; A49-W307 HydrophobicContact CB-CZ3 4.15Å
50	V	42.1	Very low	42.8	Very low	19 Å²	19	65.5 Å²	65.5	12%	0.115	35%	0.348	C	S	.	.	H	α-helix	trans	-63.6	-39.9	173.5	-177.2	0	0	0	0	109.9	A46 L47 C289 K291 V303	A46-V50 WeakPolarHBondContact O-CG2 3.45Å; A46-V50 PolarHBondContact O-N 3.43Å; L47-V50 PolarHBondContact O-N 3.34Å; V50-C289 WeakPolarHBondContact CG2-SG 3.5Å; V50-K291 HydrophobicContact CG1-CD 4.44Å; V50-V303 HydrophobicContact CB-CG2 4.2Å; V50-V303 HydrophobicContact CG1-CG2 4.41Å; V50-V303 HydrophobicContact CG2-CB 3.9Å; V50-V303 HydrophobicContact CG2-CG1 4.06Å; V50-V303 HydrophobicContact CG2-CG2 3.41Å; V50-V303 VanDerWaalsContact CG2-CG2 3.41Å
51	Y	45	Very low	43.3	Very low	30 Å²	30	67 Å²	67	12%	0.118	36%	0.362	C	S	.	.	H	α-helix	trans	-93	-21.5	-175.8	-64.3	-69.3	0	0	0	113.9	L47 A49 P53 L54 I55 F77 K291	L47-Y51 HydrophobicContact CD2-CE2 4.24Å; L47-Y51 WeakPolarHBondContact O-CD2 3.48Å; L47-Y51 PolarHBondContact O-N 2.8Å; A49-Y51 VanDerWaalsContact C-N 3.27Å; A49-Y51 PolarHBondContact O-N 3.49Å; Y51-P53 VanDerWaalsContact C-CD 3.41Å; Y51-P53 VanDerWaalsContact C-N 3.33Å; Y51-L54 HydrophobicContact CD1-CD1 4.11Å; Y51-L54 CarbonylContact O-C 3.52Å; Y51-L54 WeakPolarHBondContact O-CA 3.27Å; Y51-L54 WeakPolarHBondContact O-CB 3.43Å; Y51-L54 PolarHBondContact O-N 3.38Å; Y51-I55 WeakPolarHBondContact O-CD1 3.31Å; Y51-I55 WeakPolarHBondContact O-CG1 3.22Å; Y51-I55 PolarHBondContact O-N 2.77Å; Y51-F77 HydrophobicContact CD1-CD1 4.06Å; Y51-F77 AromaticContact CD1-CE1 3.48Å; Y51-F77 HydrophobicContact CD1-CE1 3.48Å; Y51-F77 VanDerWaalsContact CD1-CE1 3.48Å; Y51-F77 HydrophobicContact CD1-CZ 4.41Å; Y51-F77 AromaticContact CD2-CD1 3.42Å; Y51-F77 HydrophobicContact CD2-CD1 3.42Å; Y51-F77 VanDerWaalsContact CD2-CD1 3.42Å; Y51-F77 AromaticContact CD2-CE1 3.51Å; Y51-F77 HydrophobicContact CD2-CE1 3.51Å; Y51-F77 HydrophobicContact CD2-CG 4.23Å; Y51-F77 HydrophobicContact CD2-CZ 4.38Å; Y51-F77 AromaticContact CE1-CD1 3.8Å; Y51-F77 HydrophobicContact CE1-CD1 3.8Å; Y51-F77 AromaticContact CE1-CE1 3.56Å; Y51-F77 HydrophobicContact CE1-CE1 3.56Å; Y51-F77 HydrophobicContact CE2-CB 4.4Å; Y51-F77 AromaticContact CE2-CD1 3.16Å; Y51-F77 HydrophobicContact CE2-CD1 3.16Å; Y51-F77 AromaticContact CE2-CE1 3.65Å; Y51-F77 HydrophobicContact CE2-CE1 3.65Å; Y51-F77 HydrophobicContact CE2-CG 4.06Å; Y51-F77 AromaticContact CG-CD1 3.9Å; Y51-F77 HydrophobicContact CG-CD1 3.9Å; Y51-F77 AromaticContact CG-CE1 3.46Å; Y51-F77 HydrophobicContact CG-CE1 3.46Å; Y51-F77 VanDerWaalsContact CG-CE1 3.46Å; Y51-F77 HydrophobicContact CG-CZ 4.2Å; Y51-F77 AromaticContact CZ-CD1 3.34Å; Y51-F77 AromaticContact CZ-CE1 3.64Å; Y51-K291 PolarHBondContact OH-NZ 3.09Å
52	N	40.2	Very low	43.9	Very low	89 Å²	89	59.1 Å²	59.1	48%	0.476	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-38.5	179.9	-130.7	-14	0	0	0	114.9	M48 L54	M48-N52 VanDerWaalsContact O-CB 3.24Å; M48-N52 WeakPolarHBondContact O-CB 3.3Å; M48-N52 PolarHBondContact O-N 2.76Å; N52-L54 VanDerWaalsContact C-N 3.32Å
53	P	41.3	Very low	44.3	Very low	105 Å²	105	55 Å²	55	68%	0.682	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-26.6	174.9	-15.9	29.3	0	0	0	113.2	A49 Y51 I55	A49-P53 WeakPolarHBondContact O-CD 3.43Å; Y51-P53 VanDerWaalsContact C-CD 3.41Å; Y51-P53 VanDerWaalsContact C-N 3.33Å; P53-I55 VanDerWaalsContact C-N 3.34Å
54	L	40.7	Very low	44.9	Very low	126 Å²	126	56.3 Å²	56.3	66%	0.66	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-11.9	179.6	-69.2	165	0	0	0	112.5	Y51 N52 P56	Y51-L54 HydrophobicContact CD1-CD1 4.11Å; Y51-L54 CarbonylContact O-C 3.52Å; Y51-L54 WeakPolarHBondContact O-CA 3.27Å; Y51-L54 WeakPolarHBondContact O-CB 3.43Å; Y51-L54 PolarHBondContact O-N 3.38Å; N52-L54 VanDerWaalsContact C-N 3.32Å; L54-P56 WeakPolarHBondContact O-CD 3.33Å
55	I	43.4	Very low	45.6	Very low	28 Å²	28	59.6 Å²	59.6	14%	0.144	34%	0.335	C	S	.	.	S	Bend	trans	-98.4	115.2	-177.7	-69.1	167.3	0	0	0	108.2	Y51 P53 W59	Y51-I55 WeakPolarHBondContact O-CD1 3.31Å; Y51-I55 WeakPolarHBondContact O-CG1 3.22Å; Y51-I55 PolarHBondContact O-N 2.77Å; P53-I55 VanDerWaalsContact C-N 3.34Å; I55-W59 HydrophobicContact CG2-CB 3.16Å; I55-W59 HydrophobicContact CG2-CD2 3.79Å; I55-W59 HydrophobicContact CG2-CG 3.14Å
56	P	43.8	Very low	46	Very low	59 Å²	59	56.4 Å²	56.4	38%	0.383	32%	0.318	S	S	.	.			trans	-51.3	147.1	174.7	-27.4	36.4	0	0	0	110.9	L54 I58 W59 E100	L54-P56 WeakPolarHBondContact O-CD 3.33Å; P56-I58 PolarHBondContact O-N 2.86Å; P56-W59 VanDerWaalsContact O-CD1 3.23Å; P56-W59 PolarHBondContact O-N 3.07Å; P56-W59 VanDerWaalsContact O-N 3.17Å; P56-E100 WeakPolarHBondContact CG-OE1 3.22Å
57	G	45.2	Very low	46.4	Very low	69 Å²	69	59.2 Å²	59.2	71%	0.711	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-54.8	-8.3	-173.8	0	0	0	0	0	116.5	W59	G57-W59 VanDerWaalsContact C-N 3.3Å; G57-W59 PolarHBondContact O-N 2.99Å
58	I	46.6	Very low	46.8	Very low	107 Å²	107	61.5 Å²	61.5	55%	0.549	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-66.8	-23.5	177.8	-59.3	172.3	0	0	0	112.8	P56	P56-I58 PolarHBondContact O-N 2.86Å
59	W	48.4	Very low	47.4	Very low	6 Å²	6	62.7 Å²	62.7	2%	0.023	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-91.4	-7.3	-171.9	-62.6	65.7	0	0	0	115.1	I55 P56 G57 T61 S62 V63 Y79 C86 L98 E100	I55-W59 HydrophobicContact CG2-CB 3.16Å; I55-W59 HydrophobicContact CG2-CD2 3.79Å; I55-W59 HydrophobicContact CG2-CG 3.14Å; P56-W59 VanDerWaalsContact O-CD1 3.23Å; P56-W59 PolarHBondContact O-N 3.07Å; P56-W59 VanDerWaalsContact O-N 3.17Å; G57-W59 VanDerWaalsContact C-N 3.3Å; G57-W59 PolarHBondContact O-N 2.99Å; W59-T61 PolarHBondContact O-N 3.44Å; W59-S62 PolarHBondContact O-N 3.19Å; W59-V63 HydrophobicContact CB-CG2 3.92Å; W59-V63 VanDerWaalsContact O-CB 3.31Å; W59-V63 WeakPolarHBondContact O-CB 3.41Å; W59-V63 WeakPolarHBondContact O-CG2 3.44Å; W59-V63 PolarHBondContact O-N 3.37Å; W59-Y79 HydrophobicContact CH2-CD2 4.48Å; W59-Y79 HydrophobicContact CH2-CE2 4.23Å; W59-Y79 AromaticContact CZ2-CE2 3.98Å; W59-Y79 HydrophobicContact CZ2-CE2 3.98Å; W59-C86 HydrophobicContact CH2-CB 4.07Å; W59-C86 WeakPolarHBondContact CH2-SG 3.47Å; W59-C86 HydrophobicContact CZ3-CB 3.75Å; W59-C86 WeakPolarHBondContact CZ3-SG 3.35Å; W59-L98 HydrophobicContact CE3-CD2 3.46Å; W59-L98 VanDerWaalsContact CE3-CD2 3.46Å; W59-L98 HydrophobicContact CE3-CG 4Å; W59-L98 HydrophobicContact CZ3-CB 4.15Å; W59-L98 HydrophobicContact CZ3-CD2 3.53Å; W59-L98 HydrophobicContact CZ3-CG 3.64Å; W59-E100 HydrophobicContact CH2-CB 4.17Å; W59-E100 HydrophobicContact CZ2-CB 3.45Å; W59-E100 VanDerWaalsContact CZ2-CB 3.45Å; W59-E100 HydrophobicContact CZ2-CG 3.72Å; W59-E100 PolarHBondContact NE1-OE1 2.85Å
60	K	48	Very low	47.7	Very low	148 Å²	148	70.8 Å²	70.8	64%	0.643	39%	0.392	S	S	*	.	H	α-helix	trans	-53.1	-34.6	-172.9	-100.2	-179.3	176.1	175.9	0	113.9	N64	K60-N64 PolarHBondContact O-ND2 2.9Å; K60-N64 VanDerWaalsContact O-ND2 3.16Å
61	T	47	Very low	48.2	Very low	91 Å²	91	75.7 Å²	75.7	56%	0.558	42%	0.418	S	S	*	.	H	α-helix	trans	-76.9	-44.6	-178.6	15.9	0	0	0	0	113.5	W59	W59-T61 PolarHBondContact O-N 3.44Å
62	S	51	Low	49.2	Very low	4 Å²	4	75.7 Å²	75.7	3%	0.028	42%	0.42	C	S	.	.	H	α-helix	trans	-74.1	-36.1	-177.2	-28.8	0	0	0	0	111.7	W59 N64 Q65 V66 E102 N103	W59-S62 PolarHBondContact O-N 3.19Å; S62-N64 VanDerWaalsContact C-N 3.31Å; S62-N64 PolarHBondContact O-N 2.73Å; S62-Q65 WeakPolarHBondContact O-CB 3.21Å; S62-Q65 PolarHBondContact O-N 3.04Å; S62-Q65 VanDerWaalsContact O-N 3.08Å; S62-V66 PolarHBondContact O-N 3.08Å; S62-E102 PolarHBondContact OG-O 3.45Å; S62-N103 WeakPolarHBondContact OG-CA 3.42Å; S62-N103 PolarHBondContact OG-OD1 2.83Å
63	V	51.4	Low	50.4	Low	14 Å²	14	74 Å²	74	9%	0.085	41%	0.406	C	S	.	.	H	α-helix	trans	-63.2	-38.4	177.4	169.5	0	0	0	0	111.6	M48 W59 Q65 V66 C67 L98	M48-V63 HydrophobicContact CE-CB 4.36Å; M48-V63 HydrophobicContact CE-CG1 3Å; W59-V63 HydrophobicContact CB-CG2 3.92Å; W59-V63 VanDerWaalsContact O-CB 3.31Å; W59-V63 WeakPolarHBondContact O-CB 3.41Å; W59-V63 WeakPolarHBondContact O-CG2 3.44Å; W59-V63 PolarHBondContact O-N 3.37Å; V63-Q65 PolarHBondContact O-N 3.34Å; V63-V66 WeakPolarHBondContact O-CB 3.14Å; V63-V66 PolarHBondContact O-N 2.9Å; V63-V66 VanDerWaalsContact O-N 3.11Å; V63-C67 PolarHBondContact O-N 3.22Å; V63-C67 PolarHBondContact O-SG 3.46Å; V63-L98 HydrophobicContact CG2-CD2 4.39Å
64	N	52.3	Low	52	Low	103 Å²	103	69.7 Å²	69.7	55%	0.551	38%	0.378	S	S	*	.	H	α-helix	trans	-61	-30.2	174	-82.5	-26.5	0	0	0	112.8	K60 S62 C67 T68	K60-N64 PolarHBondContact O-ND2 2.9Å; K60-N64 VanDerWaalsContact O-ND2 3.16Å; S62-N64 VanDerWaalsContact C-N 3.31Å; S62-N64 PolarHBondContact O-N 2.73Å; N64-C67 PolarHBondContact O-N 3.07Å; N64-T68 VanDerWaalsContact O-CG2 3.31Å; N64-T68 WeakPolarHBondContact O-CG2 3.49Å; N64-T68 PolarHBondContact O-N 3.47Å; N64-T68 PolarHBondContact O-OG1 3.26Å
65	Q	54	Low	53.7	Low	97 Å²	97	65.9 Å²	65.9	45%	0.453	36%	0.357	S	S	.	.	H	α-helix	trans	-66.4	-40.6	174.7	-68.7	-175.9	-11.6	0	0	111.7	S62 V63 T68 N103	S62-Q65 WeakPolarHBondContact O-CB 3.21Å; S62-Q65 PolarHBondContact O-N 3.04Å; S62-Q65 VanDerWaalsContact O-N 3.08Å; V63-Q65 PolarHBondContact O-N 3.34Å; Q65-T68 WeakPolarHBondContact CA-OG1 3.26Å; Q65-T68 PolarHBondContact O-N 3.04Å; Q65-T68 PolarHBondContact O-OG1 3.25Å; Q65-N103 PolarHBondContact OE1-O 2.58Å
66	V	53.6	Low	55.4	Low	6 Å²	6	66.9 Å²	66.9	4%	0.036	36%	0.362	C	S	.	.	H	α-helix	trans	-61.2	-46.2	173.4	-168.4	0	0	0	0	110.1	S62 V63 T68 M69 I74 F88 L105	S62-V66 PolarHBondContact O-N 3.08Å; V63-V66 WeakPolarHBondContact O-CB 3.14Å; V63-V66 PolarHBondContact O-N 2.9Å; V63-V66 VanDerWaalsContact O-N 3.11Å; V66-T68 PolarHBondContact O-N 3.37Å; V66-M69 WeakPolarHBondContact O-CB 3.48Å; V66-M69 WeakPolarHBondContact O-CG 3.34Å; V66-M69 PolarHBondContact O-N 2.93Å; V66-M69 VanDerWaalsContact O-N 3.13Å; V66-I74 HydrophobicContact CG1-CD1 3.81Å; V66-F88 HydrophobicContact CG1-CD1 4.15Å; V66-F88 HydrophobicContact CG1-CE1 4.39Å; V66-F88 HydrophobicContact CG1-CG 4.29Å; V66-F88 HydrophobicContact CG2-CE2 4.26Å; V66-F88 HydrophobicContact CG2-CZ 4.31Å; V66-L105 HydrophobicContact CB-CD2 4.48Å; V66-L105 HydrophobicContact CG2-CD1 3.45Å; V66-L105 VanDerWaalsContact CG2-CD1 3.45Å; V66-L105 HydrophobicContact CG2-CD2 3.77Å; V66-L105 HydrophobicContact CG2-CG 4.19Å
67	C	50.3	Low	57.2	Low	61 Å²	61	64.5 Å²	64.5	41%	0.412	35%	0.345	S	S	.	.	H	α-helix	trans	-66.3	-21.3	178.6	-59.7	0	0	0	0	113.7	V63 N64 M69	V63-C67 PolarHBondContact O-N 3.22Å; V63-C67 PolarHBondContact O-SG 3.46Å; N64-C67 PolarHBondContact O-N 3.07Å; C67-M69 VanDerWaalsContact C-N 3.31Å
68	T	52.2	Low	58.7	Low	92 Å²	92	62.1 Å²	62.1	56%	0.564	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	1.1	175.1	54.1	0	0	0	0	114.5	N64 Q65 V66 K70	N64-T68 VanDerWaalsContact O-CG2 3.31Å; N64-T68 WeakPolarHBondContact O-CG2 3.49Å; N64-T68 PolarHBondContact O-N 3.47Å; N64-T68 PolarHBondContact O-OG1 3.26Å; Q65-T68 WeakPolarHBondContact CA-OG1 3.26Å; Q65-T68 PolarHBondContact O-N 3.04Å; Q65-T68 PolarHBondContact O-OG1 3.25Å; V66-T68 PolarHBondContact O-N 3.37Å; T68-K70 PolarHBondContact O-N 3.24Å
69	M	55.9	Low	60.1	Low	54 Å²	54	60.7 Å²	60.7	27%	0.266	31%	0.305	S	S	.	.			trans	-68.6	72.7	166.1	-66	-176.9	173.5	0	0	109.6	V66 C67 D71 D72 Y96 L105	V66-M69 WeakPolarHBondContact O-CB 3.48Å; V66-M69 WeakPolarHBondContact O-CG 3.34Å; V66-M69 PolarHBondContact O-N 2.93Å; V66-M69 VanDerWaalsContact O-N 3.13Å; C67-M69 VanDerWaalsContact C-N 3.31Å; M69-D71 PolarHBondContact O-N 2.93Å; M69-D72 PolarHBondContact O-N 3.02Å; M69-Y96 HydrophobicContact CE-CD1 3.87Å; M69-Y96 HydrophobicContact CE-CD2 4.11Å; M69-Y96 HydrophobicContact CE-CE1 3.4Å; M69-Y96 HydrophobicContact CE-CE2 3.65Å; M69-Y96 HydrophobicContact CE-CG 4.21Å; M69-Y96 HydrophobicContact SD-CD2 4.18Å; M69-Y96 HydrophobicContact SD-CE1 4.43Å; M69-Y96 HydrophobicContact SD-CE2 3.59Å; M69-Y96 VanDerWaalsContact SD-CE2 3.59Å; M69-L105 HydrophobicContact CE-CD2 3.22Å; M69-L105 HydrophobicContact SD-CD2 4.49Å
70	K	50.2	Low	61.5	Low	179 Å²	179	61.5 Å²	61.5	78%	0.778	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-16.1	-166.1	-80.9	-178.1	176.3	-179	0	115.2	T68	T68-K70 PolarHBondContact O-N 3.24Å
71	D	52.7	Low	62.6	Low	122 Å²	122	58.4 Å²	58.4	65%	0.652	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.9	7.9	-171.5	-59.5	-26.5	0	0	0	114.5	M69 R92	M69-D71 PolarHBondContact O-N 2.93Å; D71-R92 PolarHBondContact O-NE 3.26Å; D71-R92 PolarHBondContact O-NH2 3.25Å
72	D	65.3	Low	63.8	Low	30 Å²	30	60.4 Å²	60.4	16%	0.16	32%	0.318	C	S	.	.			trans	-136.4	133.4	-179.1	-155.4	-0.2	0	0	0	112.9	M69 T90 K91 R92	M69-D72 PolarHBondContact O-N 3.02Å; D72-T90 WeakPolarHBondContact OD2-CB 3.21Å; D72-T90 PolarHBondContact OD2-OG1 3.4Å; D72-K91 PolarHBondContact OD1-N 2.84Å; D72-R92 HydrophobicContact CB-CG 4.39Å; D72-R92 VanDerWaalsContact CG-CG 3.47Å; D72-R92 VanDerWaalsContact OD1-CG 3.29Å; D72-R92 WeakPolarHBondContact OD1-CG 3.42Å; D72-R92 PolarHBondContact OD1-N 3.32Å; D72-R92 WeakPolarHBondContact OD2-CB 3.3Å
73	R	65.6	Low	64.8	Low	52 Å²	52	63.9 Å²	63.9	20%	0.196	34%	0.336	C	S	.	.			trans	-96.2	136.1	-171.8	-61.3	-176.3	-177.5	160.3	3.3	110.4	H40 I75 T90 K91	H40-R73 VanDerWaalsContact CB-NE 3.32Å; H40-R73 VanDerWaalsContact CB-NH1 3.29Å; H40-R73 WeakPolarHBondContact CD2-CD 3.47Å; H40-R73 PolarHBondContact CD2-NH1 3.34Å; H40-R73 PolarHBondContact CE1-NH1 3.45Å; H40-R73 VanDerWaalsContact CG-CZ 3.4Å; H40-R73 PolarHBondContact ND1-NH1 2.93Å; H40-R73 PolarHBondContact NE2-NH1 3.18Å; R73-I75 PolarHBondContact O-N 3.18Å; R73-T90 CarbonylContact O-C 3.59Å; R73-T90 WeakPolarHBondContact O-CA 3.48Å; R73-K91 HydrophobicContact CB-CB 4.12Å; R73-K91 PolarHBondContact O-N 3.28Å
74	I	75.1	Confident	66	Low	15 Å²	15	67.2 Å²	67.2	8%	0.077	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	125.3	171.3	-56.5	168.3	0	0	0	108.2	T44 V66 E76 F88 V89	T44-I74 HydrophobicContact CG2-CB 4.17Å; T44-I74 HydrophobicContact CG2-CD1 4.22Å; T44-I74 HydrophobicContact CG2-CG1 4.22Å; V66-I74 HydrophobicContact CG1-CD1 3.81Å; I74-E76 WeakPolarHBondContact CG2-O 3.24Å; I74-F88 HydrophobicContact CD1-CD1 4.03Å; I74-V89 CarbonylContact C-O 3.51Å; I74-V89 WeakPolarHBondContact CA-O 3.32Å
75	I	76.1	Confident	67.2	Low	46 Å²	46	64 Å²	64	24%	0.236	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	-19.3	178.8	57.7	168.6	0	0	0	112.8	R73 V89 K91 L115 A118	R73-I75 PolarHBondContact O-N 3.18Å; I75-V89 HydrophobicContact CD1-CG1 3.98Å; I75-V89 HydrophobicContact CG1-CB 4.14Å; I75-V89 HydrophobicContact CG1-CG1 3.92Å; I75-V89 WeakPolarHBondContact CG1-O 3.18Å; I75-V89 PolarHBondContact N-O 3.49Å; I75-K91 HydrophobicContact CG2-CB 3.91Å; I75-K91 HydrophobicContact CG2-CG 4.38Å; I75-L115 HydrophobicContact CD1-CB 3.48Å; I75-L115 VanDerWaalsContact CD1-CB 3.48Å; I75-L115 HydrophobicContact CD1-CD1 3.92Å; I75-L115 HydrophobicContact CD1-CG 4.37Å; I75-A118 HydrophobicContact CD1-CB 3.58Å; I75-A118 HydrophobicContact CG1-CB 3.94Å
76	E	80	Confident	68.4	Low	49 Å²	49	59.5 Å²	59.5	23%	0.229	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	146.5	179.1	-175.3	58.3	-100.1	0	0	110.7	I74 V89 A118 A119 W120	I74-E76 WeakPolarHBondContact CG2-O 3.24Å; E76-V89 HydrophobicContact CB-CB 4.14Å; E76-V89 HydrophobicContact CB-CG2 4.22Å; E76-V89 PolarHBondContact O-N 3.36Å; E76-A118 HydrophobicContact CB-CB 3.69Å; E76-A118 HydrophobicContact CG-CB 4.37Å; E76-A118 VanDerWaalsContact OE2-O 3.11Å; E76-A119 WeakPolarHBondContact OE2-CA 3.5Å; E76-W120 VanDerWaalsContact CG-CD1 3.47Å
77	F	79.6	Confident	69.8	Low	10 Å²	10	59.9 Å²	59.9	4%	0.044	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	135.2	179.2	167.4	-88.8	0	0	0	110.8	Y51 C86 Y87 F88	Y51-F77 HydrophobicContact CD1-CD1 4.06Å; Y51-F77 AromaticContact CD1-CE1 3.48Å; Y51-F77 HydrophobicContact CD1-CE1 3.48Å; Y51-F77 VanDerWaalsContact CD1-CE1 3.48Å; Y51-F77 HydrophobicContact CD1-CZ 4.41Å; Y51-F77 AromaticContact CD2-CD1 3.42Å; Y51-F77 HydrophobicContact CD2-CD1 3.42Å; Y51-F77 VanDerWaalsContact CD2-CD1 3.42Å; Y51-F77 AromaticContact CD2-CE1 3.51Å; Y51-F77 HydrophobicContact CD2-CE1 3.51Å; Y51-F77 HydrophobicContact CD2-CG 4.23Å; Y51-F77 HydrophobicContact CD2-CZ 4.38Å; Y51-F77 AromaticContact CE1-CD1 3.8Å; Y51-F77 HydrophobicContact CE1-CD1 3.8Å; Y51-F77 AromaticContact CE1-CE1 3.56Å; Y51-F77 HydrophobicContact CE1-CE1 3.56Å; Y51-F77 HydrophobicContact CE2-CB 4.4Å; Y51-F77 AromaticContact CE2-CD1 3.16Å; Y51-F77 HydrophobicContact CE2-CD1 3.16Å; Y51-F77 AromaticContact CE2-CE1 3.65Å; Y51-F77 HydrophobicContact CE2-CE1 3.65Å; Y51-F77 HydrophobicContact CE2-CG 4.06Å; Y51-F77 AromaticContact CG-CD1 3.9Å; Y51-F77 HydrophobicContact CG-CD1 3.9Å; Y51-F77 AromaticContact CG-CE1 3.46Å; Y51-F77 HydrophobicContact CG-CE1 3.46Å; Y51-F77 VanDerWaalsContact CG-CE1 3.46Å; Y51-F77 HydrophobicContact CG-CZ 4.2Å; Y51-F77 AromaticContact CZ-CD1 3.34Å; Y51-F77 AromaticContact CZ-CE1 3.64Å; F77-C86 HydrophobicContact CE2-CB 3.8Å; F77-C86 HydrophobicContact CZ-CB 4.32Å; F77-Y87 WeakPolarHBondContact CA-O 3.48Å; F77-F88 AromaticContact CD2-CD1 3.52Å; F77-F88 HydrophobicContact CD2-CD1 3.52Å; F77-F88 AromaticContact CD2-CE1 3.32Å; F77-F88 HydrophobicContact CD2-CE1 3.32Å; F77-F88 HydrophobicContact CD2-CG 4.34Å; F77-F88 HydrophobicContact CD2-CZ 4Å; F77-F88 HydrophobicContact CE2-CD1 4.13Å; F77-F88 AromaticContact CE2-CE1 3.47Å; F77-F88 HydrophobicContact CE2-CE1 3.47Å; F77-F88 VanDerWaalsContact CE2-CE1 3.47Å; F77-F88 AromaticContact CE2-CZ 3.73Å; F77-F88 HydrophobicContact CE2-CZ 3.73Å
78	V	78.3	Confident	71.4	Confident	18 Å²	18	57.1 Å²	57.1	11%	0.109	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	139.4	170.4	70.7	0	0	0	0	110.8	V80 C86 Y87 W120	V78-V80 HydrophobicContact CG1-CG2 4.43Å; V78-C86 CarbonylContact O-C 3.55Å; V78-C86 WeakPolarHBondContact O-CA 3.36Å; V78-Y87 HydrophobicContact CG1-CD2 3.95Å; V78-Y87 HydrophobicContact CG1-CG 4.39Å; V78-Y87 PolarHBondContact N-O 3.22Å; V78-Y87 VanDerWaalsContact N-O 3.1Å; V78-Y87 PolarHBondContact O-N 2.99Å; V78-W120 HydrophobicContact CB-CD2 4.45Å; V78-W120 HydrophobicContact CB-CG 4.03Å; V78-W120 HydrophobicContact CG1-CD2 3.74Å; V78-W120 VanDerWaalsContact CG1-CE2 3.43Å; V78-W120 HydrophobicContact CG1-CE3 4.48Å; V78-W120 HydrophobicContact CG1-CG 3.84Å; V78-W120 HydrophobicContact CG1-CZ2 3.97Å; V78-W120 VanDerWaalsContact CG1-NE1 3.33Å
79	Y	76.3	Confident	72.8	Confident	77 Å²	77	52.7 Å²	52.7	30%	0.302	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	128.5	165.5	174.9	-117.3	0	0	0	108.1	W59 P81 M84 M85 C86 E100	W59-Y79 HydrophobicContact CH2-CD2 4.48Å; W59-Y79 HydrophobicContact CH2-CE2 4.23Å; W59-Y79 AromaticContact CZ2-CE2 3.98Å; W59-Y79 HydrophobicContact CZ2-CE2 3.98Å; Y79-P81 HydrophobicContact CD1-CB 4.48Å; Y79-P81 HydrophobicContact CD1-CG 3.9Å; Y79-P81 HydrophobicContact CE1-CB 3.93Å; Y79-P81 HydrophobicContact CE1-CG 3.83Å; Y79-P81 WeakPolarHBondContact O-CD 3.39Å; Y79-M84 PolarHBondContact OH-SD 3.45Å; Y79-M85 WeakPolarHBondContact CD2-O 3.36Å; Y79-C86 VanDerWaalsContact CD2-SG 3.54Å; Y79-E100 PolarHBondContact OH-OE2 3.08Å; Y79-E100 VanDerWaalsContact OH-OE2 3.07Å
80	V	77	Confident	74	Confident	23 Å²	23	50.3 Å²	50.3	14%	0.139	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	100.2	176.7	-178.3	0	0	0	0	107.4	V78 V82 D83 M84 M85 Y87	V78-V80 HydrophobicContact CG1-CG2 4.43Å; V80-V82 VanDerWaalsContact C-N 3.25Å; V80-V82 PolarHBondContact O-N 3.25Å; V80-D83 HydrophobicContact CG1-CB 4.32Å; V80-D83 PolarHBondContact O-N 3.5Å; V80-M84 PolarHBondContact O-N 3.02Å; V80-M84 VanDerWaalsContact O-N 3.07Å; V80-M85 PolarHBondContact N-O 3.02Å; V80-M85 PolarHBondContact O-N 2.98Å; V80-Y87 HydrophobicContact CB-CE2 4.34Å; V80-Y87 HydrophobicContact CG2-CD2 4.02Å; V80-Y87 HydrophobicContact CG2-CE2 3.76Å
81	P	70.5	Confident	75.3	Confident	83 Å²	83	44.3 Å²	44.3	54%	0.539	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-32.8	-173.2	-22.3	32.3	0	0	0	113.1	Y79 D83 M84	Y79-P81 HydrophobicContact CD1-CB 4.48Å; Y79-P81 HydrophobicContact CD1-CG 3.9Å; Y79-P81 HydrophobicContact CE1-CB 3.93Å; Y79-P81 HydrophobicContact CE1-CG 3.83Å; Y79-P81 WeakPolarHBondContact O-CD 3.39Å; P81-D83 VanDerWaalsContact C-N 3.32Å; P81-D83 PolarHBondContact O-N 3.22Å; P81-M84 PolarHBondContact O-N 3.48Å; P81-M84 VanDerWaalsContact O-SD 3.39Å
82	V	72.7	Confident	76.5	Confident	134 Å²	134	44.9 Å²	44.9	81%	0.812	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-39.1	-177.5	-178.4	0	0	0	0	111.8	V80	V80-V82 VanDerWaalsContact C-N 3.25Å; V80-V82 PolarHBondContact O-N 3.25Å
83	D	71.5	Confident	77	Confident	76 Å²	76	43.5 Å²	43.5	41%	0.406	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-8.8	-179.9	-63.4	-29.3	0	0	0	112.4	V80 P81 M85	V80-D83 HydrophobicContact CG1-CB 4.32Å; V80-D83 PolarHBondContact O-N 3.5Å; P81-D83 VanDerWaalsContact C-N 3.32Å; P81-D83 PolarHBondContact O-N 3.22Å; D83-M85 HydrophobicContact CB-CB 4Å; D83-M85 HydrophobicContact CB-CG 3.71Å; D83-M85 WeakPolarHBondContact O-CG 3.36Å; D83-M85 PolarHBondContact O-N 3.35Å
84	M	77	Confident	77.8	Confident	85 Å²	85	41.5 Å²	41.5	42%	0.419	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	42	-169.2	-53.6	-75.4	-91.9	0	0	110.9	Y79 V80 P81 E100	Y79-M84 PolarHBondContact OH-SD 3.45Å; V80-M84 PolarHBondContact O-N 3.02Å; V80-M84 VanDerWaalsContact O-N 3.07Å; P81-M84 PolarHBondContact O-N 3.48Å; P81-M84 VanDerWaalsContact O-SD 3.39Å; M84-E100 HydrophobicContact CB-CB 3.68Å; M84-E100 HydrophobicContact CE-CG 4.31Å; M84-E100 WeakPolarHBondContact CE-OE2 3.5Å; M84-E100 WeakPolarHBondContact O-CB 3.38Å; M84-E100 PolarHBondContact O-N 2.93Å
85	M	77.6	Confident	78.2	Confident	36 Å²	36	40.8 Å²	40.8	18%	0.177	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	138.3	-174.1	-72.4	-74.4	-99.2	0	0	110.9	Y79 V80 D83 Y87 L98 K99	Y79-M85 WeakPolarHBondContact CD2-O 3.36Å; V80-M85 PolarHBondContact N-O 3.02Å; V80-M85 PolarHBondContact O-N 2.98Å; D83-M85 HydrophobicContact CB-CB 4Å; D83-M85 HydrophobicContact CB-CG 3.71Å; D83-M85 WeakPolarHBondContact O-CG 3.36Å; D83-M85 PolarHBondContact O-N 3.35Å; M85-Y87 HydrophobicContact CB-CE2 3.87Å; M85-L98 CarbonylContact C-O 3.57Å; M85-L98 WeakPolarHBondContact CA-O 3.46Å; M85-K99 HydrophobicContact CG-CG 4.47Å; M85-K99 WeakPolarHBondContact SD-CA 3.29Å; M85-K99 HydrophobicContact SD-CB 3.31Å; M85-K99 WeakPolarHBondContact SD-CB 3.35Å; M85-K99 HydrophobicContact SD-CD 4.06Å; M85-K99 HydrophobicContact SD-CG 3.55Å; M85-K99 VanDerWaalsContact SD-CG 3.55Å
86	C	79.9	Confident	78.5	Confident	1 Å²	1	40 Å²	40	1%	0.007	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	140	166	-75.8	0	0	0	0	109.9	W59 F77 V78 Y79 F88 S97 L98	W59-C86 HydrophobicContact CH2-CB 4.07Å; W59-C86 WeakPolarHBondContact CH2-SG 3.47Å; W59-C86 HydrophobicContact CZ3-CB 3.75Å; W59-C86 WeakPolarHBondContact CZ3-SG 3.35Å; F77-C86 HydrophobicContact CE2-CB 3.8Å; F77-C86 HydrophobicContact CZ-CB 4.32Å; V78-C86 CarbonylContact O-C 3.55Å; V78-C86 WeakPolarHBondContact O-CA 3.36Å; Y79-C86 VanDerWaalsContact CD2-SG 3.54Å; C86-F88 HydrophobicContact CB-CE2 3.8Å; C86-F88 HydrophobicContact CB-CZ 3.92Å; C86-S97 CarbonylContact O-C 3.5Å; C86-S97 VanDerWaalsContact O-CA 3.28Å; C86-S97 WeakPolarHBondContact O-CA 3.44Å; C86-L98 HydrophobicContact CB-CB 4.34Å; C86-L98 PolarHBondContact N-O 3.09Å; C86-L98 PolarHBondContact O-N 3.37Å
87	Y	82.4	Confident	78.6	Confident	15 Å²	15	38 Å²	38	6%	0.059	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	134.3	171.9	-58	-89.6	0	0	0	110.6	L13 F77 V78 V80 M85 Y96 I108 W120	L13-Y87 HydrophobicContact CD1-CE1 3.75Å; L13-Y87 WeakPolarHBondContact CD1-OH 3.37Å; F77-Y87 WeakPolarHBondContact CA-O 3.48Å; V78-Y87 HydrophobicContact CG1-CD2 3.95Å; V78-Y87 HydrophobicContact CG1-CG 4.39Å; V78-Y87 PolarHBondContact N-O 3.22Å; V78-Y87 VanDerWaalsContact N-O 3.1Å; V78-Y87 PolarHBondContact O-N 2.99Å; V80-Y87 HydrophobicContact CB-CE2 4.34Å; V80-Y87 HydrophobicContact CG2-CD2 4.02Å; V80-Y87 HydrophobicContact CG2-CE2 3.76Å; M85-Y87 HydrophobicContact CB-CE2 3.87Å; Y87-Y96 CarbonylContact C-O 3.52Å; Y87-Y96 VanDerWaalsContact CA-O 3.27Å; Y87-Y96 WeakPolarHBondContact CA-O 3.46Å; Y87-I108 HydrophobicContact CD1-CD1 3.55Å; Y87-I108 HydrophobicContact CE1-CD1 3.59Å; Y87-W120 HydrophobicContact CG-CH2 4.45Å; Y87-W120 HydrophobicContact CG-CZ2 4.15Å
88	F	82.8	Confident	78.6	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.009	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	132.1	179.2	-51.1	-94	0	0	0	109.3	V66 I74 F77 C86 I95 Y96 L98 L105	V66-F88 HydrophobicContact CG1-CD1 4.15Å; V66-F88 HydrophobicContact CG1-CE1 4.39Å; V66-F88 HydrophobicContact CG1-CG 4.29Å; V66-F88 HydrophobicContact CG2-CE2 4.26Å; V66-F88 HydrophobicContact CG2-CZ 4.31Å; I74-F88 HydrophobicContact CD1-CD1 4.03Å; F77-F88 AromaticContact CD2-CD1 3.52Å; F77-F88 HydrophobicContact CD2-CD1 3.52Å; F77-F88 AromaticContact CD2-CE1 3.32Å; F77-F88 HydrophobicContact CD2-CE1 3.32Å; F77-F88 HydrophobicContact CD2-CG 4.34Å; F77-F88 HydrophobicContact CD2-CZ 4Å; F77-F88 HydrophobicContact CE2-CD1 4.13Å; F77-F88 AromaticContact CE2-CE1 3.47Å; F77-F88 HydrophobicContact CE2-CE1 3.47Å; F77-F88 VanDerWaalsContact CE2-CE1 3.47Å; F77-F88 AromaticContact CE2-CZ 3.73Å; F77-F88 HydrophobicContact CE2-CZ 3.73Å; C86-F88 HydrophobicContact CB-CE2 3.8Å; C86-F88 HydrophobicContact CB-CZ 3.92Å; F88-I95 CarbonylContact O-C 3.52Å; F88-I95 VanDerWaalsContact O-CA 3.26Å; F88-I95 WeakPolarHBondContact O-CA 3.44Å; F88-Y96 PolarHBondContact N-O 3.4Å; F88-Y96 PolarHBondContact O-N 2.9Å; F88-L98 HydrophobicContact CE2-CB 3.89Å; F88-L98 HydrophobicContact CE2-CD2 4.37Å; F88-L98 HydrophobicContact CZ-CD2 4.5Å; F88-L105 HydrophobicContact CD2-CD1 4.26Å; F88-L105 HydrophobicContact CE2-CD1 4.23Å
89	V	81.8	Confident	78.6	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	127.9	173.9	-173.8	0	0	0	0	108.9	I74 I75 E76 I95 L115 A118 L127 L129	I74-V89 CarbonylContact C-O 3.51Å; I74-V89 WeakPolarHBondContact CA-O 3.32Å; I75-V89 HydrophobicContact CD1-CG1 3.98Å; I75-V89 HydrophobicContact CG1-CB 4.14Å; I75-V89 HydrophobicContact CG1-CG1 3.92Å; I75-V89 WeakPolarHBondContact CG1-O 3.18Å; I75-V89 PolarHBondContact N-O 3.49Å; E76-V89 HydrophobicContact CB-CB 4.14Å; E76-V89 HydrophobicContact CB-CG2 4.22Å; E76-V89 PolarHBondContact O-N 3.36Å; V89-I95 HydrophobicContact CG1-CG1 4.38Å; V89-I95 HydrophobicContact CG2-CG1 4.35Å; V89-L115 HydrophobicContact CG1-CD1 3.66Å; V89-A118 HydrophobicContact CB-CB 4.28Å; V89-A118 HydrophobicContact CG1-CB 3.92Å; V89-L127 HydrophobicContact CG2-CD1 4.19Å; V89-L127 HydrophobicContact CG2-CD2 3.75Å; V89-L129 HydrophobicContact CG1-CD2 4.05Å
90	T	81.7	Confident	78.2	Confident	3 Å²	3	38.5 Å²	38.5	2%	0.018	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	157.9	179.6	75.2	0	0	0	0	113.1	D72 R73 R92 G93 S94 Y96	D72-T90 WeakPolarHBondContact OD2-CB 3.21Å; D72-T90 PolarHBondContact OD2-OG1 3.4Å; R73-T90 CarbonylContact O-C 3.59Å; R73-T90 WeakPolarHBondContact O-CA 3.48Å; T90-R92 VanDerWaalsContact C-N 3.28Å; T90-R92 PolarHBondContact O-N 3.04Å; T90-G93 PolarHBondContact O-N 3.43Å; T90-S94 PolarHBondContact N-O 3.47Å; T90-S94 WeakPolarHBondContact OG1-CB 3.44Å; T90-S94 PolarHBondContact OG1-N 3.07Å; T90-S94 VanDerWaalsContact OG1-N 3.08Å; T90-S94 PolarHBondContact OG1-O 3.28Å; T90-Y96 HydrophobicContact CG2-CD2 3.89Å; T90-Y96 HydrophobicContact CG2-CE2 3.58Å
91	K	78	Confident	77.8	Confident	53 Å²	53	40.2 Å²	40.2	23%	0.23	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-31	-179.2	-170.6	172.6	-179.4	175.8	0	112.1	D72 R73 I75 G93 M114 L115	D72-K91 PolarHBondContact OD1-N 2.84Å; R73-K91 HydrophobicContact CB-CB 4.12Å; R73-K91 PolarHBondContact O-N 3.28Å; I75-K91 HydrophobicContact CG2-CB 3.91Å; I75-K91 HydrophobicContact CG2-CG 4.38Å; K91-G93 PolarHBondContact O-N 3.38Å; K91-M114 CarbonylContact O-C 3.6Å; K91-M114 WeakPolarHBondContact O-CA 3.39Å; K91-L115 PolarHBondContact O-N 3.31Å
92	R	77.2	Confident	77.7	Confident	135 Å²	135	40.2 Å²	40.2	51%	0.509	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	0.1	172.7	-59.1	171.1	-179.7	-153.5	-5.8	113.8	D71 D72 T90 L113	D71-R92 PolarHBondContact O-NE 3.26Å; D71-R92 PolarHBondContact O-NH2 3.25Å; D72-R92 HydrophobicContact CB-CG 4.39Å; D72-R92 VanDerWaalsContact CG-CG 3.47Å; D72-R92 VanDerWaalsContact OD1-CG 3.29Å; D72-R92 WeakPolarHBondContact OD1-CG 3.42Å; D72-R92 PolarHBondContact OD1-N 3.32Å; D72-R92 WeakPolarHBondContact OD2-CB 3.3Å; T90-R92 VanDerWaalsContact C-N 3.28Å; T90-R92 PolarHBondContact O-N 3.04Å; R92-L113 CarbonylContact C-O 3.6Å
93	G	76.3	Confident	77.2	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.194	C	C	.	.	S	Bend	trans	98.4	6.7	171.4	0	0	0	0	0	115.7	T90 K91 V111	T90-G93 PolarHBondContact O-N 3.43Å; K91-G93 PolarHBondContact O-N 3.38Å; G93-V111 WeakPolarHBondContact CA-O 3.44Å; G93-V111 WeakPolarHBondContact O-CB 3.28Å; G93-V111 WeakPolarHBondContact O-CG2 3.36Å; G93-V111 PolarHBondContact O-N 3.09Å
94	S	81.4	Confident	76.9	Confident	10 Å²	10	39.6 Å²	39.6	7%	0.07	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	137.9	174.7	-68.7	0	0	0	0	111.5	T90 Y96 E107 V109 S110	T90-S94 PolarHBondContact N-O 3.47Å; T90-S94 WeakPolarHBondContact OG1-CB 3.44Å; T90-S94 PolarHBondContact OG1-N 3.07Å; T90-S94 VanDerWaalsContact OG1-N 3.08Å; T90-S94 PolarHBondContact OG1-O 3.28Å; S94-Y96 VanDerWaalsContact CB-CE2 3.48Å; S94-E107 VanDerWaalsContact CB-OE1 3.27Å; S94-E107 WeakPolarHBondContact CB-OE1 3.35Å; S94-E107 PolarHBondContact OG-OE1 3.45Å; S94-V109 CarbonylContact C-O 3.5Å; S94-V109 WeakPolarHBondContact CA-O 3.44Å; S94-S110 PolarHBondContact OG-OG 3.29Å
95	I	83.4	Confident	76.6	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	119.2	175.2	-55.5	176.5	0	0	0	107.7	F3 F88 V89 I108 V109 L127	F3-I95 HydrophobicContact CD2-CD1 3.87Å; F3-I95 HydrophobicContact CE2-CD1 3.88Å; F88-I95 CarbonylContact O-C 3.52Å; F88-I95 VanDerWaalsContact O-CA 3.26Å; F88-I95 WeakPolarHBondContact O-CA 3.44Å; V89-I95 HydrophobicContact CG1-CG1 4.38Å; V89-I95 HydrophobicContact CG2-CG1 4.35Å; I95-I108 HydrophobicContact CG2-CD1 4.26Å; I95-I108 PolarHBondContact O-N 3.45Å; I95-V109 HydrophobicContact CB-CB 4.32Å; I95-V109 HydrophobicContact CD1-CB 4.2Å; I95-V109 HydrophobicContact CG1-CB 4.47Å; I95-V109 PolarHBondContact N-O 2.95Å; I95-V109 PolarHBondContact O-N 3.47Å; I95-L127 HydrophobicContact CD1-CD2 3.61Å; I95-L127 HydrophobicContact CG1-CD2 4.45Å
96	Y	82.7	Confident	76.5	Confident	28 Å²	28	39 Å²	39	11%	0.11	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	141.6	179	-60.9	-82.8	0	0	0	110.9	M69 Y87 F88 T90 S94 L105 L106 E107	M69-Y96 HydrophobicContact CE-CD1 3.87Å; M69-Y96 HydrophobicContact CE-CD2 4.11Å; M69-Y96 HydrophobicContact CE-CE1 3.4Å; M69-Y96 HydrophobicContact CE-CE2 3.65Å; M69-Y96 HydrophobicContact CE-CG 4.21Å; M69-Y96 HydrophobicContact SD-CD2 4.18Å; M69-Y96 HydrophobicContact SD-CE1 4.43Å; M69-Y96 HydrophobicContact SD-CE2 3.59Å; M69-Y96 VanDerWaalsContact SD-CE2 3.59Å; Y87-Y96 CarbonylContact C-O 3.52Å; Y87-Y96 VanDerWaalsContact CA-O 3.27Å; Y87-Y96 WeakPolarHBondContact CA-O 3.46Å; F88-Y96 PolarHBondContact N-O 3.4Å; F88-Y96 PolarHBondContact O-N 2.9Å; T90-Y96 HydrophobicContact CG2-CD2 3.89Å; T90-Y96 HydrophobicContact CG2-CE2 3.58Å; S94-Y96 VanDerWaalsContact CB-CE2 3.48Å; Y96-L105 HydrophobicContact CD1-CD2 3.79Å; Y96-L105 HydrophobicContact CD1-CG 3.94Å; Y96-L105 HydrophobicContact CE1-CD2 4.37Å; Y96-L105 HydrophobicContact CG-CD2 4.01Å; Y96-L105 HydrophobicContact CG-CG 4.19Å; Y96-L106 CarbonylContact C-O 3.57Å; Y96-L106 VanDerWaalsContact CA-O 3.29Å; Y96-L106 WeakPolarHBondContact CA-O 3.46Å; Y96-E107 HydrophobicContact CD1-CB 3.77Å; Y96-E107 HydrophobicContact CD1-CG 4.13Å; Y96-E107 HydrophobicContact CE1-CB 3.56Å; Y96-E107 HydrophobicContact CE1-CG 3.71Å
97	S	82.7	Confident	76.5	Confident	9 Å²	9	43.6 Å²	43.6	6%	0.063	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	146	164.2	50.6	0	0	0	0	111.1	C86 L106 I108	C86-S97 CarbonylContact O-C 3.5Å; C86-S97 VanDerWaalsContact O-CA 3.28Å; C86-S97 WeakPolarHBondContact O-CA 3.44Å; S97-L106 PolarHBondContact N-O 3.14Å; S97-L106 PolarHBondContact O-N 2.85Å; S97-L106 PolarHBondContact OG-O 3.39Å; S97-I108 WeakPolarHBondContact OG-CG1 3.49Å
98	L	79.4	Confident	76.3	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	123.6	170.2	-179.5	64.9	0	0	0	109.6	W59 V63 M85 C86 F88 E102 L105	W59-L98 HydrophobicContact CE3-CD2 3.46Å; W59-L98 VanDerWaalsContact CE3-CD2 3.46Å; W59-L98 HydrophobicContact CE3-CG 4Å; W59-L98 HydrophobicContact CZ3-CB 4.15Å; W59-L98 HydrophobicContact CZ3-CD2 3.53Å; W59-L98 HydrophobicContact CZ3-CG 3.64Å; V63-L98 HydrophobicContact CG2-CD2 4.39Å; M85-L98 CarbonylContact C-O 3.57Å; M85-L98 WeakPolarHBondContact CA-O 3.46Å; C86-L98 HydrophobicContact CB-CB 4.34Å; C86-L98 PolarHBondContact N-O 3.09Å; C86-L98 PolarHBondContact O-N 3.37Å; F88-L98 HydrophobicContact CE2-CB 3.89Å; F88-L98 HydrophobicContact CE2-CD2 4.37Å; F88-L98 HydrophobicContact CZ-CD2 4.5Å; L98-E102 WeakPolarHBondContact CD1-O 3.47Å; L98-L105 HydrophobicContact CB-CD1 4.03Å
99	K	78.4	Confident	76	Confident	77 Å²	77	46.5 Å²	46.5	34%	0.335	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	141.8	177.3	-165.1	169.4	174.3	-173.9	0	111.6	M85 G101 E102	M85-K99 HydrophobicContact CG-CG 4.47Å; M85-K99 WeakPolarHBondContact SD-CA 3.29Å; M85-K99 HydrophobicContact SD-CB 3.31Å; M85-K99 WeakPolarHBondContact SD-CB 3.35Å; M85-K99 HydrophobicContact SD-CD 4.06Å; M85-K99 HydrophobicContact SD-CG 3.55Å; M85-K99 VanDerWaalsContact SD-CG 3.55Å; K99-G101 PolarHBondContact O-N 3.02Å; K99-E102 HydrophobicContact CB-CB 4.12Å; K99-E102 HydrophobicContact CB-CG 4.16Å; K99-E102 PolarHBondContact O-N 2.94Å
100	E	68.3	Low	75.7	Confident	37 Å²	37	49.6 Å²	49.6	17%	0.173	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	126.8	173.7	-168.4	146.6	-164.8	0	0	111.4	P56 W59 Y79 M84 E102	P56-E100 WeakPolarHBondContact CG-OE1 3.22Å; W59-E100 HydrophobicContact CH2-CB 4.17Å; W59-E100 HydrophobicContact CZ2-CB 3.45Å; W59-E100 VanDerWaalsContact CZ2-CB 3.45Å; W59-E100 HydrophobicContact CZ2-CG 3.72Å; W59-E100 PolarHBondContact NE1-OE1 2.85Å; Y79-E100 PolarHBondContact OH-OE2 3.08Å; Y79-E100 VanDerWaalsContact OH-OE2 3.07Å; M84-E100 HydrophobicContact CB-CB 3.68Å; M84-E100 HydrophobicContact CE-CG 4.31Å; M84-E100 WeakPolarHBondContact CE-OE2 3.5Å; M84-E100 WeakPolarHBondContact O-CB 3.38Å; M84-E100 PolarHBondContact O-N 2.93Å; E100-E102 VanDerWaalsContact C-N 3.28Å; E100-E102 PolarHBondContact O-N 2.93Å
101	G	68.3	Low	75.2	Confident	60 Å²	60	50.1 Å²	50.1	62%	0.619	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	-8.8	-176.8	0	0	0	0	0	115	K99	K99-G101 PolarHBondContact O-N 3.02Å
102	E	68.3	Low	74.9	Confident	83 Å²	83	55.1 Å²	55.1	39%	0.388	29%	0.293	S	S	.	.			trans	-99.9	134.3	172.4	-62.9	-176.1	-175.8	0	0	110.5	S62 L98 K99 E100 L104	S62-E102 PolarHBondContact OG-O 3.45Å; L98-E102 WeakPolarHBondContact CD1-O 3.47Å; K99-E102 HydrophobicContact CB-CB 4.12Å; K99-E102 HydrophobicContact CB-CG 4.16Å; K99-E102 PolarHBondContact O-N 2.94Å; E100-E102 VanDerWaalsContact C-N 3.28Å; E100-E102 PolarHBondContact O-N 2.93Å; E102-L104 VanDerWaalsContact C-N 3.28Å
103	N	61.1	Low	74.5	Confident	91 Å²	91	51.1 Å²	51.1	49%	0.487	28%	0.281	S	S	.	.			trans	-89.4	8.5	175.6	-75.1	-21.7	0	0	0	112.9	S62 Q65	S62-N103 WeakPolarHBondContact OG-CA 3.42Å; S62-N103 PolarHBondContact OG-OD1 2.83Å; Q65-N103 PolarHBondContact OE1-O 2.58Å
104	L	66.3	Low	74.5	Confident	105 Å²	105	57 Å²	57	55%	0.55	31%	0.31	S	S	.	.			trans	-100	110.6	-175.9	-168	75	0	0	0	109.9	E102 L106	E102-L104 VanDerWaalsContact C-N 3.28Å; L104-L106 HydrophobicContact CD2-CD1 4.33Å; L104-L106 HydrophobicContact CD2-CD2 3.63Å; L104-L106 HydrophobicContact CD2-CG 3.9Å; L104-L106 HydrophobicContact CG-CD2 4.23Å; L104-L106 HydrophobicContact CG-CG 4.19Å; L104-L106 PolarHBondContact O-N 3.35Å
105	L	70.8	Confident	74.3	Confident	27 Å²	27	56.5 Å²	56.5	14%	0.141	31%	0.306	C	S	.	.			trans	-77	116.5	167	-168.3	75	0	0	0	109	V66 M69 F88 Y96 L98	V66-L105 HydrophobicContact CB-CD2 4.48Å; V66-L105 HydrophobicContact CG2-CD1 3.45Å; V66-L105 VanDerWaalsContact CG2-CD1 3.45Å; V66-L105 HydrophobicContact CG2-CD2 3.77Å; V66-L105 HydrophobicContact CG2-CG 4.19Å; M69-L105 HydrophobicContact CE-CD2 3.22Å; M69-L105 HydrophobicContact SD-CD2 4.49Å; F88-L105 HydrophobicContact CD2-CD1 4.26Å; F88-L105 HydrophobicContact CE2-CD1 4.23Å; Y96-L105 HydrophobicContact CD1-CD2 3.79Å; Y96-L105 HydrophobicContact CD1-CG 3.94Å; Y96-L105 HydrophobicContact CE1-CD2 4.37Å; Y96-L105 HydrophobicContact CG-CD2 4.01Å; Y96-L105 HydrophobicContact CG-CG 4.19Å; L98-L105 HydrophobicContact CB-CD1 4.03Å
106	L	75.5	Confident	73.9	Confident	82 Å²	82	57.8 Å²	57.8	43%	0.429	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	121	-179.3	-75.1	164.9	0	0	0	109.7	Y96 S97 L104 I108	Y96-L106 CarbonylContact C-O 3.57Å; Y96-L106 VanDerWaalsContact CA-O 3.29Å; Y96-L106 WeakPolarHBondContact CA-O 3.46Å; S97-L106 PolarHBondContact N-O 3.14Å; S97-L106 PolarHBondContact O-N 2.85Å; S97-L106 PolarHBondContact OG-O 3.39Å; L104-L106 HydrophobicContact CD2-CD1 4.33Å; L104-L106 HydrophobicContact CD2-CD2 3.63Å; L104-L106 HydrophobicContact CD2-CG 3.9Å; L104-L106 HydrophobicContact CG-CD2 4.23Å; L104-L106 HydrophobicContact CG-CG 4.19Å; L104-L106 PolarHBondContact O-N 3.35Å; L106-I108 PolarHBondContact O-N 3.46Å
107	E	79.6	Confident	73.8	Confident	97 Å²	97	57 Å²	57	45%	0.453	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	115.3	166.9	-166.9	170.3	180	0	0	108.9	S94 Y96 S110	S94-E107 VanDerWaalsContact CB-OE1 3.27Å; S94-E107 WeakPolarHBondContact CB-OE1 3.35Å; S94-E107 PolarHBondContact OG-OE1 3.45Å; Y96-E107 HydrophobicContact CD1-CB 3.77Å; Y96-E107 HydrophobicContact CD1-CG 4.13Å; Y96-E107 HydrophobicContact CE1-CB 3.56Å; Y96-E107 HydrophobicContact CE1-CG 3.71Å; E107-S110 VanDerWaalsContact OE1-CB 3.26Å; E107-S110 WeakPolarHBondContact OE1-CB 3.37Å; E107-S110 PolarHBondContact OE1-OG 3.41Å
108	I	77.5	Confident	73.8	Confident	52 Å²	52	57 Å²	57	27%	0.267	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	-42.1	-175.4	-36.8	174.3	0	0	0	110.4	F15 Y87 I95 S97 L106	F15-I108 HydrophobicContact CD2-CG2 4.39Å; F15-I108 HydrophobicContact CE2-CB 4.31Å; F15-I108 HydrophobicContact CE2-CG2 3.37Å; F15-I108 HydrophobicContact CZ-CG2 3.91Å; Y87-I108 HydrophobicContact CD1-CD1 3.55Å; Y87-I108 HydrophobicContact CE1-CD1 3.59Å; I95-I108 HydrophobicContact CG2-CD1 4.26Å; I95-I108 PolarHBondContact O-N 3.45Å; S97-I108 WeakPolarHBondContact OG-CG1 3.49Å; L106-I108 PolarHBondContact O-N 3.46Å
109	V	77.3	Confident	74.1	Confident	26 Å²	26	57.4 Å²	57.4	16%	0.158	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	135	-175.6	179.1	0	0	0	0	108.2	F3 F15 S94 I95 V111	F3-V109 HydrophobicContact CE1-CG1 4.16Å; F3-V109 HydrophobicContact CE2-CG1 4.32Å; F3-V109 HydrophobicContact CZ-CG1 3.71Å; F15-V109 HydrophobicContact CB-CG2 4.43Å; F15-V109 HydrophobicContact CD1-CG2 4.11Å; F15-V109 HydrophobicContact CD2-CG2 3.35Å; F15-V109 HydrophobicContact CE1-CG2 4.21Å; F15-V109 HydrophobicContact CE2-CG2 3.52Å; F15-V109 HydrophobicContact CG-CG2 3.68Å; F15-V109 HydrophobicContact CZ-CG2 3.93Å; S94-V109 CarbonylContact C-O 3.5Å; S94-V109 WeakPolarHBondContact CA-O 3.44Å; I95-V109 HydrophobicContact CB-CB 4.32Å; I95-V109 HydrophobicContact CD1-CB 4.2Å; I95-V109 HydrophobicContact CG1-CB 4.47Å; I95-V109 PolarHBondContact N-O 2.95Å; I95-V109 PolarHBondContact O-N 3.47Å; V109-V111 HydrophobicContact CG1-CG2 4.13Å
110	S	76.4	Confident	74.5	Confident	66 Å²	66	55.1 Å²	55.1	46%	0.462	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	121.2	164.2	-162.4	0	0	0	0	108.2	S94 E107	S94-S110 PolarHBondContact OG-OG 3.29Å; E107-S110 VanDerWaalsContact OE1-CB 3.26Å; E107-S110 WeakPolarHBondContact OE1-CB 3.37Å; E107-S110 PolarHBondContact OE1-OG 3.41Å
111	V	71.2	Confident	75.2	Confident	14 Å²	14	53.5 Å²	53.5	9%	0.085	30%	0.302	C	S	.	.			trans	-95.1	117.7	170.3	-168.1	0	0	0	0	106.2	M1 F3 G93 V109 L113 L129	M1-V111 HydrophobicContact CE-CG1 3.94Å; M1-V111 HydrophobicContact SD-CG1 4.2Å; F3-V111 HydrophobicContact CE2-CG2 3.68Å; F3-V111 HydrophobicContact CZ-CG2 3.74Å; G93-V111 WeakPolarHBondContact CA-O 3.44Å; G93-V111 WeakPolarHBondContact O-CB 3.28Å; G93-V111 WeakPolarHBondContact O-CG2 3.36Å; G93-V111 PolarHBondContact O-N 3.09Å; V109-V111 HydrophobicContact CG1-CG2 4.13Å; V111-L113 HydrophobicContact CG1-CB 3.93Å; V111-L113 HydrophobicContact CG1-CD1 3.91Å; V111-L113 HydrophobicContact CG1-CG 4.1Å; V111-L113 PolarHBondContact O-N 2.86Å; V111-L129 HydrophobicContact CG2-CD1 4.21Å
112	D	71.6	Confident	75.8	Confident	158 Å²	158	54.1 Å²	54.1	85%	0.845	30%	0.295	S	S	*	.	S	Bend	trans	-70.4	47.2	178.4	-75	-30.3	0	0	0	112.6
113	L	68.7	Low	76.3	Confident	51 Å²	51	54.8 Å²	54.8	27%	0.267	30%	0.302	S	S	.	.	S	Bend	trans	-144.7	135.2	-174.1	-66.9	173.7	0	0	0	109.4	M1 R92 V111 L115 E131	M1-L113 HydrophobicContact CE-CD1 3.31Å; M1-L113 HydrophobicContact SD-CD1 4.18Å; R92-L113 CarbonylContact C-O 3.6Å; V111-L113 HydrophobicContact CG1-CB 3.93Å; V111-L113 HydrophobicContact CG1-CD1 3.91Å; V111-L113 HydrophobicContact CG1-CG 4.1Å; V111-L113 PolarHBondContact O-N 2.86Å; L113-L115 PolarHBondContact O-N 3.31Å; L113-E131 HydrophobicContact CB-CG 4.26Å; L113-E131 HydrophobicContact CD1-CG 4.28Å; L113-E131 HydrophobicContact CD2-CG 4.22Å; L113-E131 VanDerWaalsContact CD2-OE1 3.3Å; L113-E131 WeakPolarHBondContact CD2-OE1 3.47Å; L113-E131 HydrophobicContact CG-CG 4.49Å
114	M	74.9	Confident	77	Confident	122 Å²	122	52.2 Å²	52.2	60%	0.601	29%	0.291	S	S	*	.			trans	-68.8	123	167.1	-77.7	-156.8	-166.6	0	0	109.6	K91 H132	K91-M114 CarbonylContact O-C 3.6Å; K91-M114 WeakPolarHBondContact O-CA 3.39Å; M114-H132 HydrophobicContact CB-CB 4.2Å; M114-H132 WeakPolarHBondContact O-CB 3.33Å; M114-H132 PolarHBondContact O-N 3.35Å
115	L	77.8	Confident	77.5	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	129.9	178.2	-61	-178.9	0	0	0	109.8	I75 V89 K91 L113 L129 A130	I75-L115 HydrophobicContact CD1-CB 3.48Å; I75-L115 VanDerWaalsContact CD1-CB 3.48Å; I75-L115 HydrophobicContact CD1-CD1 3.92Å; I75-L115 HydrophobicContact CD1-CG 4.37Å; V89-L115 HydrophobicContact CG1-CD1 3.66Å; K91-L115 PolarHBondContact O-N 3.31Å; L113-L115 PolarHBondContact O-N 3.31Å; L115-L129 HydrophobicContact CD1-CD1 4.05Å; L115-L129 HydrophobicContact CD1-CD2 3.91Å; L115-L129 HydrophobicContact CD1-CG 4.45Å; L115-L129 HydrophobicContact CD2-CB 4.05Å; L115-L129 HydrophobicContact CD2-CD1 4.23Å; L115-A130 CarbonylContact C-O 3.53Å; L115-A130 WeakPolarHBondContact CA-O 3.29Å
116	A	75.5	Confident	78.1	Confident	29 Å²	29	49.8 Å²	49.8	24%	0.24	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-33.6	173.1	0	0	0	0	0	112	A130 H132 A144	A116-A130 PolarHBondContact N-O 3.21Å; A116-H132 HydrophobicContact CB-CB 4.03Å; A116-A144 HydrophobicContact CB-CB 3.86Å
117	A	79.5	Confident	78.4	Confident	10 Å²	10	45.9 Å²	45.9	8%	0.083	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	152.5	176.4	0	0	0	0	0	110.4	A130 A144 I146	A117-A130 HydrophobicContact CB-CB 4.26Å; A117-A130 PolarHBondContact N-O 3.34Å; A117-A130 PolarHBondContact O-N 3.04Å; A117-A144 HydrophobicContact CB-CB 4.36Å; A117-I146 HydrophobicContact CB-CD1 4Å; A117-I146 HydrophobicContact CB-CG1 3.95Å
118	A	84.5	Confident	78.6	Confident	10 Å²	10	41.3 Å²	41.3	8%	0.083	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	148.9	169.8	0	0	0	0	0	108.2	I75 E76 V89 L127 A128 L129	I75-A118 HydrophobicContact CD1-CB 3.58Å; I75-A118 HydrophobicContact CG1-CB 3.94Å; E76-A118 HydrophobicContact CB-CB 3.69Å; E76-A118 HydrophobicContact CG-CB 4.37Å; E76-A118 VanDerWaalsContact OE2-O 3.11Å; V89-A118 HydrophobicContact CB-CB 4.28Å; V89-A118 HydrophobicContact CG1-CB 3.92Å; A118-L127 HydrophobicContact CB-CD1 4.34Å; A118-A128 CarbonylContact C-O 3.6Å; A118-A128 VanDerWaalsContact CA-O 3.23Å; A118-A128 WeakPolarHBondContact CA-O 3.4Å; A118-L129 HydrophobicContact CB-CD2 3.48Å; A118-L129 VanDerWaalsContact CB-CD2 3.48Å
119	A	85.4	Confident	78.9	Confident	8 Å²	8	39.2 Å²	39.2	7%	0.066	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	132.1	171.9	0	0	0	0	0	110.9	E76 A128 I146 W148	E76-A119 WeakPolarHBondContact OE2-CA 3.5Å; A119-A128 PolarHBondContact N-O 3.43Å; A119-A128 WeakPolarHBondContact O-CB 3.3Å; A119-A128 PolarHBondContact O-N 3.04Å; A119-I146 HydrophobicContact CB-CB 3.9Å; A119-I146 HydrophobicContact CB-CG2 3.7Å; A119-W148 PolarHBondContact O-NE1 2.88Å
120	W	85.2	Confident	78.9	Confident	30 Å²	30	38.9 Å²	38.9	11%	0.114	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	145.4	170.3	-71.3	97	0	0	0	111.3	E76 V78 Y87 L126 L127 W148	E76-W120 VanDerWaalsContact CG-CD1 3.47Å; V78-W120 HydrophobicContact CB-CD2 4.45Å; V78-W120 HydrophobicContact CB-CG 4.03Å; V78-W120 HydrophobicContact CG1-CD2 3.74Å; V78-W120 VanDerWaalsContact CG1-CE2 3.43Å; V78-W120 HydrophobicContact CG1-CE3 4.48Å; V78-W120 HydrophobicContact CG1-CG 3.84Å; V78-W120 HydrophobicContact CG1-CZ2 3.97Å; V78-W120 VanDerWaalsContact CG1-NE1 3.33Å; Y87-W120 HydrophobicContact CG-CH2 4.45Å; Y87-W120 HydrophobicContact CG-CZ2 4.15Å; W120-L126 CarbonylContact C-O 3.58Å; W120-L126 WeakPolarHBondContact CA-O 3.43Å; W120-L127 HydrophobicContact CD2-CB 4.03Å; W120-L127 HydrophobicContact CD2-CD1 3.95Å; W120-L127 HydrophobicContact CD2-CG 4.48Å; W120-L127 HydrophobicContact CE3-CB 3.82Å; W120-L127 HydrophobicContact CG-CD1 4.09Å; W120-L127 HydrophobicContact CH2-CB 3.96Å; W120-L127 HydrophobicContact CH2-CD2 4.3Å; W120-L127 HydrophobicContact CZ2-CB 4.14Å; W120-L127 HydrophobicContact CZ2-CD1 4.35Å; W120-L127 HydrophobicContact CZ2-CD2 3.9Å; W120-L127 HydrophobicContact CZ2-CG 4.35Å; W120-L127 HydrophobicContact CZ3-CB 3.8Å; W120-W148 VanDerWaalsContact C-NE1 3.34Å; W120-W148 PolarHBondContact O-NE1 2.86Å
121	S	84.6	Confident	78.8	Confident	2 Å²	2	39 Å²	39	1%	0.014	22%	0.221	C	C	.	.			trans	-64.5	156.3	168.1	56.5	0	0	0	0	110.6	D123 S124 V125 L126	S121-D123 VanDerWaalsContact CB-OD1 3.26Å; S121-D123 WeakPolarHBondContact CB-OD1 3.44Å; S121-D123 PolarHBondContact O-N 3.36Å; S121-D123 PolarHBondContact OG-OD1 3.44Å; S121-S124 WeakPolarHBondContact O-CA 3.34Å; S121-S124 PolarHBondContact O-N 3.19Å; S121-V125 PolarHBondContact OG-N 3.29Å; S121-L126 PolarHBondContact N-O 3.34Å; S121-L126 PolarHBondContact OG-N 3.42Å; S121-L126 PolarHBondContact OG-O 3.08Å
122	P	80.4	Confident	78.6	Confident	73 Å²	73	41.6 Å²	41.6	47%	0.474	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-31	-177.7	-25.1	33.9	0	0	0	114.5	S124 W148 D149	P122-S124 PolarHBondContact O-N 3.32Å; P122-W148 HydrophobicContact CG-CB 4.41Å; P122-D149 WeakPolarHBondContact CG-O 3.41Å
123	D	77.8	Confident	77.8	Confident	98 Å²	98	38.6 Å²	38.6	52%	0.524	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-1	174.5	65.8	-7.4	0	0	0	113.5	S121 V125	S121-D123 VanDerWaalsContact CB-OD1 3.26Å; S121-D123 WeakPolarHBondContact CB-OD1 3.44Å; S121-D123 PolarHBondContact O-N 3.36Å; S121-D123 PolarHBondContact OG-OD1 3.44Å; D123-V125 HydrophobicContact CB-CG2 4.13Å; D123-V125 PolarHBondContact O-N 3.43Å; D123-V125 PolarHBondContact OD1-N 2.89Å; D123-V125 VanDerWaalsContact OD1-N 3.16Å; D123-V125 WeakPolarHBondContact OD2-CG2 3.3Å
124	S	76.9	Confident	76.6	Confident	36 Å²	36	44.2 Å²	44.2	25%	0.252	25%	0.245	S	C	.	.	S	Bend	trans	59	23	-176.8	-53.1	0	0	0	0	114.8	S121 P122	S121-S124 WeakPolarHBondContact O-CA 3.34Å; S121-S124 PolarHBondContact O-N 3.19Å; P122-S124 PolarHBondContact O-N 3.32Å
125	V	77.3	Confident	75	Confident	54 Å²	54	39.8 Å²	39.8	33%	0.327	23%	0.228	S	C	.	.			trans	-95.2	-34.6	-177.5	178	0	0	0	0	113	A5 S121 D123	A5-V125 PolarHBondContact N-O 3.01Å; S121-V125 PolarHBondContact OG-N 3.29Å; D123-V125 HydrophobicContact CB-CG2 4.13Å; D123-V125 PolarHBondContact O-N 3.43Å; D123-V125 PolarHBondContact OD1-N 2.89Å; D123-V125 VanDerWaalsContact OD1-N 3.16Å; D123-V125 WeakPolarHBondContact OD2-CG2 3.3Å
126	L	81.6	Confident	73.2	Confident	27 Å²	27	43.3 Å²	43.3	14%	0.141	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	132.4	-176.8	-61.7	175.2	0	0	0	110.2	R4 W120 S121 W148	R4-L126 HydrophobicContact CB-CD2 3.99Å; R4-L126 HydrophobicContact CG-CD2 3.87Å; W120-L126 CarbonylContact C-O 3.58Å; W120-L126 WeakPolarHBondContact CA-O 3.43Å; S121-L126 PolarHBondContact N-O 3.34Å; S121-L126 PolarHBondContact OG-N 3.42Å; S121-L126 PolarHBondContact OG-O 3.08Å; L126-W148 HydrophobicContact CB-CH2 3.75Å; L126-W148 HydrophobicContact CB-CZ2 3.97Å; L126-W148 HydrophobicContact CD1-CH2 3.89Å; L126-W148 HydrophobicContact CD1-CZ3 4.35Å; L126-W148 HydrophobicContact CG-CH2 4.49Å
127	L	83.8	Confident	71.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	120.2	170.3	174	62.9	0	0	0	109.8	F2 F3 V89 I95 A118 W120 L129	F2-L127 WeakPolarHBondContact CA-O 3.46Å; F3-L127 HydrophobicContact CB-CB 4.19Å; F3-L127 HydrophobicContact CD2-CD2 4.38Å; F3-L127 PolarHBondContact N-O 3.02Å; F3-L127 PolarHBondContact O-N 3.24Å; V89-L127 HydrophobicContact CG2-CD1 4.19Å; V89-L127 HydrophobicContact CG2-CD2 3.75Å; I95-L127 HydrophobicContact CD1-CD2 3.61Å; I95-L127 HydrophobicContact CG1-CD2 4.45Å; A118-L127 HydrophobicContact CB-CD1 4.34Å; W120-L127 HydrophobicContact CD2-CB 4.03Å; W120-L127 HydrophobicContact CD2-CD1 3.95Å; W120-L127 HydrophobicContact CD2-CG 4.48Å; W120-L127 HydrophobicContact CE3-CB 3.82Å; W120-L127 HydrophobicContact CG-CD1 4.09Å; W120-L127 HydrophobicContact CH2-CB 3.96Å; W120-L127 HydrophobicContact CH2-CD2 4.3Å; W120-L127 HydrophobicContact CZ2-CB 4.14Å; W120-L127 HydrophobicContact CZ2-CD1 4.35Å; W120-L127 HydrophobicContact CZ2-CD2 3.9Å; W120-L127 HydrophobicContact CZ2-CG 4.35Å; W120-L127 HydrophobicContact CZ3-CB 3.8Å; L127-L129 HydrophobicContact CD1-CD2 3.98Å; L127-L129 HydrophobicContact CD2-CD2 3.94Å; L127-L129 HydrophobicContact CD2-CG 4.43Å; L127-L129 HydrophobicContact CG-CD2 3.77Å; L127-L129 HydrophobicContact CG-CG 4.19Å
128	A	83.3	Confident	69.6	Low	2 Å²	2	49.6 Å²	49.6	2%	0.017	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	130.3	174.2	0	0	0	0	0	111	F2 A118 A119 I146 W148 I155	F2-A128 HydrophobicContact CD1-CB 4.05Å; F2-A128 HydrophobicContact CE1-CB 3.61Å; A118-A128 CarbonylContact C-O 3.6Å; A118-A128 VanDerWaalsContact CA-O 3.23Å; A118-A128 WeakPolarHBondContact CA-O 3.4Å; A119-A128 PolarHBondContact N-O 3.43Å; A119-A128 WeakPolarHBondContact O-CB 3.3Å; A119-A128 PolarHBondContact O-N 3.04Å; A128-I146 HydrophobicContact CB-CD1 4.11Å; A128-I146 HydrophobicContact CB-CG2 3.91Å; A128-W148 HydrophobicContact CB-CZ2 3.79Å; A128-I155 HydrophobicContact CB-CD1 3.17Å
129	L	83.8	Confident	67.5	Low	8 Å²	8	54.9 Å²	54.9	4%	0.042	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	132.7	177	-58	-176.1	0	0	0	111.4	M1 F3 V89 V111 L115 A118 L127	M1-L129 HydrophobicContact CB-CB 4.45Å; M1-L129 PolarHBondContact N-O 3.08Å; M1-L129 PolarHBondContact O-N 3.03Å; F3-L129 HydrophobicContact CD2-CD1 3.55Å; F3-L129 HydrophobicContact CD2-CG 4.24Å; F3-L129 HydrophobicContact CE2-CD1 3.32Å; F3-L129 HydrophobicContact CE2-CG 4.43Å; V89-L129 HydrophobicContact CG1-CD2 4.05Å; V111-L129 HydrophobicContact CG2-CD1 4.21Å; L115-L129 HydrophobicContact CD1-CD1 4.05Å; L115-L129 HydrophobicContact CD1-CD2 3.91Å; L115-L129 HydrophobicContact CD1-CG 4.45Å; L115-L129 HydrophobicContact CD2-CB 4.05Å; L115-L129 HydrophobicContact CD2-CD1 4.23Å; A118-L129 HydrophobicContact CB-CD2 3.48Å; A118-L129 VanDerWaalsContact CB-CD2 3.48Å; L127-L129 HydrophobicContact CD1-CD2 3.98Å; L127-L129 HydrophobicContact CD2-CD2 3.94Å; L127-L129 HydrophobicContact CD2-CG 4.43Å; L127-L129 HydrophobicContact CG-CD2 3.77Å; L127-L129 HydrophobicContact CG-CG 4.19Å
130	A	77.6	Confident	65.5	Low	18 Å²	18	58.9 Å²	58.9	15%	0.149	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	129	171.6	0	0	0	0	0	110.2	L115 A116 A117 I146	L115-A130 CarbonylContact C-O 3.53Å; L115-A130 WeakPolarHBondContact CA-O 3.29Å; A116-A130 PolarHBondContact N-O 3.21Å; A117-A130 HydrophobicContact CB-CB 4.26Å; A117-A130 PolarHBondContact N-O 3.34Å; A117-A130 PolarHBondContact O-N 3.04Å; A130-I146 HydrophobicContact CB-CD1 3.71Å; A130-I146 HydrophobicContact CB-CG1 4.25Å
131	E	74	Confident	64	Low	69 Å²	69	60.3 Å²	60.3	32%	0.322	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	143	178.1	-176.5	-176.6	164.2	0	0	110.9	L113 L133	L113-E131 HydrophobicContact CB-CG 4.26Å; L113-E131 HydrophobicContact CD1-CG 4.28Å; L113-E131 HydrophobicContact CD2-CG 4.22Å; L113-E131 VanDerWaalsContact CD2-OE1 3.3Å; L113-E131 WeakPolarHBondContact CD2-OE1 3.47Å; L113-E131 HydrophobicContact CG-CG 4.49Å; E131-L133 PolarHBondContact O-N 2.94Å
132	H	65.8	Low	62.8	Low	69 Å²	69	62.2 Å²	62.2	32%	0.319	37%	0.367	S	S	.	.			trans	-76.5	99.5	172.7	-153.8	-47	0	0	0	110	M114 A116 L134	M114-H132 HydrophobicContact CB-CB 4.2Å; M114-H132 WeakPolarHBondContact O-CB 3.33Å; M114-H132 PolarHBondContact O-N 3.35Å; A116-H132 HydrophobicContact CB-CB 4.03Å; H132-L134 PolarHBondContact O-N 3.38Å
133	L	54.4	Low	62.2	Low	94 Å²	94	60.3 Å²	60.3	49%	0.492	36%	0.361	S	S	.	.			trans	-73	124.1	165.4	-72.7	163.5	0	0	0	107.7	E131 A135	E131-L133 PolarHBondContact O-N 2.94Å; L133-A135 PolarHBondContact O-N 3.41Å
134	L	45.2	Very low	62.1	Low	170 Å²	170	56.7 Å²	56.7	89%	0.89	34%	0.344	S	S	*	.			trans	-45.9	97.8	-178.9	-74.9	146.9	0	0	0	112	H132	H132-L134 PolarHBondContact O-N 3.38Å
135	A	40.6	Very low	62.4	Low	28 Å²	28	57 Å²	57	23%	0.231	35%	0.345	C	S	.	.			trans	-117.8	142.1	166.6	0	0	0	0	0	108.5	L133 V137	L133-A135 PolarHBondContact O-N 3.41Å; A135-V137 PolarHBondContact O-N 3.1Å
136	P	39.8	Very low	62.8	Low	75 Å²	75	55.3 Å²	55.3	49%	0.487	33%	0.334	S	S	.	.			trans	-64.5	127.3	-179.3	25.3	-31.9	0	0	0	110.9	S138	P136-S138 PolarHBondContact O-N 3.13Å; P136-S138 VanDerWaalsContact O-N 3.08Å
137	V	40.5	Very low	63.1	Low	61 Å²	61	55.3 Å²	55.3	37%	0.37	34%	0.336	S	S	.	.	S	Bend	trans	-80.4	24.7	-167.8	-172.1	0	0	0	0	113.5	D33 A135	D33-V137 VanDerWaalsContact OD2-CB 3.3Å; D33-V137 WeakPolarHBondContact OD2-CB 3.32Å; D33-V137 WeakPolarHBondContact OD2-CG1 3.42Å; A135-V137 PolarHBondContact O-N 3.1Å
138	S	39.6	Very low	63.3	Low	110 Å²	110	56.3 Å²	56.3	77%	0.769	34%	0.339	S	S	*	.			trans	-97.5	6.8	-174.4	69.3	0	0	0	0	115.2	P136	P136-S138 PolarHBondContact O-N 3.13Å; P136-S138 VanDerWaalsContact O-N 3.08Å
139	Q	39	Very low	63.5	Low	121 Å²	121	57 Å²	57	57%	0.565	34%	0.343	S	S	*	.	S	Bend	trans	-123.3	122.6	174	-73.6	-178.2	-14.1	0	0	110.3	T142	Q139-T142 HydrophobicContact CB-CG2 3.98Å; Q139-T142 VanDerWaalsContact O-CG2 3.24Å; Q139-T142 WeakPolarHBondContact O-CG2 3.4Å; Q139-T142 PolarHBondContact O-N 2.87Å; Q139-T142 PolarHBondContact O-OG1 3.23Å
140	A	44	Very low	63.4	Low	92 Å²	92	59.4 Å²	59.4	76%	0.76	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	140.9	161.2	0	0	0	0	0	108.4
141	N	53.2	Low	63.7	Low	60 Å²	60	64.6 Å²	64.6	32%	0.321	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	26.2	-170.7	-65.1	-31.4	0	0	0	118	R166	N141-R166 PolarHBondContact O-NH2 3.43Å
142	T	59.6	Low	64.2	Low	42 Å²	42	61.7 Å²	61.7	26%	0.258	37%	0.374	S	S	.	.			trans	-92.2	-6.8	172.7	46.4	0	0	0	0	115.3	Q139 F160	Q139-T142 HydrophobicContact CB-CG2 3.98Å; Q139-T142 VanDerWaalsContact O-CG2 3.24Å; Q139-T142 WeakPolarHBondContact O-CG2 3.4Å; Q139-T142 PolarHBondContact O-N 2.87Å; Q139-T142 PolarHBondContact O-OG1 3.23Å; T142-F160 HydrophobicContact CG2-CD1 3.85Å; T142-F160 HydrophobicContact CG2-CE1 3.82Å
143	G	67.6	Low	65.1	Low	33 Å²	33	64.1 Å²	64.1	34%	0.34	39%	0.385	S	S	.	.			trans	-68.4	160.7	-176.3	0	0	0	0	0	115	R166	G143-R166 VanDerWaalsContact O-CZ 3.31Å; G143-R166 PolarHBondContact O-NH1 3.26Å; G143-R166 PolarHBondContact O-NH2 3.3Å
144	A	76.8	Confident	66.7	Low	21 Å²	21	60.5 Å²	60.5	17%	0.174	37%	0.368	C	S	.	.			trans	-95.6	149.7	167.4	0	0	0	0	0	110	A116 A117 S158	A116-A144 HydrophobicContact CB-CB 3.86Å; A117-A144 HydrophobicContact CB-CB 4.36Å; A144-S158 VanDerWaalsContact CA-O 3.23Å; A144-S158 WeakPolarHBondContact CA-O 3.41Å; A144-S158 WeakPolarHBondContact CB-O 3.34Å
145	V	83.3	Confident	68.8	Low	44 Å²	44	52.5 Å²	52.5	27%	0.267	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	139	173.1	172.1	0	0	0	0	108.6	S158 L189	V145-S158 PolarHBondContact N-O 3.35Å; V145-S158 PolarHBondContact O-N 3Å; V145-L189 HydrophobicContact CB-CD2 3.96Å; V145-L189 HydrophobicContact CG2-CD1 3.69Å; V145-L189 HydrophobicContact CG2-CD2 3.52Å; V145-L189 HydrophobicContact CG2-CG 4.19Å
146	I	86.5	Confident	71.1	Confident	18 Å²	18	51.3 Å²	51.3	9%	0.092	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	131.3	174.3	-63.7	170.3	0	0	0	108	A117 A119 A128 A130 I155 A156	A117-I146 HydrophobicContact CB-CD1 4Å; A117-I146 HydrophobicContact CB-CG1 3.95Å; A119-I146 HydrophobicContact CB-CB 3.9Å; A119-I146 HydrophobicContact CB-CG2 3.7Å; A128-I146 HydrophobicContact CB-CD1 4.11Å; A128-I146 HydrophobicContact CB-CG2 3.91Å; A130-I146 HydrophobicContact CB-CD1 3.71Å; A130-I146 HydrophobicContact CB-CG1 4.25Å; I146-I155 HydrophobicContact CG2-CD1 3.14Å; I146-I155 HydrophobicContact CG2-CG1 3.43Å; I146-I155 VanDerWaalsContact CG2-CG1 3.43Å; I146-A156 WeakPolarHBondContact CA-O 3.32Å
147	C	86.9	Confident	73.4	Confident	27 Å²	27	48.9 Å²	48.9	18%	0.182	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	130.5	173.8	-168.3	0	0	0	0	109.6	A156 W193	C147-A156 PolarHBondContact N-O 3.01Å; C147-A156 PolarHBondContact O-N 3.15Å; C147-W193 VanDerWaalsContact SG-CB 3.51Å; C147-W193 PolarHBondContact SG-N 3.48Å; C147-W193 VanDerWaalsContact SG-N 3.36Å
148	W	87.3	Confident	75.6	Confident	20 Å²	20	46.1 Å²	46.1	8%	0.076	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	149.9	175.2	-71.2	93.9	0	0	0	110.8	F2 A119 W120 P122 L126 A128 G152 I155	F2-W148 HydrophobicContact CD1-CH2 4.14Å; F2-W148 HydrophobicContact CD1-CZ2 4.19Å; F2-W148 AromaticContact CE1-CH2 3.26Å; F2-W148 HydrophobicContact CE1-CH2 3.26Å; F2-W148 AromaticContact CE1-CZ2 3.4Å; F2-W148 HydrophobicContact CE1-CZ2 3.4Å; F2-W148 HydrophobicContact CE1-CZ3 4.31Å; F2-W148 AromaticContact CZ-CH2 3.63Å; F2-W148 HydrophobicContact CZ-CH2 3.63Å; F2-W148 HydrophobicContact CZ-CZ2 4.16Å; F2-W148 HydrophobicContact CZ-CZ3 4.31Å; A119-W148 PolarHBondContact O-NE1 2.88Å; W120-W148 VanDerWaalsContact C-NE1 3.34Å; W120-W148 PolarHBondContact O-NE1 2.86Å; P122-W148 HydrophobicContact CG-CB 4.41Å; L126-W148 HydrophobicContact CB-CH2 3.75Å; L126-W148 HydrophobicContact CB-CZ2 3.97Å; L126-W148 HydrophobicContact CD1-CH2 3.89Å; L126-W148 HydrophobicContact CD1-CZ3 4.35Å; L126-W148 HydrophobicContact CG-CH2 4.49Å; A128-W148 HydrophobicContact CB-CZ2 3.79Å; W148-G152 WeakPolarHBondContact CZ3-O 3.39Å; W148-I155 HydrophobicContact CD2-CB 4.35Å; W148-I155 HydrophobicContact CD2-CD1 4.08Å; W148-I155 HydrophobicContact CD2-CG1 4.25Å; W148-I155 HydrophobicContact CE3-CB 4.15Å; W148-I155 HydrophobicContact CH2-CD1 4.41Å; W148-I155 HydrophobicContact CZ2-CD1 3.95Å; W148-I155 HydrophobicContact CZ3-CB 4.41Å
149	D	87.4	Confident	77.6	Confident	16 Å²	16	43.2 Å²	43.2	9%	0.086	26%	0.261	C	S	.	.			trans	-69.2	164	160	72	-4.1	0	0	0	110.5	P122 L151 G152 E153 C154 W193	P122-D149 WeakPolarHBondContact CG-O 3.41Å; D149-L151 PolarHBondContact O-N 3.27Å; D149-G152 PolarHBondContact O-N 2.9Å; D149-G152 VanDerWaalsContact OD1-CA 3.29Å; D149-G152 WeakPolarHBondContact OD1-CA 3.28Å; D149-G152 PolarHBondContact OD1-N 3.46Å; D149-E153 PolarHBondContact OD1-N 3.39Å; D149-C154 HydrophobicContact CB-CB 4.36Å; D149-C154 VanDerWaalsContact CG-N 3.27Å; D149-C154 PolarHBondContact N-O 2.91Å; D149-C154 PolarHBondContact OD1-N 3.15Å; D149-C154 VanDerWaalsContact OD1-N 3.1Å; D149-C154 WeakPolarHBondContact OD2-CB 3.35Å; D149-C154 PolarHBondContact OD2-N 3.42Å; D149-W193 HydrophobicContact CB-CD2 3.94Å; D149-W193 HydrophobicContact CB-CE3 4.38Å; D149-W193 HydrophobicContact CB-CG 4.42Å; D149-W193 HydrophobicContact CB-CH2 4.21Å; D149-W193 HydrophobicContact CB-CZ2 3.74Å; D149-W193 HydrophobicContact CB-CZ3 4.49Å
150	S	81.9	Confident	79.5	Confident	60 Å²	60	39.7 Å²	39.7	42%	0.42	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-20.8	-176.7	54.1	0	0	0	0	114.3	P195	S150-P195 WeakPolarHBondContact CB-O 3.3Å; S150-P195 PolarHBondContact OG-O 3.12Å
151	L	84	Confident	81	Confident	126 Å²	126	37.3 Å²	37.3	66%	0.66	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-10.1	179.8	-60.8	179	0	0	0	112.8	D149 E153	D149-L151 PolarHBondContact O-N 3.27Å; L151-E153 HydrophobicContact CB-CG 3.95Å; L151-E153 PolarHBondContact O-N 3.37Å
152	G	84	Confident	81.9	Confident	9 Å²	9	38.8 Å²	38.8	9%	0.093	23%	0.234	C	C	.	.	S	Bend	trans	69.6	16.1	-173.2	0	0	0	0	0	114	W148 D149	W148-G152 WeakPolarHBondContact CZ3-O 3.39Å; D149-G152 PolarHBondContact O-N 2.9Å; D149-G152 VanDerWaalsContact OD1-CA 3.29Å; D149-G152 WeakPolarHBondContact OD1-CA 3.28Å; D149-G152 PolarHBondContact OD1-N 3.46Å
153	E	85.9	Confident	82.7	Confident	120 Å²	120	41.4 Å²	41.4	56%	0.561	26%	0.26	S	S	*	.	S	Bend	trans	-88.5	-33.4	-178.3	-67.1	-169.2	166.4	0	0	112.4	D149 L151 N172 S173	D149-E153 PolarHBondContact OD1-N 3.39Å; L151-E153 HydrophobicContact CB-CG 3.95Å; L151-E153 PolarHBondContact O-N 3.37Å; E153-N172 CarbonylContact O-C 3.56Å; E153-N172 VanDerWaalsContact O-CA 3.31Å; E153-N172 WeakPolarHBondContact O-CA 3.43Å; E153-S173 PolarHBondContact O-N 3.41Å
154	C	88.2	Confident	83	Confident	18 Å²	18	49 Å²	49	12%	0.122	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	151.8	-178.4	-63.3	0	0	0	0	112	D149 I170 W171 W193	D149-C154 HydrophobicContact CB-CB 4.36Å; D149-C154 VanDerWaalsContact CG-N 3.27Å; D149-C154 PolarHBondContact N-O 2.91Å; D149-C154 PolarHBondContact OD1-N 3.15Å; D149-C154 VanDerWaalsContact OD1-N 3.1Å; D149-C154 WeakPolarHBondContact OD2-CB 3.35Å; D149-C154 PolarHBondContact OD2-N 3.42Å; C154-I170 HydrophobicContact CB-CG2 4.16Å; C154-W171 CarbonylContact C-O 3.46Å; C154-W171 VanDerWaalsContact CA-O 3.28Å; C154-W171 WeakPolarHBondContact CA-O 3.46Å; C154-W193 HydrophobicContact CB-CH2 3.7Å; C154-W193 HydrophobicContact CB-CZ2 4.32Å; C154-W193 HydrophobicContact CB-CZ3 4.38Å
155	I	89.1	Confident	83.1	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.01	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	129.8	177.9	-169.1	168.2	0	0	0	110.4	F2 A128 I146 W148 V157 I170 W171	F2-I155 HydrophobicContact CE1-CD1 4.03Å; F2-I155 HydrophobicContact CZ-CD1 4.16Å; F2-I155 HydrophobicContact CZ-CG2 4.06Å; A128-I155 HydrophobicContact CB-CD1 3.17Å; I146-I155 HydrophobicContact CG2-CD1 3.14Å; I146-I155 HydrophobicContact CG2-CG1 3.43Å; I146-I155 VanDerWaalsContact CG2-CG1 3.43Å; W148-I155 HydrophobicContact CD2-CB 4.35Å; W148-I155 HydrophobicContact CD2-CD1 4.08Å; W148-I155 HydrophobicContact CD2-CG1 4.25Å; W148-I155 HydrophobicContact CE3-CB 4.15Å; W148-I155 HydrophobicContact CH2-CD1 4.41Å; W148-I155 HydrophobicContact CZ2-CD1 3.95Å; W148-I155 HydrophobicContact CZ3-CB 4.41Å; I155-V157 HydrophobicContact CG1-CG2 4.35Å; I155-I170 CarbonylContact O-C 3.57Å; I155-I170 VanDerWaalsContact O-CA 3.32Å; I155-I170 WeakPolarHBondContact O-CA 3.45Å; I155-W171 HydrophobicContact CG2-CB 3.67Å; I155-W171 HydrophobicContact CG2-CG 4.43Å; I155-W171 PolarHBondContact N-O 3.36Å; I155-W171 PolarHBondContact O-N 3.04Å
156	A	88.2	Confident	83.2	Confident	3 Å²	3	46.8 Å²	46.8	3%	0.025	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	123.2	172.1	0	0	0	0	0	108.9	I146 C147 V168 H169 W193 I200	I146-A156 WeakPolarHBondContact CA-O 3.32Å; C147-A156 PolarHBondContact N-O 3.01Å; C147-A156 PolarHBondContact O-N 3.15Å; A156-V168 HydrophobicContact CB-CG1 4.16Å; A156-H169 WeakPolarHBondContact CA-O 3.15Å; A156-W193 HydrophobicContact CB-CE3 3.73Å; A156-W193 HydrophobicContact CB-CZ3 3.56Å; A156-I200 HydrophobicContact CB-CD1 4.05Å
157	V	88.3	Confident	83.2	Confident	24 Å²	24	47.6 Å²	47.6	15%	0.145	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	113.6	177.6	-174.1	0	0	0	0	108.3	I155 V159 V168 H169	I155-V157 HydrophobicContact CG1-CG2 4.35Å; V157-V159 HydrophobicContact CG1-CG2 3.91Å; V157-V168 WeakPolarHBondContact O-CA 3.43Å; V157-H169 PolarHBondContact N-O 3.33Å; V157-H169 PolarHBondContact O-N 2.92Å
158	S	87.3	Confident	83.2	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.014	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	122.4	175.2	-172.6	0	0	0	0	110.1	A144 V145 R166 I191	A144-S158 VanDerWaalsContact CA-O 3.23Å; A144-S158 WeakPolarHBondContact CA-O 3.41Å; A144-S158 WeakPolarHBondContact CB-O 3.34Å; V145-S158 PolarHBondContact N-O 3.35Å; V145-S158 PolarHBondContact O-N 3Å; S158-R166 WeakPolarHBondContact OG-CD 3.47Å; S158-R166 WeakPolarHBondContact OG-CG 3.41Å; S158-R166 PolarHBondContact OG-NH1 3.26Å; S158-I191 WeakPolarHBondContact OG-CD1 3.31Å
159	V	81.8	Confident	83.3	Confident	50 Å²	50	47.5 Å²	47.5	30%	0.303	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	138.3	-178.3	-172.7	0	0	0	0	108.7	V157 R166 S167	V157-V159 HydrophobicContact CG1-CG2 3.91Å; V159-R166 WeakPolarHBondContact O-CA 3.31Å; V159-S167 PolarHBondContact N-O 2.91Å; V159-S167 PolarHBondContact O-N 3.45Å
160	F	78.4	Confident	83.4	Confident	47 Å²	47	46.8 Å²	46.8	21%	0.206	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	131.6	173	-177	-94.7	0	0	0	110.1	T142 P162 R166	T142-F160 HydrophobicContact CG2-CD1 3.85Å; T142-F160 HydrophobicContact CG2-CE1 3.82Å; F160-P162 HydrophobicContact CE1-CG 4.26Å; F160-R166 HydrophobicContact CD2-CB 4.31Å
161	S	75	Confident	83.7	Confident	42 Å²	42	45.6 Å²	45.6	29%	0.294	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	125	169.9	179.4	0	0	0	0	108.9	A163 R164 G165	S161-A163 PolarHBondContact O-N 2.99Å; S161-R164 CarbonylContact O-C 3.53Å; S161-R164 PolarHBondContact O-N 2.88Å; S161-G165 PolarHBondContact N-O 2.87Å; S161-G165 WeakPolarHBondContact O-CA 3.46Å; S161-G165 PolarHBondContact O-N 3.37Å
162	P	72.2	Confident	83.9	Confident	91 Å²	91	41.4 Å²	41.4	59%	0.591	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-29.3	178.5	-27.7	34.3	0	0	0	114.4	F160	F160-P162 HydrophobicContact CE1-CG 4.26Å
163	A	75.8	Confident	83.9	Confident	97 Å²	97	43 Å²	43	80%	0.802	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-25.8	-178.9	0	0	0	0	0	114.3	S161	S161-A163 PolarHBondContact O-N 2.99Å
164	R	74.6	Confident	83.6	Confident	192 Å²	192	44.9 Å²	44.9	73%	0.725	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-120.9	-5.4	-175.9	-85.5	-172.4	175.9	178	-1.1	113.2	S161 Y183	S161-R164 CarbonylContact O-C 3.53Å; S161-R164 PolarHBondContact O-N 2.88Å; R164-Y183 WeakPolarHBondContact O-CE2 3.42Å; R164-Y183 PolarHBondContact O-OH 3.31Å
165	G	78.8	Confident	83.1	Confident	14 Å²	14	45.1 Å²	45.1	14%	0.144	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	70.4	-155	-166.2	0	0	0	0	0	112.1	S161	S161-G165 PolarHBondContact N-O 2.87Å; S161-G165 WeakPolarHBondContact O-CA 3.46Å; S161-G165 PolarHBondContact O-N 3.37Å
166	R	85.5	Confident	82.8	Confident	5 Å²	5	48.7 Å²	48.7	2%	0.019	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	135.2	-175.5	-172.5	163.2	-71	-76.7	-0.1	111.8	N141 G143 S158 V159 F160 I187	N141-R166 PolarHBondContact O-NH2 3.43Å; G143-R166 VanDerWaalsContact O-CZ 3.31Å; G143-R166 PolarHBondContact O-NH1 3.26Å; G143-R166 PolarHBondContact O-NH2 3.3Å; S158-R166 WeakPolarHBondContact OG-CD 3.47Å; S158-R166 WeakPolarHBondContact OG-CG 3.41Å; S158-R166 PolarHBondContact OG-NH1 3.26Å; V159-R166 WeakPolarHBondContact O-CA 3.31Å; F160-R166 HydrophobicContact CD2-CB 4.31Å; R166-I187 VanDerWaalsContact CB-O 3.3Å; R166-I187 WeakPolarHBondContact CB-O 3.43Å; R166-I187 HydrophobicContact CG-CG2 4.45Å
167	S	85.8	Confident	82.7	Confident	35 Å²	35	52.4 Å²	52.4	25%	0.245	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	140.4	170.7	59.5	0	0	0	0	110.3	V159 H169	V159-S167 PolarHBondContact N-O 2.91Å; V159-S167 PolarHBondContact O-N 3.45Å; S167-H169 PolarHBondContact OG-NE2 3.47Å
168	V	88.2	Confident	82.7	Confident	5 Å²	5	54.3 Å²	54.3	3%	0.03	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	124.8	179.2	-176.6	0	0	0	0	108.4	A156 V157 S180 L181 I191	A156-V168 HydrophobicContact CB-CG1 4.16Å; V157-V168 WeakPolarHBondContact O-CA 3.43Å; V168-S180 CarbonylContact O-C 3.5Å; V168-S180 VanDerWaalsContact O-CA 3.31Å; V168-S180 WeakPolarHBondContact O-CA 3.43Å; V168-L181 HydrophobicContact CB-CB 4.18Å; V168-L181 HydrophobicContact CB-CD1 3.58Å; V168-L181 HydrophobicContact CB-CG 3.72Å; V168-L181 HydrophobicContact CG1-CD1 3.7Å; V168-L181 HydrophobicContact CG1-CG 3.94Å; V168-L181 HydrophobicContact CG2-CD1 4.03Å; V168-L181 PolarHBondContact O-N 3.07Å; V168-I191 HydrophobicContact CG2-CD1 3.6Å
169	H	88.9	Confident	82.8	Confident	40 Å²	40	58.1 Å²	58.1	19%	0.185	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	130.9	-176.9	-57.4	-71.4	0	0	0	109.8	A156 V157 S167 H177 S180	A156-H169 WeakPolarHBondContact CA-O 3.15Å; V157-H169 PolarHBondContact N-O 3.33Å; V157-H169 PolarHBondContact O-N 2.92Å; S167-H169 PolarHBondContact OG-NE2 3.47Å; H169-H177 AromaticContact ND1-NE2 3.88Å; H169-S180 WeakPolarHBondContact ND1-CB 3.42Å; H169-S180 PolarHBondContact ND1-OG 3.16Å
170	I	89.3	Confident	83.1	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	129.3	177.3	-53	177.3	0	0	0	108.5	C154 I155 L178 R179 L181 W193 I200	C154-I170 HydrophobicContact CB-CG2 4.16Å; I155-I170 CarbonylContact O-C 3.57Å; I155-I170 VanDerWaalsContact O-CA 3.32Å; I155-I170 WeakPolarHBondContact O-CA 3.45Å; I170-L178 HydrophobicContact CG2-CD1 4.35Å; I170-L178 WeakPolarHBondContact O-CB 3.23Å; I170-L178 PolarHBondContact O-N 3.37Å; I170-R179 HydrophobicContact CB-CG 4.04Å; I170-R179 HydrophobicContact CD1-CG 4.04Å; I170-R179 HydrophobicContact CG1-CG 4.38Å; I170-R179 PolarHBondContact N-O 3.45Å; I170-R179 PolarHBondContact O-N 3.12Å; I170-L181 HydrophobicContact CD1-CD2 4.18Å; I170-W193 HydrophobicContact CD1-CH2 4.4Å; I170-W193 HydrophobicContact CG2-CH2 3.9Å; I170-W193 HydrophobicContact CG2-CZ3 4.4Å; I170-I200 HydrophobicContact CD1-CD1 3.5Å; I170-I200 VanDerWaalsContact CD1-CD1 3.5Å; I170-I200 HydrophobicContact CG1-CD1 3.9Å
171	W	89	Confident	83.7	Confident	35 Å²	35	56.5 Å²	56.5	13%	0.133	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	156.3	177.5	-51.2	73.1	0	0	0	108.9	L22 C154 I155 L175 V176 H177	L22-W171 HydrophobicContact CD1-CZ2 4.33Å; C154-W171 CarbonylContact C-O 3.46Å; C154-W171 VanDerWaalsContact CA-O 3.28Å; C154-W171 WeakPolarHBondContact CA-O 3.46Å; I155-W171 HydrophobicContact CG2-CB 3.67Å; I155-W171 HydrophobicContact CG2-CG 4.43Å; I155-W171 PolarHBondContact N-O 3.36Å; I155-W171 PolarHBondContact O-N 3.04Å; W171-L175 VanDerWaalsContact CE3-O 3.23Å; W171-L175 WeakPolarHBondContact CZ3-O 3.32Å; W171-V176 CarbonylContact C-O 3.55Å; W171-V176 VanDerWaalsContact CA-O 3.3Å; W171-V176 WeakPolarHBondContact CA-O 3.47Å; W171-H177 HydrophobicContact CD2-CB 4.12Å; W171-H177 AromaticContact CE2-CD2 3.93Å; W171-H177 HydrophobicContact CE3-CB 3.68Å; W171-H177 HydrophobicContact CH2-CB 3.83Å; W171-H177 HydrophobicContact CZ2-CB 4.25Å; W171-H177 AromaticContact CZ2-CD2 3.92Å; W171-H177 HydrophobicContact CZ3-CB 3.54Å
172	N	87.8	Confident	84.4	Confident	39 Å²	39	58.9 Å²	58.9	21%	0.209	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	172.1	166.7	68.7	10.6	0	0	0	111.2	E153 K174 L175 V176 L178	E153-N172 CarbonylContact O-C 3.56Å; E153-N172 VanDerWaalsContact O-CA 3.31Å; E153-N172 WeakPolarHBondContact O-CA 3.43Å; N172-K174 PolarHBondContact O-N 2.93Å; N172-K174 WeakPolarHBondContact OD1-CA 3.47Å; N172-K174 WeakPolarHBondContact OD1-CB 3.48Å; N172-K174 PolarHBondContact OD1-N 3.11Å; N172-L175 PolarHBondContact O-N 2.74Å; N172-L175 PolarHBondContact OD1-N 2.88Å; N172-V176 PolarHBondContact N-O 3.4Å; N172-V176 WeakPolarHBondContact OD1-CB 3.42Å; N172-V176 PolarHBondContact OD1-N 3.2Å; N172-L178 HydrophobicContact CB-CD1 4.1Å; N172-L178 HydrophobicContact CB-CD2 4.25Å; N172-L178 HydrophobicContact CB-CG 4.3Å
173	S	82.9	Confident	85	Confident	41 Å²	41	60.5 Å²	60.5	29%	0.287	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-7.5	175.4	60.7	0	0	0	0	114.9	F2 E153	F2-S173 WeakPolarHBondContact CD2-O 3.38Å; F2-S173 WeakPolarHBondContact CE2-O 3.43Å; E153-S173 PolarHBondContact O-N 3.41Å
174	K	80.6	Confident	85.3	Confident	160 Å²	160	56.3 Å²	56.3	70%	0.696	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	10.9	174.3	-58.7	-177.5	-178.5	177.8	0	113.5	N172 V176	N172-K174 PolarHBondContact O-N 2.93Å; N172-K174 WeakPolarHBondContact OD1-CA 3.47Å; N172-K174 WeakPolarHBondContact OD1-CB 3.48Å; N172-K174 PolarHBondContact OD1-N 3.11Å; K174-V176 HydrophobicContact CB-CG2 4.42Å; K174-V176 PolarHBondContact O-N 3.05Å
175	L	76.9	Confident	85.4	Confident	23 Å²	23	51.3 Å²	51.3	12%	0.12	26%	0.263	C	S	.	.			trans	56.5	33	-173.6	-58.2	171.5	0	0	0	113.8	F2 A18 F20 W171 N172	F2-L175 HydrophobicContact CD2-CB 4.43Å; F2-L175 HydrophobicContact CD2-CD1 3.71Å; F2-L175 HydrophobicContact CD2-CD2 3.54Å; F2-L175 HydrophobicContact CD2-CG 3.23Å; F2-L175 HydrophobicContact CE1-CD2 4.35Å; F2-L175 HydrophobicContact CE2-CB 4.28Å; F2-L175 HydrophobicContact CE2-CD1 4.17Å; F2-L175 HydrophobicContact CE2-CD2 3.1Å; F2-L175 HydrophobicContact CE2-CG 3.23Å; F2-L175 HydrophobicContact CG-CD1 4.25Å; F2-L175 HydrophobicContact CG-CD2 4.28Å; F2-L175 HydrophobicContact CG-CG 4.16Å; F2-L175 HydrophobicContact CZ-CD2 3.57Å; F2-L175 HydrophobicContact CZ-CG 4.19Å; A18-L175 HydrophobicContact CB-CD1 4.5Å; A18-L175 VanDerWaalsContact O-CD1 3.23Å; A18-L175 WeakPolarHBondContact O-CD1 3.39Å; F20-L175 HydrophobicContact CD2-CB 4.35Å; W171-L175 VanDerWaalsContact CE3-O 3.23Å; W171-L175 WeakPolarHBondContact CZ3-O 3.32Å; N172-L175 PolarHBondContact O-N 2.74Å; N172-L175 PolarHBondContact OD1-N 2.88Å
176	V	83.1	Confident	85.6	Confident	78 Å²	78	53.2 Å²	53.2	47%	0.473	27%	0.274	S	S	.	.			trans	-87.8	121.5	164.8	-175	0	0	0	0	107.6	W171 N172 K174 L178	W171-V176 CarbonylContact C-O 3.55Å; W171-V176 VanDerWaalsContact CA-O 3.3Å; W171-V176 WeakPolarHBondContact CA-O 3.47Å; N172-V176 PolarHBondContact N-O 3.4Å; N172-V176 WeakPolarHBondContact OD1-CB 3.42Å; N172-V176 PolarHBondContact OD1-N 3.2Å; K174-V176 HydrophobicContact CB-CG2 4.42Å; K174-V176 PolarHBondContact O-N 3.05Å; V176-L178 PolarHBondContact O-N 3.02Å
177	H	86.6	Confident	85.6	Confident	81 Å²	81	53.5 Å²	53.5	38%	0.375	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	126.4	174.5	179.5	-98	0	0	0	108.9	H169 W171 R179 S180	H169-H177 AromaticContact ND1-NE2 3.88Å; W171-H177 HydrophobicContact CD2-CB 4.12Å; W171-H177 AromaticContact CE2-CD2 3.93Å; W171-H177 HydrophobicContact CE3-CB 3.68Å; W171-H177 HydrophobicContact CH2-CB 3.83Å; W171-H177 HydrophobicContact CZ2-CB 4.25Å; W171-H177 AromaticContact CZ2-CD2 3.92Å; W171-H177 HydrophobicContact CZ3-CB 3.54Å; H177-R179 PolarHBondContact CE1-N 3.48Å; H177-R179 VanDerWaalsContact NE2-C 3.34Å; H177-R179 PolarHBondContact NE2-O 2.97Å; H177-S180 PolarHBondContact NE2-OG 2.88Å
178	L	87.6	Confident	85.4	Confident	63 Å²	63	52 Å²	52	33%	0.33	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-48.1	178	-60.9	-178.6	0	0	0	110.8	I170 N172 V176	I170-L178 HydrophobicContact CG2-CD1 4.35Å; I170-L178 WeakPolarHBondContact O-CB 3.23Å; I170-L178 PolarHBondContact O-N 3.37Å; N172-L178 HydrophobicContact CB-CD1 4.1Å; N172-L178 HydrophobicContact CB-CD2 4.25Å; N172-L178 HydrophobicContact CB-CG 4.3Å; V176-L178 PolarHBondContact O-N 3.02Å
179	R	89.3	Confident	85.2	Confident	82 Å²	82	53.1 Å²	53.1	31%	0.309	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.7	172.3	-171.9	51.2	-144.1	158	-129.3	2.5	111.9	I170 H177 E218	I170-R179 HydrophobicContact CB-CG 4.04Å; I170-R179 HydrophobicContact CD1-CG 4.04Å; I170-R179 HydrophobicContact CG1-CG 4.38Å; I170-R179 PolarHBondContact N-O 3.45Å; I170-R179 PolarHBondContact O-N 3.12Å; H177-R179 PolarHBondContact CE1-N 3.48Å; H177-R179 VanDerWaalsContact NE2-C 3.34Å; H177-R179 PolarHBondContact NE2-O 2.97Å; R179-E218 WeakPolarHBondContact CD-O 3.44Å; R179-E218 PolarHBondContact NE-O 3.42Å
180	S	89.6	Confident	85.1	Confident	50 Å²	50	52 Å²	52	35%	0.35	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	147.7	174.7	-46.4	0	0	0	0	109	V168 H169 H177	V168-S180 CarbonylContact O-C 3.5Å; V168-S180 VanDerWaalsContact O-CA 3.31Å; V168-S180 WeakPolarHBondContact O-CA 3.43Å; H169-S180 WeakPolarHBondContact ND1-CB 3.42Å; H169-S180 PolarHBondContact ND1-OG 3.16Å; H177-S180 PolarHBondContact NE2-OG 2.88Å
181	L	90.9	Very high	85.1	Confident	14 Å²	14	52.7 Å²	52.7	7%	0.073	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-65.4	148.3	172.5	-58.6	-169.8	0	0	0	110.2	V168 I170 Y183 I200 F216 G220	V168-L181 HydrophobicContact CB-CB 4.18Å; V168-L181 HydrophobicContact CB-CD1 3.58Å; V168-L181 HydrophobicContact CB-CG 3.72Å; V168-L181 HydrophobicContact CG1-CD1 3.7Å; V168-L181 HydrophobicContact CG1-CG 3.94Å; V168-L181 HydrophobicContact CG2-CD1 4.03Å; V168-L181 PolarHBondContact O-N 3.07Å; I170-L181 HydrophobicContact CD1-CD2 4.18Å; L181-Y183 PolarHBondContact O-N 3.17Å; L181-I200 HydrophobicContact CD1-CG2 4.06Å; L181-I200 HydrophobicContact CD2-CD1 4.2Å; L181-F216 HydrophobicContact CB-CD1 4.03Å; L181-F216 HydrophobicContact CB-CE1 4.06Å; L181-F216 HydrophobicContact CB-CG 4.48Å; L181-F216 HydrophobicContact CD1-CB 4.27Å; L181-F216 HydrophobicContact CD1-CD1 4.25Å; L181-F216 HydrophobicContact CD1-CD2 3.83Å; L181-F216 HydrophobicContact CD1-CE2 4.21Å; L181-F216 HydrophobicContact CD1-CG 3.86Å; L181-F216 HydrophobicContact CD2-CB 3.8Å; L181-F216 HydrophobicContact CD2-CD1 4.07Å; L181-F216 HydrophobicContact CD2-CG 3.98Å; L181-F216 HydrophobicContact CG-CD1 4.34Å; L181-F216 HydrophobicContact CG-CG 4.33Å; L181-G220 CarbonylContact C-O 3.57Å; L181-G220 WeakPolarHBondContact CA-O 3.33Å
182	E	88.3	Confident	85	Confident	91 Å²	91	51.5 Å²	51.5	43%	0.425	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-54.1	129.1	172	-176.6	-175	168.6	0	0	109.2	S184 F216 G220 K222	E182-S184 PolarHBondContact O-N 3.43Å; E182-F216 HydrophobicContact CB-CE1 4.14Å; E182-G220 PolarHBondContact N-O 3.09Å; E182-K222 PolarHBondContact OE2-N 2.85Å
183	Y	85.4	Confident	85.1	Confident	126 Å²	126	50.7 Å²	50.7	49%	0.494	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-70.8	124.3	-172.5	174.7	-106.4	0	0	0	111.1	R164 L181 P185	R164-Y183 WeakPolarHBondContact O-CE2 3.42Å; R164-Y183 PolarHBondContact O-OH 3.31Å; L181-Y183 PolarHBondContact O-N 3.17Å; Y183-P185 HydrophobicContact CE1-CB 4.37Å
184	S	81.7	Confident	85.4	Confident	9 Å²	9	50.7 Å²	50.7	6%	0.063	26%	0.256	C	S	.	.			trans	-126.5	125.5	166.1	-137.7	0	0	0	0	108	E182 S186 I187 E204 K222	E182-S184 PolarHBondContact O-N 3.43Å; S184-S186 PolarHBondContact O-N 2.72Å; S184-I187 VanDerWaalsContact CB-CD1 3.42Å; S184-I187 PolarHBondContact O-N 3Å; S184-E204 WeakPolarHBondContact CB-OE1 3.35Å; S184-E204 PolarHBondContact OG-OE1 3.12Å; S184-K222 PolarHBondContact OG-NZ 2.87Å
185	P	76.6	Confident	85.6	Confident	87 Å²	87	44.9 Å²	44.9	57%	0.565	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-27	-175.3	24.8	-33.5	0	0	0	112.9	Y183	Y183-P185 HydrophobicContact CE1-CB 4.37Å
186	S	83.7	Confident	85.8	Confident	53 Å²	53	46.5 Å²	46.5	37%	0.371	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	4.5	-173	-63.1	0	0	0	0	114.2	S184 G188 E204 F205	S184-S186 PolarHBondContact O-N 2.72Å; S186-G188 PolarHBondContact O-N 2.64Å; S186-E204 VanDerWaalsContact CB-CG 3.48Å; S186-E204 WeakPolarHBondContact O-CA 3.5Å; S186-F205 WeakPolarHBondContact CB-O 3.22Å; S186-F205 PolarHBondContact O-N 3.14Å
187	I	84.9	Confident	85.5	Confident	12 Å²	12	45.5 Å²	45.5	6%	0.062	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	121.3	174.4	-73.1	162.2	0	0	0	109.8	R166 S184 C202 C203 F216	R166-I187 VanDerWaalsContact CB-O 3.3Å; R166-I187 WeakPolarHBondContact CB-O 3.43Å; R166-I187 HydrophobicContact CG-CG2 4.45Å; S184-I187 VanDerWaalsContact CB-CD1 3.42Å; S184-I187 PolarHBondContact O-N 3Å; I187-C202 HydrophobicContact CG2-CB 4.08Å; I187-C203 WeakPolarHBondContact CA-O 3.3Å; I187-F216 HydrophobicContact CD1-CE2 4.17Å; I187-F216 HydrophobicContact CD1-CZ 3.75Å
188	G	82.8	Confident	85	Confident	3 Å²	3	42.1 Å²	42.1	3%	0.031	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	-163.8	174.2	0	0	0	0	0	112.9	S186 C203	S186-G188 PolarHBondContact O-N 2.64Å; G188-C203 PolarHBondContact N-O 2.66Å
189	L	83	Confident	85	Confident	29 Å²	29	41.4 Å²	41.4	15%	0.152	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	154.6	164.4	-65.9	177.9	0	0	0	108.4	V145 I191 F205	V145-L189 HydrophobicContact CB-CD2 3.96Å; V145-L189 HydrophobicContact CG2-CD1 3.69Å; V145-L189 HydrophobicContact CG2-CD2 3.52Å; V145-L189 HydrophobicContact CG2-CG 4.19Å; L189-I191 HydrophobicContact CD2-CD1 3.91Å; L189-I191 HydrophobicContact CD2-CG1 4.24Å; L189-F205 VanDerWaalsContact O-CE2 3.26Å; L189-F205 WeakPolarHBondContact O-CE2 3.43Å; L189-F205 WeakPolarHBondContact O-CZ 3.32Å
190	P	87.5	Confident	85	Confident	15 Å²	15	37.6 Å²	37.6	10%	0.097	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	cis	-80.5	169.9	4.3	33.9	-40.7	0	0	0	114.2	V237 M240	P190-V237 WeakPolarHBondContact CD-O 3.15Å; P190-V237 HydrophobicContact CG-CG1 4.03Å; P190-M240 HydrophobicContact CB-CE 4.44Å; P190-M240 HydrophobicContact CG-CB 4.15Å; P190-M240 HydrophobicContact CG-CE 3.89Å; P190-M240 HydrophobicContact CG-CG 3.64Å; P190-M240 HydrophobicContact CG-SD 4.48Å; P190-M240 WeakPolarHBondContact O-CE 3.37Å
191	I	88.1	Confident	85.1	Confident	15 Å²	15	35.2 Å²	35.2	8%	0.077	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	139.4	172.3	-65.9	161.8	0	0	0	107.4	S158 V168 L189 I200 V201 C202	S158-I191 WeakPolarHBondContact OG-CD1 3.31Å; V168-I191 HydrophobicContact CG2-CD1 3.6Å; L189-I191 HydrophobicContact CD2-CD1 3.91Å; L189-I191 HydrophobicContact CD2-CG1 4.24Å; I191-I200 HydrophobicContact CG2-CG2 3.79Å; I191-V201 WeakPolarHBondContact CA-O 3.38Å; I191-C202 HydrophobicContact CG1-CB 4.43Å
192	C	88.8	Confident	85.1	Confident	10 Å²	10	34.5 Å²	34.5	7%	0.068	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	155.2	175.3	68.2	0	0	0	0	112.1	V201 M240 W242	C192-V201 PolarHBondContact N-O 2.84Å; C192-V201 PolarHBondContact O-N 2.58Å; C192-M240 HydrophobicContact CB-CB 4.36Å; C192-M240 WeakPolarHBondContact CB-O 3.08Å; C192-W242 VanDerWaalsContact SG-CD1 3.51Å
193	W	88.6	Confident	85.3	Confident	22 Å²	22	30.2 Å²	30.2	8%	0.083	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	133.6	176.3	-155.1	-58.3	0	0	0	109.4	C147 D149 C154 A156 I170 P195 I200	C147-W193 VanDerWaalsContact SG-CB 3.51Å; C147-W193 PolarHBondContact SG-N 3.48Å; C147-W193 VanDerWaalsContact SG-N 3.36Å; D149-W193 HydrophobicContact CB-CD2 3.94Å; D149-W193 HydrophobicContact CB-CE3 4.38Å; D149-W193 HydrophobicContact CB-CG 4.42Å; D149-W193 HydrophobicContact CB-CH2 4.21Å; D149-W193 HydrophobicContact CB-CZ2 3.74Å; D149-W193 HydrophobicContact CB-CZ3 4.49Å; C154-W193 HydrophobicContact CB-CH2 3.7Å; C154-W193 HydrophobicContact CB-CZ2 4.32Å; C154-W193 HydrophobicContact CB-CZ3 4.38Å; A156-W193 HydrophobicContact CB-CE3 3.73Å; A156-W193 HydrophobicContact CB-CZ3 3.56Å; I170-W193 HydrophobicContact CD1-CH2 4.4Å; I170-W193 HydrophobicContact CG2-CH2 3.9Å; I170-W193 HydrophobicContact CG2-CZ3 4.4Å; W193-P195 WeakPolarHBondContact O-CD 3.29Å; W193-I200 HydrophobicContact CD2-CD1 4.31Å; W193-I200 HydrophobicContact CD2-CG1 3.76Å; W193-I200 HydrophobicContact CE3-CD1 3.98Å; W193-I200 HydrophobicContact CE3-CG1 3.87Å; W193-I200 HydrophobicContact CG-CG1 4.25Å; W193-I200 HydrophobicContact CH2-CD1 3.97Å; W193-I200 HydrophobicContact CH2-CG1 4.39Å; W193-I200 HydrophobicContact CZ2-CD1 4.3Å; W193-I200 HydrophobicContact CZ2-CG1 4.29Å; W193-I200 HydrophobicContact CZ3-CD1 3.82Å; W193-I200 HydrophobicContact CZ3-CG1 4.2Å
194	R	89.3	Confident	85.4	Confident	42 Å²	42	26.1 Å²	26.1	16%	0.158	16%	0.164	C	C	.	.			trans	-74.9	119.3	174.5	-171.6	-178.6	-172	-158.5	-1.5	109.6	S196 R199 W242 S246	R194-S196 WeakPolarHBondContact CD-O 3.48Å; R194-S196 WeakPolarHBondContact CG-O 3.39Å; R194-S196 PolarHBondContact O-N 2.94Å; R194-S196 VanDerWaalsContact O-N 3.1Å; R194-R199 HydrophobicContact CB-CB 4.16Å; R194-R199 VanDerWaalsContact CB-O 3.27Å; R194-R199 WeakPolarHBondContact CB-O 3.33Å; R194-R199 PolarHBondContact N-O 3.01Å; R194-W242 HydrophobicContact CB-CD2 4.4Å; R194-W242 HydrophobicContact CB-CG 4.48Å; R194-W242 HydrophobicContact CB-CZ2 4.39Å; R194-W242 HydrophobicContact CG-CD2 3.97Å; R194-W242 HydrophobicContact CG-CE3 4.31Å; R194-W242 HydrophobicContact CG-CG 4.37Å; R194-W242 HydrophobicContact CG-CH2 4.32Å; R194-W242 HydrophobicContact CG-CZ2 4.06Å; R194-W242 HydrophobicContact CG-CZ3 4.48Å; R194-S246 PolarHBondContact NE-O 3.21Å; R194-S246 PolarHBondContact NH2-O 3.33Å
195	P	84.1	Confident	85.5	Confident	37 Å²	37	28 Å²	28	24%	0.24	17%	0.171	C	C	.	.	S	Bend	trans	-55.8	-34.3	-173.2	-29.1	35.4	0	0	0	114.4	S150 W193 W242 S246	S150-P195 WeakPolarHBondContact CB-O 3.3Å; S150-P195 PolarHBondContact OG-O 3.12Å; W193-P195 WeakPolarHBondContact O-CD 3.29Å; P195-W242 VanDerWaalsContact CD-CB 3.45Å; P195-W242 HydrophobicContact CG-CB 4.16Å; P195-S246 WeakPolarHBondContact CD-OG 3.49Å
196	S	80.9	Confident	85.6	Confident	57 Å²	57	26.1 Å²	26.1	40%	0.399	16%	0.16	S	C	.	.	S	Bend	trans	-111.7	138.1	174.3	65.2	0	0	0	0	112.2	R194 S246	R194-S196 WeakPolarHBondContact CD-O 3.48Å; R194-S196 WeakPolarHBondContact CG-O 3.39Å; R194-S196 PolarHBondContact O-N 2.94Å; R194-S196 VanDerWaalsContact O-N 3.1Å; S196-S246 PolarHBondContact N-OG 3.11Å; S196-S246 WeakPolarHBondContact OG-CB 3.5Å; S196-S246 PolarHBondContact OG-OG 3.13Å
197	G	76.8	Confident	85.1	Confident	58 Å²	58	32.9 Å²	32.9	60%	0.598	19%	0.185	S	C	*	.	S	Bend	trans	83.7	9.2	175.1	0	0	0	0	0	116.1	R199	G197-R199 VanDerWaalsContact C-N 3.28Å; G197-R199 WeakPolarHBondContact O-CG 3.2Å; G197-R199 PolarHBondContact O-N 3.35Å
198	G	76.9	Confident	84.9	Confident	9 Å²	9	40.5 Å²	40.5	9%	0.093	22%	0.22	C	C	.	.	S	Bend	trans	67.6	19.5	165.7	0	0	0	0	0	116	E218	G198-E218 WeakPolarHBondContact CA-OE1 3.48Å; G198-E218 WeakPolarHBondContact O-CG 3.07Å
199	R	87.5	Confident	84.9	Confident	49 Å²	49	45.2 Å²	45.2	19%	0.185	25%	0.245	C	C	.	.			trans	-90.1	138.9	-175.8	-59.7	-176.3	-177	-176	-8.1	111.2	R194 G197 I215 F216 H223	R194-R199 HydrophobicContact CB-CB 4.16Å; R194-R199 VanDerWaalsContact CB-O 3.27Å; R194-R199 WeakPolarHBondContact CB-O 3.33Å; R194-R199 PolarHBondContact N-O 3.01Å; G197-R199 VanDerWaalsContact C-N 3.28Å; G197-R199 WeakPolarHBondContact O-CG 3.2Å; G197-R199 PolarHBondContact O-N 3.35Å; R199-I215 HydrophobicContact CB-CG2 3.79Å; R199-I215 HydrophobicContact CG-CG2 4.32Å; R199-F216 VanDerWaalsContact CA-O 3.32Å; R199-F216 WeakPolarHBondContact CA-O 3.47Å; R199-H223 PolarHBondContact NH2-NE2 3.44Å
200	I	89.9	Confident	85.2	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	134.6	175.9	-64	166.2	0	0	0	108.8	A156 I170 L181 I191 W193 I215 F216	A156-I200 HydrophobicContact CB-CD1 4.05Å; I170-I200 HydrophobicContact CD1-CD1 3.5Å; I170-I200 VanDerWaalsContact CD1-CD1 3.5Å; I170-I200 HydrophobicContact CG1-CD1 3.9Å; L181-I200 HydrophobicContact CD1-CG2 4.06Å; L181-I200 HydrophobicContact CD2-CD1 4.2Å; I191-I200 HydrophobicContact CG2-CG2 3.79Å; W193-I200 HydrophobicContact CD2-CD1 4.31Å; W193-I200 HydrophobicContact CD2-CG1 3.76Å; W193-I200 HydrophobicContact CE3-CD1 3.98Å; W193-I200 HydrophobicContact CE3-CG1 3.87Å; W193-I200 HydrophobicContact CG-CG1 4.25Å; W193-I200 HydrophobicContact CH2-CD1 3.97Å; W193-I200 HydrophobicContact CH2-CG1 4.39Å; W193-I200 HydrophobicContact CZ2-CD1 4.3Å; W193-I200 HydrophobicContact CZ2-CG1 4.29Å; W193-I200 HydrophobicContact CZ3-CD1 3.82Å; W193-I200 HydrophobicContact CZ3-CG1 4.2Å; I200-I215 CarbonylContact O-C 3.47Å; I200-I215 WeakPolarHBondContact O-CA 3.43Å; I200-F216 HydrophobicContact CB-CB 4.44Å; I200-F216 PolarHBondContact N-O 3.39Å; I200-F216 PolarHBondContact O-N 2.95Å
201	V	91.5	Very high	85.3	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	129	178.8	-174.8	0	0	0	0	109.4	I191 C192 I213 I214 I215 M240 W242 L249	I191-V201 WeakPolarHBondContact CA-O 3.38Å; C192-V201 PolarHBondContact N-O 2.84Å; C192-V201 PolarHBondContact O-N 2.58Å; V201-I213 HydrophobicContact CG1-CG2 3.3Å; V201-I214 CarbonylContact C-O 3.55Å; V201-I214 WeakPolarHBondContact CA-O 3.39Å; V201-I215 HydrophobicContact CG2-CG1 4.22Å; V201-M240 HydrophobicContact CG1-CE 4.26Å; V201-M240 HydrophobicContact CG1-SD 4.02Å; V201-W242 HydrophobicContact CG2-CZ2 3.89Å; V201-W242 VanDerWaalsContact CG2-NE1 3.26Å; V201-L249 HydrophobicContact CG1-CD2 4.5Å
202	C	91.8	Very high	85.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	157.3	177.6	-57.5	0	0	0	0	109.8	I187 I191 I214 F216	I187-C202 HydrophobicContact CG2-CB 4.08Å; I191-C202 HydrophobicContact CG1-CB 4.43Å; C202-I214 PolarHBondContact N-O 3.33Å; C202-I214 PolarHBondContact O-N 3.05Å; C202-F216 HydrophobicContact CB-CD2 4.45Å; C202-F216 HydrophobicContact CB-CE2 3.97Å
203	C	90.9	Very high	85.7	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	129.2	172.2	-171.5	0	0	0	0	110	I187 G188 F205 I213 M240	I187-C203 WeakPolarHBondContact CA-O 3.3Å; G188-C203 PolarHBondContact N-O 2.66Å; C203-F205 HydrophobicContact CB-CE2 3.9Å; C203-F205 HydrophobicContact CB-CZ 4.08Å; C203-I213 HydrophobicContact CB-CD1 4.27Å; C203-M240 HydrophobicContact CB-CE 4.21Å
204	E	88.4	Confident	85.9	Confident	41 Å²	41	42.3 Å²	42.3	19%	0.192	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	121.4	168.7	-177	160.6	-118.9	0	0	109.5	S184 S186 T212 I214	S184-E204 WeakPolarHBondContact CB-OE1 3.35Å; S184-E204 PolarHBondContact OG-OE1 3.12Å; S186-E204 VanDerWaalsContact CB-CG 3.48Å; S186-E204 WeakPolarHBondContact O-CA 3.5Å; E204-T212 PolarHBondContact N-O 3.3Å; E204-T212 PolarHBondContact O-N 3.16Å; E204-I214 HydrophobicContact CB-CD1 3.62Å; E204-I214 HydrophobicContact CB-CG1 4.16Å; E204-I214 HydrophobicContact CG-CD1 4.33Å; E204-I214 WeakPolarHBondContact OE2-CD1 3.24Å
205	F	83.8	Confident	86	Confident	47 Å²	47	40.5 Å²	40.5	21%	0.206	23%	0.225	C	C	.	.			trans	-95.5	132.1	-178.2	-65.7	-87.7	0	0	0	110.3	S186 L189 C203 V237	S186-F205 WeakPolarHBondContact CB-O 3.22Å; S186-F205 PolarHBondContact O-N 3.14Å; L189-F205 VanDerWaalsContact O-CE2 3.26Å; L189-F205 WeakPolarHBondContact O-CE2 3.43Å; L189-F205 WeakPolarHBondContact O-CZ 3.32Å; C203-F205 HydrophobicContact CB-CE2 3.9Å; C203-F205 HydrophobicContact CB-CZ 4.08Å; F205-V237 HydrophobicContact CE1-CB 4.17Å; F205-V237 HydrophobicContact CE1-CG2 4.32Å; F205-V237 HydrophobicContact CZ-CB 4.12Å
206	S	79.1	Confident	86.4	Confident	49 Å²	49	38.8 Å²	38.8	34%	0.343	21%	0.214	S	C	.	.			trans	-121.5	146	170	-177.2	0	0	0	0	108.8	E208 D209	S206-E208 PolarHBondContact OG-N 3.04Å; S206-D209 PolarHBondContact OG-N 3.47Å; S206-D209 VanDerWaalsContact OG-N 3.16Å
207	H	73	Confident	86.7	Confident	194 Å²	194	39.3 Å²	39.3	90%	0.898	21%	0.21	S	C	*	.	S	Bend	trans	-81.6	-24.9	172.2	-75.8	-67.9	0	0	0	112.3
208	E	79.4	Confident	86.9	Confident	172 Å²	172	41.4 Å²	41.4	80%	0.804	20%	0.204	S	C	*	.	S	Bend	trans	-100.2	-28.4	-177	-62.8	-173	173	0	0	112.4	S206	S206-E208 PolarHBondContact OG-N 3.04Å
209	D	84	Confident	87.2	Confident	102 Å²	102	48.3 Å²	48.3	55%	0.545	23%	0.232	S	C	.	.	S	Bend	trans	-111.7	164.4	-177.4	-58.7	-58.6	0	0	0	112.1	S206	S206-D209 PolarHBondContact OG-N 3.47Å; S206-D209 VanDerWaalsContact OG-N 3.16Å
210	S	88.5	Confident	87.1	Confident	11 Å²	11	46 Å²	46	8%	0.077	22%	0.224	C	C	.	.			trans	-64	151.2	170.1	55.2	0	0	0	0	111.3	T212 L228	S210-T212 PolarHBondContact O-N 2.95Å; S210-L228 WeakPolarHBondContact CB-O 3.47Å; S210-L228 PolarHBondContact OG-O 3.49Å
211	P	90.7	Very high	87.1	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.019	25%	0.247	C	C	.	.			trans	-54.4	138.4	176.5	-22.2	31.2	0	0	0	111.1	L228 F232 V237	P211-L228 HydrophobicContact CB-CD1 3.97Å; P211-L228 HydrophobicContact CG-CD1 4.27Å; P211-L228 WeakPolarHBondContact O-CG 3.42Å; P211-L228 PolarHBondContact O-N 3.25Å; P211-F232 WeakPolarHBondContact CD-O 3.5Å; P211-V237 HydrophobicContact CB-CG2 3.81Å; P211-V237 HydrophobicContact CG-CG2 4.08Å
212	T	92.2	Very high	87	Confident	17 Å²	17	53.7 Å²	53.7	10%	0.104	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	125.4	-179	-66	0	0	0	0	110.2	E204 S210 I214 Q225 S227	E204-T212 PolarHBondContact N-O 3.3Å; E204-T212 PolarHBondContact O-N 3.16Å; S210-T212 PolarHBondContact O-N 2.95Å; T212-I214 HydrophobicContact CG2-CG1 4.36Å; T212-Q225 HydrophobicContact CG2-CB 4.06Å; T212-Q225 HydrophobicContact CG2-CG 4.45Å; T212-S227 PolarHBondContact OG1-OG 3.31Å
213	I	93.3	Very high	86.7	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	120	177.6	-55.4	-54.2	0	0	0	108.3	V201 C203 Q225 F226 L228 M240 L249 L251	V201-I213 HydrophobicContact CG1-CG2 3.3Å; C203-I213 HydrophobicContact CB-CD1 4.27Å; I213-Q225 CarbonylContact O-C 3.56Å; I213-Q225 WeakPolarHBondContact O-CA 3.38Å; I213-F226 HydrophobicContact CB-CD1 3.98Å; I213-F226 HydrophobicContact CB-CE1 3.52Å; I213-F226 HydrophobicContact CB-CE2 4.12Å; I213-F226 HydrophobicContact CB-CG 4.47Å; I213-F226 HydrophobicContact CB-CZ 3.6Å; I213-F226 HydrophobicContact CG1-CE1 4.18Å; I213-F226 HydrophobicContact CG1-CE2 3.96Å; I213-F226 HydrophobicContact CG1-CZ 3.71Å; I213-F226 HydrophobicContact CG2-CD1 4.32Å; I213-F226 HydrophobicContact CG2-CE1 3.55Å; I213-F226 HydrophobicContact CG2-CZ 3.83Å; I213-F226 PolarHBondContact N-O 3.42Å; I213-F226 PolarHBondContact O-N 2.9Å; I213-L228 HydrophobicContact CG1-CD2 4.15Å; I213-M240 HydrophobicContact CD1-SD 3.85Å; I213-L249 HydrophobicContact CG2-CD2 4.48Å; I213-L251 HydrophobicContact CD1-CD1 4.32Å; I213-L251 HydrophobicContact CD1-CD2 4.46Å; I213-L251 HydrophobicContact CG1-CD1 4.22Å
214	I	92.3	Very high	86.6	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	134.9	-179.5	-53.9	178.7	0	0	0	109.3	V201 C202 E204 T212 F216 K222 Q225	V201-I214 CarbonylContact C-O 3.55Å; V201-I214 WeakPolarHBondContact CA-O 3.39Å; C202-I214 PolarHBondContact N-O 3.33Å; C202-I214 PolarHBondContact O-N 3.05Å; E204-I214 HydrophobicContact CB-CD1 3.62Å; E204-I214 HydrophobicContact CB-CG1 4.16Å; E204-I214 HydrophobicContact CG-CD1 4.33Å; E204-I214 WeakPolarHBondContact OE2-CD1 3.24Å; T212-I214 HydrophobicContact CG2-CG1 4.36Å; I214-F216 HydrophobicContact CB-CE2 3.91Å; I214-F216 HydrophobicContact CG2-CD2 3.94Å; I214-F216 HydrophobicContact CG2-CE1 4.46Å; I214-F216 HydrophobicContact CG2-CE2 3.39Å; I214-F216 HydrophobicContact CG2-CZ 3.69Å; I214-K222 HydrophobicContact CG2-CB 4.45Å; I214-K222 HydrophobicContact CG2-CD 4.09Å; I214-K222 HydrophobicContact CG2-CG 3.89Å; I214-Q225 HydrophobicContact CG1-CB 4.26Å
215	I	91.4	Very high	86.7	Confident	4 Å²	4	61.9 Å²	61.9	2%	0.021	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	122.1	179.3	-51.8	177.5	0	0	0	108.1	R199 I200 V201 H223 H224 W273	R199-I215 HydrophobicContact CB-CG2 3.79Å; R199-I215 HydrophobicContact CG-CG2 4.32Å; I200-I215 CarbonylContact O-C 3.47Å; I200-I215 WeakPolarHBondContact O-CA 3.43Å; V201-I215 HydrophobicContact CG2-CG1 4.22Å; I215-H223 WeakPolarHBondContact O-CA 3.39Å; I215-H223 WeakPolarHBondContact O-CB 3.39Å; I215-H223 PolarHBondContact O-N 3.39Å; I215-H224 HydrophobicContact CB-CB 4.46Å; I215-H224 PolarHBondContact N-O 3Å; I215-H224 PolarHBondContact O-N 2.91Å; I215-W273 HydrophobicContact CD1-CH2 4.12Å; I215-W273 HydrophobicContact CD1-CZ2 3.24Å
216	F	91.2	Very high	87.1	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	142.1	178.4	-67.4	-95.7	0	0	0	110.8	L181 E182 I187 R199 I200 C202 I214 L221 K222	L181-F216 HydrophobicContact CB-CD1 4.03Å; L181-F216 HydrophobicContact CB-CE1 4.06Å; L181-F216 HydrophobicContact CB-CG 4.48Å; L181-F216 HydrophobicContact CD1-CB 4.27Å; L181-F216 HydrophobicContact CD1-CD1 4.25Å; L181-F216 HydrophobicContact CD1-CD2 3.83Å; L181-F216 HydrophobicContact CD1-CE2 4.21Å; L181-F216 HydrophobicContact CD1-CG 3.86Å; L181-F216 HydrophobicContact CD2-CB 3.8Å; L181-F216 HydrophobicContact CD2-CD1 4.07Å; L181-F216 HydrophobicContact CD2-CG 3.98Å; L181-F216 HydrophobicContact CG-CD1 4.34Å; L181-F216 HydrophobicContact CG-CG 4.33Å; E182-F216 HydrophobicContact CB-CE1 4.14Å; I187-F216 HydrophobicContact CD1-CE2 4.17Å; I187-F216 HydrophobicContact CD1-CZ 3.75Å; R199-F216 VanDerWaalsContact CA-O 3.32Å; R199-F216 WeakPolarHBondContact CA-O 3.47Å; I200-F216 HydrophobicContact CB-CB 4.44Å; I200-F216 PolarHBondContact N-O 3.39Å; I200-F216 PolarHBondContact O-N 2.95Å; C202-F216 HydrophobicContact CB-CD2 4.45Å; C202-F216 HydrophobicContact CB-CE2 3.97Å; I214-F216 HydrophobicContact CB-CE2 3.91Å; I214-F216 HydrophobicContact CG2-CD2 3.94Å; I214-F216 HydrophobicContact CG2-CE1 4.46Å; I214-F216 HydrophobicContact CG2-CE2 3.39Å; I214-F216 HydrophobicContact CG2-CZ 3.69Å; F216-L221 WeakPolarHBondContact CA-O 3.4Å; F216-K222 HydrophobicContact CD1-CG 4.06Å; F216-K222 HydrophobicContact CE1-CB 4.41Å; F216-K222 HydrophobicContact CE1-CG 3.42Å; F216-K222 VanDerWaalsContact CE1-CG 3.42Å; F216-K222 HydrophobicContact CZ-CG 3.8Å
217	E	88.3	Confident	87.7	Confident	69 Å²	69	61.5 Å²	61.5	32%	0.322	30%	0.299	S	S	.	.			trans	-71.3	161.6	167	-95.9	172.3	-145.7	0	0	111.4	K219 G220 L221 H223	E217-K219 PolarHBondContact O-N 3.22Å; E217-G220 WeakPolarHBondContact O-CA 3.39Å; E217-G220 PolarHBondContact O-N 3.18Å; E217-L221 PolarHBondContact N-O 3.47Å; E217-H223 HydrophobicContact CB-CB 4.47Å; E217-H223 HydrophobicContact CG-CB 3.87Å; E217-H223 IonicContact OE1-CE1 2.83Å; E217-H223 IonicContact OE1-CG 2.95Å; E217-H223 IonicContact OE1-ND1 2.93Å; E217-H223 PolarHBondContact OE1-ND1 3.22Å
218	E	79.9	Confident	88.7	Confident	102 Å²	102	52.4 Å²	52.4	48%	0.477	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-33.3	174.4	-69.6	178.8	-176.4	0	0	112.7	R179 G198 G220	R179-E218 WeakPolarHBondContact CD-O 3.44Å; R179-E218 PolarHBondContact NE-O 3.42Å; G198-E218 WeakPolarHBondContact CA-OE1 3.48Å; G198-E218 WeakPolarHBondContact O-CG 3.07Å; E218-G220 PolarHBondContact O-N 3.47Å
219	K	84.1	Confident	89.3	Confident	153 Å²	153	44.8 Å²	44.8	67%	0.665	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-11.7	178.2	-66.9	-179.4	-176.6	171.4	0	113.8	E217	E217-K219 PolarHBondContact O-N 3.22Å
220	G	84.8	Confident	89.6	Confident	2 Å²	2	48.6 Å²	48.6	2%	0.021	24%	0.235	C	C	.	.	S	Bend	trans	90.1	9.5	-178.4	0	0	0	0	0	115	L181 E182 E217 E218	L181-G220 CarbonylContact C-O 3.57Å; L181-G220 WeakPolarHBondContact CA-O 3.33Å; E182-G220 PolarHBondContact N-O 3.09Å; E217-G220 WeakPolarHBondContact O-CA 3.39Å; E217-G220 PolarHBondContact O-N 3.18Å; E218-G220 PolarHBondContact O-N 3.47Å
221	L	90.1	Very high	89.7	Confident	96 Å²	96	52.8 Å²	52.8	50%	0.503	25%	0.252	S	S	.	.	S	Bend	trans	-93.5	148.1	177.9	-61.4	175	0	0	0	110.9	F216 E217 H223	F216-L221 WeakPolarHBondContact CA-O 3.4Å; E217-L221 PolarHBondContact N-O 3.47Å; L221-H223 PolarHBondContact O-N 2.84Å
222	K	89.4	Confident	89.7	Confident	66 Å²	66	52.7 Å²	52.7	29%	0.287	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	124.5	171.6	-68.8	-173.4	-178.5	-173.5	0	109.4	E182 S184 I214 F216	E182-K222 PolarHBondContact OE2-N 2.85Å; S184-K222 PolarHBondContact OG-NZ 2.87Å; I214-K222 HydrophobicContact CG2-CB 4.45Å; I214-K222 HydrophobicContact CG2-CD 4.09Å; I214-K222 HydrophobicContact CG2-CG 3.89Å; F216-K222 HydrophobicContact CD1-CG 4.06Å; F216-K222 HydrophobicContact CE1-CB 4.41Å; F216-K222 HydrophobicContact CE1-CG 3.42Å; F216-K222 VanDerWaalsContact CE1-CG 3.42Å; F216-K222 HydrophobicContact CZ-CG 3.8Å
223	H	86.6	Confident	89.5	Confident	57 Å²	57	54.6 Å²	54.6	26%	0.264	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	-46.7	-178.7	180	72.2	0	0	0	112.3	R199 I215 E217 L221 Y271	R199-H223 PolarHBondContact NH2-NE2 3.44Å; I215-H223 WeakPolarHBondContact O-CA 3.39Å; I215-H223 WeakPolarHBondContact O-CB 3.39Å; I215-H223 PolarHBondContact O-N 3.39Å; E217-H223 HydrophobicContact CB-CB 4.47Å; E217-H223 HydrophobicContact CG-CB 3.87Å; E217-H223 IonicContact OE1-CE1 2.83Å; E217-H223 IonicContact OE1-CG 2.95Å; E217-H223 IonicContact OE1-ND1 2.93Å; E217-H223 PolarHBondContact OE1-ND1 3.22Å; L221-H223 PolarHBondContact O-N 2.84Å; H223-Y271 AromaticContact NE2-CE1 3.77Å
224	H	88.3	Confident	89.2	Confident	50 Å²	50	57.6 Å²	57.6	23%	0.231	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	154.4	-177.6	-165.4	-67.9	0	0	0	109.3	I215 Y271 W273	I215-H224 HydrophobicContact CB-CB 4.46Å; I215-H224 PolarHBondContact N-O 3Å; I215-H224 PolarHBondContact O-N 2.91Å; H224-Y271 AromaticContact CD2-CD1 3.84Å; H224-Y271 PolarHBondContact NE2-O 2.87Å; H224-W273 AromaticContact CE1-CD1 3.75Å; H224-W273 AromaticContact CE1-NE1 3.82Å; H224-W273 AromaticContact ND1-NE1 3.75Å
225	Q	91	Very high	89.1	Confident	105 Å²	105	58.5 Å²	58.5	49%	0.491	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	150.4	172.2	68	-175.9	32.3	0	0	110.9	T212 I213 I214	T212-Q225 HydrophobicContact CG2-CB 4.06Å; T212-Q225 HydrophobicContact CG2-CG 4.45Å; I213-Q225 CarbonylContact O-C 3.56Å; I213-Q225 WeakPolarHBondContact O-CA 3.38Å; I214-Q225 HydrophobicContact CG1-CB 4.26Å
226	F	92	Very high	88.9	Confident	22 Å²	22	61.7 Å²	61.7	10%	0.096	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	141.3	170.3	69.1	-84	0	0	0	110.2	I213 L228 L249 Y266 W273	I213-F226 HydrophobicContact CB-CD1 3.98Å; I213-F226 HydrophobicContact CB-CE1 3.52Å; I213-F226 HydrophobicContact CB-CE2 4.12Å; I213-F226 HydrophobicContact CB-CG 4.47Å; I213-F226 HydrophobicContact CB-CZ 3.6Å; I213-F226 HydrophobicContact CG1-CE1 4.18Å; I213-F226 HydrophobicContact CG1-CE2 3.96Å; I213-F226 HydrophobicContact CG1-CZ 3.71Å; I213-F226 HydrophobicContact CG2-CD1 4.32Å; I213-F226 HydrophobicContact CG2-CE1 3.55Å; I213-F226 HydrophobicContact CG2-CZ 3.83Å; I213-F226 PolarHBondContact N-O 3.42Å; I213-F226 PolarHBondContact O-N 2.9Å; F226-L228 HydrophobicContact CE2-CD2 4Å; F226-L249 HydrophobicContact CZ-CD2 4.31Å; F226-Y266 HydrophobicContact CD2-CE1 4.31Å; F226-Y266 AromaticContact CE2-CD1 3.94Å; F226-Y266 HydrophobicContact CE2-CD1 3.94Å; F226-Y266 HydrophobicContact CE2-CD2 4.43Å; F226-Y266 AromaticContact CE2-CE1 3.76Å; F226-Y266 HydrophobicContact CE2-CE1 3.76Å; F226-Y266 HydrophobicContact CE2-CE2 4.27Å; F226-Y266 HydrophobicContact CE2-CG 4.26Å; F226-Y266 AromaticContact CE2-CZ 3.94Å; F226-Y266 HydrophobicContact CZ-CD1 4.38Å; F226-Y266 HydrophobicContact CZ-CG 4.39Å; F226-W273 HydrophobicContact CB-CB 4.4Å; F226-W273 HydrophobicContact CB-CG 4.28Å; F226-W273 HydrophobicContact CD1-CB 4.25Å; F226-W273 AromaticContact CD1-CD1 3.43Å; F226-W273 VanDerWaalsContact CD1-CD1 3.43Å; F226-W273 AromaticContact CD1-CD2 3.64Å; F226-W273 HydrophobicContact CD1-CD2 3.64Å; F226-W273 AromaticContact CD1-CE2 3.65Å; F226-W273 HydrophobicContact CD1-CE3 4.41Å; F226-W273 AromaticContact CD1-CG 3.52Å; F226-W273 HydrophobicContact CD1-CG 3.52Å; F226-W273 HydrophobicContact CD1-CZ2 4.42Å; F226-W273 AromaticContact CD1-NE1 3.5Å; F226-W273 HydrophobicContact CD2-CB 4.11Å; F226-W273 HydrophobicContact CD2-CG 4.25Å; F226-W273 AromaticContact CE1-CD2 3.41Å; F226-W273 HydrophobicContact CE1-CD2 3.41Å; F226-W273 VanDerWaalsContact CE1-CD2 3.41Å; F226-W273 AromaticContact CE1-CE2 3.51Å; F226-W273 AromaticContact CE1-CE3 3.75Å; F226-W273 HydrophobicContact CE1-CE3 3.75Å; F226-W273 AromaticContact CE1-CG 3.8Å; F226-W273 HydrophobicContact CE1-CG 3.8Å; F226-W273 HydrophobicContact CE1-CH2 4.09Å; F226-W273 AromaticContact CE1-CZ2 3.93Å; F226-W273 HydrophobicContact CE1-CZ2 3.93Å; F226-W273 HydrophobicContact CE1-CZ3 4.05Å; F226-W273 AromaticContact CE1-NE1 3.88Å; F226-W273 HydrophobicContact CE2-CB 4.44Å; F226-W273 HydrophobicContact CE2-CG 4.49Å; F226-W273 HydrophobicContact CG-CB 4Å; F226-W273 AromaticContact CG-CD1 3.8Å; F226-W273 HydrophobicContact CG-CD2 4.29Å; F226-W273 AromaticContact CG-CG 3.76Å; F226-W273 HydrophobicContact CG-CG 3.76Å; F226-W273 AromaticContact CZ-CD2 3.9Å; F226-W273 HydrophobicContact CZ-CD2 3.9Å; F226-W273 AromaticContact CZ-CE3 3.85Å; F226-W273 HydrophobicContact CZ-CE3 3.85Å; F226-W273 HydrophobicContact CZ-CG 4.27Å; F226-W273 HydrophobicContact CZ-CZ3 4.19Å
227	S	92.2	Very high	88.9	Confident	66 Å²	66	61.8 Å²	61.8	46%	0.462	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	141.5	177.8	-55.8	0	0	0	0	109.8	T212	T212-S227 PolarHBondContact OG1-OG 3.31Å
228	L	93.6	Very high	88.9	Confident	4 Å²	4	59.7 Å²	59.7	2%	0.021	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-68.3	159.5	174.5	-60.8	-176.7	0	0	0	110.8	S210 P211 I213 F226 K230 F232 V237 L251 L253 Y266	S210-L228 WeakPolarHBondContact CB-O 3.47Å; S210-L228 PolarHBondContact OG-O 3.49Å; P211-L228 HydrophobicContact CB-CD1 3.97Å; P211-L228 HydrophobicContact CG-CD1 4.27Å; P211-L228 WeakPolarHBondContact O-CG 3.42Å; P211-L228 PolarHBondContact O-N 3.25Å; I213-L228 HydrophobicContact CG1-CD2 4.15Å; F226-L228 HydrophobicContact CE2-CD2 4Å; L228-K230 PolarHBondContact O-N 3.07Å; L228-F232 HydrophobicContact CB-CB 4.46Å; L228-F232 HydrophobicContact CB-CD2 4.37Å; L228-V237 HydrophobicContact CD1-CG2 4.22Å; L228-L251 HydrophobicContact CD1-CD1 4.42Å; L228-L251 HydrophobicContact CD2-CD1 3.64Å; L228-L253 HydrophobicContact CD1-CD1 4.46Å; L228-L253 HydrophobicContact CD1-CD2 3.61Å; L228-Y266 HydrophobicContact CD2-CE2 3.78Å; L228-Y266 WeakPolarHBondContact CD2-OH 3.44Å
229	P	92.3	Very high	89.3	Confident	11 Å²	11	58.5 Å²	58.5	7%	0.071	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-50.4	142.7	175.2	-28.7	31.7	0	0	0	112.1	F231 F232 Y266 L275 E330 F357	P229-F231 PolarHBondContact O-N 2.75Å; P229-F232 HydrophobicContact CB-CD2 3.88Å; P229-F232 HydrophobicContact CB-CE2 4.06Å; P229-F232 HydrophobicContact CG-CD2 3.99Å; P229-F232 HydrophobicContact CG-CE2 3.9Å; P229-F232 PolarHBondContact O-N 3.48Å; P229-Y266 VanDerWaalsContact CD-OH 3.24Å; P229-Y266 WeakPolarHBondContact CD-OH 3.49Å; P229-L275 HydrophobicContact CG-CD2 4.07Å; P229-E330 HydrophobicContact CG-CG 4.05Å; P229-F357 HydrophobicContact CB-CE1 3.87Å; P229-F357 HydrophobicContact CB-CZ 3.89Å; P229-F357 HydrophobicContact CG-CE1 3.77Å; P229-F357 HydrophobicContact CG-CZ 4.13Å
230	K	90	Very high	89.7	Confident	183 Å²	183	51.9 Å²	51.9	80%	0.796	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-55	-25.5	-179.3	-70.7	-172.5	177.1	-175.5	0	113.5	L228 F232 T233	L228-K230 PolarHBondContact O-N 3.07Å; K230-F232 PolarHBondContact O-N 3.21Å; K230-T233 WeakPolarHBondContact O-CB 3.44Å; K230-T233 PolarHBondContact O-N 2.93Å; K230-T233 PolarHBondContact O-OG1 3.05Å
231	F	89.5	Confident	89.9	Confident	99 Å²	99	52.7 Å²	52.7	43%	0.434	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-51.8	-35.1	171.9	178.6	-93.6	0	0	0	112.9	P229 T233 F235 Y262 F357	P229-F231 PolarHBondContact O-N 2.75Å; F231-T233 VanDerWaalsContact C-N 3.28Å; F231-T233 PolarHBondContact O-N 3.19Å; F231-F235 HydrophobicContact CE1-CZ 4.11Å; F231-F235 WeakPolarHBondContact O-CE2 3.33Å; F231-Y262 HydrophobicContact CE1-CE1 4.02Å; F231-Y262 HydrophobicContact CE1-CE2 4.49Å; F231-Y262 AromaticContact CE1-CZ 3.88Å; F231-Y262 HydrophobicContact CZ-CE1 4.47Å; F231-F357 HydrophobicContact CB-CE2 4.32Å; F231-F357 HydrophobicContact CB-CZ 3.96Å; F231-F357 AromaticContact CD1-CE2 3.75Å; F231-F357 HydrophobicContact CD1-CE2 3.75Å; F231-F357 HydrophobicContact CD1-CZ 4.13Å; F231-F357 HydrophobicContact CE1-CE2 4.26Å; F231-F357 HydrophobicContact CG-CE2 4.01Å; F231-F357 HydrophobicContact CG-CZ 4.17Å
232	F	91	Very high	89.9	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-88	14	-179	-58.2	-67.8	0	0	0	113.9	P211 L228 P229 K230 G234 F235 L253 Y262 L264 T278 F357	P211-F232 WeakPolarHBondContact CD-O 3.5Å; L228-F232 HydrophobicContact CB-CB 4.46Å; L228-F232 HydrophobicContact CB-CD2 4.37Å; P229-F232 HydrophobicContact CB-CD2 3.88Å; P229-F232 HydrophobicContact CB-CE2 4.06Å; P229-F232 HydrophobicContact CG-CD2 3.99Å; P229-F232 HydrophobicContact CG-CE2 3.9Å; P229-F232 PolarHBondContact O-N 3.48Å; K230-F232 PolarHBondContact O-N 3.21Å; F232-G234 PolarHBondContact O-N 3.36Å; F232-F235 HydrophobicContact CB-CB 4.33Å; F232-F235 HydrophobicContact CB-CD2 4.42Å; F232-F235 HydrophobicContact CB-CG 4.31Å; F232-F235 AromaticContact CD1-CD1 3.92Å; F232-F235 HydrophobicContact CD1-CD1 3.92Å; F232-F235 HydrophobicContact CD1-CE1 4.04Å; F232-F235 HydrophobicContact CD1-CG 4.2Å; F232-F235 HydrophobicContact CD1-CZ 4.45Å; F232-F235 WeakPolarHBondContact O-CB 3.2Å; F232-F235 PolarHBondContact O-N 3.35Å; F232-F235 VanDerWaalsContact O-N 3.09Å; F232-L253 HydrophobicContact CB-CD2 4.03Å; F232-L253 HydrophobicContact CD1-CD2 4.13Å; F232-L253 HydrophobicContact CG-CD2 4.15Å; F232-Y262 AromaticContact CE1-CD1 3.94Å; F232-Y262 HydrophobicContact CE1-CD1 3.94Å; F232-Y262 HydrophobicContact CE1-CD2 4.43Å; F232-Y262 HydrophobicContact CE1-CE1 4.48Å; F232-Y262 AromaticContact CE1-CG 3.9Å; F232-Y262 HydrophobicContact CE1-CG 3.9Å; F232-Y262 HydrophobicContact CZ-CD1 4.44Å; F232-L264 HydrophobicContact CD2-CD1 4.22Å; F232-L264 HydrophobicContact CE1-CD2 4.3Å; F232-L264 HydrophobicContact CE2-CD1 3.75Å; F232-L264 HydrophobicContact CE2-CD2 4.16Å; F232-L264 HydrophobicContact CZ-CD1 3.93Å; F232-L264 HydrophobicContact CZ-CD2 3.63Å; F232-L264 HydrophobicContact CZ-CG 4.37Å; F232-T278 HydrophobicContact CZ-CG2 4.46Å; F232-F357 HydrophobicContact CD2-CZ 4.43Å; F232-F357 HydrophobicContact CE2-CE1 4.27Å; F232-F357 AromaticContact CE2-CE2 3.96Å; F232-F357 HydrophobicContact CE2-CE2 3.96Å; F232-F357 AromaticContact CE2-CZ 3.54Å; F232-F357 HydrophobicContact CE2-CZ 3.54Å; F232-F357 AromaticContact CZ-CE2 3.72Å; F232-F357 HydrophobicContact CZ-CE2 3.72Å; F232-F357 AromaticContact CZ-CZ 3.82Å; F232-F357 HydrophobicContact CZ-CZ 3.82Å
233	T	89.2	Confident	90	Very high	58 Å²	58	45.9 Å²	45.9	36%	0.356	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	128.9	174.6	-54.5	0	0	0	0	109.8	K230 F231 F235	K230-T233 WeakPolarHBondContact O-CB 3.44Å; K230-T233 PolarHBondContact O-N 2.93Å; K230-T233 PolarHBondContact O-OG1 3.05Å; F231-T233 VanDerWaalsContact C-N 3.28Å; F231-T233 PolarHBondContact O-N 3.19Å; T233-F235 VanDerWaalsContact C-N 3.3Å; T233-F235 PolarHBondContact O-N 3.21Å
234	G	86.7	Confident	89.9	Confident	63 Å²	63	45.5 Å²	45.5	65%	0.649	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.2	0.9	-175.5	0	0	0	0	0	115.5	F232	F232-G234 PolarHBondContact O-N 3.36Å
235	F	89.9	Confident	89.7	Confident	18 Å²	18	48.1 Å²	48.1	8%	0.079	26%	0.259	C	S	.	.			trans	-80.4	146.1	173.3	-75.2	-126.2	0	0	0	110.8	F231 F232 T233 L253 S255 Y262	F231-F235 HydrophobicContact CE1-CZ 4.11Å; F231-F235 WeakPolarHBondContact O-CE2 3.33Å; F232-F235 HydrophobicContact CB-CB 4.33Å; F232-F235 HydrophobicContact CB-CD2 4.42Å; F232-F235 HydrophobicContact CB-CG 4.31Å; F232-F235 AromaticContact CD1-CD1 3.92Å; F232-F235 HydrophobicContact CD1-CD1 3.92Å; F232-F235 HydrophobicContact CD1-CE1 4.04Å; F232-F235 HydrophobicContact CD1-CG 4.2Å; F232-F235 HydrophobicContact CD1-CZ 4.45Å; F232-F235 WeakPolarHBondContact O-CB 3.2Å; F232-F235 PolarHBondContact O-N 3.35Å; F232-F235 VanDerWaalsContact O-N 3.09Å; T233-F235 VanDerWaalsContact C-N 3.3Å; T233-F235 PolarHBondContact O-N 3.21Å; F235-L253 HydrophobicContact CB-CB 4.39Å; F235-L253 HydrophobicContact CB-CD2 3.97Å; F235-L253 HydrophobicContact CD1-CB 4.23Å; F235-S255 VanDerWaalsContact CE1-CB 3.48Å; F235-Y262 HydrophobicContact CD1-CD2 4.29Å; F235-Y262 AromaticContact CE1-CD2 3.6Å; F235-Y262 HydrophobicContact CE1-CD2 3.6Å; F235-Y262 AromaticContact CE1-CE2 3.56Å; F235-Y262 HydrophobicContact CE1-CE2 3.56Å; F235-Y262 HydrophobicContact CZ-CE2 4.17Å
236	E	87.5	Confident	89.6	Confident	72 Å²	72	43.2 Å²	43.2	34%	0.336	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	128.2	173.3	-174.4	178.3	177	0	0	109.5	C238 L253 R254	E236-C238 PolarHBondContact O-N 2.92Å; E236-L253 CarbonylContact O-C 3.56Å; E236-L253 WeakPolarHBondContact O-CA 3.34Å; E236-R254 PolarHBondContact N-O 3.42Å; E236-R254 PolarHBondContact O-N 2.82Å
237	V	89.7	Confident	89.4	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.006	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	112.4	169.7	-177.4	0	0	0	0	107.2	P190 F205 P211 L228 M240 H252 L253	P190-V237 WeakPolarHBondContact CD-O 3.15Å; P190-V237 HydrophobicContact CG-CG1 4.03Å; F205-V237 HydrophobicContact CE1-CB 4.17Å; F205-V237 HydrophobicContact CE1-CG2 4.32Å; F205-V237 HydrophobicContact CZ-CB 4.12Å; P211-V237 HydrophobicContact CB-CG2 3.81Å; P211-V237 HydrophobicContact CG-CG2 4.08Å; L228-V237 HydrophobicContact CD1-CG2 4.22Å; V237-M240 HydrophobicContact CG1-CG 4.04Å; V237-H252 CarbonylContact C-O 3.58Å; V237-L253 HydrophobicContact CG2-CD2 3.95Å; V237-L253 HydrophobicContact CG2-CG 4.16Å
238	C	88.6	Confident	89.4	Confident	26 Å²	26	40.7 Å²	40.7	18%	0.176	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	-43	-173.8	-60.2	0	0	0	0	112.5	E236 H252	E236-C238 PolarHBondContact O-N 2.92Å; C238-H252 WeakPolarHBondContact CB-ND1 3.39Å; C238-H252 PolarHBondContact N-O 2.97Å
239	F	88.8	Confident	89.4	Confident	77 Å²	77	40.5 Å²	40.5	34%	0.338	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	148.8	-179.9	-76.2	-83.6	0	0	0	112.3	L251 H252 T288	F239-L251 WeakPolarHBondContact O-CA 3.49Å; F239-H252 HydrophobicContact CB-CB 4.1Å; F239-H252 AromaticContact CD2-ND1 3.8Å; F239-H252 PolarHBondContact N-O 3.31Å; F239-H252 PolarHBondContact O-N 3.21Å; F239-T288 VanDerWaalsContact CE2-O 3.29Å; F239-T288 WeakPolarHBondContact CE2-O 3.31Å
240	M	92.2	Very high	89.5	Confident	13 Å²	13	40 Å²	40	6%	0.064	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	128.8	171.1	-67.6	-166	-71.4	0	0	109.3	P190 C192 V201 C203 I213 V237 A250 L251	P190-M240 HydrophobicContact CB-CE 4.44Å; P190-M240 HydrophobicContact CG-CB 4.15Å; P190-M240 HydrophobicContact CG-CE 3.89Å; P190-M240 HydrophobicContact CG-CG 3.64Å; P190-M240 HydrophobicContact CG-SD 4.48Å; P190-M240 WeakPolarHBondContact O-CE 3.37Å; C192-M240 HydrophobicContact CB-CB 4.36Å; C192-M240 WeakPolarHBondContact CB-O 3.08Å; V201-M240 HydrophobicContact CG1-CE 4.26Å; V201-M240 HydrophobicContact CG1-SD 4.02Å; C203-M240 HydrophobicContact CB-CE 4.21Å; I213-M240 HydrophobicContact CD1-SD 3.85Å; V237-M240 HydrophobicContact CG1-CG 4.04Å; M240-A250 WeakPolarHBondContact CA-O 3.45Å; M240-L251 HydrophobicContact CB-CD2 4.17Å; M240-L251 HydrophobicContact CG-CD2 3.45Å; M240-L251 VanDerWaalsContact CG-CD2 3.45Å; M240-L251 HydrophobicContact SD-CD2 3.74Å
241	A	89.6	Confident	89.8	Confident	19 Å²	19	31.2 Å²	31.2	16%	0.157	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	131.6	-179.4	0	0	0	0	0	111.4	A250 W292	A241-A250 PolarHBondContact N-O 2.94Å; A241-A250 PolarHBondContact O-N 3.29Å; A241-W292 PolarHBondContact O-NE1 3.27Å
242	W	90.6	Very high	90	Very high	19 Å²	19	26.6 Å²	26.6	7%	0.072	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	143.2	174.5	-79.3	101.2	0	0	0	111.3	C192 R194 P195 V201 S246 L249 W273	C192-W242 VanDerWaalsContact SG-CD1 3.51Å; R194-W242 HydrophobicContact CB-CD2 4.4Å; R194-W242 HydrophobicContact CB-CG 4.48Å; R194-W242 HydrophobicContact CB-CZ2 4.39Å; R194-W242 HydrophobicContact CG-CD2 3.97Å; R194-W242 HydrophobicContact CG-CE3 4.31Å; R194-W242 HydrophobicContact CG-CG 4.37Å; R194-W242 HydrophobicContact CG-CH2 4.32Å; R194-W242 HydrophobicContact CG-CZ2 4.06Å; R194-W242 HydrophobicContact CG-CZ3 4.48Å; P195-W242 VanDerWaalsContact CD-CB 3.45Å; P195-W242 HydrophobicContact CG-CB 4.16Å; V201-W242 HydrophobicContact CG2-CZ2 3.89Å; V201-W242 VanDerWaalsContact CG2-NE1 3.26Å; W242-S246 WeakPolarHBondContact CZ3-O 3.2Å; W242-L249 HydrophobicContact CD2-CB 4.19Å; W242-L249 HydrophobicContact CD2-CD1 4Å; W242-L249 HydrophobicContact CE3-CB 3.99Å; W242-L249 HydrophobicContact CG-CD1 4.16Å; W242-L249 HydrophobicContact CH2-CB 4.15Å; W242-L249 HydrophobicContact CZ2-CB 4.27Å; W242-L249 HydrophobicContact CZ2-CD1 4.42Å; W242-L249 HydrophobicContact CZ2-CD2 4.19Å; W242-L249 HydrophobicContact CZ3-CB 3.97Å; W242-W273 AromaticContact CH2-CH2 3.38Å; W242-W273 HydrophobicContact CH2-CH2 3.38Å; W242-W273 HydrophobicContact CH2-CZ2 4.27Å; W242-W273 HydrophobicContact CH2-CZ3 4.12Å; W242-W273 AromaticContact CZ2-CH2 3.77Å; W242-W273 HydrophobicContact CZ2-CH2 3.77Å; W242-W273 HydrophobicContact CZ3-CH2 4.36Å
243	S	91	Very high	90.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.156	C	C	.	.			trans	-57.9	152.8	163.5	65.7	0	0	0	0	110.7	Q245 S246 D247 V248 P297	S243-Q245 PolarHBondContact O-N 3.17Å; S243-S246 WeakPolarHBondContact O-CA 3.49Å; S243-S246 PolarHBondContact O-N 3.49Å; S243-S246 PolarHBondContact OG-N 3.4Å; S243-D247 PolarHBondContact OG-N 3.42Å; S243-D247 VanDerWaalsContact OG-N 3.11Å; S243-D247 PolarHBondContact OG-OD1 3.46Å; S243-V248 PolarHBondContact N-O 3.45Å; S243-V248 PolarHBondContact OG-N 2.85Å; S243-V248 VanDerWaalsContact OG-N 3.09Å; S243-V248 PolarHBondContact OG-O 3.44Å; S243-P297 VanDerWaalsContact CB-O 3.28Å; S243-P297 WeakPolarHBondContact CB-O 3.39Å
244	S	84.1	Confident	90.2	Very high	50 Å²	50	27.4 Å²	27.4	35%	0.35	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-27	179.8	63.7	0	0	0	0	112.6	P297	S244-P297 WeakPolarHBondContact OG-CA 3.42Å; S244-P297 VanDerWaalsContact OG-CB 3.23Å; S244-P297 WeakPolarHBondContact OG-CB 3.47Å
245	Q	84.8	Confident	90.3	Very high	105 Å²	105	24.8 Å²	24.8	49%	0.491	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-5.4	171.8	-78.3	-178.4	-1.2	0	0	114.6	S243 D247 P297	S243-Q245 PolarHBondContact O-N 3.17Å; Q245-D247 PolarHBondContact O-N 3.12Å; Q245-P297 HydrophobicContact CB-CB 4.15Å; Q245-P297 HydrophobicContact CG-CB 3.55Å; Q245-P297 HydrophobicContact CG-CG 4.11Å
246	S	88	Confident	89.7	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.007	16%	0.156	C	C	.	.	S	Bend	trans	58.8	27.1	-178.5	-41.8	0	0	0	0	115.3	R194 P195 S196 W242 S243	R194-S246 PolarHBondContact NE-O 3.21Å; R194-S246 PolarHBondContact NH2-O 3.33Å; P195-S246 WeakPolarHBondContact CD-OG 3.49Å; S196-S246 PolarHBondContact N-OG 3.11Å; S196-S246 WeakPolarHBondContact OG-CB 3.5Å; S196-S246 PolarHBondContact OG-OG 3.13Å; W242-S246 WeakPolarHBondContact CZ3-O 3.2Å; S243-S246 WeakPolarHBondContact O-CA 3.49Å; S243-S246 PolarHBondContact O-N 3.49Å; S243-S246 PolarHBondContact OG-N 3.4Å
247	D	87.4	Confident	89.2	Confident	31 Å²	31	32.2 Å²	32.2	17%	0.166	17%	0.174	C	C	.	.	S	Bend	trans	-96	-24.3	177.3	62.4	-20.4	0	0	0	113	S243 Q245 R298	S243-D247 PolarHBondContact OG-N 3.42Å; S243-D247 VanDerWaalsContact OG-N 3.11Å; S243-D247 PolarHBondContact OG-OD1 3.46Å; Q245-D247 PolarHBondContact O-N 3.12Å; D247-R298 IonicContact OD2-CZ 3.78Å; D247-R298 VanDerWaalsContact OD2-CZ 3.31Å; D247-R298 IonicContact OD2-NE 2.7Å; D247-R298 PolarHBondContact OD2-NE 2.7Å; D247-R298 IonicContact OD2-NH2 3.93Å; D247-R298 PolarHBondContact OD2-NH2 3.32Å
248	V	92.6	Very high	88.3	Confident	4 Å²	4	36.7 Å²	36.7	2%	0.024	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	130.8	178.9	-169.8	0	0	0	0	110.5	S243 L265 Y266 T267 W292	S243-V248 PolarHBondContact N-O 3.45Å; S243-V248 PolarHBondContact OG-N 2.85Å; S243-V248 VanDerWaalsContact OG-N 3.09Å; S243-V248 PolarHBondContact OG-O 3.44Å; V248-L265 HydrophobicContact CG1-CB 4.16Å; V248-L265 HydrophobicContact CG1-CD2 4.41Å; V248-Y266 CarbonylContact C-O 3.53Å; V248-Y266 WeakPolarHBondContact CA-O 3.31Å; V248-T267 HydrophobicContact CG2-CG2 4.26Å; V248-W292 HydrophobicContact CB-CH2 3.96Å; V248-W292 HydrophobicContact CB-CZ2 3.98Å; V248-W292 HydrophobicContact CG1-CH2 3.81Å; V248-W292 HydrophobicContact CG1-CZ2 3.74Å
249	L	93.9	Very high	88	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	117.3	170.9	174.3	60.6	0	0	0	108.8	V201 I213 F226 W242 L251 Y266 W273	V201-L249 HydrophobicContact CG1-CD2 4.5Å; I213-L249 HydrophobicContact CG2-CD2 4.48Å; F226-L249 HydrophobicContact CZ-CD2 4.31Å; W242-L249 HydrophobicContact CD2-CB 4.19Å; W242-L249 HydrophobicContact CD2-CD1 4Å; W242-L249 HydrophobicContact CE3-CB 3.99Å; W242-L249 HydrophobicContact CG-CD1 4.16Å; W242-L249 HydrophobicContact CH2-CB 4.15Å; W242-L249 HydrophobicContact CZ2-CB 4.27Å; W242-L249 HydrophobicContact CZ2-CD1 4.42Å; W242-L249 HydrophobicContact CZ2-CD2 4.19Å; W242-L249 HydrophobicContact CZ3-CB 3.97Å; L249-L251 HydrophobicContact CD1-CD2 4.12Å; L249-L251 HydrophobicContact CD2-CD2 4.02Å; L249-L251 HydrophobicContact CG-CD2 3.83Å; L249-L251 HydrophobicContact CG-CG 4.45Å; L249-Y266 PolarHBondContact N-O 2.85Å; L249-Y266 PolarHBondContact O-N 3.4Å; L249-W273 HydrophobicContact CB-CH2 4.44Å; L249-W273 HydrophobicContact CB-CZ3 3.99Å; L249-W273 HydrophobicContact CD2-CH2 3.9Å; L249-W273 HydrophobicContact CD2-CZ3 3.81Å
250	A	95	Very high	88	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	131.1	173.4	0	0	0	0	0	110.4	M240 A241 L264 L265 L290 W292 L300	M240-A250 WeakPolarHBondContact CA-O 3.45Å; A241-A250 PolarHBondContact N-O 2.94Å; A241-A250 PolarHBondContact O-N 3.29Å; A250-L264 CarbonylContact C-O 3.57Å; A250-L264 VanDerWaalsContact CA-O 3.29Å; A250-L264 WeakPolarHBondContact CA-O 3.44Å; A250-L265 HydrophobicContact CB-CD2 3.77Å; A250-L290 HydrophobicContact CB-CD1 4.26Å; A250-W292 HydrophobicContact CB-CZ2 3.95Å; A250-L300 HydrophobicContact CB-CD2 4.27Å
251	L	95.3	Very high	88.1	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	134.8	173.6	-48.5	178.1	0	0	0	109.2	I213 L228 F239 M240 L249 L253 V263 L264 Y266	I213-L251 HydrophobicContact CD1-CD1 4.32Å; I213-L251 HydrophobicContact CD1-CD2 4.46Å; I213-L251 HydrophobicContact CG1-CD1 4.22Å; L228-L251 HydrophobicContact CD1-CD1 4.42Å; L228-L251 HydrophobicContact CD2-CD1 3.64Å; F239-L251 WeakPolarHBondContact O-CA 3.49Å; M240-L251 HydrophobicContact CB-CD2 4.17Å; M240-L251 HydrophobicContact CG-CD2 3.45Å; M240-L251 VanDerWaalsContact CG-CD2 3.45Å; M240-L251 HydrophobicContact SD-CD2 3.74Å; L249-L251 HydrophobicContact CD1-CD2 4.12Å; L249-L251 HydrophobicContact CD2-CD2 4.02Å; L249-L251 HydrophobicContact CG-CD2 3.83Å; L249-L251 HydrophobicContact CG-CG 4.45Å; L251-L253 HydrophobicContact CB-CD1 4.03Å; L251-V263 CarbonylContact O-C 3.37Å; L251-V263 VanDerWaalsContact O-CA 3.29Å; L251-V263 WeakPolarHBondContact O-CA 3.36Å; L251-L264 HydrophobicContact CB-CB 4.24Å; L251-L264 PolarHBondContact N-O 3.15Å; L251-L264 PolarHBondContact O-N 2.69Å; L251-Y266 HydrophobicContact CD1-CD2 3.69Å; L251-Y266 HydrophobicContact CD1-CE2 3.63Å; L251-Y266 HydrophobicContact CG-CD2 4.16Å; L251-Y266 HydrophobicContact CG-CE2 4.49Å
252	H	94.6	Very high	88.3	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	125.4	166.7	166.8	-147.3	0	0	0	108.8	V237 C238 F239 R254 D261 Y262 V287 L290	V237-H252 CarbonylContact C-O 3.58Å; C238-H252 WeakPolarHBondContact CB-ND1 3.39Å; C238-H252 PolarHBondContact N-O 2.97Å; F239-H252 HydrophobicContact CB-CB 4.1Å; F239-H252 AromaticContact CD2-ND1 3.8Å; F239-H252 PolarHBondContact N-O 3.31Å; F239-H252 PolarHBondContact O-N 3.21Å; H252-R254 PolarHBondContact CE1-NH2 3.45Å; H252-D261 IonicContact NE2-OD1 2.9Å; H252-D261 PolarHBondContact NE2-OD1 3.49Å; H252-D261 VanDerWaalsContact NE2-OD1 3.15Å; H252-D261 IonicContact NE2-OD2 2.72Å; H252-Y262 CarbonylContact C-O 3.42Å; H252-Y262 VanDerWaalsContact CA-O 3.31Å; H252-Y262 WeakPolarHBondContact CA-O 3.39Å; H252-V287 PolarHBondContact CE1-O 3.41Å; H252-V287 VanDerWaalsContact CE1-O 3.29Å; H252-L290 HydrophobicContact CB-CD1 3.6Å; H252-L290 HydrophobicContact CB-CG 4.16Å
253	L	93.3	Very high	88.5	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	147.4	174.1	-63.8	96	0	0	0	111.3	L228 F232 F235 E236 V237 L251 D261 Y262 L264	L228-L253 HydrophobicContact CD1-CD1 4.46Å; L228-L253 HydrophobicContact CD1-CD2 3.61Å; F232-L253 HydrophobicContact CB-CD2 4.03Å; F232-L253 HydrophobicContact CD1-CD2 4.13Å; F232-L253 HydrophobicContact CG-CD2 4.15Å; F235-L253 HydrophobicContact CB-CB 4.39Å; F235-L253 HydrophobicContact CB-CD2 3.97Å; F235-L253 HydrophobicContact CD1-CB 4.23Å; E236-L253 CarbonylContact O-C 3.56Å; E236-L253 WeakPolarHBondContact O-CA 3.34Å; V237-L253 HydrophobicContact CG2-CD2 3.95Å; V237-L253 HydrophobicContact CG2-CG 4.16Å; L251-L253 HydrophobicContact CB-CD1 4.03Å; L253-D261 CarbonylContact O-C 3.57Å; L253-D261 WeakPolarHBondContact O-CA 3.44Å; L253-Y262 PolarHBondContact N-O 2.96Å; L253-Y262 PolarHBondContact O-N 3.06Å; L253-L264 HydrophobicContact CD1-CD1 3.42Å; L253-L264 VanDerWaalsContact CD1-CD1 3.42Å; L253-L264 HydrophobicContact CD1-CG 3.6Å
254	R	91.4	Very high	88.8	Confident	76 Å²	76	36.5 Å²	36.5	29%	0.287	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	133.1	175.2	-178.6	164	-68.6	155.8	4	110.7	E236 H252 D261 S286 V287	E236-R254 PolarHBondContact N-O 3.42Å; E236-R254 PolarHBondContact O-N 2.82Å; H252-R254 PolarHBondContact CE1-NH2 3.45Å; R254-D261 VanDerWaalsContact CB-OD1 3.28Å; R254-D261 WeakPolarHBondContact CB-OD1 3.18Å; R254-D261 VanDerWaalsContact CG-OD1 3.27Å; R254-D261 WeakPolarHBondContact CG-OD1 3.23Å; R254-D261 IonicContact CZ-OD1 3.67Å; R254-D261 IonicContact CZ-OD2 3.17Å; R254-D261 IonicContact NE-OD1 3.67Å; R254-D261 PolarHBondContact NE-OD1 3Å; R254-D261 IonicContact NE-OD2 2.8Å; R254-D261 IonicContact NH2-OD1 3.9Å; R254-D261 PolarHBondContact NH2-OD1 3.38Å; R254-D261 IonicContact NH2-OD2 2.69Å; R254-D261 PolarHBondContact NH2-OD2 3.03Å; R254-S286 PolarHBondContact NH2-OG 3.14Å; R254-V287 PolarHBondContact NH2-O 2.71Å
255	S	87.7	Confident	89.3	Confident	7 Å²	7	34.4 Å²	34.4	5%	0.049	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	125.1	168.7	-169.3	0	0	0	0	110.1	F235 A257 N258 A260	F235-S255 VanDerWaalsContact CE1-CB 3.48Å; S255-A257 VanDerWaalsContact C-N 3.29Å; S255-A257 PolarHBondContact OG-N 3.37Å; S255-N258 PolarHBondContact OG-N 2.96Å; S255-N258 VanDerWaalsContact OG-N 3.13Å; S255-A260 PolarHBondContact N-O 3.21Å
256	Q	77.4	Confident	89.8	Confident	159 Å²	159	29.5 Å²	29.5	74%	0.743	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-19.7	168.4	-64.4	-174.9	0.6	0	0	112.4
257	A	76.8	Confident	90.1	Very high	88 Å²	88	29.9 Å²	29.9	73%	0.727	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-36.3	-176.4	0	0	0	0	0	112.7	S255	S255-A257 VanDerWaalsContact C-N 3.29Å; S255-A257 PolarHBondContact OG-N 3.37Å
258	N	71.1	Confident	90.1	Very high	95 Å²	95	30.4 Å²	30.4	51%	0.508	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-1.6	-172	-62.5	-8.7	0	0	0	113.7	S255 A260	S255-N258 PolarHBondContact OG-N 2.96Å; S255-N258 VanDerWaalsContact OG-N 3.13Å; N258-A260 HydrophobicContact CB-CB 4.28Å; N258-A260 PolarHBondContact O-N 3.33Å
259	D	82.6	Confident	89.9	Confident	117 Å²	117	31.7 Å²	31.7	63%	0.626	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.5	46.3	-171.8	-76.4	-24.9	0	0	0	112.5	A283	D259-A283 HydrophobicContact CB-CB 4.05Å; D259-A283 WeakPolarHBondContact O-CB 3.5Å; D259-A283 PolarHBondContact O-N 3.39Å
260	A	89.7	Confident	89.6	Confident	4 Å²	4	33.7 Å²	33.7	3%	0.033	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	142.6	-176.6	0	0	0	0	0	111.9	S255 N258 Y262 F281 V282	S255-A260 PolarHBondContact N-O 3.21Å; N258-A260 HydrophobicContact CB-CB 4.28Å; N258-A260 PolarHBondContact O-N 3.33Å; A260-Y262 HydrophobicContact CB-CE2 3.95Å; A260-F281 CarbonylContact C-O 3.49Å; A260-F281 VanDerWaalsContact CA-O 3.28Å; A260-F281 WeakPolarHBondContact CA-O 3.31Å; A260-V282 HydrophobicContact CB-CG1 4.25Å
261	D	92.8	Very high	89.1	Confident	4 Å²	4	40.4 Å²	40.4	2%	0.021	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	137	173.7	-77.1	-29.1	0	0	0	110.4	H252 L253 R254 F281 S286 V287	H252-D261 IonicContact NE2-OD1 2.9Å; H252-D261 PolarHBondContact NE2-OD1 3.49Å; H252-D261 VanDerWaalsContact NE2-OD1 3.15Å; H252-D261 IonicContact NE2-OD2 2.72Å; L253-D261 CarbonylContact O-C 3.57Å; L253-D261 WeakPolarHBondContact O-CA 3.44Å; R254-D261 VanDerWaalsContact CB-OD1 3.28Å; R254-D261 WeakPolarHBondContact CB-OD1 3.18Å; R254-D261 VanDerWaalsContact CG-OD1 3.27Å; R254-D261 WeakPolarHBondContact CG-OD1 3.23Å; R254-D261 IonicContact CZ-OD1 3.67Å; R254-D261 IonicContact CZ-OD2 3.17Å; R254-D261 IonicContact NE-OD1 3.67Å; R254-D261 PolarHBondContact NE-OD1 3Å; R254-D261 IonicContact NE-OD2 2.8Å; R254-D261 IonicContact NH2-OD1 3.9Å; R254-D261 PolarHBondContact NH2-OD1 3.38Å; R254-D261 IonicContact NH2-OD2 2.69Å; R254-D261 PolarHBondContact NH2-OD2 3.03Å; D261-F281 HydrophobicContact CB-CB 4.49Å; D261-F281 PolarHBondContact N-O 2.99Å; D261-F281 PolarHBondContact O-N 3.34Å; D261-S286 VanDerWaalsContact OD2-CA 3.3Å; D261-S286 WeakPolarHBondContact OD2-CA 3.45Å; D261-S286 WeakPolarHBondContact OD2-CB 3.34Å; D261-S286 PolarHBondContact OD2-OG 3.4Å; D261-V287 HydrophobicContact CB-CB 4.23Å; D261-V287 HydrophobicContact CB-CG2 3.94Å; D261-V287 PolarHBondContact OD2-N 3.39Å
262	Y	94.2	Very high	88.9	Confident	24 Å²	24	43.3 Å²	43.3	9%	0.094	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	136.9	178.5	-70.4	-100.2	0	0	0	110.6	F231 F232 F235 H252 L253 A260 T278 L279 C280	F231-Y262 HydrophobicContact CE1-CE1 4.02Å; F231-Y262 HydrophobicContact CE1-CE2 4.49Å; F231-Y262 AromaticContact CE1-CZ 3.88Å; F231-Y262 HydrophobicContact CZ-CE1 4.47Å; F232-Y262 AromaticContact CE1-CD1 3.94Å; F232-Y262 HydrophobicContact CE1-CD1 3.94Å; F232-Y262 HydrophobicContact CE1-CD2 4.43Å; F232-Y262 HydrophobicContact CE1-CE1 4.48Å; F232-Y262 AromaticContact CE1-CG 3.9Å; F232-Y262 HydrophobicContact CE1-CG 3.9Å; F232-Y262 HydrophobicContact CZ-CD1 4.44Å; F235-Y262 HydrophobicContact CD1-CD2 4.29Å; F235-Y262 AromaticContact CE1-CD2 3.6Å; F235-Y262 HydrophobicContact CE1-CD2 3.6Å; F235-Y262 AromaticContact CE1-CE2 3.56Å; F235-Y262 HydrophobicContact CE1-CE2 3.56Å; F235-Y262 HydrophobicContact CZ-CE2 4.17Å; H252-Y262 CarbonylContact C-O 3.42Å; H252-Y262 VanDerWaalsContact CA-O 3.31Å; H252-Y262 WeakPolarHBondContact CA-O 3.39Å; L253-Y262 PolarHBondContact N-O 2.96Å; L253-Y262 PolarHBondContact O-N 3.06Å; A260-Y262 HydrophobicContact CB-CE2 3.95Å; Y262-T278 HydrophobicContact CD1-CG2 4.02Å; Y262-L279 CarbonylContact C-O 3.59Å; Y262-L279 WeakPolarHBondContact CA-O 3.34Å; Y262-C280 HydrophobicContact CD1-CB 4.09Å; Y262-C280 HydrophobicContact CE1-CB 3.78Å; Y262-C280 VanDerWaalsContact CZ-SG 3.54Å
263	V	95.1	Very high	88.8	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	117.9	171.4	-179.9	0	0	0	0	109.1	L251 L265 L279 F281 V287 L290 I302	L251-V263 CarbonylContact O-C 3.37Å; L251-V263 VanDerWaalsContact O-CA 3.29Å; L251-V263 WeakPolarHBondContact O-CA 3.36Å; V263-L265 HydrophobicContact CG1-CD2 4.47Å; V263-L279 HydrophobicContact CB-CB 4.25Å; V263-L279 PolarHBondContact N-O 3.21Å; V263-L279 PolarHBondContact O-N 3.25Å; V263-F281 HydrophobicContact CB-CE2 4.36Å; V263-F281 HydrophobicContact CG2-CD2 4.38Å; V263-F281 HydrophobicContact CG2-CE2 3.88Å; V263-V287 HydrophobicContact CG2-CG2 4.14Å; V263-L290 HydrophobicContact CG1-CD1 4.14Å; V263-L290 HydrophobicContact CG1-CD2 4.08Å; V263-L290 HydrophobicContact CG2-CD2 4.02Å; V263-I302 HydrophobicContact CB-CD1 4.35Å; V263-I302 HydrophobicContact CG1-CD1 4.14Å; V263-I302 HydrophobicContact CG2-CD1 4.21Å
264	L	96.2	Very high	88.8	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	132.4	-176.6	-51	-172.7	0	0	0	110.3	F232 A250 L251 L253 Y266 L275 T278	F232-L264 HydrophobicContact CD2-CD1 4.22Å; F232-L264 HydrophobicContact CE1-CD2 4.3Å; F232-L264 HydrophobicContact CE2-CD1 3.75Å; F232-L264 HydrophobicContact CE2-CD2 4.16Å; F232-L264 HydrophobicContact CZ-CD1 3.93Å; F232-L264 HydrophobicContact CZ-CD2 3.63Å; F232-L264 HydrophobicContact CZ-CG 4.37Å; A250-L264 CarbonylContact C-O 3.57Å; A250-L264 VanDerWaalsContact CA-O 3.29Å; A250-L264 WeakPolarHBondContact CA-O 3.44Å; L251-L264 HydrophobicContact CB-CB 4.24Å; L251-L264 PolarHBondContact N-O 3.15Å; L251-L264 PolarHBondContact O-N 2.69Å; L253-L264 HydrophobicContact CD1-CD1 3.42Å; L253-L264 VanDerWaalsContact CD1-CD1 3.42Å; L253-L264 HydrophobicContact CD1-CG 3.6Å; L264-Y266 HydrophobicContact CB-CD2 4.12Å; L264-Y266 HydrophobicContact CB-CE2 3.86Å; L264-Y266 HydrophobicContact CD1-CE2 3.86Å; L264-L275 HydrophobicContact CB-CD1 3.77Å; L264-L275 HydrophobicContact CD2-CD1 4.33Å; L264-L275 HydrophobicContact CG-CD1 4.44Å; L264-T278 HydrophobicContact CD2-CG2 3.63Å
265	L	95.7	Very high	89	Confident	6 Å²	6	41 Å²	41	3%	0.031	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	106.7	175.1	-56.8	-174.5	0	0	0	110.2	V248 A250 V263 K276 K277 W292 L300 V314	V248-L265 HydrophobicContact CG1-CB 4.16Å; V248-L265 HydrophobicContact CG1-CD2 4.41Å; A250-L265 HydrophobicContact CB-CD2 3.77Å; V263-L265 HydrophobicContact CG1-CD2 4.47Å; L265-K276 PolarHBondContact O-N 3.32Å; L265-K277 HydrophobicContact CB-CB 4.17Å; L265-K277 HydrophobicContact CD1-CB 4.12Å; L265-K277 HydrophobicContact CG-CB 4.31Å; L265-K277 PolarHBondContact N-O 2.99Å; L265-W292 HydrophobicContact CD2-CZ2 4.4Å; L265-L300 HydrophobicContact CD2-CD2 3.87Å; L265-V314 HydrophobicContact CD1-CG2 3.98Å
266	Y	95.3	Very high	89.3	Confident	2 Å²	2	43 Å²	43	1%	0.008	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	145.5	179.2	-84.9	-83.1	0	0	0	112.1	F226 L228 P229 V248 L249 L251 L264 W273 Y274 L275	F226-Y266 HydrophobicContact CD2-CE1 4.31Å; F226-Y266 AromaticContact CE2-CD1 3.94Å; F226-Y266 HydrophobicContact CE2-CD1 3.94Å; F226-Y266 HydrophobicContact CE2-CD2 4.43Å; F226-Y266 AromaticContact CE2-CE1 3.76Å; F226-Y266 HydrophobicContact CE2-CE1 3.76Å; F226-Y266 HydrophobicContact CE2-CE2 4.27Å; F226-Y266 HydrophobicContact CE2-CG 4.26Å; F226-Y266 AromaticContact CE2-CZ 3.94Å; F226-Y266 HydrophobicContact CZ-CD1 4.38Å; F226-Y266 HydrophobicContact CZ-CG 4.39Å; L228-Y266 HydrophobicContact CD2-CE2 3.78Å; L228-Y266 WeakPolarHBondContact CD2-OH 3.44Å; P229-Y266 VanDerWaalsContact CD-OH 3.24Å; P229-Y266 WeakPolarHBondContact CD-OH 3.49Å; V248-Y266 CarbonylContact C-O 3.53Å; V248-Y266 WeakPolarHBondContact CA-O 3.31Å; L249-Y266 PolarHBondContact N-O 2.85Å; L249-Y266 PolarHBondContact O-N 3.4Å; L251-Y266 HydrophobicContact CD1-CD2 3.69Å; L251-Y266 HydrophobicContact CD1-CE2 3.63Å; L251-Y266 HydrophobicContact CG-CD2 4.16Å; L251-Y266 HydrophobicContact CG-CE2 4.49Å; L264-Y266 HydrophobicContact CB-CD2 4.12Å; L264-Y266 HydrophobicContact CB-CE2 3.86Å; L264-Y266 HydrophobicContact CD1-CE2 3.86Å; Y266-W273 HydrophobicContact CD1-CB 4.3Å; Y266-W273 HydrophobicContact CD1-CE3 4.27Å; Y266-W273 HydrophobicContact CG-CE3 4.38Å; Y266-Y274 WeakPolarHBondContact CA-O 3.45Å; Y266-L275 HydrophobicContact CD1-CB 4.2Å; Y266-L275 HydrophobicContact CD2-CD1 4.12Å; Y266-L275 HydrophobicContact CE1-CB 3.67Å; Y266-L275 HydrophobicContact CE1-CD1 4.34Å; Y266-L275 HydrophobicContact CE1-CG 4.47Å; Y266-L275 HydrophobicContact CE2-CD1 3.8Å
267	T	93.3	Very high	90.1	Very high	10 Å²	10	37.6 Å²	37.6	6%	0.061	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	155.7	174.2	63.2	0	0	0	0	109.6	V248 W273 Y274 K276 W316	V248-T267 HydrophobicContact CG2-CG2 4.26Å; T267-W273 CarbonylContact O-C 3.6Å; T267-W273 WeakPolarHBondContact O-CA 3.47Å; T267-Y274 PolarHBondContact N-O 3.43Å; T267-Y274 PolarHBondContact O-N 3.4Å; T267-K276 HydrophobicContact CG2-CG 4Å; T267-K276 WeakPolarHBondContact OG1-CG 3.43Å; T267-W316 HydrophobicContact CG2-CH2 3.48Å; T267-W316 VanDerWaalsContact CG2-CH2 3.48Å; T267-W316 HydrophobicContact CG2-CZ2 4.06Å; T267-W316 HydrophobicContact CG2-CZ3 4.3Å
268	I	89.1	Confident	91	Very high	42 Å²	42	33.5 Å²	33.5	22%	0.215	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	130.2	-177.7	-170	179.2	0	0	0	111.3	H272 W273	I268-H272 WeakPolarHBondContact CA-O 3.4Å; I268-W273 HydrophobicContact CB-CD2 4.2Å; I268-W273 HydrophobicContact CB-CE3 4.26Å; I268-W273 HydrophobicContact CB-CH2 4.45Å; I268-W273 HydrophobicContact CB-CZ2 4.23Å; I268-W273 HydrophobicContact CB-CZ3 4.42Å; I268-W273 HydrophobicContact CD1-CD2 4.47Å; I268-W273 HydrophobicContact CD1-CZ2 3.8Å; I268-W273 HydrophobicContact CG1-CD2 4.35Å; I268-W273 HydrophobicContact CG1-CZ2 4.38Å
269	C	87.9	Confident	92	Very high	30 Å²	30	29.3 Å²	29.3	20%	0.203	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	136.8	172.3	-176.1	0	0	0	0	109.9	Y271 H272 Y274 Q608 G612	C269-Y271 PolarHBondContact O-N 2.76Å; C269-Y271 VanDerWaalsContact O-N 3.13Å; C269-H272 PolarHBondContact N-O 3.11Å; C269-H272 WeakPolarHBondContact O-CB 3.29Å; C269-H272 PolarHBondContact O-N 2.62Å; C269-Y274 HydrophobicContact CB-CD2 4.43Å; C269-Y274 HydrophobicContact CB-CE2 3.93Å; C269-Q608 PolarHBondContact SG-NE2 3.23Å; C269-Q608 VanDerWaalsContact SG-NE2 3.44Å; C269-G612 WeakPolarHBondContact SG-CA 3.42Å
270	N	87.5	Confident	92.5	Very high	43 Å²	43	25.4 Å²	25.4	23%	0.23	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.1	37.9	-174.6	-67.3	-28.6	0	0	0	113.9	H272 P345 R611 G612	N270-H272 PolarHBondContact O-N 2.61Å; N270-H272 VanDerWaalsContact O-N 3.14Å; N270-P345 PolarHBondContact ND2-O 3.38Å; N270-R611 PolarHBondContact OD1-O 3.23Å; N270-G612 VanDerWaalsContact ND2-C 3.35Å; N270-G612 PolarHBondContact ND2-O 3.25Å; N270-G612 VanDerWaalsContact ND2-O 3.1Å; N270-G612 VanDerWaalsContact OD1-CA 3.22Å; N270-G612 WeakPolarHBondContact OD1-CA 3.44Å
271	Y	85.1	Confident	92.5	Very high	140 Å²	140	25.8 Å²	25.8	55%	0.549	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	12.3	-174.7	-67.6	-89.4	0	0	0	115.9	H223 H224 C269	H223-Y271 AromaticContact NE2-CE1 3.77Å; H224-Y271 AromaticContact CD2-CD1 3.84Å; H224-Y271 PolarHBondContact NE2-O 2.87Å; C269-Y271 PolarHBondContact O-N 2.76Å; C269-Y271 VanDerWaalsContact O-N 3.13Å
272	H	90.8	Very high	92.3	Very high	62 Å²	62	28.3 Å²	28.3	29%	0.287	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	137.8	168.5	-170.5	77.2	0	0	0	110.2	I268 C269 N270 Y274 D329 P346	I268-H272 WeakPolarHBondContact CA-O 3.4Å; C269-H272 PolarHBondContact N-O 3.11Å; C269-H272 WeakPolarHBondContact O-CB 3.29Å; C269-H272 PolarHBondContact O-N 2.62Å; N270-H272 PolarHBondContact O-N 2.61Å; N270-H272 VanDerWaalsContact O-N 3.14Å; H272-Y274 HydrophobicContact CB-CE2 4.02Å; H272-Y274 AromaticContact CD2-CD1 3.73Å; H272-Y274 AromaticContact CD2-CD2 3.82Å; H272-Y274 AromaticContact CD2-CE1 3.49Å; H272-Y274 VanDerWaalsContact CD2-CE1 3.49Å; H272-Y274 WeakPolarHBondContact CD2-CE1 3.3Å; H272-Y274 AromaticContact CD2-CE2 3.56Å; H272-Y274 AromaticContact CD2-CG 3.9Å; H272-Y274 AromaticContact CD2-CZ 3.4Å; H272-D329 IonicContact CD2-OD2 2.71Å; H272-D329 IonicContact CE1-OD2 2.8Å; H272-D329 IonicContact NE2-OD2 3.21Å; H272-D329 PolarHBondContact NE2-OD2 3.35Å; H272-P346 HydrophobicContact CB-CB 3.78Å; H272-P346 HydrophobicContact CB-CG 4.09Å
273	W	92.1	Very high	91.8	Very high	14 Å²	14	29.5 Å²	29.5	5%	0.053	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	117.1	179.8	-77.5	91.1	0	0	0	109.3	I215 H224 F226 W242 L249 Y266 T267 I268	I215-W273 HydrophobicContact CD1-CH2 4.12Å; I215-W273 HydrophobicContact CD1-CZ2 3.24Å; H224-W273 AromaticContact CE1-CD1 3.75Å; H224-W273 AromaticContact CE1-NE1 3.82Å; H224-W273 AromaticContact ND1-NE1 3.75Å; F226-W273 HydrophobicContact CB-CB 4.4Å; F226-W273 HydrophobicContact CB-CG 4.28Å; F226-W273 HydrophobicContact CD1-CB 4.25Å; F226-W273 AromaticContact CD1-CD1 3.43Å; F226-W273 VanDerWaalsContact CD1-CD1 3.43Å; F226-W273 AromaticContact CD1-CD2 3.64Å; F226-W273 HydrophobicContact CD1-CD2 3.64Å; F226-W273 AromaticContact CD1-CE2 3.65Å; F226-W273 HydrophobicContact CD1-CE3 4.41Å; F226-W273 AromaticContact CD1-CG 3.52Å; F226-W273 HydrophobicContact CD1-CG 3.52Å; F226-W273 HydrophobicContact CD1-CZ2 4.42Å; F226-W273 AromaticContact CD1-NE1 3.5Å; F226-W273 HydrophobicContact CD2-CB 4.11Å; F226-W273 HydrophobicContact CD2-CG 4.25Å; F226-W273 AromaticContact CE1-CD2 3.41Å; F226-W273 HydrophobicContact CE1-CD2 3.41Å; F226-W273 VanDerWaalsContact CE1-CD2 3.41Å; F226-W273 AromaticContact CE1-CE2 3.51Å; F226-W273 AromaticContact CE1-CE3 3.75Å; F226-W273 HydrophobicContact CE1-CE3 3.75Å; F226-W273 AromaticContact CE1-CG 3.8Å; F226-W273 HydrophobicContact CE1-CG 3.8Å; F226-W273 HydrophobicContact CE1-CH2 4.09Å; F226-W273 AromaticContact CE1-CZ2 3.93Å; F226-W273 HydrophobicContact CE1-CZ2 3.93Å; F226-W273 HydrophobicContact CE1-CZ3 4.05Å; F226-W273 AromaticContact CE1-NE1 3.88Å; F226-W273 HydrophobicContact CE2-CB 4.44Å; F226-W273 HydrophobicContact CE2-CG 4.49Å; F226-W273 HydrophobicContact CG-CB 4Å; F226-W273 AromaticContact CG-CD1 3.8Å; F226-W273 HydrophobicContact CG-CD2 4.29Å; F226-W273 AromaticContact CG-CG 3.76Å; F226-W273 HydrophobicContact CG-CG 3.76Å; F226-W273 AromaticContact CZ-CD2 3.9Å; F226-W273 HydrophobicContact CZ-CD2 3.9Å; F226-W273 AromaticContact CZ-CE3 3.85Å; F226-W273 HydrophobicContact CZ-CE3 3.85Å; F226-W273 HydrophobicContact CZ-CG 4.27Å; F226-W273 HydrophobicContact CZ-CZ3 4.19Å; W242-W273 AromaticContact CH2-CH2 3.38Å; W242-W273 HydrophobicContact CH2-CH2 3.38Å; W242-W273 HydrophobicContact CH2-CZ2 4.27Å; W242-W273 HydrophobicContact CH2-CZ3 4.12Å; W242-W273 AromaticContact CZ2-CH2 3.77Å; W242-W273 HydrophobicContact CZ2-CH2 3.77Å; W242-W273 HydrophobicContact CZ3-CH2 4.36Å; L249-W273 HydrophobicContact CB-CH2 4.44Å; L249-W273 HydrophobicContact CB-CZ3 3.99Å; L249-W273 HydrophobicContact CD2-CH2 3.9Å; L249-W273 HydrophobicContact CD2-CZ3 3.81Å; Y266-W273 HydrophobicContact CD1-CB 4.3Å; Y266-W273 HydrophobicContact CD1-CE3 4.27Å; Y266-W273 HydrophobicContact CG-CE3 4.38Å; T267-W273 CarbonylContact O-C 3.6Å; T267-W273 WeakPolarHBondContact O-CA 3.47Å; I268-W273 HydrophobicContact CB-CD2 4.2Å; I268-W273 HydrophobicContact CB-CE3 4.26Å; I268-W273 HydrophobicContact CB-CH2 4.45Å; I268-W273 HydrophobicContact CB-CZ2 4.23Å; I268-W273 HydrophobicContact CB-CZ3 4.42Å; I268-W273 HydrophobicContact CD1-CD2 4.47Å; I268-W273 HydrophobicContact CD1-CZ2 3.8Å; I268-W273 HydrophobicContact CG1-CD2 4.35Å; I268-W273 HydrophobicContact CG1-CZ2 4.38Å
274	Y	94.1	Very high	91.4	Very high	13 Å²	13	34 Å²	34	5%	0.051	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	123.4	-180	-64.3	-88.6	0	0	0	110.4	Y266 T267 C269 H272 K276 V327 D329 F334 P346	Y266-Y274 WeakPolarHBondContact CA-O 3.45Å; T267-Y274 PolarHBondContact N-O 3.43Å; T267-Y274 PolarHBondContact O-N 3.4Å; C269-Y274 HydrophobicContact CB-CD2 4.43Å; C269-Y274 HydrophobicContact CB-CE2 3.93Å; H272-Y274 HydrophobicContact CB-CE2 4.02Å; H272-Y274 AromaticContact CD2-CD1 3.73Å; H272-Y274 AromaticContact CD2-CD2 3.82Å; H272-Y274 AromaticContact CD2-CE1 3.49Å; H272-Y274 VanDerWaalsContact CD2-CE1 3.49Å; H272-Y274 WeakPolarHBondContact CD2-CE1 3.3Å; H272-Y274 AromaticContact CD2-CE2 3.56Å; H272-Y274 AromaticContact CD2-CG 3.9Å; H272-Y274 AromaticContact CD2-CZ 3.4Å; Y274-K276 VanDerWaalsContact CB-CE 3.49Å; Y274-K276 PolarHBondContact O-N 3.21Å; Y274-V327 HydrophobicContact CE1-CG1 4.39Å; Y274-D329 WeakPolarHBondContact CA-OD1 3.44Å; Y274-D329 HydrophobicContact CD1-CB 3.95Å; Y274-F334 HydrophobicContact CE1-CD2 4.45Å; Y274-F334 HydrophobicContact CE1-CE2 4.14Å; Y274-P346 WeakPolarHBondContact OH-CA 3.48Å; Y274-P346 VanDerWaalsContact OH-CB 3.25Å; Y274-P346 WeakPolarHBondContact OH-CB 3.34Å
275	L	95.4	Very high	90.8	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	107.1	167.5	179.7	53.4	0	0	0	108.8	P229 L264 Y266 D329 E330 F357	P229-L275 HydrophobicContact CG-CD2 4.07Å; L264-L275 HydrophobicContact CB-CD1 3.77Å; L264-L275 HydrophobicContact CD2-CD1 4.33Å; L264-L275 HydrophobicContact CG-CD1 4.44Å; Y266-L275 HydrophobicContact CD1-CB 4.2Å; Y266-L275 HydrophobicContact CD2-CD1 4.12Å; Y266-L275 HydrophobicContact CE1-CB 3.67Å; Y266-L275 HydrophobicContact CE1-CD1 4.34Å; Y266-L275 HydrophobicContact CE1-CG 4.47Å; Y266-L275 HydrophobicContact CE2-CD1 3.8Å; L275-D329 PolarHBondContact N-OD1 2.69Å; L275-E330 HydrophobicContact CB-CB 4.45Å; L275-E330 HydrophobicContact CB-CG 3.72Å; L275-E330 HydrophobicContact CD2-CB 4.44Å; L275-E330 HydrophobicContact CD2-CG 4.08Å; L275-E330 HydrophobicContact CG-CG 4.47Å; L275-E330 PolarHBondContact O-N 3.47Å; L275-E330 VanDerWaalsContact O-N 3.08Å; L275-F357 HydrophobicContact CD2-CD1 4Å; L275-F357 HydrophobicContact CD2-CE1 4.05Å
276	K	94	Very high	90.4	Very high	48 Å²	48	37.5 Å²	37.5	21%	0.209	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	-26.6	-173.4	-65.8	-58.7	-173.2	-165.7	0	114.4	L265 T267 Y274 L328	L265-K276 PolarHBondContact O-N 3.32Å; T267-K276 HydrophobicContact CG2-CG 4Å; T267-K276 WeakPolarHBondContact OG1-CG 3.43Å; Y274-K276 VanDerWaalsContact CB-CE 3.49Å; Y274-K276 PolarHBondContact O-N 3.21Å; K276-L328 HydrophobicContact CD-CB 4.4Å; K276-L328 WeakPolarHBondContact CD-O 3.45Å; K276-L328 PolarHBondContact NZ-O 2.74Å
277	K	93.8	Very high	90.1	Very high	46 Å²	46	37.4 Å²	37.4	20%	0.2	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	133.8	-178.5	-156.8	151.1	-175	153.1	0	110.2	L265 L279 E360	L265-K277 HydrophobicContact CB-CB 4.17Å; L265-K277 HydrophobicContact CD1-CB 4.12Å; L265-K277 HydrophobicContact CG-CB 4.31Å; L265-K277 PolarHBondContact N-O 2.99Å; K277-L279 HydrophobicContact CD-CD2 4.48Å; K277-L279 HydrophobicContact CG-CD2 3.93Å; K277-E360 IonicContact NZ-OE1 2.71Å; K277-E360 PolarHBondContact NZ-OE1 3.28Å
278	T	95.1	Very high	89.8	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.012	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	114.3	178.1	-63.2	0	0	0	0	108.4	F232 Y262 L264 F357 N359	F232-T278 HydrophobicContact CZ-CG2 4.46Å; Y262-T278 HydrophobicContact CD1-CG2 4.02Å; L264-T278 HydrophobicContact CD2-CG2 3.63Å; T278-F357 HydrophobicContact CG2-CB 4.32Å; T278-F357 HydrophobicContact CG2-CD2 3.83Å; T278-F357 HydrophobicContact CG2-CE2 4.48Å; T278-F357 HydrophobicContact CG2-CG 4.21Å; T278-N359 PolarHBondContact N-OD1 3.34Å; T278-N359 PolarHBondContact O-ND2 3.08Å; T278-N359 PolarHBondContact O-OD1 3.42Å; T278-N359 VanDerWaalsContact O-OD1 3.14Å
279	L	93.1	Very high	89.5	Confident	7 Å²	7	36.8 Å²	36.8	4%	0.037	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	135.5	176.5	-49.7	-176	0	0	0	108.9	Y262 V263 K277 F281 I302 L312 F406	Y262-L279 CarbonylContact C-O 3.59Å; Y262-L279 WeakPolarHBondContact CA-O 3.34Å; V263-L279 HydrophobicContact CB-CB 4.25Å; V263-L279 PolarHBondContact N-O 3.21Å; V263-L279 PolarHBondContact O-N 3.25Å; K277-L279 HydrophobicContact CD-CD2 4.48Å; K277-L279 HydrophobicContact CG-CD2 3.93Å; L279-F281 HydrophobicContact CB-CE2 3.86Å; L279-F281 HydrophobicContact CB-CZ 3.96Å; L279-F281 HydrophobicContact CD1-CZ 4.23Å; L279-I302 HydrophobicContact CD1-CD1 3.93Å; L279-L312 HydrophobicContact CD1-CD1 3.47Å; L279-L312 VanDerWaalsContact CD1-CD1 3.47Å; L279-F406 HydrophobicContact CD1-CE2 4.07Å; L279-F406 HydrophobicContact CD2-CE2 3.59Å; L279-F406 HydrophobicContact CD2-CZ 4.28Å; L279-F406 HydrophobicContact CG-CE2 4.41Å
280	C	91.9	Very high	89.5	Confident	36 Å²	36	36.1 Å²	36.1	24%	0.243	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	132.1	178.4	-176	0	0	0	0	108.8	Y262	Y262-C280 HydrophobicContact CD1-CB 4.09Å; Y262-C280 HydrophobicContact CE1-CB 3.78Å; Y262-C280 VanDerWaalsContact CZ-SG 3.54Å
281	F	90.6	Very high	89.4	Confident	12 Å²	12	38.3 Å²	38.3	5%	0.053	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	119.9	176.2	-55.6	-73.4	0	0	0	109.2	A260 D261 V263 L279 V287 I302 F304 L310 N404	A260-F281 CarbonylContact C-O 3.49Å; A260-F281 VanDerWaalsContact CA-O 3.28Å; A260-F281 WeakPolarHBondContact CA-O 3.31Å; D261-F281 HydrophobicContact CB-CB 4.49Å; D261-F281 PolarHBondContact N-O 2.99Å; D261-F281 PolarHBondContact O-N 3.34Å; V263-F281 HydrophobicContact CB-CE2 4.36Å; V263-F281 HydrophobicContact CG2-CD2 4.38Å; V263-F281 HydrophobicContact CG2-CE2 3.88Å; L279-F281 HydrophobicContact CB-CE2 3.86Å; L279-F281 HydrophobicContact CB-CZ 3.96Å; L279-F281 HydrophobicContact CD1-CZ 4.23Å; F281-V287 HydrophobicContact CD2-CG2 3.64Å; F281-V287 HydrophobicContact CE2-CG2 4.09Å; F281-V287 HydrophobicContact CG-CG2 4.37Å; F281-I302 HydrophobicContact CE2-CD1 4.25Å; F281-I302 HydrophobicContact CE2-CG2 4.39Å; F281-I302 HydrophobicContact CZ-CD1 4.17Å; F281-F304 HydrophobicContact CB-CE1 4.33Å; F281-F304 AromaticContact CD1-CE1 3.62Å; F281-F304 HydrophobicContact CD1-CE1 3.62Å; F281-F304 AromaticContact CD1-CZ 3.84Å; F281-F304 HydrophobicContact CD1-CZ 3.84Å; F281-F304 AromaticContact CD2-CE1 3.98Å; F281-F304 HydrophobicContact CD2-CE1 3.98Å; F281-F304 AromaticContact CE1-CE1 3.81Å; F281-F304 HydrophobicContact CE1-CE1 3.81Å; F281-F304 AromaticContact CE1-CZ 3.56Å; F281-F304 HydrophobicContact CE1-CZ 3.56Å; F281-F304 HydrophobicContact CE2-CE1 4.15Å; F281-F304 HydrophobicContact CE2-CZ 4.31Å; F281-F304 AromaticContact CG-CE1 3.7Å; F281-F304 HydrophobicContact CG-CE1 3.7Å; F281-F304 HydrophobicContact CG-CZ 4.32Å; F281-F304 HydrophobicContact CZ-CE1 4.07Å; F281-F304 AromaticContact CZ-CZ 3.81Å; F281-F304 HydrophobicContact CZ-CZ 3.81Å; F281-L310 HydrophobicContact CE1-CD2 4.17Å; F281-L310 HydrophobicContact CZ-CD2 4.01Å; F281-N404 WeakPolarHBondContact CA-OD1 3.14Å
282	V	88.2	Confident	89.6	Confident	56 Å²	56	32.8 Å²	32.8	34%	0.339	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	148.5	-179	-65.3	0	0	0	0	111.2	A260 K285 E403 N404	A260-V282 HydrophobicContact CB-CG1 4.25Å; V282-K285 PolarHBondContact O-N 2.73Å; V282-E403 HydrophobicContact CG2-CB 4.29Å; V282-E403 VanDerWaalsContact CG2-O 3.27Å; V282-E403 WeakPolarHBondContact CG2-O 3.47Å; V282-N404 PolarHBondContact N-OD1 2.95Å; V282-N404 PolarHBondContact O-ND2 2.78Å
283	A	84.7	Confident	89.3	Confident	50 Å²	50	32.5 Å²	32.5	41%	0.413	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	145.7	176.6	0	0	0	0	0	112.4	D259	D259-A283 HydrophobicContact CB-CB 4.05Å; D259-A283 WeakPolarHBondContact O-CB 3.5Å; D259-A283 PolarHBondContact O-N 3.39Å
284	P	84.7	Confident	88.6	Confident	93 Å²	93	36 Å²	36	60%	0.604	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	cis	-84.4	-1.7	12.7	34.9	-34.1	0	0	0	114.2	N305 E403	P284-N305 PolarHBondContact O-ND2 3.4Å; P284-N305 PolarHBondContact O-OD1 2.86Å; P284-E403 WeakPolarHBondContact CD-OE2 3.44Å
285	K	84.3	Confident	87.7	Confident	51 Å²	51	43.7 Å²	43.7	22%	0.222	25%	0.246	C	C	.	.			trans	-81.2	121.6	-179	-164.5	165.2	-174.3	164.9	0	110.3	V282 F304 S308 N404	V282-K285 PolarHBondContact O-N 2.73Å; K285-F304 HydrophobicContact CD-CD1 4.01Å; K285-F304 HydrophobicContact CD-CD2 4.37Å; K285-F304 HydrophobicContact CD-CE1 4.22Å; K285-F304 HydrophobicContact CD-CG 4.07Å; K285-F304 VanDerWaalsContact CE-CD1 3.46Å; K285-F304 HydrophobicContact CG-CB 3.95Å; K285-F304 HydrophobicContact CG-CD1 3.49Å; K285-F304 VanDerWaalsContact CG-CD1 3.49Å; K285-F304 HydrophobicContact CG-CE1 4.06Å; K285-F304 HydrophobicContact CG-CG 3.74Å; K285-S308 WeakPolarHBondContact CE-OG 3.22Å; K285-S308 PolarHBondContact NZ-OG 2.94Å; K285-N404 HydrophobicContact CD-CB 4.43Å
286	S	87.7	Confident	86.9	Confident	30 Å²	30	47.9 Å²	47.9	21%	0.21	27%	0.265	C	S	.	.			trans	-132.1	136.9	-177.4	177.6	0	0	0	0	110.2	R254 D261 F304 N305	R254-S286 PolarHBondContact NH2-OG 3.14Å; D261-S286 VanDerWaalsContact OD2-CA 3.3Å; D261-S286 WeakPolarHBondContact OD2-CA 3.45Å; D261-S286 WeakPolarHBondContact OD2-CB 3.34Å; D261-S286 PolarHBondContact OD2-OG 3.4Å; S286-F304 CarbonylContact O-C 3.54Å; S286-F304 WeakPolarHBondContact O-CA 3.43Å; S286-N305 PolarHBondContact N-OD1 2.85Å; S286-N305 PolarHBondContact O-N 3.43Å; S286-N305 PolarHBondContact O-OD1 2.93Å
287	V	89	Confident	86.1	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	126.4	179.4	177.9	0	0	0	0	109.2	H252 R254 D261 V263 F281 L290 I302 F304	H252-V287 PolarHBondContact CE1-O 3.41Å; H252-V287 VanDerWaalsContact CE1-O 3.29Å; R254-V287 PolarHBondContact NH2-O 2.71Å; D261-V287 HydrophobicContact CB-CB 4.23Å; D261-V287 HydrophobicContact CB-CG2 3.94Å; D261-V287 PolarHBondContact OD2-N 3.39Å; V263-V287 HydrophobicContact CG2-CG2 4.14Å; F281-V287 HydrophobicContact CD2-CG2 3.64Å; F281-V287 HydrophobicContact CE2-CG2 4.09Å; F281-V287 HydrophobicContact CG-CG2 4.37Å; V287-L290 HydrophobicContact CG1-CD2 4.19Å; V287-L290 HydrophobicContact CG1-CG 4.47Å; V287-I302 HydrophobicContact CB-CG2 4.47Å; V287-I302 HydrophobicContact CG1-CG2 3.91Å; V287-I302 HydrophobicContact CG2-CG2 3.84Å; V287-F304 HydrophobicContact CG2-CD1 4.08Å; V287-F304 HydrophobicContact CG2-CE1 3.85Å
288	T	85.8	Confident	85.5	Confident	15 Å²	15	47.8 Å²	47.8	9%	0.092	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	-35.2	179.5	-42.2	0	0	0	0	112.1	A46 F239 V303 F304 N305	A46-T288 HydrophobicContact CB-CG2 3.17Å; F239-T288 VanDerWaalsContact CE2-O 3.29Å; F239-T288 WeakPolarHBondContact CE2-O 3.31Å; T288-V303 PolarHBondContact N-O 3.05Å; T288-F304 VanDerWaalsContact OG1-C 3.22Å; T288-F304 PolarHBondContact OG1-O 3.01Å; T288-N305 WeakPolarHBondContact OG1-CA 3.39Å; T288-N305 PolarHBondContact OG1-N 2.88Å; T288-N305 VanDerWaalsContact OG1-N 3.09Å
289	C	82.7	Confident	85.2	Confident	24 Å²	24	48 Å²	48	16%	0.162	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	155.7	173.2	68.2	0	0	0	0	113.3	V50 V303	V50-C289 WeakPolarHBondContact CG2-SG 3.5Å; C289-V303 PolarHBondContact N-O 3.29Å; C289-V303 PolarHBondContact O-N 3.31Å
290	L	87.9	Confident	85.1	Confident	16 Å²	16	47.6 Å²	47.6	8%	0.084	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	130	171.4	-65.3	-178.6	0	0	0	109.5	A250 H252 V263 V287 L300 H301 I302	A250-L290 HydrophobicContact CB-CD1 4.26Å; H252-L290 HydrophobicContact CB-CD1 3.6Å; H252-L290 HydrophobicContact CB-CG 4.16Å; V263-L290 HydrophobicContact CG1-CD1 4.14Å; V263-L290 HydrophobicContact CG1-CD2 4.08Å; V263-L290 HydrophobicContact CG2-CD2 4.02Å; V287-L290 HydrophobicContact CG1-CD2 4.19Å; V287-L290 HydrophobicContact CG1-CG 4.47Å; L290-L300 HydrophobicContact CB-CD1 4.42Å; L290-H301 WeakPolarHBondContact CA-O 3.15Å; L290-I302 HydrophobicContact CD2-CB 4.16Å; L290-I302 HydrophobicContact CD2-CD1 4.32Å; L290-I302 HydrophobicContact CD2-CG1 3.68Å; L290-I302 HydrophobicContact CD2-CG2 4.01Å
291	K	86.1	Confident	85.1	Confident	88 Å²	88	48.3 Å²	48.3	38%	0.383	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	122.3	176.9	-165.2	172.4	-175.8	-173.3	0	111.6	V50 Y51 H301	V50-K291 HydrophobicContact CG1-CD 4.44Å; Y51-K291 PolarHBondContact OH-NZ 3.09Å; K291-H301 PolarHBondContact N-O 2.89Å; K291-H301 PolarHBondContact O-N 3.19Å
292	W	89	Confident	85.1	Confident	24 Å²	24	47.8 Å²	47.8	9%	0.091	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	143.5	169.1	-69.5	100.2	0	0	0	110.3	A241 V248 A250 L265 L300 V314	A241-W292 PolarHBondContact O-NE1 3.27Å; V248-W292 HydrophobicContact CB-CH2 3.96Å; V248-W292 HydrophobicContact CB-CZ2 3.98Å; V248-W292 HydrophobicContact CG1-CH2 3.81Å; V248-W292 HydrophobicContact CG1-CZ2 3.74Å; A250-W292 HydrophobicContact CB-CZ2 3.95Å; L265-W292 HydrophobicContact CD2-CZ2 4.4Å; W292-L300 HydrophobicContact CD2-CB 4.24Å; W292-L300 HydrophobicContact CD2-CD1 3.96Å; W292-L300 HydrophobicContact CE3-CB 3.86Å; W292-L300 HydrophobicContact CE3-CD1 4.45Å; W292-L300 HydrophobicContact CG-CD1 4.19Å; W292-L300 HydrophobicContact CH2-CB 4.08Å; W292-L300 HydrophobicContact CH2-CD2 4.45Å; W292-L300 HydrophobicContact CZ2-CB 4.46Å; W292-L300 HydrophobicContact CZ2-CD1 4.4Å; W292-L300 HydrophobicContact CZ2-CD2 4.32Å; W292-L300 HydrophobicContact CZ3-CB 3.75Å; W292-V314 HydrophobicContact CH2-CG2 4.47Å
293	E	84.3	Confident	85.2	Confident	56 Å²	56	45.1 Å²	45.1	26%	0.262	25%	0.247	S	C	.	.			trans	-73.3	140.3	172.3	-168.5	167	-177	0	0	110.8	Q296 S299	E293-Q296 HydrophobicContact CB-CB 4.34Å; E293-Q296 HydrophobicContact CG-CB 4.21Å; E293-S299 PolarHBondContact N-O 2.86Å; E293-S299 WeakPolarHBondContact OE2-CB 3.39Å
294	A	77	Confident	85.3	Confident	87 Å²	87	42.8 Å²	42.8	72%	0.719	23%	0.228	S	C	*	.	S	Bend	trans	-76.3	-40.2	-177.1	0	0	0	0	0	111.8
295	E	77.1	Confident	85.4	Confident	176 Å²	176	40.9 Å²	40.9	82%	0.822	21%	0.212	S	C	*	.	S	Bend	trans	-82.9	-40.8	-177.7	-61.2	-169.3	172.6	0	0	112.3	P297	E295-P297 WeakPolarHBondContact O-CD 3.31Å
296	Q	78.4	Confident	85.3	Confident	88 Å²	88	42.7 Å²	42.7	41%	0.411	23%	0.225	S	C	.	.	S	Bend	trans	-100.1	99.7	176.7	-60	-166.8	13.1	0	0	110.5	E293 R298 S299	E293-Q296 HydrophobicContact CB-CB 4.34Å; E293-Q296 HydrophobicContact CG-CB 4.21Å; Q296-R298 PolarHBondContact O-N 3.06Å; Q296-S299 WeakPolarHBondContact CB-OG 3.39Å; Q296-S299 PolarHBondContact O-N 3.49Å; Q296-S299 PolarHBondContact OE1-OG 3.1Å
297	P	75.8	Confident	84.8	Confident	33 Å²	33	45.9 Å²	45.9	21%	0.214	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-15	-164.1	25.4	-36.2	0	0	0	115.2	S243 S244 Q245 E295	S243-P297 VanDerWaalsContact CB-O 3.28Å; S243-P297 WeakPolarHBondContact CB-O 3.39Å; S244-P297 WeakPolarHBondContact OG-CA 3.42Å; S244-P297 VanDerWaalsContact OG-CB 3.23Å; S244-P297 WeakPolarHBondContact OG-CB 3.47Å; Q245-P297 HydrophobicContact CB-CB 4.15Å; Q245-P297 HydrophobicContact CG-CB 3.55Å; Q245-P297 HydrophobicContact CG-CG 4.11Å; E295-P297 WeakPolarHBondContact O-CD 3.31Å
298	R	82.9	Confident	84.5	Confident	59 Å²	59	47.4 Å²	47.4	22%	0.223	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.9	18.9	-177.6	-60.8	-167	-174	112.3	12	113.8	D247 Q296 V314	D247-R298 IonicContact OD2-CZ 3.78Å; D247-R298 VanDerWaalsContact OD2-CZ 3.31Å; D247-R298 IonicContact OD2-NE 2.7Å; D247-R298 PolarHBondContact OD2-NE 2.7Å; D247-R298 IonicContact OD2-NH2 3.93Å; D247-R298 PolarHBondContact OD2-NH2 3.32Å; Q296-R298 PolarHBondContact O-N 3.06Å; R298-V314 HydrophobicContact CB-CB 4.28Å; R298-V314 WeakPolarHBondContact CB-O 3.44Å; R298-V314 WeakPolarHBondContact CD-O 3.43Å; R298-V314 PolarHBondContact O-N 3.47Å
299	S	88.4	Confident	84.5	Confident	6 Å²	6	49.5 Å²	49.5	4%	0.042	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	118.3	175.8	-58.9	0	0	0	0	109	E293 Q296 L312 D313	E293-S299 PolarHBondContact N-O 2.86Å; E293-S299 WeakPolarHBondContact OE2-CB 3.39Å; Q296-S299 WeakPolarHBondContact CB-OG 3.39Å; Q296-S299 PolarHBondContact O-N 3.49Å; Q296-S299 PolarHBondContact OE1-OG 3.1Å; S299-L312 WeakPolarHBondContact CA-O 3.23Å; S299-D313 WeakPolarHBondContact CB-OD1 3.46Å; S299-D313 PolarHBondContact OG-OD1 3.21Å
300	L	91.4	Very high	84.7	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	128	-176.8	175.9	65.2	0	0	0	109.9	A250 L265 L290 W292 I302 L312	A250-L300 HydrophobicContact CB-CD2 4.27Å; L265-L300 HydrophobicContact CD2-CD2 3.87Å; L290-L300 HydrophobicContact CB-CD1 4.42Å; W292-L300 HydrophobicContact CD2-CB 4.24Å; W292-L300 HydrophobicContact CD2-CD1 3.96Å; W292-L300 HydrophobicContact CE3-CB 3.86Å; W292-L300 HydrophobicContact CE3-CD1 4.45Å; W292-L300 HydrophobicContact CG-CD1 4.19Å; W292-L300 HydrophobicContact CH2-CB 4.08Å; W292-L300 HydrophobicContact CH2-CD2 4.45Å; W292-L300 HydrophobicContact CZ2-CB 4.46Å; W292-L300 HydrophobicContact CZ2-CD1 4.4Å; W292-L300 HydrophobicContact CZ2-CD2 4.32Å; W292-L300 HydrophobicContact CZ3-CB 3.75Å; L300-I302 HydrophobicContact CD2-CD1 4.49Å; L300-I302 HydrophobicContact CD2-CG1 4.32Å; L300-I302 HydrophobicContact CG-CG1 4.28Å; L300-L312 HydrophobicContact CB-CB 4.43Å; L300-L312 PolarHBondContact N-O 3.13Å; L300-L312 PolarHBondContact O-N 3.02Å
301	H	90.5	Very high	84.7	Confident	51 Å²	51	52.6 Å²	52.6	24%	0.236	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	127.1	170.4	-61.7	-89.3	0	0	0	110.5	L290 K291 H311	L290-H301 WeakPolarHBondContact CA-O 3.15Å; K291-H301 PolarHBondContact N-O 2.89Å; K291-H301 PolarHBondContact O-N 3.19Å; H301-H311 AromaticContact CE1-CE1 3.72Å; H301-H311 AromaticContact CE1-ND1 3.02Å; H301-H311 PolarHBondContact CE1-ND1 3.39Å; H301-H311 AromaticContact ND1-ND1 3.44Å; H301-H311 PolarHBondContact ND1-ND1 3.33Å; H301-H311 AromaticContact NE2-CE1 3.89Å; H301-H311 AromaticContact NE2-ND1 3.48Å; H301-H311 PolarHBondContact NE2-ND1 3.45Å
302	I	91.1	Very high	84.8	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	111.5	171.8	-51.6	-178	0	0	0	107.2	V263 L279 F281 V287 L290 L300 F304 C309 L310 L312	V263-I302 HydrophobicContact CB-CD1 4.35Å; V263-I302 HydrophobicContact CG1-CD1 4.14Å; V263-I302 HydrophobicContact CG2-CD1 4.21Å; L279-I302 HydrophobicContact CD1-CD1 3.93Å; F281-I302 HydrophobicContact CE2-CD1 4.25Å; F281-I302 HydrophobicContact CE2-CG2 4.39Å; F281-I302 HydrophobicContact CZ-CD1 4.17Å; V287-I302 HydrophobicContact CB-CG2 4.47Å; V287-I302 HydrophobicContact CG1-CG2 3.91Å; V287-I302 HydrophobicContact CG2-CG2 3.84Å; L290-I302 HydrophobicContact CD2-CB 4.16Å; L290-I302 HydrophobicContact CD2-CD1 4.32Å; L290-I302 HydrophobicContact CD2-CG1 3.68Å; L290-I302 HydrophobicContact CD2-CG2 4.01Å; L300-I302 HydrophobicContact CD2-CD1 4.49Å; L300-I302 HydrophobicContact CD2-CG1 4.32Å; L300-I302 HydrophobicContact CG-CG1 4.28Å; I302-F304 HydrophobicContact CB-CZ 4.4Å; I302-F304 HydrophobicContact CG2-CE1 3.95Å; I302-F304 HydrophobicContact CG2-CE2 4.24Å; I302-F304 HydrophobicContact CG2-CZ 3.76Å; I302-C309 CarbonylContact O-C 3.54Å; I302-C309 WeakPolarHBondContact O-CA 3.36Å; I302-L310 HydrophobicContact CB-CB 4.34Å; I302-L310 HydrophobicContact CD1-CD2 4.43Å; I302-L310 PolarHBondContact N-O 3.11Å; I302-L310 PolarHBondContact O-N 3.32Å; I302-L312 HydrophobicContact CD1-CD1 3.58Å; I302-L312 HydrophobicContact CG1-CD1 4.34Å
303	V	89.7	Confident	84.7	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.006	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	133.9	179.6	-175.4	0	0	0	0	109.8	A49 V50 T288 C289 W307 C309	A49-V303 HydrophobicContact CB-CG1 4.16Å; V50-V303 HydrophobicContact CB-CG2 4.2Å; V50-V303 HydrophobicContact CG1-CG2 4.41Å; V50-V303 HydrophobicContact CG2-CB 3.9Å; V50-V303 HydrophobicContact CG2-CG1 4.06Å; V50-V303 HydrophobicContact CG2-CG2 3.41Å; V50-V303 VanDerWaalsContact CG2-CG2 3.41Å; T288-V303 PolarHBondContact N-O 3.05Å; C289-V303 PolarHBondContact N-O 3.29Å; C289-V303 PolarHBondContact O-N 3.31Å; V303-W307 HydrophobicContact CG1-CE3 4.49Å; V303-C309 HydrophobicContact CG2-CB 4.26Å
304	F	87.7	Confident	84.8	Confident	1 Å²	1	50.7 Å²	50.7	0%	0.004	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	167.9	-176.3	-57.1	-83.3	0	0	0	112	F281 K285 S286 V287 T288 I302 D306 W307 S308 L310	F281-F304 HydrophobicContact CB-CE1 4.33Å; F281-F304 AromaticContact CD1-CE1 3.62Å; F281-F304 HydrophobicContact CD1-CE1 3.62Å; F281-F304 AromaticContact CD1-CZ 3.84Å; F281-F304 HydrophobicContact CD1-CZ 3.84Å; F281-F304 AromaticContact CD2-CE1 3.98Å; F281-F304 HydrophobicContact CD2-CE1 3.98Å; F281-F304 AromaticContact CE1-CE1 3.81Å; F281-F304 HydrophobicContact CE1-CE1 3.81Å; F281-F304 AromaticContact CE1-CZ 3.56Å; F281-F304 HydrophobicContact CE1-CZ 3.56Å; F281-F304 HydrophobicContact CE2-CE1 4.15Å; F281-F304 HydrophobicContact CE2-CZ 4.31Å; F281-F304 AromaticContact CG-CE1 3.7Å; F281-F304 HydrophobicContact CG-CE1 3.7Å; F281-F304 HydrophobicContact CG-CZ 4.32Å; F281-F304 HydrophobicContact CZ-CE1 4.07Å; F281-F304 AromaticContact CZ-CZ 3.81Å; F281-F304 HydrophobicContact CZ-CZ 3.81Å; K285-F304 HydrophobicContact CD-CD1 4.01Å; K285-F304 HydrophobicContact CD-CD2 4.37Å; K285-F304 HydrophobicContact CD-CE1 4.22Å; K285-F304 HydrophobicContact CD-CG 4.07Å; K285-F304 VanDerWaalsContact CE-CD1 3.46Å; K285-F304 HydrophobicContact CG-CB 3.95Å; K285-F304 HydrophobicContact CG-CD1 3.49Å; K285-F304 VanDerWaalsContact CG-CD1 3.49Å; K285-F304 HydrophobicContact CG-CE1 4.06Å; K285-F304 HydrophobicContact CG-CG 3.74Å; S286-F304 CarbonylContact O-C 3.54Å; S286-F304 WeakPolarHBondContact O-CA 3.43Å; V287-F304 HydrophobicContact CG2-CD1 4.08Å; V287-F304 HydrophobicContact CG2-CE1 3.85Å; T288-F304 VanDerWaalsContact OG1-C 3.22Å; T288-F304 PolarHBondContact OG1-O 3.01Å; I302-F304 HydrophobicContact CB-CZ 4.4Å; I302-F304 HydrophobicContact CG2-CE1 3.95Å; I302-F304 HydrophobicContact CG2-CE2 4.24Å; I302-F304 HydrophobicContact CG2-CZ 3.76Å; F304-D306 WeakPolarHBondContact CB-OD1 3.31Å; F304-D306 PolarHBondContact O-N 2.85Å; F304-W307 PolarHBondContact O-N 3.25Å; F304-W307 VanDerWaalsContact O-N 3.11Å; F304-S308 WeakPolarHBondContact CD2-O 3.33Å; F304-S308 WeakPolarHBondContact CD2-OG 3.46Å; F304-S308 PolarHBondContact N-O 3.33Å; F304-L310 HydrophobicContact CE2-CB 3.72Å; F304-L310 HydrophobicContact CZ-CB 4.15Å
305	N	86.7	Confident	85.2	Confident	52 Å²	52	49.2 Å²	49.2	28%	0.278	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-18.8	179.3	63.3	-24.7	0	0	0	114.3	P284 S286 T288	P284-N305 PolarHBondContact O-ND2 3.4Å; P284-N305 PolarHBondContact O-OD1 2.86Å; S286-N305 PolarHBondContact N-OD1 2.85Å; S286-N305 PolarHBondContact O-N 3.43Å; S286-N305 PolarHBondContact O-OD1 2.93Å; T288-N305 WeakPolarHBondContact OG1-CA 3.39Å; T288-N305 PolarHBondContact OG1-N 2.88Å; T288-N305 VanDerWaalsContact OG1-N 3.09Å
306	D	82	Confident	85.6	Confident	89 Å²	89	46.1 Å²	46.1	48%	0.476	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	5.3	175.4	69.8	-8.9	0	0	0	113.4	F304 S308	F304-D306 WeakPolarHBondContact CB-OD1 3.31Å; F304-D306 PolarHBondContact O-N 2.85Å; D306-S308 PolarHBondContact O-N 2.82Å; D306-S308 VanDerWaalsContact OD1-CB 3.26Å; D306-S308 WeakPolarHBondContact OD1-CB 3.35Å; D306-S308 PolarHBondContact OD1-N 2.66Å; D306-S308 PolarHBondContact OD1-OG 3.3Å; D306-S308 PolarHBondContact OD2-OG 2.82Å
307	W	76.7	Confident	85.9	Confident	97 Å²	97	46.3 Å²	46.3	37%	0.367	24%	0.239	S	C	.	.	S	Bend	trans	68.5	7.3	-175.4	-45.8	122.1	0	0	0	116	Q42 D45 A46 A49 V303 F304	Q42-W307 VanDerWaalsContact O-CH2 3.28Å; Q42-W307 WeakPolarHBondContact O-CH2 3.5Å; D45-W307 HydrophobicContact CB-CH2 3.29Å; D45-W307 HydrophobicContact CB-CZ2 2.9Å; D45-W307 HydrophobicContact CB-CZ3 4.36Å; D45-W307 WeakPolarHBondContact O-CH2 3.39Å; D45-W307 WeakPolarHBondContact O-CZ3 3.1Å; A46-W307 VanDerWaalsContact CA-CH2 3.48Å; A46-W307 HydrophobicContact CB-CE3 4.48Å; A46-W307 HydrophobicContact CB-CH2 3.96Å; A46-W307 HydrophobicContact CB-CZ3 3.47Å; A46-W307 VanDerWaalsContact CB-CZ3 3.47Å; A49-W307 HydrophobicContact CB-CB 3.53Å; A49-W307 HydrophobicContact CB-CD2 3.47Å; A49-W307 VanDerWaalsContact CB-CD2 3.47Å; A49-W307 HydrophobicContact CB-CE3 3.09Å; A49-W307 HydrophobicContact CB-CG 3.7Å; A49-W307 HydrophobicContact CB-CZ3 4.15Å; V303-W307 HydrophobicContact CG1-CE3 4.49Å; F304-W307 PolarHBondContact O-N 3.25Å; F304-W307 VanDerWaalsContact O-N 3.11Å
308	S	83	Confident	86.5	Confident	32 Å²	32	48.2 Å²	48.2	22%	0.224	25%	0.251	C	S	.	.			trans	-68	149.9	163	69.6	0	0	0	0	109.8	K285 F304 D306	K285-S308 WeakPolarHBondContact CE-OG 3.22Å; K285-S308 PolarHBondContact NZ-OG 2.94Å; F304-S308 WeakPolarHBondContact CD2-O 3.33Å; F304-S308 WeakPolarHBondContact CD2-OG 3.46Å; F304-S308 PolarHBondContact N-O 3.33Å; D306-S308 PolarHBondContact O-N 2.82Å; D306-S308 VanDerWaalsContact OD1-CB 3.26Å; D306-S308 WeakPolarHBondContact OD1-CB 3.35Å; D306-S308 PolarHBondContact OD1-N 2.66Å; D306-S308 PolarHBondContact OD1-OG 3.3Å; D306-S308 PolarHBondContact OD2-OG 2.82Å
309	C	85.1	Confident	86.9	Confident	59 Å²	59	46.4 Å²	46.4	40%	0.399	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	128.9	177.3	178.8	0	0	0	0	108.5	I302 V303	I302-C309 CarbonylContact O-C 3.54Å; I302-C309 WeakPolarHBondContact O-CA 3.36Å; V303-C309 HydrophobicContact CG2-CB 4.26Å
310	L	87.8	Confident	87	Confident	24 Å²	24	48.1 Å²	48.1	13%	0.126	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	117.2	168.4	178	66	0	0	0	108.1	F281 I302 F304 L312 F406	F281-L310 HydrophobicContact CE1-CD2 4.17Å; F281-L310 HydrophobicContact CZ-CD2 4.01Å; I302-L310 HydrophobicContact CB-CB 4.34Å; I302-L310 HydrophobicContact CD1-CD2 4.43Å; I302-L310 PolarHBondContact N-O 3.11Å; I302-L310 PolarHBondContact O-N 3.32Å; F304-L310 HydrophobicContact CE2-CB 3.72Å; F304-L310 HydrophobicContact CZ-CB 4.15Å; L310-L312 HydrophobicContact CD1-CD2 4.23Å; L310-L312 HydrophobicContact CD2-CD1 4.32Å; L310-L312 HydrophobicContact CD2-CD2 4.02Å; L310-L312 HydrophobicContact CD2-CG 4.22Å; L310-L312 HydrophobicContact CG-CD2 3.94Å; L310-L312 HydrophobicContact CG-CG 4.03Å; L310-F406 HydrophobicContact CD2-CD2 4.28Å; L310-F406 HydrophobicContact CD2-CE2 4.37Å
311	H	87.5	Confident	86.8	Confident	81 Å²	81	50.3 Å²	50.3	38%	0.375	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	123.6	174.3	178.8	77.6	0	0	0	109.1	H301 D313	H301-H311 AromaticContact CE1-CE1 3.72Å; H301-H311 AromaticContact CE1-ND1 3.02Å; H301-H311 PolarHBondContact CE1-ND1 3.39Å; H301-H311 AromaticContact ND1-ND1 3.44Å; H301-H311 PolarHBondContact ND1-ND1 3.33Å; H301-H311 AromaticContact NE2-CE1 3.89Å; H301-H311 AromaticContact NE2-ND1 3.48Å; H301-H311 PolarHBondContact NE2-ND1 3.45Å; H311-D313 IonicContact CD2-OD1 2.77Å; H311-D313 IonicContact CD2-OD2 3.55Å; H311-D313 IonicContact CE1-OD1 3.43Å; H311-D313 IonicContact NE2-OD1 3.55Å; H311-D313 PolarHBondContact NE2-OD1 3.29Å; H311-D313 IonicContact NE2-OD2 2.9Å
312	L	88.6	Confident	86.5	Confident	19 Å²	19	52.8 Å²	52.8	10%	0.099	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	114.6	-176.3	-66.4	175.9	0	0	0	110.5	L279 S299 L300 I302 L310 F406	L279-L312 HydrophobicContact CD1-CD1 3.47Å; L279-L312 VanDerWaalsContact CD1-CD1 3.47Å; S299-L312 WeakPolarHBondContact CA-O 3.23Å; L300-L312 HydrophobicContact CB-CB 4.43Å; L300-L312 PolarHBondContact N-O 3.13Å; L300-L312 PolarHBondContact O-N 3.02Å; I302-L312 HydrophobicContact CD1-CD1 3.58Å; I302-L312 HydrophobicContact CG1-CD1 4.34Å; L310-L312 HydrophobicContact CD1-CD2 4.23Å; L310-L312 HydrophobicContact CD2-CD1 4.32Å; L310-L312 HydrophobicContact CD2-CD2 4.02Å; L310-L312 HydrophobicContact CD2-CG 4.22Å; L310-L312 HydrophobicContact CG-CD2 3.94Å; L310-L312 HydrophobicContact CG-CG 4.03Å; L312-F406 HydrophobicContact CD2-CE1 4.07Å; L312-F406 HydrophobicContact CD2-CE2 4.26Å; L312-F406 HydrophobicContact CD2-CZ 3.66Å
313	D	86.3	Confident	86.5	Confident	69 Å²	69	53.2 Å²	53.2	37%	0.369	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	107.3	169.7	-64.4	-39.2	0	0	0	109.9	S299 H311	S299-D313 WeakPolarHBondContact CB-OD1 3.46Å; S299-D313 PolarHBondContact OG-OD1 3.21Å; H311-D313 IonicContact CD2-OD1 2.77Å; H311-D313 IonicContact CD2-OD2 3.55Å; H311-D313 IonicContact CE1-OD1 3.43Å; H311-D313 IonicContact NE2-OD1 3.55Å; H311-D313 PolarHBondContact NE2-OD1 3.29Å; H311-D313 IonicContact NE2-OD2 2.9Å
314	V	87.5	Confident	86.5	Confident	40 Å²	40	53.3 Å²	53.3	24%	0.242	28%	0.28	C	S	.	.			trans	-90.3	119.7	-176.4	-175	0	0	0	0	110.2	L265 W292 R298	L265-V314 HydrophobicContact CD1-CG2 3.98Å; W292-V314 HydrophobicContact CH2-CG2 4.47Å; R298-V314 HydrophobicContact CB-CB 4.28Å; R298-V314 WeakPolarHBondContact CB-O 3.44Å; R298-V314 WeakPolarHBondContact CD-O 3.43Å; R298-V314 PolarHBondContact O-N 3.47Å
315	I	85.5	Confident	86.8	Confident	56 Å²	56	53.7 Å²	53.7	29%	0.287	28%	0.283	S	S	.	.			trans	-118.7	137.1	-179.2	-59.6	152.7	0	0	0	109.6	S317 Y503	I315-S317 PolarHBondContact O-N 3.17Å; I315-Y503 HydrophobicContact CD1-CD1 4.5Å; I315-Y503 HydrophobicContact CD1-CE1 3.36Å; I315-Y503 WeakPolarHBondContact CD1-OH 3.32Å; I315-Y503 HydrophobicContact CG1-CE1 4.35Å
316	W	85.2	Confident	87.1	Confident	112 Å²	112	51.5 Å²	51.5	42%	0.424	27%	0.272	S	S	.	.			trans	-68.3	125.6	171.1	-70.3	103.9	0	0	0	110.4	T267	T267-W316 HydrophobicContact CG2-CH2 3.48Å; T267-W316 VanDerWaalsContact CG2-CH2 3.48Å; T267-W316 HydrophobicContact CG2-CZ2 4.06Å; T267-W316 HydrophobicContact CG2-CZ3 4.3Å
317	S	85.2	Confident	87.7	Confident	91 Å²	91	49.8 Å²	49.8	64%	0.636	27%	0.265	S	S	*	.			trans	-125.1	134.8	172.4	-173	0	0	0	0	109.4	I315	I315-S317 PolarHBondContact O-N 3.17Å
318	T	87.5	Confident	88.5	Confident	73 Å²	73	46 Å²	46	45%	0.448	25%	0.252	S	S	.	.			trans	-103.9	107	174.1	-57.3	0	0	0	0	108.4	R320 V325	T318-R320 HydrophobicContact CG2-CB 4.48Å; T318-R320 PolarHBondContact O-N 3.38Å; T318-V325 HydrophobicContact CG2-CG1 4.23Å
319	C	90.6	Very high	89	Confident	21 Å²	21	45.1 Å²	45.1	14%	0.142	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	109.6	176.5	-170.5	0	0	0	0	109.5	A326 V361 F363	C319-A326 HydrophobicContact CB-CB 4.39Å; C319-A326 PolarHBondContact O-N 3.13Å; C319-V361 HydrophobicContact CB-CG2 3.9Å; C319-V361 PolarHBondContact SG-O 3.23Å; C319-F363 WeakPolarHBondContact SG-CD2 3.47Å
320	R	90.5	Very high	89.5	Confident	43 Å²	43	44.9 Å²	44.9	16%	0.162	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	146.9	-174.3	66.2	-171.8	179.8	-174.2	-0.2	111.6	T318 T324 V325 E508 M542 V598	T318-R320 HydrophobicContact CG2-CB 4.48Å; T318-R320 PolarHBondContact O-N 3.38Å; R320-T324 WeakPolarHBondContact CA-O 3.44Å; R320-V325 HydrophobicContact CB-CG2 4.01Å; R320-E508 IonicContact CZ-OE1 3.72Å; R320-E508 IonicContact NH2-OE1 3.06Å; R320-E508 PolarHBondContact NH2-OE1 3.32Å; R320-M542 VanDerWaalsContact CZ-SD 3.51Å; R320-M542 VanDerWaalsContact NE-CE 3.3Å; R320-M542 PolarHBondContact NH1-SD 3.43Å; R320-V598 WeakPolarHBondContact CD-O 3.48Å; R320-V598 PolarHBondContact NH1-O 3.23Å
321	K	87.8	Confident	89.7	Confident	45 Å²	45	45.1 Å²	45.1	20%	0.196	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	118.7	168.8	-172.7	77.7	175.2	-152.8	0	108	S323 T324 F363 G364 H365 E367	K321-S323 PolarHBondContact O-N 3.35Å; K321-S323 VanDerWaalsContact O-N 3.09Å; K321-T324 PolarHBondContact N-O 3.34Å; K321-T324 PolarHBondContact O-N 3.33Å; K321-F363 HydrophobicContact CB-CB 3.88Å; K321-F363 HydrophobicContact CB-CD1 4.01Å; K321-F363 HydrophobicContact CB-CD2 3.82Å; K321-F363 HydrophobicContact CB-CE2 4.36Å; K321-F363 HydrophobicContact CB-CG 3.63Å; K321-F363 HydrophobicContact CD-CB 4.44Å; K321-F363 HydrophobicContact CG-CB 4.38Å; K321-G364 PolarHBondContact NZ-O 3.42Å; K321-H365 WeakPolarHBondContact CE-O 3.47Å; K321-H365 PolarHBondContact NZ-O 3.27Å; K321-E367 HydrophobicContact CB-CG 3.94Å; K321-E367 HydrophobicContact CG-CG 3.61Å
322	N	84.6	Confident	90	Very high	103 Å²	103	42.2 Å²	42.2	55%	0.551	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	47	-115.2	-171.4	-53.9	-33.1	0	0	0	111.1	E367 T599	N322-E367 HydrophobicContact CB-CG 4.44Å; N322-E367 WeakPolarHBondContact CB-OE1 3.34Å; N322-E367 PolarHBondContact ND2-OE1 3.42Å; N322-T599 PolarHBondContact O-OG1 2.92Å
323	S	90.2	Very high	90.2	Very high	10 Å²	10	41.3 Å²	41.3	7%	0.07	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-5.7	-179.4	56.7	0	0	0	0	115.3	K321 N337 F338 S339	K321-S323 PolarHBondContact O-N 3.35Å; K321-S323 VanDerWaalsContact O-N 3.09Å; S323-N337 PolarHBondContact OG-OD1 2.6Å; S323-F338 WeakPolarHBondContact O-CD2 3.23Å; S323-F338 PolarHBondContact O-N 3.01Å; S323-S339 PolarHBondContact OG-OG 3.46Å
324	T	91.6	Very high	90.5	Very high	2 Å²	2	39 Å²	39	1%	0.012	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	132.2	-176.5	-58.1	0	0	0	0	111	R320 K321 T336 N337 F363 E367	R320-T324 WeakPolarHBondContact CA-O 3.44Å; K321-T324 PolarHBondContact N-O 3.34Å; K321-T324 PolarHBondContact O-N 3.33Å; T324-T336 WeakPolarHBondContact CA-O 3.38Å; T324-N337 PolarHBondContact OG1-ND2 3.13Å; T324-F363 HydrophobicContact CG2-CE1 4.26Å; T324-F363 HydrophobicContact CG2-CZ 3.98Å; T324-E367 WeakPolarHBondContact CB-OE2 3.45Å; T324-E367 PolarHBondContact OG1-OE2 3.4Å
325	V	93.3	Very high	90.7	Very high	9 Å²	9	37.2 Å²	37.2	6%	0.055	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	135.6	178.5	178.5	0	0	0	0	109.7	T318 R320 V327 T336 F338 V598 T599	T318-V325 HydrophobicContact CG2-CG1 4.23Å; R320-V325 HydrophobicContact CB-CG2 4.01Å; V325-V327 HydrophobicContact CG1-CG2 4.22Å; V325-T336 PolarHBondContact N-O 2.89Å; V325-T336 PolarHBondContact O-N 2.96Å; V325-F338 HydrophobicContact CB-CE2 3.96Å; V325-F338 HydrophobicContact CG2-CD2 3.98Å; V325-F338 HydrophobicContact CG2-CE2 3.64Å; V325-V598 HydrophobicContact CG1-CG1 4.46Å; V325-V598 HydrophobicContact CG2-CG1 4.04Å; V325-T599 HydrophobicContact CG2-CG2 4.29Å
326	A	92.9	Very high	91	Very high	7 Å²	7	35.2 Å²	35.2	6%	0.058	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	131	175.5	0	0	0	0	0	110.4	C319 V333 F334 F335 V361 F363 L370	C319-A326 HydrophobicContact CB-CB 4.39Å; C319-A326 PolarHBondContact O-N 3.13Å; A326-V333 HydrophobicContact CB-CG1 4.03Å; A326-F334 CarbonylContact C-O 3.52Å; A326-F334 VanDerWaalsContact CA-O 3.32Å; A326-F334 WeakPolarHBondContact CA-O 3.37Å; A326-F335 HydrophobicContact CB-CD1 4.45Å; A326-F335 HydrophobicContact CB-CE1 4.4Å; A326-V361 HydrophobicContact CB-CG2 4.22Å; A326-F363 HydrophobicContact CB-CE2 4.01Å; A326-F363 HydrophobicContact CB-CZ 3.96Å; A326-L370 HydrophobicContact CB-CD1 4.33Å; A326-L370 HydrophobicContact CB-CD2 4.38Å
327	V	93.5	Very high	91.3	Very high	52 Å²	52	31.1 Å²	31.1	32%	0.315	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	128.6	179.5	-179	0	0	0	0	109.3	Y274 V325 F334	Y274-V327 HydrophobicContact CE1-CG1 4.39Å; V325-V327 HydrophobicContact CG1-CG2 4.22Å; V327-F334 HydrophobicContact CB-CB 4.34Å; V327-F334 PolarHBondContact N-O 3.43Å; V327-F334 PolarHBondContact O-N 2.9Å
328	L	94.6	Very high	91.6	Very high	19 Å²	19	27.3 Å²	27.3	10%	0.099	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	135.8	179.1	-54.6	-176.1	0	0	0	111.7	K276 V333 V358 N359 V361	K276-L328 HydrophobicContact CD-CB 4.4Å; K276-L328 WeakPolarHBondContact CD-O 3.45Å; K276-L328 PolarHBondContact NZ-O 2.74Å; L328-V333 HydrophobicContact CD2-CG1 4.31Å; L328-V333 HydrophobicContact CD2-CG2 3.94Å; L328-V358 HydrophobicContact CD1-CG1 4.29Å; L328-V358 HydrophobicContact CD2-CB 4.03Å; L328-V358 HydrophobicContact CD2-CG1 3.55Å; L328-N359 WeakPolarHBondContact CD1-O 3.37Å; L328-V361 HydrophobicContact CD2-CB 4.26Å; L328-V361 HydrophobicContact CD2-CG1 3.62Å; L328-V361 HydrophobicContact CD2-CG2 3.67Å; L328-V361 HydrophobicContact CG-CG2 4.23Å
329	D	94.2	Very high	91.7	Very high	12 Å²	12	26.9 Å²	26.9	6%	0.064	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	106.6	166.1	-162	15.4	0	0	0	109.9	H272 Y274 L275 D331 T332 F334	H272-D329 IonicContact CD2-OD2 2.71Å; H272-D329 IonicContact CE1-OD2 2.8Å; H272-D329 IonicContact NE2-OD2 3.21Å; H272-D329 PolarHBondContact NE2-OD2 3.35Å; Y274-D329 WeakPolarHBondContact CA-OD1 3.44Å; Y274-D329 HydrophobicContact CD1-CB 3.95Å; L275-D329 PolarHBondContact N-OD1 2.69Å; D329-D331 PolarHBondContact O-N 3.06Å; D329-T332 PolarHBondContact N-O 3.18Å; D329-T332 WeakPolarHBondContact O-CA 3.37Å; D329-T332 PolarHBondContact O-N 2.96Å; D329-T332 VanDerWaalsContact O-O 3.08Å; D329-F334 HydrophobicContact CB-CD2 4.11Å; D329-F334 HydrophobicContact CB-CE1 4.46Å; D329-F334 HydrophobicContact CB-CE2 3.36Å; D329-F334 HydrophobicContact CB-CZ 3.57Å; D329-F334 WeakPolarHBondContact OD2-CE2 3.26Å
330	E	94	Very high	91.6	Very high	55 Å²	55	32 Å²	32	26%	0.257	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	-118.1	-178.7	-54.2	177.2	-178	0	0	112.8	P229 L275 T332 F357 V358	P229-E330 HydrophobicContact CG-CG 4.05Å; L275-E330 HydrophobicContact CB-CB 4.45Å; L275-E330 HydrophobicContact CB-CG 3.72Å; L275-E330 HydrophobicContact CD2-CB 4.44Å; L275-E330 HydrophobicContact CD2-CG 4.08Å; L275-E330 HydrophobicContact CG-CG 4.47Å; L275-E330 PolarHBondContact O-N 3.47Å; L275-E330 VanDerWaalsContact O-N 3.08Å; E330-T332 VanDerWaalsContact C-N 3.34Å; E330-F357 HydrophobicContact CB-CD1 4.09Å; E330-F357 HydrophobicContact CB-CE1 4.18Å; E330-F357 CarbonylContact O-C 3.53Å; E330-F357 WeakPolarHBondContact O-CA 3.4Å; E330-V358 PolarHBondContact O-N 3.14Å
331	D	93.4	Very high	91.5	Very high	28 Å²	28	31.3 Å²	31.3	15%	0.15	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	7	177.6	61.9	7.1	0	0	0	112.2	D329 K353 L354 F357	D329-D331 PolarHBondContact O-N 3.06Å; D331-K353 WeakPolarHBondContact OD1-CE 3.34Å; D331-K353 WeakPolarHBondContact OD2-CE 3.46Å; D331-K353 IonicContact OD2-NZ 2.69Å; D331-K353 PolarHBondContact OD2-NZ 3.15Å; D331-L354 PolarHBondContact O-N 2.83Å; D331-F357 HydrophobicContact CB-CD1 4.45Å
332	T	93.5	Very high	91.5	Very high	20 Å²	20	32.3 Å²	32.3	12%	0.123	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	137.9	-173.2	-55.9	0	0	0	0	111.2	D329 E330 F334 I352	D329-T332 PolarHBondContact N-O 3.18Å; D329-T332 WeakPolarHBondContact O-CA 3.37Å; D329-T332 PolarHBondContact O-N 2.96Å; D329-T332 VanDerWaalsContact O-O 3.08Å; E330-T332 VanDerWaalsContact C-N 3.34Å; T332-F334 HydrophobicContact CG2-CD1 3.79Å; T332-F334 HydrophobicContact CG2-CE1 3.48Å; T332-F334 VanDerWaalsContact CG2-CE1 3.48Å; T332-I352 CarbonylContact C-O 3.58Å; T332-I352 VanDerWaalsContact CA-O 3.32Å; T332-I352 WeakPolarHBondContact CA-O 3.47Å; T332-I352 WeakPolarHBondContact CG2-O 3.28Å
333	V	92.7	Very high	91.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	118.6	172	-173.5	0	0	0	0	108.8	A326 L328 F335 S351 I352 L354 V358 V361 L370	A326-V333 HydrophobicContact CB-CG1 4.03Å; L328-V333 HydrophobicContact CD2-CG1 4.31Å; L328-V333 HydrophobicContact CD2-CG2 3.94Å; V333-F335 HydrophobicContact CB-CE2 4.29Å; V333-F335 HydrophobicContact CB-CZ 4.35Å; V333-F335 HydrophobicContact CG1-CE1 4.28Å; V333-F335 HydrophobicContact CG1-CE2 4.18Å; V333-F335 HydrophobicContact CG1-CZ 3.91Å; V333-S351 VanDerWaalsContact O-CA 3.25Å; V333-S351 WeakPolarHBondContact O-CA 3.28Å; V333-I352 HydrophobicContact CB-CG2 3.94Å; V333-I352 HydrophobicContact CG2-CG2 4.36Å; V333-I352 PolarHBondContact N-O 2.63Å; V333-I352 PolarHBondContact O-N 2.76Å; V333-L354 HydrophobicContact CG2-CD1 4.38Å; V333-V358 HydrophobicContact CG2-CB 4.41Å; V333-V358 HydrophobicContact CG2-CG1 4.08Å; V333-V358 HydrophobicContact CG2-CG2 3.98Å; V333-V361 HydrophobicContact CG1-CG1 4.45Å; V333-V361 HydrophobicContact CG2-CG1 4.11Å; V333-L370 HydrophobicContact CG1-CD2 3.91Å
334	F	93	Very high	91.9	Very high	22 Å²	22	31.2 Å²	31.2	10%	0.096	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	133.7	176.3	-58.5	-28.3	0	0	0	111	Y274 A326 V327 D329 T332 Y348	Y274-F334 HydrophobicContact CE1-CD2 4.45Å; Y274-F334 HydrophobicContact CE1-CE2 4.14Å; A326-F334 CarbonylContact C-O 3.52Å; A326-F334 VanDerWaalsContact CA-O 3.32Å; A326-F334 WeakPolarHBondContact CA-O 3.37Å; V327-F334 HydrophobicContact CB-CB 4.34Å; V327-F334 PolarHBondContact N-O 3.43Å; V327-F334 PolarHBondContact O-N 2.9Å; D329-F334 HydrophobicContact CB-CD2 4.11Å; D329-F334 HydrophobicContact CB-CE1 4.46Å; D329-F334 HydrophobicContact CB-CE2 3.36Å; D329-F334 HydrophobicContact CB-CZ 3.57Å; D329-F334 WeakPolarHBondContact OD2-CE2 3.26Å; T332-F334 HydrophobicContact CG2-CD1 3.79Å; T332-F334 HydrophobicContact CG2-CE1 3.48Å; T332-F334 VanDerWaalsContact CG2-CE1 3.48Å; F334-Y348 HydrophobicContact CB-CD1 4.02Å; F334-Y348 HydrophobicContact CB-CG 3.95Å; F334-Y348 AromaticContact CD1-CD1 3.37Å; F334-Y348 HydrophobicContact CD1-CD1 3.37Å; F334-Y348 HydrophobicContact CD1-CD2 4.31Å; F334-Y348 AromaticContact CD1-CE1 3.38Å; F334-Y348 HydrophobicContact CD1-CE1 3.38Å; F334-Y348 HydrophobicContact CD1-CE2 4.33Å; F334-Y348 AromaticContact CD1-CG 3.85Å; F334-Y348 HydrophobicContact CD1-CG 3.85Å; F334-Y348 AromaticContact CD1-CZ 3.86Å; F334-Y348 AromaticContact CD2-CD1 3.81Å; F334-Y348 HydrophobicContact CD2-CD1 3.81Å; F334-Y348 HydrophobicContact CD2-CE1 4.3Å; F334-Y348 AromaticContact CE1-CD1 3.68Å; F334-Y348 HydrophobicContact CE1-CD1 3.68Å; F334-Y348 AromaticContact CE1-CE1 3.22Å; F334-Y348 HydrophobicContact CE1-CE1 3.22Å; F334-Y348 AromaticContact CE1-CZ 3.75Å; F334-Y348 HydrophobicContact CE2-CD1 4.08Å; F334-Y348 HydrophobicContact CE2-CE1 4.17Å; F334-Y348 AromaticContact CG-CD1 3.45Å; F334-Y348 HydrophobicContact CG-CD1 3.45Å; F334-Y348 VanDerWaalsContact CG-CD1 3.45Å; F334-Y348 AromaticContact CG-CE1 3.95Å; F334-Y348 HydrophobicContact CG-CE1 3.95Å; F334-Y348 AromaticContact CG-CG 3.88Å; F334-Y348 HydrophobicContact CG-CG 3.88Å; F334-Y348 HydrophobicContact CZ-CD1 4.03Å; F334-Y348 AromaticContact CZ-CE1 3.66Å; F334-Y348 HydrophobicContact CZ-CE1 3.66Å
335	F	90.7	Very high	91.8	Very high	1 Å²	1	32.6 Å²	32.6	0%	0.004	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	132.1	177.4	-60.9	-84.9	0	0	0	110.8	A326 V333 Q349 A350 I352 L370	A326-F335 HydrophobicContact CB-CD1 4.45Å; A326-F335 HydrophobicContact CB-CE1 4.4Å; V333-F335 HydrophobicContact CB-CE2 4.29Å; V333-F335 HydrophobicContact CB-CZ 4.35Å; V333-F335 HydrophobicContact CG1-CE1 4.28Å; V333-F335 HydrophobicContact CG1-CE2 4.18Å; V333-F335 HydrophobicContact CG1-CZ 3.91Å; F335-Q349 PolarHBondContact O-N 3.33Å; F335-A350 HydrophobicContact CB-CB 4.26Å; F335-A350 PolarHBondContact N-O 3.02Å; F335-A350 PolarHBondContact O-N 2.82Å; F335-I352 HydrophobicContact CE2-CB 4.18Å; F335-I352 HydrophobicContact CE2-CG2 3.7Å; F335-I352 HydrophobicContact CZ-CG2 4.2Å; F335-L370 HydrophobicContact CE1-CD2 3.75Å; F335-L370 HydrophobicContact CZ-CD2 3.76Å
336	T	92.3	Very high	91.6	Very high	15 Å²	15	34.6 Å²	34.6	9%	0.092	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	114.7	168.6	-59.2	0	0	0	0	109.2	T324 V325 F338 Q349	T324-T336 WeakPolarHBondContact CA-O 3.38Å; V325-T336 PolarHBondContact N-O 2.89Å; V325-T336 PolarHBondContact O-N 2.96Å; T336-F338 HydrophobicContact CG2-CD1 4.15Å; T336-F338 HydrophobicContact CG2-CD2 4.39Å; T336-F338 HydrophobicContact CG2-CE1 3.83Å; T336-F338 HydrophobicContact CG2-CE2 4.13Å; T336-F338 HydrophobicContact CG2-CG 4.41Å; T336-F338 HydrophobicContact CG2-CZ 3.84Å; T336-Q349 HydrophobicContact CG2-CG 4.39Å
337	N	91.5	Very high	91.6	Very high	25 Å²	25	40.3 Å²	40.3	13%	0.134	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	104.8	168.3	-175	-27.5	0	0	0	108.9	S323 T324 S339 N340 G341 Q349	S323-N337 PolarHBondContact OG-OD1 2.6Å; T324-N337 PolarHBondContact OG1-ND2 3.13Å; N337-S339 PolarHBondContact O-N 3.21Å; N337-S339 WeakPolarHBondContact OD1-CB 3.4Å; N337-S339 PolarHBondContact OD1-N 3.15Å; N337-S339 PolarHBondContact OD1-OG 3.01Å; N337-N340 PolarHBondContact O-N 3.25Å; N337-N340 VanDerWaalsContact O-N 3.14Å; N337-G341 PolarHBondContact O-N 3.01Å; N337-Q349 PolarHBondContact O-NE2 3.4Å; N337-Q349 PolarHBondContact O-OE1 3.15Å; N337-Q349 VanDerWaalsContact O-OE1 3.14Å
338	F	92.2	Very high	91.5	Very high	12 Å²	12	42.3 Å²	42.3	5%	0.053	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-17.9	-176.4	-72.8	-74.7	0	0	0	113.8	S323 V325 T336 N340 G341 V342 V598 T599 F601 V606 L614	S323-F338 WeakPolarHBondContact O-CD2 3.23Å; S323-F338 PolarHBondContact O-N 3.01Å; V325-F338 HydrophobicContact CB-CE2 3.96Å; V325-F338 HydrophobicContact CG2-CD2 3.98Å; V325-F338 HydrophobicContact CG2-CE2 3.64Å; T336-F338 HydrophobicContact CG2-CD1 4.15Å; T336-F338 HydrophobicContact CG2-CD2 4.39Å; T336-F338 HydrophobicContact CG2-CE1 3.83Å; T336-F338 HydrophobicContact CG2-CE2 4.13Å; T336-F338 HydrophobicContact CG2-CG 4.41Å; T336-F338 HydrophobicContact CG2-CZ 3.84Å; F338-N340 VanDerWaalsContact C-N 3.3Å; F338-G341 PolarHBondContact O-N 3.25Å; F338-V342 HydrophobicContact CD1-CB 4.34Å; F338-V342 HydrophobicContact CD1-CG1 4.08Å; F338-V342 HydrophobicContact CD1-CG2 4.3Å; F338-V342 HydrophobicContact CE1-CG1 4.04Å; F338-V598 HydrophobicContact CE2-CG1 4.14Å; F338-V598 HydrophobicContact CZ-CG1 4.46Å; F338-T599 HydrophobicContact CB-CG2 4.26Å; F338-T599 HydrophobicContact CD2-CG2 3.49Å; F338-T599 VanDerWaalsContact CD2-CG2 3.49Å; F338-T599 HydrophobicContact CE2-CG2 4.13Å; F338-T599 HydrophobicContact CG-CG2 4.04Å; F338-F601 VanDerWaalsContact C-CZ 3.48Å; F338-F601 HydrophobicContact CB-CD1 4.17Å; F338-F601 HydrophobicContact CB-CE1 3.38Å; F338-F601 HydrophobicContact CB-CZ 3.85Å; F338-F601 WeakPolarHBondContact O-CZ 3.36Å; F338-V606 HydrophobicContact CB-CG2 4.36Å; F338-V606 HydrophobicContact CD1-CG1 4.18Å; F338-V606 HydrophobicContact CD1-CG2 4.26Å; F338-V606 HydrophobicContact CE1-CG1 4.08Å; F338-V606 HydrophobicContact CG-CG2 4.27Å; F338-V606 HydrophobicContact CZ-CG1 4.43Å; F338-L614 HydrophobicContact CE1-CD1 3.43Å; F338-L614 VanDerWaalsContact CE1-CD1 3.43Å; F338-L614 HydrophobicContact CZ-CD1 3.72Å
339	S	89.3	Confident	91.3	Very high	64 Å²	64	44.9 Å²	44.9	45%	0.448	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-29	174	73.3	0	0	0	0	112.7	S323 N337	S323-S339 PolarHBondContact OG-OG 3.46Å; N337-S339 PolarHBondContact O-N 3.21Å; N337-S339 WeakPolarHBondContact OD1-CB 3.4Å; N337-S339 PolarHBondContact OD1-N 3.15Å; N337-S339 PolarHBondContact OD1-OG 3.01Å
340	N	88.7	Confident	91.1	Very high	129 Å²	129	45.4 Å²	45.4	69%	0.69	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-20	177.2	-67.7	-21.3	0	0	0	112.9	N337 F338	N337-N340 PolarHBondContact O-N 3.25Å; N337-N340 VanDerWaalsContact O-N 3.14Å; F338-N340 VanDerWaalsContact C-N 3.3Å
341	G	87.1	Confident	90.9	Very high	27 Å²	27	44.8 Å²	44.8	28%	0.278	26%	0.257	S	S	.	.			trans	158.3	150.2	177.8	0	0	0	0	0	113	N337 F338 T343 Q349	N337-G341 PolarHBondContact O-N 3.01Å; F338-G341 PolarHBondContact O-N 3.25Å; G341-T343 PolarHBondContact O-N 3.13Å; G341-Q349 PolarHBondContact O-NE2 2.87Å
342	V	89.2	Confident	90.8	Very high	66 Å²	66	43.9 Å²	43.9	40%	0.4	25%	0.252	S	S	.	.			trans	-89.5	87.6	-178.3	-172.2	0	0	0	0	109.3	F338 L614 T616	F338-V342 HydrophobicContact CD1-CB 4.34Å; F338-V342 HydrophobicContact CD1-CG1 4.08Å; F338-V342 HydrophobicContact CD1-CG2 4.3Å; F338-V342 HydrophobicContact CE1-CG1 4.04Å; V342-L614 HydrophobicContact CG1-CB 3.95Å; V342-L614 HydrophobicContact CG1-CD1 4Å; V342-T616 WeakPolarHBondContact CG2-OG1 3.32Å
343	T	91.2	Very high	90.7	Very high	29 Å²	29	49.3 Å²	49.3	18%	0.178	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-82.4	123.6	177.9	-53.4	0	0	0	0	109.3	G341 M347 Q349 L614	G341-T343 PolarHBondContact O-N 3.13Å; T343-M347 HydrophobicContact CG2-CB 3.61Å; T343-Q349 WeakPolarHBondContact OG1-CG 3.33Å; T343-L614 WeakPolarHBondContact O-CD1 3.39Å
344	P	90.9	Very high	90.6	Very high	62 Å²	62	49.5 Å²	49.5	40%	0.403	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-78.4	142.3	-175.6	30.8	-34.4	0	0	0	111.8	M347	P344-M347 WeakPolarHBondContact O-CA 3.42Å; P344-M347 VanDerWaalsContact O-CB 3.29Å; P344-M347 WeakPolarHBondContact O-CB 3.26Å; P344-M347 PolarHBondContact O-N 3.03Å
345	P	89.4	Confident	90.4	Very high	30 Å²	30	53.5 Å²	53.5	20%	0.195	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	142.8	169.9	-21.3	32.4	0	0	0	110.8	N270 L614	N270-P345 PolarHBondContact ND2-O 3.38Å; P345-L614 HydrophobicContact CG-CD2 4.47Å; P345-L614 HydrophobicContact CG-CG 4.44Å
346	P	89.4	Confident	90.5	Very high	51 Å²	51	57.3 Å²	57.3	33%	0.331	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	cis	-85.5	2.7	6.6	35.2	-37.2	0	0	0	115.5	H272 Y274	H272-P346 HydrophobicContact CB-CB 3.78Å; H272-P346 HydrophobicContact CB-CG 4.09Å; Y274-P346 WeakPolarHBondContact OH-CA 3.48Å; Y274-P346 VanDerWaalsContact OH-CB 3.25Å; Y274-P346 WeakPolarHBondContact OH-CB 3.34Å
347	M	92.4	Very high	90.6	Very high	127 Å²	127	57.2 Å²	57.2	63%	0.626	31%	0.312	S	S	*	.			trans	-70.8	156.2	178	-56.8	174.7	65.2	0	0	111.3	T343 P344	T343-M347 HydrophobicContact CG2-CB 3.61Å; P344-M347 WeakPolarHBondContact O-CA 3.42Å; P344-M347 VanDerWaalsContact O-CB 3.29Å; P344-M347 WeakPolarHBondContact O-CB 3.26Å; P344-M347 PolarHBondContact O-N 3.03Å
348	Y	92	Very high	90.7	Very high	94 Å²	94	56.1 Å²	56.1	37%	0.369	31%	0.307	S	S	.	.			trans	-144.3	166.5	-178.9	52.2	-98.7	0	0	0	110	F334 A350 S351	F334-Y348 HydrophobicContact CB-CD1 4.02Å; F334-Y348 HydrophobicContact CB-CG 3.95Å; F334-Y348 AromaticContact CD1-CD1 3.37Å; F334-Y348 HydrophobicContact CD1-CD1 3.37Å; F334-Y348 HydrophobicContact CD1-CD2 4.31Å; F334-Y348 AromaticContact CD1-CE1 3.38Å; F334-Y348 HydrophobicContact CD1-CE1 3.38Å; F334-Y348 HydrophobicContact CD1-CE2 4.33Å; F334-Y348 AromaticContact CD1-CG 3.85Å; F334-Y348 HydrophobicContact CD1-CG 3.85Å; F334-Y348 AromaticContact CD1-CZ 3.86Å; F334-Y348 AromaticContact CD2-CD1 3.81Å; F334-Y348 HydrophobicContact CD2-CD1 3.81Å; F334-Y348 HydrophobicContact CD2-CE1 4.3Å; F334-Y348 AromaticContact CE1-CD1 3.68Å; F334-Y348 HydrophobicContact CE1-CD1 3.68Å; F334-Y348 AromaticContact CE1-CE1 3.22Å; F334-Y348 HydrophobicContact CE1-CE1 3.22Å; F334-Y348 AromaticContact CE1-CZ 3.75Å; F334-Y348 HydrophobicContact CE2-CD1 4.08Å; F334-Y348 HydrophobicContact CE2-CE1 4.17Å; F334-Y348 AromaticContact CG-CD1 3.45Å; F334-Y348 HydrophobicContact CG-CD1 3.45Å; F334-Y348 VanDerWaalsContact CG-CD1 3.45Å; F334-Y348 AromaticContact CG-CE1 3.95Å; F334-Y348 HydrophobicContact CG-CE1 3.95Å; F334-Y348 AromaticContact CG-CG 3.88Å; F334-Y348 HydrophobicContact CG-CG 3.88Å; F334-Y348 HydrophobicContact CZ-CD1 4.03Å; F334-Y348 AromaticContact CZ-CE1 3.66Å; F334-Y348 HydrophobicContact CZ-CE1 3.66Å; Y348-A350 VanDerWaalsContact CD2-O 3.29Å; Y348-A350 WeakPolarHBondContact CD2-O 3.47Å; Y348-S351 WeakPolarHBondContact CE2-OG 3.41Å; Y348-S351 PolarHBondContact OH-OG 3.49Å
349	Q	90.7	Very high	90.8	Very high	74 Å²	74	56.6 Å²	56.6	35%	0.346	31%	0.309	S	S	.	.	S	Bend	trans	-90.6	-38.5	-179.8	-70.3	174.9	-16.4	0	0	112.7	F335 T336 N337 G341 T343	F335-Q349 PolarHBondContact O-N 3.33Å; T336-Q349 HydrophobicContact CG2-CG 4.39Å; N337-Q349 PolarHBondContact O-NE2 3.4Å; N337-Q349 PolarHBondContact O-OE1 3.15Å; N337-Q349 VanDerWaalsContact O-OE1 3.14Å; G341-Q349 PolarHBondContact O-NE2 2.87Å; T343-Q349 WeakPolarHBondContact OG1-CG 3.33Å
350	A	89.2	Confident	91	Very high	22 Å²	22	55.2 Å²	55.2	18%	0.182	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	157.9	175.3	0	0	0	0	0	109.1	F335 Y348	F335-A350 HydrophobicContact CB-CB 4.26Å; F335-A350 PolarHBondContact N-O 3.02Å; F335-A350 PolarHBondContact O-N 2.82Å; Y348-A350 VanDerWaalsContact CD2-O 3.29Å; Y348-A350 WeakPolarHBondContact CD2-O 3.47Å
351	S	90.9	Very high	91.2	Very high	43 Å²	43	50.1 Å²	50.1	30%	0.301	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	139.6	176.8	58.4	0	0	0	0	110.2	V333 Y348	V333-S351 VanDerWaalsContact O-CA 3.25Å; V333-S351 WeakPolarHBondContact O-CA 3.28Å; Y348-S351 WeakPolarHBondContact CE2-OG 3.41Å; Y348-S351 PolarHBondContact OH-OG 3.49Å
352	I	90.4	Very high	91.5	Very high	9 Å²	9	50 Å²	50	5%	0.046	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.2	171	-162.1	171.9	0	0	0	109.6	T332 V333 F335 L354 I382 E389 Y391	T332-I352 CarbonylContact C-O 3.58Å; T332-I352 VanDerWaalsContact CA-O 3.32Å; T332-I352 WeakPolarHBondContact CA-O 3.47Å; T332-I352 WeakPolarHBondContact CG2-O 3.28Å; V333-I352 HydrophobicContact CB-CG2 3.94Å; V333-I352 HydrophobicContact CG2-CG2 4.36Å; V333-I352 PolarHBondContact N-O 2.63Å; V333-I352 PolarHBondContact O-N 2.76Å; F335-I352 HydrophobicContact CE2-CB 4.18Å; F335-I352 HydrophobicContact CE2-CG2 3.7Å; F335-I352 HydrophobicContact CZ-CG2 4.2Å; I352-L354 HydrophobicContact CD1-CD2 4.31Å; I352-L354 HydrophobicContact CG1-CD2 4.29Å; I352-L354 HydrophobicContact CG2-CD2 4.39Å; I352-I382 HydrophobicContact CD1-CB 4.4Å; I352-I382 HydrophobicContact CD1-CG1 4.12Å; I352-I382 HydrophobicContact CD1-CG2 3.5Å; I352-I382 VanDerWaalsContact CD1-CG2 3.5Å; I352-I382 HydrophobicContact CG2-CD1 3.97Å; I352-I382 HydrophobicContact CG2-CG2 4.4Å; I352-E389 WeakPolarHBondContact CB-OE2 3.26Å; I352-E389 HydrophobicContact CD1-CB 3.94Å; I352-E389 HydrophobicContact CG1-CB 4.4Å; I352-Y391 HydrophobicContact CD1-CD1 3.9Å; I352-Y391 HydrophobicContact CG1-CD1 4.46Å
353	K	91.5	Very high	91.7	Very high	134 Å²	134	47.3 Å²	47.3	58%	0.583	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-95.8	126.3	174	-174.4	172.8	-173.6	166.7	0	109	D331	D331-K353 WeakPolarHBondContact OD1-CE 3.34Å; D331-K353 WeakPolarHBondContact OD2-CE 3.46Å; D331-K353 IonicContact OD2-NZ 2.69Å; D331-K353 PolarHBondContact OD2-NZ 3.15Å
354	L	91.3	Very high	91.5	Very high	3 Å²	3	46 Å²	46	2%	0.016	24%	0.238	C	C	.	.			trans	-103.6	166.4	178.3	-56.2	-179.6	0	0	0	110.2	D331 V333 I352 F356 V358 A372 L374 I382 Y391	D331-L354 PolarHBondContact O-N 2.83Å; V333-L354 HydrophobicContact CG2-CD1 4.38Å; I352-L354 HydrophobicContact CD1-CD2 4.31Å; I352-L354 HydrophobicContact CG1-CD2 4.29Å; I352-L354 HydrophobicContact CG2-CD2 4.39Å; L354-F356 VanDerWaalsContact C-N 3.28Å; L354-F356 PolarHBondContact O-N 3.01Å; L354-V358 HydrophobicContact CB-CG2 4.47Å; L354-V358 HydrophobicContact CD1-CG2 3.72Å; L354-V358 HydrophobicContact CG-CG2 4.4Å; L354-A372 HydrophobicContact CD1-CB 4.04Å; L354-L374 HydrophobicContact CB-CD2 4.28Å; L354-L374 HydrophobicContact CD1-CD2 3.73Å; L354-I382 HydrophobicContact CD1-CD1 4.19Å; L354-I382 HydrophobicContact CD2-CD1 4.35Å; L354-I382 HydrophobicContact CD2-CG1 4.42Å; L354-Y391 HydrophobicContact CD2-CD1 3.87Å; L354-Y391 HydrophobicContact CD2-CD2 4.03Å; L354-Y391 HydrophobicContact CD2-CE1 4.08Å; L354-Y391 HydrophobicContact CD2-CE2 4.24Å; L354-Y391 HydrophobicContact CD2-CG 3.85Å
355	D	88.9	Confident	91.1	Very high	107 Å²	107	48.2 Å²	48.2	57%	0.572	24%	0.243	S	C	*	.	S	Bend	trans	-73.8	-18.6	-174.8	-63.4	-53.4	0	0	0	113.8	Y391	D355-Y391 VanDerWaalsContact CG-OH 3.24Å; D355-Y391 PolarHBondContact OD1-OH 3.06Å; D355-Y391 PolarHBondContact OD2-OH 2.88Å
356	F	91.4	Very high	90.6	Very high	81 Å²	81	50.7 Å²	50.7	36%	0.355	25%	0.254	S	S	.	.	S	Bend	trans	-137.7	164.8	-179.7	-63.2	-94.4	0	0	0	111	L354 V358 L374 N376 M378	L354-F356 VanDerWaalsContact C-N 3.28Å; L354-F356 PolarHBondContact O-N 3.01Å; F356-V358 PolarHBondContact O-N 3.37Å; F356-L374 HydrophobicContact CB-CB 4.19Å; F356-L374 HydrophobicContact CB-CD1 4.19Å; F356-L374 HydrophobicContact CD2-CD1 4.39Å; F356-N376 HydrophobicContact CD1-CB 3.83Å; F356-N376 WeakPolarHBondContact CD2-ND2 3.28Å; F356-N376 HydrophobicContact CE1-CB 4.02Å; F356-N376 WeakPolarHBondContact CE2-ND2 3.3Å; F356-N376 HydrophobicContact CG-CB 4.18Å; F356-N376 VanDerWaalsContact CZ-ND2 3.34Å; F356-N376 WeakPolarHBondContact CZ-ND2 3.19Å; F356-M378 HydrophobicContact CD2-CE 3.34Å; F356-M378 HydrophobicContact CE2-CE 3.43Å; F356-M378 VanDerWaalsContact CE2-CE 3.43Å; F356-M378 HydrophobicContact CE2-SD 4.41Å; F356-M378 HydrophobicContact CG-CE 4.45Å
357	F	94.1	Very high	90.1	Very high	13 Å²	13	50.2 Å²	50.2	6%	0.057	25%	0.248	C	C	.	.			trans	-59.5	137.3	178.1	-59.1	-72.4	0	0	0	111.6	P229 F231 F232 L275 T278 E330 D331 L374 S375	P229-F357 HydrophobicContact CB-CE1 3.87Å; P229-F357 HydrophobicContact CB-CZ 3.89Å; P229-F357 HydrophobicContact CG-CE1 3.77Å; P229-F357 HydrophobicContact CG-CZ 4.13Å; F231-F357 HydrophobicContact CB-CE2 4.32Å; F231-F357 HydrophobicContact CB-CZ 3.96Å; F231-F357 AromaticContact CD1-CE2 3.75Å; F231-F357 HydrophobicContact CD1-CE2 3.75Å; F231-F357 HydrophobicContact CD1-CZ 4.13Å; F231-F357 HydrophobicContact CE1-CE2 4.26Å; F231-F357 HydrophobicContact CG-CE2 4.01Å; F231-F357 HydrophobicContact CG-CZ 4.17Å; F232-F357 HydrophobicContact CD2-CZ 4.43Å; F232-F357 HydrophobicContact CE2-CE1 4.27Å; F232-F357 AromaticContact CE2-CE2 3.96Å; F232-F357 HydrophobicContact CE2-CE2 3.96Å; F232-F357 AromaticContact CE2-CZ 3.54Å; F232-F357 HydrophobicContact CE2-CZ 3.54Å; F232-F357 AromaticContact CZ-CE2 3.72Å; F232-F357 HydrophobicContact CZ-CE2 3.72Å; F232-F357 AromaticContact CZ-CZ 3.82Å; F232-F357 HydrophobicContact CZ-CZ 3.82Å; L275-F357 HydrophobicContact CD2-CD1 4Å; L275-F357 HydrophobicContact CD2-CE1 4.05Å; T278-F357 HydrophobicContact CG2-CB 4.32Å; T278-F357 HydrophobicContact CG2-CD2 3.83Å; T278-F357 HydrophobicContact CG2-CE2 4.48Å; T278-F357 HydrophobicContact CG2-CG 4.21Å; E330-F357 HydrophobicContact CB-CD1 4.09Å; E330-F357 HydrophobicContact CB-CE1 4.18Å; E330-F357 CarbonylContact O-C 3.53Å; E330-F357 WeakPolarHBondContact O-CA 3.4Å; D331-F357 HydrophobicContact CB-CD1 4.45Å; F357-L374 CarbonylContact O-C 3.58Å; F357-L374 WeakPolarHBondContact O-CA 3.26Å; F357-S375 PolarHBondContact O-N 3Å
358	V	94.6	Very high	89.6	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.012	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	121.4	-177.6	-166.8	0	0	0	0	109.5	L328 E330 V333 L354 F356 V361 A372 L374	L328-V358 HydrophobicContact CD1-CG1 4.29Å; L328-V358 HydrophobicContact CD2-CB 4.03Å; L328-V358 HydrophobicContact CD2-CG1 3.55Å; E330-V358 PolarHBondContact O-N 3.14Å; V333-V358 HydrophobicContact CG2-CB 4.41Å; V333-V358 HydrophobicContact CG2-CG1 4.08Å; V333-V358 HydrophobicContact CG2-CG2 3.98Å; L354-V358 HydrophobicContact CB-CG2 4.47Å; L354-V358 HydrophobicContact CD1-CG2 3.72Å; L354-V358 HydrophobicContact CG-CG2 4.4Å; F356-V358 PolarHBondContact O-N 3.37Å; V358-V361 HydrophobicContact CG1-CG1 3.82Å; V358-A372 HydrophobicContact CG1-CB 4.07Å; V358-L374 HydrophobicContact CB-CD2 4.45Å; V358-L374 HydrophobicContact CG2-CD2 3.97Å
359	N	93.6	Very high	89.3	Confident	21 Å²	21	46.3 Å²	46.3	11%	0.112	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-39.5	179.9	-81.6	-21.9	0	0	0	112.4	T278 L328 L373 S375	T278-N359 PolarHBondContact N-OD1 3.34Å; T278-N359 PolarHBondContact O-ND2 3.08Å; T278-N359 PolarHBondContact O-OD1 3.42Å; T278-N359 VanDerWaalsContact O-OD1 3.14Å; L328-N359 WeakPolarHBondContact CD1-O 3.37Å; N359-L373 PolarHBondContact N-O 3.03Å; N359-S375 WeakPolarHBondContact ND2-CA 3.31Å
360	E	94.1	Very high	89.4	Confident	36 Å²	36	42.9 Å²	42.9	17%	0.168	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	151.6	-176.7	-61	-175.2	-169.8	0	0	111.1	K277 A372 L373 N409 L410	K277-E360 IonicContact NZ-OE1 2.71Å; K277-E360 PolarHBondContact NZ-OE1 3.28Å; E360-A372 CarbonylContact O-C 3.53Å; E360-A372 WeakPolarHBondContact O-CA 3.47Å; E360-L373 HydrophobicContact CB-CB 4.29Å; E360-L373 PolarHBondContact N-O 3.36Å; E360-L373 PolarHBondContact O-N 3.29Å; E360-N409 VanDerWaalsContact CD-N 3.33Å; E360-N409 PolarHBondContact OE1-N 2.78Å; E360-N409 WeakPolarHBondContact OE2-CA 3.44Å; E360-N409 PolarHBondContact OE2-N 3.37Å; E360-L410 PolarHBondContact OE2-N 3.27Å
361	V	94	Very high	89.5	Confident	21 Å²	21	42 Å²	42	13%	0.127	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	147.4	175.7	-74.6	0	0	0	0	111.1	C319 A326 L328 V333 V358 L370 Y371 A372	C319-V361 HydrophobicContact CB-CG2 3.9Å; C319-V361 PolarHBondContact SG-O 3.23Å; A326-V361 HydrophobicContact CB-CG2 4.22Å; L328-V361 HydrophobicContact CD2-CB 4.26Å; L328-V361 HydrophobicContact CD2-CG1 3.62Å; L328-V361 HydrophobicContact CD2-CG2 3.67Å; L328-V361 HydrophobicContact CG-CG2 4.23Å; V333-V361 HydrophobicContact CG1-CG1 4.45Å; V333-V361 HydrophobicContact CG2-CG1 4.11Å; V358-V361 HydrophobicContact CG1-CG1 3.82Å; V361-L370 HydrophobicContact CB-CD1 4.2Å; V361-L370 HydrophobicContact CB-CD2 3.98Å; V361-L370 HydrophobicContact CB-CG 4.23Å; V361-L370 HydrophobicContact CG1-CD2 3.82Å; V361-L370 HydrophobicContact CG1-CG 4.44Å; V361-Y371 CarbonylContact C-O 3.58Å; V361-Y371 WeakPolarHBondContact CA-O 3.49Å; V361-A372 HydrophobicContact CG1-CB 3.73Å
362	T	93.1	Very high	89.7	Confident	25 Å²	25	39.9 Å²	39.9	15%	0.153	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	139.9	175.4	-166	0	0	0	0	110.6	L370 Y371 L410	T362-L370 WeakPolarHBondContact O-CD1 3.49Å; T362-Y371 HydrophobicContact CG2-CD2 4.45Å; T362-Y371 PolarHBondContact N-O 3.3Å; T362-Y371 PolarHBondContact O-N 3.43Å; T362-L410 WeakPolarHBondContact CB-O 3.1Å; T362-L410 HydrophobicContact CG2-CD2 4.14Å; T362-L410 HydrophobicContact CG2-CG 3.84Å
363	F	91.7	Very high	89.9	Confident	10 Å²	10	39.6 Å²	39.6	4%	0.044	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	147.4	176.5	-77.9	-80.6	0	0	0	110.9	C319 K321 T324 A326 L370	C319-F363 WeakPolarHBondContact SG-CD2 3.47Å; K321-F363 HydrophobicContact CB-CB 3.88Å; K321-F363 HydrophobicContact CB-CD1 4.01Å; K321-F363 HydrophobicContact CB-CD2 3.82Å; K321-F363 HydrophobicContact CB-CE2 4.36Å; K321-F363 HydrophobicContact CB-CG 3.63Å; K321-F363 HydrophobicContact CD-CB 4.44Å; K321-F363 HydrophobicContact CG-CB 4.38Å; T324-F363 HydrophobicContact CG2-CE1 4.26Å; T324-F363 HydrophobicContact CG2-CZ 3.98Å; A326-F363 HydrophobicContact CB-CE2 4.01Å; A326-F363 HydrophobicContact CB-CZ 3.96Å; F363-L370 HydrophobicContact CB-CD1 4.45Å; F363-L370 HydrophobicContact CD1-CD1 3.63Å; F363-L370 HydrophobicContact CD2-CD1 3.88Å; F363-L370 HydrophobicContact CE1-CD1 3.71Å; F363-L370 HydrophobicContact CE2-CD1 3.94Å; F363-L370 HydrophobicContact CG-CD1 3.72Å; F363-L370 HydrophobicContact CZ-CD1 3.86Å
364	G	87.7	Confident	90	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.167	C	C	.	.			trans	-72.8	-158	169.9	0	0	0	0	0	113.3	K321 N366 E369	K321-G364 PolarHBondContact NZ-O 3.42Å; G364-N366 VanDerWaalsContact C-N 3.28Å; G364-N366 PolarHBondContact O-N 2.99Å; G364-E369 PolarHBondContact N-O 2.94Å
365	H	82.4	Confident	89.9	Confident	110 Å²	110	33.7 Å²	33.7	51%	0.509	17%	0.17	S	C	.	.	S	Bend	trans	-64	-38.8	174.4	-172	70.6	0	0	0	111.2	K321 Y412	K321-H365 WeakPolarHBondContact CE-O 3.47Å; K321-H365 PolarHBondContact NZ-O 3.27Å; H365-Y412 HydrophobicContact CB-CE1 4.06Å
366	N	80	Confident	89.8	Confident	81 Å²	81	30.4 Å²	30.4	43%	0.433	15%	0.153	S	C	.	.	S	Bend	trans	-105.5	162.8	-180	-62.1	-26.8	0	0	0	111.5	G364 D368	G364-N366 VanDerWaalsContact C-N 3.28Å; G364-N366 PolarHBondContact O-N 2.99Å; N366-D368 PolarHBondContact O-N 3.42Å
367	E	78.7	Confident	89.6	Confident	41 Å²	41	29 Å²	29	19%	0.192	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-15.5	175.2	-69.8	178.8	-126.4	0	0	113.5	K321 N322 T324	K321-E367 HydrophobicContact CB-CG 3.94Å; K321-E367 HydrophobicContact CG-CG 3.61Å; N322-E367 HydrophobicContact CB-CG 4.44Å; N322-E367 WeakPolarHBondContact CB-OE1 3.34Å; N322-E367 PolarHBondContact ND2-OE1 3.42Å; T324-E367 WeakPolarHBondContact CB-OE2 3.45Å; T324-E367 PolarHBondContact OG1-OE2 3.4Å
368	D	80.7	Confident	89.4	Confident	93 Å²	93	29.6 Å²	29.6	50%	0.497	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-15.2	-174.2	-58.1	-36.8	0	0	0	113.1	N366 R384	N366-D368 PolarHBondContact O-N 3.42Å; D368-R384 PolarHBondContact O-N 3.44Å
369	E	87.2	Confident	89.2	Confident	46 Å²	46	29.5 Å²	29.5	22%	0.215	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	124.7	-179.6	-67.6	176.1	165.5	0	0	110.2	G364 I382	G364-E369 PolarHBondContact N-O 2.94Å; E369-I382 WeakPolarHBondContact CA-O 3.48Å
370	L	91.1	Very high	89.1	Confident	2 Å²	2	28.5 Å²	28.5	1%	0.01	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	135.9	175.4	-172.7	85.5	0	0	0	109.6	A326 V333 F335 V361 T362 F363 I382	A326-L370 HydrophobicContact CB-CD1 4.33Å; A326-L370 HydrophobicContact CB-CD2 4.38Å; V333-L370 HydrophobicContact CG1-CD2 3.91Å; F335-L370 HydrophobicContact CE1-CD2 3.75Å; F335-L370 HydrophobicContact CZ-CD2 3.76Å; V361-L370 HydrophobicContact CB-CD1 4.2Å; V361-L370 HydrophobicContact CB-CD2 3.98Å; V361-L370 HydrophobicContact CB-CG 4.23Å; V361-L370 HydrophobicContact CG1-CD2 3.82Å; V361-L370 HydrophobicContact CG1-CG 4.44Å; T362-L370 WeakPolarHBondContact O-CD1 3.49Å; F363-L370 HydrophobicContact CB-CD1 4.45Å; F363-L370 HydrophobicContact CD1-CD1 3.63Å; F363-L370 HydrophobicContact CD2-CD1 3.88Å; F363-L370 HydrophobicContact CE1-CD1 3.71Å; F363-L370 HydrophobicContact CE2-CD1 3.94Å; F363-L370 HydrophobicContact CG-CD1 3.72Å; F363-L370 HydrophobicContact CZ-CD1 3.86Å; L370-I382 HydrophobicContact CB-CB 4.31Å; L370-I382 HydrophobicContact CD2-CD1 4.02Å; L370-I382 PolarHBondContact N-O 3.42Å; L370-I382 WeakPolarHBondContact O-CB 3.12Å; L370-I382 PolarHBondContact O-N 3.01Å
371	Y	93	Very high	89	Confident	3 Å²	3	27.4 Å²	27.4	1%	0.012	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	137.5	174.1	-55.2	-85.6	0	0	0	110	V361 T362 C380 C381 Y412 L418 W437	V361-Y371 CarbonylContact C-O 3.58Å; V361-Y371 WeakPolarHBondContact CA-O 3.49Å; T362-Y371 HydrophobicContact CG2-CD2 4.45Å; T362-Y371 PolarHBondContact N-O 3.3Å; T362-Y371 PolarHBondContact O-N 3.43Å; Y371-C380 CarbonylContact C-O 3.52Å; Y371-C380 WeakPolarHBondContact CA-O 3.4Å; Y371-C381 HydrophobicContact CD1-CB 3.96Å; Y371-C381 HydrophobicContact CE1-CB 3.83Å; Y371-Y412 AromaticContact CD2-CD2 3.77Å; Y371-Y412 HydrophobicContact CD2-CD2 3.77Å; Y371-Y412 HydrophobicContact CD2-CG 4.3Å; Y371-Y412 AromaticContact CE2-CD2 3.14Å; Y371-Y412 HydrophobicContact CE2-CD2 3.14Å; Y371-Y412 AromaticContact CE2-CE2 3.5Å; Y371-Y412 HydrophobicContact CE2-CE2 3.5Å; Y371-Y412 AromaticContact CE2-CG 3.95Å; Y371-Y412 HydrophobicContact CE2-CG 3.95Å; Y371-Y412 AromaticContact CZ-CD2 3.7Å; Y371-Y412 AromaticContact CZ-CE2 3.71Å; Y371-Y412 WeakPolarHBondContact OH-CE2 3.27Å; Y371-L418 HydrophobicContact CD1-CD1 4.25Å; Y371-L418 HydrophobicContact CD1-CD2 4.17Å; Y371-L418 HydrophobicContact CD2-CD2 4.34Å; Y371-L418 HydrophobicContact CE1-CD2 4.46Å; Y371-L418 HydrophobicContact CG-CD2 4.09Å; Y371-W437 AromaticContact CD1-CH2 3.91Å; Y371-W437 HydrophobicContact CD1-CH2 3.91Å; Y371-W437 AromaticContact CD1-CZ2 3.46Å; Y371-W437 HydrophobicContact CD1-CZ2 3.46Å; Y371-W437 VanDerWaalsContact CD1-CZ2 3.46Å; Y371-W437 AromaticContact CE1-CE2 3.7Å; Y371-W437 HydrophobicContact CE1-CH2 4.15Å; Y371-W437 AromaticContact CE1-CZ2 3.32Å; Y371-W437 HydrophobicContact CE1-CZ2 3.32Å; Y371-W437 AromaticContact CE1-NE1 3.87Å
372	A	93.8	Very high	88.7	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	137.4	-178.1	0	0	0	0	0	111.5	L354 V358 E360 V361 I379 C380 I382	L354-A372 HydrophobicContact CD1-CB 4.04Å; V358-A372 HydrophobicContact CG1-CB 4.07Å; E360-A372 CarbonylContact O-C 3.53Å; E360-A372 WeakPolarHBondContact O-CA 3.47Å; V361-A372 HydrophobicContact CG1-CB 3.73Å; A372-I379 CarbonylContact O-C 3.55Å; A372-I379 VanDerWaalsContact O-CA 3.29Å; A372-I379 WeakPolarHBondContact O-CA 3.43Å; A372-C380 HydrophobicContact CB-CB 4.25Å; A372-C380 PolarHBondContact N-O 3.27Å; A372-C380 PolarHBondContact O-N 2.8Å; A372-I382 HydrophobicContact CB-CD1 4.25Å
373	L	94.3	Very high	88.2	Confident	2 Å²	2	27.1 Å²	27.1	1%	0.01	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	120.9	169.9	178.6	66	0	0	0	109	N359 E360 I379 L396 W407 L410 L420	N359-L373 PolarHBondContact N-O 3.03Å; E360-L373 HydrophobicContact CB-CB 4.29Å; E360-L373 PolarHBondContact N-O 3.36Å; E360-L373 PolarHBondContact O-N 3.29Å; L373-I379 HydrophobicContact CD1-CG1 4.25Å; L373-L396 HydrophobicContact CD1-CD1 4.34Å; L373-W407 HydrophobicContact CD1-CB 4.39Å; L373-W407 HydrophobicContact CD2-CB 4.16Å; L373-L410 HydrophobicContact CB-CB 4.29Å; L373-L410 HydrophobicContact CB-CD2 4.06Å; L373-L420 HydrophobicContact CD1-CD2 4.01Å; L373-L420 HydrophobicContact CD2-CD2 3.93Å; L373-L420 HydrophobicContact CG-CD2 4.48Å
374	L	93.8	Very high	87.3	Confident	2 Å²	2	29.7 Å²	29.7	1%	0.01	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	159	-178.3	-58.9	-175.6	0	0	0	112.4	L354 F356 F357 V358 N376 H377 M378 C380	L354-L374 HydrophobicContact CB-CD2 4.28Å; L354-L374 HydrophobicContact CD1-CD2 3.73Å; F356-L374 HydrophobicContact CB-CB 4.19Å; F356-L374 HydrophobicContact CB-CD1 4.19Å; F356-L374 HydrophobicContact CD2-CD1 4.39Å; F357-L374 CarbonylContact O-C 3.58Å; F357-L374 WeakPolarHBondContact O-CA 3.26Å; V358-L374 HydrophobicContact CB-CD2 4.45Å; V358-L374 HydrophobicContact CG2-CD2 3.97Å; L374-N376 VanDerWaalsContact CB-OD1 3.31Å; L374-N376 WeakPolarHBondContact CB-OD1 3.49Å; L374-N376 PolarHBondContact O-N 3.1Å; L374-H377 PolarHBondContact O-N 3.12Å; L374-H377 VanDerWaalsContact O-N 3.09Å; L374-M378 HydrophobicContact CB-CB 4.38Å; L374-M378 WeakPolarHBondContact CB-O 3.36Å; L374-M378 HydrophobicContact CD1-CB 4.08Å; L374-M378 HydrophobicContact CD1-CE 3.65Å; L374-M378 PolarHBondContact N-O 3.42Å; L374-C380 WeakPolarHBondContact CD1-SG 3.24Å
375	S	90.1	Very high	86.2	Confident	11 Å²	11	35.7 Å²	35.7	8%	0.077	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-16.7	-178.2	65.4	0	0	0	0	114.7	F357 N359	F357-S375 PolarHBondContact O-N 3Å; N359-S375 WeakPolarHBondContact ND2-CA 3.31Å
376	N	87	Confident	84.9	Confident	39 Å²	39	42.4 Å²	42.4	21%	0.209	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99	18	175.8	74.5	-32.7	0	0	0	112.9	F356 L374 M378	F356-N376 HydrophobicContact CD1-CB 3.83Å; F356-N376 WeakPolarHBondContact CD2-ND2 3.28Å; F356-N376 HydrophobicContact CE1-CB 4.02Å; F356-N376 WeakPolarHBondContact CE2-ND2 3.3Å; F356-N376 HydrophobicContact CG-CB 4.18Å; F356-N376 VanDerWaalsContact CZ-ND2 3.34Å; F356-N376 WeakPolarHBondContact CZ-ND2 3.19Å; L374-N376 VanDerWaalsContact CB-OD1 3.31Å; L374-N376 WeakPolarHBondContact CB-OD1 3.49Å; L374-N376 PolarHBondContact O-N 3.1Å; N376-M378 VanDerWaalsContact C-N 3.27Å; N376-M378 VanDerWaalsContact ND2-CE 3.29Å; N376-M378 WeakPolarHBondContact ND2-CE 3.21Å; N376-M378 WeakPolarHBondContact ND2-CG 3.46Å; N376-M378 PolarHBondContact ND2-SD 3.22Å; N376-M378 PolarHBondContact O-N 2.97Å; N376-M378 PolarHBondContact OD1-N 2.93Å
377	H	86.8	Confident	83.5	Confident	50 Å²	50	46.4 Å²	46.4	23%	0.231	22%	0.22	C	C	.	.	S	Bend	trans	68.2	16.4	179.7	-41.9	-59	0	0	0	115.5	L374 L396 P405 W407	L374-H377 PolarHBondContact O-N 3.12Å; L374-H377 VanDerWaalsContact O-N 3.09Å; H377-L396 VanDerWaalsContact O-CB 3.25Å; H377-L396 WeakPolarHBondContact O-CB 3.41Å; H377-L396 WeakPolarHBondContact O-CD1 3.31Å; H377-L396 WeakPolarHBondContact O-CG 3.34Å; H377-L396 PolarHBondContact O-N 3.4Å; H377-P405 PolarHBondContact CE1-O 2.9Å; H377-W407 AromaticContact CG-CD1 3.96Å; H377-W407 AromaticContact ND1-CD1 3.54Å
378	M	89.6	Confident	82.3	Confident	27 Å²	27	47.3 Å²	47.3	13%	0.133	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	149.7	167.3	-63.5	-172.8	-39.8	0	0	111.3	F356 L374 N376 V394 N395	F356-M378 HydrophobicContact CD2-CE 3.34Å; F356-M378 HydrophobicContact CE2-CE 3.43Å; F356-M378 VanDerWaalsContact CE2-CE 3.43Å; F356-M378 HydrophobicContact CE2-SD 4.41Å; F356-M378 HydrophobicContact CG-CE 4.45Å; L374-M378 HydrophobicContact CB-CB 4.38Å; L374-M378 WeakPolarHBondContact CB-O 3.36Å; L374-M378 HydrophobicContact CD1-CB 4.08Å; L374-M378 HydrophobicContact CD1-CE 3.65Å; L374-M378 PolarHBondContact N-O 3.42Å; N376-M378 VanDerWaalsContact C-N 3.27Å; N376-M378 VanDerWaalsContact ND2-CE 3.29Å; N376-M378 WeakPolarHBondContact ND2-CE 3.21Å; N376-M378 WeakPolarHBondContact ND2-CG 3.46Å; N376-M378 PolarHBondContact ND2-SD 3.22Å; N376-M378 PolarHBondContact O-N 2.97Å; N376-M378 PolarHBondContact OD1-N 2.93Å; M378-V394 WeakPolarHBondContact CA-O 3.35Å; M378-N395 HydrophobicContact CG-CB 4.47Å
379	I	91.9	Very high	81.6	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	134.5	168.9	-56	-178.9	0	0	0	108.9	A372 L373 T393 V394 L396 L410 L418 L420 L433 W437	A372-I379 CarbonylContact O-C 3.55Å; A372-I379 VanDerWaalsContact O-CA 3.29Å; A372-I379 WeakPolarHBondContact O-CA 3.43Å; L373-I379 HydrophobicContact CD1-CG1 4.25Å; I379-T393 CarbonylContact O-C 3.54Å; I379-T393 WeakPolarHBondContact O-CA 3.44Å; I379-V394 HydrophobicContact CB-CG2 3.92Å; I379-V394 PolarHBondContact N-O 3.41Å; I379-V394 PolarHBondContact O-N 2.98Å; I379-L396 HydrophobicContact CD1-CD1 3.97Å; I379-L396 HydrophobicContact CD1-CD2 3.76Å; I379-L396 HydrophobicContact CD1-CG 4.15Å; I379-L396 HydrophobicContact CG1-CD1 3.94Å; I379-L396 HydrophobicContact CG1-CD2 4.18Å; I379-L396 HydrophobicContact CG1-CG 4.08Å; I379-L410 HydrophobicContact CD1-CD1 4.38Å; I379-L418 HydrophobicContact CD1-CD1 4.12Å; I379-L418 HydrophobicContact CG2-CD1 3.77Å; I379-L420 HydrophobicContact CD1-CD1 3.67Å; I379-L433 HydrophobicContact CD1-CD1 3.49Å; I379-L433 VanDerWaalsContact CD1-CD1 3.49Å; I379-W437 HydrophobicContact CG2-CH2 4.01Å
380	C	91.3	Very high	81	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	140.6	172.9	-54.2	0	0	0	0	110.9	Y371 A372 L374 T392 T393	Y371-C380 CarbonylContact C-O 3.52Å; Y371-C380 WeakPolarHBondContact CA-O 3.4Å; A372-C380 HydrophobicContact CB-CB 4.25Å; A372-C380 PolarHBondContact N-O 3.27Å; A372-C380 PolarHBondContact O-N 2.8Å; L374-C380 WeakPolarHBondContact CD1-SG 3.24Å; C380-T392 CarbonylContact C-O 3.52Å; C380-T392 VanDerWaalsContact CA-O 3.26Å; C380-T392 WeakPolarHBondContact CA-O 3.45Å; C380-T393 HydrophobicContact CB-CG2 4.5Å; C380-T393 VanDerWaalsContact SG-CG2 3.58Å
381	C	90.5	Very high	80.5	Confident	13 Å²	13	51.4 Å²	51.4	9%	0.088	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	122.4	158.4	178.9	0	0	0	0	108	Y371 Y391 T392 W437	Y371-C381 HydrophobicContact CD1-CB 3.96Å; Y371-C381 HydrophobicContact CE1-CB 3.83Å; C381-Y391 CarbonylContact O-C 3.59Å; C381-Y391 WeakPolarHBondContact O-CA 3.35Å; C381-Y391 WeakPolarHBondContact O-CB 3.38Å; C381-T392 PolarHBondContact N-O 3.24Å; C381-T392 PolarHBondContact O-N 3.12Å; C381-W437 HydrophobicContact CB-CD2 3.58Å; C381-W437 HydrophobicContact CB-CE3 3.36Å; C381-W437 HydrophobicContact CB-CG 4.45Å; C381-W437 HydrophobicContact CB-CH2 3.51Å; C381-W437 HydrophobicContact CB-CZ2 3.72Å; C381-W437 HydrophobicContact CB-CZ3 3.32Å
382	I	88	Confident	80.1	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	115.2	178.8	-60.7	157.6	0	0	0	106.7	I352 L354 E369 L370 A372	I352-I382 HydrophobicContact CD1-CB 4.4Å; I352-I382 HydrophobicContact CD1-CG1 4.12Å; I352-I382 HydrophobicContact CD1-CG2 3.5Å; I352-I382 VanDerWaalsContact CD1-CG2 3.5Å; I352-I382 HydrophobicContact CG2-CD1 3.97Å; I352-I382 HydrophobicContact CG2-CG2 4.4Å; L354-I382 HydrophobicContact CD1-CD1 4.19Å; L354-I382 HydrophobicContact CD2-CD1 4.35Å; L354-I382 HydrophobicContact CD2-CG1 4.42Å; E369-I382 WeakPolarHBondContact CA-O 3.48Å; L370-I382 HydrophobicContact CB-CB 4.31Å; L370-I382 HydrophobicContact CD2-CD1 4.02Å; L370-I382 PolarHBondContact N-O 3.42Å; L370-I382 WeakPolarHBondContact O-CB 3.12Å; L370-I382 PolarHBondContact O-N 3.01Å; A372-I382 HydrophobicContact CB-CD1 4.25Å
383	S	83.4	Confident	79.8	Confident	40 Å²	40	55.7 Å²	55.7	28%	0.28	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	125.6	174.1	-177.4	0	0	0	0	109.5	E385 I390	S383-E385 PolarHBondContact O-N 3.42Å; S383-I390 PolarHBondContact N-O 3.23Å; S383-I390 PolarHBondContact O-N 3.32Å
384	R	73.2	Confident	79.5	Confident	64 Å²	64	55.7 Å²	55.7	24%	0.242	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	89.3	179.9	-61.9	-176.5	72.6	-152.6	-2.8	109.7	D368 E389	D368-R384 PolarHBondContact O-N 3.44Å; R384-E389 IonicContact CZ-OE1 3.2Å; R384-E389 IonicContact NE-OE1 3.89Å; R384-E389 PolarHBondContact NE-OE1 2.74Å; R384-E389 IonicContact NH2-OE1 3.34Å
385	E	63.1	Low	79	Confident	126 Å²	126	58.8 Å²	58.8	59%	0.589	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.6	147.1	166.8	-67.5	-168.9	170.4	0	0	110.4	S383 D387 S388	S383-E385 PolarHBondContact O-N 3.42Å; E385-D387 PolarHBondContact O-N 2.97Å; E385-S388 PolarHBondContact O-N 3Å; E385-S388 VanDerWaalsContact O-N 3.14Å
386	R	54.8	Low	78.6	Confident	250 Å²	250	59 Å²	59	94%	0.943	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-22.6	-164.1	-67.7	-177.9	-171.1	173.4	4.1	116.1
387	D	51.2	Low	77.7	Confident	166 Å²	166	64.2 Å²	64.2	89%	0.888	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.4	-3.2	-175.8	-66.1	-44.5	0	0	0	114.3	E385	E385-D387 PolarHBondContact O-N 2.97Å
388	S	54.6	Low	76.7	Confident	60 Å²	60	65.4 Å²	65.4	42%	0.42	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	129.2	178.5	57.2	0	0	0	0	111.7	E385	E385-S388 PolarHBondContact O-N 3Å; E385-S388 VanDerWaalsContact O-N 3.14Å
389	E	64.4	Low	75.4	Confident	63 Å²	63	72.5 Å²	72.5	29%	0.294	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	113.7	172	-61.4	-176	158.6	0	0	108.1	I352 R384	I352-E389 WeakPolarHBondContact CB-OE2 3.26Å; I352-E389 HydrophobicContact CD1-CB 3.94Å; I352-E389 HydrophobicContact CG1-CB 4.4Å; R384-E389 IonicContact CZ-OE1 3.2Å; R384-E389 IonicContact NE-OE1 3.89Å; R384-E389 PolarHBondContact NE-OE1 2.74Å; R384-E389 IonicContact NH2-OE1 3.34Å
390	I	74.7	Confident	74.7	Confident	98 Å²	98	76.9 Å²	76.9	50%	0.503	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	138.5	177.5	-56.9	173.1	0	0	0	107	S383	S383-I390 PolarHBondContact N-O 3.23Å; S383-I390 PolarHBondContact O-N 3.32Å
391	Y	81	Confident	74.3	Confident	66 Å²	66	78.5 Å²	78.5	26%	0.259	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	146.6	171.3	67.2	-87.6	0	0	0	111.4	I352 L354 D355 C381 T393	I352-Y391 HydrophobicContact CD1-CD1 3.9Å; I352-Y391 HydrophobicContact CG1-CD1 4.46Å; L354-Y391 HydrophobicContact CD2-CD1 3.87Å; L354-Y391 HydrophobicContact CD2-CD2 4.03Å; L354-Y391 HydrophobicContact CD2-CE1 4.08Å; L354-Y391 HydrophobicContact CD2-CE2 4.24Å; L354-Y391 HydrophobicContact CD2-CG 3.85Å; D355-Y391 VanDerWaalsContact CG-OH 3.24Å; D355-Y391 PolarHBondContact OD1-OH 3.06Å; D355-Y391 PolarHBondContact OD2-OH 2.88Å; C381-Y391 CarbonylContact O-C 3.59Å; C381-Y391 WeakPolarHBondContact O-CA 3.35Å; C381-Y391 WeakPolarHBondContact O-CB 3.38Å; Y391-T393 HydrophobicContact CD2-CG2 3.68Å; Y391-T393 HydrophobicContact CE2-CG2 3.75Å
392	T	84.5	Confident	73.9	Confident	45 Å²	45	79.6 Å²	79.6	28%	0.276	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	139.4	172.1	48.7	0	0	0	0	109.2	C380 C381	C380-T392 CarbonylContact C-O 3.52Å; C380-T392 VanDerWaalsContact CA-O 3.26Å; C380-T392 WeakPolarHBondContact CA-O 3.45Å; C381-T392 PolarHBondContact N-O 3.24Å; C381-T392 PolarHBondContact O-N 3.12Å
393	T	87.9	Confident	73.6	Confident	48 Å²	48	85.7 Å²	85.7	29%	0.294	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	140.1	-175.5	59.9	0	0	0	0	111	I379 C380 Y391	I379-T393 CarbonylContact O-C 3.54Å; I379-T393 WeakPolarHBondContact O-CA 3.44Å; C380-T393 HydrophobicContact CB-CG2 4.5Å; C380-T393 VanDerWaalsContact SG-CG2 3.58Å; Y391-T393 HydrophobicContact CD2-CG2 3.68Å; Y391-T393 HydrophobicContact CE2-CG2 3.75Å
394	V	88	Confident	73.7	Confident	2 Å²	2	85.2 Å²	85.2	1%	0.012	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	142	170.8	-62.8	0	0	0	0	109.7	M378 I379 V435 W437 C440 V442	M378-V394 WeakPolarHBondContact CA-O 3.35Å; I379-V394 HydrophobicContact CB-CG2 3.92Å; I379-V394 PolarHBondContact N-O 3.41Å; I379-V394 PolarHBondContact O-N 2.98Å; V394-V435 HydrophobicContact CG1-CG1 4Å; V394-V435 HydrophobicContact CG2-CG1 4.08Å; V394-W437 HydrophobicContact CG1-CE3 4.31Å; V394-W437 HydrophobicContact CG1-CZ3 4.17Å; V394-W437 HydrophobicContact CG2-CH2 4.26Å; V394-W437 HydrophobicContact CG2-CZ3 4.07Å; V394-C440 HydrophobicContact CG1-CB 4.47Å; V394-V442 HydrophobicContact CB-CB 3.99Å; V394-V442 HydrophobicContact CB-CG1 3.82Å; V394-V442 HydrophobicContact CG2-CB 3.94Å; V394-V442 HydrophobicContact CG2-CG1 4.01Å
395	N	84	Confident	74.4	Confident	67 Å²	67	82.8 Å²	82.8	36%	0.358	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	128.8	-177.7	-171.8	-4.1	0	0	0	110.2	M378 E397 V442	M378-N395 HydrophobicContact CG-CB 4.47Å; N395-E397 VanDerWaalsContact C-N 3.26Å; N395-E397 VanDerWaalsContact ND2-CD 3.29Å; N395-E397 PolarHBondContact ND2-OE2 3.44Å; N395-E397 PolarHBondContact O-N 2.98Å; N395-E397 WeakPolarHBondContact OD1-CB 3.5Å; N395-E397 VanDerWaalsContact OD1-CG 3.26Å; N395-E397 WeakPolarHBondContact OD1-CG 3.23Å; N395-E397 PolarHBondContact OD1-N 2.86Å; N395-V442 WeakPolarHBondContact O-CG1 3.34Å
396	L	81.6	Confident	75.7	Confident	14 Å²	14	78.1 Å²	78.1	7%	0.073	40%	0.396	C	S	.	.			trans	-80.8	-4.5	177.5	-62.8	177.5	0	0	0	113.8	L373 H377 I379 N398 W407 L433 V442	L373-L396 HydrophobicContact CD1-CD1 4.34Å; H377-L396 VanDerWaalsContact O-CB 3.25Å; H377-L396 WeakPolarHBondContact O-CB 3.41Å; H377-L396 WeakPolarHBondContact O-CD1 3.31Å; H377-L396 WeakPolarHBondContact O-CG 3.34Å; H377-L396 PolarHBondContact O-N 3.4Å; I379-L396 HydrophobicContact CD1-CD1 3.97Å; I379-L396 HydrophobicContact CD1-CD2 3.76Å; I379-L396 HydrophobicContact CD1-CG 4.15Å; I379-L396 HydrophobicContact CG1-CD1 3.94Å; I379-L396 HydrophobicContact CG1-CD2 4.18Å; I379-L396 HydrophobicContact CG1-CG 4.08Å; L396-N398 PolarHBondContact O-N 3.4Å; L396-N398 VanDerWaalsContact O-N 3.16Å; L396-W407 HydrophobicContact CD1-CD2 3.98Å; L396-W407 HydrophobicContact CD1-CE3 4.37Å; L396-W407 HydrophobicContact CD1-CG 4.2Å; L396-L433 HydrophobicContact CD2-CD1 3.35Å; L396-L433 HydrophobicContact CD2-CD2 4.14Å; L396-L433 HydrophobicContact CD2-CG 4.4Å; L396-V442 HydrophobicContact CD2-CG1 4.28Å; L396-V442 HydrophobicContact CD2-CG2 4.07Å
397	E	67.2	Low	77.4	Confident	150 Å²	150	67.1 Å²	67.1	70%	0.701	36%	0.355	S	S	*	.			trans	-53.5	121.9	-179.8	-80.1	173.5	176.9	0	0	111.3	N395	N395-E397 VanDerWaalsContact C-N 3.26Å; N395-E397 VanDerWaalsContact ND2-CD 3.29Å; N395-E397 PolarHBondContact ND2-OE2 3.44Å; N395-E397 PolarHBondContact O-N 2.98Å; N395-E397 WeakPolarHBondContact OD1-CB 3.5Å; N395-E397 VanDerWaalsContact OD1-CG 3.26Å; N395-E397 WeakPolarHBondContact OD1-CG 3.23Å; N395-E397 PolarHBondContact OD1-N 2.86Å
398	N	65	Low	79.4	Confident	75 Å²	75	61 Å²	61	40%	0.401	32%	0.319	S	S	.	.			trans	-133.8	128.9	176.8	-176.7	-18.2	0	0	0	106.3	L396 T400 L401	L396-N398 PolarHBondContact O-N 3.4Å; L396-N398 VanDerWaalsContact O-N 3.16Å; N398-T400 PolarHBondContact ND2-OG1 3.45Å; N398-T400 PolarHBondContact O-N 3.4Å; N398-T400 PolarHBondContact OD1-N 3Å; N398-T400 PolarHBondContact OD1-OG1 2.97Å; N398-L401 HydrophobicContact CB-CD1 4.26Å; N398-L401 HydrophobicContact CB-CG 4.33Å; N398-L401 PolarHBondContact O-N 2.97Å; N398-L401 VanDerWaalsContact O-N 3.09Å
399	D	63.7	Low	81.2	Confident	176 Å²	176	59.2 Å²	59.2	94%	0.941	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-10.5	-176.4	-67.1	-26.8	0	0	0	114.1
400	T	77.3	Confident	82.6	Confident	91 Å²	91	56.6 Å²	56.6	56%	0.558	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-18.5	-178.2	54.7	0	0	0	0	115.1	N398 R425	N398-T400 PolarHBondContact ND2-OG1 3.45Å; N398-T400 PolarHBondContact O-N 3.4Å; N398-T400 PolarHBondContact OD1-N 3Å; N398-T400 PolarHBondContact OD1-OG1 2.97Å; T400-R425 PolarHBondContact O-NH2 3.27Å
401	L	82.4	Confident	83.5	Confident	34 Å²	34	52.2 Å²	52.2	18%	0.178	27%	0.271	C	S	.	.	S	Bend	trans	-74	157.7	-177.6	-63.4	172.8	0	0	0	111.7	N398 P405 W407 L422	N398-L401 HydrophobicContact CB-CD1 4.26Å; N398-L401 HydrophobicContact CB-CG 4.33Å; N398-L401 PolarHBondContact O-N 2.97Å; N398-L401 VanDerWaalsContact O-N 3.09Å; L401-P405 HydrophobicContact CB-CB 4.45Å; L401-P405 HydrophobicContact CB-CG 4.41Å; L401-P405 HydrophobicContact CD1-CG 4.45Å; L401-W407 HydrophobicContact CD1-CZ2 3.91Å; L401-W407 HydrophobicContact CD2-CZ2 4.47Å; L401-L422 HydrophobicContact CD2-CD2 3.58Å
402	S	83	Confident	84	Confident	36 Å²	36	49.5 Å²	49.5	25%	0.252	26%	0.261	S	S	.	.			trans	-68.7	172.2	167.5	81	0	0	0	0	112.2	N404 P405 D424	S402-N404 PolarHBondContact O-N 2.83Å; S402-N404 PolarHBondContact OG-N 3.4Å; S402-P405 WeakPolarHBondContact O-CD 3.37Å; S402-D424 WeakPolarHBondContact CB-OD1 3.49Å; S402-D424 PolarHBondContact N-OD2 3.33Å; S402-D424 PolarHBondContact OG-OD1 3.2Å
403	E	80.8	Confident	84.3	Confident	129 Å²	129	47.5 Å²	47.5	60%	0.603	25%	0.248	S	C	*	.	S	Bend	trans	-65.5	-20.8	176.8	-65.5	167.6	167.3	0	0	113.2	V282 P284	V282-E403 HydrophobicContact CG2-CB 4.29Å; V282-E403 VanDerWaalsContact CG2-O 3.27Å; V282-E403 WeakPolarHBondContact CG2-O 3.47Å; P284-E403 WeakPolarHBondContact CD-OE2 3.44Å
404	N	85.3	Confident	84.4	Confident	30 Å²	30	47.4 Å²	47.4	16%	0.16	25%	0.246	C	C	.	.	S	Bend	trans	-132.9	61.4	-176.3	-71	-79.9	0	0	0	112.1	F281 V282 K285 S402	F281-N404 WeakPolarHBondContact CA-OD1 3.14Å; V282-N404 PolarHBondContact N-OD1 2.95Å; V282-N404 PolarHBondContact O-ND2 2.78Å; K285-N404 HydrophobicContact CD-CB 4.43Å; S402-N404 PolarHBondContact O-N 2.83Å; S402-N404 PolarHBondContact OG-N 3.4Å
405	P	88.5	Confident	84.2	Confident	13 Å²	13	52.7 Å²	52.7	8%	0.084	27%	0.271	C	S	.	.			trans	-75.5	139.8	178	32.3	-28.6	0	0	0	110.1	H377 L401 S402 L422	H377-P405 PolarHBondContact CE1-O 2.9Å; L401-P405 HydrophobicContact CB-CB 4.45Å; L401-P405 HydrophobicContact CB-CG 4.41Å; L401-P405 HydrophobicContact CD1-CG 4.45Å; S402-P405 WeakPolarHBondContact O-CD 3.37Å; P405-L422 HydrophobicContact CB-CD1 3.76Å
406	F	88.8	Confident	84.5	Confident	28 Å²	28	54.7 Å²	54.7	12%	0.123	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	103.2	-179.9	-172.4	-94.8	0	0	0	111.4	L279 L310 L312 Y408 N423	L279-F406 HydrophobicContact CD1-CE2 4.07Å; L279-F406 HydrophobicContact CD2-CE2 3.59Å; L279-F406 HydrophobicContact CD2-CZ 4.28Å; L279-F406 HydrophobicContact CG-CE2 4.41Å; L310-F406 HydrophobicContact CD2-CD2 4.28Å; L310-F406 HydrophobicContact CD2-CE2 4.37Å; L312-F406 HydrophobicContact CD2-CE1 4.07Å; L312-F406 HydrophobicContact CD2-CE2 4.26Å; L312-F406 HydrophobicContact CD2-CZ 3.66Å; F406-Y408 AromaticContact CD1-CD1 3.56Å; F406-Y408 HydrophobicContact CD1-CD1 3.56Å; F406-Y408 HydrophobicContact CD1-CE1 4.17Å; F406-Y408 HydrophobicContact CD1-CG 4.23Å; F406-Y408 AromaticContact CE1-CD1 3.65Å; F406-Y408 HydrophobicContact CE1-CD1 3.65Å; F406-Y408 HydrophobicContact CE1-CE1 4.4Å; F406-Y408 AromaticContact CE1-CG 3.86Å; F406-Y408 HydrophobicContact CE1-CG 3.86Å; F406-N423 HydrophobicContact CB-CB 4.27Å; F406-N423 PolarHBondContact N-O 3.41Å; F406-N423 PolarHBondContact O-N 3.28Å
407	W	91.8	Very high	84.9	Confident	19 Å²	19	54.8 Å²	54.8	7%	0.072	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	134.5	175.8	-64.7	95.1	0	0	0	111.4	L373 H377 L396 L401 L420 L421 L422 V431	L373-W407 HydrophobicContact CD1-CB 4.39Å; L373-W407 HydrophobicContact CD2-CB 4.16Å; H377-W407 AromaticContact CG-CD1 3.96Å; H377-W407 AromaticContact ND1-CD1 3.54Å; L396-W407 HydrophobicContact CD1-CD2 3.98Å; L396-W407 HydrophobicContact CD1-CE3 4.37Å; L396-W407 HydrophobicContact CD1-CG 4.2Å; L401-W407 HydrophobicContact CD1-CZ2 3.91Å; L401-W407 HydrophobicContact CD2-CZ2 4.47Å; W407-L420 HydrophobicContact CB-CD2 4.45Å; W407-L420 HydrophobicContact CE3-CB 3.84Å; W407-L420 HydrophobicContact CE3-CD2 4.34Å; W407-L420 HydrophobicContact CZ3-CB 4.13Å; W407-L421 WeakPolarHBondContact CA-O 3.4Å; W407-L422 HydrophobicContact CD2-CB 4.35Å; W407-L422 HydrophobicContact CD2-CD1 3.92Å; W407-L422 HydrophobicContact CE3-CB 3.89Å; W407-L422 HydrophobicContact CE3-CD1 4.33Å; W407-L422 HydrophobicContact CG-CD1 4.37Å; W407-L422 HydrophobicContact CH2-CB 4.03Å; W407-L422 HydrophobicContact CH2-CD1 4.34Å; W407-L422 HydrophobicContact CH2-CD2 3.91Å; W407-L422 HydrophobicContact CH2-CG 4.31Å; W407-L422 HydrophobicContact CZ2-CB 4.45Å; W407-L422 HydrophobicContact CZ2-CD1 3.9Å; W407-L422 HydrophobicContact CZ2-CD2 3.97Å; W407-L422 HydrophobicContact CZ2-CG 4.32Å; W407-L422 HydrophobicContact CZ3-CB 3.74Å; W407-L422 HydrophobicContact CZ3-CD2 4.47Å; W407-L422 HydrophobicContact CZ3-CG 4.46Å; W407-V431 HydrophobicContact CH2-CB 4.34Å; W407-V431 HydrophobicContact CH2-CG1 4.17Å; W407-V431 HydrophobicContact CH2-CG2 4.02Å; W407-V431 HydrophobicContact CZ3-CB 3.91Å; W407-V431 HydrophobicContact CZ3-CG1 4.15Å; W407-V431 HydrophobicContact CZ3-CG2 3.77Å
408	Y	92.1	Very high	86.2	Confident	37 Å²	37	47.7 Å²	47.7	15%	0.145	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	171.1	177.9	69	-74.9	0	0	0	112.3	F406 L421 L428	F406-Y408 AromaticContact CD1-CD1 3.56Å; F406-Y408 HydrophobicContact CD1-CD1 3.56Å; F406-Y408 HydrophobicContact CD1-CE1 4.17Å; F406-Y408 HydrophobicContact CD1-CG 4.23Å; F406-Y408 AromaticContact CE1-CD1 3.65Å; F406-Y408 HydrophobicContact CE1-CD1 3.65Å; F406-Y408 HydrophobicContact CE1-CE1 4.4Å; F406-Y408 AromaticContact CE1-CG 3.86Å; F406-Y408 HydrophobicContact CE1-CG 3.86Å; Y408-L421 HydrophobicContact CD1-CB 3.87Å; Y408-L421 HydrophobicContact CD2-CB 4.25Å; Y408-L421 HydrophobicContact CD2-CD1 4.07Å; Y408-L421 HydrophobicContact CE1-CB 3.52Å; Y408-L421 HydrophobicContact CE1-CD1 4.43Å; Y408-L421 HydrophobicContact CE2-CB 3.92Å; Y408-L421 HydrophobicContact CE2-CD1 3.38Å; Y408-L421 HydrophobicContact CE2-CG 4.31Å; Y408-L421 HydrophobicContact CG-CB 4.23Å; Y408-L421 PolarHBondContact N-O 3.26Å; Y408-L421 PolarHBondContact O-N 3.22Å; Y408-L428 HydrophobicContact CE1-CD1 3.95Å; Y408-L428 WeakPolarHBondContact OH-CD1 3.37Å
409	N	92.3	Very high	87.6	Confident	22 Å²	22	44.1 Å²	44.1	12%	0.118	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	59.1	54.2	178.5	-168.8	-133.9	0	0	0	114.3	E360 S411 L421 V457	E360-N409 VanDerWaalsContact CD-N 3.33Å; E360-N409 PolarHBondContact OE1-N 2.78Å; E360-N409 WeakPolarHBondContact OE2-CA 3.44Å; E360-N409 PolarHBondContact OE2-N 3.37Å; N409-S411 PolarHBondContact O-N 3.49Å; N409-S411 PolarHBondContact O-OG 2.83Å; N409-L421 HydrophobicContact CB-CD1 3.85Å; N409-L421 HydrophobicContact CB-CG 4.34Å; N409-V457 PolarHBondContact ND2-O 3.1Å; N409-V457 VanDerWaalsContact OD1-CA 3.25Å; N409-V457 WeakPolarHBondContact OD1-CA 3.19Å; N409-V457 WeakPolarHBondContact OD1-CB 3.33Å; N409-V457 WeakPolarHBondContact OD1-CG2 3.48Å; N409-V457 PolarHBondContact OD1-N 2.95Å; N409-V457 PolarHBondContact OD1-O 3.39Å
410	L	93.9	Very high	89	Confident	8 Å²	8	35.8 Å²	35.8	4%	0.042	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	118.4	176.4	176.3	66.2	0	0	0	111.4	E360 T362 L373 I379 L418 L420	E360-L410 PolarHBondContact OE2-N 3.27Å; T362-L410 WeakPolarHBondContact CB-O 3.1Å; T362-L410 HydrophobicContact CG2-CD2 4.14Å; T362-L410 HydrophobicContact CG2-CG 3.84Å; L373-L410 HydrophobicContact CB-CB 4.29Å; L373-L410 HydrophobicContact CB-CD2 4.06Å; I379-L410 HydrophobicContact CD1-CD1 4.38Å; L410-L418 HydrophobicContact CD1-CD1 4.24Å; L410-L420 HydrophobicContact CB-CD2 4.18Å; L410-L420 HydrophobicContact CB-CG 4.47Å; L410-L420 HydrophobicContact CD1-CD1 3.8Å; L410-L420 HydrophobicContact CD1-CD2 4.05Å; L410-L420 HydrophobicContact CD1-CG 3.9Å
411	S	93.5	Very high	89.8	Confident	7 Å²	7	31.4 Å²	31.4	5%	0.049	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	130.4	-179.9	-56.2	0	0	0	0	111.2	N409 L419	N409-S411 PolarHBondContact O-N 3.49Å; N409-S411 PolarHBondContact O-OG 2.83Å; S411-L419 PolarHBondContact N-O 3.13Å; S411-L419 PolarHBondContact O-N 2.9Å
412	Y	92.2	Very high	90.3	Very high	8 Å²	8	29.9 Å²	29.9	3%	0.031	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	141.7	174.6	173.3	-105.7	0	0	0	110.4	H365 Y371 D414 Q415 L418 Y461	H365-Y412 HydrophobicContact CB-CE1 4.06Å; Y371-Y412 AromaticContact CD2-CD2 3.77Å; Y371-Y412 HydrophobicContact CD2-CD2 3.77Å; Y371-Y412 HydrophobicContact CD2-CG 4.3Å; Y371-Y412 AromaticContact CE2-CD2 3.14Å; Y371-Y412 HydrophobicContact CE2-CD2 3.14Å; Y371-Y412 AromaticContact CE2-CE2 3.5Å; Y371-Y412 HydrophobicContact CE2-CE2 3.5Å; Y371-Y412 AromaticContact CE2-CG 3.95Å; Y371-Y412 HydrophobicContact CE2-CG 3.95Å; Y371-Y412 AromaticContact CZ-CD2 3.7Å; Y371-Y412 AromaticContact CZ-CE2 3.71Å; Y371-Y412 WeakPolarHBondContact OH-CE2 3.27Å; Y412-D414 WeakPolarHBondContact CE2-O 3.41Å; Y412-D414 VanDerWaalsContact CZ-CA 3.5Å; Y412-D414 VanDerWaalsContact OH-C 3.25Å; Y412-D414 WeakPolarHBondContact OH-CA 3.48Å; Y412-Q415 PolarHBondContact OH-N 2.88Å; Y412-L418 HydrophobicContact CD2-CD2 3.96Å; Y412-Y461 AromaticContact CD1-CE1 3.54Å; Y412-Y461 HydrophobicContact CD1-CE1 3.54Å; Y412-Y461 AromaticContact CD1-CZ 3.62Å; Y412-Y461 VanDerWaalsContact CD1-OH 3.29Å; Y412-Y461 WeakPolarHBondContact CD1-OH 3.48Å; Y412-Y461 AromaticContact CE1-CE1 3.85Å; Y412-Y461 HydrophobicContact CE1-CE1 3.85Å; Y412-Y461 PolarHBondContact O-OH 3.16Å
413	V	91.3	Very high	90.6	Very high	3 Å²	3	30 Å²	30	2%	0.018	14%	0.144	C	C	.	.			trans	-118.2	-60	171.6	-175.7	0	0	0	0	109.4	H417 L419 Y461 V466 I468 L482	V413-H417 HydrophobicContact CB-CB 4.2Å; V413-H417 WeakPolarHBondContact CB-O 3.34Å; V413-H417 PolarHBondContact N-O 3.17Å; V413-H417 VanDerWaalsContact N-O 3.09Å; V413-L419 HydrophobicContact CG2-CB 3.97Å; V413-Y461 WeakPolarHBondContact O-CE1 3.48Å; V413-V466 HydrophobicContact CG1-CB 3.97Å; V413-V466 HydrophobicContact CG1-CG1 4.08Å; V413-V466 HydrophobicContact CG1-CG2 4.26Å; V413-V466 WeakPolarHBondContact O-CG2 3.48Å; V413-I468 HydrophobicContact CG2-CD1 4.47Å; V413-L482 HydrophobicContact CG1-CB 4.16Å; V413-L482 HydrophobicContact CG1-CD1 4.2Å; V413-L482 HydrophobicContact CG1-CD2 3.89Å; V413-L482 HydrophobicContact CG1-CG 4.3Å
414	D	88.8	Confident	91	Very high	47 Å²	47	24.6 Å²	24.6	25%	0.251	12%	0.119	S	C	.	.	S	Bend	trans	-148.8	-177.4	173.4	65.9	43.2	0	0	0	110.2	Y412 H416 H417 L482	Y412-D414 WeakPolarHBondContact CE2-O 3.41Å; Y412-D414 VanDerWaalsContact CZ-CA 3.5Å; Y412-D414 VanDerWaalsContact OH-C 3.25Å; Y412-D414 WeakPolarHBondContact OH-CA 3.48Å; D414-H416 PolarHBondContact O-N 3.02Å; D414-H416 WeakPolarHBondContact OD1-CA 2.95Å; D414-H416 PolarHBondContact OD1-N 3.32Å; D414-H417 VanDerWaalsContact CG-ND1 3.32Å; D414-H417 PolarHBondContact N-O 3.07Å; D414-H417 VanDerWaalsContact N-O 3.15Å; D414-H417 PolarHBondContact O-N 3.23Å; D414-H417 VanDerWaalsContact O-O 3.12Å; D414-H417 IonicContact OD1-CG 3.89Å; D414-H417 PolarHBondContact OD1-N 3.04Å; D414-H417 IonicContact OD1-ND1 3.67Å; D414-H417 PolarHBondContact OD1-ND1 3.3Å; D414-H417 IonicContact OD2-CE1 3.68Å; D414-H417 IonicContact OD2-CG 2.84Å; D414-H417 IonicContact OD2-ND1 3.28Å; D414-H417 PolarHBondContact OD2-ND1 3.2Å; D414-L482 WeakPolarHBondContact OD2-CD2 3.41Å
415	Q	85.3	Confident	90.9	Very high	113 Å²	113	31.9 Å²	31.9	53%	0.528	14%	0.144	S	C	.	.	S	Bend	trans	-58.8	-21.7	-176.5	-68.7	-176.2	-31	0	0	113.8	Y412 W437	Y412-Q415 PolarHBondContact OH-N 2.88Å; Q415-W437 PolarHBondContact O-NE1 3.4Å
416	H	88.8	Confident	90.4	Very high	108 Å²	108	36.7 Å²	36.7	50%	0.5	18%	0.178	S	C	.	.	S	Bend	trans	-109.6	-20.7	-178.9	-58.7	-58.2	0	0	0	112.9	D414 E434 V435	D414-H416 PolarHBondContact O-N 3.02Å; D414-H416 WeakPolarHBondContact OD1-CA 2.95Å; D414-H416 PolarHBondContact OD1-N 3.32Å; H416-E434 CarbonylContact O-C 3.54Å; H416-E434 VanDerWaalsContact O-CA 3.25Å; H416-E434 WeakPolarHBondContact O-CA 3.26Å; H416-V435 PolarHBondContact O-N 3.48Å
417	H	91.8	Very high	90.4	Very high	16 Å²	16	37.2 Å²	37.2	7%	0.074	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	127.8	-173.3	-56.5	93.2	0	0	0	113	V413 D414 V432 L433 E434 K445 L482	V413-H417 HydrophobicContact CB-CB 4.2Å; V413-H417 WeakPolarHBondContact CB-O 3.34Å; V413-H417 PolarHBondContact N-O 3.17Å; V413-H417 VanDerWaalsContact N-O 3.09Å; D414-H417 VanDerWaalsContact CG-ND1 3.32Å; D414-H417 PolarHBondContact N-O 3.07Å; D414-H417 VanDerWaalsContact N-O 3.15Å; D414-H417 PolarHBondContact O-N 3.23Å; D414-H417 VanDerWaalsContact O-O 3.12Å; D414-H417 IonicContact OD1-CG 3.89Å; D414-H417 PolarHBondContact OD1-N 3.04Å; D414-H417 IonicContact OD1-ND1 3.67Å; D414-H417 PolarHBondContact OD1-ND1 3.3Å; D414-H417 IonicContact OD2-CE1 3.68Å; D414-H417 IonicContact OD2-CG 2.84Å; D414-H417 IonicContact OD2-ND1 3.28Å; D414-H417 PolarHBondContact OD2-ND1 3.2Å; H417-V432 HydrophobicContact CB-CG1 4.42Å; H417-L433 CarbonylContact C-O 3.49Å; H417-L433 WeakPolarHBondContact CA-O 3.43Å; H417-E434 IonicContact NE2-OE1 2.77Å; H417-K445 PolarHBondContact NE2-NZ 2.81Å; H417-L482 HydrophobicContact CB-CD1 4.45Å; H417-L482 HydrophobicContact CB-CD2 4.37Å
418	L	93.5	Very high	90.3	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.01	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	155.4	169.2	-63.5	179.9	0	0	0	110.1	Y371 I379 L410 Y412 L433 V435 W437	Y371-L418 HydrophobicContact CD1-CD1 4.25Å; Y371-L418 HydrophobicContact CD1-CD2 4.17Å; Y371-L418 HydrophobicContact CD2-CD2 4.34Å; Y371-L418 HydrophobicContact CE1-CD2 4.46Å; Y371-L418 HydrophobicContact CG-CD2 4.09Å; I379-L418 HydrophobicContact CD1-CD1 4.12Å; I379-L418 HydrophobicContact CG2-CD1 3.77Å; L410-L418 HydrophobicContact CD1-CD1 4.24Å; Y412-L418 HydrophobicContact CD2-CD2 3.96Å; L418-L433 HydrophobicContact CB-CB 4.34Å; L418-L433 PolarHBondContact N-O 3Å; L418-L433 PolarHBondContact O-N 3.02Å; L418-V435 HydrophobicContact CD1-CG2 4.02Å; L418-V435 HydrophobicContact CG-CG2 4.22Å; L418-W437 HydrophobicContact CD1-CH2 4.35Å; L418-W437 HydrophobicContact CD1-CZ2 4.01Å
419	L	94.3	Very high	90.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	131	-179.6	-167.2	74.7	0	0	0	109.9	S411 V413 L430 V431 V432 V457 I468 L485	S411-L419 PolarHBondContact N-O 3.13Å; S411-L419 PolarHBondContact O-N 2.9Å; V413-L419 HydrophobicContact CG2-CB 3.97Å; L419-L430 HydrophobicContact CD1-CD1 3.65Å; L419-L430 HydrophobicContact CD1-CD2 4.34Å; L419-L430 HydrophobicContact CD1-CG 3.91Å; L419-L430 HydrophobicContact CD2-CD1 4Å; L419-L430 HydrophobicContact CG-CD1 3.72Å; L419-V431 WeakPolarHBondContact CA-O 3.4Å; L419-V432 HydrophobicContact CD1-CB 4.45Å; L419-V432 HydrophobicContact CD1-CG2 3.62Å; L419-V457 HydrophobicContact CD2-CB 4.34Å; L419-V457 HydrophobicContact CD2-CG1 3.45Å; L419-V457 VanDerWaalsContact CD2-CG1 3.45Å; L419-V457 HydrophobicContact CD2-CG2 4.37Å; L419-I468 HydrophobicContact CD2-CD1 4.28Å; L419-I468 HydrophobicContact CD2-CG2 3.63Å; L419-L485 HydrophobicContact CD1-CD1 4.21Å
420	L	94.3	Very high	90.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	160.7	175.2	-70.6	106.6	0	0	0	111.5	L373 I379 W407 L410 V431 L433	L373-L420 HydrophobicContact CD1-CD2 4.01Å; L373-L420 HydrophobicContact CD2-CD2 3.93Å; L373-L420 HydrophobicContact CG-CD2 4.48Å; I379-L420 HydrophobicContact CD1-CD1 3.67Å; W407-L420 HydrophobicContact CB-CD2 4.45Å; W407-L420 HydrophobicContact CE3-CB 3.84Å; W407-L420 HydrophobicContact CE3-CD2 4.34Å; W407-L420 HydrophobicContact CZ3-CB 4.13Å; L410-L420 HydrophobicContact CB-CD2 4.18Å; L410-L420 HydrophobicContact CB-CG 4.47Å; L410-L420 HydrophobicContact CD1-CD1 3.8Å; L410-L420 HydrophobicContact CD1-CD2 4.05Å; L410-L420 HydrophobicContact CD1-CG 3.9Å; L420-V431 PolarHBondContact N-O 3.39Å; L420-V431 PolarHBondContact O-N 3.13Å; L420-L433 HydrophobicContact CD1-CD1 3.31Å; L420-L433 HydrophobicContact CD1-CG 4.11Å
421	L	93.8	Very high	90.3	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	135.8	166.6	-64.9	169.2	0	0	0	109.8	W407 Y408 N409 L428 F429 L430 L450 V455 V457	W407-L421 WeakPolarHBondContact CA-O 3.4Å; Y408-L421 HydrophobicContact CD1-CB 3.87Å; Y408-L421 HydrophobicContact CD2-CB 4.25Å; Y408-L421 HydrophobicContact CD2-CD1 4.07Å; Y408-L421 HydrophobicContact CE1-CB 3.52Å; Y408-L421 HydrophobicContact CE1-CD1 4.43Å; Y408-L421 HydrophobicContact CE2-CB 3.92Å; Y408-L421 HydrophobicContact CE2-CD1 3.38Å; Y408-L421 HydrophobicContact CE2-CG 4.31Å; Y408-L421 HydrophobicContact CG-CB 4.23Å; Y408-L421 PolarHBondContact N-O 3.26Å; Y408-L421 PolarHBondContact O-N 3.22Å; N409-L421 HydrophobicContact CB-CD1 3.85Å; N409-L421 HydrophobicContact CB-CG 4.34Å; L421-L428 HydrophobicContact CB-CD1 4.44Å; L421-F429 WeakPolarHBondContact CA-O 3.4Å; L421-L430 HydrophobicContact CD2-CB 4.37Å; L421-L430 HydrophobicContact CD2-CD1 3.86Å; L421-L450 HydrophobicContact CD2-CD1 4.03Å; L421-V455 HydrophobicContact CD1-CG2 3.61Å; L421-V455 VanDerWaalsContact CD1-O 3.29Å; L421-V455 WeakPolarHBondContact CD1-O 2.7Å; L421-V455 HydrophobicContact CD2-CG2 3.47Å; L421-V455 VanDerWaalsContact CD2-CG2 3.47Å; L421-V455 HydrophobicContact CG-CG2 4.2Å; L421-V457 HydrophobicContact CD1-CG2 4.13Å; L421-V457 HydrophobicContact CD2-CG2 3.97Å; L421-V457 HydrophobicContact CG-CG2 4.01Å
422	L	92.3	Very high	90.3	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	120.2	176.3	170.2	64.2	0	0	0	109.1	L401 P405 W407 D424 L428 F429 V431 M447	L401-L422 HydrophobicContact CD2-CD2 3.58Å; P405-L422 HydrophobicContact CB-CD1 3.76Å; W407-L422 HydrophobicContact CD2-CB 4.35Å; W407-L422 HydrophobicContact CD2-CD1 3.92Å; W407-L422 HydrophobicContact CE3-CB 3.89Å; W407-L422 HydrophobicContact CE3-CD1 4.33Å; W407-L422 HydrophobicContact CG-CD1 4.37Å; W407-L422 HydrophobicContact CH2-CB 4.03Å; W407-L422 HydrophobicContact CH2-CD1 4.34Å; W407-L422 HydrophobicContact CH2-CD2 3.91Å; W407-L422 HydrophobicContact CH2-CG 4.31Å; W407-L422 HydrophobicContact CZ2-CB 4.45Å; W407-L422 HydrophobicContact CZ2-CD1 3.9Å; W407-L422 HydrophobicContact CZ2-CD2 3.97Å; W407-L422 HydrophobicContact CZ2-CG 4.32Å; W407-L422 HydrophobicContact CZ3-CB 3.74Å; W407-L422 HydrophobicContact CZ3-CD2 4.47Å; W407-L422 HydrophobicContact CZ3-CG 4.46Å; L422-D424 HydrophobicContact CD1-CB 4.08Å; L422-D424 HydrophobicContact CD2-CB 4.27Å; L422-D424 HydrophobicContact CG-CB 4.06Å; L422-L428 CarbonylContact O-C 3.53Å; L422-L428 WeakPolarHBondContact O-CA 3.45Å; L422-F429 HydrophobicContact CB-CB 4.35Å; L422-F429 HydrophobicContact CD2-CD2 4.37Å; L422-F429 HydrophobicContact CG-CD2 4.43Å; L422-F429 PolarHBondContact N-O 3.41Å; L422-F429 PolarHBondContact O-N 2.87Å; L422-V431 HydrophobicContact CB-CG2 3.94Å; L422-V431 HydrophobicContact CD2-CG2 4.5Å; L422-M447 HydrophobicContact CD2-CE 3.68Å
423	N	90.1	Very high	90.3	Very high	40 Å²	40	35.2 Å²	35.2	21%	0.214	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	113.3	162.1	-174	-26.5	0	0	0	108.5	F406 A427 L428	F406-N423 HydrophobicContact CB-CB 4.27Å; F406-N423 PolarHBondContact N-O 3.41Å; F406-N423 PolarHBondContact O-N 3.28Å; N423-A427 WeakPolarHBondContact CA-O 3.49Å; N423-L428 HydrophobicContact CB-CD1 4.34Å
424	D	87.8	Confident	90.4	Very high	14 Å²	14	37.7 Å²	37.7	8%	0.075	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	135.8	176.4	-169.6	21.5	0	0	0	110.6	S402 L422 S426 A427	S402-D424 WeakPolarHBondContact CB-OD1 3.49Å; S402-D424 PolarHBondContact N-OD2 3.33Å; S402-D424 PolarHBondContact OG-OD1 3.2Å; L422-D424 HydrophobicContact CD1-CB 4.08Å; L422-D424 HydrophobicContact CD2-CB 4.27Å; L422-D424 HydrophobicContact CG-CB 4.06Å; D424-S426 PolarHBondContact O-N 3.31Å; D424-S426 VanDerWaalsContact O-N 3.12Å; D424-A427 PolarHBondContact N-O 3.39Å; D424-A427 PolarHBondContact O-N 2.9Å; D424-A427 VanDerWaalsContact O-O 3.13Å
425	R	83.6	Confident	90.4	Very high	183 Å²	183	35.5 Å²	35.5	69%	0.691	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.3	37.5	-179	-54.4	179.9	-171.3	178.7	2.7	113.9	T400 A427	T400-R425 PolarHBondContact O-NH2 3.27Å; R425-A427 PolarHBondContact O-N 3.41Å
426	S	79.1	Confident	90.7	Very high	114 Å²	114	33.3 Å²	33.3	80%	0.797	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.8	13.1	-176.9	-42.1	0	0	0	0	115.3	D424	D424-S426 PolarHBondContact O-N 3.31Å; D424-S426 VanDerWaalsContact O-N 3.12Å
427	A	87.4	Confident	90.6	Very high	39 Å²	39	30.1 Å²	30.1	32%	0.322	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	140.6	171.2	0	0	0	0	0	109.9	N423 D424 R425 F429	N423-A427 WeakPolarHBondContact CA-O 3.49Å; D424-A427 PolarHBondContact N-O 3.39Å; D424-A427 PolarHBondContact O-N 2.9Å; D424-A427 VanDerWaalsContact O-O 3.13Å; R425-A427 PolarHBondContact O-N 3.41Å; A427-F429 HydrophobicContact CB-CD2 4.48Å; A427-F429 HydrophobicContact CB-CE2 3.55Å; A427-F429 HydrophobicContact CB-CZ 3.67Å
428	L	90.9	Very high	90.3	Very high	7 Å²	7	33.9 Å²	33.9	4%	0.037	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	132.8	179.5	-176.6	61	0	0	0	109.9	Y408 L421 L422 N423 L450 W452 V455	Y408-L428 HydrophobicContact CE1-CD1 3.95Å; Y408-L428 WeakPolarHBondContact OH-CD1 3.37Å; L421-L428 HydrophobicContact CB-CD1 4.44Å; L422-L428 CarbonylContact O-C 3.53Å; L422-L428 WeakPolarHBondContact O-CA 3.45Å; N423-L428 HydrophobicContact CB-CD1 4.34Å; L428-L450 HydrophobicContact CB-CB 4.43Å; L428-L450 HydrophobicContact CD2-CB 4.45Å; L428-L450 HydrophobicContact CD2-CD1 4.3Å; L428-L450 HydrophobicContact CG-CB 4.32Å; L428-L450 HydrophobicContact CG-CD1 4.2Å; L428-L450 PolarHBondContact O-N 3.27Å; L428-W452 WeakPolarHBondContact CD2-O 3.3Å; L428-V455 HydrophobicContact CD2-CB 4.44Å; L428-V455 HydrophobicContact CD2-CG1 4.15Å; L428-V455 HydrophobicContact CD2-CG2 3.91Å
429	F	91.6	Very high	90	Very high	48 Å²	48	37.8 Å²	37.8	21%	0.211	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	141.6	-179.3	-55.9	-90.3	0	0	0	111.2	L421 L422 A427 V431 M447 H448 P449	L421-F429 WeakPolarHBondContact CA-O 3.4Å; L422-F429 HydrophobicContact CB-CB 4.35Å; L422-F429 HydrophobicContact CD2-CD2 4.37Å; L422-F429 HydrophobicContact CG-CD2 4.43Å; L422-F429 PolarHBondContact N-O 3.41Å; L422-F429 PolarHBondContact O-N 2.87Å; A427-F429 HydrophobicContact CB-CD2 4.48Å; A427-F429 HydrophobicContact CB-CE2 3.55Å; A427-F429 HydrophobicContact CB-CZ 3.67Å; F429-V431 HydrophobicContact CB-CG2 4.19Å; F429-M447 HydrophobicContact CB-CE 4.42Å; F429-M447 HydrophobicContact CG-CE 4.28Å; F429-H448 CarbonylContact C-O 3.45Å; F429-H448 VanDerWaalsContact CA-O 3.23Å; F429-H448 WeakPolarHBondContact CA-O 3.19Å; F429-P449 HydrophobicContact CD1-CB 4.06Å; F429-P449 HydrophobicContact CE1-CB 3.96Å
430	L	92.8	Very high	89.6	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	121	162.1	179.2	69.4	0	0	0	108.8	L419 L421 M447 H448 L450 V457 L470 L485 L490	L419-L430 HydrophobicContact CD1-CD1 3.65Å; L419-L430 HydrophobicContact CD1-CD2 4.34Å; L419-L430 HydrophobicContact CD1-CG 3.91Å; L419-L430 HydrophobicContact CD2-CD1 4Å; L419-L430 HydrophobicContact CG-CD1 3.72Å; L421-L430 HydrophobicContact CD2-CB 4.37Å; L421-L430 HydrophobicContact CD2-CD1 3.86Å; L430-M447 WeakPolarHBondContact O-CA 3.26Å; L430-H448 HydrophobicContact CB-CB 4.25Å; L430-H448 PolarHBondContact N-O 3.43Å; L430-H448 PolarHBondContact O-N 2.97Å; L430-L450 HydrophobicContact CB-CD1 4.18Å; L430-L450 HydrophobicContact CB-CD2 4.46Å; L430-L450 HydrophobicContact CB-CG 4.42Å; L430-V457 HydrophobicContact CD1-CG2 3.65Å; L430-L470 HydrophobicContact CD1-CD2 4.46Å; L430-L470 HydrophobicContact CD2-CD1 3.9Å; L430-L470 HydrophobicContact CD2-CG 4.5Å; L430-L485 HydrophobicContact CD2-CD1 4.09Å; L430-L485 HydrophobicContact CD2-CD2 3.95Å; L430-L490 HydrophobicContact CD2-CD1 4.42Å
431	V	92.8	Very high	89.3	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	122.1	-174.1	-174.2	0	0	0	0	110.1	W407 L419 L420 L422 F429 L433 A444 C446 M447	W407-V431 HydrophobicContact CH2-CB 4.34Å; W407-V431 HydrophobicContact CH2-CG1 4.17Å; W407-V431 HydrophobicContact CH2-CG2 4.02Å; W407-V431 HydrophobicContact CZ3-CB 3.91Å; W407-V431 HydrophobicContact CZ3-CG1 4.15Å; W407-V431 HydrophobicContact CZ3-CG2 3.77Å; L419-V431 WeakPolarHBondContact CA-O 3.4Å; L420-V431 PolarHBondContact N-O 3.39Å; L420-V431 PolarHBondContact O-N 3.13Å; L422-V431 HydrophobicContact CB-CG2 3.94Å; L422-V431 HydrophobicContact CD2-CG2 4.5Å; F429-V431 HydrophobicContact CB-CG2 4.19Å; V431-L433 HydrophobicContact CG1-CD2 3.74Å; V431-L433 HydrophobicContact CG1-CG 4.3Å; V431-A444 HydrophobicContact CG1-CB 3.98Å; V431-C446 WeakPolarHBondContact CA-O 3.34Å; V431-M447 HydrophobicContact CB-CG 4.47Å; V431-M447 HydrophobicContact CG1-CG 3.99Å; V431-M447 HydrophobicContact CG2-CE 4.2Å; V431-M447 HydrophobicContact CG2-CG 4Å
432	V	93.3	Very high	89	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	116	168.3	-175.9	0	0	0	0	107.9	H417 L419 K445 C446 L482 L485 L486	H417-V432 HydrophobicContact CB-CG1 4.42Å; L419-V432 HydrophobicContact CD1-CB 4.45Å; L419-V432 HydrophobicContact CD1-CG2 3.62Å; V432-K445 PolarHBondContact O-N 3.07Å; V432-C446 WeakPolarHBondContact CB-SG 3.07Å; V432-C446 WeakPolarHBondContact CG2-SG 3.25Å; V432-C446 PolarHBondContact N-O 3.45Å; V432-C446 PolarHBondContact O-N 3.25Å; V432-L482 HydrophobicContact CG1-CD1 4Å; V432-L485 HydrophobicContact CG2-CB 4.1Å; V432-L485 HydrophobicContact CG2-CD1 4.06Å; V432-L486 HydrophobicContact CG1-CD2 4.08Å
433	L	92.7	Very high	88.9	Confident	4 Å²	4	51.8 Å²	51.8	2%	0.021	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	136.1	174.8	-61.8	-179.5	0	0	0	109.8	I379 L396 H417 L418 L420 V431 V435 V442 Q443 A444	I379-L433 HydrophobicContact CD1-CD1 3.49Å; I379-L433 VanDerWaalsContact CD1-CD1 3.49Å; L396-L433 HydrophobicContact CD2-CD1 3.35Å; L396-L433 HydrophobicContact CD2-CD2 4.14Å; L396-L433 HydrophobicContact CD2-CG 4.4Å; H417-L433 CarbonylContact C-O 3.49Å; H417-L433 WeakPolarHBondContact CA-O 3.43Å; L418-L433 HydrophobicContact CB-CB 4.34Å; L418-L433 PolarHBondContact N-O 3Å; L418-L433 PolarHBondContact O-N 3.02Å; L420-L433 HydrophobicContact CD1-CD1 3.31Å; L420-L433 HydrophobicContact CD1-CG 4.11Å; V431-L433 HydrophobicContact CG1-CD2 3.74Å; V431-L433 HydrophobicContact CG1-CG 4.3Å; L433-V435 HydrophobicContact CB-CG2 4.37Å; L433-V442 HydrophobicContact CB-CG2 4.04Å; L433-V442 HydrophobicContact CD1-CG2 4.08Å; L433-V442 HydrophobicContact CD2-CG2 4.15Å; L433-V442 HydrophobicContact CG-CG2 4.34Å; L433-Q443 WeakPolarHBondContact CA-O 3.39Å; L433-A444 HydrophobicContact CD2-CB 4.14Å
434	E	92.6	Very high	88.7	Confident	55 Å²	55	52 Å²	52	26%	0.257	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	122.4	164.8	-175.6	171.2	-130.7	0	0	108.2	H416 H417 V442 Q443 K445	H416-E434 CarbonylContact O-C 3.54Å; H416-E434 VanDerWaalsContact O-CA 3.25Å; H416-E434 WeakPolarHBondContact O-CA 3.26Å; H417-E434 IonicContact NE2-OE1 2.77Å; E434-V442 WeakPolarHBondContact O-CA 2.99Å; E434-Q443 HydrophobicContact CB-CG 4Å; E434-Q443 PolarHBondContact N-O 3.33Å; E434-Q443 PolarHBondContact O-N 3.24Å; E434-Q443 PolarHBondContact OE2-NE2 3.12Å; E434-K445 HydrophobicContact CB-CB 4.3Å; E434-K445 HydrophobicContact CB-CD 4.06Å; E434-K445 IonicContact OE1-NZ 3.15Å; E434-K445 PolarHBondContact OE1-NZ 3.22Å; E434-K445 IonicContact OE2-NZ 3.54Å
435	V	90.8	Very high	88.8	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.012	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	128.7	-175	-168.8	0	0	0	0	109.3	V394 H416 L418 L433 W437 V442	V394-V435 HydrophobicContact CG1-CG1 4Å; V394-V435 HydrophobicContact CG2-CG1 4.08Å; H416-V435 PolarHBondContact O-N 3.48Å; L418-V435 HydrophobicContact CD1-CG2 4.02Å; L418-V435 HydrophobicContact CG-CG2 4.22Å; L433-V435 HydrophobicContact CB-CG2 4.37Å; V435-W437 HydrophobicContact CB-CZ2 4.09Å; V435-W437 HydrophobicContact CG1-CD2 3.64Å; V435-W437 VanDerWaalsContact CG1-CE2 3.45Å; V435-W437 HydrophobicContact CG1-CE3 3.89Å; V435-W437 HydrophobicContact CG1-CG 4.23Å; V435-W437 HydrophobicContact CG1-CH2 3.86Å; V435-W437 HydrophobicContact CG1-CZ2 3.58Å; V435-W437 HydrophobicContact CG1-CZ3 4Å; V435-W437 HydrophobicContact CG2-CZ2 4.31Å; V435-V442 HydrophobicContact CG2-CB 4.41Å; V435-V442 HydrophobicContact CG2-CG2 3.89Å
436	D	90.3	Very high	89	Confident	66 Å²	66	47.1 Å²	47.1	35%	0.353	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	99.9	165.9	178.5	0.2	0	0	0	108.9	A438 T439 C440 T441	D436-A438 PolarHBondContact O-N 2.98Å; D436-A438 WeakPolarHBondContact OD1-CB 3.49Å; D436-A438 PolarHBondContact OD1-N 3.2Å; D436-T439 WeakPolarHBondContact CB-OG1 3.12Å; D436-T439 PolarHBondContact O-N 2.96Å; D436-T439 PolarHBondContact OD1-N 2.85Å; D436-T439 WeakPolarHBondContact OD2-CB 3.13Å; D436-T439 WeakPolarHBondContact OD2-CG2 3.33Å; D436-T439 PolarHBondContact OD2-OG1 2.99Å; D436-C440 WeakPolarHBondContact O-CA 3.26Å; D436-C440 PolarHBondContact O-N 2.91Å; D436-T441 PolarHBondContact N-O 3.2Å; D436-T441 PolarHBondContact O-N 3.01Å; D436-T441 VanDerWaalsContact O-N 3.1Å
437	W	87.4	Confident	89.5	Confident	42 Å²	42	45.3 Å²	45.3	16%	0.159	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-22.5	179.5	-59	107.2	0	0	0	113.3	Y371 I379 C381 V394 Q415 L418 V435	Y371-W437 AromaticContact CD1-CH2 3.91Å; Y371-W437 HydrophobicContact CD1-CH2 3.91Å; Y371-W437 AromaticContact CD1-CZ2 3.46Å; Y371-W437 HydrophobicContact CD1-CZ2 3.46Å; Y371-W437 VanDerWaalsContact CD1-CZ2 3.46Å; Y371-W437 AromaticContact CE1-CE2 3.7Å; Y371-W437 HydrophobicContact CE1-CH2 4.15Å; Y371-W437 AromaticContact CE1-CZ2 3.32Å; Y371-W437 HydrophobicContact CE1-CZ2 3.32Å; Y371-W437 AromaticContact CE1-NE1 3.87Å; I379-W437 HydrophobicContact CG2-CH2 4.01Å; C381-W437 HydrophobicContact CB-CD2 3.58Å; C381-W437 HydrophobicContact CB-CE3 3.36Å; C381-W437 HydrophobicContact CB-CG 4.45Å; C381-W437 HydrophobicContact CB-CH2 3.51Å; C381-W437 HydrophobicContact CB-CZ2 3.72Å; C381-W437 HydrophobicContact CB-CZ3 3.32Å; V394-W437 HydrophobicContact CG1-CE3 4.31Å; V394-W437 HydrophobicContact CG1-CZ3 4.17Å; V394-W437 HydrophobicContact CG2-CH2 4.26Å; V394-W437 HydrophobicContact CG2-CZ3 4.07Å; Q415-W437 PolarHBondContact O-NE1 3.4Å; L418-W437 HydrophobicContact CD1-CH2 4.35Å; L418-W437 HydrophobicContact CD1-CZ2 4.01Å; V435-W437 HydrophobicContact CB-CZ2 4.09Å; V435-W437 HydrophobicContact CG1-CD2 3.64Å; V435-W437 VanDerWaalsContact CG1-CE2 3.45Å; V435-W437 HydrophobicContact CG1-CE3 3.89Å; V435-W437 HydrophobicContact CG1-CG 4.23Å; V435-W437 HydrophobicContact CG1-CH2 3.86Å; V435-W437 HydrophobicContact CG1-CZ2 3.58Å; V435-W437 HydrophobicContact CG1-CZ3 4Å; V435-W437 HydrophobicContact CG2-CZ2 4.31Å
438	A	86	Confident	89.6	Confident	95 Å²	95	44 Å²	44	79%	0.785	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78	-38.3	179.2	0	0	0	0	0	111.7	D436	D436-A438 PolarHBondContact O-N 2.98Å; D436-A438 WeakPolarHBondContact OD1-CB 3.49Å; D436-A438 PolarHBondContact OD1-N 3.2Å
439	T	86.8	Confident	89.6	Confident	83 Å²	83	48 Å²	48	51%	0.509	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-5.3	175.2	59.8	0	0	0	0	113.3	D436 T441	D436-T439 WeakPolarHBondContact CB-OG1 3.12Å; D436-T439 PolarHBondContact O-N 2.96Å; D436-T439 PolarHBondContact OD1-N 2.85Å; D436-T439 WeakPolarHBondContact OD2-CB 3.13Å; D436-T439 WeakPolarHBondContact OD2-CG2 3.33Å; D436-T439 PolarHBondContact OD2-OG1 2.99Å; T439-T441 PolarHBondContact O-N 3.36Å; T439-T441 PolarHBondContact OG1-OG1 3.26Å
440	C	85.7	Confident	89.5	Confident	65 Å²	65	46.4 Å²	46.4	44%	0.439	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	54	39.3	-172.9	-61.6	0	0	0	0	112.1	V394 D436	V394-C440 HydrophobicContact CG1-CB 4.47Å; D436-C440 WeakPolarHBondContact O-CA 3.26Å; D436-C440 PolarHBondContact O-N 2.91Å
441	T	87.4	Confident	89.1	Confident	76 Å²	76	50.9 Å²	50.9	47%	0.466	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	146.2	178.1	62.3	0	0	0	0	110.9	D436 T439	D436-T441 PolarHBondContact N-O 3.2Å; D436-T441 PolarHBondContact O-N 3.01Å; D436-T441 VanDerWaalsContact O-N 3.1Å; T439-T441 PolarHBondContact O-N 3.36Å; T439-T441 PolarHBondContact OG1-OG1 3.26Å
442	V	88.6	Confident	88.7	Confident	36 Å²	36	54 Å²	54	22%	0.218	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	138.6	174.2	59.3	0	0	0	0	108.9	V394 N395 L396 L433 E434 V435	V394-V442 HydrophobicContact CB-CB 3.99Å; V394-V442 HydrophobicContact CB-CG1 3.82Å; V394-V442 HydrophobicContact CG2-CB 3.94Å; V394-V442 HydrophobicContact CG2-CG1 4.01Å; N395-V442 WeakPolarHBondContact O-CG1 3.34Å; L396-V442 HydrophobicContact CD2-CG1 4.28Å; L396-V442 HydrophobicContact CD2-CG2 4.07Å; L433-V442 HydrophobicContact CB-CG2 4.04Å; L433-V442 HydrophobicContact CD1-CG2 4.08Å; L433-V442 HydrophobicContact CD2-CG2 4.15Å; L433-V442 HydrophobicContact CG-CG2 4.34Å; E434-V442 WeakPolarHBondContact O-CA 2.99Å; V435-V442 HydrophobicContact CG2-CB 4.41Å; V435-V442 HydrophobicContact CG2-CG2 3.89Å
443	Q	88.4	Confident	87.8	Confident	118 Å²	118	61.8 Å²	61.8	55%	0.551	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.7	140.7	174.1	62	-176.3	-13.3	0	0	110.7	L433 E434 K445	L433-Q443 WeakPolarHBondContact CA-O 3.39Å; E434-Q443 HydrophobicContact CB-CG 4Å; E434-Q443 PolarHBondContact N-O 3.33Å; E434-Q443 PolarHBondContact O-N 3.24Å; E434-Q443 PolarHBondContact OE2-NE2 3.12Å; Q443-K445 PolarHBondContact O-N 3.41Å
444	A	87.5	Confident	87.2	Confident	45 Å²	45	63.3 Å²	63.3	37%	0.372	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	103.8	170.9	0	0	0	0	0	109.1	V431 L433 M447	V431-A444 HydrophobicContact CG1-CB 3.98Å; L433-A444 HydrophobicContact CD2-CB 4.14Å; A444-M447 HydrophobicContact CB-CG 4.29Å; A444-M447 HydrophobicContact CB-SD 4.39Å
445	K	88.6	Confident	87	Confident	87 Å²	87	61 Å²	61	38%	0.378	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	-40.2	-176.4	-169.4	162.8	-177.9	168.7	0	111.8	H417 V432 E434 Q443 L486	H417-K445 PolarHBondContact NE2-NZ 2.81Å; V432-K445 PolarHBondContact O-N 3.07Å; E434-K445 HydrophobicContact CB-CB 4.3Å; E434-K445 HydrophobicContact CB-CD 4.06Å; E434-K445 IonicContact OE1-NZ 3.15Å; E434-K445 PolarHBondContact OE1-NZ 3.22Å; E434-K445 IonicContact OE2-NZ 3.54Å; Q443-K445 PolarHBondContact O-N 3.41Å; K445-L486 HydrophobicContact CB-CD2 4.41Å; K445-L486 HydrophobicContact CD-CD2 3.54Å; K445-L486 HydrophobicContact CG-CD2 3.77Å
446	C	88.2	Confident	86.9	Confident	8 Å²	8	62 Å²	62	5%	0.054	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	150.3	169.2	61.6	0	0	0	0	111.8	V431 V432 L485	V431-C446 WeakPolarHBondContact CA-O 3.34Å; V432-C446 WeakPolarHBondContact CB-SG 3.07Å; V432-C446 WeakPolarHBondContact CG2-SG 3.25Å; V432-C446 PolarHBondContact N-O 3.45Å; V432-C446 PolarHBondContact O-N 3.25Å; C446-L485 PolarHBondContact SG-O 3.09Å
447	M	89.2	Confident	87	Confident	76 Å²	76	59 Å²	59	37%	0.374	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	111.6	177.4	-67.4	-177.8	64	0	0	108.9	L422 F429 L430 V431 A444	L422-M447 HydrophobicContact CD2-CE 3.68Å; F429-M447 HydrophobicContact CB-CE 4.42Å; F429-M447 HydrophobicContact CG-CE 4.28Å; L430-M447 WeakPolarHBondContact O-CA 3.26Å; V431-M447 HydrophobicContact CB-CG 4.47Å; V431-M447 HydrophobicContact CG1-CG 3.99Å; V431-M447 HydrophobicContact CG2-CE 4.2Å; V431-M447 HydrophobicContact CG2-CG 4Å; A444-M447 HydrophobicContact CB-CG 4.29Å; A444-M447 HydrophobicContact CB-SD 4.39Å
448	H	90.4	Very high	87.1	Confident	10 Å²	10	58.8 Å²	58.8	5%	0.046	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	117.6	-176.8	-66.3	-90.2	0	0	0	110.7	F429 L430 L485 L490	F429-H448 CarbonylContact C-O 3.45Å; F429-H448 VanDerWaalsContact CA-O 3.23Å; F429-H448 WeakPolarHBondContact CA-O 3.19Å; L430-H448 HydrophobicContact CB-CB 4.25Å; L430-H448 PolarHBondContact N-O 3.43Å; L430-H448 PolarHBondContact O-N 2.97Å; H448-L485 PolarHBondContact CE1-O 3.28Å; H448-L485 PolarHBondContact NE2-O 2.94Å; H448-L490 HydrophobicContact CB-CD1 4.28Å; H448-L490 HydrophobicContact CB-CD2 4.35Å
449	P	89.9	Confident	87.3	Confident	92 Å²	92	55.9 Å²	55.9	60%	0.597	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	134.1	174.7	28.6	-33.1	0	0	0	110.7	F429	F429-P449 HydrophobicContact CD1-CB 4.06Å; F429-P449 HydrophobicContact CE1-CB 3.96Å
450	L	89.6	Confident	87.4	Confident	15 Å²	15	53.2 Å²	53.2	8%	0.079	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	135.8	179.7	-61.3	-178.5	0	0	0	110.4	L421 L428 L430 W452 V455 L470 L490	L421-L450 HydrophobicContact CD2-CD1 4.03Å; L428-L450 HydrophobicContact CB-CB 4.43Å; L428-L450 HydrophobicContact CD2-CB 4.45Å; L428-L450 HydrophobicContact CD2-CD1 4.3Å; L428-L450 HydrophobicContact CG-CB 4.32Å; L428-L450 HydrophobicContact CG-CD1 4.2Å; L428-L450 PolarHBondContact O-N 3.27Å; L430-L450 HydrophobicContact CB-CD1 4.18Å; L430-L450 HydrophobicContact CB-CD2 4.46Å; L430-L450 HydrophobicContact CB-CG 4.42Å; L450-W452 HydrophobicContact CB-CE3 4.29Å; L450-W452 HydrophobicContact CD2-CZ3 4.44Å; L450-W452 PolarHBondContact O-N 2.74Å; L450-V455 HydrophobicContact CD1-CB 4.42Å; L450-V455 HydrophobicContact CD1-CG1 4.11Å; L450-V455 HydrophobicContact CD1-CG2 3.46Å; L450-V455 VanDerWaalsContact CD1-CG2 3.46Å; L450-L470 HydrophobicContact CD1-CD2 4.4Å; L450-L470 HydrophobicContact CD2-CD1 4.42Å; L450-L490 HydrophobicContact CD2-CD2 3.75Å
451	P	85.3	Confident	87.3	Confident	93 Å²	93	52.9 Å²	52.9	60%	0.604	28%	0.283	S	S	*	.	S	Bend	trans	-78	-1.8	-178.2	31.9	-37.3	0	0	0	114.3	L492	P451-L492 HydrophobicContact CG-CD1 3.85Å
452	W	83.7	Confident	87.1	Confident	67 Å²	67	51.7 Å²	51.7	25%	0.254	27%	0.27	S	S	.	.	S	Bend	trans	-100.7	152.3	-177	-58.9	-78.2	0	0	0	112	L428 L450 V455 T472 L478 L492	L428-W452 WeakPolarHBondContact CD2-O 3.3Å; L450-W452 HydrophobicContact CB-CE3 4.29Å; L450-W452 HydrophobicContact CD2-CZ3 4.44Å; L450-W452 PolarHBondContact O-N 2.74Å; W452-V455 HydrophobicContact CB-CG1 3.87Å; W452-V455 HydrophobicContact CD2-CG1 4.3Å; W452-V455 HydrophobicContact CE3-CG1 3.88Å; W452-V455 HydrophobicContact CG-CG1 4.33Å; W452-T472 HydrophobicContact CD2-CG2 3.66Å; W452-T472 HydrophobicContact CE3-CG2 4.09Å; W452-T472 HydrophobicContact CG-CG2 4.17Å; W452-T472 HydrophobicContact CH2-CG2 4.11Å; W452-T472 HydrophobicContact CZ2-CG2 3.65Å; W452-T472 HydrophobicContact CZ3-CG2 4.3Å; W452-L478 HydrophobicContact CH2-CD1 3.48Å; W452-L478 VanDerWaalsContact CH2-CD1 3.48Å; W452-L478 HydrophobicContact CZ2-CD1 4.3Å; W452-L478 HydrophobicContact CZ3-CD1 3.96Å; W452-L492 HydrophobicContact CH2-CD1 4.17Å; W452-L492 HydrophobicContact CH2-CD2 3.77Å; W452-L492 HydrophobicContact CH2-CG 4.41Å; W452-L492 HydrophobicContact CZ3-CD2 3.93Å
453	L	74.9	Confident	86.5	Confident	163 Å²	163	55.6 Å²	55.6	85%	0.853	31%	0.306	S	S	*	.	S	Bend	trans	-73.3	-29	176.8	-65.7	172.1	0	0	0	112.8
454	S	80	Confident	86	Confident	35 Å²	35	55.2 Å²	55.2	25%	0.245	32%	0.317	C	S	.	.			trans	-147.1	140.8	175.6	63.2	0	0	0	0	110.8	A473	S454-A473 PolarHBondContact O-N 2.93Å; S454-A473 WeakPolarHBondContact OG-CB 3.24Å
455	V	88.4	Confident	85.9	Confident	8 Å²	8	56.4 Å²	56.4	5%	0.048	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	165.9	171.1	-56	0	0	0	0	110.1	L421 L428 L450 W452 L470 Q471	L421-V455 HydrophobicContact CD1-CG2 3.61Å; L421-V455 VanDerWaalsContact CD1-O 3.29Å; L421-V455 WeakPolarHBondContact CD1-O 2.7Å; L421-V455 HydrophobicContact CD2-CG2 3.47Å; L421-V455 VanDerWaalsContact CD2-CG2 3.47Å; L421-V455 HydrophobicContact CG-CG2 4.2Å; L428-V455 HydrophobicContact CD2-CB 4.44Å; L428-V455 HydrophobicContact CD2-CG1 4.15Å; L428-V455 HydrophobicContact CD2-CG2 3.91Å; L450-V455 HydrophobicContact CD1-CB 4.42Å; L450-V455 HydrophobicContact CD1-CG1 4.11Å; L450-V455 HydrophobicContact CD1-CG2 3.46Å; L450-V455 VanDerWaalsContact CD1-CG2 3.46Å; W452-V455 HydrophobicContact CB-CG1 3.87Å; W452-V455 HydrophobicContact CD2-CG1 4.3Å; W452-V455 HydrophobicContact CE3-CG1 3.88Å; W452-V455 HydrophobicContact CG-CG1 4.33Å; V455-L470 HydrophobicContact CB-CD2 4.39Å; V455-L470 HydrophobicContact CG2-CD2 3.95Å; V455-Q471 CarbonylContact C-O 3.31Å; V455-Q471 WeakPolarHBondContact CA-O 3.35Å; V455-Q471 WeakPolarHBondContact CB-O 3.37Å
456	K	89.5	Confident	85.8	Confident	23 Å²	23	53.3 Å²	53.3	10%	0.1	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	135.4	169.3	-175.6	169	-179.7	-179.5	0	109.9	W458 Q471 Y503	K456-W458 HydrophobicContact CD-CH2 4.12Å; K456-W458 HydrophobicContact CD-CZ2 3.5Å; K456-W458 VanDerWaalsContact CD-CZ2 3.5Å; K456-W458 HydrophobicContact CG-CZ2 4.18Å; K456-Q471 PolarHBondContact N-O 3.05Å; K456-Q471 PolarHBondContact O-N 3.21Å; K456-Y503 WeakPolarHBondContact CB-OH 3.47Å; K456-Y503 WeakPolarHBondContact CD-OH 3.35Å
457	V	91.3	Very high	85.9	Confident	2 Å²	2	53 Å²	53	1%	0.012	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	140.8	175.6	-167	0	0	0	0	110.3	N409 L419 L421 L430 I468 F469 L470	N409-V457 PolarHBondContact ND2-O 3.1Å; N409-V457 VanDerWaalsContact OD1-CA 3.25Å; N409-V457 WeakPolarHBondContact OD1-CA 3.19Å; N409-V457 WeakPolarHBondContact OD1-CB 3.33Å; N409-V457 WeakPolarHBondContact OD1-CG2 3.48Å; N409-V457 PolarHBondContact OD1-N 2.95Å; N409-V457 PolarHBondContact OD1-O 3.39Å; L419-V457 HydrophobicContact CD2-CB 4.34Å; L419-V457 HydrophobicContact CD2-CG1 3.45Å; L419-V457 VanDerWaalsContact CD2-CG1 3.45Å; L419-V457 HydrophobicContact CD2-CG2 4.37Å; L421-V457 HydrophobicContact CD1-CG2 4.13Å; L421-V457 HydrophobicContact CD2-CG2 3.97Å; L421-V457 HydrophobicContact CG-CG2 4.01Å; L430-V457 HydrophobicContact CD1-CG2 3.65Å; V457-I468 HydrophobicContact CG1-CG2 3.6Å; V457-F469 CarbonylContact C-O 3.58Å; V457-F469 WeakPolarHBondContact CA-O 3.43Å; V457-L470 HydrophobicContact CG2-CD2 3.61Å
458	W	90.3	Very high	86	Confident	37 Å²	37	49.3 Å²	49.3	14%	0.14	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	143.8	172.1	-51.9	92.4	0	0	0	108.8	K456 F469 Q471 V507 M509	K456-W458 HydrophobicContact CD-CH2 4.12Å; K456-W458 HydrophobicContact CD-CZ2 3.5Å; K456-W458 VanDerWaalsContact CD-CZ2 3.5Å; K456-W458 HydrophobicContact CG-CZ2 4.18Å; W458-F469 HydrophobicContact CB-CB 4.26Å; W458-F469 PolarHBondContact N-O 2.85Å; W458-F469 PolarHBondContact O-N 2.83Å; W458-Q471 VanDerWaalsContact NE1-OE1 3.15Å; W458-V507 HydrophobicContact CD2-CB 3.98Å; W458-V507 HydrophobicContact CD2-CG2 4.41Å; W458-V507 HydrophobicContact CE3-CB 4.43Å; W458-V507 HydrophobicContact CG-CB 4.33Å; W458-V507 HydrophobicContact CH2-CB 4.47Å; W458-V507 HydrophobicContact CH2-CG2 4.48Å; W458-V507 HydrophobicContact CZ2-CB 4.03Å; W458-V507 HydrophobicContact CZ2-CG2 3.72Å; W458-M509 HydrophobicContact CB-CE 4.22Å; W458-M509 HydrophobicContact CB-SD 4.46Å
459	T	90.3	Very high	86	Confident	34 Å²	34	48.9 Å²	48.9	21%	0.209	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	144.6	178.2	54.9	0	0	0	0	111	Y461 L467 I468	T459-Y461 PolarHBondContact OG1-OH 3.4Å; T459-L467 WeakPolarHBondContact CA-O 3.43Å; T459-I468 HydrophobicContact CG2-CG1 4.49Å
460	F	87.8	Confident	86	Confident	27 Å²	27	44.6 Å²	44.6	12%	0.118	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	124.7	175.7	177.7	-107.5	0	0	0	110.6	R462 V466 L467 F469 M509 E511 V516	F460-R462 HydrophobicContact CD1-CG 4Å; F460-R462 HydrophobicContact CE1-CG 3.66Å; F460-V466 WeakPolarHBondContact O-CA 3.39Å; F460-L467 HydrophobicContact CB-CB 4.39Å; F460-L467 HydrophobicContact CD1-CD1 4.18Å; F460-L467 PolarHBondContact N-O 2.89Å; F460-L467 PolarHBondContact O-N 3.36Å; F460-F469 HydrophobicContact CB-CE2 4.11Å; F460-M509 HydrophobicContact CB-CB 3.82Å; F460-M509 HydrophobicContact CB-CG 4.09Å; F460-M509 HydrophobicContact CB-SD 4.02Å; F460-M509 HydrophobicContact CD1-CB 4.21Å; F460-M509 HydrophobicContact CD2-CB 3.53Å; F460-M509 WeakPolarHBondContact CD2-O 3.34Å; F460-M509 HydrophobicContact CE2-CB 4.1Å; F460-M509 WeakPolarHBondContact CE2-O 3.37Å; F460-M509 HydrophobicContact CG-CB 3.57Å; F460-M509 HydrophobicContact CG-CG 4.36Å; F460-E511 HydrophobicContact CE1-CB 4.21Å; F460-E511 HydrophobicContact CZ-CB 3.95Å; F460-V516 HydrophobicContact CD1-CG2 4.04Å; F460-V516 HydrophobicContact CE1-CG2 3.58Å; F460-V516 HydrophobicContact CZ-CG2 4.45Å
461	Y	84.7	Confident	86	Confident	58 Å²	58	43.9 Å²	43.9	23%	0.227	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	118.7	-176.7	-52.6	-88.3	0	0	0	110	Y412 V413 T459 V466	Y412-Y461 AromaticContact CD1-CE1 3.54Å; Y412-Y461 HydrophobicContact CD1-CE1 3.54Å; Y412-Y461 AromaticContact CD1-CZ 3.62Å; Y412-Y461 VanDerWaalsContact CD1-OH 3.29Å; Y412-Y461 WeakPolarHBondContact CD1-OH 3.48Å; Y412-Y461 AromaticContact CE1-CE1 3.85Å; Y412-Y461 HydrophobicContact CE1-CE1 3.85Å; Y412-Y461 PolarHBondContact O-OH 3.16Å; V413-Y461 WeakPolarHBondContact O-CE1 3.48Å; T459-Y461 PolarHBondContact OG1-OH 3.4Å; Y461-V466 HydrophobicContact CD1-CB 4.48Å; Y461-V466 HydrophobicContact CD1-CG1 4.17Å; Y461-V466 HydrophobicContact CD1-CG2 3.52Å; Y461-V466 HydrophobicContact CE1-CG1 4.09Å; Y461-V466 HydrophobicContact CE1-CG2 3.91Å
462	R	82.1	Confident	86	Confident	52 Å²	52	39.5 Å²	39.5	20%	0.196	22%	0.221	C	C	.	.			trans	-94.4	169.4	164.7	-65.3	179.1	150.7	178.4	-12.4	109.5	F460 S464 E465 E511	F460-R462 HydrophobicContact CD1-CG 4Å; F460-R462 HydrophobicContact CE1-CG 3.66Å; R462-S464 PolarHBondContact O-N 2.94Å; R462-E465 WeakPolarHBondContact CA-O 3.45Å; R462-E465 HydrophobicContact CB-CG 4.19Å; R462-E465 WeakPolarHBondContact CB-O 3.2Å; R462-E465 IonicContact CZ-OE1 2.86Å; R462-E465 PolarHBondContact N-O 3.24Å; R462-E465 IonicContact NH1-OE1 2.88Å; R462-E465 PolarHBondContact NH1-OE1 3.48Å; R462-E511 WeakPolarHBondContact CG-OE2 3.29Å; R462-E511 IonicContact NE-OE1 3.31Å; R462-E511 IonicContact NE-OE2 3.6Å; R462-E511 PolarHBondContact NE-OE2 2.9Å; R462-E511 IonicContact NH2-OE1 2.86Å
463	A	76	Confident	85.8	Confident	118 Å²	118	38.7 Å²	38.7	98%	0.975	23%	0.228	S	C	*	.	S	Bend	trans	-60.2	-27.2	173.9	0	0	0	0	0	113.2
464	S	78.5	Confident	85.9	Confident	110 Å²	110	35 Å²	35	77%	0.769	21%	0.212	S	C	*	.	S	Bend	trans	-111.5	-22	-174	58	0	0	0	0	115.3	R462	R462-S464 PolarHBondContact O-N 2.94Å
465	E	86	Confident	86	Confident	70 Å²	70	33.4 Å²	33.4	33%	0.327	20%	0.201	S	C	.	.			trans	-157.1	165.3	-169.8	66.1	-177.8	178.1	0	0	111.4	R462 L467	R462-E465 WeakPolarHBondContact CA-O 3.45Å; R462-E465 HydrophobicContact CB-CG 4.19Å; R462-E465 WeakPolarHBondContact CB-O 3.2Å; R462-E465 IonicContact CZ-OE1 2.86Å; R462-E465 PolarHBondContact N-O 3.24Å; R462-E465 IonicContact NH1-OE1 2.88Å; R462-E465 PolarHBondContact NH1-OE1 3.48Å; E465-L467 HydrophobicContact CG-CD2 4.22Å; E465-L467 WeakPolarHBondContact OE1-CD2 3.3Å
466	V	87.1	Confident	85.8	Confident	22 Å²	22	35.4 Å²	35.4	13%	0.133	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	125.6	169.2	-177	0	0	0	0	109.3	V413 F460 Y461	V413-V466 HydrophobicContact CG1-CB 3.97Å; V413-V466 HydrophobicContact CG1-CG1 4.08Å; V413-V466 HydrophobicContact CG1-CG2 4.26Å; V413-V466 WeakPolarHBondContact O-CG2 3.48Å; F460-V466 WeakPolarHBondContact O-CA 3.39Å; Y461-V466 HydrophobicContact CD1-CB 4.48Å; Y461-V466 HydrophobicContact CD1-CG1 4.17Å; Y461-V466 HydrophobicContact CD1-CG2 3.52Å; Y461-V466 HydrophobicContact CE1-CG1 4.09Å; Y461-V466 HydrophobicContact CE1-CG2 3.91Å
467	L	89.6	Confident	85.7	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	134.5	172.5	-59.7	-175.1	0	0	0	109.3	T459 F460 E465 F469 T481 V516	T459-L467 WeakPolarHBondContact CA-O 3.43Å; F460-L467 HydrophobicContact CB-CB 4.39Å; F460-L467 HydrophobicContact CD1-CD1 4.18Å; F460-L467 PolarHBondContact N-O 2.89Å; F460-L467 PolarHBondContact O-N 3.36Å; E465-L467 HydrophobicContact CG-CD2 4.22Å; E465-L467 WeakPolarHBondContact OE1-CD2 3.3Å; L467-F469 HydrophobicContact CB-CD2 4.38Å; L467-F469 HydrophobicContact CB-CE2 3.56Å; L467-F469 HydrophobicContact CB-CZ 4.06Å; L467-F469 HydrophobicContact CD1-CE2 4.31Å; L467-F469 HydrophobicContact CD1-CZ 4.11Å; L467-T481 HydrophobicContact CD2-CG2 3.89Å; L467-V516 HydrophobicContact CD1-CB 4.37Å; L467-V516 HydrophobicContact CD1-CG1 4.37Å; L467-V516 HydrophobicContact CD1-CG2 3.91Å
468	I	90.9	Very high	85.6	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	125	-177.7	-59.7	168	0	0	0	107.4	V413 L419 V457 T459 K479 F480 L485	V413-I468 HydrophobicContact CG2-CD1 4.47Å; L419-I468 HydrophobicContact CD2-CD1 4.28Å; L419-I468 HydrophobicContact CD2-CG2 3.63Å; V457-I468 HydrophobicContact CG1-CG2 3.6Å; T459-I468 HydrophobicContact CG2-CG1 4.49Å; I468-K479 CarbonylContact O-C 3.21Å; I468-K479 WeakPolarHBondContact O-CA 3.27Å; I468-F480 HydrophobicContact CB-CB 4.46Å; I468-F480 PolarHBondContact N-O 3.49Å; I468-F480 PolarHBondContact O-N 3.12Å; I468-L485 HydrophobicContact CD1-CD1 3.4Å; I468-L485 VanDerWaalsContact CD1-CD1 3.4Å; I468-L485 HydrophobicContact CD1-CG 4.46Å; I468-L485 HydrophobicContact CG2-CD1 4.45Å
469	F	90.1	Very high	85.5	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	120.8	-178.1	-64.1	-91.4	0	0	0	110.5	V457 W458 F460 L467 I477 L478 K479 F496 M509 V516	V457-F469 CarbonylContact C-O 3.58Å; V457-F469 WeakPolarHBondContact CA-O 3.43Å; W458-F469 HydrophobicContact CB-CB 4.26Å; W458-F469 PolarHBondContact N-O 2.85Å; W458-F469 PolarHBondContact O-N 2.83Å; F460-F469 HydrophobicContact CB-CE2 4.11Å; L467-F469 HydrophobicContact CB-CD2 4.38Å; L467-F469 HydrophobicContact CB-CE2 3.56Å; L467-F469 HydrophobicContact CB-CZ 4.06Å; L467-F469 HydrophobicContact CD1-CE2 4.31Å; L467-F469 HydrophobicContact CD1-CZ 4.11Å; F469-I477 HydrophobicContact CB-CG2 4.04Å; F469-I477 HydrophobicContact CD1-CG2 3.89Å; F469-I477 HydrophobicContact CG-CG2 4.44Å; F469-L478 CarbonylContact C-O 3.56Å; F469-L478 WeakPolarHBondContact CA-O 3.41Å; F469-K479 HydrophobicContact CD1-CB 4.01Å; F469-K479 HydrophobicContact CD1-CG 4.21Å; F469-K479 HydrophobicContact CE1-CB 3.88Å; F469-K479 HydrophobicContact CE1-CD 4.05Å; F469-K479 HydrophobicContact CE1-CG 3.74Å; F469-K479 HydrophobicContact CZ-CD 4.29Å; F469-K479 HydrophobicContact CZ-CG 4.14Å; F469-F496 HydrophobicContact CE1-CD1 4.29Å; F469-F496 HydrophobicContact CE1-CD2 4.04Å; F469-F496 HydrophobicContact CE1-CE1 4.45Å; F469-F496 HydrophobicContact CE1-CE2 4.2Å; F469-F496 HydrophobicContact CE1-CG 4.08Å; F469-F496 HydrophobicContact CE1-CZ 4.39Å; F469-M509 HydrophobicContact CD2-CG 3.95Å; F469-M509 HydrophobicContact CD2-SD 3.75Å; F469-M509 HydrophobicContact CE2-CG 3.58Å; F469-M509 HydrophobicContact CE2-SD 3.96Å; F469-M509 HydrophobicContact CG-SD 4.47Å; F469-M509 HydrophobicContact CZ-CG 3.98Å; F469-V516 HydrophobicContact CZ-CG1 4.06Å
470	L	90.2	Very high	85.4	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.01	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	116.4	177.3	-86.6	166.9	0	0	0	109.8	L430 L450 V455 V457 I477 L478 F480	L430-L470 HydrophobicContact CD1-CD2 4.46Å; L430-L470 HydrophobicContact CD2-CD1 3.9Å; L430-L470 HydrophobicContact CD2-CG 4.5Å; L450-L470 HydrophobicContact CD1-CD2 4.4Å; L450-L470 HydrophobicContact CD2-CD1 4.42Å; V455-L470 HydrophobicContact CB-CD2 4.39Å; V455-L470 HydrophobicContact CG2-CD2 3.95Å; V457-L470 HydrophobicContact CG2-CD2 3.61Å; L470-I477 CarbonylContact O-C 3.55Å; L470-I477 VanDerWaalsContact O-CA 3.31Å; L470-I477 WeakPolarHBondContact O-CA 3.16Å; L470-L478 HydrophobicContact CB-CB 4.23Å; L470-L478 PolarHBondContact N-O 2.98Å; L470-L478 PolarHBondContact O-N 3.13Å; L470-F480 HydrophobicContact CB-CE2 4.07Å; L470-F480 HydrophobicContact CD1-CD2 3.85Å; L470-F480 HydrophobicContact CD1-CE2 3.36Å; L470-F480 HydrophobicContact CD1-CZ 4.21Å; L470-F480 HydrophobicContact CG-CD2 4.38Å; L470-F480 HydrophobicContact CG-CE2 4.11Å
471	Q	89.6	Confident	85.5	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	124.2	173.8	178.3	167.2	28.2	0	0	111	V455 K456 W458 S476 I477 Y503 C504	V455-Q471 CarbonylContact C-O 3.31Å; V455-Q471 WeakPolarHBondContact CA-O 3.35Å; V455-Q471 WeakPolarHBondContact CB-O 3.37Å; K456-Q471 PolarHBondContact N-O 3.05Å; K456-Q471 PolarHBondContact O-N 3.21Å; W458-Q471 VanDerWaalsContact NE1-OE1 3.15Å; Q471-S476 CarbonylContact C-O 3.4Å; Q471-S476 WeakPolarHBondContact CA-O 3.4Å; Q471-I477 HydrophobicContact CB-CG1 4.12Å; Q471-I477 HydrophobicContact CG-CG1 4.23Å; Q471-Y503 HydrophobicContact CG-CD2 4.41Å; Q471-Y503 HydrophobicContact CG-CE2 4.23Å; Q471-C504 PolarHBondContact OE1-O 3.09Å
472	T	86.1	Confident	85.6	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.012	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	162.4	174.5	69.5	0	0	0	0	111.5	W452 T474 G475 S476	W452-T472 HydrophobicContact CD2-CG2 3.66Å; W452-T472 HydrophobicContact CE3-CG2 4.09Å; W452-T472 HydrophobicContact CG-CG2 4.17Å; W452-T472 HydrophobicContact CH2-CG2 4.11Å; W452-T472 HydrophobicContact CZ2-CG2 3.65Å; W452-T472 HydrophobicContact CZ3-CG2 4.3Å; T472-T474 PolarHBondContact O-N 3.46Å; T472-T474 VanDerWaalsContact O-N 3.16Å; T472-T474 PolarHBondContact OG1-N 3.38Å; T472-T474 PolarHBondContact OG1-OG1 3.44Å; T472-G475 PolarHBondContact O-N 2.9Å; T472-S476 PolarHBondContact N-O 3.33Å; T472-S476 WeakPolarHBondContact OG1-CB 3.41Å; T472-S476 PolarHBondContact OG1-N 3.35Å; T472-S476 VanDerWaalsContact OG1-N 3.13Å; T472-S476 PolarHBondContact OG1-O 2.98Å
473	A	79	Confident	85.8	Confident	49 Å²	49	33 Å²	33	41%	0.405	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-29.9	170.9	0	0	0	0	0	113.5	S454 G475	S454-A473 PolarHBondContact O-N 2.93Å; S454-A473 WeakPolarHBondContact OG-CB 3.24Å; A473-G475 PolarHBondContact O-N 2.82Å
474	T	77.7	Confident	86.2	Confident	86 Å²	86	29.9 Å²	29.9	53%	0.528	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-1.6	177.2	59.9	0	0	0	0	113.7	T472 S476	T472-T474 PolarHBondContact O-N 3.46Å; T472-T474 VanDerWaalsContact O-N 3.16Å; T472-T474 PolarHBondContact OG1-N 3.38Å; T472-T474 PolarHBondContact OG1-OG1 3.44Å; T474-S476 VanDerWaalsContact C-N 3.35Å; T474-S476 PolarHBondContact OG1-OG 3.26Å
475	G	80.4	Confident	86.6	Confident	1 Å²	1	24.6 Å²	24.6	1%	0.01	15%	0.146	C	C	.	.	S	Bend	trans	87	-3.5	-178.3	0	0	0	0	0	115.1	T472 A473 S502	T472-G475 PolarHBondContact O-N 2.9Å; A473-G475 PolarHBondContact O-N 2.82Å; G475-S502 WeakPolarHBondContact CA-O 3.35Å
476	S	85.2	Confident	86.7	Confident	51 Å²	51	23.8 Å²	23.8	36%	0.357	14%	0.144	S	C	.	.			trans	-67.9	138.6	176.4	-51.1	0	0	0	0	110.3	Q471 T472 T474	Q471-S476 CarbonylContact C-O 3.4Å; Q471-S476 WeakPolarHBondContact CA-O 3.4Å; T472-S476 PolarHBondContact N-O 3.33Å; T472-S476 WeakPolarHBondContact OG1-CB 3.41Å; T472-S476 PolarHBondContact OG1-N 3.35Å; T472-S476 VanDerWaalsContact OG1-N 3.13Å; T472-S476 PolarHBondContact OG1-O 2.98Å; T474-S476 VanDerWaalsContact C-N 3.35Å; T474-S476 PolarHBondContact OG1-OG 3.26Å
477	I	88.1	Confident	86.6	Confident	1 Å²	1	28 Å²	28	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	127.9	-179.4	-67.2	169.3	0	0	0	108.7	F469 L470 Q471 F496 C498 V507 L518	F469-I477 HydrophobicContact CB-CG2 4.04Å; F469-I477 HydrophobicContact CD1-CG2 3.89Å; F469-I477 HydrophobicContact CG-CG2 4.44Å; L470-I477 CarbonylContact O-C 3.55Å; L470-I477 VanDerWaalsContact O-CA 3.31Å; L470-I477 WeakPolarHBondContact O-CA 3.16Å; Q471-I477 HydrophobicContact CB-CG1 4.12Å; Q471-I477 HydrophobicContact CG-CG1 4.23Å; I477-F496 HydrophobicContact CG2-CB 4.2Å; I477-F496 WeakPolarHBondContact O-CA 3.48Å; I477-F496 WeakPolarHBondContact O-CB 3.2Å; I477-F496 PolarHBondContact O-N 3.47Å; I477-C498 HydrophobicContact CD1-CB 4.04Å; I477-V507 HydrophobicContact CD1-CG1 4.3Å; I477-L518 HydrophobicContact CD1-CD1 4.29Å; I477-L518 HydrophobicContact CD1-CD2 3.46Å; I477-L518 VanDerWaalsContact CD1-CD2 3.46Å; I477-L518 HydrophobicContact CD1-CG 4.43Å
478	L	88.5	Confident	85.7	Confident	4 Å²	4	33.3 Å²	33.3	2%	0.021	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	147.8	176.2	-60.3	163.9	0	0	0	108.8	W452 F469 L470 F480 L492 Q494 V495	W452-L478 HydrophobicContact CH2-CD1 3.48Å; W452-L478 VanDerWaalsContact CH2-CD1 3.48Å; W452-L478 HydrophobicContact CZ2-CD1 4.3Å; W452-L478 HydrophobicContact CZ3-CD1 3.96Å; F469-L478 CarbonylContact C-O 3.56Å; F469-L478 WeakPolarHBondContact CA-O 3.41Å; L470-L478 HydrophobicContact CB-CB 4.23Å; L470-L478 PolarHBondContact N-O 2.98Å; L470-L478 PolarHBondContact O-N 3.13Å; L478-F480 HydrophobicContact CB-CE2 3.49Å; L478-F480 VanDerWaalsContact CB-CE2 3.49Å; L478-F480 HydrophobicContact CB-CZ 3.77Å; L478-F480 HydrophobicContact CD1-CE2 4.46Å; L478-F480 HydrophobicContact CD1-CZ 4.31Å; L478-L492 HydrophobicContact CD1-CD2 4.07Å; L478-L492 WeakPolarHBondContact CD2-O 3.37Å; L478-Q494 WeakPolarHBondContact CA-O 3.37Å; L478-Q494 WeakPolarHBondContact CD2-O 3.31Å; L478-V495 HydrophobicContact CD2-CG2 3.94Å
479	K	88.4	Confident	84.6	Confident	56 Å²	56	39.7 Å²	39.7	24%	0.243	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	135.5	-178.5	177.9	-169.9	167	-169.4	0	110.5	I468 F469 Q494 F496	I468-K479 CarbonylContact O-C 3.21Å; I468-K479 WeakPolarHBondContact O-CA 3.27Å; F469-K479 HydrophobicContact CD1-CB 4.01Å; F469-K479 HydrophobicContact CD1-CG 4.21Å; F469-K479 HydrophobicContact CE1-CB 3.88Å; F469-K479 HydrophobicContact CE1-CD 4.05Å; F469-K479 HydrophobicContact CE1-CG 3.74Å; F469-K479 HydrophobicContact CZ-CD 4.29Å; F469-K479 HydrophobicContact CZ-CG 4.14Å; K479-Q494 PolarHBondContact N-O 2.89Å; K479-F496 HydrophobicContact CB-CB 4.33Å; K479-F496 HydrophobicContact CB-CD2 3.9Å; K479-F496 HydrophobicContact CB-CG 4.46Å; K479-F496 HydrophobicContact CD-CD2 3.77Å; K479-F496 HydrophobicContact CD-CE2 3.82Å; K479-F496 HydrophobicContact CG-CD2 4.37Å
480	F	88.3	Confident	83.9	Confident	3 Å²	3	41.3 Å²	41.3	1%	0.013	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	163.4	176.5	-53	-81	0	0	0	110.9	I468 L470 L478 L485 L490	I468-F480 HydrophobicContact CB-CB 4.46Å; I468-F480 PolarHBondContact N-O 3.49Å; I468-F480 PolarHBondContact O-N 3.12Å; L470-F480 HydrophobicContact CB-CE2 4.07Å; L470-F480 HydrophobicContact CD1-CD2 3.85Å; L470-F480 HydrophobicContact CD1-CE2 3.36Å; L470-F480 HydrophobicContact CD1-CZ 4.21Å; L470-F480 HydrophobicContact CG-CD2 4.38Å; L470-F480 HydrophobicContact CG-CE2 4.11Å; L478-F480 HydrophobicContact CB-CE2 3.49Å; L478-F480 VanDerWaalsContact CB-CE2 3.49Å; L478-F480 HydrophobicContact CB-CZ 3.77Å; L478-F480 HydrophobicContact CD1-CE2 4.46Å; L478-F480 HydrophobicContact CD1-CZ 4.31Å; F480-L485 HydrophobicContact CB-CD2 4.18Å; F480-L485 HydrophobicContact CB-CG 4.31Å; F480-L485 HydrophobicContact CG-CD2 4.25Å; F480-L490 HydrophobicContact CD1-CD1 4.3Å; F480-L490 HydrophobicContact CE1-CD1 3.99Å; F480-L490 HydrophobicContact CE1-CG 4Å; F480-L490 HydrophobicContact CE2-CD1 4.46Å; F480-L490 HydrophobicContact CZ-CD1 4.07Å; F480-L490 HydrophobicContact CZ-CG 4.09Å
481	T	88.5	Confident	83.2	Confident	20 Å²	20	44.5 Å²	44.5	12%	0.123	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	161.2	164.7	69.8	0	0	0	0	110.2	L467 P483 D484 L485	L467-T481 HydrophobicContact CD2-CG2 3.89Å; T481-P483 WeakPolarHBondContact OG1-CD 3.38Å; T481-D484 WeakPolarHBondContact CB-OD2 3.42Å; T481-D484 PolarHBondContact N-OD2 3.37Å; T481-D484 WeakPolarHBondContact O-CB 3.4Å; T481-D484 PolarHBondContact O-N 3.25Å; T481-D484 VanDerWaalsContact O-N 3.16Å; T481-D484 PolarHBondContact OG1-OD1 3.05Å; T481-D484 PolarHBondContact OG1-OD2 2.91Å; T481-L485 PolarHBondContact O-N 2.95Å
482	L	87.3	Confident	82.5	Confident	21 Å²	21	47.7 Å²	47.7	11%	0.11	27%	0.266	C	S	.	.	H	α-helix	trans	-56.4	-44.6	176.7	177.5	66.8	0	0	0	112.7	V413 D414 H417 V432 D484 L485 L486	V413-L482 HydrophobicContact CG1-CB 4.16Å; V413-L482 HydrophobicContact CG1-CD1 4.2Å; V413-L482 HydrophobicContact CG1-CD2 3.89Å; V413-L482 HydrophobicContact CG1-CG 4.3Å; D414-L482 WeakPolarHBondContact OD2-CD2 3.41Å; H417-L482 HydrophobicContact CB-CD1 4.45Å; H417-L482 HydrophobicContact CB-CD2 4.37Å; V432-L482 HydrophobicContact CG1-CD1 4Å; L482-D484 VanDerWaalsContact C-N 3.31Å; L482-D484 PolarHBondContact O-N 3.49Å; L482-L485 PolarHBondContact O-N 3.3Å; L482-L486 HydrophobicContact CD1-CD1 4.12Å; L482-L486 HydrophobicContact CD1-CD2 4.4Å; L482-L486 HydrophobicContact CD1-CG 3.99Å; L482-L486 HydrophobicContact CD2-CD1 4.38Å; L482-L486 HydrophobicContact CG-CD1 3.91Å; L482-L486 HydrophobicContact CG-CG 4.2Å; L482-L486 WeakPolarHBondContact O-CG 3.32Å; L482-L486 PolarHBondContact O-N 3.27Å
483	P	86.9	Confident	81.5	Confident	77 Å²	77	51.8 Å²	51.8	50%	0.5	30%	0.295	S	S	.	.	H	α-helix	trans	-55.5	-40.9	173.6	-28	35.8	0	0	0	114.1	T481 L485 L486 N487	T481-P483 WeakPolarHBondContact OG1-CD 3.38Å; P483-L485 VanDerWaalsContact C-N 3.3Å; P483-L485 PolarHBondContact O-N 3.06Å; P483-L486 PolarHBondContact O-N 3.34Å; P483-N487 WeakPolarHBondContact O-CB 3.46Å; P483-N487 VanDerWaalsContact O-CG 3.26Å; P483-N487 PolarHBondContact O-N 3.12Å; P483-N487 PolarHBondContact O-ND2 3.45Å
484	D	84.9	Confident	81	Confident	52 Å²	52	54.1 Å²	54.1	28%	0.278	30%	0.297	S	S	.	.	H	α-helix	trans	-60.3	-43.7	178.3	-53	-32.1	0	0	0	110.7	T481 L482 E489	T481-D484 WeakPolarHBondContact CB-OD2 3.42Å; T481-D484 PolarHBondContact N-OD2 3.37Å; T481-D484 WeakPolarHBondContact O-CB 3.4Å; T481-D484 PolarHBondContact O-N 3.25Å; T481-D484 VanDerWaalsContact O-N 3.16Å; T481-D484 PolarHBondContact OG1-OD1 3.05Å; T481-D484 PolarHBondContact OG1-OD2 2.91Å; L482-D484 VanDerWaalsContact C-N 3.31Å; L482-D484 PolarHBondContact O-N 3.49Å; D484-E489 PolarHBondContact O-N 2.91Å; D484-E489 VanDerWaalsContact O-N 3.12Å
485	L	86.4	Confident	80.6	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-68.6	-37.9	178.2	-63.8	-177.3	0	0	0	112.9	L419 L430 V432 C446 H448 I468 F480 T481 L482 P483 N488 L490	L419-L485 HydrophobicContact CD1-CD1 4.21Å; L430-L485 HydrophobicContact CD2-CD1 4.09Å; L430-L485 HydrophobicContact CD2-CD2 3.95Å; V432-L485 HydrophobicContact CG2-CB 4.1Å; V432-L485 HydrophobicContact CG2-CD1 4.06Å; C446-L485 PolarHBondContact SG-O 3.09Å; H448-L485 PolarHBondContact CE1-O 3.28Å; H448-L485 PolarHBondContact NE2-O 2.94Å; I468-L485 HydrophobicContact CD1-CD1 3.4Å; I468-L485 VanDerWaalsContact CD1-CD1 3.4Å; I468-L485 HydrophobicContact CD1-CG 4.46Å; I468-L485 HydrophobicContact CG2-CD1 4.45Å; F480-L485 HydrophobicContact CB-CD2 4.18Å; F480-L485 HydrophobicContact CB-CG 4.31Å; F480-L485 HydrophobicContact CG-CD2 4.25Å; T481-L485 PolarHBondContact O-N 2.95Å; L482-L485 PolarHBondContact O-N 3.3Å; P483-L485 VanDerWaalsContact C-N 3.3Å; P483-L485 PolarHBondContact O-N 3.06Å; L485-N488 PolarHBondContact O-N 2.93Å; L485-L490 HydrophobicContact CD2-CD1 3.53Å
486	L	88.1	Confident	80.4	Confident	52 Å²	52	56 Å²	56	27%	0.272	31%	0.305	S	S	.	.	H	α-helix	trans	-73	-28.6	179.6	-68.5	-179.9	0	0	0	112.6	V432 K445 L482 P483 N488	V432-L486 HydrophobicContact CG1-CD2 4.08Å; K445-L486 HydrophobicContact CB-CD2 4.41Å; K445-L486 HydrophobicContact CD-CD2 3.54Å; K445-L486 HydrophobicContact CG-CD2 3.77Å; L482-L486 HydrophobicContact CD1-CD1 4.12Å; L482-L486 HydrophobicContact CD1-CD2 4.4Å; L482-L486 HydrophobicContact CD1-CG 3.99Å; L482-L486 HydrophobicContact CD2-CD1 4.38Å; L482-L486 HydrophobicContact CG-CD1 3.91Å; L482-L486 HydrophobicContact CG-CG 4.2Å; L482-L486 WeakPolarHBondContact O-CG 3.32Å; L482-L486 PolarHBondContact O-N 3.27Å; P483-L486 PolarHBondContact O-N 3.34Å; L486-N488 PolarHBondContact O-N 2.65Å
487	N	84.2	Confident	79.8	Confident	111 Å²	111	59.4 Å²	59.4	59%	0.594	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	4.8	175.9	-69.1	-24.9	0	0	0	113.6	P483 E489	P483-N487 WeakPolarHBondContact O-CB 3.46Å; P483-N487 VanDerWaalsContact O-CG 3.26Å; P483-N487 PolarHBondContact O-N 3.12Å; P483-N487 PolarHBondContact O-ND2 3.45Å; N487-E489 VanDerWaalsContact C-N 3.26Å; N487-E489 PolarHBondContact O-N 3.02Å
488	N	71.3	Confident	79.3	Confident	112 Å²	112	60.5 Å²	60.5	60%	0.599	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	28.2	-176	-68.1	-33.6	0	0	0	114.7	L485 L486	L485-N488 PolarHBondContact O-N 2.93Å; L486-N488 PolarHBondContact O-N 2.65Å
489	E	68.3	Low	78.3	Confident	134 Å²	134	61.6 Å²	61.6	63%	0.626	34%	0.335	S	S	*	.			trans	-104.3	78.6	179.2	-67.5	-172.3	170	0	0	110.6	D484 N487 D491	D484-E489 PolarHBondContact O-N 2.91Å; D484-E489 VanDerWaalsContact O-N 3.12Å; N487-E489 VanDerWaalsContact C-N 3.26Å; N487-E489 PolarHBondContact O-N 3.02Å; E489-D491 PolarHBondContact O-N 3.15Å
490	L	75.4	Confident	77.7	Confident	34 Å²	34	59.2 Å²	59.2	18%	0.178	33%	0.326	C	S	.	.			trans	-86.7	80.3	172	-157.4	92.8	0	0	0	110.3	L430 H448 L450 F480 L485 L492	L430-L490 HydrophobicContact CD2-CD1 4.42Å; H448-L490 HydrophobicContact CB-CD1 4.28Å; H448-L490 HydrophobicContact CB-CD2 4.35Å; L450-L490 HydrophobicContact CD2-CD2 3.75Å; F480-L490 HydrophobicContact CD1-CD1 4.3Å; F480-L490 HydrophobicContact CE1-CD1 3.99Å; F480-L490 HydrophobicContact CE1-CG 4Å; F480-L490 HydrophobicContact CE2-CD1 4.46Å; F480-L490 HydrophobicContact CZ-CD1 4.07Å; F480-L490 HydrophobicContact CZ-CG 4.09Å; L485-L490 HydrophobicContact CD2-CD1 3.53Å; L490-L492 HydrophobicContact CD2-CD2 3.34Å; L490-L492 HydrophobicContact CD2-CG 4.17Å; L490-L492 HydrophobicContact CG-CD2 3.95Å; L490-L492 PolarHBondContact O-N 3.12Å
491	D	74.1	Confident	76.9	Confident	69 Å²	69	64 Å²	64	37%	0.369	37%	0.365	S	S	.	.			trans	-74.5	93.3	176.1	-175.5	8.8	0	0	0	111.2	E489 S493 Q494	E489-D491 PolarHBondContact O-N 3.15Å; D491-S493 PolarHBondContact O-N 3.27Å; D491-S493 VanDerWaalsContact OD1-CB 3.26Å; D491-S493 WeakPolarHBondContact OD1-CB 3.47Å; D491-S493 PolarHBondContact OD1-N 3.31Å; D491-S493 PolarHBondContact OD1-OG 3.41Å; D491-S493 PolarHBondContact OD2-OG 3.32Å; D491-S493 VanDerWaalsContact OD2-OG 3.1Å; D491-Q494 HydrophobicContact CB-CG 4.26Å; D491-Q494 PolarHBondContact O-N 3.44Å; D491-Q494 WeakPolarHBondContact OD2-CG 3.28Å; D491-Q494 PolarHBondContact OD2-NE2 2.97Å
492	L	74.4	Confident	76.5	Confident	66 Å²	66	64 Å²	64	35%	0.346	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-3.7	178.4	-61.1	-175.3	0	0	0	114	P451 W452 L478 L490	P451-L492 HydrophobicContact CG-CD1 3.85Å; W452-L492 HydrophobicContact CH2-CD1 4.17Å; W452-L492 HydrophobicContact CH2-CD2 3.77Å; W452-L492 HydrophobicContact CH2-CG 4.41Å; W452-L492 HydrophobicContact CZ3-CD2 3.93Å; L478-L492 HydrophobicContact CD1-CD2 4.07Å; L478-L492 WeakPolarHBondContact CD2-O 3.37Å; L490-L492 HydrophobicContact CD2-CD2 3.34Å; L490-L492 HydrophobicContact CD2-CG 4.17Å; L490-L492 HydrophobicContact CG-CD2 3.95Å; L490-L492 PolarHBondContact O-N 3.12Å
493	S	66.4	Low	76.2	Confident	89 Å²	89	65.3 Å²	65.3	62%	0.622	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-14.9	176.3	76	0	0	0	0	113.6	D491 V495	D491-S493 PolarHBondContact O-N 3.27Å; D491-S493 VanDerWaalsContact OD1-CB 3.26Å; D491-S493 WeakPolarHBondContact OD1-CB 3.47Å; D491-S493 PolarHBondContact OD1-N 3.31Å; D491-S493 PolarHBondContact OD1-OG 3.41Å; D491-S493 PolarHBondContact OD2-OG 3.32Å; D491-S493 VanDerWaalsContact OD2-OG 3.1Å; S493-V495 VanDerWaalsContact C-N 3.29Å; S493-V495 PolarHBondContact O-N 3.48Å
494	Q	68.6	Low	76.2	Confident	97 Å²	97	61.7 Å²	61.7	45%	0.453	35%	0.346	S	S	.	.			trans	-81.7	68.8	-175.6	-61.6	-170.6	17.8	0	0	112.9	L478 K479 D491 F496	L478-Q494 WeakPolarHBondContact CA-O 3.37Å; L478-Q494 WeakPolarHBondContact CD2-O 3.31Å; K479-Q494 PolarHBondContact N-O 2.89Å; D491-Q494 HydrophobicContact CB-CG 4.26Å; D491-Q494 PolarHBondContact O-N 3.44Å; D491-Q494 WeakPolarHBondContact OD2-CG 3.28Å; D491-Q494 PolarHBondContact OD2-NE2 2.97Å; Q494-F496 PolarHBondContact O-N 2.94Å
495	V	70	Confident	76.1	Confident	86 Å²	86	61.1 Å²	61.1	52%	0.521	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	119.7	173.8	-174.7	0	0	0	0	109.9	L478 S493	L478-V495 HydrophobicContact CD2-CG2 3.94Å; S493-V495 VanDerWaalsContact C-N 3.29Å; S493-V495 PolarHBondContact O-N 3.48Å
496	F	75.6	Confident	76.2	Confident	41 Å²	41	63.3 Å²	63.3	18%	0.18	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	135.1	170.1	-156.5	-93	0	0	0	109.8	F469 I477 K479 Q494 C498 L518	F469-F496 HydrophobicContact CE1-CD1 4.29Å; F469-F496 HydrophobicContact CE1-CD2 4.04Å; F469-F496 HydrophobicContact CE1-CE1 4.45Å; F469-F496 HydrophobicContact CE1-CE2 4.2Å; F469-F496 HydrophobicContact CE1-CG 4.08Å; F469-F496 HydrophobicContact CE1-CZ 4.39Å; I477-F496 HydrophobicContact CG2-CB 4.2Å; I477-F496 WeakPolarHBondContact O-CA 3.48Å; I477-F496 WeakPolarHBondContact O-CB 3.2Å; I477-F496 PolarHBondContact O-N 3.47Å; K479-F496 HydrophobicContact CB-CB 4.33Å; K479-F496 HydrophobicContact CB-CD2 3.9Å; K479-F496 HydrophobicContact CB-CG 4.46Å; K479-F496 HydrophobicContact CD-CD2 3.77Å; K479-F496 HydrophobicContact CD-CE2 3.82Å; K479-F496 HydrophobicContact CG-CD2 4.37Å; Q494-F496 PolarHBondContact O-N 2.94Å; F496-C498 PolarHBondContact O-N 3.47Å; F496-L518 HydrophobicContact CD1-CB 4.29Å; F496-L518 HydrophobicContact CE1-CB 3.94Å
497	H	72.8	Confident	76.2	Confident	122 Å²	122	61.1 Å²	61.1	57%	0.565	35%	0.345	S	S	*	.			trans	-64.1	104.1	-175.6	-69.1	-76.6	0	0	0	112	D530 E531	H497-D530 CarbonylContact O-C 3.53Å; H497-D530 WeakPolarHBondContact O-CA 3.45Å; H497-E531 HydrophobicContact CB-CG 3.87Å; H497-E531 IonicContact CE1-OE1 3.2Å; H497-E531 IonicContact CG-OE1 3.89Å; H497-E531 IonicContact ND1-OE1 3.75Å; H497-E531 PolarHBondContact ND1-OE1 3.08Å
498	C	77.2	Confident	76.4	Confident	25 Å²	25	57.6 Å²	57.6	17%	0.169	33%	0.326	C	S	.	.			trans	-124.7	130.1	173.7	-177.5	0	0	0	0	109.2	I477 F496 S500 L518 D530	I477-C498 HydrophobicContact CD1-CB 4.04Å; F496-C498 PolarHBondContact O-N 3.47Å; C498-S500 VanDerWaalsContact C-N 3.28Å; C498-S500 PolarHBondContact O-N 3.3Å; C498-L518 HydrophobicContact CB-CD2 3.69Å; C498-D530 CarbonylContact C-O 3.56Å; C498-D530 WeakPolarHBondContact CA-O 3.48Å
499	G	66.5	Low	77.3	Confident	27 Å²	27	53 Å²	53	28%	0.278	30%	0.3	S	S	.	.	S	Bend	trans	-80	-8.2	-176.2	0	0	0	0	0	114.3	Y528 D530	G499-Y528 WeakPolarHBondContact O-CE1 3.45Å; G499-D530 PolarHBondContact N-O 3.27Å
500	S	76.6	Confident	78.1	Confident	6 Å²	6	46.6 Å²	46.6	4%	0.042	27%	0.271	C	S	.	.			trans	-85.4	116.2	176.7	-176.6	0	0	0	0	109.9	C498 S502 C504	C498-S500 VanDerWaalsContact C-N 3.28Å; C498-S500 PolarHBondContact O-N 3.3Å; S500-S502 PolarHBondContact O-N 2.76Å; S500-S502 PolarHBondContact OG-N 2.82Å; S500-S502 PolarHBondContact OG-O 3.41Å; S500-S502 PolarHBondContact OG-OG 2.9Å; S500-C504 VanDerWaalsContact CB-SG 3.56Å
501	A	71.1	Confident	78.6	Confident	102 Å²	102	48.1 Å²	48.1	84%	0.843	28%	0.277	S	S	*	.	S	Bend	trans	-80.9	15.9	167.2	0	0	0	0	0	112.7
502	S	80.4	Confident	78.9	Confident	20 Å²	20	45.5 Å²	45.5	14%	0.14	26%	0.264	C	S	.	.	S	Bend	trans	-135.9	159.4	-174.6	53	0	0	0	0	110	G475 S500 C504 N522	G475-S502 WeakPolarHBondContact CA-O 3.35Å; S500-S502 PolarHBondContact O-N 2.76Å; S500-S502 PolarHBondContact OG-N 2.82Å; S500-S502 PolarHBondContact OG-O 3.41Å; S500-S502 PolarHBondContact OG-OG 2.9Å; S502-C504 PolarHBondContact O-N 3.4Å; S502-N522 PolarHBondContact OG-ND2 2.82Å; S502-N522 VanDerWaalsContact OG-ND2 3.1Å
503	Y	82.1	Confident	79	Confident	50 Å²	50	49.1 Å²	49.1	20%	0.196	28%	0.277	C	S	.	.			trans	-57.8	138.6	176.4	-169.7	-88.3	0	0	0	111.6	I315 K456 Q471	I315-Y503 HydrophobicContact CD1-CD1 4.5Å; I315-Y503 HydrophobicContact CD1-CE1 3.36Å; I315-Y503 WeakPolarHBondContact CD1-OH 3.32Å; I315-Y503 HydrophobicContact CG1-CE1 4.35Å; K456-Y503 WeakPolarHBondContact CB-OH 3.47Å; K456-Y503 WeakPolarHBondContact CD-OH 3.35Å; Q471-Y503 HydrophobicContact CG-CD2 4.41Å; Q471-Y503 HydrophobicContact CG-CE2 4.23Å
504	C	85	Confident	79.5	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	118.8	-178.8	-54.3	0	0	0	0	110.2	Q471 S500 S502 Q506 V507 L521	Q471-C504 PolarHBondContact OE1-O 3.09Å; S500-C504 VanDerWaalsContact CB-SG 3.56Å; S502-C504 PolarHBondContact O-N 3.4Å; C504-Q506 VanDerWaalsContact C-N 3.32Å; C504-Q506 PolarHBondContact O-N 2.93Å; C504-V507 HydrophobicContact CB-CG2 3.62Å; C504-L521 CarbonylContact C-O 3.53Å; C504-L521 WeakPolarHBondContact CA-O 3.45Å
505	S	83.2	Confident	80.3	Confident	41 Å²	41	54 Å²	54	29%	0.287	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	-38	180	62	0	0	0	0	112.8	L521	S505-L521 PolarHBondContact N-O 2.93Å; S505-L521 PolarHBondContact OG-O 3.14Å
506	Q	88.4	Confident	81.1	Confident	46 Å²	46	50.6 Å²	50.6	22%	0.215	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	135.4	178.8	-175.9	-176.1	-6	0	0	109.1	C504 E508 L521 F541	C504-Q506 VanDerWaalsContact C-N 3.32Å; C504-Q506 PolarHBondContact O-N 2.93Å; Q506-E508 PolarHBondContact NE2-OE1 3.42Å; Q506-L521 PolarHBondContact N-O 3.43Å; Q506-L521 PolarHBondContact O-N 2.98Å; Q506-F541 HydrophobicContact CB-CE1 3.81Å; Q506-F541 HydrophobicContact CB-CZ 4.45Å; Q506-F541 HydrophobicContact CG-CD1 4.38Å; Q506-F541 HydrophobicContact CG-CE1 3.59Å; Q506-F541 HydrophobicContact CG-CZ 3.86Å; Q506-F541 PolarHBondContact NE2-O 2.91Å
507	V	89.4	Confident	81.7	Confident	5 Å²	5	49.4 Å²	49.4	3%	0.03	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	127.4	176.3	-164.4	0	0	0	0	107.8	W458 I477 C504 M509 L518 I519	W458-V507 HydrophobicContact CD2-CB 3.98Å; W458-V507 HydrophobicContact CD2-CG2 4.41Å; W458-V507 HydrophobicContact CE3-CB 4.43Å; W458-V507 HydrophobicContact CG-CB 4.33Å; W458-V507 HydrophobicContact CH2-CB 4.47Å; W458-V507 HydrophobicContact CH2-CG2 4.48Å; W458-V507 HydrophobicContact CZ2-CB 4.03Å; W458-V507 HydrophobicContact CZ2-CG2 3.72Å; I477-V507 HydrophobicContact CD1-CG1 4.3Å; C504-V507 HydrophobicContact CB-CG2 3.62Å; V507-M509 HydrophobicContact CB-CE 3.82Å; V507-M509 HydrophobicContact CG1-CE 3.2Å; V507-L518 HydrophobicContact CG1-CD1 3.37Å; V507-L518 HydrophobicContact CG1-CD2 4.44Å; V507-L518 HydrophobicContact CG1-CG 3.9Å; V507-I519 CarbonylContact C-O 3.45Å; V507-I519 WeakPolarHBondContact CA-O 3.42Å
508	E	88.7	Confident	82.5	Confident	38 Å²	38	43.6 Å²	43.6	18%	0.178	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	147.6	172.2	-61.2	-174.7	175.4	0	0	109.1	R320 Q506 I519 F541 V543	R320-E508 IonicContact CZ-OE1 3.72Å; R320-E508 IonicContact NH2-OE1 3.06Å; R320-E508 PolarHBondContact NH2-OE1 3.32Å; Q506-E508 PolarHBondContact NE2-OE1 3.42Å; E508-I519 PolarHBondContact N-O 3.39Å; E508-I519 PolarHBondContact O-N 3.31Å; E508-F541 HydrophobicContact CB-CE2 3.85Å; E508-F541 HydrophobicContact CB-CZ 4.19Å; E508-F541 HydrophobicContact CG-CE2 3.8Å; E508-F541 HydrophobicContact CG-CZ 3.98Å; E508-V543 HydrophobicContact CB-CG2 4.48Å; E508-V543 PolarHBondContact OE2-N 3.2Å
509	M	88.5	Confident	83.1	Confident	14 Å²	14	42.4 Å²	42.4	7%	0.069	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	146.6	176.9	-59.9	84.1	-118.3	0	0	108.7	W458 F460 F469 V507 V516 H517 L518	W458-M509 HydrophobicContact CB-CE 4.22Å; W458-M509 HydrophobicContact CB-SD 4.46Å; F460-M509 HydrophobicContact CB-CB 3.82Å; F460-M509 HydrophobicContact CB-CG 4.09Å; F460-M509 HydrophobicContact CB-SD 4.02Å; F460-M509 HydrophobicContact CD1-CB 4.21Å; F460-M509 HydrophobicContact CD2-CB 3.53Å; F460-M509 WeakPolarHBondContact CD2-O 3.34Å; F460-M509 HydrophobicContact CE2-CB 4.1Å; F460-M509 WeakPolarHBondContact CE2-O 3.37Å; F460-M509 HydrophobicContact CG-CB 3.57Å; F460-M509 HydrophobicContact CG-CG 4.36Å; F469-M509 HydrophobicContact CD2-CG 3.95Å; F469-M509 HydrophobicContact CD2-SD 3.75Å; F469-M509 HydrophobicContact CE2-CG 3.58Å; F469-M509 HydrophobicContact CE2-SD 3.96Å; F469-M509 HydrophobicContact CG-SD 4.47Å; F469-M509 HydrophobicContact CZ-CG 3.98Å; V507-M509 HydrophobicContact CB-CE 3.82Å; V507-M509 HydrophobicContact CG1-CE 3.2Å; M509-V516 HydrophobicContact CB-CG1 4.14Å; M509-V516 HydrophobicContact CG-CG1 4.42Å; M509-H517 WeakPolarHBondContact CA-O 3.45Å; M509-L518 HydrophobicContact CE-CD1 3.62Å; M509-L518 HydrophobicContact CG-CD1 4.13Å
510	L	86.7	Confident	84.3	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	151	172.9	68.4	89	0	0	0	109.7	C512 V516 H517 I519 V543 I563 V567	L510-C512 HydrophobicContact CD1-CB 3.71Å; L510-V516 CarbonylContact O-C 3.49Å; L510-V516 VanDerWaalsContact O-CA 3.3Å; L510-V516 WeakPolarHBondContact O-CA 3.4Å; L510-H517 HydrophobicContact CD1-CB 3.91Å; L510-H517 HydrophobicContact CG-CB 4.03Å; L510-H517 PolarHBondContact N-O 3.11Å; L510-H517 PolarHBondContact O-N 3.32Å; L510-I519 HydrophobicContact CD2-CD1 3.38Å; L510-I519 HydrophobicContact CD2-CG1 3.92Å; L510-V543 HydrophobicContact CB-CG1 4.49Å; L510-V543 HydrophobicContact CD2-CG2 4.33Å; L510-I563 HydrophobicContact CD1-CG2 3.64Å; L510-I563 HydrophobicContact CD2-CD1 3.95Å; L510-I563 HydrophobicContact CD2-CG1 4.14Å; L510-I563 HydrophobicContact CD2-CG2 4.09Å; L510-V567 HydrophobicContact CD1-CG2 4.14Å
511	E	84.3	Confident	85	Confident	66 Å²	66	41.2 Å²	41.2	31%	0.308	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	118.9	172.1	-176.3	163.1	-168.5	0	0	110.1	F460 R462 K515 V516	F460-E511 HydrophobicContact CE1-CB 4.21Å; F460-E511 HydrophobicContact CZ-CB 3.95Å; R462-E511 WeakPolarHBondContact CG-OE2 3.29Å; R462-E511 IonicContact NE-OE1 3.31Å; R462-E511 IonicContact NE-OE2 3.6Å; R462-E511 PolarHBondContact NE-OE2 2.9Å; R462-E511 IonicContact NH2-OE1 2.86Å; E511-K515 WeakPolarHBondContact CA-O 3.32Å; E511-V516 HydrophobicContact CB-CG2 4.24Å
512	C	80.6	Confident	85.8	Confident	15 Å²	15	36.5 Å²	36.5	10%	0.101	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	132.7	176.1	-170.5	0	0	0	0	108.8	L510 N514 K515 I563 V567	L510-C512 HydrophobicContact CD1-CB 3.71Å; C512-N514 VanDerWaalsContact C-N 3.27Å; C512-N514 PolarHBondContact O-N 2.97Å; C512-K515 PolarHBondContact N-O 3.26Å; C512-K515 PolarHBondContact O-N 3.24Å; C512-K515 VanDerWaalsContact O-O 3.08Å; C512-I563 HydrophobicContact CB-CG2 3.98Å; C512-V567 HydrophobicContact CB-CG2 4.12Å
513	F	76.9	Confident	85.8	Confident	142 Å²	142	41 Å²	41	62%	0.623	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.1	40.3	-176.9	-50.5	-67.7	0	0	0	113.9	K515 K564	F513-K515 PolarHBondContact O-N 3.22Å; F513-K515 VanDerWaalsContact O-N 3.17Å; F513-K564 HydrophobicContact CE2-CG 4.46Å; F513-K564 HydrophobicContact CZ-CD 4.38Å; F513-K564 HydrophobicContact CZ-CG 4.01Å
514	N	78	Confident	86	Confident	143 Å²	143	44.5 Å²	44.5	77%	0.765	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	58	20.1	-175.6	-61.1	-5.8	0	0	0	114.6	C512	C512-N514 VanDerWaalsContact C-N 3.27Å; C512-N514 PolarHBondContact O-N 2.97Å
515	K	84.5	Confident	86.1	Confident	144 Å²	144	46.1 Å²	46.1	63%	0.626	23%	0.226	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-117.4	138	171.7	-68.8	-173.1	178.9	-176.9	0	109.4	E511 C512 F513	E511-K515 WeakPolarHBondContact CA-O 3.32Å; C512-K515 PolarHBondContact N-O 3.26Å; C512-K515 PolarHBondContact O-N 3.24Å; C512-K515 VanDerWaalsContact O-O 3.08Å; F513-K515 PolarHBondContact O-N 3.22Å; F513-K515 VanDerWaalsContact O-N 3.17Å
516	V	86.7	Confident	86.5	Confident	16 Å²	16	47.9 Å²	47.9	10%	0.097	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	127.9	172.8	163.4	0	0	0	0	109.1	F460 L467 F469 M509 L510 E511	F460-V516 HydrophobicContact CD1-CG2 4.04Å; F460-V516 HydrophobicContact CE1-CG2 3.58Å; F460-V516 HydrophobicContact CZ-CG2 4.45Å; L467-V516 HydrophobicContact CD1-CB 4.37Å; L467-V516 HydrophobicContact CD1-CG1 4.37Å; L467-V516 HydrophobicContact CD1-CG2 3.91Å; F469-V516 HydrophobicContact CZ-CG1 4.06Å; M509-V516 HydrophobicContact CB-CG1 4.14Å; M509-V516 HydrophobicContact CG-CG1 4.42Å; L510-V516 CarbonylContact O-C 3.49Å; L510-V516 VanDerWaalsContact O-CA 3.3Å; L510-V516 WeakPolarHBondContact O-CA 3.4Å; E511-V516 HydrophobicContact CB-CG2 4.24Å
517	H	87.8	Confident	86.6	Confident	16 Å²	16	45.7 Å²	45.7	7%	0.074	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	140.4	175.3	-67	-76.9	0	0	0	109.5	M509 L510 D530 V567	M509-H517 WeakPolarHBondContact CA-O 3.45Å; L510-H517 HydrophobicContact CD1-CB 3.91Å; L510-H517 HydrophobicContact CG-CB 4.03Å; L510-H517 PolarHBondContact N-O 3.11Å; L510-H517 PolarHBondContact O-N 3.32Å; H517-D530 WeakPolarHBondContact CA-OD1 3.48Å; H517-D530 IonicContact CE1-OD2 3.72Å; H517-D530 IonicContact CG-OD2 3.74Å; H517-D530 IonicContact ND1-OD1 3.42Å; H517-D530 IonicContact ND1-OD2 2.79Å; H517-D530 PolarHBondContact ND1-OD2 3.05Å; H517-V567 WeakPolarHBondContact NE2-CG1 3.34Å
518	L	89.5	Confident	86.6	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	123.3	179.6	-173.8	83.4	0	0	0	109.3	I477 F496 C498 V507 M509 V529 D530	I477-L518 HydrophobicContact CD1-CD1 4.29Å; I477-L518 HydrophobicContact CD1-CD2 3.46Å; I477-L518 VanDerWaalsContact CD1-CD2 3.46Å; I477-L518 HydrophobicContact CD1-CG 4.43Å; F496-L518 HydrophobicContact CD1-CB 4.29Å; F496-L518 HydrophobicContact CE1-CB 3.94Å; C498-L518 HydrophobicContact CB-CD2 3.69Å; V507-L518 HydrophobicContact CG1-CD1 3.37Å; V507-L518 HydrophobicContact CG1-CD2 4.44Å; V507-L518 HydrophobicContact CG1-CG 3.9Å; M509-L518 HydrophobicContact CE-CD1 3.62Å; M509-L518 HydrophobicContact CG-CD1 4.13Å; L518-V529 CarbonylContact O-C 3.58Å; L518-V529 WeakPolarHBondContact O-CA 3.28Å; L518-D530 PolarHBondContact N-OD1 2.87Å; L518-D530 PolarHBondContact O-N 3.04Å
519	I	90.6	Very high	86.6	Confident	0 Å²	0	45 Å²	45	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	120.2	169.5	-57.2	-171.9	0	0	0	108.4	V507 E508 L510 L527 Y528 V529 F541 V543 L549	V507-I519 CarbonylContact C-O 3.45Å; V507-I519 WeakPolarHBondContact CA-O 3.42Å; E508-I519 PolarHBondContact N-O 3.39Å; E508-I519 PolarHBondContact O-N 3.31Å; L510-I519 HydrophobicContact CD2-CD1 3.38Å; L510-I519 HydrophobicContact CD2-CG1 3.92Å; I519-L527 HydrophobicContact CG2-CD1 3.57Å; I519-L527 HydrophobicContact CG2-CG 4.27Å; I519-Y528 WeakPolarHBondContact CA-O 3.29Å; I519-V529 HydrophobicContact CG1-CG2 4.43Å; I519-F541 HydrophobicContact CB-CE2 3.92Å; I519-F541 HydrophobicContact CB-CZ 4.3Å; I519-F541 HydrophobicContact CG2-CD2 3.78Å; I519-F541 HydrophobicContact CG2-CE1 4.46Å; I519-F541 HydrophobicContact CG2-CE2 3.39Å; I519-F541 HydrophobicContact CG2-CG 4.47Å; I519-F541 HydrophobicContact CG2-CZ 3.77Å; I519-V543 HydrophobicContact CD1-CG2 4Å; I519-L549 HydrophobicContact CD1-CD1 3.64Å; I519-L549 HydrophobicContact CD1-CD2 3.93Å; I519-L549 HydrophobicContact CD1-CG 4.29Å; I519-L549 HydrophobicContact CG2-CD1 4.38Å
520	S	91.3	Very high	86.5	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	133.4	-175.4	62.1	0	0	0	0	112.2	L527 Y528	S520-L527 CarbonylContact O-C 3.42Å; S520-L527 WeakPolarHBondContact O-CA 3.28Å; S520-Y528 PolarHBondContact N-O 2.88Å; S520-Y528 PolarHBondContact O-N 3.08Å
521	L	91.6	Very high	86.5	Confident	7 Å²	7	50.4 Å²	50.4	4%	0.037	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	114.5	174.8	178.9	63	0	0	0	109.7	C504 S505 Q506 K526 L527 V538 F541	C504-L521 CarbonylContact C-O 3.53Å; C504-L521 WeakPolarHBondContact CA-O 3.45Å; S505-L521 PolarHBondContact N-O 2.93Å; S505-L521 PolarHBondContact OG-O 3.14Å; Q506-L521 PolarHBondContact N-O 3.43Å; Q506-L521 PolarHBondContact O-N 2.98Å; L521-K526 WeakPolarHBondContact CA-O 3.35Å; L521-L527 HydrophobicContact CB-CD1 4.18Å; L521-L527 HydrophobicContact CD1-CB 4.41Å; L521-V538 HydrophobicContact CD1-CB 3.83Å; L521-V538 HydrophobicContact CD1-CG1 3.91Å; L521-V538 HydrophobicContact CD2-CG1 4.27Å; L521-F541 HydrophobicContact CB-CD1 3.75Å; L521-F541 HydrophobicContact CB-CE1 3.57Å; L521-F541 HydrophobicContact CD2-CD1 4.12Å
522	N	87.9	Confident	86.6	Confident	4 Å²	4	49.5 Å²	49.5	2%	0.021	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	168.5	177.3	77.7	2.6	0	0	0	113.2	S502 F524 S525 K526	S502-N522 PolarHBondContact OG-ND2 2.82Å; S502-N522 VanDerWaalsContact OG-ND2 3.1Å; N522-F524 PolarHBondContact O-N 2.75Å; N522-F524 WeakPolarHBondContact OD1-CA 3.45Å; N522-F524 PolarHBondContact OD1-N 3.03Å; N522-F524 VanDerWaalsContact OD1-N 3.14Å; N522-S525 PolarHBondContact O-N 3.29Å; N522-S525 VanDerWaalsContact O-N 3.1Å; N522-S525 PolarHBondContact OD1-N 2.84Å; N522-K526 PolarHBondContact N-O 3.3Å; N522-K526 WeakPolarHBondContact OD1-CA 3.22Å; N522-K526 VanDerWaalsContact OD1-CB 3.31Å; N522-K526 WeakPolarHBondContact OD1-CB 3.36Å; N522-K526 PolarHBondContact OD1-N 3.04Å; N522-K526 PolarHBondContact OD1-O 3.34Å
523	E	80.1	Confident	87	Confident	114 Å²	114	50.7 Å²	50.7	53%	0.533	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-26.7	177.4	65	-167.5	155.8	0	0	113.7	S525	E523-S525 PolarHBondContact O-N 3.37Å
524	F	85.6	Confident	87.5	Confident	124 Å²	124	44.4 Å²	44.4	54%	0.544	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	15.9	176.9	-53.3	-70.3	0	0	0	113.7	N522 K526	N522-F524 PolarHBondContact O-N 2.75Å; N522-F524 WeakPolarHBondContact OD1-CA 3.45Å; N522-F524 PolarHBondContact OD1-N 3.03Å; N522-F524 VanDerWaalsContact OD1-N 3.14Å; F524-K526 HydrophobicContact CB-CG 4.48Å; F524-K526 PolarHBondContact O-N 3.1Å
525	S	88.4	Confident	88	Confident	34 Å²	34	37.6 Å²	37.6	24%	0.238	18%	0.176	C	C	.	.	S	Bend	trans	63.7	23.7	178.8	-56.5	0	0	0	0	114.5	N522 E523 S536 T537 V538	N522-S525 PolarHBondContact O-N 3.29Å; N522-S525 VanDerWaalsContact O-N 3.1Å; N522-S525 PolarHBondContact OD1-N 2.84Å; E523-S525 PolarHBondContact O-N 3.37Å; S525-S536 CarbonylContact O-C 3.6Å; S525-T537 PolarHBondContact O-N 3.4Å; S525-V538 VanDerWaalsContact CA-O 3.31Å; S525-V538 WeakPolarHBondContact CA-O 3.49Å; S525-V538 WeakPolarHBondContact CB-O 3.28Å; S525-V538 PolarHBondContact O-N 3.46Å
526	K	91	Very high	88.2	Confident	78 Å²	78	32.7 Å²	32.7	34%	0.339	16%	0.16	S	C	.	.			trans	-98.1	124.6	176.9	-59.2	-178.7	-177.6	173.5	0	110.4	L521 N522 F524 Y528 L533 C535	L521-K526 WeakPolarHBondContact CA-O 3.35Å; N522-K526 PolarHBondContact N-O 3.3Å; N522-K526 WeakPolarHBondContact OD1-CA 3.22Å; N522-K526 VanDerWaalsContact OD1-CB 3.31Å; N522-K526 WeakPolarHBondContact OD1-CB 3.36Å; N522-K526 PolarHBondContact OD1-N 3.04Å; N522-K526 PolarHBondContact OD1-O 3.34Å; F524-K526 HydrophobicContact CB-CG 4.48Å; F524-K526 PolarHBondContact O-N 3.1Å; K526-Y528 HydrophobicContact CB-CD2 4.26Å; K526-Y528 HydrophobicContact CB-CE2 3.51Å; K526-Y528 HydrophobicContact CD-CE2 4.41Å; K526-L533 HydrophobicContact CB-CD1 3.77Å; K526-L533 HydrophobicContact CD-CD1 4.4Å; K526-L533 HydrophobicContact CG-CD1 4.29Å; K526-C535 WeakPolarHBondContact CA-O 3.14Å
527	L	91.3	Very high	88.3	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	121.5	177.4	-173.5	68.6	0	0	0	109.9	I519 S520 L521 L534 C535 V538 F541 L549 F551	I519-L527 HydrophobicContact CG2-CD1 3.57Å; I519-L527 HydrophobicContact CG2-CG 4.27Å; S520-L527 CarbonylContact O-C 3.42Å; S520-L527 WeakPolarHBondContact O-CA 3.28Å; L521-L527 HydrophobicContact CB-CD1 4.18Å; L521-L527 HydrophobicContact CD1-CB 4.41Å; L527-L534 HydrophobicContact CD2-CD2 3.97Å; L527-L534 WeakPolarHBondContact O-CB 3.29Å; L527-L534 PolarHBondContact O-N 3.04Å; L527-C535 PolarHBondContact N-O 3.47Å; L527-C535 PolarHBondContact O-N 3.45Å; L527-V538 HydrophobicContact CB-CB 3.95Å; L527-V538 HydrophobicContact CB-CG1 4.31Å; L527-V538 HydrophobicContact CB-CG2 3.59Å; L527-V538 HydrophobicContact CD2-CG1 4.29Å; L527-V538 HydrophobicContact CD2-CG2 3.96Å; L527-V538 HydrophobicContact CG-CG2 4.4Å; L527-F541 HydrophobicContact CD1-CB 4.31Å; L527-F541 HydrophobicContact CD1-CD1 3.66Å; L527-F541 HydrophobicContact CD1-CD2 4.38Å; L527-F541 HydrophobicContact CD1-CE1 4.01Å; L527-F541 HydrophobicContact CD1-CG 3.86Å; L527-L549 HydrophobicContact CD2-CD2 4.28Å; L527-F551 HydrophobicContact CD2-CB 4.25Å; L527-F551 HydrophobicContact CD2-CD1 4.06Å; L527-F551 HydrophobicContact CD2-CG 4.12Å
528	Y	89.9	Confident	88.5	Confident	28 Å²	28	33.1 Å²	33.1	11%	0.11	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	152.2	178.4	-65.1	-96.5	0	0	0	111	G499 I519 S520 K526 H532 L533	G499-Y528 WeakPolarHBondContact O-CE1 3.45Å; I519-Y528 WeakPolarHBondContact CA-O 3.29Å; S520-Y528 PolarHBondContact N-O 2.88Å; S520-Y528 PolarHBondContact O-N 3.08Å; K526-Y528 HydrophobicContact CB-CD2 4.26Å; K526-Y528 HydrophobicContact CB-CE2 3.51Å; K526-Y528 HydrophobicContact CD-CE2 4.41Å; Y528-H532 CarbonylContact C-O 3.52Å; Y528-H532 VanDerWaalsContact CA-O 3.32Å; Y528-H532 WeakPolarHBondContact CA-O 3.37Å; Y528-L533 HydrophobicContact CD1-CB 4.02Å; Y528-L533 HydrophobicContact CD1-CD1 4.29Å; Y528-L533 HydrophobicContact CD2-CD1 4.49Å; Y528-L533 HydrophobicContact CE1-CB 3.77Å; Y528-L533 HydrophobicContact CE1-CD1 3.92Å; Y528-L533 HydrophobicContact CE1-CG 4.4Å; Y528-L533 HydrophobicContact CE2-CD1 4.12Å
529	V	88.5	Confident	88.5	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	107	169.2	-178.9	0	0	0	0	106.9	L518 I519 E531 H532 L534 V566	L518-V529 CarbonylContact O-C 3.58Å; L518-V529 WeakPolarHBondContact O-CA 3.28Å; I519-V529 HydrophobicContact CG1-CG2 4.43Å; V529-E531 PolarHBondContact O-N 3.27Å; V529-E531 VanDerWaalsContact O-N 3.12Å; V529-H532 PolarHBondContact N-O 3.23Å; V529-H532 WeakPolarHBondContact O-CB 3.27Å; V529-H532 PolarHBondContact O-N 2.73Å; V529-L534 HydrophobicContact CG2-CB 4.15Å; V529-L534 HydrophobicContact CG2-CD2 4.06Å; V529-V566 HydrophobicContact CB-CG1 4.3Å; V529-V566 HydrophobicContact CG1-CG1 4.09Å; V529-V566 HydrophobicContact CG2-CG1 3.4Å
530	D	86.6	Confident	88.6	Confident	10 Å²	10	35.5 Å²	35.5	5%	0.053	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	-113	-162.3	-48.3	-39.5	0	0	0	109.2	H497 C498 G499 H517 L518 K569	H497-D530 CarbonylContact O-C 3.53Å; H497-D530 WeakPolarHBondContact O-CA 3.45Å; C498-D530 CarbonylContact C-O 3.56Å; C498-D530 WeakPolarHBondContact CA-O 3.48Å; G499-D530 PolarHBondContact N-O 3.27Å; H517-D530 WeakPolarHBondContact CA-OD1 3.48Å; H517-D530 IonicContact CE1-OD2 3.72Å; H517-D530 IonicContact CG-OD2 3.74Å; H517-D530 IonicContact ND1-OD1 3.42Å; H517-D530 IonicContact ND1-OD2 2.79Å; H517-D530 PolarHBondContact ND1-OD2 3.05Å; L518-D530 PolarHBondContact N-OD1 2.87Å; L518-D530 PolarHBondContact O-N 3.04Å; D530-K569 WeakPolarHBondContact OD2-CE 3.28Å; D530-K569 IonicContact OD2-NZ 2.69Å; D530-K569 PolarHBondContact OD2-NZ 2.73Å
531	E	85.7	Confident	88.7	Confident	117 Å²	117	35.5 Å²	35.5	55%	0.547	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-12.8	177.7	-60.9	179.8	161.3	0	0	114.5	H497 V529	H497-E531 HydrophobicContact CB-CG 3.87Å; H497-E531 IonicContact CE1-OE1 3.2Å; H497-E531 IonicContact CG-OE1 3.89Å; H497-E531 IonicContact ND1-OE1 3.75Å; H497-E531 PolarHBondContact ND1-OE1 3.08Å; V529-E531 PolarHBondContact O-N 3.27Å; V529-E531 VanDerWaalsContact O-N 3.12Å
532	H	87.2	Confident	88.7	Confident	47 Å²	47	35.9 Å²	35.9	22%	0.218	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	121.5	-170.5	178.9	-78	0	0	0	111.2	Y528 V529 L534 K569 F571	Y528-H532 CarbonylContact C-O 3.52Å; Y528-H532 VanDerWaalsContact CA-O 3.32Å; Y528-H532 WeakPolarHBondContact CA-O 3.37Å; V529-H532 PolarHBondContact N-O 3.23Å; V529-H532 WeakPolarHBondContact O-CB 3.27Å; V529-H532 PolarHBondContact O-N 2.73Å; H532-L534 PolarHBondContact O-N 2.8Å; H532-K569 HydrophobicContact CB-CB 4.33Å; H532-K569 HydrophobicContact CB-CD 4.38Å; H532-K569 HydrophobicContact CB-CG 4.11Å; H532-F571 PolarHBondContact CE1-O 3.22Å
533	L	88.2	Confident	88.8	Confident	41 Å²	41	36.7 Å²	36.7	22%	0.215	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	109.5	171.9	176.7	64.5	0	0	0	110.2	K526 Y528	K526-L533 HydrophobicContact CB-CD1 3.77Å; K526-L533 HydrophobicContact CD-CD1 4.4Å; K526-L533 HydrophobicContact CG-CD1 4.29Å; Y528-L533 HydrophobicContact CD1-CB 4.02Å; Y528-L533 HydrophobicContact CD1-CD1 4.29Å; Y528-L533 HydrophobicContact CD2-CD1 4.49Å; Y528-L533 HydrophobicContact CE1-CB 3.77Å; Y528-L533 HydrophobicContact CE1-CD1 3.92Å; Y528-L533 HydrophobicContact CE1-CG 4.4Å; Y528-L533 HydrophobicContact CE2-CD1 4.12Å
534	L	86.9	Confident	89.3	Confident	10 Å²	10	31.7 Å²	31.7	5%	0.052	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	-48.9	179	-174.1	67.2	0	0	0	111.8	L527 V529 H532 L549 F551 V566 Y573	L527-L534 HydrophobicContact CD2-CD2 3.97Å; L527-L534 WeakPolarHBondContact O-CB 3.29Å; L527-L534 PolarHBondContact O-N 3.04Å; V529-L534 HydrophobicContact CG2-CB 4.15Å; V529-L534 HydrophobicContact CG2-CD2 4.06Å; H532-L534 PolarHBondContact O-N 2.8Å; L534-L549 HydrophobicContact CD2-CD2 3.51Å; L534-F551 HydrophobicContact CD2-CE1 4.37Å; L534-V566 HydrophobicContact CD2-CG1 4.08Å; L534-Y573 WeakPolarHBondContact O-CB 3.46Å; L534-Y573 PolarHBondContact O-N 2.71Å
535	C	88	Confident	89.2	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	142.5	-179.7	-178.3	0	0	0	0	110.9	K526 L527 T537 V538 F551 D574	K526-C535 WeakPolarHBondContact CA-O 3.14Å; L527-C535 PolarHBondContact N-O 3.47Å; L527-C535 PolarHBondContact O-N 3.45Å; C535-T537 PolarHBondContact SG-OG1 3.15Å; C535-V538 HydrophobicContact CB-CG2 3.72Å; C535-F551 HydrophobicContact CB-CE2 4.28Å; C535-F551 HydrophobicContact CB-CZ 4.47Å; C535-D574 PolarHBondContact SG-OD1 2.92Å
536	S	89.1	Confident	88.8	Confident	40 Å²	40	33.2 Å²	33.2	28%	0.28	18%	0.18	S	C	.	.	S	Bend	trans	-97.1	2.9	-176.6	60.2	0	0	0	0	115.2	S525 D574	S525-S536 CarbonylContact O-C 3.6Å; S536-D574 VanDerWaalsContact CB-OD2 3.29Å; S536-D574 WeakPolarHBondContact CB-OD2 3.26Å; S536-D574 PolarHBondContact N-OD1 3.12Å; S536-D574 PolarHBondContact N-OD2 3.4Å; S536-D574 VanDerWaalsContact OG-CG 3.24Å; S536-D574 PolarHBondContact OG-OD1 2.89Å; S536-D574 PolarHBondContact OG-OD2 3.15Å
537	T	88.8	Confident	88.4	Confident	42 Å²	42	33.3 Å²	33.3	26%	0.258	18%	0.181	S	C	.	.			trans	-128.6	31.9	-171.4	61.1	0	0	0	0	113.3	S525 C535 T553 I554	S525-T537 PolarHBondContact O-N 3.4Å; C535-T537 PolarHBondContact SG-OG1 3.15Å; T537-T553 CarbonylContact O-C 3.59Å; T537-T553 WeakPolarHBondContact O-CA 3.1Å; T537-I554 WeakPolarHBondContact O-CG1 3.38Å; T537-I554 PolarHBondContact O-N 3.09Å
538	V	91.7	Very high	88.2	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	135.4	-174.6	178.6	0	0	0	0	112.1	L521 S525 L527 C535 F541 F551 T552	L521-V538 HydrophobicContact CD1-CB 3.83Å; L521-V538 HydrophobicContact CD1-CG1 3.91Å; L521-V538 HydrophobicContact CD2-CG1 4.27Å; S525-V538 VanDerWaalsContact CA-O 3.31Å; S525-V538 WeakPolarHBondContact CA-O 3.49Å; S525-V538 WeakPolarHBondContact CB-O 3.28Å; S525-V538 PolarHBondContact O-N 3.46Å; L527-V538 HydrophobicContact CB-CB 3.95Å; L527-V538 HydrophobicContact CB-CG1 4.31Å; L527-V538 HydrophobicContact CB-CG2 3.59Å; L527-V538 HydrophobicContact CD2-CG1 4.29Å; L527-V538 HydrophobicContact CD2-CG2 3.96Å; L527-V538 HydrophobicContact CG-CG2 4.4Å; C535-V538 HydrophobicContact CB-CG2 3.72Å; V538-F541 HydrophobicContact CG1-CB 4.46Å; V538-F551 HydrophobicContact CG1-CB 3.9Å; V538-F551 HydrophobicContact CG1-CD2 4.38Å; V538-F551 HydrophobicContact CG1-CG 4.47Å; V538-F551 HydrophobicContact CG2-CD2 3.64Å; V538-F551 HydrophobicContact CG2-CE2 4.08Å; V538-F551 HydrophobicContact CG2-CG 4.25Å; V538-T552 CarbonylContact C-O 3.41Å; V538-T552 WeakPolarHBondContact CA-O 3.18Å
539	T	90.3	Very high	88.2	Confident	41 Å²	41	32.3 Å²	32.3	25%	0.252	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	-31.8	-178.6	53.2	0	0	0	0	113.4	T552 I554	T539-T552 PolarHBondContact N-O 3.41Å; T539-T552 WeakPolarHBondContact OG1-CB 3.42Å; T539-T552 PolarHBondContact OG1-O 3.06Å; T539-T552 PolarHBondContact OG1-OG1 2.69Å; T539-I554 HydrophobicContact CG2-CB 4.42Å; T539-I554 HydrophobicContact CG2-CG1 3.64Å
540	S	92.2	Very high	88.4	Confident	8 Å²	8	32.3 Å²	32.3	6%	0.056	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	152.7	172.8	70.9	0	0	0	0	109.3	F551 T552 I597	S540-F551 CarbonylContact O-C 3.55Å; S540-F551 VanDerWaalsContact O-CA 3.25Å; S540-F551 WeakPolarHBondContact O-CA 3.45Å; S540-F551 WeakPolarHBondContact O-CB 2.89Å; S540-T552 PolarHBondContact N-OG1 3.09Å; S540-T552 PolarHBondContact O-N 3.15Å; S540-T552 PolarHBondContact O-OG1 2.76Å; S540-T552 PolarHBondContact OG-OG1 3Å; S540-I597 PolarHBondContact OG-N 3.16Å
541	F	93.5	Very high	88.7	Confident	1 Å²	1	31.8 Å²	31.8	0%	0.004	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	165.1	175.3	80.7	-86.4	0	0	0	112.4	Q506 E508 I519 L521 L527 V538 L549 L550 F551	Q506-F541 HydrophobicContact CB-CE1 3.81Å; Q506-F541 HydrophobicContact CB-CZ 4.45Å; Q506-F541 HydrophobicContact CG-CD1 4.38Å; Q506-F541 HydrophobicContact CG-CE1 3.59Å; Q506-F541 HydrophobicContact CG-CZ 3.86Å; Q506-F541 PolarHBondContact NE2-O 2.91Å; E508-F541 HydrophobicContact CB-CE2 3.85Å; E508-F541 HydrophobicContact CB-CZ 4.19Å; E508-F541 HydrophobicContact CG-CE2 3.8Å; E508-F541 HydrophobicContact CG-CZ 3.98Å; I519-F541 HydrophobicContact CB-CE2 3.92Å; I519-F541 HydrophobicContact CB-CZ 4.3Å; I519-F541 HydrophobicContact CG2-CD2 3.78Å; I519-F541 HydrophobicContact CG2-CE1 4.46Å; I519-F541 HydrophobicContact CG2-CE2 3.39Å; I519-F541 HydrophobicContact CG2-CG 4.47Å; I519-F541 HydrophobicContact CG2-CZ 3.77Å; L521-F541 HydrophobicContact CB-CD1 3.75Å; L521-F541 HydrophobicContact CB-CE1 3.57Å; L521-F541 HydrophobicContact CD2-CD1 4.12Å; L527-F541 HydrophobicContact CD1-CB 4.31Å; L527-F541 HydrophobicContact CD1-CD1 3.66Å; L527-F541 HydrophobicContact CD1-CD2 4.38Å; L527-F541 HydrophobicContact CD1-CE1 4.01Å; L527-F541 HydrophobicContact CD1-CG 3.86Å; V538-F541 HydrophobicContact CG1-CB 4.46Å; F541-L549 HydrophobicContact CD2-CD1 3.93Å; F541-L550 CarbonylContact C-O 3.35Å; F541-L550 WeakPolarHBondContact CA-O 3.39Å; F541-L550 WeakPolarHBondContact CB-O 3.24Å; F541-F551 HydrophobicContact CB-CB 3.74Å
542	M	92	Very high	89.1	Confident	14 Å²	14	26.3 Å²	26.3	7%	0.069	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	136.2	177.5	179.8	165.1	-148.7	0	0	110.9	R320 L550 I597 T599 S600	R320-M542 VanDerWaalsContact CZ-SD 3.51Å; R320-M542 VanDerWaalsContact NE-CE 3.3Å; R320-M542 PolarHBondContact NH1-SD 3.43Å; M542-L550 PolarHBondContact N-O 3.1Å; M542-L550 PolarHBondContact O-N 3.18Å; M542-I597 HydrophobicContact CB-CD1 4.49Å; M542-I597 HydrophobicContact CB-CG2 3.88Å; M542-I597 HydrophobicContact CG-CG2 4.48Å; M542-I597 HydrophobicContact SD-CG2 3.72Å; M542-T599 VanDerWaalsContact SD-C 3.53Å; M542-S600 PolarHBondContact SD-N 2.88Å; M542-S600 PolarHBondContact SD-OG 3.35Å
543	V	90.8	Very high	89.2	Confident	22 Å²	22	24.2 Å²	24.2	13%	0.133	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	128.4	163.9	175.2	0	0	0	0	109.9	E508 L510 I519 L549 I563	E508-V543 HydrophobicContact CB-CG2 4.48Å; E508-V543 PolarHBondContact OE2-N 3.2Å; L510-V543 HydrophobicContact CB-CG1 4.49Å; L510-V543 HydrophobicContact CD2-CG2 4.33Å; I519-V543 HydrophobicContact CD1-CG2 4Å; V543-L549 HydrophobicContact CG2-CD1 4.37Å; V543-I563 HydrophobicContact CG1-CD1 3.86Å
544	H	89.8	Confident	89.2	Confident	9 Å²	9	26.4 Å²	26.4	4%	0.042	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	113.2	-178.8	-179.9	77.1	0	0	0	110.8	D546 E547 Y548 L550 S600 G602	H544-D546 PolarHBondContact O-N 2.9Å; H544-E547 PolarHBondContact O-N 2.94Å; H544-E547 VanDerWaalsContact O-N 3.13Å; H544-Y548 PolarHBondContact N-O 3.32Å; H544-Y548 PolarHBondContact O-N 2.99Å; H544-Y548 VanDerWaalsContact O-N 3.08Å; H544-L550 HydrophobicContact CB-CD1 3.75Å; H544-L550 HydrophobicContact CB-CG 3.96Å; H544-S600 VanDerWaalsContact ND1-CB 3.33Å; H544-S600 WeakPolarHBondContact ND1-CB 3.44Å; H544-S600 PolarHBondContact ND1-OG 3Å; H544-G602 PolarHBondContact CE1-O 2.79Å; H544-G602 PolarHBondContact NE2-O 2.98Å; H544-G602 VanDerWaalsContact NE2-O 3.08Å
545	C	83.4	Confident	89.1	Confident	91 Å²	91	28.9 Å²	28.9	62%	0.615	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	50	29.9	176.9	-63.4	0	0	0	0	114.7	E547	C545-E547 PolarHBondContact O-N 3.22Å
546	D	80.1	Confident	89.2	Confident	99 Å²	99	32 Å²	32	53%	0.529	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	9.6	-174.9	-54.9	-38.6	0	0	0	115.6	H544 I563	H544-D546 PolarHBondContact O-N 2.9Å; D546-I563 WeakPolarHBondContact O-CD1 3.01Å
547	E	81.6	Confident	89.1	Confident	80 Å²	80	32.2 Å²	32.2	37%	0.374	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-31.8	178.3	-70.6	-164.4	163	0	0	112.5	H544 C545 P562 I563 R625	H544-E547 PolarHBondContact O-N 2.94Å; H544-E547 VanDerWaalsContact O-N 3.13Å; C545-E547 PolarHBondContact O-N 3.22Å; E547-P562 CarbonylContact O-C 3.54Å; E547-P562 WeakPolarHBondContact O-CA 3.48Å; E547-I563 PolarHBondContact O-N 2.71Å; E547-R625 IonicContact OE1-CZ 2.76Å; E547-R625 IonicContact OE1-NE 2.78Å; E547-R625 IonicContact OE1-NH2 2.76Å; E547-R625 PolarHBondContact OE1-NH2 3.35Å; E547-R625 IonicContact OE2-CZ 2.74Å; E547-R625 IonicContact OE2-NE 3.85Å; E547-R625 PolarHBondContact OE2-NE 3.05Å; E547-R625 IonicContact OE2-NH2 2.74Å
548	Y	88.1	Confident	89.3	Confident	6 Å²	6	30.2 Å²	30.2	2%	0.024	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	144.8	-174.2	-63.5	-90.5	0	0	0	112.9	H544 V560 I561 P562 L622 R625 P705	H544-Y548 PolarHBondContact N-O 3.32Å; H544-Y548 PolarHBondContact O-N 2.99Å; H544-Y548 VanDerWaalsContact O-N 3.08Å; Y548-V560 HydrophobicContact CD1-CG1 3.9Å; Y548-V560 HydrophobicContact CG-CG1 4.41Å; Y548-I561 CarbonylContact C-O 3.56Å; Y548-I561 WeakPolarHBondContact CA-O 3.48Å; Y548-P562 HydrophobicContact CD1-CB 4.3Å; Y548-P562 HydrophobicContact CE1-CB 4.16Å; Y548-L622 HydrophobicContact CD1-CD2 4.28Å; Y548-L622 HydrophobicContact CD2-CD2 3.59Å; Y548-L622 HydrophobicContact CE2-CD2 3.94Å; Y548-L622 HydrophobicContact CG-CD2 3.79Å; Y548-R625 HydrophobicContact CE2-CB 4.48Å; Y548-R625 HydrophobicContact CE2-CG 4.17Å; Y548-R625 WeakPolarHBondContact OH-CB 3.46Å; Y548-P705 HydrophobicContact CE1-CB 4.08Å
549	L	90.3	Very high	89.1	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	121.5	166.4	178.3	60.8	0	0	0	108.8	I519 L527 L534 F541 V543 F551 I561 I563 V566	I519-L549 HydrophobicContact CD1-CD1 3.64Å; I519-L549 HydrophobicContact CD1-CD2 3.93Å; I519-L549 HydrophobicContact CD1-CG 4.29Å; I519-L549 HydrophobicContact CG2-CD1 4.38Å; L527-L549 HydrophobicContact CD2-CD2 4.28Å; L534-L549 HydrophobicContact CD2-CD2 3.51Å; F541-L549 HydrophobicContact CD2-CD1 3.93Å; V543-L549 HydrophobicContact CG2-CD1 4.37Å; L549-F551 HydrophobicContact CD2-CD1 4.43Å; L549-F551 HydrophobicContact CG-CD1 4.26Å; L549-I561 PolarHBondContact N-O 3.05Å; L549-I561 PolarHBondContact O-N 2.93Å; L549-I563 HydrophobicContact CB-CG1 4.48Å; L549-V566 HydrophobicContact CB-CG2 4.13Å; L549-V566 HydrophobicContact CD2-CG1 3.96Å; L549-V566 HydrophobicContact CD2-CG2 4.03Å
550	L	92.6	Very high	89	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	131.8	175.8	-51.4	177.3	0	0	0	108.6	F541 M542 H544 L558 C559 V560 I597 V605	F541-L550 CarbonylContact C-O 3.35Å; F541-L550 WeakPolarHBondContact CA-O 3.39Å; F541-L550 WeakPolarHBondContact CB-O 3.24Å; M542-L550 PolarHBondContact N-O 3.1Å; M542-L550 PolarHBondContact O-N 3.18Å; H544-L550 HydrophobicContact CB-CD1 3.75Å; H544-L550 HydrophobicContact CB-CG 3.96Å; L550-L558 HydrophobicContact CB-CD1 4.42Å; L550-C559 WeakPolarHBondContact CA-O 3.37Å; L550-V560 HydrophobicContact CD2-CB 3.96Å; L550-V560 HydrophobicContact CD2-CG1 3.63Å; L550-V560 HydrophobicContact CD2-CG2 3.6Å; L550-I597 HydrophobicContact CB-CD1 3.94Å; L550-V605 HydrophobicContact CD1-CG1 4.33Å; L550-V605 HydrophobicContact CD1-CG2 3.68Å
551	F	92.5	Very high	88.5	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	150.7	170.5	63.5	-92.3	0	0	0	112.8	L527 L534 C535 V538 S540 F541 L549 T553 L558 C559 I561 Y573	L527-F551 HydrophobicContact CD2-CB 4.25Å; L527-F551 HydrophobicContact CD2-CD1 4.06Å; L527-F551 HydrophobicContact CD2-CG 4.12Å; L534-F551 HydrophobicContact CD2-CE1 4.37Å; C535-F551 HydrophobicContact CB-CE2 4.28Å; C535-F551 HydrophobicContact CB-CZ 4.47Å; V538-F551 HydrophobicContact CG1-CB 3.9Å; V538-F551 HydrophobicContact CG1-CD2 4.38Å; V538-F551 HydrophobicContact CG1-CG 4.47Å; V538-F551 HydrophobicContact CG2-CD2 3.64Å; V538-F551 HydrophobicContact CG2-CE2 4.08Å; V538-F551 HydrophobicContact CG2-CG 4.25Å; S540-F551 CarbonylContact O-C 3.55Å; S540-F551 VanDerWaalsContact O-CA 3.25Å; S540-F551 WeakPolarHBondContact O-CA 3.45Å; S540-F551 WeakPolarHBondContact O-CB 2.89Å; F541-F551 HydrophobicContact CB-CB 3.74Å; L549-F551 HydrophobicContact CD2-CD1 4.43Å; L549-F551 HydrophobicContact CG-CD1 4.26Å; F551-T553 HydrophobicContact CD2-CG2 4.14Å; F551-T553 HydrophobicContact CE2-CG2 3.96Å; F551-L558 WeakPolarHBondContact O-CA 3.44Å; F551-C559 HydrophobicContact CD1-CB 4.12Å; F551-C559 HydrophobicContact CD2-CB 4.01Å; F551-C559 HydrophobicContact CE1-CB 3.7Å; F551-C559 HydrophobicContact CE2-CB 3.57Å; F551-C559 HydrophobicContact CG-CB 4.28Å; F551-C559 HydrophobicContact CZ-CB 3.4Å; F551-C559 VanDerWaalsContact CZ-CB 3.4Å; F551-C559 PolarHBondContact N-O 3.38Å; F551-C559 VanDerWaalsContact N-O 3.07Å; F551-C559 PolarHBondContact O-N 2.97Å; F551-I561 HydrophobicContact CE1-CD1 3.55Å; F551-I561 HydrophobicContact CE1-CG1 4.09Å; F551-I561 HydrophobicContact CZ-CD1 3.94Å; F551-Y573 HydrophobicContact CE2-CD1 4.35Å; F551-Y573 AromaticContact CZ-CD1 3.86Å; F551-Y573 HydrophobicContact CZ-CD1 3.86Å; F551-Y573 HydrophobicContact CZ-CE1 4.11Å; F551-Y573 HydrophobicContact CZ-CG 4.32Å
552	T	93.3	Very high	88	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.006	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	141.1	176	52.5	0	0	0	0	111	V538 T539 S540 K557 L558 I597 F607	V538-T552 CarbonylContact C-O 3.41Å; V538-T552 WeakPolarHBondContact CA-O 3.18Å; T539-T552 PolarHBondContact N-O 3.41Å; T539-T552 WeakPolarHBondContact OG1-CB 3.42Å; T539-T552 PolarHBondContact OG1-O 3.06Å; T539-T552 PolarHBondContact OG1-OG1 2.69Å; S540-T552 PolarHBondContact N-OG1 3.09Å; S540-T552 PolarHBondContact O-N 3.15Å; S540-T552 PolarHBondContact O-OG1 2.76Å; S540-T552 PolarHBondContact OG-OG1 3Å; T552-K557 CarbonylContact C-O 3.4Å; T552-K557 VanDerWaalsContact CA-O 3.25Å; T552-K557 WeakPolarHBondContact CA-O 3.38Å; T552-L558 HydrophobicContact CG2-CD1 4.4Å; T552-I597 HydrophobicContact CG2-CD1 4.19Å; T552-I597 HydrophobicContact CG2-CG1 3.95Å; T552-F607 HydrophobicContact CG2-CD1 4.22Å; T552-F607 HydrophobicContact CG2-CE1 3.6Å
553	T	90	Very high	87.5	Confident	3 Å²	3	28.1 Å²	28.1	2%	0.018	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	160.7	-179.6	66.9	0	0	0	0	113.3	T537 F551 S555 H556 K557	T537-T553 CarbonylContact O-C 3.59Å; T537-T553 WeakPolarHBondContact O-CA 3.1Å; F551-T553 HydrophobicContact CD2-CG2 4.14Å; F551-T553 HydrophobicContact CE2-CG2 3.96Å; T553-S555 PolarHBondContact O-N 3Å; T553-S555 PolarHBondContact OG1-N 3.46Å; T553-S555 PolarHBondContact OG1-OG 3.23Å; T553-H556 PolarHBondContact O-N 2.79Å; T553-H556 PolarHBondContact OG1-N 3.42Å; T553-K557 PolarHBondContact N-O 3.28Å; T553-K557 PolarHBondContact OG1-N 3.19Å; T553-K557 VanDerWaalsContact OG1-N 3.14Å; T553-K557 PolarHBondContact OG1-O 2.65Å
554	I	88.5	Confident	86.9	Confident	87 Å²	87	33 Å²	33	45%	0.446	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-27.9	169.9	-61.7	166.9	0	0	0	110.5	T537 T539 H556	T537-I554 WeakPolarHBondContact O-CG1 3.38Å; T537-I554 PolarHBondContact O-N 3.09Å; T539-I554 HydrophobicContact CG2-CB 4.42Å; T539-I554 HydrophobicContact CG2-CG1 3.64Å; I554-H556 PolarHBondContact O-CE1 2.88Å; I554-H556 PolarHBondContact O-N 2.97Å; I554-H556 PolarHBondContact O-ND1 3.47Å
555	S	84.9	Confident	86.3	Confident	62 Å²	62	34.2 Å²	34.2	43%	0.434	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	13.2	173.1	56.4	0	0	0	0	114.6	T553	T553-S555 PolarHBondContact O-N 3Å; T553-S555 PolarHBondContact OG1-N 3.46Å; T553-S555 PolarHBondContact OG1-OG 3.23Å
556	H	88.9	Confident	85.9	Confident	67 Å²	67	30.1 Å²	30.1	31%	0.31	15%	0.15	S	C	.	.	S	Bend	trans	62.7	44.1	172.8	-41.2	-36.5	0	0	0	113.2	T553 I554 V591 R593	T553-H556 PolarHBondContact O-N 2.79Å; T553-H556 PolarHBondContact OG1-N 3.42Å; I554-H556 PolarHBondContact O-CE1 2.88Å; I554-H556 PolarHBondContact O-N 2.97Å; I554-H556 PolarHBondContact O-ND1 3.47Å; H556-V591 VanDerWaalsContact C-CG2 3.46Å; H556-V591 WeakPolarHBondContact CB-O 3.38Å; H556-V591 WeakPolarHBondContact O-CG2 3.45Å; H556-V591 PolarHBondContact O-N 3.14Å; H556-R593 VanDerWaalsContact CE1-CG 3.42Å; H556-R593 WeakPolarHBondContact CE1-CG 3.33Å; H556-R593 WeakPolarHBondContact NE2-CG 3.31Å
557	K	88.6	Confident	85.8	Confident	43 Å²	43	26.3 Å²	26.3	19%	0.187	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	138.2	174.7	-62.8	178.6	175	-169.8	0	110	T552 T553 Y588 R589	T552-K557 CarbonylContact C-O 3.4Å; T552-K557 VanDerWaalsContact CA-O 3.25Å; T552-K557 WeakPolarHBondContact CA-O 3.38Å; T553-K557 PolarHBondContact N-O 3.28Å; T553-K557 PolarHBondContact OG1-N 3.19Å; T553-K557 VanDerWaalsContact OG1-N 3.14Å; T553-K557 PolarHBondContact OG1-O 2.65Å; K557-Y588 HydrophobicContact CD-CD2 3.61Å; K557-Y588 HydrophobicContact CD-CE2 3.95Å; K557-Y588 HydrophobicContact CD-CG 3.97Å; K557-Y588 HydrophobicContact CG-CD2 4.14Å; K557-R589 CarbonylContact C-O 3.57Å; K557-R589 WeakPolarHBondContact CA-O 3.5Å
558	L	91.6	Very high	85.4	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	119.7	163.1	168.6	68.8	0	0	0	108	L550 F551 T552 V560 Y588 R589 V591 I597 F607 V617 P619	L550-L558 HydrophobicContact CB-CD1 4.42Å; F551-L558 WeakPolarHBondContact O-CA 3.44Å; T552-L558 HydrophobicContact CG2-CD1 4.4Å; L558-V560 HydrophobicContact CD2-CG2 4.16Å; L558-V560 HydrophobicContact CG-CG2 4.1Å; L558-Y588 CarbonylContact O-C 3.15Å; L558-Y588 WeakPolarHBondContact O-CA 3.24Å; L558-R589 HydrophobicContact CB-CB 4.45Å; L558-R589 PolarHBondContact N-O 2.87Å; L558-R589 PolarHBondContact O-N 3.37Å; L558-V591 HydrophobicContact CB-CG1 3.68Å; L558-I597 HydrophobicContact CD1-CD1 4.25Å; L558-F607 HydrophobicContact CB-CZ 4.16Å; L558-F607 HydrophobicContact CD1-CE1 4.15Å; L558-F607 HydrophobicContact CD1-CZ 3.82Å; L558-F607 HydrophobicContact CD2-CE2 4.35Å; L558-F607 HydrophobicContact CD2-CZ 3.73Å; L558-F607 HydrophobicContact CG-CZ 4.08Å; L558-V617 HydrophobicContact CD2-CG2 4.18Å; L558-P619 HydrophobicContact CD2-CB 4.4Å; L558-P619 HydrophobicContact CD2-CG 3.71Å
559	C	88.4	Confident	84.4	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	138	171.7	-57.1	0	0	0	0	109.9	L550 F551 Y573 D587	L550-C559 WeakPolarHBondContact CA-O 3.37Å; F551-C559 HydrophobicContact CD1-CB 4.12Å; F551-C559 HydrophobicContact CD2-CB 4.01Å; F551-C559 HydrophobicContact CE1-CB 3.7Å; F551-C559 HydrophobicContact CE2-CB 3.57Å; F551-C559 HydrophobicContact CG-CB 4.28Å; F551-C559 HydrophobicContact CZ-CB 3.4Å; F551-C559 VanDerWaalsContact CZ-CB 3.4Å; F551-C559 PolarHBondContact N-O 3.38Å; F551-C559 VanDerWaalsContact N-O 3.07Å; F551-C559 PolarHBondContact O-N 2.97Å; C559-Y573 HydrophobicContact CB-CE1 4.2Å; C559-Y573 WeakPolarHBondContact SG-CE1 3.4Å; C559-D587 WeakPolarHBondContact CA-O 3.48Å
560	V	88.4	Confident	82.9	Confident	3 Å²	3	38.8 Å²	38.8	2%	0.018	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	106.9	178.5	-179.8	0	0	0	0	108.4	Y548 L550 L558 D587 P619 P621 L622	Y548-V560 HydrophobicContact CD1-CG1 3.9Å; Y548-V560 HydrophobicContact CG-CG1 4.41Å; L550-V560 HydrophobicContact CD2-CB 3.96Å; L550-V560 HydrophobicContact CD2-CG1 3.63Å; L550-V560 HydrophobicContact CD2-CG2 3.6Å; L558-V560 HydrophobicContact CD2-CG2 4.16Å; L558-V560 HydrophobicContact CG-CG2 4.1Å; V560-D587 PolarHBondContact N-O 3.19Å; V560-P619 HydrophobicContact CG2-CB 3.83Å; V560-P619 HydrophobicContact CG2-CG 4.18Å; V560-P621 HydrophobicContact CB-CG 4.06Å; V560-P621 HydrophobicContact CG1-CB 3.91Å; V560-P621 HydrophobicContact CG1-CG 4.02Å; V560-L622 HydrophobicContact CG1-CD2 4.25Å; V560-L622 HydrophobicContact CG1-CG 4.37Å
561	I	82.1	Confident	81.5	Confident	5 Å²	5	43.1 Å²	43.1	3%	0.026	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	129	-172.4	-50.5	-172.7	0	0	0	110.1	Y548 L549 F551 I563 R565 V566 Y573	Y548-I561 CarbonylContact C-O 3.56Å; Y548-I561 WeakPolarHBondContact CA-O 3.48Å; L549-I561 PolarHBondContact N-O 3.05Å; L549-I561 PolarHBondContact O-N 2.93Å; F551-I561 HydrophobicContact CE1-CD1 3.55Å; F551-I561 HydrophobicContact CE1-CG1 4.09Å; F551-I561 HydrophobicContact CZ-CD1 3.94Å; I561-I563 PolarHBondContact O-N 3.48Å; I561-R565 HydrophobicContact CG2-CB 4.32Å; I561-V566 HydrophobicContact CB-CG2 4Å; I561-V566 HydrophobicContact CG2-CG2 3.57Å; I561-Y573 HydrophobicContact CD1-CD2 3.64Å; I561-Y573 HydrophobicContact CD1-CE2 3.57Å; I561-Y573 HydrophobicContact CD1-CG 4.27Å; I561-Y573 HydrophobicContact CG1-CE2 4.38Å
562	P	82.3	Confident	80.2	Confident	10 Å²	10	47.3 Å²	47.3	7%	0.065	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	131.9	171.8	24.3	-34.3	0	0	0	111.6	E547 Y548 K564 R565 V566 P705	E547-P562 CarbonylContact O-C 3.54Å; E547-P562 WeakPolarHBondContact O-CA 3.48Å; Y548-P562 HydrophobicContact CD1-CB 4.3Å; Y548-P562 HydrophobicContact CE1-CB 4.16Å; P562-K564 PolarHBondContact O-N 3.27Å; P562-K564 VanDerWaalsContact O-N 3.16Å; P562-R565 HydrophobicContact CG-CB 4.15Å; P562-R565 WeakPolarHBondContact O-CB 3.45Å; P562-R565 PolarHBondContact O-N 3.47Å; P562-V566 PolarHBondContact O-N 3.45Å; P562-P705 HydrophobicContact CB-CB 3.88Å; P562-P705 HydrophobicContact CG-CB 3.58Å; P562-P705 HydrophobicContact CG-CG 3.77Å
563	I	82.2	Confident	79.1	Confident	2 Å²	2	48 Å²	48	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-56.4	-35.4	-177	-79.5	169.8	0	0	0	112	L510 C512 V543 D546 E547 L549 I561 R565 V566 V567	L510-I563 HydrophobicContact CD1-CG2 3.64Å; L510-I563 HydrophobicContact CD2-CD1 3.95Å; L510-I563 HydrophobicContact CD2-CG1 4.14Å; L510-I563 HydrophobicContact CD2-CG2 4.09Å; C512-I563 HydrophobicContact CB-CG2 3.98Å; V543-I563 HydrophobicContact CG1-CD1 3.86Å; D546-I563 WeakPolarHBondContact O-CD1 3.01Å; E547-I563 PolarHBondContact O-N 2.71Å; L549-I563 HydrophobicContact CB-CG1 4.48Å; I561-I563 PolarHBondContact O-N 3.48Å; I563-R565 PolarHBondContact O-N 3.22Å; I563-V566 WeakPolarHBondContact O-CB 3.12Å; I563-V566 PolarHBondContact O-N 3.04Å; I563-V567 HydrophobicContact CG2-CG2 3.85Å; I563-V567 WeakPolarHBondContact O-CB 3.02Å; I563-V567 WeakPolarHBondContact O-CG2 3.46Å; I563-V567 PolarHBondContact O-N 2.94Å
564	K	78	Confident	77.9	Confident	125 Å²	125	48.8 Å²	48.8	54%	0.543	22%	0.223	S	C	.	.	H	α-helix	trans	-55.1	-37	175.4	-65.5	-179.5	-177.8	172.4	0	112.3	F513 P562 Q568	F513-K564 HydrophobicContact CE2-CG 4.46Å; F513-K564 HydrophobicContact CZ-CD 4.38Å; F513-K564 HydrophobicContact CZ-CG 4.01Å; P562-K564 PolarHBondContact O-N 3.27Å; P562-K564 VanDerWaalsContact O-N 3.16Å; K564-Q568 VanDerWaalsContact O-CG 3.22Å; K564-Q568 WeakPolarHBondContact O-CG 3.21Å; K564-Q568 PolarHBondContact O-N 3.1Å
565	R	75.9	Confident	76.4	Confident	35 Å²	35	49.5 Å²	49.5	13%	0.132	23%	0.228	C	C	.	.	H	α-helix	trans	-76.3	-38.9	176.9	-172.2	175.1	175.7	-160.4	-5.2	111.4	I561 P562 I563 Q568 E576 D587	I561-R565 HydrophobicContact CG2-CB 4.32Å; P562-R565 HydrophobicContact CG-CB 4.15Å; P562-R565 WeakPolarHBondContact O-CB 3.45Å; P562-R565 PolarHBondContact O-N 3.47Å; I563-R565 PolarHBondContact O-N 3.22Å; R565-Q568 PolarHBondContact O-N 3.46Å; R565-E576 IonicContact CZ-OE2 3.88Å; R565-E576 IonicContact NH2-OE1 3.23Å; R565-E576 PolarHBondContact NH2-OE1 2.77Å; R565-E576 IonicContact NH2-OE2 3.81Å; R565-E576 PolarHBondContact NH2-OE2 3.11Å; R565-D587 IonicContact NH1-OD2 3.87Å; R565-D587 PolarHBondContact NH1-OD2 3.36Å
566	V	76.5	Confident	75.1	Confident	4 Å²	4	49.6 Å²	49.6	2%	0.024	22%	0.222	C	C	.	.	H	α-helix	trans	-60.9	-48.5	177.1	-178.9	0	0	0	0	111.2	V529 L534 L549 I561 P562 I563 Q568 K569	V529-V566 HydrophobicContact CB-CG1 4.3Å; V529-V566 HydrophobicContact CG1-CG1 4.09Å; V529-V566 HydrophobicContact CG2-CG1 3.4Å; L534-V566 HydrophobicContact CD2-CG1 4.08Å; L549-V566 HydrophobicContact CB-CG2 4.13Å; L549-V566 HydrophobicContact CD2-CG1 3.96Å; L549-V566 HydrophobicContact CD2-CG2 4.03Å; I561-V566 HydrophobicContact CB-CG2 4Å; I561-V566 HydrophobicContact CG2-CG2 3.57Å; P562-V566 PolarHBondContact O-N 3.45Å; I563-V566 WeakPolarHBondContact O-CB 3.12Å; I563-V566 PolarHBondContact O-N 3.04Å; V566-Q568 VanDerWaalsContact C-N 3.27Å; V566-Q568 PolarHBondContact O-N 3.22Å; V566-K569 PolarHBondContact O-N 2.72Å
567	V	77.7	Confident	73.4	Confident	19 Å²	19	47.7 Å²	47.7	12%	0.115	21%	0.214	C	C	.	.	H	α-helix	trans	-69.6	-22.3	-176.9	170.3	0	0	0	0	113	L510 C512 H517 I563 K569	L510-V567 HydrophobicContact CD1-CG2 4.14Å; C512-V567 HydrophobicContact CB-CG2 4.12Å; H517-V567 WeakPolarHBondContact NE2-CG1 3.34Å; I563-V567 HydrophobicContact CG2-CG2 3.85Å; I563-V567 WeakPolarHBondContact O-CB 3.02Å; I563-V567 WeakPolarHBondContact O-CG2 3.46Å; I563-V567 PolarHBondContact O-N 2.94Å; V567-K569 PolarHBondContact O-N 3.48Å; V567-K569 VanDerWaalsContact O-N 3.17Å
568	Q	72.3	Confident	71.3	Confident	76 Å²	76	52.4 Å²	52.4	36%	0.355	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-12.8	175.5	-77.6	170.8	11.4	0	0	113.2	K564 R565 V566 R570	K564-Q568 VanDerWaalsContact O-CG 3.22Å; K564-Q568 WeakPolarHBondContact O-CG 3.21Å; K564-Q568 PolarHBondContact O-N 3.1Å; R565-Q568 PolarHBondContact O-N 3.46Å; V566-Q568 VanDerWaalsContact C-N 3.27Å; V566-Q568 PolarHBondContact O-N 3.22Å; Q568-R570 WeakPolarHBondContact O-CG 3.47Å; Q568-R570 PolarHBondContact O-N 2.94Å
569	K	66.8	Low	69.2	Low	85 Å²	85	56.3 Å²	56.3	37%	0.37	27%	0.267	S	S	.	.			trans	52	28	174.5	-62.8	177.5	-176.7	-178.1	0	114.6	D530 H532 V566 V567	D530-K569 WeakPolarHBondContact OD2-CE 3.28Å; D530-K569 IonicContact OD2-NZ 2.69Å; D530-K569 PolarHBondContact OD2-NZ 2.73Å; H532-K569 HydrophobicContact CB-CB 4.33Å; H532-K569 HydrophobicContact CB-CD 4.38Å; H532-K569 HydrophobicContact CB-CG 4.11Å; V566-K569 PolarHBondContact O-N 2.72Å; V567-K569 PolarHBondContact O-N 3.48Å; V567-K569 VanDerWaalsContact O-N 3.17Å
570	R	59.4	Low	67.3	Low	188 Å²	188	58.4 Å²	58.4	71%	0.709	29%	0.285	S	S	*	.			trans	-97.6	-7.6	-172.9	-83.8	174.4	-175.6	175.1	0	114.4	Q568	Q568-R570 WeakPolarHBondContact O-CG 3.47Å; Q568-R570 PolarHBondContact O-N 2.94Å
571	F	62.3	Low	64.9	Low	90 Å²	90	64.7 Å²	64.7	40%	0.395	32%	0.323	S	S	.	.			trans	-145.3	134.7	-167.3	-53.4	-77.6	0	0	0	112.2	H532	H532-F571 PolarHBondContact CE1-O 3.22Å
572	K	66.6	Low	62.7	Low	89 Å²	89	66.9 Å²	66.9	39%	0.387	35%	0.348	S	S	.	.			trans	-97.9	117.4	169.1	-172.2	-176.4	176.9	-167.1	0	108.1	D574 D575	K572-D574 VanDerWaalsContact CE-OD2 3.31Å; K572-D574 WeakPolarHBondContact CE-OD2 3.42Å; K572-D574 HydrophobicContact CG-CB 4.46Å; K572-D574 PolarHBondContact O-N 2.77Å; K572-D575 PolarHBondContact O-N 3.08Å
573	Y	69.8	Low	60.7	Low	14 Å²	14	75 Å²	75	6%	0.055	39%	0.39	C	S	.	.	H	α-helix	trans	-70.7	-20.4	-168.5	-160.5	-101.7	0	0	0	113.4	L534 F551 C559 I561 D575 E576 I577	L534-Y573 WeakPolarHBondContact O-CB 3.46Å; L534-Y573 PolarHBondContact O-N 2.71Å; F551-Y573 HydrophobicContact CE2-CD1 4.35Å; F551-Y573 AromaticContact CZ-CD1 3.86Å; F551-Y573 HydrophobicContact CZ-CD1 3.86Å; F551-Y573 HydrophobicContact CZ-CE1 4.11Å; F551-Y573 HydrophobicContact CZ-CG 4.32Å; C559-Y573 HydrophobicContact CB-CE1 4.2Å; C559-Y573 WeakPolarHBondContact SG-CE1 3.4Å; I561-Y573 HydrophobicContact CD1-CD2 3.64Å; I561-Y573 HydrophobicContact CD1-CE2 3.57Å; I561-Y573 HydrophobicContact CD1-CG 4.27Å; I561-Y573 HydrophobicContact CG1-CE2 4.38Å; Y573-D575 PolarHBondContact O-N 3.33Å; Y573-E576 PolarHBondContact O-N 3.34Å; Y573-I577 HydrophobicContact CD1-CD1 3.33Å; Y573-I577 HydrophobicContact CD1-CG1 3.5Å; Y573-I577 VanDerWaalsContact CD1-CG1 3.5Å; Y573-I577 HydrophobicContact CE1-CD1 3.53Å; Y573-I577 HydrophobicContact CE1-CG1 3.36Å; Y573-I577 WeakPolarHBondContact O-CG1 3.39Å; Y573-I577 PolarHBondContact O-N 2.72Å; Y573-I577 VanDerWaalsContact O-N 3.12Å
574	D	64.3	Low	58.9	Low	20 Å²	20	80.2 Å²	80.2	11%	0.107	42%	0.417	C	S	.	.	H	α-helix	trans	-56.2	-34.4	176.1	-64.6	-22.5	0	0	0	112.2	C535 S536 K572	C535-D574 PolarHBondContact SG-OD1 2.92Å; S536-D574 VanDerWaalsContact CB-OD2 3.29Å; S536-D574 WeakPolarHBondContact CB-OD2 3.26Å; S536-D574 PolarHBondContact N-OD1 3.12Å; S536-D574 PolarHBondContact N-OD2 3.4Å; S536-D574 VanDerWaalsContact OG-CG 3.24Å; S536-D574 PolarHBondContact OG-OD1 2.89Å; S536-D574 PolarHBondContact OG-OD2 3.15Å; K572-D574 VanDerWaalsContact CE-OD2 3.31Å; K572-D574 WeakPolarHBondContact CE-OD2 3.42Å; K572-D574 HydrophobicContact CG-CB 4.46Å; K572-D574 PolarHBondContact O-N 2.77Å
575	D	57.4	Low	57.5	Low	103 Å²	103	77.9 Å²	77.9	55%	0.551	41%	0.41	S	S	*	.	H	α-helix	trans	-77.2	-31.3	-177.8	-60.4	-29	0	0	0	112.4	K572 Y573 S579	K572-D575 PolarHBondContact O-N 3.08Å; Y573-D575 PolarHBondContact O-N 3.33Å; D575-S579 PolarHBondContact O-N 3.31Å; D575-S579 PolarHBondContact O-OG 3.09Å
576	E	58	Low	56.5	Low	63 Å²	63	77.5 Å²	77.5	29%	0.294	41%	0.413	S	S	.	.	H	α-helix	trans	-77.2	-35.1	176.8	-74.4	-174	-168	0	0	112.1	R565 Y573 L578 S579 A580	R565-E576 IonicContact CZ-OE2 3.88Å; R565-E576 IonicContact NH2-OE1 3.23Å; R565-E576 PolarHBondContact NH2-OE1 2.77Å; R565-E576 IonicContact NH2-OE2 3.81Å; R565-E576 PolarHBondContact NH2-OE2 3.11Å; Y573-E576 PolarHBondContact O-N 3.34Å; E576-L578 PolarHBondContact O-N 2.9Å; E576-S579 WeakPolarHBondContact CA-OG 3.41Å; E576-S579 PolarHBondContact O-N 3.38Å; E576-S579 PolarHBondContact O-OG 2.86Å; E576-A580 PolarHBondContact O-N 3.28Å
577	I	52.8	Low	55.9	Low	28 Å²	28	77.6 Å²	77.6	14%	0.144	41%	0.413	C	S	.	.	H	α-helix	trans	-62.3	-34.8	176.9	-66.1	166.6	0	0	0	111.4	Y573	Y573-I577 HydrophobicContact CD1-CD1 3.33Å; Y573-I577 HydrophobicContact CD1-CG1 3.5Å; Y573-I577 VanDerWaalsContact CD1-CG1 3.5Å; Y573-I577 HydrophobicContact CE1-CD1 3.53Å; Y573-I577 HydrophobicContact CE1-CG1 3.36Å; Y573-I577 WeakPolarHBondContact O-CG1 3.39Å; Y573-I577 PolarHBondContact O-N 2.72Å; Y573-I577 VanDerWaalsContact O-N 3.12Å
578	L	44.3	Very low	55.8	Low	141 Å²	141	79.4 Å²	79.4	74%	0.738	42%	0.418	S	S	*	.	H	α-helix	trans	-80.6	-29.2	-178.3	-72.5	165.8	0	0	0	113.2	E576	E576-L578 PolarHBondContact O-N 2.9Å
579	S	47.3	Very low	56.3	Low	82 Å²	82	81.6 Å²	81.6	57%	0.573	42%	0.423	S	S	*	.	H	α-helix	trans	-90	-12.8	-177.3	51.9	0	0	0	0	114.2	D575 E576 T581	D575-S579 PolarHBondContact O-N 3.31Å; D575-S579 PolarHBondContact O-OG 3.09Å; E576-S579 WeakPolarHBondContact CA-OG 3.41Å; E576-S579 PolarHBondContact O-N 3.38Å; E576-S579 PolarHBondContact O-OG 2.86Å; S579-T581 PolarHBondContact O-N 3.45Å
580	A	49.6	Very low	57.3	Low	45 Å²	45	82.4 Å²	82.4	37%	0.372	44%	0.437	S	S	.	.			trans	-75.2	60.4	177.3	0	0	0	0	0	112.9	E576 Y588	E576-A580 PolarHBondContact O-N 3.28Å; A580-Y588 HydrophobicContact CB-CE1 4.2Å
581	T	36.9	Very low	58.8	Low	134 Å²	134	74.4 Å²	74.4	82%	0.822	41%	0.409	S	S	*	.			trans	-91.3	86	165.9	50.6	0	0	0	0	109.3	S579	S579-T581 PolarHBondContact O-N 3.45Å
582	G	37.2	Very low	60.1	Low	52 Å²	52	74.3 Å²	74.3	54%	0.536	41%	0.41	S	S	.	.	S	Bend	trans	148.2	109.4	166.3	0	0	0	0	0	115.2	I584	G582-I584 PolarHBondContact O-N 3.27Å
583	N	40.3	Very low	61.2	Low	180 Å²	180	79.1 Å²	79.1	96%	0.963	43%	0.426	S	S	*	.	S	Bend	trans	33.8	3.4	149.1	-74.1	-4	0	0	0	123.3
584	I	42.6	Very low	62	Low	112 Å²	112	80.1 Å²	80.1	57%	0.574	44%	0.44	S	S	*	.	S	Bend	trans	-95.3	129.7	176.5	-57.9	168.2	0	0	0	106.3	G582 S586 F696	G582-I584 PolarHBondContact O-N 3.27Å; I584-S586 PolarHBondContact O-N 3.29Å; I584-F696 HydrophobicContact CG2-CB 4.21Å; I584-F696 HydrophobicContact CG2-CD2 4.42Å
585	L	50	Low	63.3	Low	75 Å²	75	79.3 Å²	79.3	39%	0.393	44%	0.436	S	S	.	.			trans	-55.1	84.2	177.2	-78.7	157.3	0	0	0	110.1	L620 L693 Y697	L585-L620 HydrophobicContact CD1-CD2 3.99Å; L585-L620 HydrophobicContact CD2-CD2 4.09Å; L585-L620 HydrophobicContact CG-CD2 4.49Å; L585-L693 HydrophobicContact CD1-CD1 3.99Å; L585-L693 HydrophobicContact CD1-CG 4.45Å; L585-L693 WeakPolarHBondContact CD1-O 3.48Å; L585-Y697 HydrophobicContact CB-CE2 4.45Å
586	S	54.8	Low	65	Low	28 Å²	28	80.5 Å²	80.5	20%	0.196	43%	0.433	C	S	.	.			trans	-69	156.2	179.4	49.9	0	0	0	0	110.3	I584 Y588	I584-S586 PolarHBondContact O-N 3.29Å; S586-Y588 PolarHBondContact O-N 3.27Å; S586-Y588 VanDerWaalsContact OG-CD1 3.23Å; S586-Y588 WeakPolarHBondContact OG-CD1 3.27Å; S586-Y588 WeakPolarHBondContact OG-CE1 3.5Å
587	D	63.3	Low	66.7	Low	5 Å²	5	78 Å²	78	3%	0.027	42%	0.422	C	S	.	.	S	Bend	trans	-54	7.5	175.6	-82.7	-30.8	0	0	0	116.3	C559 V560 R565 F696	C559-D587 WeakPolarHBondContact CA-O 3.48Å; V560-D587 PolarHBondContact N-O 3.19Å; R565-D587 IonicContact NH1-OD2 3.87Å; R565-D587 PolarHBondContact NH1-OD2 3.36Å; D587-F696 HydrophobicContact CB-CE1 4.37Å; D587-F696 HydrophobicContact CB-CZ 4.38Å; D587-F696 VanDerWaalsContact CG-CZ 3.48Å; D587-F696 WeakPolarHBondContact OD1-CE1 3.3Å; D587-F696 WeakPolarHBondContact OD2-CE1 3.13Å; D587-F696 WeakPolarHBondContact OD2-CZ 3.5Å
588	Y	75.7	Confident	68.6	Low	58 Å²	58	77.3 Å²	77.3	23%	0.227	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	146.7	179.7	67.4	-100.3	0	0	0	113.9	K557 L558 A580 S586	K557-Y588 HydrophobicContact CD-CD2 3.61Å; K557-Y588 HydrophobicContact CD-CE2 3.95Å; K557-Y588 HydrophobicContact CD-CG 3.97Å; K557-Y588 HydrophobicContact CG-CD2 4.14Å; L558-Y588 CarbonylContact O-C 3.15Å; L558-Y588 WeakPolarHBondContact O-CA 3.24Å; A580-Y588 HydrophobicContact CB-CE1 4.2Å; S586-Y588 PolarHBondContact O-N 3.27Å; S586-Y588 VanDerWaalsContact OG-CD1 3.23Å; S586-Y588 WeakPolarHBondContact OG-CD1 3.27Å; S586-Y588 WeakPolarHBondContact OG-CE1 3.5Å
589	R	84	Confident	71	Confident	122 Å²	122	70.6 Å²	70.6	46%	0.46	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	132.2	171.6	-179.3	-175.5	179	83.6	1.3	109	K557 L558	K557-R589 CarbonylContact C-O 3.57Å; K557-R589 WeakPolarHBondContact CA-O 3.5Å; L558-R589 HydrophobicContact CB-CB 4.45Å; L558-R589 PolarHBondContact N-O 2.87Å; L558-R589 PolarHBondContact O-N 3.37Å
590	P	87.7	Confident	73.2	Confident	102 Å²	102	67.1 Å²	67.1	66%	0.662	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.2	138.6	171.5	27.2	-33.3	0	0	0	110.6
591	V	90.1	Very high	75.1	Confident	19 Å²	19	66.8 Å²	66.8	12%	0.115	35%	0.349	C	S	.	.			trans	-126.1	164.5	176	-65.9	0	0	0	0	109.9	H556 L558 F607	H556-V591 VanDerWaalsContact C-CG2 3.46Å; H556-V591 WeakPolarHBondContact CB-O 3.38Å; H556-V591 WeakPolarHBondContact O-CG2 3.45Å; H556-V591 PolarHBondContact O-N 3.14Å; L558-V591 HydrophobicContact CB-CG1 3.68Å; V591-F607 HydrophobicContact CG1-CE2 4.17Å; V591-F607 HydrophobicContact CG1-CZ 4.1Å
592	E	90	Very high	77.6	Confident	89 Å²	89	63 Å²	63	42%	0.416	34%	0.338	S	S	.	.			trans	-65.2	151.2	176.1	-176.2	173.6	167.7	0	0	111.2	G594 S595 L609	E592-G594 PolarHBondContact O-N 3.44Å; E592-S595 PolarHBondContact N-OG 2.91Å; E592-S595 WeakPolarHBondContact O-CB 3.31Å; E592-S595 PolarHBondContact O-N 2.95Å; E592-S595 VanDerWaalsContact O-N 3.16Å; E592-S595 PolarHBondContact O-OG 3.23Å; E592-L609 HydrophobicContact CB-CD2 3.8Å; E592-L609 HydrophobicContact CG-CD2 4.28Å; E592-L609 VanDerWaalsContact OE2-CD1 3.28Å; E592-L609 WeakPolarHBondContact OE2-CD1 3.2Å
593	R	89.7	Confident	80.1	Confident	190 Å²	190	61.4 Å²	61.4	72%	0.717	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	122.6	-179.6	171.7	161.4	-173	-165.3	3.3	111.5	H556 S595 P610	H556-R593 VanDerWaalsContact CE1-CG 3.42Å; H556-R593 WeakPolarHBondContact CE1-CG 3.33Å; H556-R593 WeakPolarHBondContact NE2-CG 3.31Å; R593-S595 VanDerWaalsContact C-N 3.34Å; R593-P610 VanDerWaalsContact O-CD 3.27Å; R593-P610 WeakPolarHBondContact O-CD 3.39Å; R593-P610 WeakPolarHBondContact O-CG 2.97Å
594	G	86.6	Confident	82.6	Confident	35 Å²	35	53.5 Å²	53.5	36%	0.361	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.5	10.8	175.1	0	0	0	0	0	115.4	E592 R596	E592-G594 PolarHBondContact O-N 3.44Å; G594-R596 PolarHBondContact O-N 3.22Å
595	S	92	Very high	85.1	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.021	25%	0.248	C	C	.	.			trans	-56.7	132.7	172.6	-56.8	0	0	0	0	111.5	E592 R593 L609	E592-S595 PolarHBondContact N-OG 2.91Å; E592-S595 WeakPolarHBondContact O-CB 3.31Å; E592-S595 PolarHBondContact O-N 2.95Å; E592-S595 VanDerWaalsContact O-N 3.16Å; E592-S595 PolarHBondContact O-OG 3.23Å; R593-S595 VanDerWaalsContact C-N 3.34Å; S595-L609 WeakPolarHBondContact OG-CD2 3.44Å
596	R	92.2	Very high	87.2	Confident	127 Å²	127	44.6 Å²	44.6	48%	0.479	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	140.5	175.9	-68	-175.5	174.1	-174.2	-2.2	111.4	G594 V598 F607 Q608	G594-R596 PolarHBondContact O-N 3.22Å; R596-V598 PolarHBondContact O-N 2.83Å; R596-F607 CarbonylContact O-C 3.46Å; R596-F607 VanDerWaalsContact O-CA 3.22Å; R596-F607 WeakPolarHBondContact O-CA 3.46Å; R596-Q608 PolarHBondContact N-O 3.41Å; R596-Q608 PolarHBondContact O-N 2.94Å
597	I	94	Very high	89.1	Confident	11 Å²	11	43.2 Å²	43.2	6%	0.056	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	122.8	-179.9	-59.6	165.7	0	0	0	109.5	S540 M542 L550 T552 L558 V605 F607	S540-I597 PolarHBondContact OG-N 3.16Å; M542-I597 HydrophobicContact CB-CD1 4.49Å; M542-I597 HydrophobicContact CB-CG2 3.88Å; M542-I597 HydrophobicContact CG-CG2 4.48Å; M542-I597 HydrophobicContact SD-CG2 3.72Å; L550-I597 HydrophobicContact CB-CD1 3.94Å; T552-I597 HydrophobicContact CG2-CD1 4.19Å; T552-I597 HydrophobicContact CG2-CG1 3.95Å; L558-I597 HydrophobicContact CD1-CD1 4.25Å; I597-V605 HydrophobicContact CG1-CG1 4.46Å; I597-V605 HydrophobicContact CG2-CG1 4.29Å; I597-F607 HydrophobicContact CD1-CE1 4.46Å; I597-F607 HydrophobicContact CG1-CD1 3.94Å; I597-F607 HydrophobicContact CG1-CE1 3.49Å; I597-F607 VanDerWaalsContact CG1-CE1 3.49Å
598	V	93.1	Very high	90.5	Very high	14 Å²	14	46.1 Å²	46.1	9%	0.085	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-54.4	174.2	176.2	0	0	0	0	110	R320 V325 F338 R596 V606 Q608 L614	R320-V598 WeakPolarHBondContact CD-O 3.48Å; R320-V598 PolarHBondContact NH1-O 3.23Å; V325-V598 HydrophobicContact CG1-CG1 4.46Å; V325-V598 HydrophobicContact CG2-CG1 4.04Å; F338-V598 HydrophobicContact CE2-CG1 4.14Å; F338-V598 HydrophobicContact CZ-CG1 4.46Å; R596-V598 PolarHBondContact O-N 2.83Å; V598-V606 HydrophobicContact CB-CG1 4.49Å; V598-V606 PolarHBondContact N-O 2.8Å; V598-Q608 HydrophobicContact CG2-CB 3.59Å; V598-L614 HydrophobicContact CG2-CD2 4.45Å
599	T	93.6	Very high	91.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	167	176.3	-169.7	0	0	0	0	112.1	N322 V325 F338 M542 F601 V606	N322-T599 PolarHBondContact O-OG1 2.92Å; V325-T599 HydrophobicContact CG2-CG2 4.29Å; F338-T599 HydrophobicContact CB-CG2 4.26Å; F338-T599 HydrophobicContact CD2-CG2 3.49Å; F338-T599 VanDerWaalsContact CD2-CG2 3.49Å; F338-T599 HydrophobicContact CE2-CG2 4.13Å; F338-T599 HydrophobicContact CG-CG2 4.04Å; M542-T599 VanDerWaalsContact SD-C 3.53Å; T599-F601 HydrophobicContact CG2-CD1 4.27Å; T599-F601 HydrophobicContact CG2-CE1 4.49Å; T599-V606 HydrophobicContact CG2-CB 4.16Å; T599-V606 HydrophobicContact CG2-CG2 4.11Å; T599-V606 PolarHBondContact O-N 2.69Å
600	S	92.9	Very high	91.3	Very high	8 Å²	8	42.5 Å²	42.5	6%	0.056	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	138.9	172.1	67.2	0	0	0	0	110.1	M542 H544 S604	M542-S600 PolarHBondContact SD-N 2.88Å; M542-S600 PolarHBondContact SD-OG 3.35Å; H544-S600 VanDerWaalsContact ND1-CB 3.33Å; H544-S600 WeakPolarHBondContact ND1-CB 3.44Å; H544-S600 PolarHBondContact ND1-OG 3Å; S600-S604 CarbonylContact C-O 3.59Å; S600-S604 VanDerWaalsContact CA-O 3.26Å; S600-S604 WeakPolarHBondContact CA-O 3.36Å
601	F	90.7	Very high	91.1	Very high	38 Å²	38	46.8 Å²	46.8	17%	0.167	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	140.4	-179.6	61.5	-85	0	0	0	110.7	F338 T599 T603 S604 V606	F338-F601 VanDerWaalsContact C-CZ 3.48Å; F338-F601 HydrophobicContact CB-CD1 4.17Å; F338-F601 HydrophobicContact CB-CE1 3.38Å; F338-F601 HydrophobicContact CB-CZ 3.85Å; F338-F601 WeakPolarHBondContact O-CZ 3.36Å; T599-F601 HydrophobicContact CG2-CD1 4.27Å; T599-F601 HydrophobicContact CG2-CE1 4.49Å; F601-T603 PolarHBondContact O-N 3.49Å; F601-T603 VanDerWaalsContact O-N 3.09Å; F601-S604 PolarHBondContact N-O 2.98Å; F601-S604 WeakPolarHBondContact O-CB 3.46Å; F601-S604 PolarHBondContact O-N 3.08Å; F601-V606 HydrophobicContact CE1-CG2 3.79Å
602	G	88.4	Confident	90.8	Very high	56 Å²	56	46 Å²	46	58%	0.577	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.2	-115.4	-175.2	0	0	0	0	0	111	H544	H544-G602 PolarHBondContact CE1-O 2.79Å; H544-G602 PolarHBondContact NE2-O 2.98Å; H544-G602 VanDerWaalsContact NE2-O 3.08Å
603	T	90.5	Very high	90.8	Very high	17 Å²	17	45.9 Å²	45.9	10%	0.104	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106	4.5	173.4	62.3	0	0	0	0	113.3	F601 H618 P619 L623	F601-T603 PolarHBondContact O-N 3.49Å; F601-T603 VanDerWaalsContact O-N 3.09Å; T603-H618 WeakPolarHBondContact O-CA 3.38Å; T603-H618 PolarHBondContact O-ND1 3.27Å; T603-H618 PolarHBondContact OG1-ND1 3.2Å; T603-P619 WeakPolarHBondContact O-CD 3.38Å; T603-L623 HydrophobicContact CG2-CD2 4.18Å
604	S	92.9	Very high	91	Very high	14 Å²	14	38.4 Å²	38.4	10%	0.098	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	138	-171.3	-44.1	0	0	0	0	111.1	S600 F601 V617 H618	S600-S604 CarbonylContact C-O 3.59Å; S600-S604 VanDerWaalsContact CA-O 3.26Å; S600-S604 WeakPolarHBondContact CA-O 3.36Å; F601-S604 PolarHBondContact N-O 2.98Å; F601-S604 WeakPolarHBondContact O-CB 3.46Å; F601-S604 PolarHBondContact O-N 3.08Å; S604-V617 CarbonylContact C-O 3.41Å; S604-V617 WeakPolarHBondContact CA-O 3.44Å; S604-H618 PolarHBondContact OG-CE1 3.14Å
605	V	94.3	Very high	91.2	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	122.6	169.3	-177	0	0	0	0	107.8	L550 I597 F607 T616 V617 P619 L622	L550-V605 HydrophobicContact CD1-CG1 4.33Å; L550-V605 HydrophobicContact CD1-CG2 3.68Å; I597-V605 HydrophobicContact CG1-CG1 4.46Å; I597-V605 HydrophobicContact CG2-CG1 4.29Å; V605-F607 HydrophobicContact CB-CE2 4.4Å; V605-F607 HydrophobicContact CB-CZ 4.36Å; V605-F607 HydrophobicContact CG1-CE1 3.98Å; V605-F607 HydrophobicContact CG1-CE2 3.98Å; V605-F607 HydrophobicContact CG1-CZ 3.57Å; V605-T616 WeakPolarHBondContact O-CA 3.22Å; V605-V617 HydrophobicContact CB-CG2 4.16Å; V605-V617 PolarHBondContact N-O 3.32Å; V605-V617 PolarHBondContact O-N 2.99Å; V605-P619 HydrophobicContact CB-CG 4.44Å; V605-P619 HydrophobicContact CG2-CG 3.7Å; V605-L622 HydrophobicContact CG2-CD1 4.07Å
606	V	95.1	Very high	91.3	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	123.4	-178.3	-175.1	0	0	0	0	109.1	F338 V598 T599 F601 E615 T616	F338-V606 HydrophobicContact CB-CG2 4.36Å; F338-V606 HydrophobicContact CD1-CG1 4.18Å; F338-V606 HydrophobicContact CD1-CG2 4.26Å; F338-V606 HydrophobicContact CE1-CG1 4.08Å; F338-V606 HydrophobicContact CG-CG2 4.27Å; F338-V606 HydrophobicContact CZ-CG1 4.43Å; V598-V606 HydrophobicContact CB-CG1 4.49Å; V598-V606 PolarHBondContact N-O 2.8Å; T599-V606 HydrophobicContact CG2-CB 4.16Å; T599-V606 HydrophobicContact CG2-CG2 4.11Å; T599-V606 PolarHBondContact O-N 2.69Å; F601-V606 HydrophobicContact CE1-CG2 3.79Å; V606-E615 CarbonylContact C-O 3.58Å; V606-E615 WeakPolarHBondContact CA-O 3.39Å; V606-T616 HydrophobicContact CG2-CG2 4.23Å
607	F	94.4	Very high	91.4	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	150.2	174.2	-59.4	-76.1	0	0	0	111.4	T552 L558 V591 R596 I597 V605 L614 E615 V617	T552-F607 HydrophobicContact CG2-CD1 4.22Å; T552-F607 HydrophobicContact CG2-CE1 3.6Å; L558-F607 HydrophobicContact CB-CZ 4.16Å; L558-F607 HydrophobicContact CD1-CE1 4.15Å; L558-F607 HydrophobicContact CD1-CZ 3.82Å; L558-F607 HydrophobicContact CD2-CE2 4.35Å; L558-F607 HydrophobicContact CD2-CZ 3.73Å; L558-F607 HydrophobicContact CG-CZ 4.08Å; V591-F607 HydrophobicContact CG1-CE2 4.17Å; V591-F607 HydrophobicContact CG1-CZ 4.1Å; R596-F607 CarbonylContact O-C 3.46Å; R596-F607 VanDerWaalsContact O-CA 3.22Å; R596-F607 WeakPolarHBondContact O-CA 3.46Å; I597-F607 HydrophobicContact CD1-CE1 4.46Å; I597-F607 HydrophobicContact CG1-CD1 3.94Å; I597-F607 HydrophobicContact CG1-CE1 3.49Å; I597-F607 VanDerWaalsContact CG1-CE1 3.49Å; V605-F607 HydrophobicContact CB-CE2 4.4Å; V605-F607 HydrophobicContact CB-CZ 4.36Å; V605-F607 HydrophobicContact CG1-CE1 3.98Å; V605-F607 HydrophobicContact CG1-CE2 3.98Å; V605-F607 HydrophobicContact CG1-CZ 3.57Å; F607-L614 CarbonylContact O-C 3.57Å; F607-L614 VanDerWaalsContact O-CA 3.25Å; F607-L614 WeakPolarHBondContact O-CA 3.49Å; F607-E615 PolarHBondContact N-O 3.4Å; F607-E615 PolarHBondContact O-N 3.46Å; F607-V617 HydrophobicContact CD2-CG1 4.25Å; F607-V617 HydrophobicContact CD2-CG2 4.4Å; F607-V617 HydrophobicContact CE2-CB 4.38Å; F607-V617 HydrophobicContact CE2-CG1 4Å; F607-V617 HydrophobicContact CE2-CG2 3.51Å; F607-V617 HydrophobicContact CZ-CG2 4.31Å
608	Q	93	Very high	91.3	Very high	65 Å²	65	38.4 Å²	38.4	30%	0.304	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	124.5	159.6	-172.8	170	31.2	0	0	109.1	C269 R596 V598 L614	C269-Q608 PolarHBondContact SG-NE2 3.23Å; C269-Q608 VanDerWaalsContact SG-NE2 3.44Å; R596-Q608 PolarHBondContact N-O 3.41Å; R596-Q608 PolarHBondContact O-N 2.94Å; V598-Q608 HydrophobicContact CG2-CB 3.59Å; Q608-L614 HydrophobicContact CB-CD2 3.88Å; Q608-L614 HydrophobicContact CG-CD2 4.07Å
609	L	91.1	Very high	91.2	Very high	17 Å²	17	37.9 Å²	37.9	9%	0.089	20%	0.203	C	C	.	.			trans	-77.1	156.8	175.1	-58.6	-179.5	0	0	0	110	E592 S595 R611 G612 N613	E592-L609 HydrophobicContact CB-CD2 3.8Å; E592-L609 HydrophobicContact CG-CD2 4.28Å; E592-L609 VanDerWaalsContact OE2-CD1 3.28Å; E592-L609 WeakPolarHBondContact OE2-CD1 3.2Å; S595-L609 WeakPolarHBondContact OG-CD2 3.44Å; L609-R611 PolarHBondContact O-N 3.4Å; L609-G612 WeakPolarHBondContact O-CA 3.47Å; L609-G612 PolarHBondContact O-N 3.02Å; L609-N613 HydrophobicContact CD1-CB 4.07Å; L609-N613 PolarHBondContact N-O 3.07Å
610	P	84.4	Confident	90.9	Very high	88 Å²	88	39.7 Å²	39.7	57%	0.571	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-24.3	178.9	-26.8	35.4	0	0	0	114.4	R593 G612	R593-P610 VanDerWaalsContact O-CD 3.27Å; R593-P610 WeakPolarHBondContact O-CD 3.39Å; R593-P610 WeakPolarHBondContact O-CG 2.97Å; P610-G612 VanDerWaalsContact C-N 3.26Å
611	R	83.4	Confident	90.6	Very high	192 Å²	192	39.7 Å²	39.7	73%	0.725	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-20.1	175.4	-64.5	-176.6	-179.5	-174.2	1.7	112.9	N270 L609	N270-R611 PolarHBondContact OD1-O 3.23Å; L609-R611 PolarHBondContact O-N 3.4Å
612	G	85.2	Confident	90.6	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.01	21%	0.205	C	C	.	.	S	Bend	trans	107.2	-11.3	-178.8	0	0	0	0	0	114.7	C269 N270 L609 P610	C269-G612 WeakPolarHBondContact SG-CA 3.42Å; N270-G612 VanDerWaalsContact ND2-C 3.35Å; N270-G612 PolarHBondContact ND2-O 3.25Å; N270-G612 VanDerWaalsContact ND2-O 3.1Å; N270-G612 VanDerWaalsContact OD1-CA 3.22Å; N270-G612 WeakPolarHBondContact OD1-CA 3.44Å; L609-G612 WeakPolarHBondContact O-CA 3.47Å; L609-G612 PolarHBondContact O-N 3.02Å; P610-G612 VanDerWaalsContact C-N 3.26Å
613	N	90.2	Very high	90.7	Very high	87 Å²	87	35.9 Å²	35.9	47%	0.465	18%	0.18	S	C	.	.			trans	-63.7	150.1	175	-71	-10.8	0	0	0	111.8	L609	L609-N613 HydrophobicContact CD1-CB 4.07Å; L609-N613 PolarHBondContact N-O 3.07Å
614	L	92.4	Very high	90.7	Very high	34 Å²	34	35.1 Å²	35.1	18%	0.178	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	138.4	173.6	-58.5	-176.1	0	0	0	111.2	F338 V342 T343 P345 V598 F607 Q608	F338-L614 HydrophobicContact CE1-CD1 3.43Å; F338-L614 VanDerWaalsContact CE1-CD1 3.43Å; F338-L614 HydrophobicContact CZ-CD1 3.72Å; V342-L614 HydrophobicContact CG1-CB 3.95Å; V342-L614 HydrophobicContact CG1-CD1 4Å; T343-L614 WeakPolarHBondContact O-CD1 3.39Å; P345-L614 HydrophobicContact CG-CD2 4.47Å; P345-L614 HydrophobicContact CG-CG 4.44Å; V598-L614 HydrophobicContact CG2-CD2 4.45Å; F607-L614 CarbonylContact O-C 3.57Å; F607-L614 VanDerWaalsContact O-CA 3.25Å; F607-L614 WeakPolarHBondContact O-CA 3.49Å; Q608-L614 HydrophobicContact CB-CD2 3.88Å; Q608-L614 HydrophobicContact CG-CD2 4.07Å
615	E	92.5	Very high	90.4	Very high	68 Å²	68	37.3 Å²	37.3	32%	0.318	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	132.3	172.9	-173.1	-176	166	0	0	109	V606 F607 V617	V606-E615 CarbonylContact C-O 3.58Å; V606-E615 WeakPolarHBondContact CA-O 3.39Å; F607-E615 PolarHBondContact N-O 3.4Å; F607-E615 PolarHBondContact O-N 3.46Å; E615-V617 HydrophobicContact CG-CG1 4.25Å
616	T	93.6	Very high	90.3	Very high	47 Å²	47	38.8 Å²	38.8	29%	0.288	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	125.4	175	-56.7	0	0	0	0	109.7	V342 V605 V606	V342-T616 WeakPolarHBondContact CG2-OG1 3.32Å; V605-T616 WeakPolarHBondContact O-CA 3.22Å; V606-T616 HydrophobicContact CG2-CG2 4.23Å
617	V	92.9	Very high	90.2	Very high	7 Å²	7	38.8 Å²	38.8	4%	0.042	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	157.2	176	-47.7	0	0	0	0	110.5	L558 S604 V605 F607 E615 P619	L558-V617 HydrophobicContact CD2-CG2 4.18Å; S604-V617 CarbonylContact C-O 3.41Å; S604-V617 WeakPolarHBondContact CA-O 3.44Å; V605-V617 HydrophobicContact CB-CG2 4.16Å; V605-V617 PolarHBondContact N-O 3.32Å; V605-V617 PolarHBondContact O-N 2.99Å; F607-V617 HydrophobicContact CD2-CG1 4.25Å; F607-V617 HydrophobicContact CD2-CG2 4.4Å; F607-V617 HydrophobicContact CE2-CB 4.38Å; F607-V617 HydrophobicContact CE2-CG1 4Å; F607-V617 HydrophobicContact CE2-CG2 3.51Å; F607-V617 HydrophobicContact CZ-CG2 4.31Å; E615-V617 HydrophobicContact CG-CG1 4.25Å; V617-P619 HydrophobicContact CG2-CG 4.15Å
618	H	92.5	Very high	90	Very high	54 Å²	54	38.8 Å²	38.8	25%	0.25	19%	0.192	C	C	.	.			trans	-116.1	95.8	171.9	-62	-90.5	0	0	0	109.2	T603 S604 L623 H646	T603-H618 WeakPolarHBondContact O-CA 3.38Å; T603-H618 PolarHBondContact O-ND1 3.27Å; T603-H618 PolarHBondContact OG1-ND1 3.2Å; S604-H618 PolarHBondContact OG-CE1 3.14Å; H618-L623 HydrophobicContact CB-CD1 3.79Å; H618-L623 HydrophobicContact CB-CD2 4.03Å; H618-L623 HydrophobicContact CB-CG 3.96Å; H618-L623 WeakPolarHBondContact O-CD1 3.47Å; H618-H646 AromaticContact CD2-CE1 3.56Å; H618-H646 AromaticContact CG-CE1 3.57Å; H618-H646 AromaticContact ND1-CE1 3.89Å; H618-H646 AromaticContact NE2-CE1 3.84Å
619	P	90.6	Very high	89.8	Confident	3 Å²	3	37.9 Å²	37.9	2%	0.019	19%	0.189	C	C	.	.			trans	-61.7	139	-179.8	-21.3	33.5	0	0	0	111.6	L558 V560 T603 V605 V617 P621 L622 L623	L558-P619 HydrophobicContact CD2-CB 4.4Å; L558-P619 HydrophobicContact CD2-CG 3.71Å; V560-P619 HydrophobicContact CG2-CB 3.83Å; V560-P619 HydrophobicContact CG2-CG 4.18Å; T603-P619 WeakPolarHBondContact O-CD 3.38Å; V605-P619 HydrophobicContact CB-CG 4.44Å; V605-P619 HydrophobicContact CG2-CG 3.7Å; V617-P619 HydrophobicContact CG2-CG 4.15Å; P619-P621 VanDerWaalsContact C-CD 3.4Å; P619-L622 HydrophobicContact CB-CG 4.45Å; P619-L622 HydrophobicContact CG-CD1 4.2Å; P619-L622 PolarHBondContact O-N 3.48Å; P619-L623 PolarHBondContact O-N 3.43Å; P619-L623 VanDerWaalsContact O-N 3.08Å
620	L	88.7	Confident	89.9	Confident	38 Å²	38	39.6 Å²	39.6	20%	0.199	20%	0.196	C	C	.	.	H	α-helix	trans	-54.4	-41.1	-179.1	-177	61.9	0	0	0	113.8	L585 L622 L623 L624 L648 Y694 Y697	L585-L620 HydrophobicContact CD1-CD2 3.99Å; L585-L620 HydrophobicContact CD2-CD2 4.09Å; L585-L620 HydrophobicContact CG-CD2 4.49Å; L620-L622 VanDerWaalsContact C-N 3.35Å; L620-L622 PolarHBondContact O-N 3.33Å; L620-L623 PolarHBondContact O-N 2.87Å; L620-L624 HydrophobicContact CD1-CD1 4.12Å; L620-L624 HydrophobicContact CD1-CD2 4.38Å; L620-L624 HydrophobicContact CD1-CG 3.9Å; L620-L624 HydrophobicContact CG-CD1 3.94Å; L620-L624 HydrophobicContact CG-CG 4.18Å; L620-L624 WeakPolarHBondContact O-CB 3.42Å; L620-L624 WeakPolarHBondContact O-CG 3.43Å; L620-L624 PolarHBondContact O-N 3.15Å; L620-L648 HydrophobicContact CD1-CD2 3.54Å; L620-Y694 HydrophobicContact CD1-CE1 4.24Å; L620-Y694 HydrophobicContact CD2-CE1 4.33Å; L620-Y697 HydrophobicContact CD2-CE2 3.67Å; L620-Y697 HydrophobicContact CG-CE2 4.05Å
621	P	86.1	Confident	90.3	Very high	7 Å²	7	35.8 Å²	35.8	5%	0.045	17%	0.171	C	C	.	.	H	α-helix	trans	-60.4	-41.7	178.6	-21.3	31.4	0	0	0	113.1	V560 P619 R625 Y697	V560-P621 HydrophobicContact CB-CG 4.06Å; V560-P621 HydrophobicContact CG1-CB 3.91Å; V560-P621 HydrophobicContact CG1-CG 4.02Å; P619-P621 VanDerWaalsContact C-CD 3.4Å; P621-R625 WeakPolarHBondContact O-CB 3.14Å; P621-R625 PolarHBondContact O-N 2.89Å; P621-Y697 HydrophobicContact CB-CE1 3.99Å; P621-Y697 HydrophobicContact CG-CE1 3.61Å
622	L	89.9	Confident	90.6	Very high	5 Å²	5	30.2 Å²	30.2	3%	0.026	16%	0.155	C	C	.	.	H	α-helix	trans	-69.9	-38.3	178.3	-58.1	-175.2	0	0	0	111.4	Y548 V560 V605 P619 L620 S626	Y548-L622 HydrophobicContact CD1-CD2 4.28Å; Y548-L622 HydrophobicContact CD2-CD2 3.59Å; Y548-L622 HydrophobicContact CE2-CD2 3.94Å; Y548-L622 HydrophobicContact CG-CD2 3.79Å; V560-L622 HydrophobicContact CG1-CD2 4.25Å; V560-L622 HydrophobicContact CG1-CG 4.37Å; V605-L622 HydrophobicContact CG2-CD1 4.07Å; P619-L622 HydrophobicContact CB-CG 4.45Å; P619-L622 HydrophobicContact CG-CD1 4.2Å; P619-L622 PolarHBondContact O-N 3.48Å; L620-L622 VanDerWaalsContact C-N 3.35Å; L620-L622 PolarHBondContact O-N 3.33Å; L622-S626 WeakPolarHBondContact O-CB 3.48Å; L622-S626 PolarHBondContact O-N 3.34Å
623	L	91.5	Very high	90.9	Very high	10 Å²	10	36.1 Å²	36.1	5%	0.052	18%	0.182	C	C	.	.	H	α-helix	trans	-63.8	-44.2	174.9	-75.3	171.5	0	0	0	112.3	T603 H618 P619 L620 T627 H646 L648	T603-L623 HydrophobicContact CG2-CD2 4.18Å; H618-L623 HydrophobicContact CB-CD1 3.79Å; H618-L623 HydrophobicContact CB-CD2 4.03Å; H618-L623 HydrophobicContact CB-CG 3.96Å; H618-L623 WeakPolarHBondContact O-CD1 3.47Å; P619-L623 PolarHBondContact O-N 3.43Å; P619-L623 VanDerWaalsContact O-N 3.08Å; L620-L623 PolarHBondContact O-N 2.87Å; L623-T627 WeakPolarHBondContact O-CB 3.36Å; L623-T627 PolarHBondContact O-N 2.97Å; L623-T627 PolarHBondContact O-OG1 3.27Å; L623-H646 HydrophobicContact CD1-CB 3.92Å; L623-H646 HydrophobicContact CD2-CB 4.19Å; L623-L648 HydrophobicContact CB-CD1 4.43Å
624	L	89.6	Confident	91	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65.3	-47.4	177.4	-72.9	175.7	0	0	0	110.9	L620 S626 T627 C628 L652 Y694 Y697 F698	L620-L624 HydrophobicContact CD1-CD1 4.12Å; L620-L624 HydrophobicContact CD1-CD2 4.38Å; L620-L624 HydrophobicContact CD1-CG 3.9Å; L620-L624 HydrophobicContact CG-CD1 3.94Å; L620-L624 HydrophobicContact CG-CG 4.18Å; L620-L624 WeakPolarHBondContact O-CB 3.42Å; L620-L624 WeakPolarHBondContact O-CG 3.43Å; L620-L624 PolarHBondContact O-N 3.15Å; L624-S626 PolarHBondContact O-N 3.45Å; L624-T627 PolarHBondContact O-N 3.36Å; L624-T627 VanDerWaalsContact O-N 3.15Å; L624-C628 WeakPolarHBondContact O-CB 3.38Å; L624-C628 PolarHBondContact O-N 2.98Å; L624-C628 PolarHBondContact O-SG 2.86Å; L624-L652 HydrophobicContact CD2-CD2 3.75Å; L624-Y694 HydrophobicContact CD1-CD1 3.84Å; L624-Y694 HydrophobicContact CD1-CE1 4.29Å; L624-Y694 HydrophobicContact CD1-CG 4.36Å; L624-Y694 HydrophobicContact CD2-CD1 4.17Å; L624-Y694 HydrophobicContact CD2-CE1 4.04Å; L624-Y694 HydrophobicContact CD2-CE2 4.46Å; L624-Y694 HydrophobicContact CD2-CG 4.45Å; L624-Y697 HydrophobicContact CD1-CD1 4.48Å; L624-Y697 HydrophobicContact CD1-CD2 3.34Å; L624-Y697 HydrophobicContact CD1-CE2 3.83Å; L624-Y697 HydrophobicContact CD1-CG 3.7Å; L624-F698 HydrophobicContact CD1-CE2 4.4Å
625	R	88	Confident	91.1	Very high	61 Å²	61	32.8 Å²	32.8	23%	0.23	17%	0.166	C	C	.	.	H	α-helix	trans	-54	-52	175.5	179.9	62.5	173.2	136.3	7.5	111.5	E547 Y548 P621 T627 C628 D629	E547-R625 IonicContact OE1-CZ 2.76Å; E547-R625 IonicContact OE1-NE 2.78Å; E547-R625 IonicContact OE1-NH2 2.76Å; E547-R625 PolarHBondContact OE1-NH2 3.35Å; E547-R625 IonicContact OE2-CZ 2.74Å; E547-R625 IonicContact OE2-NE 3.85Å; E547-R625 PolarHBondContact OE2-NE 3.05Å; E547-R625 IonicContact OE2-NH2 2.74Å; Y548-R625 HydrophobicContact CE2-CB 4.48Å; Y548-R625 HydrophobicContact CE2-CG 4.17Å; Y548-R625 WeakPolarHBondContact OH-CB 3.46Å; P621-R625 WeakPolarHBondContact O-CB 3.14Å; P621-R625 PolarHBondContact O-N 2.89Å; R625-T627 VanDerWaalsContact C-N 3.32Å; R625-T627 PolarHBondContact O-N 3.42Å; R625-C628 PolarHBondContact O-N 2.97Å; R625-D629 IonicContact CZ-OD1 3.72Å; R625-D629 IonicContact CZ-OD2 2.8Å; R625-D629 IonicContact NE-OD1 2.99Å; R625-D629 IonicContact NE-OD2 3.77Å; R625-D629 IonicContact NH1-OD1 2.83Å; R625-D629 PolarHBondContact NH1-OD1 3.43Å; R625-D629 IonicContact NH2-OD1 3.75Å; R625-D629 VanDerWaalsContact O-CG 3.27Å; R625-D629 PolarHBondContact O-N 2.91Å
626	S	90.9	Very high	91.1	Very high	30 Å²	30	29.8 Å²	29.8	21%	0.21	15%	0.152	C	C	.	.	H	α-helix	trans	-60.9	-40	178.6	-169.5	0	0	0	0	112.3	L622 L624 K630	L622-S626 WeakPolarHBondContact O-CB 3.48Å; L622-S626 PolarHBondContact O-N 3.34Å; L624-S626 PolarHBondContact O-N 3.45Å; S626-K630 WeakPolarHBondContact O-CG 3.44Å; S626-K630 PolarHBondContact O-N 3.31Å
627	T	92.6	Very high	91.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-67.5	-45.6	177.9	-57.3	0	0	0	0	111.3	L623 L624 R625 D629 K630 L631 A639 M643 L648 L652	L623-T627 WeakPolarHBondContact O-CB 3.36Å; L623-T627 PolarHBondContact O-N 2.97Å; L623-T627 PolarHBondContact O-OG1 3.27Å; L624-T627 PolarHBondContact O-N 3.36Å; L624-T627 VanDerWaalsContact O-N 3.15Å; R625-T627 VanDerWaalsContact C-N 3.32Å; R625-T627 PolarHBondContact O-N 3.42Å; T627-D629 PolarHBondContact O-N 3.35Å; T627-K630 PolarHBondContact O-N 2.9Å; T627-K630 VanDerWaalsContact O-N 3.16Å; T627-L631 HydrophobicContact CG2-CD1 4.31Å; T627-L631 WeakPolarHBondContact O-CG 3.43Å; T627-L631 PolarHBondContact O-N 3.41Å; T627-A639 HydrophobicContact CG2-CB 4.36Å; T627-M643 HydrophobicContact CG2-CG 3.71Å; T627-M643 HydrophobicContact CG2-SD 3.91Å; T627-L648 WeakPolarHBondContact OG1-CD1 3.27Å; T627-L652 HydrophobicContact CG2-CD2 4.19Å
628	C	90.6	Very high	91.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.9	-44.1	175.7	-69.8	0	0	0	0	111.7	L624 R625 K630 L631 D632 Y656 V706	L624-C628 WeakPolarHBondContact O-CB 3.38Å; L624-C628 PolarHBondContact O-N 2.98Å; L624-C628 PolarHBondContact O-SG 2.86Å; R625-C628 PolarHBondContact O-N 2.97Å; C628-K630 PolarHBondContact O-N 3Å; C628-L631 CarbonylContact O-C 3.5Å; C628-L631 WeakPolarHBondContact O-CA 3.48Å; C628-L631 WeakPolarHBondContact O-CB 3.49Å; C628-L631 PolarHBondContact O-N 3.26Å; C628-D632 PolarHBondContact O-N 2.97Å; C628-Y656 HydrophobicContact CB-CE1 3.97Å; C628-Y656 HydrophobicContact CB-CE2 4.09Å; C628-Y656 WeakPolarHBondContact SG-CE2 3.47Å; C628-V706 HydrophobicContact CB-CG1 4.42Å
629	D	89.9	Confident	91.2	Very high	46 Å²	46	37.6 Å²	37.6	25%	0.246	18%	0.176	C	C	.	.	H	α-helix	trans	-59.9	-35.4	176.4	-68.8	-25.9	0	0	0	112	R625 T627 Q633	R625-D629 IonicContact CZ-OD1 3.72Å; R625-D629 IonicContact CZ-OD2 2.8Å; R625-D629 IonicContact NE-OD1 2.99Å; R625-D629 IonicContact NE-OD2 3.77Å; R625-D629 IonicContact NH1-OD1 2.83Å; R625-D629 PolarHBondContact NH1-OD1 3.43Å; R625-D629 IonicContact NH2-OD1 3.75Å; R625-D629 VanDerWaalsContact O-CG 3.27Å; R625-D629 PolarHBondContact O-N 2.91Å; T627-D629 PolarHBondContact O-N 3.35Å; D629-Q633 WeakPolarHBondContact O-CB 3.45Å; D629-Q633 VanDerWaalsContact O-CD 3.29Å; D629-Q633 WeakPolarHBondContact O-CG 3.48Å; D629-Q633 PolarHBondContact O-N 2.88Å
630	K	92.8	Very high	91.3	Very high	53 Å²	53	37.5 Å²	37.5	23%	0.23	18%	0.176	C	C	.	.	H	α-helix	trans	-71.7	-36.1	173.8	-61.1	-56.8	163.8	-154.9	0	112.6	S626 T627 C628 C634 D635 K638 A639 L642	S626-K630 WeakPolarHBondContact O-CG 3.44Å; S626-K630 PolarHBondContact O-N 3.31Å; T627-K630 PolarHBondContact O-N 2.9Å; T627-K630 VanDerWaalsContact O-N 3.16Å; C628-K630 PolarHBondContact O-N 3Å; K630-C634 PolarHBondContact O-N 3.01Å; K630-D635 PolarHBondContact O-N 3.21Å; K630-K638 HydrophobicContact CD-CB 4.33Å; K630-K638 HydrophobicContact CD-CD 4.49Å; K630-K638 HydrophobicContact CG-CB 4.34Å; K630-A639 HydrophobicContact CB-CB 4.06Å; K630-L642 HydrophobicContact CG-CD1 4.35Å
631	L	92.3	Very high	91.5	Very high	9 Å²	9	39.3 Å²	39.3	5%	0.047	19%	0.185	C	C	.	.	H	α-helix	trans	-67.7	-41.7	174.5	-67.5	174.1	0	0	0	111.6	T627 C628 Q633 C634 F636 A639 V653 Y656	T627-L631 HydrophobicContact CG2-CD1 4.31Å; T627-L631 WeakPolarHBondContact O-CG 3.43Å; T627-L631 PolarHBondContact O-N 3.41Å; C628-L631 CarbonylContact O-C 3.5Å; C628-L631 WeakPolarHBondContact O-CA 3.48Å; C628-L631 WeakPolarHBondContact O-CB 3.49Å; C628-L631 PolarHBondContact O-N 3.26Å; L631-Q633 VanDerWaalsContact C-N 3.34Å; L631-Q633 PolarHBondContact O-N 3.08Å; L631-C634 WeakPolarHBondContact O-CA 3.46Å; L631-C634 PolarHBondContact O-N 3.26Å; L631-F636 HydrophobicContact CD2-CD1 3.92Å; L631-F636 HydrophobicContact CD2-CE1 4.25Å; L631-A639 HydrophobicContact CD2-CB 3.68Å; L631-A639 HydrophobicContact CG-CB 4.04Å; L631-V653 HydrophobicContact CD2-CG1 4.22Å; L631-V653 HydrophobicContact CD2-CG2 4.4Å; L631-Y656 HydrophobicContact CB-CD1 4.15Å; L631-Y656 HydrophobicContact CB-CE1 4.5Å; L631-Y656 HydrophobicContact CD1-CD1 4.04Å; L631-Y656 HydrophobicContact CD1-CG 4.38Å
632	D	90.1	Very high	91.7	Very high	75 Å²	75	40.8 Å²	40.8	40%	0.401	19%	0.193	S	C	.	.	H	α-helix	trans	-63.6	-39.4	175.2	-74.2	-25.6	0	0	0	111.7	C628 C634 Y656	C628-D632 PolarHBondContact O-N 2.97Å; D632-C634 PolarHBondContact O-N 2.96Å; D632-Y656 WeakPolarHBondContact OD1-CE1 3.4Å; D632-Y656 PolarHBondContact OD2-OH 3.31Å
633	Q	91.9	Very high	91.9	Very high	124 Å²	124	40.6 Å²	40.6	58%	0.579	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-2.3	172.3	-70	165.6	20	0	0	113.4	D629 L631 D635	D629-Q633 WeakPolarHBondContact O-CB 3.45Å; D629-Q633 VanDerWaalsContact O-CD 3.29Å; D629-Q633 WeakPolarHBondContact O-CG 3.48Å; D629-Q633 PolarHBondContact O-N 2.88Å; L631-Q633 VanDerWaalsContact C-N 3.34Å; L631-Q633 PolarHBondContact O-N 3.08Å; Q633-D635 PolarHBondContact O-N 3.26Å
634	C	91.9	Very high	91.9	Very high	20 Å²	20	45.3 Å²	45.3	14%	0.135	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	55	30	-173.9	-59.4	0	0	0	0	113.5	K630 L631 D632 F636 Q667 Q671	K630-C634 PolarHBondContact O-N 3.01Å; L631-C634 WeakPolarHBondContact O-CA 3.46Å; L631-C634 PolarHBondContact O-N 3.26Å; D632-C634 PolarHBondContact O-N 2.96Å; C634-F636 HydrophobicContact CB-CE2 4.09Å; C634-F636 HydrophobicContact CB-CZ 4.39Å; C634-F636 PolarHBondContact O-N 3.41Å; C634-Q667 PolarHBondContact O-NE2 2.97Å; C634-Q671 PolarHBondContact O-NE2 3.48Å; C634-Q671 VanDerWaalsContact O-NE2 3.16Å; C634-Q671 PolarHBondContact O-OE1 3.06Å
635	D	93.7	Very high	92.1	Very high	32 Å²	32	52.7 Å²	52.7	17%	0.171	24%	0.241	C	C	.	.			trans	-94.7	68.1	172.3	-167.7	-15	0	0	0	109.7	K630 Q633 R637 K638 A639	K630-D635 PolarHBondContact O-N 3.21Å; Q633-D635 PolarHBondContact O-N 3.26Å; D635-R637 PolarHBondContact O-N 3.24Å; D635-K638 PolarHBondContact O-N 3.11Å; D635-K638 WeakPolarHBondContact OD1-CG 3.37Å; D635-K638 PolarHBondContact OD1-N 3Å; D635-K638 WeakPolarHBondContact OD2-CD 3.37Å; D635-K638 WeakPolarHBondContact OD2-CE 3.43Å; D635-K638 WeakPolarHBondContact OD2-CG 3.29Å; D635-K638 IonicContact OD2-NZ 3.09Å; D635-K638 PolarHBondContact OD2-NZ 2.85Å; D635-A639 PolarHBondContact O-N 3.41Å; D635-A639 VanDerWaalsContact O-N 3.14Å
636	F	93.8	Very high	92.2	Very high	5 Å²	5	51.8 Å²	51.8	2%	0.022	24%	0.239	C	C	.	.	H	α-helix	trans	-60.5	-32.8	-176.2	-60.8	-71.3	0	0	0	112.6	L631 C634 A639 M640 V653 N664 Q667 F668	L631-F636 HydrophobicContact CD2-CD1 3.92Å; L631-F636 HydrophobicContact CD2-CE1 4.25Å; C634-F636 HydrophobicContact CB-CE2 4.09Å; C634-F636 HydrophobicContact CB-CZ 4.39Å; C634-F636 PolarHBondContact O-N 3.41Å; F636-A639 PolarHBondContact O-N 3.47Å; F636-M640 WeakPolarHBondContact O-CB 3.47Å; F636-M640 VanDerWaalsContact O-CG 3.27Å; F636-M640 WeakPolarHBondContact O-CG 3.39Å; F636-M640 PolarHBondContact O-N 3.32Å; F636-V653 HydrophobicContact CD1-CG1 4.17Å; F636-V653 HydrophobicContact CE1-CG1 4.5Å; F636-N664 HydrophobicContact CE2-CB 4.1Å; F636-N664 HydrophobicContact CZ-CB 4.01Å; F636-Q667 HydrophobicContact CD2-CG 4.25Å; F636-Q667 HydrophobicContact CE2-CB 4.35Å; F636-Q667 HydrophobicContact CE2-CG 4.19Å; F636-F668 HydrophobicContact CB-CD2 3.75Å; F636-F668 HydrophobicContact CD1-CB 4.41Å; F636-F668 AromaticContact CD1-CD2 3.85Å; F636-F668 HydrophobicContact CD1-CD2 3.85Å; F636-F668 HydrophobicContact CD2-CB 3.83Å; F636-F668 HydrophobicContact CD2-CD2 4.39Å; F636-F668 HydrophobicContact CE2-CB 4Å; F636-F668 HydrophobicContact CG-CB 4.05Å; F636-F668 AromaticContact CG-CD2 3.74Å; F636-F668 HydrophobicContact CG-CD2 3.74Å; F636-F668 HydrophobicContact CG-CG 4.41Å; F636-F668 HydrophobicContact CZ-CB 4.37Å
637	R	93.8	Very high	92.3	Very high	159 Å²	159	55.7 Å²	55.7	60%	0.6	27%	0.266	S	S	*	.	H	α-helix	trans	-62.2	-47.5	178.6	-176.6	173.3	179.6	170	-0.5	111.4	D635 L641 Q671	D635-R637 PolarHBondContact O-N 3.24Å; R637-L641 HydrophobicContact CG-CD1 4.26Å; R637-L641 VanDerWaalsContact O-CG 3.3Å; R637-L641 WeakPolarHBondContact O-CG 3.37Å; R637-L641 PolarHBondContact O-N 3.05Å; R637-L641 VanDerWaalsContact O-N 3.09Å; R637-Q671 HydrophobicContact CB-CB 4.19Å; R637-Q671 WeakPolarHBondContact CD-O 3.18Å
638	K	93	Very high	92.2	Very high	112 Å²	112	56.2 Å²	56.2	49%	0.487	27%	0.269	S	S	.	.	H	α-helix	trans	-67.8	-38.3	177.6	-69.9	-171.2	-165.2	128.3	0	111.7	K630 D635 L641 L642	K630-K638 HydrophobicContact CD-CB 4.33Å; K630-K638 HydrophobicContact CD-CD 4.49Å; K630-K638 HydrophobicContact CG-CB 4.34Å; D635-K638 PolarHBondContact O-N 3.11Å; D635-K638 WeakPolarHBondContact OD1-CG 3.37Å; D635-K638 PolarHBondContact OD1-N 3Å; D635-K638 WeakPolarHBondContact OD2-CD 3.37Å; D635-K638 WeakPolarHBondContact OD2-CE 3.43Å; D635-K638 WeakPolarHBondContact OD2-CG 3.29Å; D635-K638 IonicContact OD2-NZ 3.09Å; D635-K638 PolarHBondContact OD2-NZ 2.85Å; K638-L641 PolarHBondContact O-N 3.26Å; K638-L642 WeakPolarHBondContact O-CG 3.45Å; K638-L642 PolarHBondContact O-N 3.42Å
639	A	93.6	Very high	92.2	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-58.7	-51.7	174.4	0	0	0	0	0	111.3	T627 K630 L631 D635 F636 L641 L642 M643	T627-A639 HydrophobicContact CG2-CB 4.36Å; K630-A639 HydrophobicContact CB-CB 4.06Å; L631-A639 HydrophobicContact CD2-CB 3.68Å; L631-A639 HydrophobicContact CG-CB 4.04Å; D635-A639 PolarHBondContact O-N 3.41Å; D635-A639 VanDerWaalsContact O-N 3.14Å; F636-A639 PolarHBondContact O-N 3.47Å; A639-L641 VanDerWaalsContact C-N 3.31Å; A639-L641 PolarHBondContact O-N 3.08Å; A639-L642 PolarHBondContact O-N 2.94Å; A639-L642 VanDerWaalsContact O-N 3.15Å; A639-M643 WeakPolarHBondContact O-CB 3.35Å; A639-M643 WeakPolarHBondContact O-CG 3.44Å; A639-M643 PolarHBondContact O-N 2.96Å
640	M	92.5	Very high	92.3	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-60.3	-37.8	178.7	-72.4	-63.8	-73.7	0	0	113.1	F636 R644 M650 V653 F668 Y676 F680	F636-M640 WeakPolarHBondContact O-CB 3.47Å; F636-M640 VanDerWaalsContact O-CG 3.27Å; F636-M640 WeakPolarHBondContact O-CG 3.39Å; F636-M640 PolarHBondContact O-N 3.32Å; M640-R644 WeakPolarHBondContact O-CB 3.49Å; M640-R644 PolarHBondContact O-N 3.38Å; M640-M650 HydrophobicContact CE-CE 4.27Å; M640-M650 HydrophobicContact CE-SD 3.48Å; M640-M650 WeakPolarHBondContact CE-SD 3.24Å; M640-M650 HydrophobicContact SD-SD 3.64Å; M640-M650 VanDerWaalsContact SD-SD 3.64Å; M640-V653 HydrophobicContact SD-CG2 3.64Å; M640-F668 HydrophobicContact CG-CE2 4.43Å; M640-F668 HydrophobicContact SD-CE2 4.44Å; M640-Y676 HydrophobicContact CB-CD1 4.2Å; M640-Y676 HydrophobicContact CE-CD1 4.44Å; M640-Y676 WeakPolarHBondContact CE-O 3.35Å; M640-F680 HydrophobicContact CE-CB 4.16Å
641	L	92.6	Very high	92.3	Very high	76 Å²	76	54.2 Å²	54.2	40%	0.398	26%	0.261	S	S	.	.	H	α-helix	trans	-64.7	-44.4	175.5	-76.2	168.8	0	0	0	111.9	R637 K638 A639 K645 Y676	R637-L641 HydrophobicContact CG-CD1 4.26Å; R637-L641 VanDerWaalsContact O-CG 3.3Å; R637-L641 WeakPolarHBondContact O-CG 3.37Å; R637-L641 PolarHBondContact O-N 3.05Å; R637-L641 VanDerWaalsContact O-N 3.09Å; K638-L641 PolarHBondContact O-N 3.26Å; A639-L641 VanDerWaalsContact C-N 3.31Å; A639-L641 PolarHBondContact O-N 3.08Å; L641-K645 VanDerWaalsContact O-CB 3.26Å; L641-K645 WeakPolarHBondContact O-CB 3.36Å; L641-K645 PolarHBondContact O-N 3.24Å; L641-Y676 HydrophobicContact CD2-CE1 4.21Å; L641-Y676 WeakPolarHBondContact CD2-OH 3.29Å
642	L	91.7	Very high	92.2	Very high	39 Å²	39	53.8 Å²	53.8	20%	0.204	26%	0.258	C	S	.	.	H	α-helix	trans	-62.9	-46.4	175.9	-74.1	173.1	0	0	0	111.2	K630 K638 A639 R644 K645 H646	K630-L642 HydrophobicContact CG-CD1 4.35Å; K638-L642 WeakPolarHBondContact O-CG 3.45Å; K638-L642 PolarHBondContact O-N 3.42Å; A639-L642 PolarHBondContact O-N 2.94Å; A639-L642 VanDerWaalsContact O-N 3.15Å; L642-R644 PolarHBondContact O-N 3.43Å; L642-K645 PolarHBondContact O-N 2.88Å; L642-H646 PolarHBondContact O-CD2 3.23Å; L642-H646 PolarHBondContact O-N 3.38Å
643	M	92.9	Very high	92.3	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.7	-44.7	179.5	-66	171.2	75.3	0	0	111.5	T627 A639 S647 L648 D649 M650 L652 V653	T627-M643 HydrophobicContact CG2-CG 3.71Å; T627-M643 HydrophobicContact CG2-SD 3.91Å; A639-M643 WeakPolarHBondContact O-CB 3.35Å; A639-M643 WeakPolarHBondContact O-CG 3.44Å; A639-M643 PolarHBondContact O-N 2.96Å; M643-S647 CarbonylContact O-C 3.57Å; M643-S647 VanDerWaalsContact O-CA 3.29Å; M643-S647 WeakPolarHBondContact O-CA 3.26Å; M643-S647 PolarHBondContact O-N 3.46Å; M643-L648 HydrophobicContact CB-CB 4.02Å; M643-L648 HydrophobicContact CG-CB 4.02Å; M643-L648 HydrophobicContact CG-CD1 4.12Å; M643-L648 PolarHBondContact O-N 3.12Å; M643-D649 WeakPolarHBondContact CE-O 3.24Å; M643-M650 HydrophobicContact CB-CE 3.99Å; M643-M650 HydrophobicContact CB-SD 3.93Å; M643-M650 HydrophobicContact CE-SD 4.16Å; M643-L652 HydrophobicContact CE-CB 3.74Å; M643-L652 HydrophobicContact CE-CD2 4.47Å; M643-V653 HydrophobicContact CE-CG2 3.94Å; M643-V653 HydrophobicContact SD-CG2 3.63Å
644	R	92.3	Very high	92.3	Very high	109 Å²	109	45.6 Å²	45.6	41%	0.411	22%	0.217	S	C	.	.	H	α-helix	trans	-64.7	-45.1	175.5	-174	179.2	179.1	172.6	5.2	112.3	M640 L642 H646 S647 M650 E675 Y676	M640-R644 WeakPolarHBondContact O-CB 3.49Å; M640-R644 PolarHBondContact O-N 3.38Å; L642-R644 PolarHBondContact O-N 3.43Å; R644-H646 VanDerWaalsContact C-N 3.33Å; R644-H646 PolarHBondContact O-N 3.03Å; R644-S647 PolarHBondContact O-N 2.95Å; R644-M650 HydrophobicContact CB-CE 3.82Å; R644-E675 IonicContact CZ-OE1 2.9Å; R644-E675 IonicContact NH1-OE1 3.95Å; R644-E675 PolarHBondContact NH1-OE1 2.98Å; R644-E675 IonicContact NH1-OE2 3.8Å; R644-E675 IonicContact NH2-OE1 3.67Å; R644-E675 PolarHBondContact NH2-OE1 3.43Å; R644-Y676 PolarHBondContact NH1-OH 3.29Å
645	K	92.6	Very high	92.1	Very high	155 Å²	155	44.9 Å²	44.9	67%	0.674	21%	0.212	S	C	*	.	H	α-helix	trans	-62.2	-40.3	-178.1	-177.9	-178.9	176.9	-172.2	0	112	L641 L642	L641-K645 VanDerWaalsContact O-CB 3.26Å; L641-K645 WeakPolarHBondContact O-CB 3.36Å; L641-K645 PolarHBondContact O-N 3.24Å; L642-K645 PolarHBondContact O-N 2.88Å
646	H	91.9	Very high	91.8	Very high	43 Å²	43	43.6 Å²	43.6	20%	0.199	21%	0.205	C	C	.	.	H	α-helix	trans	-103.6	9.6	-176.2	-63.6	-74.7	0	0	0	113.7	H618 L623 L642 R644 L648	H618-H646 AromaticContact CD2-CE1 3.56Å; H618-H646 AromaticContact CG-CE1 3.57Å; H618-H646 AromaticContact ND1-CE1 3.89Å; H618-H646 AromaticContact NE2-CE1 3.84Å; L623-H646 HydrophobicContact CD1-CB 3.92Å; L623-H646 HydrophobicContact CD2-CB 4.19Å; L642-H646 PolarHBondContact O-CD2 3.23Å; L642-H646 PolarHBondContact O-N 3.38Å; R644-H646 VanDerWaalsContact C-N 3.33Å; R644-H646 PolarHBondContact O-N 3.03Å; H646-L648 VanDerWaalsContact C-N 3.28Å; H646-L648 HydrophobicContact CB-CG 4.44Å; H646-L648 PolarHBondContact O-N 2.73Å
647	S	91.4	Very high	91.5	Very high	111 Å²	111	45.3 Å²	45.3	78%	0.776	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.7	41.7	-179.4	-54.6	0	0	0	0	113.7	M643 R644	M643-S647 CarbonylContact O-C 3.57Å; M643-S647 VanDerWaalsContact O-CA 3.29Å; M643-S647 WeakPolarHBondContact O-CA 3.26Å; M643-S647 PolarHBondContact O-N 3.46Å; R644-S647 PolarHBondContact O-N 2.95Å
648	L	91.6	Very high	91.2	Very high	11 Å²	11	38.7 Å²	38.7	6%	0.058	19%	0.192	C	C	.	.			trans	-75.7	151.8	168.8	-55.3	177.5	0	0	0	109.9	L620 L623 T627 M643 H646 M650	L620-L648 HydrophobicContact CD1-CD2 3.54Å; L623-L648 HydrophobicContact CB-CD1 4.43Å; T627-L648 WeakPolarHBondContact OG1-CD1 3.27Å; M643-L648 HydrophobicContact CB-CB 4.02Å; M643-L648 HydrophobicContact CG-CB 4.02Å; M643-L648 HydrophobicContact CG-CD1 4.12Å; M643-L648 PolarHBondContact O-N 3.12Å; H646-L648 VanDerWaalsContact C-N 3.28Å; H646-L648 HydrophobicContact CB-CG 4.44Å; H646-L648 PolarHBondContact O-N 2.73Å; L648-M650 PolarHBondContact O-N 2.75Å
649	D	90.9	Very high	91	Very high	50 Å²	50	37.2 Å²	37.2	27%	0.267	19%	0.189	S	C	.	.			trans	-71.2	121.5	-176.8	-165.3	-54.6	0	0	0	111.6	M643 N651 L652 V689 L693 Y694	M643-D649 WeakPolarHBondContact CE-O 3.24Å; D649-N651 PolarHBondContact O-N 2.98Å; D649-N651 VanDerWaalsContact O-N 3.11Å; D649-N651 WeakPolarHBondContact OD1-CB 3.41Å; D649-N651 PolarHBondContact OD1-N 3.11Å; D649-N651 PolarHBondContact OD1-ND2 2.85Å; D649-L652 VanDerWaalsContact O-CB 3.28Å; D649-L652 WeakPolarHBondContact O-CB 3.46Å; D649-L652 PolarHBondContact O-N 3.45Å; D649-V689 HydrophobicContact CB-CG1 4.42Å; D649-L693 HydrophobicContact CB-CD2 4.14Å; D649-Y694 HydrophobicContact CB-CE2 4.22Å; D649-Y694 PolarHBondContact N-OH 3.44Å
650	M	91.9	Very high	90.7	Very high	5 Å²	5	38.5 Å²	38.5	3%	0.025	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-20.7	-177.8	-66.5	-62.6	175.5	0	0	113.8	M640 M643 R644 L648 L652 V653 L679 F680	M640-M650 HydrophobicContact CE-CE 4.27Å; M640-M650 HydrophobicContact CE-SD 3.48Å; M640-M650 WeakPolarHBondContact CE-SD 3.24Å; M640-M650 HydrophobicContact SD-SD 3.64Å; M640-M650 VanDerWaalsContact SD-SD 3.64Å; M643-M650 HydrophobicContact CB-CE 3.99Å; M643-M650 HydrophobicContact CB-SD 3.93Å; M643-M650 HydrophobicContact CE-SD 4.16Å; R644-M650 HydrophobicContact CB-CE 3.82Å; L648-M650 PolarHBondContact O-N 2.75Å; M650-L652 PolarHBondContact O-N 3.04Å; M650-V653 PolarHBondContact O-N 3.15Å; M650-L679 HydrophobicContact CE-CD2 3.89Å; M650-F680 HydrophobicContact CB-CD2 4.34Å; M650-F680 WeakPolarHBondContact O-CE2 3.43Å
651	N	91.7	Very high	90.6	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.011	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-25.6	174.8	-72.5	-91.4	0	0	0	112.3	D649 V653 Y654 D655 Q683 L684 C685 V689 K717	D649-N651 PolarHBondContact O-N 2.98Å; D649-N651 VanDerWaalsContact O-N 3.11Å; D649-N651 WeakPolarHBondContact OD1-CB 3.41Å; D649-N651 PolarHBondContact OD1-N 3.11Å; D649-N651 PolarHBondContact OD1-ND2 2.85Å; N651-V653 PolarHBondContact O-N 2.89Å; N651-V653 VanDerWaalsContact O-N 3.15Å; N651-Y654 PolarHBondContact O-N 2.9Å; N651-Y654 VanDerWaalsContact O-N 3.08Å; N651-D655 WeakPolarHBondContact CB-OD2 3.49Å; N651-D655 WeakPolarHBondContact O-CB 3.42Å; N651-D655 PolarHBondContact O-N 3.47Å; N651-Q683 PolarHBondContact ND2-O 3.3Å; N651-Q683 VanDerWaalsContact ND2-O 3.1Å; N651-L684 WeakPolarHBondContact OD1-CA 3.13Å; N651-L684 WeakPolarHBondContact OD1-CD1 3.38Å; N651-C685 PolarHBondContact OD1-N 3.47Å; N651-V689 HydrophobicContact CB-CB 4.42Å; N651-V689 HydrophobicContact CB-CG1 3.67Å; N651-V689 HydrophobicContact CB-CG2 3.88Å; N651-K717 PolarHBondContact OD1-NZ 2.77Å
652	L	91	Very high	90.5	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-57	-30.2	179.4	-173.8	67.2	0	0	0	112.9	L624 T627 M643 D649 M650 Y654 D655 Y656 V689 V690 Y694 F698	L624-L652 HydrophobicContact CD2-CD2 3.75Å; T627-L652 HydrophobicContact CG2-CD2 4.19Å; M643-L652 HydrophobicContact CE-CB 3.74Å; M643-L652 HydrophobicContact CE-CD2 4.47Å; D649-L652 VanDerWaalsContact O-CB 3.28Å; D649-L652 WeakPolarHBondContact O-CB 3.46Å; D649-L652 PolarHBondContact O-N 3.45Å; M650-L652 PolarHBondContact O-N 3.04Å; L652-Y654 PolarHBondContact O-N 3.26Å; L652-D655 PolarHBondContact O-N 3.27Å; L652-Y656 WeakPolarHBondContact O-CB 3.49Å; L652-Y656 PolarHBondContact O-N 3.44Å; L652-V689 HydrophobicContact CB-CG2 4.33Å; L652-V690 HydrophobicContact CD1-CG2 3.92Å; L652-Y694 HydrophobicContact CB-CE2 4.45Å; L652-Y694 HydrophobicContact CD1-CD2 4.07Å; L652-Y694 HydrophobicContact CD1-CE2 4.3Å; L652-Y694 HydrophobicContact CD2-CE2 4.47Å; L652-F698 HydrophobicContact CD1-CE2 4.01Å; L652-F698 HydrophobicContact CD1-CZ 4.2Å
653	V	92	Very high	90.4	Very high	6 Å²	6	46 Å²	46	4%	0.036	23%	0.227	C	C	.	.	H	α-helix	trans	-58.6	-37.3	178.3	179.6	0	0	0	0	112.1	L631 F636 M640 M643 M650 N651 F661 F668 F680	L631-V653 HydrophobicContact CD2-CG1 4.22Å; L631-V653 HydrophobicContact CD2-CG2 4.4Å; F636-V653 HydrophobicContact CD1-CG1 4.17Å; F636-V653 HydrophobicContact CE1-CG1 4.5Å; M640-V653 HydrophobicContact SD-CG2 3.64Å; M643-V653 HydrophobicContact CE-CG2 3.94Å; M643-V653 HydrophobicContact SD-CG2 3.63Å; M650-V653 PolarHBondContact O-N 3.15Å; N651-V653 PolarHBondContact O-N 2.89Å; N651-V653 VanDerWaalsContact O-N 3.15Å; V653-F661 HydrophobicContact CG1-CD2 3.9Å; V653-F661 HydrophobicContact CG1-CE2 3.81Å; V653-F668 HydrophobicContact CG1-CD2 4.06Å; V653-F668 HydrophobicContact CG1-CE2 3.72Å; V653-F668 HydrophobicContact CG1-CZ 4.32Å; V653-F680 HydrophobicContact CB-CE2 4.1Å
654	Y	91.2	Very high	90.4	Very high	22 Å²	22	48 Å²	48	9%	0.086	24%	0.239	C	C	.	.	H	α-helix	trans	-91.1	-47.8	175.7	179.1	-90.5	0	0	0	111.3	N651 L652 Y656 N657 P658 F661 Q662 K717 I722	N651-Y654 PolarHBondContact O-N 2.9Å; N651-Y654 VanDerWaalsContact O-N 3.08Å; L652-Y654 PolarHBondContact O-N 3.26Å; Y654-Y656 VanDerWaalsContact C-N 3.3Å; Y654-Y656 PolarHBondContact O-N 2.99Å; Y654-N657 CarbonylContact O-C 3.47Å; Y654-N657 PolarHBondContact O-N 3.25Å; Y654-P658 HydrophobicContact CD1-CG 4.49Å; Y654-P658 HydrophobicContact CE1-CB 3.99Å; Y654-P658 HydrophobicContact CE1-CG 4.12Å; Y654-P658 HydrophobicContact CE2-CB 4.31Å; Y654-P658 WeakPolarHBondContact O-CA 3.42Å; Y654-P658 WeakPolarHBondContact O-CD 3.33Å; Y654-P658 WeakPolarHBondContact O-CG 3.43Å; Y654-P658 VanDerWaalsContact O-N 3.14Å; Y654-F661 HydrophobicContact CD2-CB 4.27Å; Y654-F661 AromaticContact CD2-CD1 3.41Å; Y654-F661 HydrophobicContact CD2-CD1 3.41Å; Y654-F661 VanDerWaalsContact CD2-CD1 3.41Å; Y654-F661 AromaticContact CD2-CE1 3.83Å; Y654-F661 HydrophobicContact CD2-CE1 3.83Å; Y654-F661 AromaticContact CD2-CG 3.89Å; Y654-F661 HydrophobicContact CD2-CG 3.89Å; Y654-F661 AromaticContact CE2-CD1 3.97Å; Y654-F661 HydrophobicContact CE2-CD1 3.97Å; Y654-F661 HydrophobicContact CE2-CE1 4.49Å; Y654-Q662 PolarHBondContact OH-NE2 3.37Å; Y654-K717 HydrophobicContact CD1-CD 3.74Å; Y654-K717 HydrophobicContact CE1-CB 4.17Å; Y654-K717 HydrophobicContact CE1-CD 3.89Å; Y654-I722 HydrophobicContact CD1-CD1 3.81Å; Y654-I722 HydrophobicContact CD2-CD1 3.8Å; Y654-I722 HydrophobicContact CD2-CG1 4.16Å; Y654-I722 HydrophobicContact CD2-CG2 4.39Å; Y654-I722 HydrophobicContact CE1-CD1 3.6Å; Y654-I722 HydrophobicContact CE1-CG1 4.42Å; Y654-I722 HydrophobicContact CE2-CD1 3.6Å; Y654-I722 HydrophobicContact CE2-CG1 3.65Å; Y654-I722 HydrophobicContact CG-CD1 3.92Å; Y654-I722 VanDerWaalsContact CZ-CD1 3.49Å
655	D	89.1	Confident	90.5	Very high	4 Å²	4	42.9 Å²	42.9	2%	0.021	22%	0.219	C	C	.	.	H	α-helix	trans	-67.8	-28.5	-169.4	-71.8	-10.5	0	0	0	113.3	N651 L652 N688 V689 V690 K717	N651-D655 WeakPolarHBondContact CB-OD2 3.49Å; N651-D655 WeakPolarHBondContact O-CB 3.42Å; N651-D655 PolarHBondContact O-N 3.47Å; L652-D655 PolarHBondContact O-N 3.27Å; D655-N688 WeakPolarHBondContact CB-OD1 3.4Å; D655-N688 WeakPolarHBondContact OD2-CA 3.4Å; D655-V689 HydrophobicContact CB-CG2 4.08Å; D655-V689 WeakPolarHBondContact OD2-CG2 3.39Å; D655-V689 PolarHBondContact OD2-N 3.06Å; D655-V690 HydrophobicContact CB-CG2 3.82Å; D655-V690 WeakPolarHBondContact O-CG2 3.33Å; D655-K717 WeakPolarHBondContact OD1-CD 3.22Å; D655-K717 WeakPolarHBondContact OD1-CE 3.4Å; D655-K717 IonicContact OD1-NZ 2.88Å; D655-K717 PolarHBondContact OD1-NZ 3.46Å; D655-K717 IonicContact OD2-NZ 2.66Å; D655-K717 PolarHBondContact OD2-NZ 3.25Å
656	Y	87.2	Confident	90.5	Very high	5 Å²	5	41 Å²	41	2%	0.02	21%	0.208	C	C	.	.	S	Bend	trans	-63	-46.4	178.2	178.5	-117.8	0	0	0	112.1	C628 L631 D632 L652 Y654 F698 S708 L710	C628-Y656 HydrophobicContact CB-CE1 3.97Å; C628-Y656 HydrophobicContact CB-CE2 4.09Å; C628-Y656 WeakPolarHBondContact SG-CE2 3.47Å; L631-Y656 HydrophobicContact CB-CD1 4.15Å; L631-Y656 HydrophobicContact CB-CE1 4.5Å; L631-Y656 HydrophobicContact CD1-CD1 4.04Å; L631-Y656 HydrophobicContact CD1-CG 4.38Å; D632-Y656 WeakPolarHBondContact OD1-CE1 3.4Å; D632-Y656 PolarHBondContact OD2-OH 3.31Å; L652-Y656 WeakPolarHBondContact O-CB 3.49Å; L652-Y656 PolarHBondContact O-N 3.44Å; Y654-Y656 VanDerWaalsContact C-N 3.3Å; Y654-Y656 PolarHBondContact O-N 2.99Å; Y656-F698 HydrophobicContact CD2-CD1 4.22Å; Y656-F698 AromaticContact CD2-CE1 3.65Å; Y656-F698 HydrophobicContact CD2-CE1 3.65Å; Y656-F698 HydrophobicContact CD2-CZ 4.07Å; Y656-F698 HydrophobicContact CE2-CD1 4.07Å; Y656-F698 AromaticContact CE2-CE1 3.51Å; Y656-F698 HydrophobicContact CE2-CE1 3.51Å; Y656-F698 HydrophobicContact CE2-CZ 4.29Å; Y656-S708 PolarHBondContact OH-OG 3.24Å; Y656-S708 VanDerWaalsContact OH-OG 3.06Å; Y656-L710 HydrophobicContact CD2-CD1 3.97Å; Y656-L710 HydrophobicContact CE2-CD1 3.82Å; Y656-L710 WeakPolarHBondContact O-CD1 3.46Å; Y656-L710 WeakPolarHBondContact O-CD2 3.21Å
657	N	87.1	Confident	90.5	Very high	42 Å²	42	42.5 Å²	42.5	23%	0.225	22%	0.215	C	C	.	.			trans	-150.3	84.2	177.7	-169.7	-23.9	0	0	0	110.2	Y654 D659 S660 F661 L710	Y654-N657 CarbonylContact O-C 3.47Å; Y654-N657 PolarHBondContact O-N 3.25Å; N657-D659 PolarHBondContact O-N 3.48Å; N657-S660 PolarHBondContact O-N 2.94Å; N657-S660 WeakPolarHBondContact OD1-CB 3.21Å; N657-S660 PolarHBondContact OD1-N 3.43Å; N657-F661 PolarHBondContact O-N 2.86Å; N657-L710 HydrophobicContact CB-CD2 3.9Å
658	P	87.8	Confident	90.6	Very high	19 Å²	19	37.2 Å²	37.2	12%	0.123	18%	0.178	C	C	.	.	H	α-helix	trans	-55.9	-37.9	-176.6	-28.8	36	0	0	0	113.3	Y654 F661 Q662	Y654-P658 HydrophobicContact CD1-CG 4.49Å; Y654-P658 HydrophobicContact CE1-CB 3.99Å; Y654-P658 HydrophobicContact CE1-CG 4.12Å; Y654-P658 HydrophobicContact CE2-CB 4.31Å; Y654-P658 WeakPolarHBondContact O-CA 3.42Å; Y654-P658 WeakPolarHBondContact O-CD 3.33Å; Y654-P658 WeakPolarHBondContact O-CG 3.43Å; Y654-P658 VanDerWaalsContact O-N 3.14Å; P658-F661 PolarHBondContact O-N 2.9Å; P658-Q662 WeakPolarHBondContact O-CB 3.42Å; P658-Q662 VanDerWaalsContact O-CG 3.26Å; P658-Q662 WeakPolarHBondContact O-CG 3.36Å; P658-Q662 PolarHBondContact O-N 2.91Å
659	D	87.3	Confident	90.6	Very high	81 Å²	81	36.7 Å²	36.7	43%	0.433	18%	0.175	S	C	.	.	H	α-helix	trans	-69	-43	-179	-64.9	-31.8	0	0	0	112	N657 K663	N657-D659 PolarHBondContact O-N 3.48Å; D659-K663 WeakPolarHBondContact O-CG 3.46Å; D659-K663 PolarHBondContact O-N 3.35Å; D659-K663 VanDerWaalsContact O-N 3.15Å
660	S	88.8	Confident	90.6	Very high	28 Å²	28	40.7 Å²	40.7	20%	0.196	19%	0.186	C	C	.	.	H	α-helix	trans	-65.9	-41.1	175.4	-174.6	0	0	0	0	111.1	N657 K663 N664	N657-S660 PolarHBondContact O-N 2.94Å; N657-S660 WeakPolarHBondContact OD1-CB 3.21Å; N657-S660 PolarHBondContact OD1-N 3.43Å; S660-K663 PolarHBondContact O-N 3.08Å; S660-N664 WeakPolarHBondContact O-CB 3.24Å; S660-N664 PolarHBondContact O-N 3.02Å; S660-N664 VanDerWaalsContact O-N 3.1Å; S660-N664 PolarHBondContact O-ND2 3.15Å; S660-N664 PolarHBondContact OG-ND2 2.88Å
661	F	90.5	Very high	90.7	Very high	3 Å²	3	43 Å²	43	1%	0.013	20%	0.197	C	C	.	.	H	α-helix	trans	-59.1	-53.4	174.9	-177.7	-90	0	0	0	110.4	V653 Y654 N657 P658 K663 N664 V665 F668 F680 I722	V653-F661 HydrophobicContact CG1-CD2 3.9Å; V653-F661 HydrophobicContact CG1-CE2 3.81Å; Y654-F661 HydrophobicContact CD2-CB 4.27Å; Y654-F661 AromaticContact CD2-CD1 3.41Å; Y654-F661 HydrophobicContact CD2-CD1 3.41Å; Y654-F661 VanDerWaalsContact CD2-CD1 3.41Å; Y654-F661 AromaticContact CD2-CE1 3.83Å; Y654-F661 HydrophobicContact CD2-CE1 3.83Å; Y654-F661 AromaticContact CD2-CG 3.89Å; Y654-F661 HydrophobicContact CD2-CG 3.89Å; Y654-F661 AromaticContact CE2-CD1 3.97Å; Y654-F661 HydrophobicContact CE2-CD1 3.97Å; Y654-F661 HydrophobicContact CE2-CE1 4.49Å; N657-F661 PolarHBondContact O-N 2.86Å; P658-F661 PolarHBondContact O-N 2.9Å; F661-K663 VanDerWaalsContact C-N 3.27Å; F661-K663 PolarHBondContact O-N 3.05Å; F661-N664 CarbonylContact O-C 3.56Å; F661-N664 PolarHBondContact O-N 3.07Å; F661-V665 HydrophobicContact CD1-CG2 3.48Å; F661-V665 VanDerWaalsContact CD1-CG2 3.48Å; F661-V665 HydrophobicContact CE1-CG2 3.37Å; F661-V665 HydrophobicContact CG-CG2 4.25Å; F661-V665 HydrophobicContact CZ-CG2 4.03Å; F661-V665 WeakPolarHBondContact O-CG2 3.28Å; F661-V665 PolarHBondContact O-N 2.91Å; F661-F668 HydrophobicContact CE2-CB 4.34Å; F661-F668 AromaticContact CE2-CD1 3.63Å; F661-F668 HydrophobicContact CE2-CD1 3.63Å; F661-F668 HydrophobicContact CE2-CD2 4.14Å; F661-F668 AromaticContact CE2-CE1 3.87Å; F661-F668 HydrophobicContact CE2-CE1 3.87Å; F661-F668 HydrophobicContact CE2-CE2 4.38Å; F661-F668 AromaticContact CE2-CG 3.77Å; F661-F668 HydrophobicContact CE2-CG 3.77Å; F661-F668 HydrophobicContact CE2-CZ 4.24Å; F661-F668 AromaticContact CZ-CD1 3.73Å; F661-F668 HydrophobicContact CZ-CD1 3.73Å; F661-F668 AromaticContact CZ-CE1 3.89Å; F661-F668 HydrophobicContact CZ-CE1 3.89Å; F661-F668 HydrophobicContact CZ-CG 4.32Å; F661-F680 HydrophobicContact CE2-CZ 4.43Å; F661-F680 HydrophobicContact CZ-CE1 4.24Å; F661-F680 HydrophobicContact CZ-CZ 4.17Å; F661-I722 HydrophobicContact CE1-CG2 4.31Å
662	Q	88.9	Confident	90.5	Very high	95 Å²	95	43.2 Å²	43.2	44%	0.444	20%	0.199	S	C	.	.	H	α-helix	trans	-54.8	-40.1	-179.4	-76.1	178.4	14.6	0	0	112.9	Y654 P658 L725	Y654-Q662 PolarHBondContact OH-NE2 3.37Å; P658-Q662 WeakPolarHBondContact O-CB 3.42Å; P658-Q662 VanDerWaalsContact O-CG 3.26Å; P658-Q662 WeakPolarHBondContact O-CG 3.36Å; P658-Q662 PolarHBondContact O-N 2.91Å; Q662-L725 HydrophobicContact CG-CD1 4.4Å
663	K	91.5	Very high	90.1	Very high	174 Å²	174	44.5 Å²	44.5	76%	0.757	21%	0.212	S	C	*	.	H	α-helix	trans	-69.1	-31.4	176.3	-71.2	173.8	-175	173.2	0	113.4	D659 S660 F661	D659-K663 WeakPolarHBondContact O-CG 3.46Å; D659-K663 PolarHBondContact O-N 3.35Å; D659-K663 VanDerWaalsContact O-N 3.15Å; S660-K663 PolarHBondContact O-N 3.08Å; F661-K663 VanDerWaalsContact C-N 3.27Å; F661-K663 PolarHBondContact O-N 3.05Å
664	N	92.5	Very high	89.8	Confident	44 Å²	44	46.9 Å²	46.9	24%	0.235	23%	0.225	C	C	.	.	H	α-helix	trans	-112.2	13.8	-170.7	-63.8	-57.1	0	0	0	114.1	F636 S660 F661 R666 Q667 F668	F636-N664 HydrophobicContact CE2-CB 4.1Å; F636-N664 HydrophobicContact CZ-CB 4.01Å; S660-N664 WeakPolarHBondContact O-CB 3.24Å; S660-N664 PolarHBondContact O-N 3.02Å; S660-N664 VanDerWaalsContact O-N 3.1Å; S660-N664 PolarHBondContact O-ND2 3.15Å; S660-N664 PolarHBondContact OG-ND2 2.88Å; F661-N664 CarbonylContact O-C 3.56Å; F661-N664 PolarHBondContact O-N 3.07Å; N664-R666 PolarHBondContact O-N 3.5Å; N664-Q667 WeakPolarHBondContact O-CA 3.18Å; N664-Q667 WeakPolarHBondContact O-CB 3.28Å; N664-Q667 PolarHBondContact O-N 3.4Å; N664-F668 PolarHBondContact O-N 3.02Å
665	V	92.7	Very high	89.6	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.006	25%	0.245	C	C	.	.	H	α-helix	trans	-56.6	-37.1	-177.3	176.6	0	0	0	0	112.7	F661 Q667 F668 I669 L725 M726	F661-V665 HydrophobicContact CD1-CG2 3.48Å; F661-V665 VanDerWaalsContact CD1-CG2 3.48Å; F661-V665 HydrophobicContact CE1-CG2 3.37Å; F661-V665 HydrophobicContact CG-CG2 4.25Å; F661-V665 HydrophobicContact CZ-CG2 4.03Å; F661-V665 WeakPolarHBondContact O-CG2 3.28Å; F661-V665 PolarHBondContact O-N 2.91Å; V665-Q667 VanDerWaalsContact C-N 3.27Å; V665-Q667 PolarHBondContact O-N 2.99Å; V665-F668 WeakPolarHBondContact O-CB 2.91Å; V665-F668 PolarHBondContact O-N 3.32Å; V665-I669 HydrophobicContact CG1-CD1 3.7Å; V665-I669 HydrophobicContact CG1-CG1 4.18Å; V665-I669 WeakPolarHBondContact O-CG1 3.25Å; V665-I669 PolarHBondContact O-N 3.02Å; V665-L725 HydrophobicContact CB-CD2 3.72Å; V665-L725 HydrophobicContact CG1-CD2 3.81Å; V665-L725 HydrophobicContact CG2-CD2 3.29Å; V665-M726 HydrophobicContact CG1-CG 3.96Å
666	R	92.8	Very high	89.7	Confident	115 Å²	115	53 Å²	53	43%	0.434	25%	0.252	S	S	.	.	H	α-helix	trans	-57.7	-40.1	175.3	-174.5	174.8	-66.5	175.8	3.7	112.6	N664 R670 E729 L733	N664-R666 PolarHBondContact O-N 3.5Å; R666-R670 WeakPolarHBondContact O-CG 3.29Å; R666-R670 PolarHBondContact O-N 3.22Å; R666-E729 IonicContact CZ-OE2 3.05Å; R666-E729 VanDerWaalsContact CZ-OE2 3.23Å; R666-E729 IonicContact NE-OE2 3.87Å; R666-E729 PolarHBondContact NE-OE2 3.08Å; R666-E729 IonicContact NH2-OE1 2.97Å; R666-E729 PolarHBondContact NH2-OE1 3.3Å; R666-E729 IonicContact NH2-OE2 3.71Å; R666-E729 PolarHBondContact NH2-OE2 3.19Å; R666-L733 HydrophobicContact CG-CD2 4.03Å
667	Q	92.3	Very high	89.9	Confident	74 Å²	74	52.8 Å²	52.8	35%	0.346	25%	0.251	S	S	.	.	H	α-helix	trans	-72.1	-41.6	177.7	177.8	169	-21.5	0	0	111	C634 F636 N664 V665 I669 R670 Q671	C634-Q667 PolarHBondContact O-NE2 2.97Å; F636-Q667 HydrophobicContact CD2-CG 4.25Å; F636-Q667 HydrophobicContact CE2-CB 4.35Å; F636-Q667 HydrophobicContact CE2-CG 4.19Å; N664-Q667 WeakPolarHBondContact O-CA 3.18Å; N664-Q667 WeakPolarHBondContact O-CB 3.28Å; N664-Q667 PolarHBondContact O-N 3.4Å; V665-Q667 VanDerWaalsContact C-N 3.27Å; V665-Q667 PolarHBondContact O-N 2.99Å; Q667-I669 PolarHBondContact O-N 3.21Å; Q667-R670 PolarHBondContact O-N 2.97Å; Q667-Q671 HydrophobicContact CG-CG 4.24Å; Q667-Q671 WeakPolarHBondContact O-CB 3.42Å; Q667-Q671 WeakPolarHBondContact O-CG 3.5Å; Q667-Q671 PolarHBondContact O-N 3.24Å
668	F	93.3	Very high	90.1	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-54.7	-49.3	173.2	171.3	-109.9	0	0	0	112	F636 M640 V653 F661 N664 V665 R670 Q671 C672 L677 F680 M726	F636-F668 HydrophobicContact CB-CD2 3.75Å; F636-F668 HydrophobicContact CD1-CB 4.41Å; F636-F668 AromaticContact CD1-CD2 3.85Å; F636-F668 HydrophobicContact CD1-CD2 3.85Å; F636-F668 HydrophobicContact CD2-CB 3.83Å; F636-F668 HydrophobicContact CD2-CD2 4.39Å; F636-F668 HydrophobicContact CE2-CB 4Å; F636-F668 HydrophobicContact CG-CB 4.05Å; F636-F668 AromaticContact CG-CD2 3.74Å; F636-F668 HydrophobicContact CG-CD2 3.74Å; F636-F668 HydrophobicContact CG-CG 4.41Å; F636-F668 HydrophobicContact CZ-CB 4.37Å; M640-F668 HydrophobicContact CG-CE2 4.43Å; M640-F668 HydrophobicContact SD-CE2 4.44Å; V653-F668 HydrophobicContact CG1-CD2 4.06Å; V653-F668 HydrophobicContact CG1-CE2 3.72Å; V653-F668 HydrophobicContact CG1-CZ 4.32Å; F661-F668 HydrophobicContact CE2-CB 4.34Å; F661-F668 AromaticContact CE2-CD1 3.63Å; F661-F668 HydrophobicContact CE2-CD1 3.63Å; F661-F668 HydrophobicContact CE2-CD2 4.14Å; F661-F668 AromaticContact CE2-CE1 3.87Å; F661-F668 HydrophobicContact CE2-CE1 3.87Å; F661-F668 HydrophobicContact CE2-CE2 4.38Å; F661-F668 AromaticContact CE2-CG 3.77Å; F661-F668 HydrophobicContact CE2-CG 3.77Å; F661-F668 HydrophobicContact CE2-CZ 4.24Å; F661-F668 AromaticContact CZ-CD1 3.73Å; F661-F668 HydrophobicContact CZ-CD1 3.73Å; F661-F668 AromaticContact CZ-CE1 3.89Å; F661-F668 HydrophobicContact CZ-CE1 3.89Å; F661-F668 HydrophobicContact CZ-CG 4.32Å; N664-F668 PolarHBondContact O-N 3.02Å; V665-F668 WeakPolarHBondContact O-CB 2.91Å; V665-F668 PolarHBondContact O-N 3.32Å; F668-R670 PolarHBondContact O-N 3.49Å; F668-Q671 PolarHBondContact O-N 3.16Å; F668-C672 VanDerWaalsContact CD2-SG 3.53Å; F668-C672 HydrophobicContact CE2-CB 4.47Å; F668-C672 WeakPolarHBondContact CE2-SG 3.23Å; F668-C672 WeakPolarHBondContact O-CB 3.46Å; F668-C672 PolarHBondContact O-N 3Å; F668-C672 VanDerWaalsContact O-N 3.15Å; F668-C672 PolarHBondContact O-SG 2.84Å; F668-C672 VanDerWaalsContact O-SG 3.4Å; F668-L677 HydrophobicContact CD1-CD2 3.93Å; F668-L677 HydrophobicContact CE1-CD2 3.41Å; F668-L677 VanDerWaalsContact CE1-CD2 3.41Å; F668-L677 HydrophobicContact CZ-CD2 3.78Å; F668-F680 AromaticContact CE1-CD1 3.94Å; F668-F680 HydrophobicContact CE1-CD1 3.94Å; F668-F680 HydrophobicContact CE1-CE1 4.05Å; F668-F680 HydrophobicContact CE1-CG 4.46Å; F668-F680 HydrophobicContact CZ-CB 4.4Å; F668-F680 AromaticContact CZ-CD1 3.88Å; F668-F680 HydrophobicContact CZ-CD1 3.88Å; F668-F680 HydrophobicContact CZ-CD2 4.3Å; F668-F680 HydrophobicContact CZ-CE1 4.2Å; F668-F680 AromaticContact CZ-CG 3.93Å; F668-F680 HydrophobicContact CZ-CG 3.93Å; F668-M726 HydrophobicContact CD1-CE 4.44Å; F668-M726 HydrophobicContact CE1-CE 3.94Å
669	I	92.6	Very high	90.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58.4	-47.9	178.4	-68.2	161.1	0	0	0	111.2	V665 Q667 Q671 L677 E729 I730 L733 F739	V665-I669 HydrophobicContact CG1-CD1 3.7Å; V665-I669 HydrophobicContact CG1-CG1 4.18Å; V665-I669 WeakPolarHBondContact O-CG1 3.25Å; V665-I669 PolarHBondContact O-N 3.02Å; Q667-I669 PolarHBondContact O-N 3.21Å; I669-Q671 PolarHBondContact O-N 2.71Å; I669-L677 HydrophobicContact CB-CD1 4.49Å; I669-L677 HydrophobicContact CG2-CD1 4.11Å; I669-E729 HydrophobicContact CD1-CB 3.81Å; I669-I730 HydrophobicContact CD1-CG1 3.91Å; I669-I730 HydrophobicContact CG1-CG1 4.5Å; I669-I730 HydrophobicContact CG2-CG1 4.11Å; I669-L733 HydrophobicContact CG2-CD1 3.92Å; I669-F739 HydrophobicContact CG2-CD1 3.9Å; I669-F739 HydrophobicContact CG2-CD2 4.18Å; I669-F739 HydrophobicContact CG2-CE1 3.63Å; I669-F739 HydrophobicContact CG2-CE2 3.94Å; I669-F739 HydrophobicContact CG2-CG 4.16Å; I669-F739 HydrophobicContact CG2-CZ 3.67Å; I669-F739 VanDerWaalsContact O-CE1 3.31Å; I669-F739 WeakPolarHBondContact O-CE1 3.43Å
670	R	91.5	Very high	90.5	Very high	134 Å²	134	49.5 Å²	49.5	51%	0.506	23%	0.233	S	C	.	.	H	α-helix	trans	-67.2	-34.9	-178.3	-73.8	-179.9	175.3	-179.9	-2.2	113.6	R666 Q667 F668 L733	R666-R670 WeakPolarHBondContact O-CG 3.29Å; R666-R670 PolarHBondContact O-N 3.22Å; Q667-R670 PolarHBondContact O-N 2.97Å; F668-R670 PolarHBondContact O-N 3.49Å; R670-L733 VanDerWaalsContact NH2-CD2 3.27Å
671	Q	92.1	Very high	90.7	Very high	54 Å²	54	48.2 Å²	48.2	25%	0.252	22%	0.224	S	C	.	.	H	α-helix	trans	-81.6	-38.1	-174.3	-75.6	-172.8	2.1	0	0	113.8	C634 R637 Q667 F668 I669	C634-Q671 PolarHBondContact O-NE2 3.48Å; C634-Q671 VanDerWaalsContact O-NE2 3.16Å; C634-Q671 PolarHBondContact O-OE1 3.06Å; R637-Q671 HydrophobicContact CB-CB 4.19Å; R637-Q671 WeakPolarHBondContact CD-O 3.18Å; Q667-Q671 HydrophobicContact CG-CG 4.24Å; Q667-Q671 WeakPolarHBondContact O-CB 3.42Å; Q667-Q671 WeakPolarHBondContact O-CG 3.5Å; Q667-Q671 PolarHBondContact O-N 3.24Å; F668-Q671 PolarHBondContact O-N 3.16Å; I669-Q671 PolarHBondContact O-N 2.71Å
672	C	88.2	Confident	90.7	Very high	7 Å²	7	50.5 Å²	50.5	5%	0.047	24%	0.24	C	C	.	.	H	α-helix	trans	-79.2	-33.2	-171.1	-67.6	0	0	0	0	113.1	F668 Y676 L677	F668-C672 VanDerWaalsContact CD2-SG 3.53Å; F668-C672 HydrophobicContact CE2-CB 4.47Å; F668-C672 WeakPolarHBondContact CE2-SG 3.23Å; F668-C672 WeakPolarHBondContact O-CB 3.46Å; F668-C672 PolarHBondContact O-N 3Å; F668-C672 VanDerWaalsContact O-N 3.15Å; F668-C672 PolarHBondContact O-SG 2.84Å; F668-C672 VanDerWaalsContact O-SG 3.4Å; C672-Y676 WeakPolarHBondContact O-CD2 3.16Å; C672-L677 HydrophobicContact CB-CD2 4.04Å; C672-L677 HydrophobicContact CB-CG 4.1Å
673	G	83.7	Confident	90.7	Very high	27 Å²	27	50.2 Å²	50.2	28%	0.278	24%	0.239	S	C	.	.	H	α-helix	trans	71.2	168.3	-174.6	0	0	0	0	0	113.6	E675 Y676 L677	G673-E675 PolarHBondContact O-N 3.21Å; G673-Y676 PolarHBondContact O-N 2.74Å; G673-L677 VanDerWaalsContact O-CG 3.3Å; G673-L677 WeakPolarHBondContact O-CG 3.43Å; G673-L677 PolarHBondContact O-N 3.47Å; G673-L677 VanDerWaalsContact O-N 3.12Å
674	N	85.5	Confident	90.7	Very high	55 Å²	55	42.7 Å²	42.7	29%	0.294	21%	0.206	S	C	.	.	H	α-helix	trans	-59.6	-41.3	-166.6	-68.9	-17.1	0	0	0	115	L677 N678 S738 F739 V742	N674-L677 PolarHBondContact O-N 3.45Å; N674-N678 WeakPolarHBondContact O-CB 3.26Å; N674-N678 PolarHBondContact O-N 2.95Å; N674-S738 PolarHBondContact ND2-O 3.48Å; N674-S738 PolarHBondContact OD1-O 2.99Å; N674-F739 VanDerWaalsContact OD1-CD1 3.23Å; N674-F739 WeakPolarHBondContact OD1-CD1 3.04Å; N674-V742 HydrophobicContact CB-CG2 4.16Å
675	E	86.9	Confident	90.5	Very high	112 Å²	112	42.5 Å²	42.5	52%	0.523	21%	0.208	S	C	.	.	H	α-helix	trans	-62	-48.1	-176.5	-171.2	-171.5	164.2	0	0	111.4	R644 G673 L679	R644-E675 IonicContact CZ-OE1 2.9Å; R644-E675 IonicContact NH1-OE1 3.95Å; R644-E675 PolarHBondContact NH1-OE1 2.98Å; R644-E675 IonicContact NH1-OE2 3.8Å; R644-E675 IonicContact NH2-OE1 3.67Å; R644-E675 PolarHBondContact NH2-OE1 3.43Å; G673-E675 PolarHBondContact O-N 3.21Å; E675-L679 WeakPolarHBondContact O-CB 3.18Å; E675-L679 PolarHBondContact O-N 3.43Å
676	Y	89.8	Confident	90.2	Very high	43 Å²	43	46 Å²	46	17%	0.169	23%	0.231	C	C	.	.	H	α-helix	trans	-73	-33	-178.7	-64.6	-83.3	0	0	0	112.2	M640 L641 R644 C672 G673 L679 F680	M640-Y676 HydrophobicContact CB-CD1 4.2Å; M640-Y676 HydrophobicContact CE-CD1 4.44Å; M640-Y676 WeakPolarHBondContact CE-O 3.35Å; L641-Y676 HydrophobicContact CD2-CE1 4.21Å; L641-Y676 WeakPolarHBondContact CD2-OH 3.29Å; R644-Y676 PolarHBondContact NH1-OH 3.29Å; C672-Y676 WeakPolarHBondContact O-CD2 3.16Å; G673-Y676 PolarHBondContact O-N 2.74Å; Y676-L679 PolarHBondContact O-N 3.27Å; Y676-F680 WeakPolarHBondContact O-CB 3.33Å; Y676-F680 PolarHBondContact O-N 3.22Å
677	L	92.6	Very high	89.9	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-67.9	-44.2	174.1	-68.7	173.9	0	0	0	111.8	F668 I669 C672 G673 N674 L679 F680 I681 M726 F739 V742	F668-L677 HydrophobicContact CD1-CD2 3.93Å; F668-L677 HydrophobicContact CE1-CD2 3.41Å; F668-L677 VanDerWaalsContact CE1-CD2 3.41Å; F668-L677 HydrophobicContact CZ-CD2 3.78Å; I669-L677 HydrophobicContact CB-CD1 4.49Å; I669-L677 HydrophobicContact CG2-CD1 4.11Å; C672-L677 HydrophobicContact CB-CD2 4.04Å; C672-L677 HydrophobicContact CB-CG 4.1Å; G673-L677 VanDerWaalsContact O-CG 3.3Å; G673-L677 WeakPolarHBondContact O-CG 3.43Å; G673-L677 PolarHBondContact O-N 3.47Å; G673-L677 VanDerWaalsContact O-N 3.12Å; N674-L677 PolarHBondContact O-N 3.45Å; L677-L679 VanDerWaalsContact C-N 3.31Å; L677-L679 PolarHBondContact O-N 3Å; L677-F680 PolarHBondContact O-N 3.48Å; L677-I681 WeakPolarHBondContact O-CB 3.5Å; L677-I681 WeakPolarHBondContact O-CD1 3.48Å; L677-I681 VanDerWaalsContact O-CG1 3.27Å; L677-I681 WeakPolarHBondContact O-CG1 3.45Å; L677-I681 PolarHBondContact O-N 2.95Å; L677-M726 HydrophobicContact CD2-CE 4.04Å; L677-F739 HydrophobicContact CD1-CD1 3.81Å; L677-F739 HydrophobicContact CD1-CE1 3.8Å; L677-V742 HydrophobicContact CB-CG1 4.04Å; L677-V742 HydrophobicContact CB-CG2 3.98Å; L677-V742 HydrophobicContact CD1-CG1 4.41Å; L677-V742 HydrophobicContact CD1-CG2 4.3Å
678	N	90.8	Very high	89.5	Confident	27 Å²	27	39.4 Å²	39.4	14%	0.144	21%	0.213	C	C	.	.	H	α-helix	trans	-59.7	-43.3	174.3	-81.5	-20.7	0	0	0	111.2	N674 S682 L745 H779	N674-N678 WeakPolarHBondContact O-CB 3.26Å; N674-N678 PolarHBondContact O-N 2.95Å; N678-S682 VanDerWaalsContact O-CB 3.26Å; N678-S682 WeakPolarHBondContact O-CB 3.46Å; N678-S682 PolarHBondContact O-N 3.49Å; N678-S682 PolarHBondContact O-OG 3.46Å; N678-L745 HydrophobicContact CB-CD2 4.39Å; N678-H779 PolarHBondContact ND2-NE2 2.96Å; N678-H779 VanDerWaalsContact ND2-NE2 3.12Å
679	L	91	Very high	89.2	Confident	45 Å²	45	39.7 Å²	39.7	24%	0.236	22%	0.215	C	C	.	.	H	α-helix	trans	-59.9	-50.2	175.3	-175.7	63.3	0	0	0	111.4	M650 E675 Y676 L677 I681 S682 Q683	M650-L679 HydrophobicContact CE-CD2 3.89Å; E675-L679 WeakPolarHBondContact O-CB 3.18Å; E675-L679 PolarHBondContact O-N 3.43Å; Y676-L679 PolarHBondContact O-N 3.27Å; L677-L679 VanDerWaalsContact C-N 3.31Å; L677-L679 PolarHBondContact O-N 3Å; L679-I681 PolarHBondContact O-N 2.85Å; L679-S682 PolarHBondContact O-N 3.27Å; L679-S682 PolarHBondContact O-OG 3.12Å; L679-Q683 HydrophobicContact CD1-CG 4.25Å; L679-Q683 WeakPolarHBondContact O-CG 3.39Å; L679-Q683 PolarHBondContact O-N 3.48Å; L679-Q683 VanDerWaalsContact O-N 3.08Å
680	F	92.8	Very high	88.8	Confident	1 Å²	1	40.3 Å²	40.3	0%	0.004	22%	0.218	C	C	.	.	H	α-helix	trans	-56.9	-50.6	178	173.7	-103.2	0	0	0	112.1	M640 M650 V653 F661 F668 Y676 L677 S682 Q683 L684 M726	M640-F680 HydrophobicContact CE-CB 4.16Å; M650-F680 HydrophobicContact CB-CD2 4.34Å; M650-F680 WeakPolarHBondContact O-CE2 3.43Å; V653-F680 HydrophobicContact CB-CE2 4.1Å; F661-F680 HydrophobicContact CE2-CZ 4.43Å; F661-F680 HydrophobicContact CZ-CE1 4.24Å; F661-F680 HydrophobicContact CZ-CZ 4.17Å; F668-F680 AromaticContact CE1-CD1 3.94Å; F668-F680 HydrophobicContact CE1-CD1 3.94Å; F668-F680 HydrophobicContact CE1-CE1 4.05Å; F668-F680 HydrophobicContact CE1-CG 4.46Å; F668-F680 HydrophobicContact CZ-CB 4.4Å; F668-F680 AromaticContact CZ-CD1 3.88Å; F668-F680 HydrophobicContact CZ-CD1 3.88Å; F668-F680 HydrophobicContact CZ-CD2 4.3Å; F668-F680 HydrophobicContact CZ-CE1 4.2Å; F668-F680 AromaticContact CZ-CG 3.93Å; F668-F680 HydrophobicContact CZ-CG 3.93Å; Y676-F680 WeakPolarHBondContact O-CB 3.33Å; Y676-F680 PolarHBondContact O-N 3.22Å; L677-F680 PolarHBondContact O-N 3.48Å; F680-S682 VanDerWaalsContact C-N 3.29Å; F680-S682 PolarHBondContact O-N 3.34Å; F680-Q683 PolarHBondContact O-N 3.12Å; F680-L684 HydrophobicContact CE1-CD1 4.44Å; F680-L684 HydrophobicContact CE2-CD1 3.94Å; F680-L684 HydrophobicContact CZ-CD1 3.76Å; F680-L684 PolarHBondContact O-N 2.84Å; F680-M726 HydrophobicContact CD1-CE 4.34Å; F680-M726 HydrophobicContact CD1-SD 4.26Å; F680-M726 HydrophobicContact CE1-CE 4.47Å; F680-M726 HydrophobicContact CE1-SD 3.88Å
681	I	93	Very high	88.2	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-64.2	-35.8	-179.5	-66.2	159.7	0	0	0	111.3	L677 L679 F723 M726 V742 L745 L746 K749	L677-I681 WeakPolarHBondContact O-CB 3.5Å; L677-I681 WeakPolarHBondContact O-CD1 3.48Å; L677-I681 VanDerWaalsContact O-CG1 3.27Å; L677-I681 WeakPolarHBondContact O-CG1 3.45Å; L677-I681 PolarHBondContact O-N 2.95Å; L679-I681 PolarHBondContact O-N 2.85Å; I681-F723 HydrophobicContact CB-CE1 4.27Å; I681-F723 HydrophobicContact CG1-CE1 4.38Å; I681-F723 HydrophobicContact CG2-CD1 4.27Å; I681-F723 HydrophobicContact CG2-CE1 3.69Å; I681-F723 HydrophobicContact CG2-CZ 3.93Å; I681-M726 HydrophobicContact CD1-CE 4Å; I681-M726 HydrophobicContact CG1-CE 4.09Å; I681-M726 HydrophobicContact CG1-SD 4.33Å; I681-V742 HydrophobicContact CD1-CG1 3.44Å; I681-V742 VanDerWaalsContact CD1-CG1 3.44Å; I681-L745 HydrophobicContact CB-CD2 3.92Å; I681-L745 HydrophobicContact CB-CG 4.48Å; I681-L745 HydrophobicContact CG2-CD2 3.68Å; I681-L745 HydrophobicContact CG2-CG 3.72Å; I681-L746 HydrophobicContact CD1-CD1 4.37Å; I681-L746 HydrophobicContact CD1-CD2 3.75Å; I681-L746 HydrophobicContact CD1-CG 3.9Å; I681-L746 HydrophobicContact CG1-CD2 4.06Å; I681-L746 HydrophobicContact CG2-CD2 4.14Å; I681-K749 HydrophobicContact CG2-CG 4.21Å
682	S	89.3	Confident	87.5	Confident	51 Å²	51	37.3 Å²	37.3	36%	0.357	22%	0.223	S	C	.	.	H	α-helix	trans	-69.9	-31.8	178.8	73.1	0	0	0	0	113.7	N678 L679 F680	N678-S682 VanDerWaalsContact O-CB 3.26Å; N678-S682 WeakPolarHBondContact O-CB 3.46Å; N678-S682 PolarHBondContact O-N 3.49Å; N678-S682 PolarHBondContact O-OG 3.46Å; L679-S682 PolarHBondContact O-N 3.27Å; L679-S682 PolarHBondContact O-OG 3.12Å; F680-S682 VanDerWaalsContact C-N 3.29Å; F680-S682 PolarHBondContact O-N 3.34Å
683	Q	90.3	Very high	87.1	Confident	90 Å²	90	40.8 Å²	40.8	42%	0.421	24%	0.241	S	C	.	.	H	α-helix	trans	-97.3	-11.3	-175.5	-68.8	-174.7	-12.2	0	0	114.2	N651 L679 F680 C685	N651-Q683 PolarHBondContact ND2-O 3.3Å; N651-Q683 VanDerWaalsContact ND2-O 3.1Å; L679-Q683 HydrophobicContact CD1-CG 4.25Å; L679-Q683 WeakPolarHBondContact O-CG 3.39Å; L679-Q683 PolarHBondContact O-N 3.48Å; L679-Q683 VanDerWaalsContact O-N 3.08Å; F680-Q683 PolarHBondContact O-N 3.12Å; Q683-C685 PolarHBondContact O-N 3.42Å
684	L	91.2	Very high	87	Confident	15 Å²	15	39.8 Å²	39.8	8%	0.079	23%	0.229	C	C	.	.			trans	-61.9	122	-178.7	-162.9	71.7	0	0	0	110.4	N651 F680 I719 I722 F723	N651-L684 WeakPolarHBondContact OD1-CA 3.13Å; N651-L684 WeakPolarHBondContact OD1-CD1 3.38Å; F680-L684 HydrophobicContact CE1-CD1 4.44Å; F680-L684 HydrophobicContact CE2-CD1 3.94Å; F680-L684 HydrophobicContact CZ-CD1 3.76Å; F680-L684 PolarHBondContact O-N 2.84Å; L684-I719 HydrophobicContact CD2-CG2 4.06Å; L684-I722 HydrophobicContact CD2-CB 4.31Å; L684-I722 HydrophobicContact CD2-CD1 4.06Å; L684-I722 HydrophobicContact CD2-CG2 4.04Å; L684-F723 HydrophobicContact CB-CE1 4.27Å; L684-F723 HydrophobicContact CB-CZ 4.32Å; L684-F723 HydrophobicContact CD2-CD1 4.23Å; L684-F723 HydrophobicContact CD2-CE1 3.55Å; L684-F723 HydrophobicContact CD2-CZ 4.12Å
685	C	88.4	Confident	86.5	Confident	40 Å²	40	42.3 Å²	42.3	27%	0.27	24%	0.239	S	C	.	.			trans	-117.3	166.9	-176.9	73.1	0	0	0	0	111.3	N651 Q683 A687 K717	N651-C685 PolarHBondContact OD1-N 3.47Å; Q683-C685 PolarHBondContact O-N 3.42Å; C685-A687 VanDerWaalsContact C-N 3.32Å; C685-A687 PolarHBondContact O-N 3.24Å; C685-K717 WeakPolarHBondContact O-CE 3.35Å
686	P	86.8	Confident	85.6	Confident	75 Å²	75	39.4 Å²	39.4	49%	0.487	23%	0.225	S	C	.	.	S	Bend	trans	-75.6	-21.7	-176.1	-19.6	31.7	0	0	0	113.7	T716 K717 I719	P686-T716 WeakPolarHBondContact O-CA 3.18Å; P686-K717 PolarHBondContact O-N 2.98Å; P686-I719 HydrophobicContact CB-CD1 4.29Å; P686-I719 HydrophobicContact CG-CD1 3.77Å
687	A	84.9	Confident	84.7	Confident	45 Å²	45	37.7 Å²	37.7	37%	0.372	22%	0.218	S	C	.	.	B	Isolated β-bridge	trans	-75.4	142.1	-177.8	0	0	0	0	0	111.1	C685	C685-A687 VanDerWaalsContact C-N 3.32Å; C685-A687 PolarHBondContact O-N 3.24Å
688	N	85.7	Confident	83.6	Confident	5 Å²	5	39 Å²	39	3%	0.027	22%	0.224	C	C	.	.			trans	-82	113.3	170.6	-174.6	-25.4	0	0	0	110	D655 V690 C691 S692 C713 S715	D655-N688 WeakPolarHBondContact CB-OD1 3.4Å; D655-N688 WeakPolarHBondContact OD2-CA 3.4Å; N688-V690 VanDerWaalsContact C-N 3.27Å; N688-V690 PolarHBondContact O-N 3.21Å; N688-V690 VanDerWaalsContact OD1-CB 3.24Å; N688-V690 WeakPolarHBondContact OD1-CB 3.4Å; N688-V690 PolarHBondContact OD1-N 3.09Å; N688-C691 HydrophobicContact CB-CB 4.38Å; N688-C691 PolarHBondContact O-N 2.65Å; N688-S692 PolarHBondContact O-N 2.97Å; N688-S692 PolarHBondContact O-OG 3.43Å; N688-C713 PolarHBondContact ND2-SG 3.45Å; N688-S715 PolarHBondContact N-O 3.01Å
689	V	87.1	Confident	81.9	Confident	6 Å²	6	38.9 Å²	38.9	4%	0.036	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-69.9	-23.2	-177.7	-59.4	0	0	0	0	113.2	D649 N651 L652 D655 C691 S692 L693 Y694	D649-V689 HydrophobicContact CB-CG1 4.42Å; N651-V689 HydrophobicContact CB-CB 4.42Å; N651-V689 HydrophobicContact CB-CG1 3.67Å; N651-V689 HydrophobicContact CB-CG2 3.88Å; L652-V689 HydrophobicContact CB-CG2 4.33Å; D655-V689 HydrophobicContact CB-CG2 4.08Å; D655-V689 WeakPolarHBondContact OD2-CG2 3.39Å; D655-V689 PolarHBondContact OD2-N 3.06Å; V689-C691 VanDerWaalsContact C-N 3.33Å; V689-S692 WeakPolarHBondContact CA-OG 3.44Å; V689-S692 PolarHBondContact O-N 3.36Å; V689-L693 HydrophobicContact CB-CB 4.39Å; V689-L693 PolarHBondContact O-N 3.26Å; V689-L693 VanDerWaalsContact O-N 3.1Å; V689-Y694 HydrophobicContact CB-CD2 4.19Å; V689-Y694 HydrophobicContact CB-CE2 4.32Å; V689-Y694 HydrophobicContact CG2-CD2 3.96Å; V689-Y694 HydrophobicContact CG2-CE2 4Å; V689-Y694 PolarHBondContact O-N 3.17Å
690	V	84	Confident	80	Confident	13 Å²	13	44.5 Å²	44.5	8%	0.079	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-68.3	-34.8	175.2	175.9	0	0	0	0	111	L652 D655 N688 Y694 E695 F698	L652-V690 HydrophobicContact CD1-CG2 3.92Å; D655-V690 HydrophobicContact CB-CG2 3.82Å; D655-V690 WeakPolarHBondContact O-CG2 3.33Å; N688-V690 VanDerWaalsContact C-N 3.27Å; N688-V690 PolarHBondContact O-N 3.21Å; N688-V690 VanDerWaalsContact OD1-CB 3.24Å; N688-V690 WeakPolarHBondContact OD1-CB 3.4Å; N688-V690 PolarHBondContact OD1-N 3.09Å; V690-Y694 CarbonylContact O-C 3.59Å; V690-E695 VanDerWaalsContact O-CA 3.22Å; V690-E695 WeakPolarHBondContact O-CA 3.22Å; V690-E695 PolarHBondContact O-N 2.92Å; V690-F698 HydrophobicContact CB-CD2 4.36Å; V690-F698 HydrophobicContact CG1-CB 3.31Å; V690-F698 HydrophobicContact CG1-CD2 3.79Å; V690-F698 HydrophobicContact CG1-CG 3.69Å; V690-F698 HydrophobicContact CG2-CD2 4.27Å
691	C	77.2	Confident	77.8	Confident	60 Å²	60	47.3 Å²	47.3	41%	0.405	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-93.3	0.3	178.9	-57.3	0	0	0	0	114	N688 V689	N688-C691 HydrophobicContact CB-CB 4.38Å; N688-C691 PolarHBondContact O-N 2.65Å; V689-C691 VanDerWaalsContact C-N 3.33Å
692	S	77.8	Confident	75.4	Confident	65 Å²	65	55.5 Å²	55.5	46%	0.455	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.1	-84.6	-179.6	53.9	0	0	0	0	110.2	N688 V689 Y694 E695	N688-S692 PolarHBondContact O-N 2.97Å; N688-S692 PolarHBondContact O-OG 3.43Å; V689-S692 WeakPolarHBondContact CA-OG 3.44Å; V689-S692 PolarHBondContact O-N 3.36Å; S692-Y694 VanDerWaalsContact C-N 3.33Å; S692-Y694 PolarHBondContact O-N 3.47Å; S692-E695 WeakPolarHBondContact O-CB 3.49Å; S692-E695 PolarHBondContact O-N 3.41Å
693	L	80.6	Confident	73.4	Confident	80 Å²	80	54.9 Å²	54.9	42%	0.419	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-39.7	-176.5	-174.8	64.1	0	0	0	113.3	L585 D649 V689	L585-L693 HydrophobicContact CD1-CD1 3.99Å; L585-L693 HydrophobicContact CD1-CG 4.45Å; L585-L693 WeakPolarHBondContact CD1-O 3.48Å; D649-L693 HydrophobicContact CB-CD2 4.14Å; V689-L693 HydrophobicContact CB-CB 4.39Å; V689-L693 PolarHBondContact O-N 3.26Å; V689-L693 VanDerWaalsContact O-N 3.1Å
694	Y	81.5	Confident	71.5	Confident	7 Å²	7	52.8 Å²	52.8	3%	0.027	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	20.1	-176.7	-53.3	-56.3	0	0	0	113.1	L620 L624 D649 L652 V689 V690 S692 F696 Y697 F698	L620-Y694 HydrophobicContact CD1-CE1 4.24Å; L620-Y694 HydrophobicContact CD2-CE1 4.33Å; L624-Y694 HydrophobicContact CD1-CD1 3.84Å; L624-Y694 HydrophobicContact CD1-CE1 4.29Å; L624-Y694 HydrophobicContact CD1-CG 4.36Å; L624-Y694 HydrophobicContact CD2-CD1 4.17Å; L624-Y694 HydrophobicContact CD2-CE1 4.04Å; L624-Y694 HydrophobicContact CD2-CE2 4.46Å; L624-Y694 HydrophobicContact CD2-CG 4.45Å; D649-Y694 HydrophobicContact CB-CE2 4.22Å; D649-Y694 PolarHBondContact N-OH 3.44Å; L652-Y694 HydrophobicContact CB-CE2 4.45Å; L652-Y694 HydrophobicContact CD1-CD2 4.07Å; L652-Y694 HydrophobicContact CD1-CE2 4.3Å; L652-Y694 HydrophobicContact CD2-CE2 4.47Å; V689-Y694 HydrophobicContact CB-CD2 4.19Å; V689-Y694 HydrophobicContact CB-CE2 4.32Å; V689-Y694 HydrophobicContact CG2-CD2 3.96Å; V689-Y694 HydrophobicContact CG2-CE2 4Å; V689-Y694 PolarHBondContact O-N 3.17Å; V690-Y694 CarbonylContact O-C 3.59Å; S692-Y694 VanDerWaalsContact C-N 3.33Å; S692-Y694 PolarHBondContact O-N 3.47Å; Y694-F696 PolarHBondContact O-N 2.74Å; Y694-Y697 HydrophobicContact CD1-CD2 4.46Å; Y694-Y697 PolarHBondContact O-N 3.29Å; Y694-F698 HydrophobicContact CD2-CE2 4.5Å; Y694-F698 HydrophobicContact CG-CE2 4.25Å; Y694-F698 WeakPolarHBondContact O-CD2 3.25Å; Y694-F698 PolarHBondContact O-N 2.88Å
695	E	74.5	Confident	69.4	Low	108 Å²	108	53.1 Å²	53.1	51%	0.505	30%	0.304	S	S	.	.	H	α-helix	trans	-52.6	-41.5	-177.8	-176.6	-178.3	-171.9	0	0	112.1	V690 S692 Y697 F698 G699	V690-E695 VanDerWaalsContact O-CA 3.22Å; V690-E695 WeakPolarHBondContact O-CA 3.22Å; V690-E695 PolarHBondContact O-N 2.92Å; S692-E695 WeakPolarHBondContact O-CB 3.49Å; S692-E695 PolarHBondContact O-N 3.41Å; E695-Y697 PolarHBondContact O-N 3.24Å; E695-F698 PolarHBondContact O-N 3.38Å; E695-G699 WeakPolarHBondContact O-CA 3.25Å; E695-G699 PolarHBondContact O-N 3.39Å
696	F	67.9	Low	67.5	Low	51 Å²	51	51.7 Å²	51.7	22%	0.224	29%	0.294	C	S	.	.	H	α-helix	trans	-59.9	-29.8	179.2	-174	-83.8	0	0	0	113.5	I584 D587 Y694 H704	I584-F696 HydrophobicContact CG2-CB 4.21Å; I584-F696 HydrophobicContact CG2-CD2 4.42Å; D587-F696 HydrophobicContact CB-CE1 4.37Å; D587-F696 HydrophobicContact CB-CZ 4.38Å; D587-F696 VanDerWaalsContact CG-CZ 3.48Å; D587-F696 WeakPolarHBondContact OD1-CE1 3.3Å; D587-F696 WeakPolarHBondContact OD2-CE1 3.13Å; D587-F696 WeakPolarHBondContact OD2-CZ 3.5Å; Y694-F696 PolarHBondContact O-N 2.74Å; F696-H704 PolarHBondContact O-CE1 3.36Å; F696-H704 VanDerWaalsContact O-CE1 3.3Å; F696-H704 PolarHBondContact O-ND1 3.05Å
697	Y	71	Confident	65.5	Low	6 Å²	6	53.5 Å²	53.5	2%	0.024	31%	0.308	C	S	.	.	H	α-helix	trans	-92.8	-26.7	-175.2	-62.1	-64.8	0	0	0	113.9	L585 L620 P621 L624 Y694 E695 P705	L585-Y697 HydrophobicContact CB-CE2 4.45Å; L620-Y697 HydrophobicContact CD2-CE2 3.67Å; L620-Y697 HydrophobicContact CG-CE2 4.05Å; P621-Y697 HydrophobicContact CB-CE1 3.99Å; P621-Y697 HydrophobicContact CG-CE1 3.61Å; L624-Y697 HydrophobicContact CD1-CD1 4.48Å; L624-Y697 HydrophobicContact CD1-CD2 3.34Å; L624-Y697 HydrophobicContact CD1-CE2 3.83Å; L624-Y697 HydrophobicContact CD1-CG 3.7Å; Y694-Y697 HydrophobicContact CD1-CD2 4.46Å; Y694-Y697 PolarHBondContact O-N 3.29Å; E695-Y697 PolarHBondContact O-N 3.24Å; Y697-P705 HydrophobicContact CD1-CG 4.26Å
698	F	70.3	Confident	63.4	Low	29 Å²	29	53.3 Å²	53.3	13%	0.127	30%	0.304	C	S	.	.	H	α-helix	trans	-124.1	0.6	-173.3	-57.5	-72.3	0	0	0	114.3	L624 L652 Y656 V690 Y694 E695 V706	L624-F698 HydrophobicContact CD1-CE2 4.4Å; L652-F698 HydrophobicContact CD1-CE2 4.01Å; L652-F698 HydrophobicContact CD1-CZ 4.2Å; Y656-F698 HydrophobicContact CD2-CD1 4.22Å; Y656-F698 AromaticContact CD2-CE1 3.65Å; Y656-F698 HydrophobicContact CD2-CE1 3.65Å; Y656-F698 HydrophobicContact CD2-CZ 4.07Å; Y656-F698 HydrophobicContact CE2-CD1 4.07Å; Y656-F698 AromaticContact CE2-CE1 3.51Å; Y656-F698 HydrophobicContact CE2-CE1 3.51Å; Y656-F698 HydrophobicContact CE2-CZ 4.29Å; V690-F698 HydrophobicContact CB-CD2 4.36Å; V690-F698 HydrophobicContact CG1-CB 3.31Å; V690-F698 HydrophobicContact CG1-CD2 3.79Å; V690-F698 HydrophobicContact CG1-CG 3.69Å; V690-F698 HydrophobicContact CG2-CD2 4.27Å; Y694-F698 HydrophobicContact CD2-CE2 4.5Å; Y694-F698 HydrophobicContact CG-CE2 4.25Å; Y694-F698 WeakPolarHBondContact O-CD2 3.25Å; Y694-F698 PolarHBondContact O-N 2.88Å; E695-F698 PolarHBondContact O-N 3.38Å; F698-V706 HydrophobicContact CD1-CB 4.12Å; F698-V706 HydrophobicContact CD1-CG1 4.28Å; F698-V706 HydrophobicContact CE1-CB 3.9Å; F698-V706 HydrophobicContact CE1-CG1 3.76Å; F698-V706 HydrophobicContact CE1-CG2 4.37Å
699	G	55.1	Low	61.4	Low	23 Å²	23	58.2 Å²	58.2	24%	0.237	35%	0.345	C	S	.	.	S	Bend	trans	-59	169.5	-175.6	0	0	0	0	0	114.3	E695 S701 H704	E695-G699 WeakPolarHBondContact O-CA 3.25Å; E695-G699 PolarHBondContact O-N 3.39Å; G699-S701 PolarHBondContact O-N 2.74Å; G699-H704 PolarHBondContact O-CD2 3.33Å
700	K	50.7	Low	59.6	Low	164 Å²	164	60.5 Å²	60.5	71%	0.713	36%	0.357	S	S	*	.	S	Bend	trans	-82.6	85.4	-178.3	-63.3	-174.8	-149.9	171	0	110.9	I712	K700-I712 HydrophobicContact CD-CD1 4Å; K700-I712 HydrophobicContact CD-CG1 3.94Å; K700-I712 VanDerWaalsContact CE-CG1 3.43Å; K700-I712 VanDerWaalsContact CE-CG2 3.42Å
701	S	45.9	Very low	57.8	Low	60 Å²	60	63.8 Å²	63.8	42%	0.42	38%	0.378	S	S	.	.	S	Bend	trans	-159.6	154.1	157.4	69.4	0	0	0	0	110.8	G699 S703 H704	G699-S701 PolarHBondContact O-N 2.74Å; S701-S703 PolarHBondContact O-N 2.82Å; S701-S703 PolarHBondContact OG-OG 3.31Å; S701-H704 PolarHBondContact N-CD2 3.1Å; S701-H704 PolarHBondContact O-CD2 3.35Å; S701-H704 VanDerWaalsContact O-CD2 3.27Å; S701-H704 PolarHBondContact OG-CD2 3.44Å; S701-H704 PolarHBondContact OG-NE2 3.2Å
702	D	44.2	Very low	56.2	Low	172 Å²	172	66.8 Å²	66.8	92%	0.92	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	13.8	176.5	-68.3	-37.9	0	0	0	114.2
703	S	45.7	Very low	54.9	Low	39 Å²	39	65.9 Å²	65.9	27%	0.273	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.6	0.2	-167.8	75.7	0	0	0	0	115.1	S701	S701-S703 PolarHBondContact O-N 2.82Å; S701-S703 PolarHBondContact OG-OG 3.31Å
704	H	51	Low	53.8	Low	45 Å²	45	68 Å²	68	21%	0.208	39%	0.394	C	S	.	.			trans	-93.1	146.7	-171.1	-64.1	-67.4	0	0	0	114.9	F696 G699 S701 V706	F696-H704 PolarHBondContact O-CE1 3.36Å; F696-H704 VanDerWaalsContact O-CE1 3.3Å; F696-H704 PolarHBondContact O-ND1 3.05Å; G699-H704 PolarHBondContact O-CD2 3.33Å; S701-H704 PolarHBondContact N-CD2 3.1Å; S701-H704 PolarHBondContact O-CD2 3.35Å; S701-H704 VanDerWaalsContact O-CD2 3.27Å; S701-H704 PolarHBondContact OG-CD2 3.44Å; S701-H704 PolarHBondContact OG-NE2 3.2Å; H704-V706 VanDerWaalsContact C-N 3.32Å; H704-V706 PolarHBondContact O-N 2.72Å
705	P	47.4	Very low	52.8	Low	23 Å²	23	71.9 Å²	71.9	15%	0.149	42%	0.423	C	S	.	.	S	Bend	trans	-63.7	-31.3	-172.4	-12.2	19.5	0	0	0	114.9	Y548 P562 Y697	Y548-P705 HydrophobicContact CE1-CB 4.08Å; P562-P705 HydrophobicContact CB-CB 3.88Å; P562-P705 HydrophobicContact CG-CB 3.58Å; P562-P705 HydrophobicContact CG-CG 3.77Å; Y697-P705 HydrophobicContact CD1-CG 4.26Å
706	V	49.3	Very low	52.4	Low	10 Å²	10	69.7 Å²	69.7	6%	0.061	42%	0.417	C	S	.	.	S	Bend	trans	-110.5	75.5	-173.7	-168	0	0	0	0	108.3	C628 F698 H704 S708	C628-V706 HydrophobicContact CB-CG1 4.42Å; F698-V706 HydrophobicContact CD1-CB 4.12Å; F698-V706 HydrophobicContact CD1-CG1 4.28Å; F698-V706 HydrophobicContact CE1-CB 3.9Å; F698-V706 HydrophobicContact CE1-CG1 3.76Å; F698-V706 HydrophobicContact CE1-CG2 4.37Å; H704-V706 VanDerWaalsContact C-N 3.32Å; H704-V706 PolarHBondContact O-N 2.72Å; V706-S708 PolarHBondContact O-N 2.91Å; V706-S708 VanDerWaalsContact O-N 3.09Å
707	S	43.7	Very low	52.9	Low	112 Å²	112	68.2 Å²	68.2	78%	0.783	41%	0.41	S	S	*	.			trans	-77.9	92.3	176.7	-172.9	0	0	0	0	109.8
708	S	41.7	Very low	53.5	Low	42 Å²	42	72.7 Å²	72.7	29%	0.294	43%	0.434	S	S	.	.			trans	-113.3	135.4	150.3	55.6	0	0	0	0	107.7	Y656 V706 L710	Y656-S708 PolarHBondContact OH-OG 3.24Å; Y656-S708 VanDerWaalsContact OH-OG 3.06Å; V706-S708 PolarHBondContact O-N 2.91Å; V706-S708 VanDerWaalsContact O-N 3.09Å; S708-L710 PolarHBondContact O-N 2.8Å; S708-L710 WeakPolarHBondContact OG-CD1 3.18Å
709	A	44	Very low	54.4	Low	108 Å²	108	72.7 Å²	72.7	89%	0.893	44%	0.436	S	S	*	.			trans	-67.4	77.1	178.7	0	0	0	0	0	109.6
710	L	49.2	Very low	56	Low	53 Å²	53	74.2 Å²	74.2	28%	0.277	44%	0.44	S	S	.	.			trans	-88.6	129.8	-179.3	-74.8	164	0	0	0	109.8	Y656 N657 S708 I712	Y656-L710 HydrophobicContact CD2-CD1 3.97Å; Y656-L710 HydrophobicContact CE2-CD1 3.82Å; Y656-L710 WeakPolarHBondContact O-CD1 3.46Å; Y656-L710 WeakPolarHBondContact O-CD2 3.21Å; N657-L710 HydrophobicContact CB-CD2 3.9Å; S708-L710 PolarHBondContact O-N 2.8Å; S708-L710 WeakPolarHBondContact OG-CD1 3.18Å; L710-I712 PolarHBondContact O-N 3.41Å
711	P	44.2	Very low	57.9	Low	82 Å²	82	68.7 Å²	68.7	53%	0.532	43%	0.425	S	S	.	.			trans	-62.9	137	174.8	25.1	-30.3	0	0	0	109.3	C713	P711-C713 PolarHBondContact O-N 3.15Å
712	I	44.3	Very low	60	Low	123 Å²	123	66.1 Å²	66.1	63%	0.631	41%	0.407	S	S	*	.			trans	-49.5	99.4	175.7	-56.8	173.3	0	0	0	108.7	K700 L710	K700-I712 HydrophobicContact CD-CD1 4Å; K700-I712 HydrophobicContact CD-CG1 3.94Å; K700-I712 VanDerWaalsContact CE-CG1 3.43Å; K700-I712 VanDerWaalsContact CE-CG2 3.42Å; L710-I712 PolarHBondContact O-N 3.41Å
713	C	50.4	Low	62.4	Low	46 Å²	46	58.4 Å²	58.4	31%	0.311	37%	0.365	S	S	.	.			trans	-82.1	143.1	179.3	-176.8	0	0	0	0	109.7	N688 P711	N688-C713 PolarHBondContact ND2-SG 3.45Å; P711-C713 PolarHBondContact O-N 3.15Å
714	N	57.3	Low	64.7	Low	124 Å²	124	62.6 Å²	62.6	66%	0.663	38%	0.375	S	S	*	.			trans	-55.1	147.6	172.3	-70.9	-19.4	0	0	0	110.6	T716	N714-T716 PolarHBondContact O-N 2.83Å; N714-T716 VanDerWaalsContact O-N 3.08Å
715	S	60.7	Low	66.7	Low	90 Å²	90	63.1 Å²	63.1	63%	0.629	38%	0.379	S	S	*	.	S	Bend	trans	-61.2	-19.1	178.1	55.3	0	0	0	0	113.5	N688	N688-S715 PolarHBondContact N-O 3.01Å
716	T	65.6	Low	68.9	Low	62 Å²	62	62 Å²	62	38%	0.38	37%	0.371	S	S	.	.	B	Isolated β-bridge	trans	-126.1	134.7	-179.1	54.1	0	0	0	0	111.4	P686 N714	P686-T716 WeakPolarHBondContact O-CA 3.18Å; N714-T716 PolarHBondContact O-N 2.83Å; N714-T716 VanDerWaalsContact O-N 3.08Å
717	K	79.5	Confident	70.9	Confident	19 Å²	19	61.9 Å²	61.9	8%	0.083	37%	0.371	C	S	.	.			trans	-104.7	144.9	175	66.5	-168.5	166.5	-166	0	111.5	N651 Y654 D655 C685 P686 I719 I722	N651-K717 PolarHBondContact OD1-NZ 2.77Å; Y654-K717 HydrophobicContact CD1-CD 3.74Å; Y654-K717 HydrophobicContact CE1-CB 4.17Å; Y654-K717 HydrophobicContact CE1-CD 3.89Å; D655-K717 WeakPolarHBondContact OD1-CD 3.22Å; D655-K717 WeakPolarHBondContact OD1-CE 3.4Å; D655-K717 IonicContact OD1-NZ 2.88Å; D655-K717 PolarHBondContact OD1-NZ 3.46Å; D655-K717 IonicContact OD2-NZ 2.66Å; D655-K717 PolarHBondContact OD2-NZ 3.25Å; C685-K717 WeakPolarHBondContact O-CE 3.35Å; P686-K717 PolarHBondContact O-N 2.98Å; K717-I719 HydrophobicContact CG-CG1 4.43Å; K717-I719 PolarHBondContact O-N 3.38Å; K717-I719 VanDerWaalsContact O-N 3.12Å; K717-I722 HydrophobicContact CD-CD1 4.11Å; K717-I722 HydrophobicContact CG-CD1 4.39Å
718	N	84.1	Confident	73.3	Confident	100 Å²	100	61.2 Å²	61.2	54%	0.535	36%	0.358	S	S	.	.			trans	-82	91.2	174.1	-172.5	-14	0	0	0	110.2	T720 A721 I722	N718-T720 PolarHBondContact O-N 3.06Å; N718-T720 PolarHBondContact OD1-N 3.44Å; N718-T720 VanDerWaalsContact OD1-N 3.15Å; N718-T720 PolarHBondContact OD1-OG1 2.73Å; N718-A721 HydrophobicContact CB-CB 4.16Å; N718-A721 WeakPolarHBondContact O-CB 3.37Å; N718-A721 PolarHBondContact O-N 3.29Å; N718-A721 VanDerWaalsContact O-N 3.12Å; N718-A721 PolarHBondContact OD1-N 2.91Å; N718-I722 PolarHBondContact O-N 3.25Å
719	I	88.6	Confident	75.7	Confident	30 Å²	30	61.6 Å²	61.6	15%	0.154	36%	0.355	C	S	.	.	H	α-helix	trans	-54.4	-40.4	178.4	-62.9	177.1	0	0	0	112.1	L684 P686 K717 A721 I722 F723	L684-I719 HydrophobicContact CD2-CG2 4.06Å; P686-I719 HydrophobicContact CB-CD1 4.29Å; P686-I719 HydrophobicContact CG-CD1 3.77Å; K717-I719 HydrophobicContact CG-CG1 4.43Å; K717-I719 PolarHBondContact O-N 3.38Å; K717-I719 VanDerWaalsContact O-N 3.12Å; I719-A721 PolarHBondContact O-N 2.91Å; I719-I722 WeakPolarHBondContact O-CB 3.45Å; I719-I722 PolarHBondContact O-N 2.79Å; I719-F723 HydrophobicContact CG2-CD1 4.25Å; I719-F723 HydrophobicContact CG2-CD2 3.58Å; I719-F723 HydrophobicContact CG2-CE1 3.86Å; I719-F723 HydrophobicContact CG2-CE2 3.12Å; I719-F723 HydrophobicContact CG2-CG 4.13Å; I719-F723 HydrophobicContact CG2-CZ 3.28Å; I719-F723 PolarHBondContact O-N 3.31Å
720	T	89.4	Confident	77.9	Confident	54 Å²	54	56.5 Å²	56.5	33%	0.331	31%	0.313	S	S	.	.	H	α-helix	trans	-63.3	-32.2	-177.5	68.8	0	0	0	0	112	N718 R724	N718-T720 PolarHBondContact O-N 3.06Å; N718-T720 PolarHBondContact OD1-N 3.44Å; N718-T720 VanDerWaalsContact OD1-N 3.15Å; N718-T720 PolarHBondContact OD1-OG1 2.73Å; T720-R724 WeakPolarHBondContact O-CB 3.2Å; T720-R724 WeakPolarHBondContact O-CG 3.41Å; T720-R724 PolarHBondContact O-N 2.75Å
721	A	89.7	Confident	79.7	Confident	48 Å²	48	57.8 Å²	57.8	40%	0.397	32%	0.318	S	S	.	.	H	α-helix	trans	-68.6	-39.8	174.3	0	0	0	0	0	111.8	N718 I719 R724 L725	N718-A721 HydrophobicContact CB-CB 4.16Å; N718-A721 WeakPolarHBondContact O-CB 3.37Å; N718-A721 PolarHBondContact O-N 3.29Å; N718-A721 VanDerWaalsContact O-N 3.12Å; N718-A721 PolarHBondContact OD1-N 2.91Å; I719-A721 PolarHBondContact O-N 2.91Å; A721-R724 PolarHBondContact O-N 3.1Å; A721-L725 WeakPolarHBondContact O-CB 3.39Å; A721-L725 PolarHBondContact O-N 3.12Å
722	I	90.9	Very high	81.9	Confident	7 Å²	7	57 Å²	57	4%	0.036	32%	0.318	C	S	.	.	H	α-helix	trans	-64.7	-46.2	176.9	-56.9	169.7	0	0	0	110.1	Y654 F661 L684 K717 N718 I719 L725 M726	Y654-I722 HydrophobicContact CD1-CD1 3.81Å; Y654-I722 HydrophobicContact CD2-CD1 3.8Å; Y654-I722 HydrophobicContact CD2-CG1 4.16Å; Y654-I722 HydrophobicContact CD2-CG2 4.39Å; Y654-I722 HydrophobicContact CE1-CD1 3.6Å; Y654-I722 HydrophobicContact CE1-CG1 4.42Å; Y654-I722 HydrophobicContact CE2-CD1 3.6Å; Y654-I722 HydrophobicContact CE2-CG1 3.65Å; Y654-I722 HydrophobicContact CG-CD1 3.92Å; Y654-I722 VanDerWaalsContact CZ-CD1 3.49Å; F661-I722 HydrophobicContact CE1-CG2 4.31Å; L684-I722 HydrophobicContact CD2-CB 4.31Å; L684-I722 HydrophobicContact CD2-CD1 4.06Å; L684-I722 HydrophobicContact CD2-CG2 4.04Å; K717-I722 HydrophobicContact CD-CD1 4.11Å; K717-I722 HydrophobicContact CG-CD1 4.39Å; N718-I722 PolarHBondContact O-N 3.25Å; I719-I722 WeakPolarHBondContact O-CB 3.45Å; I719-I722 PolarHBondContact O-N 2.79Å; I722-L725 PolarHBondContact O-N 3.38Å; I722-M726 HydrophobicContact CG2-SD 4.4Å; I722-M726 WeakPolarHBondContact O-CG 3.37Å; I722-M726 PolarHBondContact O-N 3.21Å
723	F	93.6	Very high	84	Confident	10 Å²	10	51.3 Å²	51.3	4%	0.044	29%	0.289	C	S	.	.	H	α-helix	trans	-63.3	-41.9	178.2	-68.3	-17.9	0	0	0	112.6	I681 L684 I719 M726 L727 L746 K749 L750	I681-F723 HydrophobicContact CB-CE1 4.27Å; I681-F723 HydrophobicContact CG1-CE1 4.38Å; I681-F723 HydrophobicContact CG2-CD1 4.27Å; I681-F723 HydrophobicContact CG2-CE1 3.69Å; I681-F723 HydrophobicContact CG2-CZ 3.93Å; L684-F723 HydrophobicContact CB-CE1 4.27Å; L684-F723 HydrophobicContact CB-CZ 4.32Å; L684-F723 HydrophobicContact CD2-CD1 4.23Å; L684-F723 HydrophobicContact CD2-CE1 3.55Å; L684-F723 HydrophobicContact CD2-CZ 4.12Å; I719-F723 HydrophobicContact CG2-CD1 4.25Å; I719-F723 HydrophobicContact CG2-CD2 3.58Å; I719-F723 HydrophobicContact CG2-CE1 3.86Å; I719-F723 HydrophobicContact CG2-CE2 3.12Å; I719-F723 HydrophobicContact CG2-CG 4.13Å; I719-F723 HydrophobicContact CG2-CZ 3.28Å; I719-F723 PolarHBondContact O-N 3.31Å; F723-M726 PolarHBondContact O-N 3.43Å; F723-L727 WeakPolarHBondContact O-CB 3.25Å; F723-L727 PolarHBondContact O-N 3.07Å; F723-L746 HydrophobicContact CB-CD2 3.75Å; F723-L746 HydrophobicContact CD1-CD2 3.7Å; F723-L746 HydrophobicContact CG-CD2 3.87Å; F723-K749 HydrophobicContact CD2-CB 3.65Å; F723-K749 HydrophobicContact CE2-CB 3.52Å; F723-K749 HydrophobicContact CE2-CD 4.36Å; F723-K749 HydrophobicContact CE2-CG 3.99Å; F723-K749 HydrophobicContact CZ-CB 4.39Å; F723-K749 HydrophobicContact CZ-CG 4.45Å; F723-L750 HydrophobicContact CB-CD1 4.39Å; F723-L750 HydrophobicContact CB-CD2 3.93Å; F723-L750 HydrophobicContact CB-CG 4.09Å
724	R	93.5	Very high	85.5	Confident	127 Å²	127	54.1 Å²	54.1	48%	0.479	31%	0.306	S	S	.	.	H	α-helix	trans	-62	-46.4	173.6	-76	-178.5	-174	140.1	3.6	111.9	T720 A721 M726 L727 D728 L750	T720-R724 WeakPolarHBondContact O-CB 3.2Å; T720-R724 WeakPolarHBondContact O-CG 3.41Å; T720-R724 PolarHBondContact O-N 2.75Å; A721-R724 PolarHBondContact O-N 3.1Å; R724-M726 VanDerWaalsContact C-N 3.33Å; R724-M726 PolarHBondContact O-N 3.35Å; R724-L727 WeakPolarHBondContact O-CB 3.38Å; R724-L727 PolarHBondContact O-N 3.33Å; R724-L727 VanDerWaalsContact O-N 3.1Å; R724-D728 VanDerWaalsContact O-CG 3.26Å; R724-D728 PolarHBondContact O-N 3.27Å; R724-L750 HydrophobicContact CG-CD1 3.86Å; R724-L750 HydrophobicContact CG-CD2 3.77Å
725	L	92.7	Very high	86.8	Confident	55 Å²	55	54 Å²	54	29%	0.288	30%	0.302	S	S	.	.	H	α-helix	trans	-61.5	-40.9	179.2	-177.1	143.7	0	0	0	112.2	Q662 V665 A721 I722 E729	Q662-L725 HydrophobicContact CG-CD1 4.4Å; V665-L725 HydrophobicContact CB-CD2 3.72Å; V665-L725 HydrophobicContact CG1-CD2 3.81Å; V665-L725 HydrophobicContact CG2-CD2 3.29Å; A721-L725 WeakPolarHBondContact O-CB 3.39Å; A721-L725 PolarHBondContact O-N 3.12Å; I722-L725 PolarHBondContact O-N 3.38Å; L725-E729 PolarHBondContact O-N 3.37Å; L725-E729 VanDerWaalsContact O-N 3.12Å
726	M	93.5	Very high	87.8	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-64.4	-41.7	173	-71.8	-177.3	70.6	0	0	112.1	V665 F668 L677 F680 I681 I722 F723 R724 E729 I730 L746	V665-M726 HydrophobicContact CG1-CG 3.96Å; F668-M726 HydrophobicContact CD1-CE 4.44Å; F668-M726 HydrophobicContact CE1-CE 3.94Å; L677-M726 HydrophobicContact CD2-CE 4.04Å; F680-M726 HydrophobicContact CD1-CE 4.34Å; F680-M726 HydrophobicContact CD1-SD 4.26Å; F680-M726 HydrophobicContact CE1-CE 4.47Å; F680-M726 HydrophobicContact CE1-SD 3.88Å; I681-M726 HydrophobicContact CD1-CE 4Å; I681-M726 HydrophobicContact CG1-CE 4.09Å; I681-M726 HydrophobicContact CG1-SD 4.33Å; I722-M726 HydrophobicContact CG2-SD 4.4Å; I722-M726 WeakPolarHBondContact O-CG 3.37Å; I722-M726 PolarHBondContact O-N 3.21Å; F723-M726 PolarHBondContact O-N 3.43Å; R724-M726 VanDerWaalsContact C-N 3.33Å; R724-M726 PolarHBondContact O-N 3.35Å; M726-E729 PolarHBondContact O-N 3.44Å; M726-I730 VanDerWaalsContact O-CG1 3.26Å; M726-I730 WeakPolarHBondContact O-CG1 3.32Å; M726-I730 PolarHBondContact O-N 3.38Å; M726-L746 HydrophobicContact CB-CD1 4Å; M726-L746 HydrophobicContact CB-CD2 4.36Å
727	L	92.8	Very high	88.6	Confident	8 Å²	8	54.1 Å²	54.1	4%	0.042	29%	0.286	C	S	.	.	H	α-helix	trans	-64.8	-45.4	179.5	-176.4	65.3	0	0	0	111.5	F723 R724 E729 I730 Q731 A743 L746 H747 L750	F723-L727 WeakPolarHBondContact O-CB 3.25Å; F723-L727 PolarHBondContact O-N 3.07Å; R724-L727 WeakPolarHBondContact O-CB 3.38Å; R724-L727 PolarHBondContact O-N 3.33Å; R724-L727 VanDerWaalsContact O-N 3.1Å; L727-E729 PolarHBondContact O-N 2.93Å; L727-I730 PolarHBondContact O-N 3.07Å; L727-Q731 WeakPolarHBondContact O-CG 3.43Å; L727-Q731 PolarHBondContact O-N 3.25Å; L727-A743 HydrophobicContact CD1-CB 4.09Å; L727-L746 HydrophobicContact CB-CB 4.44Å; L727-L746 HydrophobicContact CB-CD1 4.07Å; L727-L746 HydrophobicContact CD1-CB 4.23Å; L727-L746 HydrophobicContact CD1-CD1 4.31Å; L727-H747 VanDerWaalsContact CD2-CE1 3.5Å; L727-H747 WeakPolarHBondContact CD2-CE1 3.42Å; L727-L750 HydrophobicContact CD2-CD1 3.95Å
728	D	92.7	Very high	88.8	Confident	97 Å²	97	55.6 Å²	55.6	52%	0.519	30%	0.299	S	S	.	.	H	α-helix	trans	-61.3	-43.5	177.9	-67.8	-19.2	0	0	0	111.1	R724 Q731 A732	R724-D728 VanDerWaalsContact O-CG 3.26Å; R724-D728 PolarHBondContact O-N 3.27Å; D728-Q731 PolarHBondContact O-N 2.98Å; D728-A732 WeakPolarHBondContact O-CB 3.32Å; D728-A732 PolarHBondContact O-N 2.96Å
729	E	92	Very high	88.9	Confident	51 Å²	51	51.4 Å²	51.4	24%	0.238	28%	0.276	C	S	.	.	H	α-helix	trans	-65.5	-40.5	174.9	-79.7	-63	151.7	0	0	112.4	R666 I669 L725 M726 L727 A732 L733	R666-E729 IonicContact CZ-OE2 3.05Å; R666-E729 VanDerWaalsContact CZ-OE2 3.23Å; R666-E729 IonicContact NE-OE2 3.87Å; R666-E729 PolarHBondContact NE-OE2 3.08Å; R666-E729 IonicContact NH2-OE1 2.97Å; R666-E729 PolarHBondContact NH2-OE1 3.3Å; R666-E729 IonicContact NH2-OE2 3.71Å; R666-E729 PolarHBondContact NH2-OE2 3.19Å; I669-E729 HydrophobicContact CD1-CB 3.81Å; L725-E729 PolarHBondContact O-N 3.37Å; L725-E729 VanDerWaalsContact O-N 3.12Å; M726-E729 PolarHBondContact O-N 3.44Å; L727-E729 PolarHBondContact O-N 2.93Å; E729-A732 PolarHBondContact O-N 2.99Å; E729-L733 WeakPolarHBondContact O-CG 3.06Å; E729-L733 PolarHBondContact O-N 3.46Å
730	I	91.1	Very high	88.9	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.5	-45	174.4	-71.3	167.7	0	0	0	110.4	I669 M726 L727 A732 L733 R736 F739 V742 A743 L746	I669-I730 HydrophobicContact CD1-CG1 3.91Å; I669-I730 HydrophobicContact CG1-CG1 4.5Å; I669-I730 HydrophobicContact CG2-CG1 4.11Å; M726-I730 VanDerWaalsContact O-CG1 3.26Å; M726-I730 WeakPolarHBondContact O-CG1 3.32Å; M726-I730 PolarHBondContact O-N 3.38Å; L727-I730 PolarHBondContact O-N 3.07Å; I730-A732 VanDerWaalsContact C-N 3.29Å; I730-A732 PolarHBondContact O-N 3Å; I730-L733 WeakPolarHBondContact O-CB 3.33Å; I730-L733 PolarHBondContact O-N 3.34Å; I730-L733 VanDerWaalsContact O-N 3.16Å; I730-R736 HydrophobicContact CG2-CB 4.38Å; I730-R736 WeakPolarHBondContact O-CB 3.33Å; I730-F739 HydrophobicContact CD1-CB 4.33Å; I730-F739 HydrophobicContact CG1-CB 4.36Å; I730-F739 HydrophobicContact CG2-CB 3.85Å; I730-V742 HydrophobicContact CD1-CB 4.34Å; I730-V742 HydrophobicContact CD1-CG1 3.81Å; I730-A743 HydrophobicContact CG2-CB 4.32Å; I730-L746 HydrophobicContact CD1-CD1 3.75Å
731	Q	87.9	Confident	88.9	Confident	81 Å²	81	49.5 Å²	49.5	38%	0.379	26%	0.264	S	S	.	.	H	α-helix	trans	-65.1	-33.1	179.5	-72.3	-179.1	-2.5	0	0	112.4	L727 D728 L733	L727-Q731 WeakPolarHBondContact O-CG 3.43Å; L727-Q731 PolarHBondContact O-N 3.25Å; D728-Q731 PolarHBondContact O-N 2.98Å; Q731-L733 VanDerWaalsContact C-N 3.31Å; Q731-L733 PolarHBondContact O-N 3.34Å
732	A	89.9	Confident	89	Confident	66 Å²	66	47.2 Å²	47.2	55%	0.545	25%	0.245	S	C	.	.	H	α-helix	trans	-73.5	-16.8	175.5	0	0	0	0	0	114	D728 E729 I730	D728-A732 WeakPolarHBondContact O-CB 3.32Å; D728-A732 PolarHBondContact O-N 2.96Å; E729-A732 PolarHBondContact O-N 2.99Å; I730-A732 VanDerWaalsContact C-N 3.29Å; I730-A732 PolarHBondContact O-N 3Å
733	L	87.7	Confident	89	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.016	24%	0.243	C	C	.	.	S	Bend	trans	-75.1	139.5	-179.2	-76.6	170.4	0	0	0	112.2	R666 I669 R670 E729 I730 Q731 E735 R736 F739	R666-L733 HydrophobicContact CG-CD2 4.03Å; I669-L733 HydrophobicContact CG2-CD1 3.92Å; R670-L733 VanDerWaalsContact NH2-CD2 3.27Å; E729-L733 WeakPolarHBondContact O-CG 3.06Å; E729-L733 PolarHBondContact O-N 3.46Å; I730-L733 WeakPolarHBondContact O-CB 3.33Å; I730-L733 PolarHBondContact O-N 3.34Å; I730-L733 VanDerWaalsContact O-N 3.16Å; Q731-L733 VanDerWaalsContact C-N 3.31Å; Q731-L733 PolarHBondContact O-N 3.34Å; L733-E735 PolarHBondContact O-N 3.08Å; L733-R736 WeakPolarHBondContact O-CB 3.26Å; L733-R736 PolarHBondContact O-N 3.38Å; L733-F739 HydrophobicContact CD1-CD2 4.37Å; L733-F739 HydrophobicContact CD1-CE2 4.14Å
734	P	83.3	Confident	88.9	Confident	104 Å²	104	46.4 Å²	46.4	68%	0.675	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-29.8	174	24.6	-32.1	0	0	0	112.3	R736	P734-R736 VanDerWaalsContact C-N 3.33Å
735	E	83.8	Confident	88.9	Confident	122 Å²	122	40.4 Å²	40.4	57%	0.57	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.8	17.3	179.4	-64.1	171	-155.8	0	0	112.9	L733 N737 S738	L733-E735 PolarHBondContact O-N 3.08Å; E735-N737 PolarHBondContact O-N 3.4Å; E735-S738 WeakPolarHBondContact O-CB 3.47Å; E735-S738 PolarHBondContact O-N 3.05Å; E735-S738 PolarHBondContact O-OG 3.15Å
736	R	82.3	Confident	88.9	Confident	92 Å²	92	37.8 Å²	37.8	35%	0.347	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-47.5	-31	-174.2	66.1	-176.6	-177.5	-96.9	-0.7	115.4	I730 L733 P734 S738 F739 L740 H763	I730-R736 HydrophobicContact CG2-CB 4.38Å; I730-R736 WeakPolarHBondContact O-CB 3.33Å; L733-R736 WeakPolarHBondContact O-CB 3.26Å; L733-R736 PolarHBondContact O-N 3.38Å; P734-R736 VanDerWaalsContact C-N 3.33Å; R736-S738 PolarHBondContact O-N 3.5Å; R736-F739 CarbonylContact O-C 3.47Å; R736-F739 PolarHBondContact O-N 3.03Å; R736-L740 PolarHBondContact O-N 3.04Å; R736-H763 PolarHBondContact NE-NE2 3.35Å; R736-H763 PolarHBondContact NH2-NE2 2.87Å
737	N	81.5	Confident	88.9	Confident	63 Å²	63	38 Å²	38	34%	0.337	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-63.8	-24.7	177.9	-64.5	-7.5	0	0	0	113.3	E735 F739 L740 H763	E735-N737 PolarHBondContact O-N 3.4Å; N737-F739 VanDerWaalsContact C-N 3.27Å; N737-L740 WeakPolarHBondContact O-CB 3.46Å; N737-H763 PolarHBondContact OD1-CD2 3.03Å
738	S	84.2	Confident	88.9	Confident	49 Å²	49	38.7 Å²	38.7	34%	0.343	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-70	-27.6	174	69.9	0	0	0	0	111.6	N674 E735 R736	N674-S738 PolarHBondContact ND2-O 3.48Å; N674-S738 PolarHBondContact OD1-O 2.99Å; E735-S738 WeakPolarHBondContact O-CB 3.47Å; E735-S738 PolarHBondContact O-N 3.05Å; E735-S738 PolarHBondContact O-OG 3.15Å; R736-S738 PolarHBondContact O-N 3.5Å
739	F	86.8	Confident	88.8	Confident	12 Å²	12	38.3 Å²	38.3	5%	0.053	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-98.5	18.2	179.4	-59	-76.5	0	0	0	113.1	I669 N674 L677 I730 L733 R736 N737 L741 V742 A743	I669-F739 HydrophobicContact CG2-CD1 3.9Å; I669-F739 HydrophobicContact CG2-CD2 4.18Å; I669-F739 HydrophobicContact CG2-CE1 3.63Å; I669-F739 HydrophobicContact CG2-CE2 3.94Å; I669-F739 HydrophobicContact CG2-CG 4.16Å; I669-F739 HydrophobicContact CG2-CZ 3.67Å; I669-F739 VanDerWaalsContact O-CE1 3.31Å; I669-F739 WeakPolarHBondContact O-CE1 3.43Å; N674-F739 VanDerWaalsContact OD1-CD1 3.23Å; N674-F739 WeakPolarHBondContact OD1-CD1 3.04Å; L677-F739 HydrophobicContact CD1-CD1 3.81Å; L677-F739 HydrophobicContact CD1-CE1 3.8Å; I730-F739 HydrophobicContact CD1-CB 4.33Å; I730-F739 HydrophobicContact CG1-CB 4.36Å; I730-F739 HydrophobicContact CG2-CB 3.85Å; L733-F739 HydrophobicContact CD1-CD2 4.37Å; L733-F739 HydrophobicContact CD1-CE2 4.14Å; R736-F739 CarbonylContact O-C 3.47Å; R736-F739 PolarHBondContact O-N 3.03Å; N737-F739 VanDerWaalsContact C-N 3.27Å; F739-L741 VanDerWaalsContact C-N 3.34Å; F739-L741 PolarHBondContact O-N 3.28Å; F739-V742 HydrophobicContact CB-CB 4.44Å; F739-V742 WeakPolarHBondContact O-CB 3.39Å; F739-V742 PolarHBondContact O-N 3.48Å; F739-A743 PolarHBondContact O-N 3.19Å
740	L	88.1	Confident	88.8	Confident	5 Å²	5	36.8 Å²	36.8	3%	0.026	20%	0.196	C	C	.	.	H	α-helix	trans	-53.1	-48.3	-175.4	179.4	59.5	0	0	0	112.4	R736 N737 V742 A743 L744 F759 L760 H763 C771	R736-L740 PolarHBondContact O-N 3.04Å; N737-L740 WeakPolarHBondContact O-CB 3.46Å; L740-V742 VanDerWaalsContact C-N 3.3Å; L740-V742 PolarHBondContact O-N 2.99Å; L740-A743 PolarHBondContact O-N 3.24Å; L740-L744 WeakPolarHBondContact O-CG 3.41Å; L740-L744 PolarHBondContact O-N 2.83Å; L740-F759 HydrophobicContact CD1-CD1 3.61Å; L740-F759 HydrophobicContact CD1-CE1 3.47Å; L740-F759 VanDerWaalsContact CD1-CE1 3.47Å; L740-L760 HydrophobicContact CD1-CD1 4.46Å; L740-L760 HydrophobicContact CD2-CD1 3.92Å; L740-L760 HydrophobicContact CG-CD1 4.39Å; L740-H763 HydrophobicContact CD1-CB 4.4Å; L740-C771 HydrophobicContact CD2-CB 4.11Å
741	L	89.4	Confident	88.7	Confident	40 Å²	40	45.7 Å²	45.7	21%	0.209	24%	0.238	C	C	.	.	H	α-helix	trans	-62.1	-37.7	179.6	-62.5	-175.9	0	0	0	112.8	F739 L744 L745 C771 H779	F739-L741 VanDerWaalsContact C-N 3.34Å; F739-L741 PolarHBondContact O-N 3.28Å; L741-L744 HydrophobicContact CD2-CD1 4.29Å; L741-L744 PolarHBondContact O-N 3.09Å; L741-L745 PolarHBondContact O-N 3.35Å; L741-L745 VanDerWaalsContact O-N 3.09Å; L741-C771 VanDerWaalsContact CD2-SG 3.54Å; L741-H779 HydrophobicContact CD2-CB 3.7Å; L741-H779 PolarHBondContact O-CE1 2.97Å; L741-H779 PolarHBondContact O-ND1 3.42Å
742	V	91.4	Very high	88.8	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-66.4	-44.4	176.9	-177.4	0	0	0	0	110.1	N674 L677 I681 I730 F739 L740 L744 L745 L746	N674-V742 HydrophobicContact CB-CG2 4.16Å; L677-V742 HydrophobicContact CB-CG1 4.04Å; L677-V742 HydrophobicContact CB-CG2 3.98Å; L677-V742 HydrophobicContact CD1-CG1 4.41Å; L677-V742 HydrophobicContact CD1-CG2 4.3Å; I681-V742 HydrophobicContact CD1-CG1 3.44Å; I681-V742 VanDerWaalsContact CD1-CG1 3.44Å; I730-V742 HydrophobicContact CD1-CB 4.34Å; I730-V742 HydrophobicContact CD1-CG1 3.81Å; F739-V742 HydrophobicContact CB-CB 4.44Å; F739-V742 WeakPolarHBondContact O-CB 3.39Å; F739-V742 PolarHBondContact O-N 3.48Å; L740-V742 VanDerWaalsContact C-N 3.3Å; L740-V742 PolarHBondContact O-N 2.99Å; V742-L744 VanDerWaalsContact C-N 3.33Å; V742-L744 PolarHBondContact O-N 2.93Å; V742-L745 PolarHBondContact O-N 3.03Å; V742-L746 HydrophobicContact CG1-CD1 4.31Å; V742-L746 WeakPolarHBondContact O-CG 3.46Å; V742-L746 PolarHBondContact O-N 2.89Å
743	A	91.7	Very high	88.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.5	-40	176	0	0	0	0	0	112.2	L727 I730 F739 L740 L746 H747 F759	L727-A743 HydrophobicContact CD1-CB 4.09Å; I730-A743 HydrophobicContact CG2-CB 4.32Å; F739-A743 PolarHBondContact O-N 3.19Å; L740-A743 PolarHBondContact O-N 3.24Å; A743-L746 PolarHBondContact O-N 2.92Å; A743-H747 PolarHBondContact O-CD2 2.92Å; A743-H747 PolarHBondContact O-N 3.17Å; A743-F759 HydrophobicContact CB-CD1 4.27Å; A743-F759 HydrophobicContact CB-CE1 3.72Å; A743-F759 HydrophobicContact CB-CZ 4.42Å
744	L	91.5	Very high	89	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61.4	-45.8	174.5	-64.3	174.8	0	0	0	111.7	L740 L741 V742 L746 H747 I748 G756 L760 M780	L740-L744 WeakPolarHBondContact O-CG 3.41Å; L740-L744 PolarHBondContact O-N 2.83Å; L741-L744 HydrophobicContact CD2-CD1 4.29Å; L741-L744 PolarHBondContact O-N 3.09Å; V742-L744 VanDerWaalsContact C-N 3.33Å; V742-L744 PolarHBondContact O-N 2.93Å; L744-L746 VanDerWaalsContact C-N 3.33Å; L744-L746 PolarHBondContact O-N 2.9Å; L744-H747 PolarHBondContact O-N 3.35Å; L744-I748 VanDerWaalsContact O-CG1 3.31Å; L744-I748 WeakPolarHBondContact O-CG1 3.45Å; L744-I748 PolarHBondContact O-N 2.92Å; L744-G756 WeakPolarHBondContact CD2-O 3.48Å; L744-L760 HydrophobicContact CD1-CD1 4.18Å; L744-L760 HydrophobicContact CD1-CD2 4.44Å; L744-L760 HydrophobicContact CD2-CB 3.97Å; L744-M780 HydrophobicContact CB-CG 4.22Å; L744-M780 HydrophobicContact CD1-CG 4.21Å; L744-M780 HydrophobicContact CD1-SD 4.5Å; L744-M780 HydrophobicContact CD2-SD 4.19Å
745	L	92.5	Very high	89.3	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.3	-41.9	176.7	176.8	58	0	0	0	111.8	N678 I681 L741 V742 I748 K749 F783	N678-L745 HydrophobicContact CB-CD2 4.39Å; I681-L745 HydrophobicContact CB-CD2 3.92Å; I681-L745 HydrophobicContact CB-CG 4.48Å; I681-L745 HydrophobicContact CG2-CD2 3.68Å; I681-L745 HydrophobicContact CG2-CG 3.72Å; L741-L745 PolarHBondContact O-N 3.35Å; L741-L745 VanDerWaalsContact O-N 3.09Å; V742-L745 PolarHBondContact O-N 3.03Å; L745-I748 PolarHBondContact O-N 3.25Å; L745-K749 HydrophobicContact CD1-CG 3.99Å; L745-K749 HydrophobicContact CG-CG 4.39Å; L745-K749 WeakPolarHBondContact O-CB 3.27Å; L745-K749 VanDerWaalsContact O-CG 3.31Å; L745-K749 WeakPolarHBondContact O-CG 3.12Å; L745-K749 PolarHBondContact O-N 3Å; L745-F783 HydrophobicContact CD1-CB 4.38Å; L745-F783 HydrophobicContact CD1-CD1 3.65Å; L745-F783 HydrophobicContact CD1-CD2 3.66Å; L745-F783 HydrophobicContact CD1-CE1 3.7Å; L745-F783 HydrophobicContact CD1-CE2 3.72Å; L745-F783 HydrophobicContact CD1-CG 3.62Å; L745-F783 HydrophobicContact CD1-CZ 3.74Å; L745-F783 HydrophobicContact CD2-CE1 4.39Å; L745-F783 HydrophobicContact CD2-CE2 4.35Å; L745-F783 HydrophobicContact CD2-CZ 3.98Å; L745-F783 HydrophobicContact CG-CE2 4.46Å; L745-F783 HydrophobicContact CG-CZ 4.44Å
746	L	93.3	Very high	89.6	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-60.5	-45.3	175.5	-70.6	168.4	0	0	0	111.7	I681 F723 M726 L727 I730 V742 A743 L744 I748 K749 L750	I681-L746 HydrophobicContact CD1-CD1 4.37Å; I681-L746 HydrophobicContact CD1-CD2 3.75Å; I681-L746 HydrophobicContact CD1-CG 3.9Å; I681-L746 HydrophobicContact CG1-CD2 4.06Å; I681-L746 HydrophobicContact CG2-CD2 4.14Å; F723-L746 HydrophobicContact CB-CD2 3.75Å; F723-L746 HydrophobicContact CD1-CD2 3.7Å; F723-L746 HydrophobicContact CG-CD2 3.87Å; M726-L746 HydrophobicContact CB-CD1 4Å; M726-L746 HydrophobicContact CB-CD2 4.36Å; L727-L746 HydrophobicContact CB-CB 4.44Å; L727-L746 HydrophobicContact CB-CD1 4.07Å; L727-L746 HydrophobicContact CD1-CB 4.23Å; L727-L746 HydrophobicContact CD1-CD1 4.31Å; I730-L746 HydrophobicContact CD1-CD1 3.75Å; V742-L746 HydrophobicContact CG1-CD1 4.31Å; V742-L746 WeakPolarHBondContact O-CG 3.46Å; V742-L746 PolarHBondContact O-N 2.89Å; A743-L746 PolarHBondContact O-N 2.92Å; L744-L746 VanDerWaalsContact C-N 3.33Å; L744-L746 PolarHBondContact O-N 2.9Å; L746-I748 VanDerWaalsContact C-N 3.33Å; L746-I748 PolarHBondContact O-N 3.15Å; L746-K749 PolarHBondContact O-N 3.43Å; L746-L750 WeakPolarHBondContact O-CB 3.4Å; L746-L750 VanDerWaalsContact O-CG 3.26Å; L746-L750 WeakPolarHBondContact O-CG 3.47Å; L746-L750 PolarHBondContact O-N 3.02Å
747	H	92.8	Very high	90	Very high	6 Å²	6	34.2 Å²	34.2	3%	0.028	17%	0.168	C	C	.	.	H	α-helix	trans	-61.2	-39.5	175.8	-81.3	-63.5	0	0	0	112.7	L727 A743 L744 L750 E751 E752	L727-H747 VanDerWaalsContact CD2-CE1 3.5Å; L727-H747 WeakPolarHBondContact CD2-CE1 3.42Å; A743-H747 PolarHBondContact O-CD2 2.92Å; A743-H747 PolarHBondContact O-N 3.17Å; L744-H747 PolarHBondContact O-N 3.35Å; H747-L750 PolarHBondContact O-N 3.35Å; H747-E751 PolarHBondContact O-N 3.45Å; H747-E752 CarbonylContact O-C 3.52Å; H747-E752 PolarHBondContact O-N 3.1Å
748	I	92.1	Very high	90.4	Very high	21 Å²	21	34.2 Å²	34.2	11%	0.108	17%	0.168	C	C	.	.	H	α-helix	trans	-62.9	-49.4	174.5	-66.3	173.7	0	0	0	110.5	L744 L745 L746 L750 E751 M780 F783 M784	L744-I748 VanDerWaalsContact O-CG1 3.31Å; L744-I748 WeakPolarHBondContact O-CG1 3.45Å; L744-I748 PolarHBondContact O-N 2.92Å; L745-I748 PolarHBondContact O-N 3.25Å; L746-I748 VanDerWaalsContact C-N 3.33Å; L746-I748 PolarHBondContact O-N 3.15Å; I748-L750 PolarHBondContact O-N 3.21Å; I748-E751 PolarHBondContact O-N 3.39Å; I748-M780 HydrophobicContact CD1-CB 3.84Å; I748-M780 HydrophobicContact CD1-CE 3.96Å; I748-M780 HydrophobicContact CD1-CG 3.87Å; I748-M780 HydrophobicContact CG1-CE 3.95Å; I748-F783 HydrophobicContact CD1-CB 4.2Å; I748-F783 HydrophobicContact CG2-CB 4.1Å; I748-M784 HydrophobicContact CB-SD 4.28Å; I748-M784 HydrophobicContact CD1-CG 4.06Å; I748-M784 HydrophobicContact CD1-SD 3.89Å; I748-M784 HydrophobicContact CG1-CG 4.19Å; I748-M784 HydrophobicContact CG1-SD 3.6Å; I748-M784 VanDerWaalsContact CG1-SD 3.6Å; I748-M784 HydrophobicContact CG2-CG 3.6Å; I748-M784 HydrophobicContact CG2-SD 3.88Å
749	K	91.2	Very high	90.5	Very high	90 Å²	90	32.7 Å²	32.7	39%	0.391	16%	0.155	S	C	.	.	H	α-helix	trans	-66.2	-20.1	-179.4	-69.2	-67.7	-174.5	179	0	113.6	I681 F723 L745 L746	I681-K749 HydrophobicContact CG2-CG 4.21Å; F723-K749 HydrophobicContact CD2-CB 3.65Å; F723-K749 HydrophobicContact CE2-CB 3.52Å; F723-K749 HydrophobicContact CE2-CD 4.36Å; F723-K749 HydrophobicContact CE2-CG 3.99Å; F723-K749 HydrophobicContact CZ-CB 4.39Å; F723-K749 HydrophobicContact CZ-CG 4.45Å; L745-K749 HydrophobicContact CD1-CG 3.99Å; L745-K749 HydrophobicContact CG-CG 4.39Å; L745-K749 WeakPolarHBondContact O-CB 3.27Å; L745-K749 VanDerWaalsContact O-CG 3.31Å; L745-K749 WeakPolarHBondContact O-CG 3.12Å; L745-K749 PolarHBondContact O-N 3Å; L746-K749 PolarHBondContact O-N 3.43Å
750	L	92.5	Very high	90.6	Very high	18 Å²	18	32.1 Å²	32.1	9%	0.094	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	2.3	173.6	-70.6	171.1	0	0	0	113.7	F723 R724 L727 L746 H747 I748 E752	F723-L750 HydrophobicContact CB-CD1 4.39Å; F723-L750 HydrophobicContact CB-CD2 3.93Å; F723-L750 HydrophobicContact CB-CG 4.09Å; R724-L750 HydrophobicContact CG-CD1 3.86Å; R724-L750 HydrophobicContact CG-CD2 3.77Å; L727-L750 HydrophobicContact CD2-CD1 3.95Å; L746-L750 WeakPolarHBondContact O-CB 3.4Å; L746-L750 VanDerWaalsContact O-CG 3.26Å; L746-L750 WeakPolarHBondContact O-CG 3.47Å; L746-L750 PolarHBondContact O-N 3.02Å; H747-L750 PolarHBondContact O-N 3.35Å; I748-L750 PolarHBondContact O-N 3.21Å; L750-E752 HydrophobicContact CB-CG 4.27Å; L750-E752 PolarHBondContact O-N 3.38Å
751	E	88.9	Confident	90.6	Very high	188 Å²	188	35.3 Å²	35.3	88%	0.879	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.9	27.7	-174.5	-56.2	179.9	179.7	0	0	113.7	H747 I748	H747-E751 PolarHBondContact O-N 3.45Å; I748-E751 PolarHBondContact O-N 3.39Å
752	E	90.8	Very high	90.3	Very high	52 Å²	52	39.7 Å²	39.7	24%	0.243	19%	0.186	C	C	.	.			trans	-115.2	42	-178.6	-57.7	-169.5	154.8	0	0	112	H747 L750 E754 K755 G756	H747-E752 CarbonylContact O-C 3.52Å; H747-E752 PolarHBondContact O-N 3.1Å; L750-E752 HydrophobicContact CB-CG 4.27Å; L750-E752 PolarHBondContact O-N 3.38Å; E752-E754 PolarHBondContact O-N 3.14Å; E752-E754 VanDerWaalsContact O-N 3.13Å; E752-K755 HydrophobicContact CB-CB 4.42Å; E752-K755 HydrophobicContact CB-CD 4.3Å; E752-K755 HydrophobicContact CB-CG 4.39Å; E752-K755 PolarHBondContact O-N 3.06Å; E752-K755 IonicContact OE1-NZ 3.81Å; E752-K755 PolarHBondContact OE1-NZ 2.96Å; E752-K755 WeakPolarHBondContact OE2-CD 3.45Å; E752-K755 WeakPolarHBondContact OE2-CE 3.39Å; E752-K755 IonicContact OE2-NZ 3.22Å; E752-K755 PolarHBondContact OE2-NZ 3.47Å; E752-G756 PolarHBondContact O-N 3.45Å; E752-G756 VanDerWaalsContact O-N 3.15Å
753	A	89.7	Confident	89.7	Confident	12 Å²	12	40.9 Å²	40.9	10%	0.099	19%	0.191	C	C	.	.	H	α-helix	trans	-55.8	-32.2	-176	0	0	0	0	0	113.5	G756 L757 M784 A792	A753-G756 PolarHBondContact O-N 2.9Å; A753-L757 WeakPolarHBondContact O-CG 3.43Å; A753-L757 PolarHBondContact O-N 2.86Å; A753-M784 HydrophobicContact CB-CE 3.75Å; A753-M784 HydrophobicContact CB-SD 3.78Å; A753-A792 HydrophobicContact CB-CB 3.97Å
754	E	91	Very high	88.9	Confident	57 Å²	57	41.8 Å²	41.8	27%	0.266	20%	0.197	S	C	.	.	H	α-helix	trans	-60.8	-44.3	175.7	-55.6	-176.2	169.5	0	0	112.2	E752 G756 L757 L758 A792 T796 R841	E752-E754 PolarHBondContact O-N 3.14Å; E752-E754 VanDerWaalsContact O-N 3.13Å; E754-G756 VanDerWaalsContact C-N 3.32Å; E754-L757 PolarHBondContact O-N 2.93Å; E754-L758 WeakPolarHBondContact O-CG 3.43Å; E754-L758 PolarHBondContact O-N 3.4Å; E754-A792 HydrophobicContact CG-CB 4.3Å; E754-T796 HydrophobicContact CB-CG2 4.27Å; E754-R841 IonicContact OE1-CZ 2.58Å; E754-R841 IonicContact OE1-NH1 2.73Å; E754-R841 PolarHBondContact OE1-NH1 3.48Å; E754-R841 IonicContact OE1-NH2 2.84Å; E754-R841 PolarHBondContact OE1-NH2 2.98Å; E754-R841 IonicContact OE2-NH1 3.2Å
755	K	90.3	Very high	87.7	Confident	106 Å²	106	47.7 Å²	47.7	46%	0.461	23%	0.225	S	C	.	.	H	α-helix	trans	-67.5	-37.6	175.7	-60.3	-171.4	-160.8	161.7	0	110.7	E752 L757 L758 F759	E752-K755 HydrophobicContact CB-CB 4.42Å; E752-K755 HydrophobicContact CB-CD 4.3Å; E752-K755 HydrophobicContact CB-CG 4.39Å; E752-K755 PolarHBondContact O-N 3.06Å; E752-K755 IonicContact OE1-NZ 3.81Å; E752-K755 PolarHBondContact OE1-NZ 2.96Å; E752-K755 WeakPolarHBondContact OE2-CD 3.45Å; E752-K755 WeakPolarHBondContact OE2-CE 3.39Å; E752-K755 IonicContact OE2-NZ 3.22Å; E752-K755 PolarHBondContact OE2-NZ 3.47Å; K755-L757 VanDerWaalsContact C-N 3.35Å; K755-L757 PolarHBondContact O-N 2.96Å; K755-L758 PolarHBondContact O-N 3.17Å; K755-F759 VanDerWaalsContact O-CB 3.23Å; K755-F759 WeakPolarHBondContact O-CB 3.42Å; K755-F759 PolarHBondContact O-N 3.34Å
756	G	89.1	Confident	86.1	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59.3	-42.7	173.2	0	0	0	0	0	112.8	L744 E752 A753 E754 F759 L760	L744-G756 WeakPolarHBondContact CD2-O 3.48Å; E752-G756 PolarHBondContact O-N 3.45Å; E752-G756 VanDerWaalsContact O-N 3.15Å; A753-G756 PolarHBondContact O-N 2.9Å; E754-G756 VanDerWaalsContact C-N 3.32Å; G756-F759 PolarHBondContact O-N 3.4Å; G756-L760 WeakPolarHBondContact O-CB 3.44Å; G756-L760 PolarHBondContact O-N 2.72Å
757	L	90.6	Very high	84.2	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-67.9	-41.3	176.7	-75.5	173.7	0	0	0	112.7	A753 E754 K755 F759 L760 K761 I777 M780 L789 A792 A793 L801 V805	A753-L757 WeakPolarHBondContact O-CG 3.43Å; A753-L757 PolarHBondContact O-N 2.86Å; E754-L757 PolarHBondContact O-N 2.93Å; K755-L757 VanDerWaalsContact C-N 3.35Å; K755-L757 PolarHBondContact O-N 2.96Å; L757-F759 VanDerWaalsContact C-N 3.35Å; L757-L760 WeakPolarHBondContact O-CB 3.12Å; L757-L760 PolarHBondContact O-N 3.2Å; L757-K761 PolarHBondContact O-N 2.91Å; L757-I777 HydrophobicContact CD2-CD1 3.7Å; L757-M780 HydrophobicContact CD2-CE 4.25Å; L757-M780 HydrophobicContact CD2-SD 3.83Å; L757-M780 HydrophobicContact CG-CE 4.21Å; L757-M780 HydrophobicContact CG-SD 4.39Å; L757-L789 HydrophobicContact CD1-CD1 4.23Å; L757-L789 HydrophobicContact CD2-CD1 3.99Å; L757-L789 HydrophobicContact CG-CD1 4.33Å; L757-A792 HydrophobicContact CD1-CB 3.93Å; L757-A793 HydrophobicContact CD1-CB 3.85Å; L757-L801 HydrophobicContact CB-CD2 4.26Å; L757-V805 HydrophobicContact CD2-CG2 4.03Å
758	L	90	Very high	82.5	Confident	63 Å²	63	68.1 Å²	68.1	33%	0.33	32%	0.322	S	S	.	.	H	α-helix	trans	-62.3	-44.2	172.7	-70.9	172.5	0	0	0	111	E754 K755 L760 K761 E762 T796 L801	E754-L758 WeakPolarHBondContact O-CG 3.43Å; E754-L758 PolarHBondContact O-N 3.4Å; K755-L758 PolarHBondContact O-N 3.17Å; L758-L760 VanDerWaalsContact C-N 3.32Å; L758-L760 PolarHBondContact O-N 3.06Å; L758-K761 WeakPolarHBondContact O-CB 3.33Å; L758-K761 PolarHBondContact O-N 3.34Å; L758-K761 VanDerWaalsContact O-N 3.14Å; L758-E762 WeakPolarHBondContact O-CG 3.49Å; L758-E762 PolarHBondContact O-N 3.23Å; L758-T796 HydrophobicContact CD2-CG2 4.2Å; L758-T796 HydrophobicContact CG-CG2 3.99Å; L758-L801 HydrophobicContact CD2-CD2 4.23Å
759	F	87.5	Confident	80.9	Confident	16 Å²	16	77.7 Å²	77.7	7%	0.07	36%	0.363	C	S	.	.	H	α-helix	trans	-60.2	-41.4	175.8	-173.1	-102.3	0	0	0	111.8	L740 A743 K755 G756 L757 E762 H763	L740-F759 HydrophobicContact CD1-CD1 3.61Å; L740-F759 HydrophobicContact CD1-CE1 3.47Å; L740-F759 VanDerWaalsContact CD1-CE1 3.47Å; A743-F759 HydrophobicContact CB-CD1 4.27Å; A743-F759 HydrophobicContact CB-CE1 3.72Å; A743-F759 HydrophobicContact CB-CZ 4.42Å; K755-F759 VanDerWaalsContact O-CB 3.23Å; K755-F759 WeakPolarHBondContact O-CB 3.42Å; K755-F759 PolarHBondContact O-N 3.34Å; G756-F759 PolarHBondContact O-N 3.4Å; L757-F759 VanDerWaalsContact C-N 3.35Å; F759-E762 PolarHBondContact O-N 2.84Å; F759-H763 AromaticContact CD2-CE1 3.49Å; F759-H763 VanDerWaalsContact CD2-CE1 3.49Å; F759-H763 WeakPolarHBondContact CD2-CE1 3.25Å; F759-H763 AromaticContact CD2-ND1 3.43Å; F759-H763 WeakPolarHBondContact CD2-ND1 3.49Å; F759-H763 AromaticContact CE2-CE1 3.29Å; F759-H763 WeakPolarHBondContact CE2-CE1 3.41Å; F759-H763 AromaticContact CE2-ND1 3.44Å; F759-H763 WeakPolarHBondContact CE2-ND1 3.47Å; F759-H763 AromaticContact CE2-NE2 3.86Å; F759-H763 AromaticContact CG-ND1 3.9Å; F759-H763 AromaticContact CZ-ND1 3.91Å; F759-H763 WeakPolarHBondContact O-CB 3.45Å; F759-H763 PolarHBondContact O-N 2.92Å; F759-H763 PolarHBondContact O-ND1 2.8Å
760	L	88.6	Confident	79.5	Confident	0 Å²	0	77.3 Å²	77.3	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-61.4	-44.6	173.5	-176.8	55.7	0	0	0	111.9	L740 L744 G756 L757 L758 C764 F773 I777	L740-L760 HydrophobicContact CD1-CD1 4.46Å; L740-L760 HydrophobicContact CD2-CD1 3.92Å; L740-L760 HydrophobicContact CG-CD1 4.39Å; L744-L760 HydrophobicContact CD1-CD1 4.18Å; L744-L760 HydrophobicContact CD1-CD2 4.44Å; L744-L760 HydrophobicContact CD2-CB 3.97Å; G756-L760 WeakPolarHBondContact O-CB 3.44Å; G756-L760 PolarHBondContact O-N 2.72Å; L757-L760 WeakPolarHBondContact O-CB 3.12Å; L757-L760 PolarHBondContact O-N 3.2Å; L758-L760 VanDerWaalsContact C-N 3.32Å; L758-L760 PolarHBondContact O-N 3.06Å; L760-C764 HydrophobicContact CD1-CB 4.32Å; L760-C764 WeakPolarHBondContact O-CB 3.18Å; L760-C764 PolarHBondContact O-N 3.24Å; L760-F773 HydrophobicContact CD2-CD2 3.99Å; L760-F773 HydrophobicContact CD2-CE2 3.87Å; L760-F773 HydrophobicContact CD2-CZ 4.37Å; L760-F773 HydrophobicContact CG-CD2 3.76Å; L760-F773 HydrophobicContact CG-CE2 3.84Å; L760-I777 HydrophobicContact CD2-CD1 3.8Å; L760-I777 HydrophobicContact CD2-CG1 4.12Å
761	K	86.7	Confident	78.4	Confident	72 Å²	72	76.8 Å²	76.8	31%	0.313	37%	0.37	S	S	.	.	H	α-helix	trans	-62.6	-43.1	178	-172.5	-178.4	-179	172.1	0	111.7	L757 L758 D798 L801	L757-K761 PolarHBondContact O-N 2.91Å; L758-K761 WeakPolarHBondContact O-CB 3.33Å; L758-K761 PolarHBondContact O-N 3.34Å; L758-K761 VanDerWaalsContact O-N 3.14Å; K761-D798 IonicContact NZ-OD1 2.65Å; K761-D798 PolarHBondContact NZ-OD1 3.27Å; K761-D798 IonicContact NZ-OD2 2.74Å; K761-D798 PolarHBondContact NZ-OD2 3.49Å; K761-L801 HydrophobicContact CB-CD1 4.01Å; K761-L801 HydrophobicContact CB-CD2 4.45Å; K761-L801 HydrophobicContact CD-CB 4.17Å; K761-L801 HydrophobicContact CD-CD1 4.11Å; K761-L801 HydrophobicContact CD-CD2 4.23Å; K761-L801 HydrophobicContact CD-CG 4.4Å; K761-L801 HydrophobicContact CG-CD1 4.25Å
762	E	83.8	Confident	78	Confident	133 Å²	133	70.1 Å²	70.1	62%	0.621	34%	0.343	S	S	*	.	H	α-helix	trans	-70.7	-37	-177.2	-73.7	176.9	177.8	0	0	113.2	L758 F759	L758-E762 WeakPolarHBondContact O-CG 3.49Å; L758-E762 PolarHBondContact O-N 3.23Å; F759-E762 PolarHBondContact O-N 2.84Å
763	H	79.5	Confident	77.8	Confident	24 Å²	24	69.2 Å²	69.2	11%	0.111	34%	0.339	C	S	.	.	H	α-helix	trans	-103.4	-9.7	-170.8	-64.4	82.8	0	0	0	114	R736 N737 L740 F759 H765	R736-H763 PolarHBondContact NE-NE2 3.35Å; R736-H763 PolarHBondContact NH2-NE2 2.87Å; N737-H763 PolarHBondContact OD1-CD2 3.03Å; L740-H763 HydrophobicContact CD1-CB 4.4Å; F759-H763 AromaticContact CD2-CE1 3.49Å; F759-H763 VanDerWaalsContact CD2-CE1 3.49Å; F759-H763 WeakPolarHBondContact CD2-CE1 3.25Å; F759-H763 AromaticContact CD2-ND1 3.43Å; F759-H763 WeakPolarHBondContact CD2-ND1 3.49Å; F759-H763 AromaticContact CE2-CE1 3.29Å; F759-H763 WeakPolarHBondContact CE2-CE1 3.41Å; F759-H763 AromaticContact CE2-ND1 3.44Å; F759-H763 WeakPolarHBondContact CE2-ND1 3.47Å; F759-H763 AromaticContact CE2-NE2 3.86Å; F759-H763 AromaticContact CG-ND1 3.9Å; F759-H763 AromaticContact CZ-ND1 3.91Å; F759-H763 WeakPolarHBondContact O-CB 3.45Å; F759-H763 PolarHBondContact O-N 2.92Å; F759-H763 PolarHBondContact O-ND1 2.8Å; H763-H765 PolarHBondContact O-N 3.38Å
764	C	74.6	Confident	77.6	Confident	19 Å²	19	70.2 Å²	70.2	13%	0.128	35%	0.347	C	S	.	.			trans	-84.3	105.8	172.2	-169.3	0	0	0	0	110.6	L760 F773	L760-C764 HydrophobicContact CD1-CB 4.32Å; L760-C764 WeakPolarHBondContact O-CB 3.18Å; L760-C764 PolarHBondContact O-N 3.24Å; C764-F773 PolarHBondContact SG-N 2.94Å
765	H	66.2	Low	77.4	Confident	125 Å²	125	70.3 Å²	70.3	58%	0.579	35%	0.35	S	S	*	.			trans	-94.3	129.2	163.6	-66.6	-57.6	0	0	0	109.1	H763 K767 S768	H763-H765 PolarHBondContact O-N 3.38Å; H765-K767 PolarHBondContact O-N 3.08Å; H765-S768 PolarHBondContact O-N 3.18Å; H765-S768 PolarHBondContact O-OG 3.28Å
766	E	58.9	Low	77.3	Confident	179 Å²	179	65.3 Å²	65.3	84%	0.836	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-13	179.7	-69	175.3	178.8	0	0	113.6
767	K	54.4	Low	77.4	Confident	209 Å²	209	65.3 Å²	65.3	91%	0.909	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	-5.4	177.7	-66.2	-176.2	179	178.2	0	115.1	H765	H765-K767 PolarHBondContact O-N 3.08Å
768	S	56.3	Low	77.4	Confident	47 Å²	47	71.6 Å²	71.6	33%	0.329	35%	0.352	S	S	.	.			trans	-84.8	125.5	178.1	31.9	0	0	0	0	111.8	H765 S770	H765-S768 PolarHBondContact O-N 3.18Å; H765-S768 PolarHBondContact O-OG 3.28Å; S768-S770 PolarHBondContact O-N 3.44Å; S768-S770 VanDerWaalsContact O-N 3.15Å
769	K	58.6	Low	77.3	Confident	221 Å²	221	69.5 Å²	69.5	96%	0.961	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-12.9	179.3	-80.9	-176.1	175.5	-179.1	0	115.1
770	S	61.2	Low	77.5	Confident	82 Å²	82	68.7 Å²	68.7	57%	0.573	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-35.7	-165.6	50.9	0	0	0	0	114.8	S768	S768-S770 PolarHBondContact O-N 3.44Å; S768-S770 VanDerWaalsContact O-N 3.15Å
771	C	69.9	Low	77.6	Confident	8 Å²	8	71.4 Å²	71.4	5%	0.054	35%	0.351	C	S	.	.			trans	-165.8	119.8	-180	-175.2	0	0	0	0	110	L740 L741	L740-C771 HydrophobicContact CD2-CB 4.11Å; L741-C771 VanDerWaalsContact CD2-SG 3.54Å
772	S	81.2	Confident	77.7	Confident	47 Å²	47	77 Å²	77	33%	0.329	37%	0.371	S	S	.	.			trans	-78	161	171.6	72.5	0	0	0	0	111	A774 D775 G776	S772-A774 PolarHBondContact O-N 3.2Å; S772-D775 VanDerWaalsContact CB-OD2 3.31Å; S772-D775 WeakPolarHBondContact CB-OD2 2.84Å; S772-D775 PolarHBondContact N-OD2 2.97Å; S772-D775 PolarHBondContact O-N 3.18Å; S772-D775 PolarHBondContact OG-N 2.78Å; S772-D775 VanDerWaalsContact OG-N 3.15Å; S772-D775 PolarHBondContact OG-OD2 3.47Å; S772-G776 PolarHBondContact O-N 3.45Å
773	F	86.3	Confident	78	Confident	33 Å²	33	74.1 Å²	74.1	15%	0.145	36%	0.357	C	S	.	.	H	α-helix	trans	-56.4	-40.6	176.4	-175.3	-91.9	0	0	0	110.7	L760 C764 D775 G776 I777 L801 K804 V805	L760-F773 HydrophobicContact CD2-CD2 3.99Å; L760-F773 HydrophobicContact CD2-CE2 3.87Å; L760-F773 HydrophobicContact CD2-CZ 4.37Å; L760-F773 HydrophobicContact CG-CD2 3.76Å; L760-F773 HydrophobicContact CG-CE2 3.84Å; C764-F773 PolarHBondContact SG-N 2.94Å; F773-D775 PolarHBondContact O-N 3Å; F773-G776 PolarHBondContact O-N 3.06Å; F773-I777 HydrophobicContact CD1-CG1 3.98Å; F773-I777 HydrophobicContact CE1-CD1 4.07Å; F773-I777 HydrophobicContact CE1-CG1 3.62Å; F773-I777 HydrophobicContact CZ-CD1 4.08Å; F773-I777 HydrophobicContact CZ-CG1 4.11Å; F773-I777 WeakPolarHBondContact O-CG1 3.32Å; F773-I777 PolarHBondContact O-N 3.09Å; F773-L801 HydrophobicContact CE2-CD1 3.76Å; F773-L801 HydrophobicContact CZ-CD1 3.62Å; F773-K804 HydrophobicContact CE1-CB 3.89Å; F773-K804 HydrophobicContact CZ-CB 4.21Å; F773-V805 HydrophobicContact CE1-CG2 4.22Å; F773-V805 HydrophobicContact CZ-CG2 3.84Å
774	A	85.7	Confident	78.4	Confident	34 Å²	34	74.6 Å²	74.6	28%	0.281	36%	0.359	S	S	.	.	H	α-helix	trans	-64.7	-35.1	176	0	0	0	0	0	113.1	S772 R778	S772-A774 PolarHBondContact O-N 3.2Å; A774-R778 WeakPolarHBondContact O-CB 3.43Å; A774-R778 WeakPolarHBondContact O-CG 3.37Å; A774-R778 PolarHBondContact O-N 2.99Å
775	D	86.3	Confident	79.2	Confident	59 Å²	59	76.2 Å²	76.2	32%	0.316	37%	0.371	S	S	.	.	H	α-helix	trans	-68.8	-39.1	174.6	-58.5	-44.1	0	0	0	111.2	S772 F773 R778 H779	S772-D775 VanDerWaalsContact CB-OD2 3.31Å; S772-D775 WeakPolarHBondContact CB-OD2 2.84Å; S772-D775 PolarHBondContact N-OD2 2.97Å; S772-D775 PolarHBondContact O-N 3.18Å; S772-D775 PolarHBondContact OG-N 2.78Å; S772-D775 VanDerWaalsContact OG-N 3.15Å; S772-D775 PolarHBondContact OG-OD2 3.47Å; F773-D775 PolarHBondContact O-N 3Å; D775-R778 PolarHBondContact O-N 2.95Å; D775-R778 IonicContact OD1-CZ 3.84Å; D775-R778 IonicContact OD1-NH1 2.75Å; D775-R778 PolarHBondContact OD1-NH1 3.05Å; D775-R778 IonicContact OD1-NH2 2.84Å; D775-R778 PolarHBondContact OD1-NH2 3.14Å; D775-H779 WeakPolarHBondContact O-CB 3.47Å; D775-H779 PolarHBondContact O-N 3.14Å
776	G	89.1	Confident	80.2	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-60.4	-47.5	173.3	0	0	0	0	0	112.2	S772 F773 H779 M780	S772-G776 PolarHBondContact O-N 3.45Å; F773-G776 PolarHBondContact O-N 3.06Å; G776-H779 WeakPolarHBondContact O-CB 3.22Å; G776-H779 PolarHBondContact O-N 3.23Å; G776-M780 WeakPolarHBondContact O-CG 3.44Å; G776-M780 PolarHBondContact O-N 2.86Å
777	I	90.9	Very high	81.6	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-62.8	-45.8	175.8	-65.2	-57.6	0	0	0	111.5	L757 L760 F773 H779 M780 L781 L789 V805 V809	L757-I777 HydrophobicContact CD2-CD1 3.7Å; L760-I777 HydrophobicContact CD2-CD1 3.8Å; L760-I777 HydrophobicContact CD2-CG1 4.12Å; F773-I777 HydrophobicContact CD1-CG1 3.98Å; F773-I777 HydrophobicContact CE1-CD1 4.07Å; F773-I777 HydrophobicContact CE1-CG1 3.62Å; F773-I777 HydrophobicContact CZ-CD1 4.08Å; F773-I777 HydrophobicContact CZ-CG1 4.11Å; F773-I777 WeakPolarHBondContact O-CG1 3.32Å; F773-I777 PolarHBondContact O-N 3.09Å; I777-H779 PolarHBondContact O-N 2.6Å; I777-M780 PolarHBondContact O-N 3Å; I777-M780 VanDerWaalsContact O-N 3.12Å; I777-L781 HydrophobicContact CG2-CD1 4.2Å; I777-L781 HydrophobicContact CG2-CG 4.48Å; I777-L781 WeakPolarHBondContact O-CG 3.43Å; I777-L781 PolarHBondContact O-N 3.22Å; I777-L789 HydrophobicContact CD1-CD2 4.24Å; I777-L789 HydrophobicContact CG2-CD2 3.88Å; I777-V805 HydrophobicContact CD1-CG1 4.37Å; I777-V805 HydrophobicContact CD1-CG2 3.95Å; I777-V809 HydrophobicContact CG2-CG2 3.69Å
778	R	89.4	Confident	83.3	Confident	132 Å²	132	65.3 Å²	65.3	50%	0.498	33%	0.33	S	S	.	.	H	α-helix	trans	-57.9	-38.7	174.4	-81.4	-174.3	-98.9	121.2	3.5	112	A774 D775 L781 Y782	A774-R778 WeakPolarHBondContact O-CB 3.43Å; A774-R778 WeakPolarHBondContact O-CG 3.37Å; A774-R778 PolarHBondContact O-N 2.99Å; D775-R778 PolarHBondContact O-N 2.95Å; D775-R778 IonicContact OD1-CZ 3.84Å; D775-R778 IonicContact OD1-NH1 2.75Å; D775-R778 PolarHBondContact OD1-NH1 3.05Å; D775-R778 IonicContact OD1-NH2 2.84Å; D775-R778 PolarHBondContact OD1-NH2 3.14Å; R778-L781 PolarHBondContact O-N 2.72Å; R778-Y782 WeakPolarHBondContact O-CD2 3.46Å
779	H	88.5	Confident	84.9	Confident	19 Å²	19	63.1 Å²	63.1	9%	0.088	32%	0.315	C	S	.	.	H	α-helix	trans	-65.3	-43.1	175.2	-172.4	-97.7	0	0	0	112.3	N678 L741 D775 G776 I777 L781 Y782 F783	N678-H779 PolarHBondContact ND2-NE2 2.96Å; N678-H779 VanDerWaalsContact ND2-NE2 3.12Å; L741-H779 HydrophobicContact CD2-CB 3.7Å; L741-H779 PolarHBondContact O-CE1 2.97Å; L741-H779 PolarHBondContact O-ND1 3.42Å; D775-H779 WeakPolarHBondContact O-CB 3.47Å; D775-H779 PolarHBondContact O-N 3.14Å; G776-H779 WeakPolarHBondContact O-CB 3.22Å; G776-H779 PolarHBondContact O-N 3.23Å; I777-H779 PolarHBondContact O-N 2.6Å; H779-L781 VanDerWaalsContact C-N 3.31Å; H779-L781 PolarHBondContact O-N 3.05Å; H779-Y782 PolarHBondContact O-N 3.3Å; H779-F783 AromaticContact CE1-CE2 3.79Å; H779-F783 VanDerWaalsContact O-CD2 3.31Å; H779-F783 WeakPolarHBondContact O-CD2 3.22Å
780	M	91.7	Very high	86.4	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63	-36.9	176.4	-64.5	-175.3	75.7	0	0	112.1	L744 I748 L757 G776 I777 Y782 F783 M784 L789	L744-M780 HydrophobicContact CB-CG 4.22Å; L744-M780 HydrophobicContact CD1-CG 4.21Å; L744-M780 HydrophobicContact CD1-SD 4.5Å; L744-M780 HydrophobicContact CD2-SD 4.19Å; I748-M780 HydrophobicContact CD1-CB 3.84Å; I748-M780 HydrophobicContact CD1-CE 3.96Å; I748-M780 HydrophobicContact CD1-CG 3.87Å; I748-M780 HydrophobicContact CG1-CE 3.95Å; L757-M780 HydrophobicContact CD2-CE 4.25Å; L757-M780 HydrophobicContact CD2-SD 3.83Å; L757-M780 HydrophobicContact CG-CE 4.21Å; L757-M780 HydrophobicContact CG-SD 4.39Å; G776-M780 WeakPolarHBondContact O-CG 3.44Å; G776-M780 PolarHBondContact O-N 2.86Å; I777-M780 PolarHBondContact O-N 3Å; I777-M780 VanDerWaalsContact O-N 3.12Å; M780-Y782 PolarHBondContact O-N 2.97Å; M780-F783 PolarHBondContact O-N 3.08Å; M780-M784 HydrophobicContact CE-SD 4.42Å; M780-M784 PolarHBondContact O-N 3.14Å; M780-L789 HydrophobicContact CB-CD1 4.11Å; M780-L789 HydrophobicContact CB-CD2 4.26Å; M780-L789 HydrophobicContact CE-CD1 3.55Å; M780-L789 HydrophobicContact SD-CD1 3.89Å
781	L	90.9	Very high	87.8	Confident	57 Å²	57	51.4 Å²	51.4	30%	0.298	26%	0.256	S	S	.	.	H	α-helix	trans	-64.7	-18.1	177.6	-71.9	171.6	0	0	0	114.3	I777 R778 H779 F783 L789 V809	I777-L781 HydrophobicContact CG2-CD1 4.2Å; I777-L781 HydrophobicContact CG2-CG 4.48Å; I777-L781 WeakPolarHBondContact O-CG 3.43Å; I777-L781 PolarHBondContact O-N 3.22Å; R778-L781 PolarHBondContact O-N 2.72Å; H779-L781 VanDerWaalsContact C-N 3.31Å; H779-L781 PolarHBondContact O-N 3.05Å; L781-F783 PolarHBondContact O-N 3.09Å; L781-L789 HydrophobicContact CD2-CD2 3.93Å; L781-L789 HydrophobicContact CG-CD2 4.08Å; L781-V809 HydrophobicContact CD1-CG2 4.36Å; L781-V809 HydrophobicContact CD2-CG1 4.36Å; L781-V809 HydrophobicContact CD2-CG2 4.47Å
782	Y	89.2	Confident	88.8	Confident	190 Å²	190	51.4 Å²	51.4	75%	0.745	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-20.5	170.4	-73.1	-60.9	0	0	0	113	R778 H779 M780	R778-Y782 WeakPolarHBondContact O-CD2 3.46Å; H779-Y782 PolarHBondContact O-N 3.3Å; M780-Y782 PolarHBondContact O-N 2.97Å
783	F	89.5	Confident	89.3	Confident	72 Å²	72	49.2 Å²	49.2	32%	0.316	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.8	-9	-173	-53.9	-77.9	0	0	0	113.9	L745 I748 H779 M780 L781	L745-F783 HydrophobicContact CD1-CB 4.38Å; L745-F783 HydrophobicContact CD1-CD1 3.65Å; L745-F783 HydrophobicContact CD1-CD2 3.66Å; L745-F783 HydrophobicContact CD1-CE1 3.7Å; L745-F783 HydrophobicContact CD1-CE2 3.72Å; L745-F783 HydrophobicContact CD1-CG 3.62Å; L745-F783 HydrophobicContact CD1-CZ 3.74Å; L745-F783 HydrophobicContact CD2-CE1 4.39Å; L745-F783 HydrophobicContact CD2-CE2 4.35Å; L745-F783 HydrophobicContact CD2-CZ 3.98Å; L745-F783 HydrophobicContact CG-CE2 4.46Å; L745-F783 HydrophobicContact CG-CZ 4.44Å; I748-F783 HydrophobicContact CD1-CB 4.2Å; I748-F783 HydrophobicContact CG2-CB 4.1Å; H779-F783 AromaticContact CE1-CE2 3.79Å; H779-F783 VanDerWaalsContact O-CD2 3.31Å; H779-F783 WeakPolarHBondContact O-CD2 3.22Å; M780-F783 PolarHBondContact O-N 3.08Å; L781-F783 PolarHBondContact O-N 3.09Å
784	M	88.9	Confident	89.5	Confident	33 Å²	33	47.7 Å²	47.7	16%	0.163	24%	0.235	C	C	.	.	S	Bend	trans	-139.9	153.8	-179.8	-67.7	-177.6	66.2	0	0	111.5	I748 A753 M780 E788	I748-M784 HydrophobicContact CB-SD 4.28Å; I748-M784 HydrophobicContact CD1-CG 4.06Å; I748-M784 HydrophobicContact CD1-SD 3.89Å; I748-M784 HydrophobicContact CG1-CG 4.19Å; I748-M784 HydrophobicContact CG1-SD 3.6Å; I748-M784 VanDerWaalsContact CG1-SD 3.6Å; I748-M784 HydrophobicContact CG2-CG 3.6Å; I748-M784 HydrophobicContact CG2-SD 3.88Å; A753-M784 HydrophobicContact CB-CE 3.75Å; A753-M784 HydrophobicContact CB-SD 3.78Å; M780-M784 HydrophobicContact CE-SD 4.42Å; M780-M784 PolarHBondContact O-N 3.14Å; M784-E788 HydrophobicContact CE-CB 3.72Å
785	S	90	Very high	89.8	Confident	53 Å²	53	46.2 Å²	46.2	37%	0.371	22%	0.222	S	C	.	.			trans	-73.6	158	173.4	67.6	0	0	0	0	112.7	E787 E788 L789	S785-E787 PolarHBondContact O-N 3.06Å; S785-E788 WeakPolarHBondContact CB-OE2 3.45Å; S785-E788 PolarHBondContact N-OE2 2.85Å; S785-E788 PolarHBondContact O-N 3.49Å; S785-E788 WeakPolarHBondContact OG-CB 3.16Å; S785-E788 WeakPolarHBondContact OG-CG 3.14Å; S785-E788 PolarHBondContact OG-N 3.46Å; S785-E788 PolarHBondContact OG-OE2 3.27Å; S785-L789 WeakPolarHBondContact O-CB 3.22Å; S785-L789 PolarHBondContact O-N 3.38Å
786	S	88.6	Confident	90	Very high	61 Å²	61	44.3 Å²	44.3	43%	0.427	21%	0.213	S	C	.	.	H	α-helix	trans	-60.5	-33.2	175.5	55	0	0	0	0	112.9	F790	S786-F790 WeakPolarHBondContact O-CB 3.42Å; S786-F790 PolarHBondContact O-N 2.9Å; S786-F790 VanDerWaalsContact O-N 3.17Å
787	E	88.1	Confident	90	Very high	119 Å²	119	47.8 Å²	47.8	56%	0.556	23%	0.227	S	C	*	.	H	α-helix	trans	-70.9	-47.5	177.8	-173.9	177.3	175.3	0	0	111.9	S785 L789 F790 N791	S785-E787 PolarHBondContact O-N 3.06Å; E787-L789 VanDerWaalsContact C-N 3.31Å; E787-L789 PolarHBondContact O-N 3Å; E787-F790 PolarHBondContact O-N 3.34Å; E787-N791 WeakPolarHBondContact O-CB 3.42Å; E787-N791 VanDerWaalsContact O-CG 3.25Å; E787-N791 PolarHBondContact O-N 2.92Å; E787-N791 PolarHBondContact O-ND2 3.37Å
788	E	88.3	Confident	90	Very high	105 Å²	105	49.9 Å²	49.9	49%	0.491	24%	0.238	S	C	.	.	H	α-helix	trans	-61.7	-40.4	177.4	-71.5	162.7	155.9	0	0	111.7	M784 S785 N791 A792	M784-E788 HydrophobicContact CE-CB 3.72Å; S785-E788 WeakPolarHBondContact CB-OE2 3.45Å; S785-E788 PolarHBondContact N-OE2 2.85Å; S785-E788 PolarHBondContact O-N 3.49Å; S785-E788 WeakPolarHBondContact OG-CB 3.16Å; S785-E788 WeakPolarHBondContact OG-CG 3.14Å; S785-E788 PolarHBondContact OG-N 3.46Å; S785-E788 PolarHBondContact OG-OE2 3.27Å; E788-N791 PolarHBondContact O-N 2.66Å; E788-A792 VanDerWaalsContact O-CB 3.31Å; E788-A792 WeakPolarHBondContact O-CB 3.42Å; E788-A792 PolarHBondContact O-N 2.86Å
789	L	90.6	Very high	89.9	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-66.6	-40.3	179.2	-168.2	63.4	0	0	0	112.1	L757 I777 M780 L781 S785 E787 A792 A793 V805 V809	L757-L789 HydrophobicContact CD1-CD1 4.23Å; L757-L789 HydrophobicContact CD2-CD1 3.99Å; L757-L789 HydrophobicContact CG-CD1 4.33Å; I777-L789 HydrophobicContact CD1-CD2 4.24Å; I777-L789 HydrophobicContact CG2-CD2 3.88Å; M780-L789 HydrophobicContact CB-CD1 4.11Å; M780-L789 HydrophobicContact CB-CD2 4.26Å; M780-L789 HydrophobicContact CE-CD1 3.55Å; M780-L789 HydrophobicContact SD-CD1 3.89Å; L781-L789 HydrophobicContact CD2-CD2 3.93Å; L781-L789 HydrophobicContact CG-CD2 4.08Å; S785-L789 WeakPolarHBondContact O-CB 3.22Å; S785-L789 PolarHBondContact O-N 3.38Å; E787-L789 VanDerWaalsContact C-N 3.31Å; E787-L789 PolarHBondContact O-N 3Å; L789-A792 PolarHBondContact O-N 3.31Å; L789-A793 PolarHBondContact O-N 3.39Å; L789-V805 HydrophobicContact CD2-CG1 4.46Å; L789-V805 HydrophobicContact CG-CG1 4.18Å; L789-V809 HydrophobicContact CD2-CG2 4.01Å
790	F	90.5	Very high	90	Very high	5 Å²	5	49 Å²	49	2%	0.022	24%	0.243	C	C	.	.	H	α-helix	trans	-66.7	-41.7	174.8	-179.1	-100.3	0	0	0	112	S786 E787 A793 L794 V802 A806	S786-F790 WeakPolarHBondContact O-CB 3.42Å; S786-F790 PolarHBondContact O-N 2.9Å; S786-F790 VanDerWaalsContact O-N 3.17Å; E787-F790 PolarHBondContact O-N 3.34Å; F790-A793 WeakPolarHBondContact O-CB 3.29Å; F790-A793 PolarHBondContact O-N 3.35Å; F790-L794 HydrophobicContact CD1-CD1 3.94Å; F790-L794 HydrophobicContact CE1-CD1 3.46Å; F790-L794 VanDerWaalsContact CE1-CD1 3.46Å; F790-L794 HydrophobicContact CE1-CG 4.13Å; F790-L794 HydrophobicContact CZ-CD1 4.06Å; F790-L794 HydrophobicContact CZ-CG 4.33Å; F790-L794 PolarHBondContact O-N 2.92Å; F790-V802 HydrophobicContact CD2-CG1 4.43Å; F790-V802 HydrophobicContact CE2-CG1 3.7Å; F790-V802 HydrophobicContact CZ-CG1 4.1Å; F790-A806 HydrophobicContact CD2-CB 4.07Å; F790-A806 HydrophobicContact CE2-CB 3.83Å
791	N	90.7	Very high	89.9	Confident	53 Å²	53	49 Å²	49	28%	0.283	24%	0.243	S	C	.	.	H	α-helix	trans	-65	-39.4	175.7	-71.1	-20.7	0	0	0	111.8	E787 E788 A793 L794 G795 L839	E787-N791 WeakPolarHBondContact O-CB 3.42Å; E787-N791 VanDerWaalsContact O-CG 3.25Å; E787-N791 PolarHBondContact O-N 2.92Å; E787-N791 PolarHBondContact O-ND2 3.37Å; E788-N791 PolarHBondContact O-N 2.66Å; N791-A793 VanDerWaalsContact C-N 3.33Å; N791-L794 PolarHBondContact O-N 2.77Å; N791-G795 PolarHBondContact O-N 2.67Å; N791-L839 HydrophobicContact CB-CD2 3.88Å; N791-L839 WeakPolarHBondContact O-CD2 3.34Å
792	A	90	Very high	89.9	Confident	8 Å²	8	46.3 Å²	46.3	7%	0.066	23%	0.229	C	C	.	.	H	α-helix	trans	-63.1	-39.8	172.7	0	0	0	0	0	111.4	A753 E754 L757 E788 L789 G795 T796	A753-A792 HydrophobicContact CB-CB 3.97Å; E754-A792 HydrophobicContact CG-CB 4.3Å; L757-A792 HydrophobicContact CD1-CB 3.93Å; E788-A792 VanDerWaalsContact O-CB 3.31Å; E788-A792 WeakPolarHBondContact O-CB 3.42Å; E788-A792 PolarHBondContact O-N 2.86Å; L789-A792 PolarHBondContact O-N 3.31Å; A792-G795 PolarHBondContact O-N 3.3Å; A792-T796 PolarHBondContact O-N 2.74Å
793	A	92.3	Very high	89.9	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.5	-44.8	175	0	0	0	0	0	111.5	L757 L789 F790 N791 G795 T796 V802 V805	L757-A793 HydrophobicContact CD1-CB 3.85Å; L789-A793 PolarHBondContact O-N 3.39Å; F790-A793 WeakPolarHBondContact O-CB 3.29Å; F790-A793 PolarHBondContact O-N 3.35Å; N791-A793 VanDerWaalsContact C-N 3.33Å; A793-G795 VanDerWaalsContact C-N 3.25Å; A793-G795 PolarHBondContact O-N 2.94Å; A793-T796 WeakPolarHBondContact O-CB 3.44Å; A793-T796 PolarHBondContact O-N 2.81Å; A793-T796 VanDerWaalsContact O-N 3.11Å; A793-T796 PolarHBondContact O-OG1 2.7Å; A793-V802 VanDerWaalsContact C-CG2 3.49Å; A793-V802 HydrophobicContact CB-CG2 4.2Å; A793-V802 VanDerWaalsContact O-CG2 3.31Å; A793-V802 WeakPolarHBondContact O-CG2 3.37Å; A793-V805 HydrophobicContact CB-CB 4Å; A793-V805 HydrophobicContact CB-CG1 4.09Å; A793-V805 HydrophobicContact CB-CG2 3.95Å
794	L	91	Very high	89.8	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-59.3	-37.8	174.8	-81.7	171.5	0	0	0	111.8	F790 N791 T796 Y797 V802 I835 I838 L839	F790-L794 HydrophobicContact CD1-CD1 3.94Å; F790-L794 HydrophobicContact CE1-CD1 3.46Å; F790-L794 VanDerWaalsContact CE1-CD1 3.46Å; F790-L794 HydrophobicContact CE1-CG 4.13Å; F790-L794 HydrophobicContact CZ-CD1 4.06Å; F790-L794 HydrophobicContact CZ-CG 4.33Å; F790-L794 PolarHBondContact O-N 2.92Å; N791-L794 PolarHBondContact O-N 2.77Å; L794-T796 PolarHBondContact O-N 2.87Å; L794-T796 VanDerWaalsContact O-N 3.17Å; L794-Y797 PolarHBondContact O-N 2.77Å; L794-Y797 VanDerWaalsContact O-N 3.07Å; L794-V802 HydrophobicContact CD2-CG1 3.83Å; L794-V802 HydrophobicContact CD2-CG2 4.03Å; L794-V802 HydrophobicContact CG-CG1 4.09Å; L794-V802 HydrophobicContact CG-CG2 4.3Å; L794-I835 HydrophobicContact CB-CG2 4.48Å; L794-I835 VanDerWaalsContact O-CG2 3.32Å; L794-I835 WeakPolarHBondContact O-CG2 3.32Å; L794-I838 HydrophobicContact CD1-CG2 4.4Å; L794-L839 HydrophobicContact CB-CD1 4.19Å; L794-L839 HydrophobicContact CB-CD2 3.86Å; L794-L839 HydrophobicContact CB-CG 4.3Å; L794-L839 HydrophobicContact CD1-CD2 4.29Å
795	G	91	Very high	89.9	Confident	2 Å²	2	40 Å²	40	2%	0.021	21%	0.206	C	C	.	.	H	α-helix	trans	-61.9	-19	177.1	0	0	0	0	0	114.6	N791 A792 A793 Y797 L839	N791-G795 PolarHBondContact O-N 2.67Å; A792-G795 PolarHBondContact O-N 3.3Å; A793-G795 VanDerWaalsContact C-N 3.25Å; A793-G795 PolarHBondContact O-N 2.94Å; G795-Y797 VanDerWaalsContact C-N 3.26Å; G795-Y797 WeakPolarHBondContact O-CD2 3.37Å; G795-Y797 WeakPolarHBondContact O-CE2 3.46Å; G795-Y797 PolarHBondContact O-N 3.38Å; G795-L839 VanDerWaalsContact CA-CD1 3.49Å
796	T	90.1	Very high	89.9	Confident	20 Å²	20	37.4 Å²	37.4	12%	0.123	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-12.7	175	70.4	0	0	0	0	113.8	E754 L758 A792 A793 L794 D798 L801	E754-T796 HydrophobicContact CB-CG2 4.27Å; L758-T796 HydrophobicContact CD2-CG2 4.2Å; L758-T796 HydrophobicContact CG-CG2 3.99Å; A792-T796 PolarHBondContact O-N 2.74Å; A793-T796 WeakPolarHBondContact O-CB 3.44Å; A793-T796 PolarHBondContact O-N 2.81Å; A793-T796 VanDerWaalsContact O-N 3.11Å; A793-T796 PolarHBondContact O-OG1 2.7Å; L794-T796 PolarHBondContact O-N 2.87Å; L794-T796 VanDerWaalsContact O-N 3.17Å; T796-D798 PolarHBondContact O-N 2.96Å; T796-D798 VanDerWaalsContact O-N 3.16Å; T796-D798 PolarHBondContact OG1-N 3.31Å; T796-L801 HydrophobicContact CG2-CD2 4.08Å
797	Y	90	Very high	89.8	Confident	72 Å²	72	39.4 Å²	39.4	28%	0.282	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	12.6	-173.7	-47	-72.5	0	0	0	115.6	L794 G795 K832 I835 D836 S844	L794-Y797 PolarHBondContact O-N 2.77Å; L794-Y797 VanDerWaalsContact O-N 3.07Å; G795-Y797 VanDerWaalsContact C-N 3.26Å; G795-Y797 WeakPolarHBondContact O-CD2 3.37Å; G795-Y797 WeakPolarHBondContact O-CE2 3.46Å; G795-Y797 PolarHBondContact O-N 3.38Å; Y797-K832 HydrophobicContact CD1-CB 3.97Å; Y797-K832 HydrophobicContact CD1-CG 3.78Å; Y797-K832 HydrophobicContact CE1-CB 3.94Å; Y797-K832 HydrophobicContact CE1-CG 4.16Å; Y797-K832 HydrophobicContact CG-CG 4.04Å; Y797-I835 HydrophobicContact CD1-CB 4.2Å; Y797-I835 HydrophobicContact CD1-CD1 4.08Å; Y797-I835 HydrophobicContact CD1-CG2 3.89Å; Y797-I835 HydrophobicContact CE1-CB 4.34Å; Y797-I835 HydrophobicContact CE1-CG2 3.98Å; Y797-D836 PolarHBondContact OH-OD1 2.89Å; Y797-D836 PolarHBondContact OH-OD2 2.79Å; Y797-D836 VanDerWaalsContact OH-OD2 3.14Å; Y797-S844 PolarHBondContact OH-OG 3Å
798	D	89.9	Confident	89.7	Confident	45 Å²	45	35.5 Å²	35.5	24%	0.241	18%	0.176	C	C	.	.			trans	-102.8	98.6	-179.4	-171	-48.3	0	0	0	110.1	K761 T796 D800 L801 V802	K761-D798 IonicContact NZ-OD1 2.65Å; K761-D798 PolarHBondContact NZ-OD1 3.27Å; K761-D798 IonicContact NZ-OD2 2.74Å; K761-D798 PolarHBondContact NZ-OD2 3.49Å; T796-D798 PolarHBondContact O-N 2.96Å; T796-D798 VanDerWaalsContact O-N 3.16Å; T796-D798 PolarHBondContact OG1-N 3.31Å; D798-D800 PolarHBondContact O-N 2.68Å; D798-D800 PolarHBondContact OD1-N 2.76Å; D798-L801 HydrophobicContact CB-CB 3.94Å; D798-L801 WeakPolarHBondContact O-CB 2.99Å; D798-L801 PolarHBondContact O-N 3.09Å; D798-L801 VanDerWaalsContact O-N 3.12Å; D798-L801 PolarHBondContact OD1-N 2.78Å; D798-V802 WeakPolarHBondContact O-CG2 3.41Å; D798-V802 PolarHBondContact O-N 2.9Å
799	L	89.2	Confident	89.6	Confident	25 Å²	25	31.5 Å²	31.5	13%	0.131	16%	0.159	C	C	.	.	H	α-helix	trans	-61.8	-32.7	-173.8	-60.8	-176.7	0	0	0	112.6	V802 Q803 L820 L823 E824 I835	L799-V802 PolarHBondContact O-N 2.94Å; L799-Q803 PolarHBondContact O-N 3.09Å; L799-L820 HydrophobicContact CB-CD2 4.29Å; L799-L820 HydrophobicContact CD2-CD2 3.86Å; L799-L823 HydrophobicContact CD1-CB 4.49Å; L799-L823 HydrophobicContact CD2-CB 4.38Å; L799-L823 HydrophobicContact CD2-CD1 4.31Å; L799-E824 HydrophobicContact CD1-CB 4.37Å; L799-I835 HydrophobicContact CD2-CD1 4.33Å
800	D	88.8	Confident	89.1	Confident	106 Å²	106	38.7 Å²	38.7	57%	0.567	20%	0.198	S	C	*	.	H	α-helix	trans	-66.4	-40.8	177.3	-61.1	-34.4	0	0	0	110.8	D798 Q803 K804	D798-D800 PolarHBondContact O-N 2.68Å; D798-D800 PolarHBondContact OD1-N 2.76Å; D800-Q803 PolarHBondContact O-N 3.25Å; D800-K804 WeakPolarHBondContact O-CG 3.35Å; D800-K804 PolarHBondContact O-N 2.71Å
801	L	90.4	Very high	88.7	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.3	-44.6	175.6	-176.2	56.1	0	0	0	111.1	L757 L758 K761 F773 T796 D798 Q803 K804 V805	L757-L801 HydrophobicContact CB-CD2 4.26Å; L758-L801 HydrophobicContact CD2-CD2 4.23Å; K761-L801 HydrophobicContact CB-CD1 4.01Å; K761-L801 HydrophobicContact CB-CD2 4.45Å; K761-L801 HydrophobicContact CD-CB 4.17Å; K761-L801 HydrophobicContact CD-CD1 4.11Å; K761-L801 HydrophobicContact CD-CD2 4.23Å; K761-L801 HydrophobicContact CD-CG 4.4Å; K761-L801 HydrophobicContact CG-CD1 4.25Å; F773-L801 HydrophobicContact CE2-CD1 3.76Å; F773-L801 HydrophobicContact CZ-CD1 3.62Å; T796-L801 HydrophobicContact CG2-CD2 4.08Å; D798-L801 HydrophobicContact CB-CB 3.94Å; D798-L801 WeakPolarHBondContact O-CB 2.99Å; D798-L801 PolarHBondContact O-N 3.09Å; D798-L801 VanDerWaalsContact O-N 3.12Å; D798-L801 PolarHBondContact OD1-N 2.78Å; L801-Q803 VanDerWaalsContact C-N 3.31Å; L801-Q803 PolarHBondContact O-N 2.63Å; L801-K804 PolarHBondContact O-N 3.44Å; L801-V805 HydrophobicContact CD1-CG2 4.19Å; L801-V805 HydrophobicContact CG-CG2 4.41Å; L801-V805 WeakPolarHBondContact O-CG2 3.46Å; L801-V805 PolarHBondContact O-N 3.18Å
802	V	90.6	Very high	88.4	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.006	21%	0.213	C	C	.	.	H	α-helix	trans	-57	-46.5	176.9	177.2	0	0	0	0	110.7	F790 A793 L794 D798 L799 V805 A806 L820	F790-V802 HydrophobicContact CD2-CG1 4.43Å; F790-V802 HydrophobicContact CE2-CG1 3.7Å; F790-V802 HydrophobicContact CZ-CG1 4.1Å; A793-V802 VanDerWaalsContact C-CG2 3.49Å; A793-V802 HydrophobicContact CB-CG2 4.2Å; A793-V802 VanDerWaalsContact O-CG2 3.31Å; A793-V802 WeakPolarHBondContact O-CG2 3.37Å; L794-V802 HydrophobicContact CD2-CG1 3.83Å; L794-V802 HydrophobicContact CD2-CG2 4.03Å; L794-V802 HydrophobicContact CG-CG1 4.09Å; L794-V802 HydrophobicContact CG-CG2 4.3Å; D798-V802 WeakPolarHBondContact O-CG2 3.41Å; D798-V802 PolarHBondContact O-N 2.9Å; L799-V802 PolarHBondContact O-N 2.94Å; V802-V805 PolarHBondContact O-N 3.04Å; V802-A806 WeakPolarHBondContact O-CB 3.36Å; V802-A806 PolarHBondContact O-N 2.93Å; V802-L820 HydrophobicContact CB-CD2 4.23Å; V802-L820 HydrophobicContact CG1-CD2 3.92Å
803	Q	89.3	Confident	88.2	Confident	73 Å²	73	44.8 Å²	44.8	34%	0.341	23%	0.229	S	C	.	.	H	α-helix	trans	-61.9	-44.7	177.9	-173.4	174.8	-2.7	0	0	111.8	L799 D800 L801 A806 Q807 Y816 L820	L799-Q803 PolarHBondContact O-N 3.09Å; D800-Q803 PolarHBondContact O-N 3.25Å; L801-Q803 VanDerWaalsContact C-N 3.31Å; L801-Q803 PolarHBondContact O-N 2.63Å; Q803-A806 PolarHBondContact O-N 2.88Å; Q803-Q807 WeakPolarHBondContact O-CB 3.44Å; Q803-Q807 VanDerWaalsContact O-CG 3.29Å; Q803-Q807 WeakPolarHBondContact O-CG 3.25Å; Q803-Q807 PolarHBondContact O-N 3.33Å; Q803-Y816 HydrophobicContact CG-CE2 4.35Å; Q803-L820 HydrophobicContact CB-CD1 3.82Å; Q803-L820 HydrophobicContact CG-CD1 4.19Å
804	K	88.5	Confident	87.9	Confident	89 Å²	89	53 Å²	53	39%	0.387	26%	0.264	S	S	.	.	H	α-helix	trans	-62.8	-41.7	177.3	-75.3	-172.9	179.1	-163.5	0	112.6	F773 D800 L801 S808	F773-K804 HydrophobicContact CE1-CB 3.89Å; F773-K804 HydrophobicContact CZ-CB 4.21Å; D800-K804 WeakPolarHBondContact O-CG 3.35Å; D800-K804 PolarHBondContact O-N 2.71Å; L801-K804 PolarHBondContact O-N 3.44Å; K804-S808 WeakPolarHBondContact O-CB 3.41Å; K804-S808 PolarHBondContact O-N 2.98Å; K804-S808 PolarHBondContact O-OG 3.13Å
805	V	90.1	Very high	87.5	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-65.4	-46.4	176.2	175	0	0	0	0	110.1	L757 F773 I777 L789 A793 L801 V802 Q807 S808 V809	L757-V805 HydrophobicContact CD2-CG2 4.03Å; F773-V805 HydrophobicContact CE1-CG2 4.22Å; F773-V805 HydrophobicContact CZ-CG2 3.84Å; I777-V805 HydrophobicContact CD1-CG1 4.37Å; I777-V805 HydrophobicContact CD1-CG2 3.95Å; L789-V805 HydrophobicContact CD2-CG1 4.46Å; L789-V805 HydrophobicContact CG-CG1 4.18Å; A793-V805 HydrophobicContact CB-CB 4Å; A793-V805 HydrophobicContact CB-CG1 4.09Å; A793-V805 HydrophobicContact CB-CG2 3.95Å; L801-V805 HydrophobicContact CD1-CG2 4.19Å; L801-V805 HydrophobicContact CG-CG2 4.41Å; L801-V805 WeakPolarHBondContact O-CG2 3.46Å; L801-V805 PolarHBondContact O-N 3.18Å; V802-V805 PolarHBondContact O-N 3.04Å; V805-Q807 VanDerWaalsContact C-N 3.31Å; V805-Q807 PolarHBondContact O-N 3.34Å; V805-S808 PolarHBondContact O-N 3.01Å; V805-V809 HydrophobicContact CG1-CG2 4.01Å; V805-V809 WeakPolarHBondContact O-CB 3.48Å; V805-V809 VanDerWaalsContact O-CG2 3.24Å; V805-V809 WeakPolarHBondContact O-CG2 3.35Å; V805-V809 PolarHBondContact O-N 3.47Å
806	A	89.1	Confident	87.3	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-58.8	-42.4	179.2	0	0	0	0	0	112.6	F790 V802 Q803 S808 V809 D810 R811 Y816	F790-A806 HydrophobicContact CD2-CB 4.07Å; F790-A806 HydrophobicContact CE2-CB 3.83Å; V802-A806 WeakPolarHBondContact O-CB 3.36Å; V802-A806 PolarHBondContact O-N 2.93Å; Q803-A806 PolarHBondContact O-N 2.88Å; A806-S808 VanDerWaalsContact C-N 3.33Å; A806-V809 PolarHBondContact O-N 3.2Å; A806-D810 PolarHBondContact O-N 2.83Å; A806-R811 PolarHBondContact O-N 2.78Å; A806-Y816 HydrophobicContact CB-CD1 3.76Å; A806-Y816 HydrophobicContact CB-CD2 3.8Å; A806-Y816 HydrophobicContact CB-CE1 4Å; A806-Y816 HydrophobicContact CB-CE2 4.09Å; A806-Y816 HydrophobicContact CB-CG 3.66Å
807	Q	87.8	Confident	87.2	Confident	103 Å²	103	60.3 Å²	60.3	48%	0.481	30%	0.297	S	S	.	.	H	α-helix	trans	-66.5	-32.8	174.8	-72.7	174	-12.1	0	0	112.7	Q803 V805	Q803-Q807 WeakPolarHBondContact O-CB 3.44Å; Q803-Q807 VanDerWaalsContact O-CG 3.29Å; Q803-Q807 WeakPolarHBondContact O-CG 3.25Å; Q803-Q807 PolarHBondContact O-N 3.33Å; V805-Q807 VanDerWaalsContact C-N 3.31Å; V805-Q807 PolarHBondContact O-N 3.34Å
808	S	86	Confident	87.1	Confident	36 Å²	36	60.3 Å²	60.3	25%	0.252	31%	0.307	S	S	.	.	H	α-helix	trans	-81.6	-20.9	-179.2	-57.1	0	0	0	0	113.5	K804 V805 A806	K804-S808 WeakPolarHBondContact O-CB 3.41Å; K804-S808 PolarHBondContact O-N 2.98Å; K804-S808 PolarHBondContact O-OG 3.13Å; V805-S808 PolarHBondContact O-N 3.01Å; A806-S808 VanDerWaalsContact C-N 3.33Å
809	V	85.7	Confident	86.9	Confident	22 Å²	22	60.6 Å²	60.6	13%	0.133	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	0.6	179.2	179.1	0	0	0	0	111.5	I777 L781 L789 V805 A806 R811	I777-V809 HydrophobicContact CG2-CG2 3.69Å; L781-V809 HydrophobicContact CD1-CG2 4.36Å; L781-V809 HydrophobicContact CD2-CG1 4.36Å; L781-V809 HydrophobicContact CD2-CG2 4.47Å; L789-V809 HydrophobicContact CD2-CG2 4.01Å; V805-V809 HydrophobicContact CG1-CG2 4.01Å; V805-V809 WeakPolarHBondContact O-CB 3.48Å; V805-V809 VanDerWaalsContact O-CG2 3.24Å; V805-V809 WeakPolarHBondContact O-CG2 3.35Å; V805-V809 PolarHBondContact O-N 3.47Å; A806-V809 PolarHBondContact O-N 3.2Å; V809-R811 VanDerWaalsContact C-N 3.27Å; V809-R811 PolarHBondContact O-N 3.04Å
810	D	80.1	Confident	86.9	Confident	150 Å²	150	59.9 Å²	59.9	80%	0.802	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	35.7	-176	-62.2	-40.7	0	0	0	113.8	A806	A806-D810 PolarHBondContact O-N 2.83Å
811	R	82.7	Confident	86.9	Confident	57 Å²	57	59.8 Å²	59.8	22%	0.215	30%	0.303	C	S	.	.			trans	-68.8	144.7	171.5	-109.7	-170.4	-176.7	-111.3	12.5	110.3	A806 V809 P813 E815 Y816	A806-R811 PolarHBondContact O-N 2.78Å; V809-R811 VanDerWaalsContact C-N 3.27Å; V809-R811 PolarHBondContact O-N 3.04Å; R811-P813 WeakPolarHBondContact O-CD 3.22Å; R811-E815 IonicContact CZ-OE2 3.52Å; R811-E815 IonicContact NH1-OE2 2.88Å; R811-E815 PolarHBondContact NH1-OE2 2.85Å; R811-Y816 HydrophobicContact CB-CD1 4.17Å; R811-Y816 WeakPolarHBondContact O-CE1 3.47Å
812	D	84.6	Confident	86.8	Confident	76 Å²	76	62.8 Å²	62.8	41%	0.406	33%	0.328	S	S	.	.			trans	-61.5	124.2	179	-170.7	-25.3	0	0	0	110.2	K814 E815 Y816	D812-K814 PolarHBondContact O-N 3.2Å; D812-K814 WeakPolarHBondContact OD1-CB 3.49Å; D812-K814 WeakPolarHBondContact OD1-CG 3.34Å; D812-K814 PolarHBondContact OD1-N 3.16Å; D812-E815 HydrophobicContact CB-CG 4.24Å; D812-E815 WeakPolarHBondContact O-CB 3.35Å; D812-E815 PolarHBondContact O-N 2.68Å; D812-Y816 VanDerWaalsContact O-CD1 3.28Å; D812-Y816 WeakPolarHBondContact O-CD1 3.48Å; D812-Y816 PolarHBondContact O-N 3.14Å
813	P	84.6	Confident	86.8	Confident	62 Å²	62	63 Å²	63	40%	0.403	33%	0.329	S	S	.	.	H	α-helix	trans	-50.8	-29.1	173.4	-28.3	36.2	0	0	0	114.3	R811 E815 Y816 L817	R811-P813 WeakPolarHBondContact O-CD 3.22Å; P813-E815 PolarHBondContact O-N 3.5Å; P813-Y816 HydrophobicContact CB-CE1 4.09Å; P813-Y816 HydrophobicContact CG-CE1 4.1Å; P813-L817 HydrophobicContact CB-CD1 3.69Å; P813-L817 HydrophobicContact CB-CG 4.2Å; P813-L817 WeakPolarHBondContact O-CB 3.35Å; P813-L817 VanDerWaalsContact O-CG 3.26Å; P813-L817 WeakPolarHBondContact O-CG 3.32Å; P813-L817 PolarHBondContact O-N 3.14Å
814	K	85.9	Confident	86.7	Confident	173 Å²	173	65.5 Å²	65.5	75%	0.752	34%	0.34	S	S	*	.	H	α-helix	trans	-67.9	-20.4	175.7	-64.4	176.2	-178.2	172.5	0	113.4	D812 P818	D812-K814 PolarHBondContact O-N 3.2Å; D812-K814 WeakPolarHBondContact OD1-CB 3.49Å; D812-K814 WeakPolarHBondContact OD1-CG 3.34Å; D812-K814 PolarHBondContact OD1-N 3.16Å; K814-P818 VanDerWaalsContact O-CD 3.31Å; K814-P818 WeakPolarHBondContact O-CD 3.44Å; K814-P818 WeakPolarHBondContact O-CG 3.37Å
815	E	84.3	Confident	86.7	Confident	104 Å²	104	66.3 Å²	66.3	49%	0.486	36%	0.355	S	S	.	.	H	α-helix	trans	-88.7	-47.2	177	-67.9	-172.4	172.1	0	0	112.3	R811 D812 P813 I819	R811-E815 IonicContact CZ-OE2 3.52Å; R811-E815 IonicContact NH1-OE2 2.88Å; R811-E815 PolarHBondContact NH1-OE2 2.85Å; D812-E815 HydrophobicContact CB-CG 4.24Å; D812-E815 WeakPolarHBondContact O-CB 3.35Å; D812-E815 PolarHBondContact O-N 2.68Å; P813-E815 PolarHBondContact O-N 3.5Å; E815-I819 WeakPolarHBondContact O-CD1 3.17Å
816	Y	85.8	Confident	86.6	Confident	13 Å²	13	68.6 Å²	68.6	5%	0.051	37%	0.367	C	S	.	.	H	α-helix	trans	-91.9	-31.8	-171.7	75	-97.2	0	0	0	113.9	Q803 A806 R811 D812 P813 I819 L820	Q803-Y816 HydrophobicContact CG-CE2 4.35Å; A806-Y816 HydrophobicContact CB-CD1 3.76Å; A806-Y816 HydrophobicContact CB-CD2 3.8Å; A806-Y816 HydrophobicContact CB-CE1 4Å; A806-Y816 HydrophobicContact CB-CE2 4.09Å; A806-Y816 HydrophobicContact CB-CG 3.66Å; R811-Y816 HydrophobicContact CB-CD1 4.17Å; R811-Y816 WeakPolarHBondContact O-CE1 3.47Å; D812-Y816 VanDerWaalsContact O-CD1 3.28Å; D812-Y816 WeakPolarHBondContact O-CD1 3.48Å; D812-Y816 PolarHBondContact O-N 3.14Å; P813-Y816 HydrophobicContact CB-CE1 4.09Å; P813-Y816 HydrophobicContact CG-CE1 4.1Å; Y816-I819 PolarHBondContact O-N 2.82Å; Y816-L820 HydrophobicContact CD2-CD1 3.86Å; Y816-L820 HydrophobicContact CE2-CD1 4.32Å; Y816-L820 WeakPolarHBondContact O-CG 3.47Å; Y816-L820 PolarHBondContact O-N 3.2Å; Y816-L820 VanDerWaalsContact O-N 3.08Å
817	L	87.6	Confident	86.5	Confident	59 Å²	59	73.6 Å²	73.6	31%	0.309	39%	0.39	S	S	.	.	H	α-helix	trans	-64.3	-40.4	-179.8	-66.9	174.3	0	0	0	113.2	P813 I819 L820 N821	P813-L817 HydrophobicContact CB-CD1 3.69Å; P813-L817 HydrophobicContact CB-CG 4.2Å; P813-L817 WeakPolarHBondContact O-CB 3.35Å; P813-L817 VanDerWaalsContact O-CG 3.26Å; P813-L817 WeakPolarHBondContact O-CG 3.32Å; P813-L817 PolarHBondContact O-N 3.14Å; L817-I819 PolarHBondContact O-N 2.76Å; L817-L820 PolarHBondContact O-N 3.1Å; L817-N821 WeakPolarHBondContact O-CB 3.47Å; L817-N821 PolarHBondContact O-N 2.86Å; L817-N821 PolarHBondContact O-ND2 2.85Å
818	P	88.3	Confident	86.6	Confident	73 Å²	73	77.4 Å²	77.4	47%	0.474	40%	0.4	S	S	.	.	H	α-helix	trans	-61.1	-35.4	175.5	-25.5	36.6	0	0	0	112.8	K814 A822	K814-P818 VanDerWaalsContact O-CD 3.31Å; K814-P818 WeakPolarHBondContact O-CD 3.44Å; K814-P818 WeakPolarHBondContact O-CG 3.37Å; P818-A822 VanDerWaalsContact O-CB 3.27Å; P818-A822 WeakPolarHBondContact O-CB 3.31Å; P818-A822 PolarHBondContact O-N 2.82Å; P818-A822 VanDerWaalsContact O-N 3.13Å
819	I	86.7	Confident	86.7	Confident	50 Å²	50	77.7 Å²	77.7	26%	0.256	40%	0.399	S	S	.	.	H	α-helix	trans	-65.6	-47.8	176.8	-58.9	172.9	0	0	0	109.7	E815 Y816 L817 A822 L823 I838	E815-I819 WeakPolarHBondContact O-CD1 3.17Å; Y816-I819 PolarHBondContact O-N 2.82Å; L817-I819 PolarHBondContact O-N 2.76Å; I819-A822 PolarHBondContact O-N 2.86Å; I819-L823 HydrophobicContact CG2-CD1 3.85Å; I819-L823 VanDerWaalsContact O-CG 3.24Å; I819-L823 WeakPolarHBondContact O-CG 3.46Å; I819-L823 PolarHBondContact O-N 3.42Å; I819-I838 HydrophobicContact CG2-CD1 4.03Å
820	L	88.1	Confident	86.9	Confident	11 Å²	11	78.2 Å²	78.2	6%	0.058	40%	0.399	C	S	.	.	H	α-helix	trans	-65.1	-47.2	180	-65.2	178.5	0	0	0	112.4	L799 V802 Q803 Y816 L817 A822 L823 E824	L799-L820 HydrophobicContact CB-CD2 4.29Å; L799-L820 HydrophobicContact CD2-CD2 3.86Å; V802-L820 HydrophobicContact CB-CD2 4.23Å; V802-L820 HydrophobicContact CG1-CD2 3.92Å; Q803-L820 HydrophobicContact CB-CD1 3.82Å; Q803-L820 HydrophobicContact CG-CD1 4.19Å; Y816-L820 HydrophobicContact CD2-CD1 3.86Å; Y816-L820 HydrophobicContact CE2-CD1 4.32Å; Y816-L820 WeakPolarHBondContact O-CG 3.47Å; Y816-L820 PolarHBondContact O-N 3.2Å; Y816-L820 VanDerWaalsContact O-N 3.08Å; L817-L820 PolarHBondContact O-N 3.1Å; L820-A822 PolarHBondContact O-N 2.85Å; L820-L823 PolarHBondContact O-N 2.99Å; L820-E824 PolarHBondContact O-N 2.76Å
821	N	88.4	Confident	87.5	Confident	104 Å²	104	74.2 Å²	74.2	56%	0.556	37%	0.373	S	S	*	.	H	α-helix	trans	-62.8	-30.6	179.9	-68.8	-15.5	0	0	0	112.5	L817 P825	L817-N821 WeakPolarHBondContact O-CB 3.47Å; L817-N821 PolarHBondContact O-N 2.86Å; L817-N821 PolarHBondContact O-ND2 2.85Å; N821-P825 VanDerWaalsContact O-CD 3.25Å; N821-P825 WeakPolarHBondContact O-CD 3.13Å
822	A	89.3	Confident	87.9	Confident	62 Å²	62	73.5 Å²	73.5	51%	0.512	37%	0.371	S	S	.	.	H	α-helix	trans	-75.4	-29.7	174.9	0	0	0	0	0	113	P818 I819 L820	P818-A822 VanDerWaalsContact O-CB 3.27Å; P818-A822 WeakPolarHBondContact O-CB 3.31Å; P818-A822 PolarHBondContact O-N 2.82Å; P818-A822 VanDerWaalsContact O-N 3.13Å; I819-A822 PolarHBondContact O-N 2.86Å; L820-A822 PolarHBondContact O-N 2.85Å
823	L	89.6	Confident	88.2	Confident	6 Å²	6	71 Å²	71	3%	0.031	36%	0.356	C	S	.	.	H	α-helix	trans	-87.3	-32.6	-177.5	-69.6	172.6	0	0	0	113.3	L799 I819 L820 L826 R831 K834 I835 I838	L799-L823 HydrophobicContact CD1-CB 4.49Å; L799-L823 HydrophobicContact CD2-CB 4.38Å; L799-L823 HydrophobicContact CD2-CD1 4.31Å; I819-L823 HydrophobicContact CG2-CD1 3.85Å; I819-L823 VanDerWaalsContact O-CG 3.24Å; I819-L823 WeakPolarHBondContact O-CG 3.46Å; I819-L823 PolarHBondContact O-N 3.42Å; L820-L823 PolarHBondContact O-N 2.99Å; L823-L826 HydrophobicContact CD2-CD1 4.15Å; L823-L826 WeakPolarHBondContact O-CB 3.17Å; L823-L826 PolarHBondContact O-N 3.07Å; L823-R831 HydrophobicContact CB-CG 4.12Å; L823-R831 HydrophobicContact CD2-CG 4.29Å; L823-R831 WeakPolarHBondContact O-CD 3.24Å; L823-R831 WeakPolarHBondContact O-CG 3.4Å; L823-R831 PolarHBondContact O-NE 2.94Å; L823-K834 HydrophobicContact CD2-CB 3.75Å; L823-I835 HydrophobicContact CD1-CD1 4.25Å; L823-I835 HydrophobicContact CD1-CG1 3.67Å; L823-I835 HydrophobicContact CD2-CG1 4.07Å; L823-I835 HydrophobicContact CG-CG1 4.49Å; L823-I838 HydrophobicContact CD1-CD1 4.37Å
824	E	87	Confident	88.5	Confident	125 Å²	125	71.3 Å²	71.3	58%	0.584	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-42.3	-176	-164.5	176.1	-173	0	0	115.5	L799 L820 L826 R831	L799-E824 HydrophobicContact CD1-CB 4.37Å; L820-E824 PolarHBondContact O-N 2.76Å; E824-L826 VanDerWaalsContact C-N 3.29Å; E824-L826 PolarHBondContact O-N 3.02Å; E824-R831 PolarHBondContact O-NH2 3.16Å
825	P	89.2	Confident	88.8	Confident	106 Å²	106	63.1 Å²	63.1	69%	0.688	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-11.2	-178.9	30	-35.2	0	0	0	114.1	N821	N821-P825 VanDerWaalsContact O-CD 3.25Å; N821-P825 WeakPolarHBondContact O-CD 3.13Å
826	L	88.6	Confident	89.2	Confident	49 Å²	49	58.2 Å²	58.2	26%	0.257	29%	0.292	S	S	.	.	S	Bend	trans	-75	147.7	-175.4	-57.9	178.3	0	0	0	111.9	L823 E824 Y830 R831 K834	L823-L826 HydrophobicContact CD2-CD1 4.15Å; L823-L826 WeakPolarHBondContact O-CB 3.17Å; L823-L826 PolarHBondContact O-N 3.07Å; E824-L826 VanDerWaalsContact C-N 3.29Å; E824-L826 PolarHBondContact O-N 3.02Å; L826-Y830 HydrophobicContact CB-CD1 4.47Å; L826-Y830 HydrophobicContact CD1-CD1 4.24Å; L826-Y830 HydrophobicContact CD2-CD1 4.21Å; L826-Y830 HydrophobicContact CD2-CE1 4.42Å; L826-R831 HydrophobicContact CB-CB 4.01Å; L826-R831 HydrophobicContact CB-CG 4.5Å; L826-R831 PolarHBondContact O-NE 2.77Å; L826-R831 PolarHBondContact O-NH2 3.29Å; L826-K834 HydrophobicContact CD1-CB 4.38Å; L826-K834 HydrophobicContact CD1-CG 3.95Å
827	E	87.3	Confident	89.3	Confident	105 Å²	105	59.9 Å²	59.9	49%	0.491	31%	0.305	S	S	.	.			trans	-58.9	149.3	171.8	-175.8	171.3	-166.9	0	0	111	D829 Y830 R831	E827-D829 PolarHBondContact O-N 2.89Å; E827-Y830 PolarHBondContact O-N 2.8Å; E827-R831 VanDerWaalsContact O-CB 3.3Å; E827-R831 WeakPolarHBondContact O-CB 3.38Å; E827-R831 PolarHBondContact O-N 3.28Å
828	R	88.6	Confident	89.4	Confident	183 Å²	183	60.8 Å²	60.8	69%	0.691	31%	0.31	S	S	*	.	H	α-helix	trans	-50.1	-52.3	-168.6	-173.1	-177.5	-176.2	-172.4	0.3	114.1	K832	R828-K832 WeakPolarHBondContact O-CG 3.38Å; R828-K832 PolarHBondContact O-N 2.92Å
829	D	88.7	Confident	89.5	Confident	42 Å²	42	58.4 Å²	58.4	23%	0.225	29%	0.293	C	S	.	.	H	α-helix	trans	-78.8	-34.3	-174.5	-60.5	-52.1	0	0	0	111.9	E827 R831 K832 Y833 L851	E827-D829 PolarHBondContact O-N 2.89Å; D829-R831 VanDerWaalsContact C-N 3.31Å; D829-R831 PolarHBondContact O-N 2.87Å; D829-K832 PolarHBondContact O-N 3.41Å; D829-K832 IonicContact OD1-NZ 3.71Å; D829-K832 PolarHBondContact OD1-NZ 3.02Å; D829-Y833 PolarHBondContact O-N 2.88Å; D829-L851 HydrophobicContact CB-CB 4.45Å
830	Y	90	Very high	89.6	Confident	33 Å²	33	64.8 Å²	64.8	13%	0.129	32%	0.319	C	S	.	.	H	α-helix	trans	-64.6	-36.2	172.6	-164.3	-100.2	0	0	0	112.1	L826 E827 Y833 K834 L849 H856 E859	L826-Y830 HydrophobicContact CB-CD1 4.47Å; L826-Y830 HydrophobicContact CD1-CD1 4.24Å; L826-Y830 HydrophobicContact CD2-CD1 4.21Å; L826-Y830 HydrophobicContact CD2-CE1 4.42Å; E827-Y830 PolarHBondContact O-N 2.8Å; Y830-Y833 HydrophobicContact CD2-CD1 4.2Å; Y830-Y833 AromaticContact CE2-CD1 3.99Å; Y830-Y833 HydrophobicContact CE2-CD1 3.99Å; Y830-Y833 HydrophobicContact CE2-CE1 4.2Å; Y830-Y833 WeakPolarHBondContact O-CB 3.33Å; Y830-Y833 PolarHBondContact O-N 3.21Å; Y830-K834 HydrophobicContact CD1-CG 4.31Å; Y830-K834 HydrophobicContact CE1-CD 4.37Å; Y830-K834 HydrophobicContact CE1-CG 4.07Å; Y830-K834 VanDerWaalsContact CZ-CE 3.42Å; Y830-K834 PolarHBondContact O-N 2.83Å; Y830-K834 WeakPolarHBondContact OH-CE 3.46Å; Y830-K834 PolarHBondContact OH-NZ 3.25Å; Y830-L849 HydrophobicContact CD2-CD1 4.13Å; Y830-L849 HydrophobicContact CE2-CD1 4.05Å; Y830-H856 AromaticContact CD2-CE1 3.94Å; Y830-H856 AromaticContact CE2-CE1 3.74Å; Y830-H856 AromaticContact CE2-ND1 3.67Å; Y830-E859 VanDerWaalsContact CE2-OE2 3.26Å; Y830-E859 WeakPolarHBondContact CE2-OE2 3.33Å; Y830-E859 PolarHBondContact OH-OE1 3.32Å; Y830-E859 PolarHBondContact OH-OE2 3.02Å
831	R	91.4	Very high	89.6	Confident	66 Å²	66	68.4 Å²	68.4	25%	0.249	33%	0.332	C	S	.	.	H	α-helix	trans	-61.8	-46.7	173.2	-171.6	-170.9	-57.2	169.2	4	111.6	L823 E824 L826 E827 D829 Y833 K834 I835	L823-R831 HydrophobicContact CB-CG 4.12Å; L823-R831 HydrophobicContact CD2-CG 4.29Å; L823-R831 WeakPolarHBondContact O-CD 3.24Å; L823-R831 WeakPolarHBondContact O-CG 3.4Å; L823-R831 PolarHBondContact O-NE 2.94Å; E824-R831 PolarHBondContact O-NH2 3.16Å; L826-R831 HydrophobicContact CB-CB 4.01Å; L826-R831 HydrophobicContact CB-CG 4.5Å; L826-R831 PolarHBondContact O-NE 2.77Å; L826-R831 PolarHBondContact O-NH2 3.29Å; E827-R831 VanDerWaalsContact O-CB 3.3Å; E827-R831 WeakPolarHBondContact O-CB 3.38Å; E827-R831 PolarHBondContact O-N 3.28Å; D829-R831 VanDerWaalsContact C-N 3.31Å; D829-R831 PolarHBondContact O-N 2.87Å; R831-Y833 VanDerWaalsContact C-N 3.3Å; R831-Y833 PolarHBondContact O-N 2.85Å; R831-K834 PolarHBondContact O-N 3Å; R831-I835 HydrophobicContact CG-CD1 4.13Å; R831-I835 WeakPolarHBondContact O-CG1 3.5Å; R831-I835 PolarHBondContact O-N 2.92Å
832	K	91.8	Very high	89.6	Confident	42 Å²	42	65.5 Å²	65.5	18%	0.183	32%	0.319	C	S	.	.	H	α-helix	trans	-60.5	-41.7	176.2	-65.6	173.5	-169.7	155.2	0	111.5	Y797 R828 D829 K834 I835 D836 N848	Y797-K832 HydrophobicContact CD1-CB 3.97Å; Y797-K832 HydrophobicContact CD1-CG 3.78Å; Y797-K832 HydrophobicContact CE1-CB 3.94Å; Y797-K832 HydrophobicContact CE1-CG 4.16Å; Y797-K832 HydrophobicContact CG-CG 4.04Å; R828-K832 WeakPolarHBondContact O-CG 3.38Å; R828-K832 PolarHBondContact O-N 2.92Å; D829-K832 PolarHBondContact O-N 3.41Å; D829-K832 IonicContact OD1-NZ 3.71Å; D829-K832 PolarHBondContact OD1-NZ 3.02Å; K832-K834 PolarHBondContact O-N 2.95Å; K832-I835 PolarHBondContact O-N 2.73Å; K832-D836 PolarHBondContact O-N 3.08Å; K832-N848 HydrophobicContact CB-CB 3.99Å; K832-N848 WeakPolarHBondContact CD-OD1 3.47Å
833	Y	90.8	Very high	89.6	Confident	22 Å²	22	66.3 Å²	66.3	9%	0.086	31%	0.313	C	S	.	.	H	α-helix	trans	-55.5	-50.6	173.3	158.7	-110.6	0	0	0	111.7	D829 Y830 R831 I835 D836 C837 A845 L849 H863	D829-Y833 PolarHBondContact O-N 2.88Å; Y830-Y833 HydrophobicContact CD2-CD1 4.2Å; Y830-Y833 AromaticContact CE2-CD1 3.99Å; Y830-Y833 HydrophobicContact CE2-CD1 3.99Å; Y830-Y833 HydrophobicContact CE2-CE1 4.2Å; Y830-Y833 WeakPolarHBondContact O-CB 3.33Å; Y830-Y833 PolarHBondContact O-N 3.21Å; R831-Y833 VanDerWaalsContact C-N 3.3Å; R831-Y833 PolarHBondContact O-N 2.85Å; Y833-I835 VanDerWaalsContact C-N 3.34Å; Y833-I835 PolarHBondContact O-N 2.79Å; Y833-D836 PolarHBondContact O-N 3.13Å; Y833-C837 WeakPolarHBondContact CE2-SG 3.37Å; Y833-C837 PolarHBondContact O-N 3.02Å; Y833-C837 PolarHBondContact O-SG 3.35Å; Y833-C837 VanDerWaalsContact O-SG 3.38Å; Y833-A845 HydrophobicContact CD2-CB 3.8Å; Y833-A845 WeakPolarHBondContact CD2-O 3.33Å; Y833-A845 HydrophobicContact CE2-CB 4.12Å; Y833-L849 HydrophobicContact CD1-CD1 3.77Å; Y833-L849 HydrophobicContact CD2-CB 3.79Å; Y833-L849 HydrophobicContact CD2-CD1 4.2Å; Y833-L849 HydrophobicContact CD2-CD2 4.18Å; Y833-L849 HydrophobicContact CD2-CG 4.28Å; Y833-L849 HydrophobicContact CE1-CD1 3.97Å; Y833-L849 HydrophobicContact CE2-CB 4.28Å; Y833-L849 HydrophobicContact CE2-CD1 4.39Å; Y833-L849 HydrophobicContact CE2-CD2 3.82Å; Y833-L849 HydrophobicContact CE2-CG 4.4Å; Y833-L849 HydrophobicContact CG-CB 4.07Å; Y833-L849 HydrophobicContact CG-CD1 3.89Å; Y833-L849 HydrophobicContact CG-CG 4.42Å; Y833-H863 AromaticContact CE2-CE1 3.96Å; Y833-H863 AromaticContact CE2-ND1 3.71Å
834	K	91.2	Very high	89.6	Confident	69 Å²	69	67.6 Å²	67.6	30%	0.3	32%	0.323	S	S	.	.	H	α-helix	trans	-62.5	-39.2	177.9	-68.3	-62.8	-177.1	-169	0	112.5	L823 L826 Y830 R831 K832 C837 I838	L823-K834 HydrophobicContact CD2-CB 3.75Å; L826-K834 HydrophobicContact CD1-CB 4.38Å; L826-K834 HydrophobicContact CD1-CG 3.95Å; Y830-K834 HydrophobicContact CD1-CG 4.31Å; Y830-K834 HydrophobicContact CE1-CD 4.37Å; Y830-K834 HydrophobicContact CE1-CG 4.07Å; Y830-K834 VanDerWaalsContact CZ-CE 3.42Å; Y830-K834 PolarHBondContact O-N 2.83Å; Y830-K834 WeakPolarHBondContact OH-CE 3.46Å; Y830-K834 PolarHBondContact OH-NZ 3.25Å; R831-K834 PolarHBondContact O-N 3Å; K832-K834 PolarHBondContact O-N 2.95Å; K834-C837 WeakPolarHBondContact O-CB 3.41Å; K834-C837 PolarHBondContact O-N 3.37Å; K834-I838 WeakPolarHBondContact O-CG1 3.41Å; K834-I838 PolarHBondContact O-N 3.47Å; K834-I838 VanDerWaalsContact O-N 3.08Å
835	I	92	Very high	89.8	Confident	2 Å²	2	61.7 Å²	61.7	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-61	-48.5	174.5	-71	168.5	0	0	0	110.7	L794 Y797 L799 L823 R831 K832 Y833 C837 I838 L839	L794-I835 HydrophobicContact CB-CG2 4.48Å; L794-I835 VanDerWaalsContact O-CG2 3.32Å; L794-I835 WeakPolarHBondContact O-CG2 3.32Å; Y797-I835 HydrophobicContact CD1-CB 4.2Å; Y797-I835 HydrophobicContact CD1-CD1 4.08Å; Y797-I835 HydrophobicContact CD1-CG2 3.89Å; Y797-I835 HydrophobicContact CE1-CB 4.34Å; Y797-I835 HydrophobicContact CE1-CG2 3.98Å; L799-I835 HydrophobicContact CD2-CD1 4.33Å; L823-I835 HydrophobicContact CD1-CD1 4.25Å; L823-I835 HydrophobicContact CD1-CG1 3.67Å; L823-I835 HydrophobicContact CD2-CG1 4.07Å; L823-I835 HydrophobicContact CG-CG1 4.49Å; R831-I835 HydrophobicContact CG-CD1 4.13Å; R831-I835 WeakPolarHBondContact O-CG1 3.5Å; R831-I835 PolarHBondContact O-N 2.92Å; K832-I835 PolarHBondContact O-N 2.73Å; Y833-I835 VanDerWaalsContact C-N 3.34Å; Y833-I835 PolarHBondContact O-N 2.79Å; I835-C837 VanDerWaalsContact C-N 3.27Å; I835-C837 PolarHBondContact O-N 2.94Å; I835-I838 WeakPolarHBondContact O-CA 3.45Å; I835-I838 WeakPolarHBondContact O-CB 3.34Å; I835-I838 PolarHBondContact O-N 2.85Å; I835-L839 HydrophobicContact CG2-CD1 3.84Å; I835-L839 HydrophobicContact CG2-CG 4.37Å; I835-L839 WeakPolarHBondContact O-CG 3.35Å; I835-L839 PolarHBondContact O-N 3.29Å
836	D	92	Very high	89.8	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.9	-33	178.4	-81.3	-37.1	0	0	0	112.8	Y797 K832 Y833 L839 K840 R841 S844 A845 N848	Y797-D836 PolarHBondContact OH-OD1 2.89Å; Y797-D836 PolarHBondContact OH-OD2 2.79Å; Y797-D836 VanDerWaalsContact OH-OD2 3.14Å; K832-D836 PolarHBondContact O-N 3.08Å; Y833-D836 PolarHBondContact O-N 3.13Å; D836-L839 CarbonylContact O-C 3.57Å; D836-L839 PolarHBondContact O-N 2.98Å; D836-K840 PolarHBondContact O-N 3.45Å; D836-R841 HydrophobicContact CB-CB 4.2Å; D836-R841 PolarHBondContact O-N 3.47Å; D836-S844 VanDerWaalsContact CG-CB 3.49Å; D836-S844 VanDerWaalsContact CG-OG 3.27Å; D836-S844 PolarHBondContact OD1-OG 3.06Å; D836-S844 WeakPolarHBondContact OD2-CB 3.42Å; D836-S844 PolarHBondContact OD2-OG 3.2Å; D836-A845 HydrophobicContact CB-CB 3.67Å; D836-A845 PolarHBondContact OD2-N 3.47Å; D836-N848 PolarHBondContact OD2-ND2 2.86Å
837	C	89.6	Confident	89.9	Confident	48 Å²	48	59.8 Å²	59.8	32%	0.324	28%	0.275	S	S	.	.	H	α-helix	trans	-62.4	-42.4	170.4	-73.3	0	0	0	0	112	Y833 K834 I835 K840	Y833-C837 WeakPolarHBondContact CE2-SG 3.37Å; Y833-C837 PolarHBondContact O-N 3.02Å; Y833-C837 PolarHBondContact O-SG 3.35Å; Y833-C837 VanDerWaalsContact O-SG 3.38Å; K834-C837 WeakPolarHBondContact O-CB 3.41Å; K834-C837 PolarHBondContact O-N 3.37Å; I835-C837 VanDerWaalsContact C-N 3.27Å; I835-C837 PolarHBondContact O-N 2.94Å; C837-K840 PolarHBondContact O-N 2.87Å
838	I	88.6	Confident	90	Very high	78 Å²	78	55.5 Å²	55.5	40%	0.4	26%	0.255	S	S	.	.	H	α-helix	trans	-63.2	-43.8	176.1	-66.1	163.8	0	0	0	110.3	L794 I819 L823 K834 I835 K840	L794-I838 HydrophobicContact CD1-CG2 4.4Å; I819-I838 HydrophobicContact CG2-CD1 4.03Å; L823-I838 HydrophobicContact CD1-CD1 4.37Å; K834-I838 WeakPolarHBondContact O-CG1 3.41Å; K834-I838 PolarHBondContact O-N 3.47Å; K834-I838 VanDerWaalsContact O-N 3.08Å; I835-I838 WeakPolarHBondContact O-CA 3.45Å; I835-I838 WeakPolarHBondContact O-CB 3.34Å; I835-I838 PolarHBondContact O-N 2.85Å; I838-K840 PolarHBondContact O-N 3.01Å
839	L	89.5	Confident	90	Very high	24 Å²	24	46.9 Å²	46.9	13%	0.126	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	0.5	178.1	-63.7	176	0	0	0	114	N791 L794 G795 I835 D836 R841	N791-L839 HydrophobicContact CB-CD2 3.88Å; N791-L839 WeakPolarHBondContact O-CD2 3.34Å; L794-L839 HydrophobicContact CB-CD1 4.19Å; L794-L839 HydrophobicContact CB-CD2 3.86Å; L794-L839 HydrophobicContact CB-CG 4.3Å; L794-L839 HydrophobicContact CD1-CD2 4.29Å; G795-L839 VanDerWaalsContact CA-CD1 3.49Å; I835-L839 HydrophobicContact CG2-CD1 3.84Å; I835-L839 HydrophobicContact CG2-CG 4.37Å; I835-L839 WeakPolarHBondContact O-CG 3.35Å; I835-L839 PolarHBondContact O-N 3.29Å; D836-L839 CarbonylContact O-C 3.57Å; D836-L839 PolarHBondContact O-N 2.98Å; L839-R841 VanDerWaalsContact C-N 3.29Å; L839-R841 HydrophobicContact CB-CG 4.01Å; L839-R841 PolarHBondContact O-N 3.32Å
840	K	89.4	Confident	89.9	Confident	183 Å²	183	46.1 Å²	46.1	80%	0.796	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.7	42.2	-177.2	-55.8	176.5	-176.8	171.7	0	112.5	D836 C837 I838 P842	D836-K840 PolarHBondContact O-N 3.45Å; C837-K840 PolarHBondContact O-N 2.87Å; I838-K840 PolarHBondContact O-N 3.01Å; K840-P842 WeakPolarHBondContact O-CD 3.2Å
841	R	89.3	Confident	89.7	Confident	87 Å²	87	50.2 Å²	50.2	33%	0.328	25%	0.245	S	C	.	.			trans	-105.1	76.9	177.2	-65	178.6	-178.8	-173.8	-1.8	110.9	E754 D836 L839 I843 S844 A845	E754-R841 IonicContact OE1-CZ 2.58Å; E754-R841 IonicContact OE1-NH1 2.73Å; E754-R841 PolarHBondContact OE1-NH1 3.48Å; E754-R841 IonicContact OE1-NH2 2.84Å; E754-R841 PolarHBondContact OE1-NH2 2.98Å; E754-R841 IonicContact OE2-NH1 3.2Å; D836-R841 HydrophobicContact CB-CB 4.2Å; D836-R841 PolarHBondContact O-N 3.47Å; L839-R841 VanDerWaalsContact C-N 3.29Å; L839-R841 HydrophobicContact CB-CG 4.01Å; L839-R841 PolarHBondContact O-N 3.32Å; R841-I843 VanDerWaalsContact C-N 3.32Å; R841-I843 PolarHBondContact O-N 3.47Å; R841-S844 PolarHBondContact O-N 2.82Å; R841-A845 WeakPolarHBondContact O-CB 3.3Å; R841-A845 PolarHBondContact O-N 3.42Å
842	P	88.2	Confident	89.3	Confident	44 Å²	44	48 Å²	48	29%	0.286	24%	0.24	S	C	.	.	H	α-helix	trans	-66	-33	-166.1	29.7	-38.7	0	0	0	113.1	K840 L846 H863 H867 L869	K840-P842 WeakPolarHBondContact O-CD 3.2Å; P842-L846 PolarHBondContact O-N 3.21Å; P842-H863 PolarHBondContact O-NE2 3.21Å; P842-H863 VanDerWaalsContact O-NE2 3.1Å; P842-H867 HydrophobicContact CB-CB 4.11Å; P842-L869 HydrophobicContact CB-CD1 4.09Å; P842-L869 VanDerWaalsContact O-CD1 3.29Å; P842-L869 WeakPolarHBondContact O-CD1 3.4Å
843	I	89.6	Confident	88.5	Confident	78 Å²	78	54 Å²	54	40%	0.4	26%	0.261	S	S	.	.	H	α-helix	trans	-70.7	-42.1	178.2	-59.1	172.4	0	0	0	111.2	R841 L846 K847 L869	R841-I843 VanDerWaalsContact C-N 3.32Å; R841-I843 PolarHBondContact O-N 3.47Å; I843-L846 PolarHBondContact O-N 2.68Å; I843-K847 WeakPolarHBondContact O-CG 3.46Å; I843-K847 PolarHBondContact O-N 2.93Å; I843-K847 VanDerWaalsContact O-N 3.15Å; I843-L869 HydrophobicContact CG1-CD2 4.08Å
844	S	88.6	Confident	87.8	Confident	34 Å²	34	58 Å²	58	24%	0.238	28%	0.283	C	S	.	.	H	α-helix	trans	-69.2	-41.7	177.3	-170.2	0	0	0	0	110.8	Y797 D836 R841 L846 K847 N848	Y797-S844 PolarHBondContact OH-OG 3Å; D836-S844 VanDerWaalsContact CG-CB 3.49Å; D836-S844 VanDerWaalsContact CG-OG 3.27Å; D836-S844 PolarHBondContact OD1-OG 3.06Å; D836-S844 WeakPolarHBondContact OD2-CB 3.42Å; D836-S844 PolarHBondContact OD2-OG 3.2Å; R841-S844 PolarHBondContact O-N 2.82Å; S844-L846 VanDerWaalsContact C-N 3.32Å; S844-L846 PolarHBondContact O-N 3.01Å; S844-K847 WeakPolarHBondContact O-CB 3.41Å; S844-K847 PolarHBondContact O-N 3.27Å; S844-K847 VanDerWaalsContact O-N 3.12Å; S844-N848 PolarHBondContact O-N 3Å; S844-N848 PolarHBondContact O-ND2 3.22Å
845	A	90.9	Very high	87.2	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-54.5	-47.6	173.1	0	0	0	0	0	111.5	Y833 D836 R841 K847 N848 L849	Y833-A845 HydrophobicContact CD2-CB 3.8Å; Y833-A845 WeakPolarHBondContact CD2-O 3.33Å; Y833-A845 HydrophobicContact CE2-CB 4.12Å; D836-A845 HydrophobicContact CB-CB 3.67Å; D836-A845 PolarHBondContact OD2-N 3.47Å; R841-A845 WeakPolarHBondContact O-CB 3.3Å; R841-A845 PolarHBondContact O-N 3.42Å; A845-K847 PolarHBondContact O-N 3.17Å; A845-N848 PolarHBondContact O-N 3.47Å; A845-L849 WeakPolarHBondContact O-CB 3.31Å; A845-L849 PolarHBondContact O-N 3.06Å
846	L	90.6	Very high	86.7	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61.9	-41.6	177.7	-176.8	67.3	0	0	0	112.2	P842 I843 S844 N848 L849 A850 V860 I864 L869 Q872 A873 M876	P842-L846 PolarHBondContact O-N 3.21Å; I843-L846 PolarHBondContact O-N 2.68Å; S844-L846 VanDerWaalsContact C-N 3.32Å; S844-L846 PolarHBondContact O-N 3.01Å; L846-N848 PolarHBondContact O-N 2.92Å; L846-L849 PolarHBondContact O-N 3.24Å; L846-A850 VanDerWaalsContact O-CB 3.32Å; L846-A850 WeakPolarHBondContact O-CB 3.26Å; L846-A850 PolarHBondContact O-N 3.27Å; L846-V860 HydrophobicContact CD1-CG1 4.18Å; L846-I864 HydrophobicContact CD1-CD1 4.27Å; L846-I864 HydrophobicContact CD1-CG1 3.71Å; L846-I864 HydrophobicContact CD2-CG1 4.44Å; L846-L869 HydrophobicContact CB-CD1 3.99Å; L846-L869 HydrophobicContact CD2-CB 3.83Å; L846-L869 HydrophobicContact CD2-CD1 3.96Å; L846-Q872 HydrophobicContact CD2-CB 4.14Å; L846-A873 HydrophobicContact CD2-CB 4.16Å; L846-M876 HydrophobicContact CD2-CE 4.08Å; L846-M876 HydrophobicContact CD2-SD 4.11Å; L846-M876 HydrophobicContact CG-CE 4.28Å; L846-M876 HydrophobicContact CG-SD 3.95Å
847	K	89.2	Confident	86.5	Confident	116 Å²	116	65.1 Å²	65.1	50%	0.504	32%	0.322	S	S	.	.	H	α-helix	trans	-59.4	-45.7	176.2	-73.9	178.5	-179.4	-178	0	111.8	I843 S844 A845 L851 M876	I843-K847 WeakPolarHBondContact O-CG 3.46Å; I843-K847 PolarHBondContact O-N 2.93Å; I843-K847 VanDerWaalsContact O-N 3.15Å; S844-K847 WeakPolarHBondContact O-CB 3.41Å; S844-K847 PolarHBondContact O-N 3.27Å; S844-K847 VanDerWaalsContact O-N 3.12Å; A845-K847 PolarHBondContact O-N 3.17Å; K847-L851 WeakPolarHBondContact O-CG 3.29Å; K847-L851 PolarHBondContact O-N 3.02Å; K847-M876 HydrophobicContact CB-CE 4.38Å; K847-M876 HydrophobicContact CD-CE 4.38Å; K847-M876 HydrophobicContact CG-CE 3.32Å; K847-M876 HydrophobicContact CG-SD 4Å
848	N	89.6	Confident	86.4	Confident	15 Å²	15	70.1 Å²	70.1	8%	0.08	34%	0.34	C	S	.	.	H	α-helix	trans	-70	-36.8	-179.6	-73.7	-45.3	0	0	0	112.1	K832 D836 S844 A845 L846 L851 C852	K832-N848 HydrophobicContact CB-CB 3.99Å; K832-N848 WeakPolarHBondContact CD-OD1 3.47Å; D836-N848 PolarHBondContact OD2-ND2 2.86Å; S844-N848 PolarHBondContact O-N 3Å; S844-N848 PolarHBondContact O-ND2 3.22Å; A845-N848 PolarHBondContact O-N 3.47Å; L846-N848 PolarHBondContact O-N 2.92Å; N848-L851 PolarHBondContact O-N 3.35Å; N848-C852 PolarHBondContact O-SG 3.06Å; N848-C852 VanDerWaalsContact O-SG 3.4Å
849	L	89.1	Confident	86.4	Confident	1 Å²	1	69.2 Å²	69.2	1%	0.005	34%	0.335	C	S	.	.	H	α-helix	trans	-69.6	-36.6	176.6	-166.9	64.8	0	0	0	112.1	Y830 Y833 A845 L846 L851 C852 H856 E859 V860 H863	Y830-L849 HydrophobicContact CD2-CD1 4.13Å; Y830-L849 HydrophobicContact CE2-CD1 4.05Å; Y833-L849 HydrophobicContact CD1-CD1 3.77Å; Y833-L849 HydrophobicContact CD2-CB 3.79Å; Y833-L849 HydrophobicContact CD2-CD1 4.2Å; Y833-L849 HydrophobicContact CD2-CD2 4.18Å; Y833-L849 HydrophobicContact CD2-CG 4.28Å; Y833-L849 HydrophobicContact CE1-CD1 3.97Å; Y833-L849 HydrophobicContact CE2-CB 4.28Å; Y833-L849 HydrophobicContact CE2-CD1 4.39Å; Y833-L849 HydrophobicContact CE2-CD2 3.82Å; Y833-L849 HydrophobicContact CE2-CG 4.4Å; Y833-L849 HydrophobicContact CG-CB 4.07Å; Y833-L849 HydrophobicContact CG-CD1 3.89Å; Y833-L849 HydrophobicContact CG-CG 4.42Å; A845-L849 WeakPolarHBondContact O-CB 3.31Å; A845-L849 PolarHBondContact O-N 3.06Å; L846-L849 PolarHBondContact O-N 3.24Å; L849-L851 PolarHBondContact O-N 3.13Å; L849-C852 VanDerWaalsContact O-CB 3.27Å; L849-C852 WeakPolarHBondContact O-CB 3.35Å; L849-C852 PolarHBondContact O-N 2.97Å; L849-H856 HydrophobicContact CD1-CB 4.46Å; L849-E859 HydrophobicContact CD2-CB 4.25Å; L849-V860 HydrophobicContact CB-CG2 4.44Å; L849-V860 HydrophobicContact CD2-CB 4.32Å; L849-V860 HydrophobicContact CD2-CG2 3.76Å; L849-V860 HydrophobicContact CG-CG2 3.65Å; L849-H863 HydrophobicContact CD2-CB 4.16Å
850	A	86.2	Confident	86.4	Confident	26 Å²	26	68.1 Å²	68.1	22%	0.215	33%	0.329	C	S	.	.	H	α-helix	trans	-65.8	-21.9	176.6	0	0	0	0	0	113.6	L846 M876 Y877	L846-A850 VanDerWaalsContact O-CB 3.32Å; L846-A850 WeakPolarHBondContact O-CB 3.26Å; L846-A850 PolarHBondContact O-N 3.27Å; A850-M876 HydrophobicContact CB-SD 4.29Å; A850-Y877 HydrophobicContact CB-CE2 3.95Å
851	L	86.1	Confident	86.4	Confident	119 Å²	119	60.8 Å²	60.8	62%	0.623	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-13.7	174	-67.2	171.8	0	0	0	113.2	D829 K847 N848 L849	D829-L851 HydrophobicContact CB-CB 4.45Å; K847-L851 WeakPolarHBondContact O-CG 3.29Å; K847-L851 PolarHBondContact O-N 3.02Å; N848-L851 PolarHBondContact O-N 3.35Å; L849-L851 PolarHBondContact O-N 3.13Å
852	C	84.2	Confident	86.5	Confident	19 Å²	19	61.1 Å²	61.1	13%	0.128	31%	0.307	C	S	.	.	S	Bend	trans	-70.8	163.7	176.7	-61.6	0	0	0	0	110.9	N848 L849 H856	N848-C852 PolarHBondContact O-SG 3.06Å; N848-C852 VanDerWaalsContact O-SG 3.4Å; L849-C852 VanDerWaalsContact O-CB 3.27Å; L849-C852 WeakPolarHBondContact O-CB 3.35Å; L849-C852 PolarHBondContact O-N 2.97Å; C852-H856 HydrophobicContact CB-CB 4.48Å
853	R	74.4	Confident	86.6	Confident	168 Å²	168	59.4 Å²	59.4	63%	0.634	30%	0.295	S	S	*	.			trans	-59.6	154.4	177.1	-61.6	-178.1	-171.6	-178	2.8	111.1	D855 H856	R853-D855 PolarHBondContact O-N 3.48Å; R853-H856 PolarHBondContact O-N 3.25Å
854	L	75.9	Confident	86.6	Confident	106 Å²	106	55.8 Å²	55.8	56%	0.555	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-54.4	-20.4	-179.9	-72.7	168.8	0	0	0	113.8	H856 F857 Q883	L854-H856 PolarHBondContact O-N 3.28Å; L854-H856 VanDerWaalsContact O-N 3.14Å; L854-F857 VanDerWaalsContact O-CB 3.28Å; L854-F857 WeakPolarHBondContact O-CB 3.29Å; L854-F857 PolarHBondContact O-N 2.97Å; L854-Q883 HydrophobicContact CD2-CG 4.29Å
855	D	77.9	Confident	86.7	Confident	138 Å²	138	57.9 Å²	57.9	74%	0.738	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-55.9	-26.1	174.7	-53.9	-24.8	0	0	0	113.1	R853	R853-D855 PolarHBondContact O-N 3.48Å
856	H	82.7	Confident	86.7	Confident	49 Å²	49	67.8 Å²	67.8	23%	0.227	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-94	10.6	177.9	-65.2	-75.5	0	0	0	114.3	Y830 L849 C852 R853 L854 E858 E859 V860	Y830-H856 AromaticContact CD2-CE1 3.94Å; Y830-H856 AromaticContact CE2-CE1 3.74Å; Y830-H856 AromaticContact CE2-ND1 3.67Å; L849-H856 HydrophobicContact CD1-CB 4.46Å; C852-H856 HydrophobicContact CB-CB 4.48Å; R853-H856 PolarHBondContact O-N 3.25Å; L854-H856 PolarHBondContact O-N 3.28Å; L854-H856 VanDerWaalsContact O-N 3.14Å; H856-E858 PolarHBondContact O-N 3.46Å; H856-E859 IonicContact CE1-OE1 2.71Å; H856-E859 IonicContact ND1-OE1 3.97Å; H856-E859 PolarHBondContact ND1-OE1 3.12Å; H856-E859 WeakPolarHBondContact O-CA 3.44Å; H856-E859 WeakPolarHBondContact O-CB 3.5Å; H856-E859 PolarHBondContact O-N 3.37Å; H856-V860 PolarHBondContact O-N 2.89Å; H856-V860 VanDerWaalsContact O-N 3.07Å
857	F	86.6	Confident	86.6	Confident	35 Å²	35	71.6 Å²	71.6	15%	0.154	34%	0.337	C	S	.	.	H	α-helix	trans	-60.9	-30.7	-175	-171.8	-112.8	0	0	0	113.4	L854 V860 L861 Y877 Q883 V886 I887	L854-F857 VanDerWaalsContact O-CB 3.28Å; L854-F857 WeakPolarHBondContact O-CB 3.29Å; L854-F857 PolarHBondContact O-N 2.97Å; F857-V860 HydrophobicContact CD2-CB 4.38Å; F857-V860 WeakPolarHBondContact O-CB 3.43Å; F857-V860 PolarHBondContact O-N 3.42Å; F857-L861 HydrophobicContact CD1-CD1 4.16Å; F857-L861 HydrophobicContact CD1-CG 4.41Å; F857-L861 HydrophobicContact CE1-CD1 3.88Å; F857-L861 HydrophobicContact CE1-CD2 4.27Å; F857-L861 HydrophobicContact CE1-CG 4.09Å; F857-L861 HydrophobicContact CZ-CD2 4.14Å; F857-L861 HydrophobicContact CZ-CG 4.33Å; F857-L861 PolarHBondContact O-N 2.77Å; F857-Y877 HydrophobicContact CD2-CE1 4.2Å; F857-Y877 HydrophobicContact CE2-CD1 4.4Å; F857-Y877 AromaticContact CE2-CE1 3.93Å; F857-Y877 HydrophobicContact CE2-CE1 3.93Å; F857-Q883 HydrophobicContact CD2-CB 4.45Å; F857-Q883 HydrophobicContact CD2-CG 4.05Å; F857-Q883 HydrophobicContact CE1-CB 4.37Å; F857-Q883 HydrophobicContact CE1-CG 4.26Å; F857-Q883 HydrophobicContact CE2-CB 3.58Å; F857-Q883 HydrophobicContact CE2-CG 3.66Å; F857-Q883 HydrophobicContact CZ-CB 3.53Å; F857-Q883 HydrophobicContact CZ-CG 3.77Å; F857-V886 HydrophobicContact CE1-CB 4.37Å; F857-V886 HydrophobicContact CE1-CG1 4.31Å; F857-I887 HydrophobicContact CE2-CD1 4.11Å; F857-I887 HydrophobicContact CE2-CG1 4.41Å; F857-I887 HydrophobicContact CZ-CD1 4.21Å; F857-I887 HydrophobicContact CZ-CG1 4.05Å
858	E	88	Confident	86.6	Confident	152 Å²	152	68.9 Å²	68.9	71%	0.71	33%	0.333	S	S	*	.	H	α-helix	trans	-67	-35.3	173.6	-166.8	173	-172.1	0	0	112.3	H856 V860 L861 N862	H856-E858 PolarHBondContact O-N 3.46Å; E858-V860 VanDerWaalsContact C-N 3.32Å; E858-L861 PolarHBondContact O-N 3.32Å; E858-N862 PolarHBondContact O-N 2.86Å; E858-N862 PolarHBondContact O-ND2 2.72Å; E858-N862 VanDerWaalsContact O-ND2 3.08Å
859	E	88.5	Confident	86.6	Confident	60 Å²	60	68.7 Å²	68.7	28%	0.28	33%	0.332	S	S	.	.	H	α-helix	trans	-66.7	-35.8	171.2	-69.3	-175.5	-129.3	0	0	111.5	Y830 L849 H856 N862 H863	Y830-E859 VanDerWaalsContact CE2-OE2 3.26Å; Y830-E859 WeakPolarHBondContact CE2-OE2 3.33Å; Y830-E859 PolarHBondContact OH-OE1 3.32Å; Y830-E859 PolarHBondContact OH-OE2 3.02Å; L849-E859 HydrophobicContact CD2-CB 4.25Å; H856-E859 IonicContact CE1-OE1 2.71Å; H856-E859 IonicContact ND1-OE1 3.97Å; H856-E859 PolarHBondContact ND1-OE1 3.12Å; H856-E859 WeakPolarHBondContact O-CA 3.44Å; H856-E859 WeakPolarHBondContact O-CB 3.5Å; H856-E859 PolarHBondContact O-N 3.37Å; E859-N862 PolarHBondContact O-N 3.37Å; E859-H863 WeakPolarHBondContact O-CB 3.39Å; E859-H863 PolarHBondContact O-N 2.92Å
860	V	89.1	Confident	86.7	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.006	33%	0.333	C	S	.	.	H	α-helix	trans	-60.8	-49.7	174.5	174	0	0	0	0	110.4	L846 L849 H856 F857 E858 N862 H863 I864 Y877	L846-V860 HydrophobicContact CD1-CG1 4.18Å; L849-V860 HydrophobicContact CB-CG2 4.44Å; L849-V860 HydrophobicContact CD2-CB 4.32Å; L849-V860 HydrophobicContact CD2-CG2 3.76Å; L849-V860 HydrophobicContact CG-CG2 3.65Å; H856-V860 PolarHBondContact O-N 2.89Å; H856-V860 VanDerWaalsContact O-N 3.07Å; F857-V860 HydrophobicContact CD2-CB 4.38Å; F857-V860 WeakPolarHBondContact O-CB 3.43Å; F857-V860 PolarHBondContact O-N 3.42Å; E858-V860 VanDerWaalsContact C-N 3.32Å; V860-N862 PolarHBondContact O-N 3.28Å; V860-H863 PolarHBondContact O-N 2.78Å; V860-I864 HydrophobicContact CG1-CD1 3.64Å; V860-I864 HydrophobicContact CG1-CG1 4.36Å; V860-I864 WeakPolarHBondContact O-CD1 3.39Å; V860-I864 WeakPolarHBondContact O-CG1 3.44Å; V860-I864 PolarHBondContact O-N 3.44Å; V860-Y877 HydrophobicContact CG1-CE2 3.96Å
861	L	89.7	Confident	86.8	Confident	29 Å²	29	70.4 Å²	70.4	15%	0.152	34%	0.344	C	S	.	.	H	α-helix	trans	-59.5	-47.2	178.2	-67.8	175.4	0	0	0	111.5	F857 E858 H863 I864 E865 V886 I887	F857-L861 HydrophobicContact CD1-CD1 4.16Å; F857-L861 HydrophobicContact CD1-CG 4.41Å; F857-L861 HydrophobicContact CE1-CD1 3.88Å; F857-L861 HydrophobicContact CE1-CD2 4.27Å; F857-L861 HydrophobicContact CE1-CG 4.09Å; F857-L861 HydrophobicContact CZ-CD2 4.14Å; F857-L861 HydrophobicContact CZ-CG 4.33Å; F857-L861 PolarHBondContact O-N 2.77Å; E858-L861 PolarHBondContact O-N 3.32Å; L861-H863 VanDerWaalsContact C-N 3.32Å; L861-H863 PolarHBondContact O-N 3.22Å; L861-I864 PolarHBondContact O-N 3.48Å; L861-E865 WeakPolarHBondContact O-CG 3.22Å; L861-E865 PolarHBondContact O-N 2.72Å; L861-V886 HydrophobicContact CD1-CG1 3.98Å; L861-V886 HydrophobicContact CD2-CG1 4.28Å; L861-I887 HydrophobicContact CD2-CG1 3.88Å
862	N	90.9	Very high	87	Confident	94 Å²	94	67.9 Å²	67.9	50%	0.503	33%	0.329	S	S	.	.	H	α-helix	trans	-60.7	-39	176.8	-77.7	-43.7	0	0	0	112.6	E858 E859 V860 R866	E858-N862 PolarHBondContact O-N 2.86Å; E858-N862 PolarHBondContact O-ND2 2.72Å; E858-N862 VanDerWaalsContact O-ND2 3.08Å; E859-N862 PolarHBondContact O-N 3.37Å; V860-N862 PolarHBondContact O-N 3.28Å; N862-R866 WeakPolarHBondContact O-CB 3.25Å; N862-R866 PolarHBondContact O-N 3.42Å
863	H	90.2	Very high	87.2	Confident	8 Å²	8	67 Å²	67	4%	0.037	32%	0.323	C	S	.	.	H	α-helix	trans	-68.7	-39.2	177.6	-170.1	80.6	0	0	0	112.1	Y833 P842 L849 E859 V860 L861 H867	Y833-H863 AromaticContact CE2-CE1 3.96Å; Y833-H863 AromaticContact CE2-ND1 3.71Å; P842-H863 PolarHBondContact O-NE2 3.21Å; P842-H863 VanDerWaalsContact O-NE2 3.1Å; L849-H863 HydrophobicContact CD2-CB 4.16Å; E859-H863 WeakPolarHBondContact O-CB 3.39Å; E859-H863 PolarHBondContact O-N 2.92Å; V860-H863 PolarHBondContact O-N 2.78Å; L861-H863 VanDerWaalsContact C-N 3.32Å; L861-H863 PolarHBondContact O-N 3.22Å; H863-H867 AromaticContact CE1-CD2 3.41Å; H863-H867 PolarHBondContact CE1-CD2 3.23Å; H863-H867 VanDerWaalsContact CE1-CD2 3.41Å; H863-H867 AromaticContact CE1-NE2 3.75Å; H863-H867 AromaticContact ND1-CD2 3.66Å; H863-H867 AromaticContact NE2-CD2 3.8Å; H863-H867 PolarHBondContact O-N 2.94Å; H863-H867 VanDerWaalsContact O-N 3.14Å
864	I	91.1	Very high	87.9	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-63.3	-50.2	175.3	-67.1	163	0	0	0	110.4	L846 V860 L861 R866 H867 S868 L869 Y870 A873 I887	L846-I864 HydrophobicContact CD1-CD1 4.27Å; L846-I864 HydrophobicContact CD1-CG1 3.71Å; L846-I864 HydrophobicContact CD2-CG1 4.44Å; V860-I864 HydrophobicContact CG1-CD1 3.64Å; V860-I864 HydrophobicContact CG1-CG1 4.36Å; V860-I864 WeakPolarHBondContact O-CD1 3.39Å; V860-I864 WeakPolarHBondContact O-CG1 3.44Å; V860-I864 PolarHBondContact O-N 3.44Å; L861-I864 PolarHBondContact O-N 3.48Å; I864-R866 VanDerWaalsContact C-N 3.34Å; I864-R866 PolarHBondContact O-N 2.8Å; I864-H867 PolarHBondContact O-N 2.89Å; I864-S868 VanDerWaalsContact O-CA 3.3Å; I864-S868 WeakPolarHBondContact O-CA 3.37Å; I864-S868 PolarHBondContact O-N 2.95Å; I864-L869 PolarHBondContact O-N 2.8Å; I864-L869 VanDerWaalsContact O-N 3.13Å; I864-Y870 HydrophobicContact CG2-CD1 3.42Å; I864-Y870 VanDerWaalsContact CG2-CD1 3.42Å; I864-Y870 HydrophobicContact CG2-CD2 4.35Å; I864-Y870 HydrophobicContact CG2-CE1 3.67Å; I864-Y870 HydrophobicContact CG2-CG 3.8Å; I864-A873 HydrophobicContact CD1-CB 3.35Å; I864-A873 HydrophobicContact CG1-CB 3.81Å; I864-A873 HydrophobicContact CG2-CB 4.5Å; I864-I887 HydrophobicContact CD1-CD1 4.31Å; I864-I887 HydrophobicContact CD1-CG1 4.38Å; I864-I887 HydrophobicContact CD1-CG2 4.48Å
865	E	90.1	Very high	88.5	Confident	77 Å²	77	61.9 Å²	61.9	36%	0.36	31%	0.307	S	S	.	.	H	α-helix	trans	-61	-43.2	-179.9	-72.1	-174.8	178.4	0	0	111.1	L861 H867 K890	L861-E865 WeakPolarHBondContact O-CG 3.22Å; L861-E865 PolarHBondContact O-N 2.72Å; E865-H867 PolarHBondContact O-N 2.93Å; E865-K890 WeakPolarHBondContact OE1-CD 3.4Å; E865-K890 WeakPolarHBondContact OE1-CE 3.45Å; E865-K890 IonicContact OE1-NZ 2.93Å; E865-K890 PolarHBondContact OE1-NZ 3.35Å
866	R	89.9	Confident	88.9	Confident	208 Å²	208	58.2 Å²	58.2	79%	0.785	29%	0.286	S	S	*	.	H	α-helix	trans	-64.4	-37.8	-179.8	-175.4	175.7	-176.6	169.7	0.8	113.8	N862 I864	N862-R866 WeakPolarHBondContact O-CB 3.25Å; N862-R866 PolarHBondContact O-N 3.42Å; I864-R866 VanDerWaalsContact C-N 3.34Å; I864-R866 PolarHBondContact O-N 2.8Å
867	H	88.9	Confident	89.2	Confident	81 Å²	81	56.4 Å²	56.4	38%	0.375	28%	0.277	S	S	.	.	H	α-helix	trans	-108	6.2	-175.3	-68.8	-71.1	0	0	0	114.1	P842 H863 I864 E865 L869	P842-H867 HydrophobicContact CB-CB 4.11Å; H863-H867 AromaticContact CE1-CD2 3.41Å; H863-H867 PolarHBondContact CE1-CD2 3.23Å; H863-H867 VanDerWaalsContact CE1-CD2 3.41Å; H863-H867 AromaticContact CE1-NE2 3.75Å; H863-H867 AromaticContact ND1-CD2 3.66Å; H863-H867 AromaticContact NE2-CD2 3.8Å; H863-H867 PolarHBondContact O-N 2.94Å; H863-H867 VanDerWaalsContact O-N 3.14Å; I864-H867 PolarHBondContact O-N 2.89Å; E865-H867 PolarHBondContact O-N 2.93Å; H867-L869 VanDerWaalsContact C-N 3.26Å; H867-L869 HydrophobicContact CB-CD1 3.92Å; H867-L869 HydrophobicContact CB-CD2 4.48Å; H867-L869 HydrophobicContact CB-CG 3.7Å; H867-L869 PolarHBondContact O-N 2.97Å
868	S	88.7	Confident	89.2	Confident	58 Å²	58	62.3 Å²	62.3	41%	0.406	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	35.6	-175.3	-50.2	0	0	0	0	114.3	I864 Y870	I864-S868 VanDerWaalsContact O-CA 3.3Å; I864-S868 WeakPolarHBondContact O-CA 3.37Å; I864-S868 PolarHBondContact O-N 2.95Å; S868-Y870 VanDerWaalsContact C-N 3.29Å; S868-Y870 PolarHBondContact O-N 2.7Å
869	L	90.6	Very high	89.1	Confident	12 Å²	12	62 Å²	62	6%	0.063	31%	0.306	C	S	.	.			trans	-89.1	33.4	-172.8	-62.3	178	0	0	0	114.4	P842 I843 L846 I864 H867 A871 Q872 A873	P842-L869 HydrophobicContact CB-CD1 4.09Å; P842-L869 VanDerWaalsContact O-CD1 3.29Å; P842-L869 WeakPolarHBondContact O-CD1 3.4Å; I843-L869 HydrophobicContact CG1-CD2 4.08Å; L846-L869 HydrophobicContact CB-CD1 3.99Å; L846-L869 HydrophobicContact CD2-CB 3.83Å; L846-L869 HydrophobicContact CD2-CD1 3.96Å; I864-L869 PolarHBondContact O-N 2.8Å; I864-L869 VanDerWaalsContact O-N 3.13Å; H867-L869 VanDerWaalsContact C-N 3.26Å; H867-L869 HydrophobicContact CB-CD1 3.92Å; H867-L869 HydrophobicContact CB-CD2 4.48Å; H867-L869 HydrophobicContact CB-CG 3.7Å; H867-L869 PolarHBondContact O-N 2.97Å; L869-A871 PolarHBondContact O-N 2.74Å; L869-Q872 PolarHBondContact O-N 3.06Å; L869-A873 WeakPolarHBondContact O-CB 3.2Å; L869-A873 PolarHBondContact O-N 3.2Å
870	Y	91	Very high	89	Confident	10 Å²	10	62.7 Å²	62.7	4%	0.039	31%	0.309	C	S	.	.	H	α-helix	trans	-62.2	-41.3	-172.9	-59.1	-86.7	0	0	0	112.9	I864 S868 A873 I874 K890 F891 F894	I864-Y870 HydrophobicContact CG2-CD1 3.42Å; I864-Y870 VanDerWaalsContact CG2-CD1 3.42Å; I864-Y870 HydrophobicContact CG2-CD2 4.35Å; I864-Y870 HydrophobicContact CG2-CE1 3.67Å; I864-Y870 HydrophobicContact CG2-CG 3.8Å; S868-Y870 VanDerWaalsContact C-N 3.29Å; S868-Y870 PolarHBondContact O-N 2.7Å; Y870-A873 PolarHBondContact O-N 2.8Å; Y870-I874 VanDerWaalsContact O-CG1 3.28Å; Y870-I874 WeakPolarHBondContact O-CG1 3.48Å; Y870-I874 PolarHBondContact O-N 3.28Å; Y870-K890 HydrophobicContact CE1-CB 4.4Å; Y870-F891 HydrophobicContact CD1-CB 3.68Å; Y870-F891 AromaticContact CD1-CD2 3.81Å; Y870-F891 HydrophobicContact CD1-CD2 3.81Å; Y870-F891 HydrophobicContact CD1-CG 4.02Å; Y870-F891 AromaticContact CD2-CD2 3.62Å; Y870-F891 HydrophobicContact CD2-CD2 3.62Å; Y870-F891 AromaticContact CD2-CE2 3.96Å; Y870-F891 HydrophobicContact CD2-CE2 3.96Å; Y870-F891 HydrophobicContact CE1-CB 4.41Å; Y870-F891 HydrophobicContact CE2-CD2 4.39Å; Y870-F891 HydrophobicContact CG-CB 4.02Å; Y870-F891 AromaticContact CG-CD2 3.28Å; Y870-F891 HydrophobicContact CG-CD2 3.28Å; Y870-F891 AromaticContact CG-CE2 3.91Å; Y870-F891 HydrophobicContact CG-CE2 3.91Å; Y870-F891 AromaticContact CG-CG 3.81Å; Y870-F891 HydrophobicContact CG-CG 3.81Å; Y870-F894 AromaticContact CD2-CD1 3.88Å; Y870-F894 HydrophobicContact CD2-CD1 3.88Å; Y870-F894 HydrophobicContact CD2-CE1 4.16Å; Y870-F894 HydrophobicContact CD2-CG 4.24Å; Y870-F894 HydrophobicContact CE1-CB 4.32Å; Y870-F894 HydrophobicContact CE2-CB 3.9Å; Y870-F894 AromaticContact CE2-CD1 3.48Å; Y870-F894 HydrophobicContact CE2-CD1 3.48Å; Y870-F894 VanDerWaalsContact CE2-CD1 3.48Å; Y870-F894 AromaticContact CE2-CD2 3.75Å; Y870-F894 HydrophobicContact CE2-CD2 3.75Å; Y870-F894 AromaticContact CE2-CE1 3.85Å; Y870-F894 HydrophobicContact CE2-CE1 3.85Å; Y870-F894 HydrophobicContact CE2-CE2 4.09Å; Y870-F894 AromaticContact CE2-CG 3.41Å; Y870-F894 HydrophobicContact CE2-CG 3.41Å; Y870-F894 VanDerWaalsContact CE2-CG 3.41Å; Y870-F894 HydrophobicContact CE2-CZ 4.13Å; Y870-F894 AromaticContact CZ-CG 3.69Å
871	A	89	Confident	88.8	Confident	53 Å²	53	67.4 Å²	67.4	44%	0.438	34%	0.34	S	S	.	.	H	α-helix	trans	-63.7	-44.9	180	0	0	0	0	0	112.1	L869 A873 I874 I875	L869-A871 PolarHBondContact O-N 2.74Å; A871-A873 VanDerWaalsContact C-N 3.34Å; A871-I874 PolarHBondContact O-N 3.28Å; A871-I875 WeakPolarHBondContact O-CG1 3.35Å; A871-I875 PolarHBondContact O-N 2.82Å
872	Q	89.1	Confident	88.6	Confident	65 Å²	65	72.9 Å²	72.9	30%	0.304	37%	0.365	S	S	.	.	H	α-helix	trans	-65.6	-39.3	177.2	-66.7	80.3	-0.7	0	0	110.8	L846 L869 I875 M876	L846-Q872 HydrophobicContact CD2-CB 4.14Å; L869-Q872 PolarHBondContact O-N 3.06Å; Q872-I875 PolarHBondContact O-N 3.43Å; Q872-M876 HydrophobicContact CB-CE 4.15Å; Q872-M876 VanDerWaalsContact O-CG 3.32Å; Q872-M876 WeakPolarHBondContact O-CG 3.35Å; Q872-M876 PolarHBondContact O-N 2.94Å; Q872-M876 VanDerWaalsContact O-N 3.13Å
873	A	89.7	Confident	88.5	Confident	0 Å²	0	70 Å²	70	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-63.8	-43	176	0	0	0	0	0	112.7	L846 I864 L869 Y870 A871 I875 M876 Y877 I887	L846-A873 HydrophobicContact CD2-CB 4.16Å; I864-A873 HydrophobicContact CD1-CB 3.35Å; I864-A873 HydrophobicContact CG1-CB 3.81Å; I864-A873 HydrophobicContact CG2-CB 4.5Å; L869-A873 WeakPolarHBondContact O-CB 3.2Å; L869-A873 PolarHBondContact O-N 3.2Å; Y870-A873 PolarHBondContact O-N 2.8Å; A871-A873 VanDerWaalsContact C-N 3.34Å; A873-I875 VanDerWaalsContact C-N 3.27Å; A873-I875 PolarHBondContact O-N 2.87Å; A873-M876 PolarHBondContact O-N 2.86Å; A873-M876 VanDerWaalsContact O-N 3.11Å; A873-Y877 WeakPolarHBondContact O-CD2 3.42Å; A873-Y877 PolarHBondContact O-N 3.49Å; A873-I887 HydrophobicContact CB-CD1 4.45Å; A873-I887 HydrophobicContact CB-CG2 4.07Å
874	I	88.9	Confident	88.5	Confident	36 Å²	36	70.9 Å²	70.9	19%	0.185	35%	0.353	C	S	.	.	H	α-helix	trans	-59.3	-38.9	176.2	-72.9	166	0	0	0	111.3	Y870 A871 K878 L884 I887 Q888 F891	Y870-I874 VanDerWaalsContact O-CG1 3.28Å; Y870-I874 WeakPolarHBondContact O-CG1 3.48Å; Y870-I874 PolarHBondContact O-N 3.28Å; A871-I874 PolarHBondContact O-N 3.28Å; I874-K878 PolarHBondContact O-N 3.02Å; I874-L884 HydrophobicContact CB-CD1 4.3Å; I874-L884 HydrophobicContact CG1-CD1 4.18Å; I874-L884 HydrophobicContact CG2-CD1 4.15Å; I874-I887 HydrophobicContact CG1-CG2 4.22Å; I874-Q888 HydrophobicContact CD1-CG 4.23Å; I874-Q888 HydrophobicContact CG1-CG 4.26Å; I874-F891 HydrophobicContact CD1-CD1 3.69Å; I874-F891 HydrophobicContact CD1-CE1 4.13Å
875	I	88.9	Confident	88.4	Confident	131 Å²	131	75.7 Å²	75.7	67%	0.672	38%	0.377	S	S	*	.	H	α-helix	trans	-66.2	-40.8	176.1	-64.9	167	0	0	0	110.9	A871 Q872 A873	A871-I875 WeakPolarHBondContact O-CG1 3.35Å; A871-I875 PolarHBondContact O-N 2.82Å; Q872-I875 PolarHBondContact O-N 3.43Å; A873-I875 VanDerWaalsContact C-N 3.27Å; A873-I875 PolarHBondContact O-N 2.87Å
876	M	86.3	Confident	88.5	Confident	61 Å²	61	75 Å²	75	30%	0.3	38%	0.378	S	S	.	.	H	α-helix	trans	-72.2	-36.9	-177.8	-67.3	176	-157.8	0	0	113.3	L846 K847 A850 Q872 A873	L846-M876 HydrophobicContact CD2-CE 4.08Å; L846-M876 HydrophobicContact CD2-SD 4.11Å; L846-M876 HydrophobicContact CG-CE 4.28Å; L846-M876 HydrophobicContact CG-SD 3.95Å; K847-M876 HydrophobicContact CB-CE 4.38Å; K847-M876 HydrophobicContact CD-CE 4.38Å; K847-M876 HydrophobicContact CG-CE 3.32Å; K847-M876 HydrophobicContact CG-SD 4Å; A850-M876 HydrophobicContact CB-SD 4.29Å; Q872-M876 HydrophobicContact CB-CE 4.15Å; Q872-M876 VanDerWaalsContact O-CG 3.32Å; Q872-M876 WeakPolarHBondContact O-CG 3.35Å; Q872-M876 PolarHBondContact O-N 2.94Å; Q872-M876 VanDerWaalsContact O-N 3.13Å; A873-M876 PolarHBondContact O-N 2.86Å; A873-M876 VanDerWaalsContact O-N 3.11Å
877	Y	87.5	Confident	88.6	Confident	12 Å²	12	65.1 Å²	65.1	5%	0.047	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	16.2	-177.7	-75.9	-90.8	0	0	0	113.7	A850 F857 V860 A873 D879 Q880 Q883 I887	A850-Y877 HydrophobicContact CB-CE2 3.95Å; F857-Y877 HydrophobicContact CD2-CE1 4.2Å; F857-Y877 HydrophobicContact CE2-CD1 4.4Å; F857-Y877 AromaticContact CE2-CE1 3.93Å; F857-Y877 HydrophobicContact CE2-CE1 3.93Å; V860-Y877 HydrophobicContact CG1-CE2 3.96Å; A873-Y877 WeakPolarHBondContact O-CD2 3.42Å; A873-Y877 PolarHBondContact O-N 3.49Å; Y877-D879 PolarHBondContact O-N 3.39Å; Y877-D879 VanDerWaalsContact O-N 3.09Å; Y877-Q880 HydrophobicContact CD1-CB 4.23Å; Y877-Q880 VanDerWaalsContact CE1-OE1 3.29Å; Y877-Q880 PolarHBondContact O-N 2.81Å; Y877-Q883 HydrophobicContact CD1-CB 3.82Å; Y877-Q883 HydrophobicContact CD1-CG 4.4Å; Y877-Q883 HydrophobicContact CE1-CB 4.28Å; Y877-Q883 HydrophobicContact CE1-CG 4.45Å; Y877-I887 HydrophobicContact CD1-CD1 4.41Å; Y877-I887 HydrophobicContact CD2-CD1 3.63Å; Y877-I887 HydrophobicContact CE2-CD1 4.21Å; Y877-I887 HydrophobicContact CG-CD1 3.76Å
878	K	86.8	Confident	88.7	Confident	158 Å²	158	62.4 Å²	62.4	69%	0.687	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-34.5	-176.9	-174.5	-177.8	175.4	-172.3	0	113.5	I874	I874-K878 PolarHBondContact O-N 3.02Å
879	D	86.3	Confident	88.9	Confident	146 Å²	146	60.7 Å²	60.7	78%	0.781	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	2.8	-176.1	-56.8	-39.7	0	0	0	113.6	Y877	Y877-D879 PolarHBondContact O-N 3.39Å; Y877-D879 VanDerWaalsContact O-N 3.09Å
880	Q	86.9	Confident	88.9	Confident	75 Å²	75	63.6 Å²	63.6	35%	0.35	33%	0.328	S	S	.	.			trans	-121.2	88.1	-176.5	-68.2	-174.7	13.5	0	0	110.7	Y877 E882 Q883 L884	Y877-Q880 HydrophobicContact CD1-CB 4.23Å; Y877-Q880 VanDerWaalsContact CE1-OE1 3.29Å; Y877-Q880 PolarHBondContact O-N 2.81Å; Q880-E882 PolarHBondContact O-N 3.29Å; Q880-Q883 HydrophobicContact CB-CB 4.34Å; Q880-Q883 PolarHBondContact O-N 2.72Å; Q880-L884 WeakPolarHBondContact O-CB 3.48Å; Q880-L884 PolarHBondContact O-N 3.17Å
881	P	85.1	Confident	89	Confident	99 Å²	99	64.7 Å²	64.7	64%	0.643	33%	0.333	S	S	*	.	H	α-helix	trans	-65.9	-36.5	-165.8	24.1	-33.7	0	0	0	114.2	M885	P881-M885 WeakPolarHBondContact O-CB 3.43Å; P881-M885 PolarHBondContact O-N 3.18Å
882	E	85.7	Confident	89.2	Confident	144 Å²	144	62.1 Å²	62.1	67%	0.673	31%	0.312	S	S	*	.	H	α-helix	trans	-66	-48.7	-179.3	-65.3	-176.8	172.2	0	0	111.4	Q880 M885 V886	Q880-E882 PolarHBondContact O-N 3.29Å; E882-M885 PolarHBondContact O-N 2.92Å; E882-V886 PolarHBondContact O-N 3.34Å
883	Q	88.1	Confident	89.4	Confident	34 Å²	34	62.5 Å²	62.5	16%	0.159	31%	0.314	C	S	.	.	H	α-helix	trans	-66	-42.1	177.9	-68.3	74.4	15.5	0	0	110.9	L854 F857 Y877 Q880 M885 V886 I887	L854-Q883 HydrophobicContact CD2-CG 4.29Å; F857-Q883 HydrophobicContact CD2-CB 4.45Å; F857-Q883 HydrophobicContact CD2-CG 4.05Å; F857-Q883 HydrophobicContact CE1-CB 4.37Å; F857-Q883 HydrophobicContact CE1-CG 4.26Å; F857-Q883 HydrophobicContact CE2-CB 3.58Å; F857-Q883 HydrophobicContact CE2-CG 3.66Å; F857-Q883 HydrophobicContact CZ-CB 3.53Å; F857-Q883 HydrophobicContact CZ-CG 3.77Å; Y877-Q883 HydrophobicContact CD1-CB 3.82Å; Y877-Q883 HydrophobicContact CD1-CG 4.4Å; Y877-Q883 HydrophobicContact CE1-CB 4.28Å; Y877-Q883 HydrophobicContact CE1-CG 4.45Å; Q880-Q883 HydrophobicContact CB-CB 4.34Å; Q880-Q883 PolarHBondContact O-N 2.72Å; Q883-M885 VanDerWaalsContact C-N 3.31Å; Q883-M885 PolarHBondContact O-N 2.76Å; Q883-V886 PolarHBondContact O-N 2.86Å; Q883-I887 WeakPolarHBondContact O-CG1 3.34Å; Q883-I887 PolarHBondContact O-N 3.34Å
884	L	90.1	Very high	89.5	Confident	27 Å²	27	64.5 Å²	64.5	14%	0.141	32%	0.322	C	S	.	.	H	α-helix	trans	-60.3	-40.3	178.5	-177.1	63.1	0	0	0	111.8	I874 Q880 V886 I887 Q888	I874-L884 HydrophobicContact CB-CD1 4.3Å; I874-L884 HydrophobicContact CG1-CD1 4.18Å; I874-L884 HydrophobicContact CG2-CD1 4.15Å; Q880-L884 WeakPolarHBondContact O-CB 3.48Å; Q880-L884 PolarHBondContact O-N 3.17Å; L884-V886 VanDerWaalsContact C-N 3.35Å; L884-V886 PolarHBondContact O-N 2.86Å; L884-I887 PolarHBondContact O-N 2.92Å; L884-Q888 HydrophobicContact CD1-CG 4.21Å; L884-Q888 HydrophobicContact CG-CG 4.34Å; L884-Q888 WeakPolarHBondContact O-CB 3.42Å; L884-Q888 VanDerWaalsContact O-CG 3.29Å; L884-Q888 WeakPolarHBondContact O-CG 3.39Å; L884-Q888 PolarHBondContact O-N 2.94Å
885	M	89.9	Confident	89.6	Confident	103 Å²	103	63.1 Å²	63.1	51%	0.507	32%	0.315	S	S	.	.	H	α-helix	trans	-63	-40.7	177.5	-170.8	174.2	66.4	0	0	111.8	P881 E882 Q883 Q888 S889	P881-M885 WeakPolarHBondContact O-CB 3.43Å; P881-M885 PolarHBondContact O-N 3.18Å; E882-M885 PolarHBondContact O-N 2.92Å; Q883-M885 VanDerWaalsContact C-N 3.31Å; Q883-M885 PolarHBondContact O-N 2.76Å; M885-Q888 PolarHBondContact O-N 3.21Å; M885-S889 PolarHBondContact O-N 2.84Å
886	V	91.2	Very high	89.8	Confident	62 Å²	62	59.1 Å²	59.1	38%	0.376	29%	0.294	S	S	.	.	H	α-helix	trans	-64.9	-46.7	175.4	179.5	0	0	0	0	111.1	F857 L861 E882 Q883 L884 Q888 S889 K890	F857-V886 HydrophobicContact CE1-CB 4.37Å; F857-V886 HydrophobicContact CE1-CG1 4.31Å; L861-V886 HydrophobicContact CD1-CG1 3.98Å; L861-V886 HydrophobicContact CD2-CG1 4.28Å; E882-V886 PolarHBondContact O-N 3.34Å; Q883-V886 PolarHBondContact O-N 2.86Å; L884-V886 VanDerWaalsContact C-N 3.35Å; L884-V886 PolarHBondContact O-N 2.86Å; V886-Q888 VanDerWaalsContact C-N 3.34Å; V886-Q888 PolarHBondContact O-N 3.31Å; V886-S889 PolarHBondContact O-N 3.08Å; V886-K890 PolarHBondContact O-N 3.44Å
887	I	91.1	Very high	90	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-61.4	-43	177.8	-64.8	169.9	0	0	0	110.9	F857 L861 I864 A873 I874 Y877 Q883 L884 K890 F891	F857-I887 HydrophobicContact CE2-CD1 4.11Å; F857-I887 HydrophobicContact CE2-CG1 4.41Å; F857-I887 HydrophobicContact CZ-CD1 4.21Å; F857-I887 HydrophobicContact CZ-CG1 4.05Å; L861-I887 HydrophobicContact CD2-CG1 3.88Å; I864-I887 HydrophobicContact CD1-CD1 4.31Å; I864-I887 HydrophobicContact CD1-CG1 4.38Å; I864-I887 HydrophobicContact CD1-CG2 4.48Å; A873-I887 HydrophobicContact CB-CD1 4.45Å; A873-I887 HydrophobicContact CB-CG2 4.07Å; I874-I887 HydrophobicContact CG1-CG2 4.22Å; Y877-I887 HydrophobicContact CD1-CD1 4.41Å; Y877-I887 HydrophobicContact CD2-CD1 3.63Å; Y877-I887 HydrophobicContact CE2-CD1 4.21Å; Y877-I887 HydrophobicContact CG-CD1 3.76Å; Q883-I887 WeakPolarHBondContact O-CG1 3.34Å; Q883-I887 PolarHBondContact O-N 3.34Å; L884-I887 PolarHBondContact O-N 2.92Å; I887-K890 PolarHBondContact O-N 3.29Å; I887-F891 WeakPolarHBondContact O-CB 3.4Å; I887-F891 PolarHBondContact O-N 3.04Å
888	Q	91.8	Very high	90.2	Very high	23 Å²	23	67.4 Å²	67.4	11%	0.107	34%	0.335	C	S	.	.	H	α-helix	trans	-67.7	-38.7	178.7	-75.3	-175.7	9.6	0	0	112.5	I874 L884 M885 V886 K890 F891 A892	I874-Q888 HydrophobicContact CD1-CG 4.23Å; I874-Q888 HydrophobicContact CG1-CG 4.26Å; L884-Q888 HydrophobicContact CD1-CG 4.21Å; L884-Q888 HydrophobicContact CG-CG 4.34Å; L884-Q888 WeakPolarHBondContact O-CB 3.42Å; L884-Q888 VanDerWaalsContact O-CG 3.29Å; L884-Q888 WeakPolarHBondContact O-CG 3.39Å; L884-Q888 PolarHBondContact O-N 2.94Å; M885-Q888 PolarHBondContact O-N 3.21Å; V886-Q888 VanDerWaalsContact C-N 3.34Å; V886-Q888 PolarHBondContact O-N 3.31Å; Q888-K890 VanDerWaalsContact C-N 3.34Å; Q888-F891 PolarHBondContact O-N 2.99Å; Q888-A892 PolarHBondContact O-N 3.08Å
889	S	92.2	Very high	90.3	Very high	22 Å²	22	67.7 Å²	67.7	15%	0.154	34%	0.336	C	S	.	.	H	α-helix	trans	-65.2	-40.1	175.2	-171.8	0	0	0	0	111.3	M885 V886 F891 A892 E893 R913	M885-S889 PolarHBondContact O-N 2.84Å; V886-S889 PolarHBondContact O-N 3.08Å; S889-F891 VanDerWaalsContact C-N 3.32Å; S889-A892 WeakPolarHBondContact O-CB 3.4Å; S889-A892 PolarHBondContact O-N 3.01Å; S889-E893 WeakPolarHBondContact O-CG 3.48Å; S889-E893 PolarHBondContact O-N 3.23Å; S889-E893 VanDerWaalsContact O-N 3.09Å; S889-R913 PolarHBondContact OG-NH1 2.87Å
890	K	91.9	Very high	90.4	Very high	74 Å²	74	65.1 Å²	65.1	32%	0.322	32%	0.319	S	S	.	.	H	α-helix	trans	-64.7	-36.8	173	-74.5	-61.4	-165.4	169.5	0	112.5	E865 Y870 V886 I887 Q888 E893 F894	E865-K890 WeakPolarHBondContact OE1-CD 3.4Å; E865-K890 WeakPolarHBondContact OE1-CE 3.45Å; E865-K890 IonicContact OE1-NZ 2.93Å; E865-K890 PolarHBondContact OE1-NZ 3.35Å; Y870-K890 HydrophobicContact CE1-CB 4.4Å; V886-K890 PolarHBondContact O-N 3.44Å; I887-K890 PolarHBondContact O-N 3.29Å; Q888-K890 VanDerWaalsContact C-N 3.34Å; K890-E893 IonicContact NZ-OE2 2.76Å; K890-E893 PolarHBondContact O-N 2.86Å; K890-F894 WeakPolarHBondContact O-CB 3.06Å; K890-F894 PolarHBondContact O-N 2.87Å
891	F	93.1	Very high	90.7	Very high	32 Å²	32	63.6 Å²	63.6	14%	0.14	31%	0.312	C	S	.	.	H	α-helix	trans	-66.7	-39.2	175	-170.9	-147.8	0	0	0	111.8	Y870 I874 I887 Q888 S889 F894 L895 H907	Y870-F891 HydrophobicContact CD1-CB 3.68Å; Y870-F891 AromaticContact CD1-CD2 3.81Å; Y870-F891 HydrophobicContact CD1-CD2 3.81Å; Y870-F891 HydrophobicContact CD1-CG 4.02Å; Y870-F891 AromaticContact CD2-CD2 3.62Å; Y870-F891 HydrophobicContact CD2-CD2 3.62Å; Y870-F891 AromaticContact CD2-CE2 3.96Å; Y870-F891 HydrophobicContact CD2-CE2 3.96Å; Y870-F891 HydrophobicContact CE1-CB 4.41Å; Y870-F891 HydrophobicContact CE2-CD2 4.39Å; Y870-F891 HydrophobicContact CG-CB 4.02Å; Y870-F891 AromaticContact CG-CD2 3.28Å; Y870-F891 HydrophobicContact CG-CD2 3.28Å; Y870-F891 AromaticContact CG-CE2 3.91Å; Y870-F891 HydrophobicContact CG-CE2 3.91Å; Y870-F891 AromaticContact CG-CG 3.81Å; Y870-F891 HydrophobicContact CG-CG 3.81Å; I874-F891 HydrophobicContact CD1-CD1 3.69Å; I874-F891 HydrophobicContact CD1-CE1 4.13Å; I887-F891 WeakPolarHBondContact O-CB 3.4Å; I887-F891 PolarHBondContact O-N 3.04Å; Q888-F891 PolarHBondContact O-N 2.99Å; S889-F891 VanDerWaalsContact C-N 3.32Å; F891-F894 HydrophobicContact CD2-CD1 4.1Å; F891-F894 HydrophobicContact CE2-CD1 4.16Å; F891-F894 PolarHBondContact O-N 3.17Å; F891-L895 HydrophobicContact CD1-CD1 4.07Å; F891-L895 HydrophobicContact CD2-CD1 4.06Å; F891-L895 HydrophobicContact CD2-CD2 4.41Å; F891-L895 HydrophobicContact CD2-CG 3.88Å; F891-L895 HydrophobicContact CE1-CD1 3.9Å; F891-L895 HydrophobicContact CE2-CD1 3.88Å; F891-L895 HydrophobicContact CE2-CD2 3.72Å; F891-L895 HydrophobicContact CE2-CG 3.68Å; F891-L895 HydrophobicContact CG-CD1 4.16Å; F891-L895 HydrophobicContact CG-CG 4.44Å; F891-L895 HydrophobicContact CZ-CD1 3.8Å; F891-L895 HydrophobicContact CZ-CD2 3.98Å; F891-L895 HydrophobicContact CZ-CG 4.06Å; F891-L895 WeakPolarHBondContact O-CB 3.3Å; F891-L895 VanDerWaalsContact O-CG 3.23Å; F891-L895 WeakPolarHBondContact O-CG 3.34Å; F891-L895 PolarHBondContact O-N 3.31Å; F891-H907 AromaticContact CD1-CD2 3.82Å; F891-H907 AromaticContact CD1-CE1 3.48Å; F891-H907 VanDerWaalsContact CD1-CE1 3.48Å; F891-H907 WeakPolarHBondContact CD1-CE1 3.3Å; F891-H907 AromaticContact CD1-ND1 3.94Å; F891-H907 AromaticContact CD1-NE2 3.39Å; F891-H907 WeakPolarHBondContact CD1-NE2 3.3Å; F891-H907 AromaticContact CE1-CD2 3.99Å; F891-H907 AromaticContact CE1-CE1 3.75Å; F891-H907 AromaticContact CE1-NE2 3.3Å; F891-H907 VanDerWaalsContact CE1-NE2 3.3Å; F891-H907 WeakPolarHBondContact CE1-NE2 3.46Å
892	A	92.4	Very high	90.9	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-59.7	-46.4	173.9	0	0	0	0	0	111.6	Q888 S889 F894 L895 E896 H907 Y908	Q888-A892 PolarHBondContact O-N 3.08Å; S889-A892 WeakPolarHBondContact O-CB 3.4Å; S889-A892 PolarHBondContact O-N 3.01Å; A892-F894 PolarHBondContact O-N 2.99Å; A892-L895 PolarHBondContact O-N 3.35Å; A892-E896 WeakPolarHBondContact O-CB 2.84Å; A892-E896 PolarHBondContact O-N 2.82Å; A892-H907 HydrophobicContact CB-CB 3.67Å; A892-Y908 HydrophobicContact CB-CD1 3.62Å; A892-Y908 HydrophobicContact CB-CD2 4.05Å; A892-Y908 HydrophobicContact CB-CE1 3.5Å; A892-Y908 HydrophobicContact CB-CE2 3.97Å; A892-Y908 HydrophobicContact CB-CG 3.88Å
893	E	92.9	Very high	91.1	Very high	73 Å²	73	57.4 Å²	57.4	34%	0.341	28%	0.281	S	S	.	.	H	α-helix	trans	-61.3	-42.1	175.9	-70.7	170.2	-167	0	0	111.8	S889 K890 E896 S897 Y908 R913	S889-E893 WeakPolarHBondContact O-CG 3.48Å; S889-E893 PolarHBondContact O-N 3.23Å; S889-E893 VanDerWaalsContact O-N 3.09Å; K890-E893 IonicContact NZ-OE2 2.76Å; K890-E893 PolarHBondContact O-N 2.86Å; E893-E896 PolarHBondContact O-N 3.06Å; E893-S897 WeakPolarHBondContact O-CB 3.48Å; E893-S897 PolarHBondContact O-N 3.4Å; E893-Y908 WeakPolarHBondContact CG-OH 3.31Å; E893-R913 IonicContact OE1-NH1 2.84Å; E893-R913 PolarHBondContact OE1-NH1 3.37Å
894	F	92.2	Very high	91.3	Very high	41 Å²	41	55.8 Å²	55.8	18%	0.18	27%	0.274	C	S	.	.	H	α-helix	trans	-62.9	-46.3	175.3	174.4	-100.2	0	0	0	112.2	Y870 K890 F891 A892 S897 R898	Y870-F894 AromaticContact CD2-CD1 3.88Å; Y870-F894 HydrophobicContact CD2-CD1 3.88Å; Y870-F894 HydrophobicContact CD2-CE1 4.16Å; Y870-F894 HydrophobicContact CD2-CG 4.24Å; Y870-F894 HydrophobicContact CE1-CB 4.32Å; Y870-F894 HydrophobicContact CE2-CB 3.9Å; Y870-F894 AromaticContact CE2-CD1 3.48Å; Y870-F894 HydrophobicContact CE2-CD1 3.48Å; Y870-F894 VanDerWaalsContact CE2-CD1 3.48Å; Y870-F894 AromaticContact CE2-CD2 3.75Å; Y870-F894 HydrophobicContact CE2-CD2 3.75Å; Y870-F894 AromaticContact CE2-CE1 3.85Å; Y870-F894 HydrophobicContact CE2-CE1 3.85Å; Y870-F894 HydrophobicContact CE2-CE2 4.09Å; Y870-F894 AromaticContact CE2-CG 3.41Å; Y870-F894 HydrophobicContact CE2-CG 3.41Å; Y870-F894 VanDerWaalsContact CE2-CG 3.41Å; Y870-F894 HydrophobicContact CE2-CZ 4.13Å; Y870-F894 AromaticContact CZ-CG 3.69Å; K890-F894 WeakPolarHBondContact O-CB 3.06Å; K890-F894 PolarHBondContact O-N 2.87Å; F891-F894 HydrophobicContact CD2-CD1 4.1Å; F891-F894 HydrophobicContact CE2-CD1 4.16Å; F891-F894 PolarHBondContact O-N 3.17Å; A892-F894 PolarHBondContact O-N 2.99Å; F894-S897 PolarHBondContact O-N 3.3Å; F894-S897 PolarHBondContact O-OG 2.59Å; F894-R898 HydrophobicContact CE1-CG 4.19Å; F894-R898 HydrophobicContact CE2-CG 4.36Å; F894-R898 HydrophobicContact CZ-CG 4.09Å; F894-R898 WeakPolarHBondContact O-CG 3.44Å; F894-R898 PolarHBondContact O-N 2.81Å
895	L	92.1	Very high	91.4	Very high	7 Å²	7	54.5 Å²	54.5	4%	0.037	27%	0.267	C	S	.	.	H	α-helix	trans	-63.9	-40.8	177.7	-70.1	170.5	0	0	0	111.6	F891 A892 S897 R898 K899 Q900 D903 A904	F891-L895 HydrophobicContact CD1-CD1 4.07Å; F891-L895 HydrophobicContact CD2-CD1 4.06Å; F891-L895 HydrophobicContact CD2-CD2 4.41Å; F891-L895 HydrophobicContact CD2-CG 3.88Å; F891-L895 HydrophobicContact CE1-CD1 3.9Å; F891-L895 HydrophobicContact CE2-CD1 3.88Å; F891-L895 HydrophobicContact CE2-CD2 3.72Å; F891-L895 HydrophobicContact CE2-CG 3.68Å; F891-L895 HydrophobicContact CG-CD1 4.16Å; F891-L895 HydrophobicContact CG-CG 4.44Å; F891-L895 HydrophobicContact CZ-CD1 3.8Å; F891-L895 HydrophobicContact CZ-CD2 3.98Å; F891-L895 HydrophobicContact CZ-CG 4.06Å; F891-L895 WeakPolarHBondContact O-CB 3.3Å; F891-L895 VanDerWaalsContact O-CG 3.23Å; F891-L895 WeakPolarHBondContact O-CG 3.34Å; F891-L895 PolarHBondContact O-N 3.31Å; A892-L895 PolarHBondContact O-N 3.35Å; L895-S897 VanDerWaalsContact C-N 3.35Å; L895-S897 PolarHBondContact O-N 3.17Å; L895-R898 CarbonylContact O-C 3.56Å; L895-R898 PolarHBondContact O-N 3.05Å; L895-R898 VanDerWaalsContact O-N 3.16Å; L895-K899 PolarHBondContact O-N 2.99Å; L895-Q900 HydrophobicContact CB-CB 4.34Å; L895-Q900 HydrophobicContact CD2-CB 4.21Å; L895-Q900 PolarHBondContact O-N 2.86Å; L895-D903 HydrophobicContact CD1-CB 3.93Å; L895-A904 HydrophobicContact CB-CB 3.84Å
896	E	92.3	Very high	91.5	Very high	47 Å²	47	52.9 Å²	52.9	22%	0.22	26%	0.26	C	S	.	.	H	α-helix	trans	-61.3	-43.4	174.1	-171.2	177.1	-175.3	0	0	110.9	A892 E893 R898 K899 F901 A904 Y908	A892-E896 WeakPolarHBondContact O-CB 2.84Å; A892-E896 PolarHBondContact O-N 2.82Å; E893-E896 PolarHBondContact O-N 3.06Å; E896-R898 PolarHBondContact O-N 2.76Å; E896-K899 WeakPolarHBondContact O-CA 3.5Å; E896-K899 PolarHBondContact O-N 2.73Å; E896-F901 HydrophobicContact CG-CD1 4.12Å; E896-F901 HydrophobicContact CG-CE1 3.99Å; E896-A904 HydrophobicContact CB-CB 4.1Å; E896-Y908 VanDerWaalsContact OE2-CE2 3.3Å; E896-Y908 WeakPolarHBondContact OE2-CE2 3.13Å; E896-Y908 PolarHBondContact OE2-OH 2.94Å
897	S	91.4	Very high	91.5	Very high	86 Å²	86	51 Å²	51	60%	0.601	25%	0.247	S	C	*	.	H	α-helix	trans	-62.5	-30.5	175.4	82.9	0	0	0	0	113.2	E893 F894 L895 K899	E893-S897 WeakPolarHBondContact O-CB 3.48Å; E893-S897 PolarHBondContact O-N 3.4Å; F894-S897 PolarHBondContact O-N 3.3Å; F894-S897 PolarHBondContact O-OG 2.59Å; L895-S897 VanDerWaalsContact C-N 3.35Å; L895-S897 PolarHBondContact O-N 3.17Å; S897-K899 VanDerWaalsContact C-N 3.26Å; S897-K899 PolarHBondContact O-N 2.97Å
898	R	90.8	Very high	91.6	Very high	161 Å²	161	51 Å²	51	61%	0.608	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.3	4.1	174.3	-69.3	-72.6	-175.6	169.9	-0.5	113.2	F894 L895 E896 Q900	F894-R898 HydrophobicContact CE1-CG 4.19Å; F894-R898 HydrophobicContact CE2-CG 4.36Å; F894-R898 HydrophobicContact CZ-CG 4.09Å; F894-R898 WeakPolarHBondContact O-CG 3.44Å; F894-R898 PolarHBondContact O-N 2.81Å; L895-R898 CarbonylContact O-C 3.56Å; L895-R898 PolarHBondContact O-N 3.05Å; L895-R898 VanDerWaalsContact O-N 3.16Å; E896-R898 PolarHBondContact O-N 2.76Å; R898-Q900 HydrophobicContact CB-CG 4.36Å; R898-Q900 PolarHBondContact O-N 2.77Å
899	K	88.1	Confident	91.6	Very high	164 Å²	164	51.8 Å²	51.8	71%	0.713	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	20.5	-175.7	-54.1	-179.9	179.9	179	0	113.9	L895 E896 S897 F901	L895-K899 PolarHBondContact O-N 2.99Å; E896-K899 WeakPolarHBondContact O-CA 3.5Å; E896-K899 PolarHBondContact O-N 2.73Å; S897-K899 VanDerWaalsContact C-N 3.26Å; S897-K899 PolarHBondContact O-N 2.97Å; K899-F901 HydrophobicContact CB-CD2 4.46Å; K899-F901 HydrophobicContact CB-CE2 3.77Å; K899-F901 HydrophobicContact CB-CZ 3.95Å; K899-F901 HydrophobicContact CG-CE2 4.28Å; K899-F901 HydrophobicContact CG-CZ 4.07Å; K899-F901 WeakPolarHBondContact O-CD2 3.46Å; K899-F901 PolarHBondContact O-N 2.79Å; K899-F901 VanDerWaalsContact O-N 3.09Å
900	Q	89.6	Confident	91.4	Very high	92 Å²	92	58.2 Å²	58.2	43%	0.43	27%	0.271	S	S	.	.			trans	-86.2	63	173	-66.2	-176.3	-56.4	0	0	109.6	L895 R898 S902 D903 A904	L895-Q900 HydrophobicContact CB-CB 4.34Å; L895-Q900 HydrophobicContact CD2-CB 4.21Å; L895-Q900 PolarHBondContact O-N 2.86Å; R898-Q900 HydrophobicContact CB-CG 4.36Å; R898-Q900 PolarHBondContact O-N 2.77Å; Q900-S902 VanDerWaalsContact C-N 3.31Å; Q900-S902 PolarHBondContact O-N 2.91Å; Q900-D903 PolarHBondContact O-N 3.32Å; Q900-A904 WeakPolarHBondContact O-CB 3.27Å; Q900-A904 PolarHBondContact O-N 2.81Å
901	F	91.7	Very high	91.3	Very high	44 Å²	44	55.2 Å²	55.2	19%	0.193	26%	0.26	C	S	.	.	H	α-helix	trans	-64.7	-31.6	-170.7	-56.7	-65.8	0	0	0	113.4	E896 K899 D903 G905 C920 Q923	E896-F901 HydrophobicContact CG-CD1 4.12Å; E896-F901 HydrophobicContact CG-CE1 3.99Å; K899-F901 HydrophobicContact CB-CD2 4.46Å; K899-F901 HydrophobicContact CB-CE2 3.77Å; K899-F901 HydrophobicContact CB-CZ 3.95Å; K899-F901 HydrophobicContact CG-CE2 4.28Å; K899-F901 HydrophobicContact CG-CZ 4.07Å; K899-F901 WeakPolarHBondContact O-CD2 3.46Å; K899-F901 PolarHBondContact O-N 2.79Å; K899-F901 VanDerWaalsContact O-N 3.09Å; F901-D903 PolarHBondContact O-N 3.16Å; F901-G905 PolarHBondContact O-N 3.49Å; F901-C920 HydrophobicContact CB-CB 4.32Å; F901-C920 WeakPolarHBondContact O-CB 3.39Å; F901-Q923 HydrophobicContact CB-CB 4.18Å; F901-Q923 HydrophobicContact CD1-CB 4.24Å; F901-Q923 HydrophobicContact CD2-CB 3.91Å; F901-Q923 HydrophobicContact CE2-CB 4.32Å; F901-Q923 HydrophobicContact CG-CB 3.85Å
902	S	89.8	Confident	91	Very high	44 Å²	44	59.2 Å²	59.2	31%	0.308	28%	0.282	S	S	.	.	H	α-helix	trans	-60.4	-47.2	177.1	55.2	0	0	0	0	111.5	Q900 G905 I906	Q900-S902 VanDerWaalsContact C-N 3.31Å; Q900-S902 PolarHBondContact O-N 2.91Å; S902-G905 PolarHBondContact O-N 3.31Å; S902-I906 WeakPolarHBondContact O-CG1 3.44Å; S902-I906 PolarHBondContact O-N 3.05Å
903	D	90.1	Very high	91	Very high	68 Å²	68	63.1 Å²	63.1	36%	0.364	30%	0.297	S	S	.	.	H	α-helix	trans	-77.7	-38.7	-175.3	-57.5	-19.7	0	0	0	110.3	L895 Q900 F901 G905 I906 H907	L895-D903 HydrophobicContact CD1-CB 3.93Å; Q900-D903 PolarHBondContact O-N 3.32Å; F901-D903 PolarHBondContact O-N 3.16Å; D903-G905 VanDerWaalsContact C-N 3.28Å; D903-G905 PolarHBondContact O-N 3.27Å; D903-I906 PolarHBondContact O-N 2.82Å; D903-H907 PolarHBondContact O-CD2 3.5Å; D903-H907 VanDerWaalsContact O-CD2 3.27Å; D903-H907 PolarHBondContact O-N 3.17Å; D903-H907 VanDerWaalsContact O-N 3.12Å
904	A	92.9	Very high	91	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-56.2	-43.7	171	0	0	0	0	0	111.4	L895 E896 Q900 I906 H907 Y908	L895-A904 HydrophobicContact CB-CB 3.84Å; E896-A904 HydrophobicContact CB-CB 4.1Å; Q900-A904 WeakPolarHBondContact O-CB 3.27Å; Q900-A904 PolarHBondContact O-N 2.81Å; A904-I906 VanDerWaalsContact C-N 3.33Å; A904-I906 PolarHBondContact O-N 2.8Å; A904-H907 PolarHBondContact O-N 3.36Å; A904-H907 VanDerWaalsContact O-N 3.17Å; A904-Y908 HydrophobicContact CB-CD2 4.44Å; A904-Y908 HydrophobicContact CB-CE2 4.31Å; A904-Y908 VanDerWaalsContact O-CD2 3.22Å; A904-Y908 WeakPolarHBondContact O-CD2 3.27Å; A904-Y908 PolarHBondContact O-N 3.27Å
905	G	91.8	Very high	91	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-58.4	-42.4	177.2	0	0	0	0	0	112.9	F901 S902 D903 H907 Y908 E909 A917 Y921	F901-G905 PolarHBondContact O-N 3.49Å; S902-G905 PolarHBondContact O-N 3.31Å; D903-G905 VanDerWaalsContact C-N 3.28Å; D903-G905 PolarHBondContact O-N 3.27Å; G905-H907 PolarHBondContact O-N 3.26Å; G905-Y908 PolarHBondContact O-N 3.4Å; G905-E909 VanDerWaalsContact O-CB 3.3Å; G905-E909 WeakPolarHBondContact O-CB 3.35Å; G905-E909 PolarHBondContact O-N 2.87Å; G905-A917 WeakPolarHBondContact O-CB 3.36Å; G905-Y921 PolarHBondContact O-OH 2.85Å
906	I	91.7	Very high	91	Very high	69 Å²	69	66.7 Å²	66.7	35%	0.354	32%	0.318	S	S	.	.	H	α-helix	trans	-63.4	-42.3	176.6	-63.7	166.5	0	0	0	110.9	S902 D903 A904 E909 R910 Y921	S902-I906 WeakPolarHBondContact O-CG1 3.44Å; S902-I906 PolarHBondContact O-N 3.05Å; D903-I906 PolarHBondContact O-N 2.82Å; A904-I906 VanDerWaalsContact C-N 3.33Å; A904-I906 PolarHBondContact O-N 2.8Å; I906-E909 PolarHBondContact O-N 3.18Å; I906-R910 WeakPolarHBondContact O-CG 3.39Å; I906-R910 PolarHBondContact O-N 2.82Å; I906-R910 VanDerWaalsContact O-N 3.11Å; I906-Y921 WeakPolarHBondContact CA-OH 3.33Å; I906-Y921 HydrophobicContact CG1-CE1 4.44Å; I906-Y921 PolarHBondContact N-OH 2.87Å
907	H	91.7	Very high	91	Very high	22 Å²	22	64.5 Å²	64.5	10%	0.102	31%	0.308	C	S	.	.	H	α-helix	trans	-70.1	-39.6	178.7	-77.7	-74.5	0	0	0	112.5	F891 A892 D903 A904 G905 E909 R910 C911	F891-H907 AromaticContact CD1-CD2 3.82Å; F891-H907 AromaticContact CD1-CE1 3.48Å; F891-H907 VanDerWaalsContact CD1-CE1 3.48Å; F891-H907 WeakPolarHBondContact CD1-CE1 3.3Å; F891-H907 AromaticContact CD1-ND1 3.94Å; F891-H907 AromaticContact CD1-NE2 3.39Å; F891-H907 WeakPolarHBondContact CD1-NE2 3.3Å; F891-H907 AromaticContact CE1-CD2 3.99Å; F891-H907 AromaticContact CE1-CE1 3.75Å; F891-H907 AromaticContact CE1-NE2 3.3Å; F891-H907 VanDerWaalsContact CE1-NE2 3.3Å; F891-H907 WeakPolarHBondContact CE1-NE2 3.46Å; A892-H907 HydrophobicContact CB-CB 3.67Å; D903-H907 PolarHBondContact O-CD2 3.5Å; D903-H907 VanDerWaalsContact O-CD2 3.27Å; D903-H907 PolarHBondContact O-N 3.17Å; D903-H907 VanDerWaalsContact O-N 3.12Å; A904-H907 PolarHBondContact O-N 3.36Å; A904-H907 VanDerWaalsContact O-N 3.17Å; G905-H907 PolarHBondContact O-N 3.26Å; H907-E909 VanDerWaalsContact C-N 3.34Å; H907-R910 PolarHBondContact O-N 3.35Å; H907-C911 PolarHBondContact O-N 2.62Å; H907-C911 VanDerWaalsContact O-N 3.12Å; H907-C911 PolarHBondContact O-SG 3.1Å
908	Y	93.8	Very high	91.1	Very high	3 Å²	3	61 Å²	61	1%	0.012	28%	0.282	C	S	.	.	H	α-helix	trans	-62.9	-40.3	172.3	-75.7	-50.6	0	0	0	112.3	A892 E893 E896 A904 G905 R910 C911 D912 R913 D916	A892-Y908 HydrophobicContact CB-CD1 3.62Å; A892-Y908 HydrophobicContact CB-CD2 4.05Å; A892-Y908 HydrophobicContact CB-CE1 3.5Å; A892-Y908 HydrophobicContact CB-CE2 3.97Å; A892-Y908 HydrophobicContact CB-CG 3.88Å; E893-Y908 WeakPolarHBondContact CG-OH 3.31Å; E896-Y908 VanDerWaalsContact OE2-CE2 3.3Å; E896-Y908 WeakPolarHBondContact OE2-CE2 3.13Å; E896-Y908 PolarHBondContact OE2-OH 2.94Å; A904-Y908 HydrophobicContact CB-CD2 4.44Å; A904-Y908 HydrophobicContact CB-CE2 4.31Å; A904-Y908 VanDerWaalsContact O-CD2 3.22Å; A904-Y908 WeakPolarHBondContact O-CD2 3.27Å; A904-Y908 PolarHBondContact O-N 3.27Å; G905-Y908 PolarHBondContact O-N 3.4Å; Y908-R910 VanDerWaalsContact C-N 3.28Å; Y908-R910 PolarHBondContact O-N 2.93Å; Y908-C911 CarbonylContact O-C 3.55Å; Y908-C911 PolarHBondContact O-N 2.83Å; Y908-C911 VanDerWaalsContact O-N 3.15Å; Y908-D912 PolarHBondContact O-N 3.34Å; Y908-R913 HydrophobicContact CD1-CB 4.12Å; Y908-R913 PolarHBondContact O-N 3.07Å; Y908-D916 HydrophobicContact CD1-CB 4.03Å; Y908-D916 HydrophobicContact CD2-CB 3.94Å; Y908-D916 HydrophobicContact CE1-CB 4.3Å; Y908-D916 HydrophobicContact CE2-CB 4.19Å; Y908-D916 HydrophobicContact CG-CB 3.85Å
909	E	91.5	Very high	91.2	Very high	39 Å²	39	58.8 Å²	58.8	18%	0.182	27%	0.274	C	S	.	.	H	α-helix	trans	-63.2	-33.8	176.6	-176.3	-175.6	160.3	0	0	112.4	G905 I906 H907 A917 Y921 L933 K937	G905-E909 VanDerWaalsContact O-CB 3.3Å; G905-E909 WeakPolarHBondContact O-CB 3.35Å; G905-E909 PolarHBondContact O-N 2.87Å; I906-E909 PolarHBondContact O-N 3.18Å; H907-E909 VanDerWaalsContact C-N 3.34Å; E909-A917 HydrophobicContact CB-CB 4.06Å; E909-Y921 PolarHBondContact OE2-OH 2.86Å; E909-L933 HydrophobicContact CG-CD1 4.16Å; E909-K937 HydrophobicContact CG-CD 4.27Å; E909-K937 WeakPolarHBondContact OE1-CE 3.05Å; E909-K937 IonicContact OE1-NZ 3.19Å; E909-K937 PolarHBondContact OE1-NZ 2.74Å
910	R	88.1	Confident	91.4	Very high	156 Å²	156	51 Å²	51	59%	0.589	24%	0.24	S	C	*	.	H	α-helix	trans	-75	-25.5	174.8	-73.7	177.9	-179.9	-179	2.6	113.6	I906 H907 Y908 D912	I906-R910 WeakPolarHBondContact O-CG 3.39Å; I906-R910 PolarHBondContact O-N 2.82Å; I906-R910 VanDerWaalsContact O-N 3.11Å; H907-R910 PolarHBondContact O-N 3.35Å; Y908-R910 VanDerWaalsContact C-N 3.28Å; Y908-R910 PolarHBondContact O-N 2.93Å; R910-D912 VanDerWaalsContact C-N 3.3Å
911	C	88.4	Confident	91.6	Very high	12 Å²	12	46.7 Å²	46.7	8%	0.081	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	16.4	177	-57.9	0	0	0	0	112.6	H907 Y908 R913	H907-C911 PolarHBondContact O-N 2.62Å; H907-C911 VanDerWaalsContact O-N 3.12Å; H907-C911 PolarHBondContact O-SG 3.1Å; Y908-C911 CarbonylContact O-C 3.55Å; Y908-C911 PolarHBondContact O-N 2.83Å; Y908-C911 VanDerWaalsContact O-N 3.15Å; C911-R913 PolarHBondContact O-N 3.21Å; C911-R913 VanDerWaalsContact O-N 3.08Å
912	D	88.7	Confident	91.6	Very high	115 Å²	115	47.9 Å²	47.9	62%	0.615	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.7	20.7	-176.6	-63.1	-35.5	0	0	0	115.5	Y908 R910 F914	Y908-D912 PolarHBondContact O-N 3.34Å; R910-D912 VanDerWaalsContact C-N 3.3Å; D912-F914 HydrophobicContact CB-CE1 4.43Å; D912-F914 HydrophobicContact CB-CE2 4.42Å; D912-F914 HydrophobicContact CB-CZ 3.98Å; D912-F914 PolarHBondContact O-N 2.67Å; D912-F914 WeakPolarHBondContact OD1-CZ 3.08Å
913	R	91.8	Very high	91.6	Very high	83 Å²	83	50.2 Å²	50.2	31%	0.313	23%	0.231	S	C	.	.			trans	-91.8	66.5	175.5	-70.2	176.9	63.1	175.4	-0.4	110.7	S889 E893 Y908 C911 D915 D916 A917	S889-R913 PolarHBondContact OG-NH1 2.87Å; E893-R913 IonicContact OE1-NH1 2.84Å; E893-R913 PolarHBondContact OE1-NH1 3.37Å; Y908-R913 HydrophobicContact CD1-CB 4.12Å; Y908-R913 PolarHBondContact O-N 3.07Å; C911-R913 PolarHBondContact O-N 3.21Å; C911-R913 VanDerWaalsContact O-N 3.08Å; R913-D915 PolarHBondContact O-N 3.4Å; R913-D916 HydrophobicContact CB-CB 4.37Å; R913-D916 IonicContact CZ-OD2 3.15Å; R913-D916 IonicContact NE-OD2 3.44Å; R913-D916 PolarHBondContact NE-OD2 2.99Å; R913-D916 IonicContact NH2-OD2 2.77Å; R913-D916 PolarHBondContact NH2-OD2 3.08Å; R913-D916 PolarHBondContact O-N 3.05Å; R913-A917 PolarHBondContact O-N 3.34Å
914	F	92	Very high	91.6	Very high	56 Å²	56	48.4 Å²	48.4	25%	0.246	22%	0.224	C	C	.	.	H	α-helix	trans	-64.4	-35	-169.7	-53.6	-47.8	0	0	0	114.6	D912 A917 L918 L933 K937 M938	D912-F914 HydrophobicContact CB-CE1 4.43Å; D912-F914 HydrophobicContact CB-CE2 4.42Å; D912-F914 HydrophobicContact CB-CZ 3.98Å; D912-F914 PolarHBondContact O-N 2.67Å; D912-F914 WeakPolarHBondContact OD1-CZ 3.08Å; F914-A917 PolarHBondContact O-N 2.89Å; F914-L918 WeakPolarHBondContact O-CB 3.42Å; F914-L918 PolarHBondContact O-N 2.84Å; F914-L933 HydrophobicContact CB-CD1 4.23Å; F914-L933 HydrophobicContact CD1-CD1 3.78Å; F914-L933 HydrophobicContact CG-CD1 4.27Å; F914-K937 HydrophobicContact CD1-CD 4.17Å; F914-K937 HydrophobicContact CE1-CB 4.5Å; F914-K937 HydrophobicContact CE1-CD 3.69Å; F914-K937 HydrophobicContact CZ-CD 4.23Å; F914-M938 HydrophobicContact CB-CG 4.03Å; F914-M938 HydrophobicContact CB-SD 4.34Å
915	D	91.9	Very high	91.5	Very high	114 Å²	114	48.9 Å²	48.9	61%	0.61	23%	0.226	S	C	*	.	H	α-helix	trans	-65.4	-39.1	177.7	-69.1	-61.8	0	0	0	112.4	R913 R919	R913-D915 PolarHBondContact O-N 3.4Å; D915-R919 WeakPolarHBondContact O-CB 3.37Å; D915-R919 PolarHBondContact O-N 3.5Å; D915-R919 VanDerWaalsContact O-N 3.08Å
916	D	92.3	Very high	91.4	Very high	26 Å²	26	50.8 Å²	50.8	14%	0.139	24%	0.238	C	C	.	.	H	α-helix	trans	-69.6	-41.9	175.2	-63.6	-39.3	0	0	0	110.5	Y908 R913 L918 R919 C920	Y908-D916 HydrophobicContact CD1-CB 4.03Å; Y908-D916 HydrophobicContact CD2-CB 3.94Å; Y908-D916 HydrophobicContact CE1-CB 4.3Å; Y908-D916 HydrophobicContact CE2-CB 4.19Å; Y908-D916 HydrophobicContact CG-CB 3.85Å; R913-D916 HydrophobicContact CB-CB 4.37Å; R913-D916 IonicContact CZ-OD2 3.15Å; R913-D916 IonicContact NE-OD2 3.44Å; R913-D916 PolarHBondContact NE-OD2 2.99Å; R913-D916 IonicContact NH2-OD2 2.77Å; R913-D916 PolarHBondContact NH2-OD2 3.08Å; R913-D916 PolarHBondContact O-N 3.05Å; D916-L918 PolarHBondContact O-N 3.01Å; D916-R919 WeakPolarHBondContact O-CB 3.38Å; D916-R919 PolarHBondContact O-N 3.04Å; D916-R919 IonicContact OD1-CZ 3Å; D916-R919 IonicContact OD1-NH1 3.21Å; D916-R919 PolarHBondContact OD1-NH1 3.17Å; D916-R919 IonicContact OD1-NH2 3.71Å; D916-R919 PolarHBondContact OD1-NH2 2.82Å; D916-C920 PolarHBondContact O-N 2.78Å; D916-C920 PolarHBondContact O-SG 3.24Å; D916-C920 VanDerWaalsContact O-SG 3.36Å
917	A	92.9	Very high	91.3	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.5	-46.5	174.8	0	0	0	0	0	112.2	G905 E909 R913 F914 R919 C920 Y921 L933	G905-A917 WeakPolarHBondContact O-CB 3.36Å; E909-A917 HydrophobicContact CB-CB 4.06Å; R913-A917 PolarHBondContact O-N 3.34Å; F914-A917 PolarHBondContact O-N 2.89Å; A917-R919 VanDerWaalsContact C-N 3.32Å; A917-R919 PolarHBondContact O-N 2.82Å; A917-C920 PolarHBondContact O-N 2.82Å; A917-Y921 HydrophobicContact CB-CE2 4.27Å; A917-Y921 VanDerWaalsContact O-CD2 3.22Å; A917-Y921 WeakPolarHBondContact O-CD2 3.41Å; A917-Y921 VanDerWaalsContact O-CG 3.23Å; A917-Y921 PolarHBondContact O-N 2.87Å; A917-L933 HydrophobicContact CB-CD2 3.97Å
918	L	92.6	Very high	91.1	Very high	14 Å²	14	52.8 Å²	52.8	7%	0.073	25%	0.245	C	C	.	.	H	α-helix	trans	-63.8	-38.4	177.5	-175.7	61.2	0	0	0	111.6	F914 D916 Y921 K922 A930 L933 M934 M938	F914-L918 WeakPolarHBondContact O-CB 3.42Å; F914-L918 PolarHBondContact O-N 2.84Å; D916-L918 PolarHBondContact O-N 3.01Å; L918-Y921 PolarHBondContact O-N 3.01Å; L918-K922 WeakPolarHBondContact O-CG 3.29Å; L918-K922 PolarHBondContact O-N 2.91Å; L918-A930 HydrophobicContact CD1-CB 4.01Å; L918-L933 HydrophobicContact CB-CD2 3.8Å; L918-L933 HydrophobicContact CD1-CD2 4.4Å; L918-M934 HydrophobicContact CD1-CG 3.82Å; L918-M934 HydrophobicContact CD1-SD 4.05Å; L918-M934 HydrophobicContact CD2-CG 4.31Å; L918-M938 HydrophobicContact CB-SD 4.23Å; L918-M938 HydrophobicContact CD2-CE 4.1Å; L918-M938 HydrophobicContact CD2-SD 3.83Å
919	R	92.9	Very high	91	Very high	113 Å²	113	54.9 Å²	54.9	43%	0.426	26%	0.259	S	S	.	.	H	α-helix	trans	-62.4	-47.2	175.7	-168.2	-170.9	-51	128.2	13.8	111.1	D915 D916 A917 K922 Q923	D915-R919 WeakPolarHBondContact O-CB 3.37Å; D915-R919 PolarHBondContact O-N 3.5Å; D915-R919 VanDerWaalsContact O-N 3.08Å; D916-R919 WeakPolarHBondContact O-CB 3.38Å; D916-R919 PolarHBondContact O-N 3.04Å; D916-R919 IonicContact OD1-CZ 3Å; D916-R919 IonicContact OD1-NH1 3.21Å; D916-R919 PolarHBondContact OD1-NH1 3.17Å; D916-R919 IonicContact OD1-NH2 3.71Å; D916-R919 PolarHBondContact OD1-NH2 2.82Å; A917-R919 VanDerWaalsContact C-N 3.32Å; A917-R919 PolarHBondContact O-N 2.82Å; R919-K922 PolarHBondContact O-N 3.39Å; R919-Q923 WeakPolarHBondContact O-CG 3.36Å; R919-Q923 PolarHBondContact O-N 2.91Å
920	C	93.1	Very high	90.9	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-62	-44.2	176.2	-69.4	0	0	0	0	111.5	F901 D916 A917 K922 Q923 S924	F901-C920 HydrophobicContact CB-CB 4.32Å; F901-C920 WeakPolarHBondContact O-CB 3.39Å; D916-C920 PolarHBondContact O-N 2.78Å; D916-C920 PolarHBondContact O-SG 3.24Å; D916-C920 VanDerWaalsContact O-SG 3.36Å; A917-C920 PolarHBondContact O-N 2.82Å; C920-K922 VanDerWaalsContact C-N 3.33Å; C920-K922 PolarHBondContact O-N 2.57Å; C920-Q923 CarbonylContact O-C 3.53Å; C920-Q923 WeakPolarHBondContact O-CB 3.31Å; C920-Q923 PolarHBondContact O-N 3.28Å; C920-S924 PolarHBondContact O-N 2.86Å; C920-S924 PolarHBondContact O-OG 2.84Å; C920-S924 VanDerWaalsContact O-OG 3.07Å
921	Y	93.4	Very high	91	Very high	3 Å²	3	48 Å²	48	1%	0.012	23%	0.231	C	C	.	.	H	α-helix	trans	-64.4	-34.2	177.4	-64.7	-35	0	0	0	113.7	G905 I906 E909 A917 L918 S924 L925 T926 P929 L933	G905-Y921 PolarHBondContact O-OH 2.85Å; I906-Y921 WeakPolarHBondContact CA-OH 3.33Å; I906-Y921 HydrophobicContact CG1-CE1 4.44Å; I906-Y921 PolarHBondContact N-OH 2.87Å; E909-Y921 PolarHBondContact OE2-OH 2.86Å; A917-Y921 HydrophobicContact CB-CE2 4.27Å; A917-Y921 VanDerWaalsContact O-CD2 3.22Å; A917-Y921 WeakPolarHBondContact O-CD2 3.41Å; A917-Y921 VanDerWaalsContact O-CG 3.23Å; A917-Y921 PolarHBondContact O-N 2.87Å; L918-Y921 PolarHBondContact O-N 3.01Å; Y921-S924 WeakPolarHBondContact CA-OG 3.48Å; Y921-S924 PolarHBondContact O-OG 3.41Å; Y921-L925 PolarHBondContact O-N 3.09Å; Y921-L925 VanDerWaalsContact O-N 3.1Å; Y921-T926 WeakPolarHBondContact CD1-OG1 3.36Å; Y921-T926 PolarHBondContact O-N 3.04Å; Y921-T926 VanDerWaalsContact O-N 3.13Å; Y921-P929 HydrophobicContact CD1-CB 4.04Å; Y921-P929 HydrophobicContact CD2-CB 3.99Å; Y921-P929 HydrophobicContact CE1-CB 3.76Å; Y921-P929 HydrophobicContact CE1-CG 4.43Å; Y921-P929 HydrophobicContact CE2-CB 3.69Å; Y921-P929 HydrophobicContact CG-CB 4.16Å; Y921-L933 HydrophobicContact CD2-CD2 4.02Å; Y921-L933 HydrophobicContact CE2-CD2 4.07Å
922	K	92.3	Very high	91.1	Very high	68 Å²	68	50.9 Å²	50.9	30%	0.296	25%	0.249	S	C	.	.	H	α-helix	trans	-64.9	-39.5	170.6	-78.2	178.6	176.2	-178.9	0	111.5	L918 R919 C920 L925 F951 F952	L918-K922 WeakPolarHBondContact O-CG 3.29Å; L918-K922 PolarHBondContact O-N 2.91Å; R919-K922 PolarHBondContact O-N 3.39Å; C920-K922 VanDerWaalsContact C-N 3.33Å; C920-K922 PolarHBondContact O-N 2.57Å; K922-L925 PolarHBondContact O-N 3.23Å; K922-F951 HydrophobicContact CB-CE1 4.05Å; K922-F951 HydrophobicContact CG-CD1 4.49Å; K922-F951 HydrophobicContact CG-CE1 4.27Å; K922-F952 HydrophobicContact CG-CZ 4.34Å
923	Q	90.7	Very high	91.2	Very high	93 Å²	93	45.4 Å²	45.4	44%	0.435	22%	0.219	S	C	.	.	H	α-helix	trans	-71.3	-37.3	177.8	-72.5	174.6	-13.6	0	0	112.8	F901 R919 C920 L925	F901-Q923 HydrophobicContact CB-CB 4.18Å; F901-Q923 HydrophobicContact CD1-CB 4.24Å; F901-Q923 HydrophobicContact CD2-CB 3.91Å; F901-Q923 HydrophobicContact CE2-CB 4.32Å; F901-Q923 HydrophobicContact CG-CB 3.85Å; R919-Q923 WeakPolarHBondContact O-CG 3.36Å; R919-Q923 PolarHBondContact O-N 2.91Å; C920-Q923 CarbonylContact O-C 3.53Å; C920-Q923 WeakPolarHBondContact O-CB 3.31Å; C920-Q923 PolarHBondContact O-N 3.28Å; Q923-L925 VanDerWaalsContact C-N 3.29Å; Q923-L925 PolarHBondContact O-N 2.87Å
924	S	90.1	Very high	91.2	Very high	31 Å²	31	41.5 Å²	41.5	22%	0.217	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-4.5	174.8	52.7	0	0	0	0	114.3	C920 Y921 T926	C920-S924 PolarHBondContact O-N 2.86Å; C920-S924 PolarHBondContact O-OG 2.84Å; C920-S924 VanDerWaalsContact O-OG 3.07Å; Y921-S924 WeakPolarHBondContact CA-OG 3.48Å; Y921-S924 PolarHBondContact O-OG 3.41Å; S924-T926 PolarHBondContact O-N 2.83Å; S924-T926 PolarHBondContact OG-OG1 3.15Å
925	L	89.4	Confident	91	Very high	9 Å²	9	41.6 Å²	41.6	5%	0.047	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	32.9	-174	-60.5	175.9	0	0	0	113.6	Y921 K922 Q923 W927 F952 R955 L956 M959	Y921-L925 PolarHBondContact O-N 3.09Å; Y921-L925 VanDerWaalsContact O-N 3.1Å; K922-L925 PolarHBondContact O-N 3.23Å; Q923-L925 VanDerWaalsContact C-N 3.29Å; Q923-L925 PolarHBondContact O-N 2.87Å; L925-W927 PolarHBondContact O-N 2.9Å; L925-F952 HydrophobicContact CD2-CD1 4.07Å; L925-F952 HydrophobicContact CD2-CE1 4.45Å; L925-R955 HydrophobicContact CD1-CB 4.28Å; L925-R955 HydrophobicContact CD2-CB 3.56Å; L925-R955 HydrophobicContact CD2-CG 4.28Å; L925-L956 HydrophobicContact CB-CD2 4.14Å; L925-L956 HydrophobicContact CD1-CD2 4.29Å; L925-M959 HydrophobicContact CD1-CE 3.65Å; L925-M959 HydrophobicContact CD1-CG 4.19Å; L925-M959 HydrophobicContact CD1-SD 3.3Å; L925-M959 WeakPolarHBondContact CD1-SD 3.49Å
926	T	89.5	Confident	90.9	Very high	41 Å²	41	40 Å²	40	25%	0.252	21%	0.205	S	C	.	.			trans	-92.8	84.5	177.9	49.3	0	0	0	0	109.6	Y921 S924 H928 P929 A930	Y921-T926 WeakPolarHBondContact CD1-OG1 3.36Å; Y921-T926 PolarHBondContact O-N 3.04Å; Y921-T926 VanDerWaalsContact O-N 3.13Å; S924-T926 PolarHBondContact O-N 2.83Å; S924-T926 PolarHBondContact OG-OG1 3.15Å; T926-H928 PolarHBondContact O-N 3.37Å; T926-P929 WeakPolarHBondContact O-CD 3.16Å; T926-A930 PolarHBondContact O-N 3.1Å
927	W	89.3	Confident	90.6	Very high	18 Å²	18	43.1 Å²	43.1	7%	0.068	22%	0.217	C	C	.	.	H	α-helix	trans	-68.2	-32	-172.4	77.9	-93	0	0	0	113.5	L925 A930 W931 F952 D967 I968 Q971	L925-W927 PolarHBondContact O-N 2.9Å; W927-A930 PolarHBondContact O-N 2.76Å; W927-W931 HydrophobicContact CE3-CB 4.08Å; W927-W931 HydrophobicContact CE3-CD2 4.48Å; W927-W931 HydrophobicContact CE3-CE3 4.27Å; W927-W931 HydrophobicContact CE3-CG 4.43Å; W927-W931 HydrophobicContact CZ3-CB 4.32Å; W927-W931 HydrophobicContact CZ3-CD2 4.27Å; W927-W931 HydrophobicContact CZ3-CE3 4.32Å; W927-W931 HydrophobicContact CZ3-CG 4.28Å; W927-W931 WeakPolarHBondContact O-CB 3.31Å; W927-W931 PolarHBondContact O-N 2.93Å; W927-F952 HydrophobicContact CB-CD1 4.02Å; W927-F952 HydrophobicContact CB-CD2 4.13Å; W927-F952 HydrophobicContact CB-CE1 4.11Å; W927-F952 HydrophobicContact CB-CE2 4.22Å; W927-F952 HydrophobicContact CB-CG 4.04Å; W927-F952 HydrophobicContact CB-CZ 4.23Å; W927-D967 HydrophobicContact CZ2-CB 4.38Å; W927-I968 HydrophobicContact CB-CD1 3.78Å; W927-I968 HydrophobicContact CB-CG1 4.31Å; W927-I968 HydrophobicContact CD2-CD1 4.12Å; W927-I968 HydrophobicContact CD2-CG1 3.66Å; W927-I968 HydrophobicContact CE3-CG1 4.07Å; W927-I968 HydrophobicContact CG-CD1 3.68Å; W927-I968 HydrophobicContact CG-CG1 3.79Å; W927-I968 HydrophobicContact CZ2-CG1 4.38Å; W927-Q971 HydrophobicContact CH2-CB 4.45Å; W927-Q971 HydrophobicContact CH2-CG 4.44Å; W927-Q971 HydrophobicContact CZ3-CG 4.31Å
928	H	89.3	Confident	90.4	Very high	115 Å²	115	45.4 Å²	45.4	53%	0.532	23%	0.228	S	C	.	.	H	α-helix	trans	-62.7	-56.5	180	-79.2	-65.1	0	0	0	113	T926 A930 W931 T932	T926-H928 PolarHBondContact O-N 3.37Å; H928-A930 VanDerWaalsContact C-N 3.28Å; H928-A930 PolarHBondContact O-N 2.8Å; H928-W931 WeakPolarHBondContact O-CB 3.48Å; H928-W931 PolarHBondContact O-N 2.95Å; H928-W931 VanDerWaalsContact O-N 3.13Å; H928-T932 PolarHBondContact O-N 3.29Å; H928-T932 PolarHBondContact O-OG1 3.4Å
929	P	89.9	Confident	90.1	Very high	47 Å²	47	52.8 Å²	52.8	31%	0.305	26%	0.259	S	S	.	.	H	α-helix	trans	-57.1	-40	173.6	-25.5	33	0	0	0	113	Y921 T926 T932 L933	Y921-P929 HydrophobicContact CD1-CB 4.04Å; Y921-P929 HydrophobicContact CD2-CB 3.99Å; Y921-P929 HydrophobicContact CE1-CB 3.76Å; Y921-P929 HydrophobicContact CE1-CG 4.43Å; Y921-P929 HydrophobicContact CE2-CB 3.69Å; Y921-P929 HydrophobicContact CG-CB 4.16Å; T926-P929 WeakPolarHBondContact O-CD 3.16Å; P929-T932 PolarHBondContact O-N 2.91Å; P929-L933 WeakPolarHBondContact O-CB 3.45Å; P929-L933 PolarHBondContact O-N 2.75Å
930	A	91.1	Very high	89.9	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-60.9	-45.9	174.9	0	0	0	0	0	111.5	L918 T926 W927 H928 L933 M934 F952	L918-A930 HydrophobicContact CD1-CB 4.01Å; T926-A930 PolarHBondContact O-N 3.1Å; W927-A930 PolarHBondContact O-N 2.76Å; H928-A930 VanDerWaalsContact C-N 3.28Å; H928-A930 PolarHBondContact O-N 2.8Å; A930-L933 PolarHBondContact O-N 2.99Å; A930-M934 HydrophobicContact CB-CE 4.41Å; A930-M934 WeakPolarHBondContact O-CB 3.42Å; A930-M934 WeakPolarHBondContact O-CG 3.32Å; A930-M934 PolarHBondContact O-N 3.3Å; A930-F952 HydrophobicContact CB-CE2 3.87Å; A930-F952 HydrophobicContact CB-CZ 3.65Å
931	W	90.3	Very high	89.6	Confident	50 Å²	50	53.7 Å²	53.7	19%	0.189	28%	0.276	C	S	.	.	H	α-helix	trans	-61.9	-46.5	179.5	-168.2	-81.2	0	0	0	111.1	W927 H928 M934 T935 I945 A949 Q971 I972	W927-W931 HydrophobicContact CE3-CB 4.08Å; W927-W931 HydrophobicContact CE3-CD2 4.48Å; W927-W931 HydrophobicContact CE3-CE3 4.27Å; W927-W931 HydrophobicContact CE3-CG 4.43Å; W927-W931 HydrophobicContact CZ3-CB 4.32Å; W927-W931 HydrophobicContact CZ3-CD2 4.27Å; W927-W931 HydrophobicContact CZ3-CE3 4.32Å; W927-W931 HydrophobicContact CZ3-CG 4.28Å; W927-W931 WeakPolarHBondContact O-CB 3.31Å; W927-W931 PolarHBondContact O-N 2.93Å; H928-W931 WeakPolarHBondContact O-CB 3.48Å; H928-W931 PolarHBondContact O-N 2.95Å; H928-W931 VanDerWaalsContact O-N 3.13Å; W931-M934 PolarHBondContact O-N 2.96Å; W931-T935 WeakPolarHBondContact O-CB 3.48Å; W931-T935 VanDerWaalsContact O-CG2 3.3Å; W931-T935 WeakPolarHBondContact O-CG2 3.35Å; W931-T935 PolarHBondContact O-N 2.82Å; W931-T935 PolarHBondContact O-OG1 2.69Å; W931-I945 HydrophobicContact CE3-CG2 4.11Å; W931-I945 HydrophobicContact CH2-CG2 3.57Å; W931-I945 HydrophobicContact CZ2-CG2 4.08Å; W931-I945 HydrophobicContact CZ3-CG2 3.59Å; W931-A949 HydrophobicContact CZ3-CB 4.19Å; W931-Q971 HydrophobicContact CH2-CG 4.05Å; W931-Q971 HydrophobicContact CZ2-CG 3.78Å; W931-I972 HydrophobicContact CH2-CG1 4.44Å
932	T	89.9	Confident	89.1	Confident	73 Å²	73	59.6 Å²	59.6	45%	0.448	30%	0.304	S	S	.	.	H	α-helix	trans	-61.9	-45	175.2	-54.7	0	0	0	0	111.4	H928 P929 T935 T936	H928-T932 PolarHBondContact O-N 3.29Å; H928-T932 PolarHBondContact O-OG1 3.4Å; P929-T932 PolarHBondContact O-N 2.91Å; T932-T935 PolarHBondContact O-N 3.42Å; T932-T935 PolarHBondContact O-OG1 3.01Å; T932-T936 HydrophobicContact CG2-CG2 4.17Å; T932-T936 WeakPolarHBondContact O-CB 3.5Å; T932-T936 WeakPolarHBondContact O-CG2 3.47Å; T932-T936 PolarHBondContact O-N 3.08Å; T932-T936 PolarHBondContact O-OG1 3.27Å
933	L	91.2	Very high	88.7	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.31	C	S	.	.	I	π-helix	trans	-60.8	-47.4	177.9	-177.6	71	0	0	0	111.6	E909 F914 A917 L918 Y921 P929 A930 K937 M938	E909-L933 HydrophobicContact CG-CD1 4.16Å; F914-L933 HydrophobicContact CB-CD1 4.23Å; F914-L933 HydrophobicContact CD1-CD1 3.78Å; F914-L933 HydrophobicContact CG-CD1 4.27Å; A917-L933 HydrophobicContact CB-CD2 3.97Å; L918-L933 HydrophobicContact CB-CD2 3.8Å; L918-L933 HydrophobicContact CD1-CD2 4.4Å; Y921-L933 HydrophobicContact CD2-CD2 4.02Å; Y921-L933 HydrophobicContact CE2-CD2 4.07Å; P929-L933 WeakPolarHBondContact O-CB 3.45Å; P929-L933 PolarHBondContact O-N 2.75Å; A930-L933 PolarHBondContact O-N 2.99Å; L933-K937 HydrophobicContact CD1-CB 4.05Å; L933-K937 HydrophobicContact CD1-CD 3.91Å; L933-K937 HydrophobicContact CD1-CG 4.48Å; L933-K937 PolarHBondContact O-N 3.47Å; L933-K937 VanDerWaalsContact O-N 3.15Å; L933-M938 HydrophobicContact CD2-SD 4.21Å; L933-M938 HydrophobicContact CG-CG 4.23Å; L933-M938 HydrophobicContact CG-SD 4.1Å; L933-M938 PolarHBondContact O-N 2.95Å
934	M	91.6	Very high	88.5	Confident	1 Å²	1	58 Å²	58	1%	0.005	31%	0.309	C	S	.	.	I	π-helix	trans	-64.2	-40.3	-179.8	-71.3	-174.8	-59.6	0	0	112.4	L918 A930 W931 K939 L940 V948	L918-M934 HydrophobicContact CD1-CG 3.82Å; L918-M934 HydrophobicContact CD1-SD 4.05Å; L918-M934 HydrophobicContact CD2-CG 4.31Å; A930-M934 HydrophobicContact CB-CE 4.41Å; A930-M934 WeakPolarHBondContact O-CB 3.42Å; A930-M934 WeakPolarHBondContact O-CG 3.32Å; A930-M934 PolarHBondContact O-N 3.3Å; W931-M934 PolarHBondContact O-N 2.96Å; M934-K939 WeakPolarHBondContact O-CA 3.34Å; M934-K939 PolarHBondContact O-N 2.74Å; M934-L940 HydrophobicContact CB-CD1 3.94Å; M934-L940 HydrophobicContact CB-CG 4.37Å; M934-L940 HydrophobicContact CG-CD1 3.61Å; M934-L940 HydrophobicContact CG-CG 4.5Å; M934-L940 PolarHBondContact O-N 3.01Å; M934-L940 HydrophobicContact SD-CD1 3.96Å; M934-V948 HydrophobicContact CE-CB 4.24Å; M934-V948 HydrophobicContact CE-CG1 3.81Å; M934-V948 HydrophobicContact SD-CB 3.79Å; M934-V948 HydrophobicContact SD-CG1 3.61Å; M934-V948 HydrophobicContact SD-CG2 3.89Å
935	T	88.1	Confident	88.4	Confident	58 Å²	58	57.5 Å²	57.5	36%	0.356	30%	0.303	S	S	.	.	I	π-helix	trans	-82.9	-38.7	-176.4	52.7	0	0	0	0	113.4	W931 T932 I945	W931-T935 WeakPolarHBondContact O-CB 3.48Å; W931-T935 VanDerWaalsContact O-CG2 3.3Å; W931-T935 WeakPolarHBondContact O-CG2 3.35Å; W931-T935 PolarHBondContact O-N 2.82Å; W931-T935 PolarHBondContact O-OG1 2.69Å; T932-T935 PolarHBondContact O-N 3.42Å; T932-T935 PolarHBondContact O-OG1 3.01Å; T935-I945 HydrophobicContact CG2-CD1 4Å
936	T	88.3	Confident	88.3	Confident	81 Å²	81	59.3 Å²	59.3	50%	0.497	31%	0.313	S	S	.	.	I	π-helix	trans	-97.2	-50	-171.6	64.9	0	0	0	0	113.7	T932	T932-T936 HydrophobicContact CG2-CG2 4.17Å; T932-T936 WeakPolarHBondContact O-CB 3.5Å; T932-T936 WeakPolarHBondContact O-CG2 3.47Å; T932-T936 PolarHBondContact O-N 3.08Å; T932-T936 PolarHBondContact O-OG1 3.27Å
937	K	87.6	Confident	88.3	Confident	90 Å²	90	64.3 Å²	64.3	39%	0.391	33%	0.333	S	S	.	.	I	π-helix	trans	-92.7	-48	-172.6	-66.6	-176.3	169.7	178.2	0	112.4	E909 F914 L933	E909-K937 HydrophobicContact CG-CD 4.27Å; E909-K937 WeakPolarHBondContact OE1-CE 3.05Å; E909-K937 IonicContact OE1-NZ 3.19Å; E909-K937 PolarHBondContact OE1-NZ 2.74Å; F914-K937 HydrophobicContact CD1-CD 4.17Å; F914-K937 HydrophobicContact CE1-CB 4.5Å; F914-K937 HydrophobicContact CE1-CD 3.69Å; F914-K937 HydrophobicContact CZ-CD 4.23Å; L933-K937 HydrophobicContact CD1-CB 4.05Å; L933-K937 HydrophobicContact CD1-CD 3.91Å; L933-K937 HydrophobicContact CD1-CG 4.48Å; L933-K937 PolarHBondContact O-N 3.47Å; L933-K937 VanDerWaalsContact O-N 3.15Å
938	M	88.6	Confident	88.3	Confident	49 Å²	49	64 Å²	64	24%	0.241	33%	0.334	C	S	.	.	S	Bend	trans	-83.6	-25.4	-179.2	-62.3	-177.5	79.5	0	0	113.8	F914 L918 L933 L940	F914-M938 HydrophobicContact CB-CG 4.03Å; F914-M938 HydrophobicContact CB-SD 4.34Å; L918-M938 HydrophobicContact CB-SD 4.23Å; L918-M938 HydrophobicContact CD2-CE 4.1Å; L918-M938 HydrophobicContact CD2-SD 3.83Å; L933-M938 HydrophobicContact CD2-SD 4.21Å; L933-M938 HydrophobicContact CG-CG 4.23Å; L933-M938 HydrophobicContact CG-SD 4.1Å; L933-M938 PolarHBondContact O-N 2.95Å; M938-L940 HydrophobicContact CB-CD2 4.29Å; M938-L940 HydrophobicContact CB-CG 4.15Å; M938-L940 PolarHBondContact O-N 3.24Å
939	K	85.9	Confident	88.3	Confident	168 Å²	168	58.7 Å²	58.7	73%	0.73	31%	0.309	S	S	*	.			trans	52.7	51.1	-179.9	-58.1	-179.4	-178.8	176.8	0	113.8	M934	M934-K939 WeakPolarHBondContact O-CA 3.34Å; M934-K939 PolarHBondContact O-N 2.74Å
940	L	87.5	Confident	88.3	Confident	45 Å²	45	59.4 Å²	59.4	24%	0.236	31%	0.311	C	S	.	.			trans	-68.6	157.8	178	-60.3	-176.4	0	0	0	112.5	M934 M938 Q944 I945	M934-L940 HydrophobicContact CB-CD1 3.94Å; M934-L940 HydrophobicContact CB-CG 4.37Å; M934-L940 HydrophobicContact CG-CD1 3.61Å; M934-L940 HydrophobicContact CG-CG 4.5Å; M934-L940 PolarHBondContact O-N 3.01Å; M934-L940 HydrophobicContact SD-CD1 3.96Å; M938-L940 HydrophobicContact CB-CD2 4.29Å; M938-L940 HydrophobicContact CB-CG 4.15Å; M938-L940 PolarHBondContact O-N 3.24Å; L940-Q944 HydrophobicContact CB-CB 4.14Å; L940-I945 HydrophobicContact CB-CG1 4.23Å
941	T	88	Confident	88.3	Confident	87 Å²	87	63.3 Å²	63.3	53%	0.534	33%	0.328	S	S	.	.			trans	-75.9	158	176.6	63.6	0	0	0	0	112.1	G943 Q944 I945	T941-G943 VanDerWaalsContact C-N 3.27Å; T941-G943 PolarHBondContact O-N 3.44Å; T941-Q944 VanDerWaalsContact N-OE1 3.07Å; T941-Q944 WeakPolarHBondContact O-CB 3.4Å; T941-Q944 PolarHBondContact O-N 3Å; T941-Q944 WeakPolarHBondContact OG1-CG 3.45Å; T941-Q944 PolarHBondContact OG1-OE1 3.06Å; T941-I945 WeakPolarHBondContact O-CG1 3.49Å; T941-I945 PolarHBondContact O-N 3.47Å
942	E	82.7	Confident	88.4	Confident	128 Å²	128	61.1 Å²	61.1	60%	0.598	32%	0.32	S	S	*	.	H	α-helix	trans	-54.7	-41.3	-179.5	-166.6	-176.6	163.1	0	0	112.2	Q944 I945 D946 K974	E942-Q944 PolarHBondContact O-N 3.46Å; E942-I945 PolarHBondContact O-N 2.69Å; E942-D946 PolarHBondContact O-N 2.9Å; E942-K974 IonicContact OE1-NZ 3.88Å; E942-K974 PolarHBondContact OE1-NZ 2.93Å
943	G	83.9	Confident	88.4	Confident	42 Å²	42	58 Å²	58	43%	0.433	30%	0.301	S	S	.	.	H	α-helix	trans	-63.9	-36.2	176.4	0	0	0	0	0	113.8	T941 D946 E947	T941-G943 VanDerWaalsContact C-N 3.27Å; T941-G943 PolarHBondContact O-N 3.44Å; G943-D946 PolarHBondContact O-N 2.62Å; G943-E947 WeakPolarHBondContact O-CG 3.04Å; G943-E947 PolarHBondContact O-N 2.58Å; G943-E947 VanDerWaalsContact O-N 3.09Å
944	Q	87.2	Confident	88.4	Confident	86 Å²	86	64.7 Å²	64.7	40%	0.402	33%	0.329	S	S	.	.	H	α-helix	trans	-70.7	-35.2	175.3	-70.9	174.5	-37.6	0	0	111.9	L940 T941 E942 V948	L940-Q944 HydrophobicContact CB-CB 4.14Å; T941-Q944 VanDerWaalsContact N-OE1 3.07Å; T941-Q944 WeakPolarHBondContact O-CB 3.4Å; T941-Q944 PolarHBondContact O-N 3Å; T941-Q944 WeakPolarHBondContact OG1-CG 3.45Å; T941-Q944 PolarHBondContact OG1-OE1 3.06Å; E942-Q944 PolarHBondContact O-N 3.46Å; Q944-V948 WeakPolarHBondContact O-CG2 3.22Å; Q944-V948 PolarHBondContact O-N 2.88Å
945	I	88.1	Confident	88.4	Confident	19 Å²	19	69.9 Å²	69.9	10%	0.097	35%	0.349	C	S	.	.	H	α-helix	trans	-66.1	-43.7	175	-64.8	170.5	0	0	0	109.7	W931 T935 L940 T941 E942 E947 V948 A949	W931-I945 HydrophobicContact CE3-CG2 4.11Å; W931-I945 HydrophobicContact CH2-CG2 3.57Å; W931-I945 HydrophobicContact CZ2-CG2 4.08Å; W931-I945 HydrophobicContact CZ3-CG2 3.59Å; T935-I945 HydrophobicContact CG2-CD1 4Å; L940-I945 HydrophobicContact CB-CG1 4.23Å; T941-I945 WeakPolarHBondContact O-CG1 3.49Å; T941-I945 PolarHBondContact O-N 3.47Å; E942-I945 PolarHBondContact O-N 2.69Å; I945-E947 PolarHBondContact O-N 3.34Å; I945-V948 PolarHBondContact O-N 3.32Å; I945-A949 VanDerWaalsContact O-CB 3.31Å; I945-A949 WeakPolarHBondContact O-CB 3.31Å; I945-A949 PolarHBondContact O-N 2.79Å
946	D	87.1	Confident	88.5	Confident	47 Å²	47	67.1 Å²	67.1	25%	0.251	33%	0.332	S	S	.	.	H	α-helix	trans	-60	-43.2	176.9	-77.8	-15	0	0	0	111.8	E942 G943 V948 A949 D950	E942-D946 PolarHBondContact O-N 2.9Å; G943-D946 PolarHBondContact O-N 2.62Å; D946-V948 VanDerWaalsContact C-N 3.34Å; D946-V948 PolarHBondContact O-N 3.18Å; D946-A949 PolarHBondContact O-N 3.1Å; D946-D950 WeakPolarHBondContact O-CB 3.36Å; D946-D950 PolarHBondContact O-N 2.86Å
947	E	89	Confident	88.6	Confident	147 Å²	147	64.6 Å²	64.6	69%	0.687	32%	0.318	S	S	*	.	H	α-helix	trans	-59.7	-42.3	175.2	-76.4	179	-173.8	0	0	112.7	G943 I945 F951	G943-E947 WeakPolarHBondContact O-CG 3.04Å; G943-E947 PolarHBondContact O-N 2.58Å; G943-E947 VanDerWaalsContact O-N 3.09Å; I945-E947 PolarHBondContact O-N 3.34Å; E947-F951 PolarHBondContact O-N 3.37Å
948	V	89.3	Confident	88.6	Confident	12 Å²	12	65.2 Å²	65.2	7%	0.073	32%	0.322	C	S	.	.	H	α-helix	trans	-71.8	-36.8	177.7	176.3	0	0	0	0	111.3	M934 Q944 I945 D946 F951 F952	M934-V948 HydrophobicContact CE-CB 4.24Å; M934-V948 HydrophobicContact CE-CG1 3.81Å; M934-V948 HydrophobicContact SD-CB 3.79Å; M934-V948 HydrophobicContact SD-CG1 3.61Å; M934-V948 HydrophobicContact SD-CG2 3.89Å; Q944-V948 WeakPolarHBondContact O-CG2 3.22Å; Q944-V948 PolarHBondContact O-N 2.88Å; I945-V948 PolarHBondContact O-N 3.32Å; D946-V948 VanDerWaalsContact C-N 3.34Å; D946-V948 PolarHBondContact O-N 3.18Å; V948-F951 WeakPolarHBondContact O-CB 3.37Å; V948-F951 PolarHBondContact O-N 2.81Å; V948-F952 HydrophobicContact CG1-CD2 3.82Å; V948-F952 HydrophobicContact CG1-CE2 3.51Å; V948-F952 WeakPolarHBondContact O-CD2 3.34Å; V948-F952 PolarHBondContact O-N 2.78Å
949	A	89.3	Confident	88.5	Confident	2 Å²	2	68.4 Å²	68.4	2%	0.017	34%	0.337	C	S	.	.	H	α-helix	trans	-67.2	-41.4	178	0	0	0	0	0	111.5	W931 I945 D946 F951 F952 V953 I968 I972	W931-A949 HydrophobicContact CZ3-CB 4.19Å; I945-A949 VanDerWaalsContact O-CB 3.31Å; I945-A949 WeakPolarHBondContact O-CB 3.31Å; I945-A949 PolarHBondContact O-N 2.79Å; D946-A949 PolarHBondContact O-N 3.1Å; A949-F951 VanDerWaalsContact C-N 3.29Å; A949-F951 PolarHBondContact O-N 2.94Å; A949-F952 PolarHBondContact O-N 2.83Å; A949-F952 VanDerWaalsContact O-N 3.11Å; A949-V953 WeakPolarHBondContact O-CG2 3.34Å; A949-V953 PolarHBondContact O-N 2.86Å; A949-I968 HydrophobicContact CB-CG2 3.92Å; A949-I972 HydrophobicContact CB-CD1 3.63Å; A949-I972 HydrophobicContact CB-CG1 4.21Å
950	D	89.6	Confident	88.5	Confident	63 Å²	63	64.2 Å²	64.2	34%	0.337	33%	0.329	S	S	.	.	H	α-helix	trans	-61.8	-37.2	173.2	-81.5	-12.5	0	0	0	111.8	D946 K954 K975	D946-D950 WeakPolarHBondContact O-CB 3.36Å; D946-D950 PolarHBondContact O-N 2.86Å; D950-K954 WeakPolarHBondContact O-CB 3.22Å; D950-K954 PolarHBondContact O-N 2.98Å; D950-K975 IonicContact OD1-NZ 2.74Å; D950-K975 PolarHBondContact OD1-NZ 3.18Å; D950-K975 IonicContact OD2-NZ 3.94Å; D950-K975 PolarHBondContact OD2-NZ 3.32Å
951	F	91.7	Very high	88.4	Confident	82 Å²	82	67.1 Å²	67.1	36%	0.36	34%	0.337	S	S	.	.	H	α-helix	trans	-60.8	-46.6	171	172.6	-90	0	0	0	112	K922 E947 V948 A949 R955	K922-F951 HydrophobicContact CB-CE1 4.05Å; K922-F951 HydrophobicContact CG-CD1 4.49Å; K922-F951 HydrophobicContact CG-CE1 4.27Å; E947-F951 PolarHBondContact O-N 3.37Å; V948-F951 WeakPolarHBondContact O-CB 3.37Å; V948-F951 PolarHBondContact O-N 2.81Å; A949-F951 VanDerWaalsContact C-N 3.29Å; A949-F951 PolarHBondContact O-N 2.94Å; F951-R955 HydrophobicContact CD2-CG 4.43Å; F951-R955 HydrophobicContact CE1-CG 4.14Å; F951-R955 HydrophobicContact CE2-CG 4.03Å; F951-R955 HydrophobicContact CZ-CG 3.87Å; F951-R955 WeakPolarHBondContact O-CB 3.25Å; F951-R955 WeakPolarHBondContact O-CG 3.5Å; F951-R955 PolarHBondContact O-N 2.81Å
952	F	92	Very high	88.5	Confident	4 Å²	4	65.6 Å²	65.6	2%	0.018	32%	0.322	C	S	.	.	H	α-helix	trans	-63	-48	176.8	-79.5	-69.4	0	0	0	111.5	K922 L925 W927 A930 V948 A949 K954 R955 L956 I968	K922-F952 HydrophobicContact CG-CZ 4.34Å; L925-F952 HydrophobicContact CD2-CD1 4.07Å; L925-F952 HydrophobicContact CD2-CE1 4.45Å; W927-F952 HydrophobicContact CB-CD1 4.02Å; W927-F952 HydrophobicContact CB-CD2 4.13Å; W927-F952 HydrophobicContact CB-CE1 4.11Å; W927-F952 HydrophobicContact CB-CE2 4.22Å; W927-F952 HydrophobicContact CB-CG 4.04Å; W927-F952 HydrophobicContact CB-CZ 4.23Å; A930-F952 HydrophobicContact CB-CE2 3.87Å; A930-F952 HydrophobicContact CB-CZ 3.65Å; V948-F952 HydrophobicContact CG1-CD2 3.82Å; V948-F952 HydrophobicContact CG1-CE2 3.51Å; V948-F952 WeakPolarHBondContact O-CD2 3.34Å; V948-F952 PolarHBondContact O-N 2.78Å; A949-F952 PolarHBondContact O-N 2.83Å; A949-F952 VanDerWaalsContact O-N 3.11Å; F952-K954 PolarHBondContact O-N 2.87Å; F952-R955 PolarHBondContact O-N 3.4Å; F952-L956 HydrophobicContact CB-CD1 4.27Å; F952-L956 WeakPolarHBondContact O-CB 3.03Å; F952-L956 WeakPolarHBondContact O-CD1 3.37Å; F952-L956 WeakPolarHBondContact O-CG 3.44Å; F952-L956 PolarHBondContact O-N 3.09Å; F952-I968 HydrophobicContact CB-CD1 3.61Å; F952-I968 HydrophobicContact CG-CD1 4.37Å
953	V	90.4	Very high	88.7	Confident	8 Å²	8	61.8 Å²	61.8	5%	0.048	31%	0.312	C	S	.	.	H	α-helix	trans	-56.6	-50.6	-179.9	170.1	0	0	0	0	110.3	A949 R955 L956 C957 A965 I968 L969 I982	A949-V953 WeakPolarHBondContact O-CG2 3.34Å; A949-V953 PolarHBondContact O-N 2.86Å; V953-R955 PolarHBondContact O-N 2.94Å; V953-L956 PolarHBondContact O-N 3.11Å; V953-C957 WeakPolarHBondContact O-CB 3.15Å; V953-C957 PolarHBondContact O-N 3.41Å; V953-C957 PolarHBondContact O-SG 3.21Å; V953-A965 HydrophobicContact CG1-CB 4.38Å; V953-I968 HydrophobicContact CG2-CB 4.04Å; V953-I968 HydrophobicContact CG2-CG2 3.73Å; V953-L969 HydrophobicContact CG1-CD1 4.37Å; V953-L969 HydrophobicContact CG1-CG 4.44Å; V953-L969 HydrophobicContact CG2-CD2 4.13Å; V953-L969 HydrophobicContact CG2-CG 4.05Å; V953-I982 HydrophobicContact CG1-CD1 4.19Å
954	K	91.3	Very high	88.8	Confident	140 Å²	140	61.1 Å²	61.1	61%	0.609	30%	0.3	S	S	*	.	H	α-helix	trans	-58.8	-48.5	178.6	-176.4	176.6	178.1	177.1	0	112	D950 F952 C957 E958	D950-K954 WeakPolarHBondContact O-CB 3.22Å; D950-K954 PolarHBondContact O-N 2.98Å; F952-K954 PolarHBondContact O-N 2.87Å; K954-C957 PolarHBondContact O-N 3.27Å; K954-E958 WeakPolarHBondContact CE-OE1 3.47Å; K954-E958 WeakPolarHBondContact O-CG 3.39Å; K954-E958 PolarHBondContact O-N 2.93Å
955	R	91.5	Very high	88.9	Confident	109 Å²	109	57 Å²	57	41%	0.411	28%	0.281	S	S	.	.	H	α-helix	trans	-68.5	-35.7	-178.9	-75.7	-71.9	176	-163.2	-7.8	113.2	L925 F951 F952 V953 E958 M959	L925-R955 HydrophobicContact CD1-CB 4.28Å; L925-R955 HydrophobicContact CD2-CB 3.56Å; L925-R955 HydrophobicContact CD2-CG 4.28Å; F951-R955 HydrophobicContact CD2-CG 4.43Å; F951-R955 HydrophobicContact CE1-CG 4.14Å; F951-R955 HydrophobicContact CE2-CG 4.03Å; F951-R955 HydrophobicContact CZ-CG 3.87Å; F951-R955 WeakPolarHBondContact O-CB 3.25Å; F951-R955 WeakPolarHBondContact O-CG 3.5Å; F951-R955 PolarHBondContact O-N 2.81Å; F952-R955 PolarHBondContact O-N 3.4Å; V953-R955 PolarHBondContact O-N 2.94Å; R955-E958 IonicContact CZ-OE2 2.83Å; R955-E958 IonicContact NE-OE2 3.82Å; R955-E958 IonicContact NH1-OE2 2.85Å; R955-E958 PolarHBondContact NH1-OE2 3.42Å; R955-E958 PolarHBondContact O-N 2.85Å; R955-M959 WeakPolarHBondContact O-CG 3.47Å; R955-M959 PolarHBondContact O-N 2.9Å; R955-M959 VanDerWaalsContact O-N 3.08Å
956	L	90.3	Very high	88.9	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-68.9	-39.9	176.5	-72.1	167.9	0	0	0	110.9	L925 F952 V953 M959 S960 R961 A965 I968	L925-L956 HydrophobicContact CB-CD2 4.14Å; L925-L956 HydrophobicContact CD1-CD2 4.29Å; F952-L956 HydrophobicContact CB-CD1 4.27Å; F952-L956 WeakPolarHBondContact O-CB 3.03Å; F952-L956 WeakPolarHBondContact O-CD1 3.37Å; F952-L956 WeakPolarHBondContact O-CG 3.44Å; F952-L956 PolarHBondContact O-N 3.09Å; V953-L956 PolarHBondContact O-N 3.11Å; L956-M959 CarbonylContact O-C 3.59Å; L956-M959 PolarHBondContact O-N 2.86Å; L956-S960 PolarHBondContact O-N 3.32Å; L956-S960 VanDerWaalsContact O-N 3.17Å; L956-R961 HydrophobicContact CB-CB 4.25Å; L956-R961 HydrophobicContact CD2-CB 3.88Å; L956-R961 HydrophobicContact CD2-CG 4.48Å; L956-R961 PolarHBondContact O-N 2.86Å; L956-A965 HydrophobicContact CB-CB 4.11Å; L956-I968 HydrophobicContact CD1-CD1 3.47Å; L956-I968 VanDerWaalsContact CD1-CD1 3.47Å
957	C	89	Confident	89	Confident	29 Å²	29	57 Å²	57	20%	0.196	28%	0.281	C	S	.	.	H	α-helix	trans	-63.3	-41.9	171.8	-71	0	0	0	0	112.2	V953 K954 M959 S960 Y962	V953-C957 WeakPolarHBondContact O-CB 3.15Å; V953-C957 PolarHBondContact O-N 3.41Å; V953-C957 PolarHBondContact O-SG 3.21Å; K954-C957 PolarHBondContact O-N 3.27Å; C957-M959 PolarHBondContact O-N 2.6Å; C957-S960 PolarHBondContact O-N 3.1Å; C957-Y962 HydrophobicContact CB-CE1 4.46Å
958	E	88.4	Confident	89	Confident	103 Å²	103	50 Å²	50	48%	0.481	25%	0.248	S	C	.	.	H	α-helix	trans	-60.4	-29.7	173.4	-75	173	-166.2	0	0	112.5	K954 R955	K954-E958 WeakPolarHBondContact CE-OE1 3.47Å; K954-E958 WeakPolarHBondContact O-CG 3.39Å; K954-E958 PolarHBondContact O-N 2.93Å; R955-E958 IonicContact CZ-OE2 2.83Å; R955-E958 IonicContact NE-OE2 3.82Å; R955-E958 IonicContact NH1-OE2 2.85Å; R955-E958 PolarHBondContact NH1-OE2 3.42Å; R955-E958 PolarHBondContact O-N 2.85Å
959	M	85.7	Confident	88.9	Confident	115 Å²	115	49.7 Å²	49.7	57%	0.567	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.3	13.3	175.1	-66.4	-162.3	-179	0	0	113.9	L925 R955 L956 C957 R961	L925-M959 HydrophobicContact CD1-CE 3.65Å; L925-M959 HydrophobicContact CD1-CG 4.19Å; L925-M959 HydrophobicContact CD1-SD 3.3Å; L925-M959 WeakPolarHBondContact CD1-SD 3.49Å; R955-M959 WeakPolarHBondContact O-CG 3.47Å; R955-M959 PolarHBondContact O-N 2.9Å; R955-M959 VanDerWaalsContact O-N 3.08Å; L956-M959 CarbonylContact O-C 3.59Å; L956-M959 PolarHBondContact O-N 2.86Å; C957-M959 PolarHBondContact O-N 2.6Å; M959-R961 HydrophobicContact CB-CG 4.38Å; M959-R961 PolarHBondContact O-N 3.25Å; M959-R961 VanDerWaalsContact O-N 3.07Å
960	S	85.9	Confident	88.8	Confident	80 Å²	80	55.5 Å²	55.5	56%	0.559	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	20.7	-177.8	-54.5	0	0	0	0	115	L956 C957 Y962	L956-S960 PolarHBondContact O-N 3.32Å; L956-S960 VanDerWaalsContact O-N 3.17Å; C957-S960 PolarHBondContact O-N 3.1Å; S960-Y962 VanDerWaalsContact C-N 3.25Å; S960-Y962 VanDerWaalsContact O-CD2 3.28Å; S960-Y962 WeakPolarHBondContact O-CD2 3.26Å; S960-Y962 PolarHBondContact O-N 3.29Å; S960-Y962 VanDerWaalsContact O-N 3.13Å
961	R	86.7	Confident	88.6	Confident	107 Å²	107	57.8 Å²	57.8	40%	0.404	28%	0.276	S	S	.	.			trans	-89.1	58.8	176.2	-66.5	-177.1	62.5	-175.6	0.8	111	L956 M959 A963 T964 A965	L956-R961 HydrophobicContact CB-CB 4.25Å; L956-R961 HydrophobicContact CD2-CB 3.88Å; L956-R961 HydrophobicContact CD2-CG 4.48Å; L956-R961 PolarHBondContact O-N 2.86Å; M959-R961 HydrophobicContact CB-CG 4.38Å; M959-R961 PolarHBondContact O-N 3.25Å; M959-R961 VanDerWaalsContact O-N 3.07Å; R961-A963 PolarHBondContact O-N 2.62Å; R961-T964 WeakPolarHBondContact CB-OG1 3.39Å; R961-T964 PolarHBondContact O-N 2.84Å; R961-T964 PolarHBondContact O-OG1 2.98Å; R961-A965 PolarHBondContact O-N 3.48Å
962	Y	89.1	Confident	88.3	Confident	55 Å²	55	55 Å²	55	22%	0.216	27%	0.265	C	S	.	.	H	α-helix	trans	-62.1	-39.4	-173.6	-57.1	-68.9	0	0	0	113.2	C957 S960 T964 A965 C966 I982 Q985	C957-Y962 HydrophobicContact CB-CE1 4.46Å; S960-Y962 VanDerWaalsContact C-N 3.25Å; S960-Y962 VanDerWaalsContact O-CD2 3.28Å; S960-Y962 WeakPolarHBondContact O-CD2 3.26Å; S960-Y962 PolarHBondContact O-N 3.29Å; S960-Y962 VanDerWaalsContact O-N 3.13Å; Y962-T964 PolarHBondContact O-N 2.89Å; Y962-A965 WeakPolarHBondContact O-CB 3.35Å; Y962-A965 PolarHBondContact O-N 3.39Å; Y962-A965 VanDerWaalsContact O-N 3.13Å; Y962-C966 PolarHBondContact O-N 2.95Å; Y962-C966 PolarHBondContact O-SG 2.86Å; Y962-I982 HydrophobicContact CD1-CG2 4.04Å; Y962-Q985 HydrophobicContact CE1-CB 4.41Å
963	A	86.2	Confident	87.5	Confident	47 Å²	47	57.1 Å²	57.1	39%	0.388	29%	0.288	S	S	.	.	H	α-helix	trans	-55.2	-50.7	178.5	0	0	0	0	0	112.2	R961 A965 C966 D967 F988	R961-A963 PolarHBondContact O-N 2.62Å; A963-A965 VanDerWaalsContact C-N 3.31Å; A963-A965 PolarHBondContact O-N 3.09Å; A963-C966 WeakPolarHBondContact O-CB 3.4Å; A963-C966 PolarHBondContact O-N 3.42Å; A963-D967 PolarHBondContact O-N 3.05Å; A963-F988 HydrophobicContact CB-CE1 4.38Å; A963-F988 HydrophobicContact CB-CE2 4.3Å; A963-F988 HydrophobicContact CB-CZ 3.67Å
964	T	86.8	Confident	86.6	Confident	29 Å²	29	61.6 Å²	61.6	18%	0.178	31%	0.307	C	S	.	.	H	α-helix	trans	-67.5	-31.2	178.9	42.6	0	0	0	0	112.9	R961 Y962 D967 I968	R961-T964 WeakPolarHBondContact CB-OG1 3.39Å; R961-T964 PolarHBondContact O-N 2.84Å; R961-T964 PolarHBondContact O-OG1 2.98Å; Y962-T964 PolarHBondContact O-N 2.89Å; T964-D967 PolarHBondContact O-N 3.34Å; T964-I968 WeakPolarHBondContact O-CG1 3.43Å; T964-I968 PolarHBondContact O-N 2.84Å; T964-I968 VanDerWaalsContact O-N 3.12Å
965	A	89.3	Confident	86.1	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-66.4	-42.4	173.3	0	0	0	0	0	111	V953 L956 R961 Y962 A963 D967 I968 L969	V953-A965 HydrophobicContact CG1-CB 4.38Å; L956-A965 HydrophobicContact CB-CB 4.11Å; R961-A965 PolarHBondContact O-N 3.48Å; Y962-A965 WeakPolarHBondContact O-CB 3.35Å; Y962-A965 PolarHBondContact O-N 3.39Å; Y962-A965 VanDerWaalsContact O-N 3.13Å; A963-A965 VanDerWaalsContact C-N 3.31Å; A963-A965 PolarHBondContact O-N 3.09Å; A965-D967 VanDerWaalsContact C-N 3.32Å; A965-D967 PolarHBondContact O-N 2.81Å; A965-I968 PolarHBondContact O-N 3.45Å; A965-L969 WeakPolarHBondContact O-CG 3.41Å; A965-L969 PolarHBondContact O-N 3.45Å
966	C	89.2	Confident	85.6	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.007	30%	0.298	C	S	.	.	H	α-helix	trans	-60.1	-40.7	172.9	-67.1	0	0	0	0	112	Y962 A963 L969 R970 L979 I982	Y962-C966 PolarHBondContact O-N 2.95Å; Y962-C966 PolarHBondContact O-SG 2.86Å; A963-C966 WeakPolarHBondContact O-CB 3.4Å; A963-C966 PolarHBondContact O-N 3.42Å; C966-L969 PolarHBondContact O-N 2.88Å; C966-R970 WeakPolarHBondContact O-CB 3.15Å; C966-R970 VanDerWaalsContact O-CG 3.28Å; C966-R970 WeakPolarHBondContact O-CG 3.39Å; C966-R970 PolarHBondContact O-N 2.84Å; C966-L979 HydrophobicContact CB-CD1 3.7Å; C966-I982 VanDerWaalsContact SG-CG2 3.54Å
967	D	88.3	Confident	85.3	Confident	64 Å²	64	63.9 Å²	63.9	34%	0.342	33%	0.327	S	S	.	.	H	α-helix	trans	-65.6	-38.6	178.8	-65.2	-27.2	0	0	0	112.4	W927 A963 T964 A965 R970 Q971	W927-D967 HydrophobicContact CZ2-CB 4.38Å; A963-D967 PolarHBondContact O-N 3.05Å; T964-D967 PolarHBondContact O-N 3.34Å; A965-D967 VanDerWaalsContact C-N 3.32Å; A965-D967 PolarHBondContact O-N 2.81Å; D967-R970 PolarHBondContact O-N 3.31Å; D967-R970 IonicContact OD1-NH1 2.72Å; D967-R970 PolarHBondContact OD1-NH1 2.82Å; D967-Q971 WeakPolarHBondContact O-CB 3.43Å; D967-Q971 PolarHBondContact O-N 2.9Å
968	I	88.6	Confident	85.2	Confident	1 Å²	1	66 Å²	66	1%	0.005	34%	0.335	C	S	.	.	H	α-helix	trans	-64.1	-45.7	173.2	-65.9	170	0	0	0	110.3	W927 A949 F952 V953 L956 T964 A965 R970 Q971 I972	W927-I968 HydrophobicContact CB-CD1 3.78Å; W927-I968 HydrophobicContact CB-CG1 4.31Å; W927-I968 HydrophobicContact CD2-CD1 4.12Å; W927-I968 HydrophobicContact CD2-CG1 3.66Å; W927-I968 HydrophobicContact CE3-CG1 4.07Å; W927-I968 HydrophobicContact CG-CD1 3.68Å; W927-I968 HydrophobicContact CG-CG1 3.79Å; W927-I968 HydrophobicContact CZ2-CG1 4.38Å; A949-I968 HydrophobicContact CB-CG2 3.92Å; F952-I968 HydrophobicContact CB-CD1 3.61Å; F952-I968 HydrophobicContact CG-CD1 4.37Å; V953-I968 HydrophobicContact CG2-CB 4.04Å; V953-I968 HydrophobicContact CG2-CG2 3.73Å; L956-I968 HydrophobicContact CD1-CD1 3.47Å; L956-I968 VanDerWaalsContact CD1-CD1 3.47Å; T964-I968 WeakPolarHBondContact O-CG1 3.43Å; T964-I968 PolarHBondContact O-N 2.84Å; T964-I968 VanDerWaalsContact O-N 3.12Å; A965-I968 PolarHBondContact O-N 3.45Å; I968-R970 VanDerWaalsContact C-N 3.32Å; I968-R970 PolarHBondContact O-N 2.93Å; I968-Q971 WeakPolarHBondContact O-CB 3.49Å; I968-Q971 PolarHBondContact O-N 3.14Å; I968-Q971 VanDerWaalsContact O-N 3.1Å; I968-I972 HydrophobicContact CG2-CD1 3.98Å; I968-I972 HydrophobicContact CG2-CG1 4.45Å; I968-I972 VanDerWaalsContact O-CG1 3.31Å; I968-I972 WeakPolarHBondContact O-CG1 3.32Å; I968-I972 PolarHBondContact O-N 2.99Å
969	L	87.6	Confident	85.2	Confident	4 Å²	4	61.6 Å²	61.6	2%	0.021	31%	0.314	C	S	.	.	H	α-helix	trans	-62.5	-38.5	177.3	-71.2	173.6	0	0	0	112.3	V953 A965 C966 Q971 I972 G973 K975 M978 L979 I982	V953-L969 HydrophobicContact CG1-CD1 4.37Å; V953-L969 HydrophobicContact CG1-CG 4.44Å; V953-L969 HydrophobicContact CG2-CD2 4.13Å; V953-L969 HydrophobicContact CG2-CG 4.05Å; A965-L969 WeakPolarHBondContact O-CG 3.41Å; A965-L969 PolarHBondContact O-N 3.45Å; C966-L969 PolarHBondContact O-N 2.88Å; L969-Q971 VanDerWaalsContact C-N 3.35Å; L969-I972 HydrophobicContact CD2-CD1 4.48Å; L969-I972 PolarHBondContact O-N 3.26Å; L969-G973 PolarHBondContact O-N 2.84Å; L969-K975 HydrophobicContact CD2-CD 4.39Å; L969-M978 HydrophobicContact CD1-CG 4.15Å; L969-M978 HydrophobicContact CD1-SD 4.3Å; L969-M978 HydrophobicContact CD2-SD 4.12Å; L969-L979 HydrophobicContact CB-CD1 4.48Å; L969-I982 HydrophobicContact CD1-CD1 3.58Å
970	R	87.9	Confident	85.2	Confident	124 Å²	124	56.2 Å²	56.2	47%	0.468	29%	0.288	S	S	.	.	H	α-helix	trans	-62.4	-41.3	171.7	-74	171.5	-178.9	149.2	-4.6	111.7	C966 D967 I968 G973 L979	C966-R970 WeakPolarHBondContact O-CB 3.15Å; C966-R970 VanDerWaalsContact O-CG 3.28Å; C966-R970 WeakPolarHBondContact O-CG 3.39Å; C966-R970 PolarHBondContact O-N 2.84Å; D967-R970 PolarHBondContact O-N 3.31Å; D967-R970 IonicContact OD1-NH1 2.72Å; D967-R970 PolarHBondContact OD1-NH1 2.82Å; I968-R970 VanDerWaalsContact C-N 3.32Å; I968-R970 PolarHBondContact O-N 2.93Å; R970-G973 PolarHBondContact O-N 2.7Å; R970-L979 HydrophobicContact CG-CD2 4.44Å
971	Q	85.5	Confident	85.3	Confident	111 Å²	111	56.5 Å²	56.5	52%	0.519	28%	0.281	S	S	.	.	H	α-helix	trans	-66.7	-35.5	178.4	-172.5	64.2	38.1	0	0	112.5	W927 W931 D967 I968 L969	W927-Q971 HydrophobicContact CH2-CB 4.45Å; W927-Q971 HydrophobicContact CH2-CG 4.44Å; W927-Q971 HydrophobicContact CZ3-CG 4.31Å; W931-Q971 HydrophobicContact CH2-CG 4.05Å; W931-Q971 HydrophobicContact CZ2-CG 3.78Å; D967-Q971 WeakPolarHBondContact O-CB 3.43Å; D967-Q971 PolarHBondContact O-N 2.9Å; I968-Q971 WeakPolarHBondContact O-CB 3.49Å; I968-Q971 PolarHBondContact O-N 3.14Å; I968-Q971 VanDerWaalsContact O-N 3.1Å; L969-Q971 VanDerWaalsContact C-N 3.35Å
972	I	83.6	Confident	85.5	Confident	24 Å²	24	52 Å²	52	12%	0.123	26%	0.264	C	S	.	.	H	α-helix	trans	-70.8	-34.7	173.1	-62.2	165.2	0	0	0	110.7	W931 A949 I968 L969 K974	W931-I972 HydrophobicContact CH2-CG1 4.44Å; A949-I972 HydrophobicContact CB-CD1 3.63Å; A949-I972 HydrophobicContact CB-CG1 4.21Å; I968-I972 HydrophobicContact CG2-CD1 3.98Å; I968-I972 HydrophobicContact CG2-CG1 4.45Å; I968-I972 VanDerWaalsContact O-CG1 3.31Å; I968-I972 WeakPolarHBondContact O-CG1 3.32Å; I968-I972 PolarHBondContact O-N 2.99Å; L969-I972 HydrophobicContact CD2-CD1 4.48Å; L969-I972 PolarHBondContact O-N 3.26Å; I972-K974 HydrophobicContact CG2-CB 4.05Å; I972-K974 HydrophobicContact CG2-CD 4.42Å; I972-K974 HydrophobicContact CG2-CG 4.32Å; I972-K974 PolarHBondContact O-N 3.12Å
973	G	76.9	Confident	85.5	Confident	49 Å²	49	49.5 Å²	49.5	51%	0.505	26%	0.255	S	S	.	.			trans	74.8	4.4	178.6	0	0	0	0	0	115	L969 R970	L969-G973 PolarHBondContact O-N 2.84Å; R970-G973 PolarHBondContact O-N 2.7Å
974	K	69.9	Low	85.6	Confident	101 Å²	101	47.4 Å²	47.4	44%	0.439	24%	0.237	S	C	.	.			trans	-117.7	157.2	179.5	-55.7	171.7	-168.3	161.5	0	108.9	E942 I972	E942-K974 IonicContact OE1-NZ 3.88Å; E942-K974 PolarHBondContact OE1-NZ 2.93Å; I972-K974 HydrophobicContact CG2-CB 4.05Å; I972-K974 HydrophobicContact CG2-CD 4.42Å; I972-K974 HydrophobicContact CG2-CG 4.32Å; I972-K974 PolarHBondContact O-N 3.12Å
975	K	81.6	Confident	85.6	Confident	87 Å²	87	51 Å²	51	38%	0.378	25%	0.252	S	S	.	.			trans	77	60.2	177.5	-46.4	176.1	-176.6	179	0	116.7	D950 L969 M978 L979	D950-K975 IonicContact OD1-NZ 2.74Å; D950-K975 PolarHBondContact OD1-NZ 3.18Å; D950-K975 IonicContact OD2-NZ 3.94Å; D950-K975 PolarHBondContact OD2-NZ 3.32Å; L969-K975 HydrophobicContact CD2-CD 4.39Å; K975-M978 HydrophobicContact CB-CB 4.14Å; K975-M978 HydrophobicContact CD-CE 4.16Å; K975-M978 HydrophobicContact CD-SD 4.07Å; K975-L979 PolarHBondContact O-N 2.69Å
976	Q	81.1	Confident	85.4	Confident	97 Å²	97	51.7 Å²	51.7	45%	0.453	26%	0.259	S	S	.	.	H	α-helix	trans	-65.6	-36.6	-178.7	-64.3	-64.6	-31	0	0	114.7	L979 A980	Q976-L979 WeakPolarHBondContact O-CB 3.48Å; Q976-L979 PolarHBondContact O-N 3.39Å; Q976-A980 PolarHBondContact O-N 3.09Å
977	D	84.4	Confident	85.3	Confident	114 Å²	114	53.8 Å²	53.8	61%	0.61	27%	0.273	S	S	*	.	H	α-helix	trans	-66.2	-42.4	179.4	-60.8	-10.1	0	0	0	111.2	L979 A980 E981	D977-L979 VanDerWaalsContact C-N 3.28Å; D977-L979 PolarHBondContact O-N 2.9Å; D977-A980 WeakPolarHBondContact O-CB 3.5Å; D977-A980 PolarHBondContact O-N 2.98Å; D977-A980 VanDerWaalsContact O-N 3.13Å; D977-E981 WeakPolarHBondContact O-CG 3.38Å; D977-E981 PolarHBondContact O-N 3.23Å
978	M	86.2	Confident	85.3	Confident	74 Å²	74	54 Å²	54	37%	0.365	27%	0.271	S	S	.	.	H	α-helix	trans	-61.6	-38.1	174.3	-175.1	-178.2	-71.5	0	0	111.3	L969 K975 I982	L969-M978 HydrophobicContact CD1-CG 4.15Å; L969-M978 HydrophobicContact CD1-SD 4.3Å; L969-M978 HydrophobicContact CD2-SD 4.12Å; K975-M978 HydrophobicContact CB-CB 4.14Å; K975-M978 HydrophobicContact CD-CE 4.16Å; K975-M978 HydrophobicContact CD-SD 4.07Å; M978-I982 HydrophobicContact CG-CD1 3.87Å; M978-I982 WeakPolarHBondContact O-CB 3.28Å; M978-I982 VanDerWaalsContact O-CG1 3.23Å; M978-I982 WeakPolarHBondContact O-CG1 3.33Å; M978-I982 PolarHBondContact O-N 3.28Å
979	L	88.6	Confident	85.3	Confident	9 Å²	9	54 Å²	54	5%	0.047	27%	0.271	C	S	.	.	H	α-helix	trans	-62.1	-45.9	173.4	177.1	65.4	0	0	0	111	C966 L969 R970 K975 Q976 D977 I982 L983	C966-L979 HydrophobicContact CB-CD1 3.7Å; L969-L979 HydrophobicContact CB-CD1 4.48Å; R970-L979 HydrophobicContact CG-CD2 4.44Å; K975-L979 PolarHBondContact O-N 2.69Å; Q976-L979 WeakPolarHBondContact O-CB 3.48Å; Q976-L979 PolarHBondContact O-N 3.39Å; D977-L979 VanDerWaalsContact C-N 3.28Å; D977-L979 PolarHBondContact O-N 2.9Å; L979-I982 PolarHBondContact O-N 3.38Å; L979-L983 HydrophobicContact CD1-CD1 4.21Å; L979-L983 HydrophobicContact CD1-CG 4.24Å; L979-L983 HydrophobicContact CG-CD1 3.96Å; L979-L983 HydrophobicContact CG-CG 4.42Å; L979-L983 WeakPolarHBondContact O-CB 3.33Å; L979-L983 WeakPolarHBondContact O-CG 3.46Å; L979-L983 PolarHBondContact O-N 3.31Å
980	A	86.5	Confident	85.3	Confident	3 Å²	3	54.8 Å²	54.8	3%	0.025	28%	0.275	C	S	.	.	H	α-helix	trans	-61.8	-45.4	177.7	0	0	0	0	0	112.1	Q976 D977 I982 L983 I984 Q995 V996 L1005	Q976-A980 PolarHBondContact O-N 3.09Å; D977-A980 WeakPolarHBondContact O-CB 3.5Å; D977-A980 PolarHBondContact O-N 2.98Å; D977-A980 VanDerWaalsContact O-N 3.13Å; A980-I982 PolarHBondContact O-N 2.88Å; A980-L983 PolarHBondContact O-N 3.23Å; A980-I984 VanDerWaalsContact O-CG1 3.28Å; A980-I984 WeakPolarHBondContact O-CG1 3.32Å; A980-I984 PolarHBondContact O-N 2.8Å; A980-Q995 HydrophobicContact CB-CG 3.86Å; A980-V996 HydrophobicContact CB-CG2 4.46Å; A980-L1005 HydrophobicContact CB-CD1 3.89Å
981	E	88.1	Confident	85.3	Confident	86 Å²	86	52.5 Å²	52.5	40%	0.402	27%	0.271	S	S	.	.	H	α-helix	trans	-59.3	-45.4	176.1	-72.6	179.7	-179.7	0	0	112.1	D977 I984 Q985 L1005	D977-E981 WeakPolarHBondContact O-CG 3.38Å; D977-E981 PolarHBondContact O-N 3.23Å; E981-I984 PolarHBondContact O-N 2.84Å; E981-Q985 WeakPolarHBondContact O-CB 3.3Å; E981-Q985 WeakPolarHBondContact O-CG 3.08Å; E981-Q985 PolarHBondContact O-N 3.32Å; E981-L1005 HydrophobicContact CG-CD2 3.73Å
982	I	89.5	Confident	85.4	Confident	11 Å²	11	47.2 Å²	47.2	6%	0.056	25%	0.247	C	C	.	.	H	α-helix	trans	-68.2	-36.3	178.6	-67.4	168.5	0	0	0	111.1	V953 Y962 C966 L969 M978 L979 A980 Q985 G986	V953-I982 HydrophobicContact CG1-CD1 4.19Å; Y962-I982 HydrophobicContact CD1-CG2 4.04Å; C966-I982 VanDerWaalsContact SG-CG2 3.54Å; L969-I982 HydrophobicContact CD1-CD1 3.58Å; M978-I982 HydrophobicContact CG-CD1 3.87Å; M978-I982 WeakPolarHBondContact O-CB 3.28Å; M978-I982 VanDerWaalsContact O-CG1 3.23Å; M978-I982 WeakPolarHBondContact O-CG1 3.33Å; M978-I982 PolarHBondContact O-N 3.28Å; L979-I982 PolarHBondContact O-N 3.38Å; A980-I982 PolarHBondContact O-N 2.88Å; I982-Q985 PolarHBondContact O-N 2.87Å; I982-G986 PolarHBondContact O-N 2.8Å
983	L	89	Confident	85.6	Confident	4 Å²	4	47.3 Å²	47.3	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-63.2	-41.4	175	-74	169.6	0	0	0	111.7	L979 A980 C987 F988 N991 A992	L979-L983 HydrophobicContact CD1-CD1 4.21Å; L979-L983 HydrophobicContact CD1-CG 4.24Å; L979-L983 HydrophobicContact CG-CD1 3.96Å; L979-L983 HydrophobicContact CG-CG 4.42Å; L979-L983 WeakPolarHBondContact O-CB 3.33Å; L979-L983 WeakPolarHBondContact O-CG 3.46Å; L979-L983 PolarHBondContact O-N 3.31Å; A980-L983 PolarHBondContact O-N 3.23Å; L983-C987 PolarHBondContact O-N 2.8Å; L983-F988 HydrophobicContact CD2-CB 3.83Å; L983-F988 HydrophobicContact CD2-CD2 3.91Å; L983-F988 HydrophobicContact CD2-CG 4.18Å; L983-F988 PolarHBondContact O-N 2.92Å; L983-N991 HydrophobicContact CD1-CB 4.24Å; L983-N991 HydrophobicContact CD2-CB 3.91Å; L983-A992 HydrophobicContact CB-CB 4.02Å
984	I	89.5	Confident	86.1	Confident	3 Å²	3	52 Å²	52	2%	0.015	25%	0.25	C	C	.	.	H	α-helix	trans	-67	-45.7	175.8	-65.1	164.2	0	0	0	110.6	A980 E981 G986 C987 A992 L1005 M1008 L1009 K1012	A980-I984 VanDerWaalsContact O-CG1 3.28Å; A980-I984 WeakPolarHBondContact O-CG1 3.32Å; A980-I984 PolarHBondContact O-N 2.8Å; E981-I984 PolarHBondContact O-N 2.84Å; I984-G986 VanDerWaalsContact C-N 3.31Å; I984-G986 PolarHBondContact O-N 2.85Å; I984-C987 PolarHBondContact O-N 3.4Å; I984-A992 HydrophobicContact CG1-CB 3.85Å; I984-L1005 HydrophobicContact CD1-CD2 4.31Å; I984-M1008 HydrophobicContact CD1-CB 4.46Å; I984-M1008 HydrophobicContact CD1-CG 4.49Å; I984-M1008 HydrophobicContact CD1-SD 4.19Å; I984-M1008 HydrophobicContact CG2-CG 4.05Å; I984-M1008 HydrophobicContact CG2-SD 4.18Å; I984-L1009 HydrophobicContact CD1-CB 4.35Å; I984-L1009 HydrophobicContact CG1-CB 4.46Å; I984-L1009 HydrophobicContact CG1-CD1 4.33Å; I984-K1012 HydrophobicContact CG2-CB 4.24Å; I984-K1012 HydrophobicContact CG2-CG 4.3Å
985	Q	87.1	Confident	86.7	Confident	105 Å²	105	50.3 Å²	50.3	49%	0.491	24%	0.243	S	C	.	.	H	α-helix	trans	-63.6	-36.8	177.4	-74.9	-178.1	1.9	0	0	112.5	Y962 E981 I982 C987	Y962-Q985 HydrophobicContact CE1-CB 4.41Å; E981-Q985 WeakPolarHBondContact O-CB 3.3Å; E981-Q985 WeakPolarHBondContact O-CG 3.08Å; E981-Q985 PolarHBondContact O-N 3.32Å; I982-Q985 PolarHBondContact O-N 2.87Å; Q985-C987 VanDerWaalsContact C-N 3.28Å; Q985-C987 PolarHBondContact O-N 2.86Å
986	G	84.4	Confident	86.9	Confident	14 Å²	14	46.2 Å²	46.2	14%	0.144	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	5.6	179.3	0	0	0	0	0	115.1	I982 I984 F988	I982-G986 PolarHBondContact O-N 2.8Å; I984-G986 VanDerWaalsContact C-N 3.31Å; I984-G986 PolarHBondContact O-N 2.85Å; G986-F988 PolarHBondContact O-N 3.5Å
987	C	87.7	Confident	86.9	Confident	44 Å²	44	46.6 Å²	46.6	30%	0.297	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	27.5	179.3	-61.5	0	0	0	0	114.2	L983 I984 Q985 W989	L983-C987 PolarHBondContact O-N 2.8Å; I984-C987 PolarHBondContact O-N 3.4Å; Q985-C987 VanDerWaalsContact C-N 3.28Å; Q985-C987 PolarHBondContact O-N 2.86Å; C987-W989 HydrophobicContact CB-CD2 4.43Å; C987-W989 HydrophobicContact CB-CH2 3.9Å; C987-W989 HydrophobicContact CB-CZ2 3.41Å; C987-W989 VanDerWaalsContact CB-CZ2 3.41Å; C987-W989 PolarHBondContact O-N 2.96Å; C987-W989 PolarHBondContact O-NE1 2.82Å; C987-W989 VanDerWaalsContact SG-CH2 3.53Å; C987-W989 WeakPolarHBondContact SG-CZ2 3.38Å
988	F	87.9	Confident	86.8	Confident	69 Å²	69	46.3 Å²	46.3	30%	0.303	24%	0.238	S	C	.	.			trans	-83.4	67.3	175.1	-60.5	-64.9	0	0	0	110.2	A963 L983 G986 M990 N991 A992	A963-F988 HydrophobicContact CB-CE1 4.38Å; A963-F988 HydrophobicContact CB-CE2 4.3Å; A963-F988 HydrophobicContact CB-CZ 3.67Å; L983-F988 HydrophobicContact CD2-CB 3.83Å; L983-F988 HydrophobicContact CD2-CD2 3.91Å; L983-F988 HydrophobicContact CD2-CG 4.18Å; L983-F988 PolarHBondContact O-N 2.92Å; G986-F988 PolarHBondContact O-N 3.5Å; F988-M990 PolarHBondContact O-N 2.85Å; F988-N991 HydrophobicContact CB-CB 4.25Å; F988-N991 PolarHBondContact O-N 3.01Å; F988-N991 VanDerWaalsContact O-N 3.11Å; F988-A992 WeakPolarHBondContact O-CB 3.18Å; F988-A992 PolarHBondContact O-N 3.25Å
989	W	89.1	Confident	86.6	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.008	24%	0.235	C	C	.	.	H	α-helix	trans	-51.9	-52.6	-162.9	-53.2	122.7	0	0	0	114.6	C987 N991 A992 F993 L1009 K1012 V1013 T1016 L1083 V1086	C987-W989 HydrophobicContact CB-CD2 4.43Å; C987-W989 HydrophobicContact CB-CH2 3.9Å; C987-W989 HydrophobicContact CB-CZ2 3.41Å; C987-W989 VanDerWaalsContact CB-CZ2 3.41Å; C987-W989 PolarHBondContact O-N 2.96Å; C987-W989 PolarHBondContact O-NE1 2.82Å; C987-W989 VanDerWaalsContact SG-CH2 3.53Å; C987-W989 WeakPolarHBondContact SG-CZ2 3.38Å; W989-N991 PolarHBondContact O-N 2.76Å; W989-A992 PolarHBondContact O-N 2.9Å; W989-F993 WeakPolarHBondContact O-CB 3.41Å; W989-F993 PolarHBondContact O-N 3.49Å; W989-L1009 HydrophobicContact CE3-CD1 4.3Å; W989-K1012 HydrophobicContact CH2-CG 4.03Å; W989-K1012 HydrophobicContact CZ3-CB 4.5Å; W989-K1012 HydrophobicContact CZ3-CG 4.02Å; W989-V1013 HydrophobicContact CD2-CG2 4.36Å; W989-V1013 HydrophobicContact CE3-CG2 3.59Å; W989-V1013 HydrophobicContact CZ3-CG2 3.78Å; W989-T1016 HydrophobicContact CH2-CG2 4.3Å; W989-T1016 HydrophobicContact CZ2-CG2 3.85Å; W989-L1083 HydrophobicContact CD2-CD1 4.25Å; W989-L1083 HydrophobicContact CG-CD1 4.48Å; W989-L1083 HydrophobicContact CZ2-CD1 4.28Å; W989-V1086 HydrophobicContact CB-CB 3.76Å; W989-V1086 HydrophobicContact CB-CG1 3.9Å; W989-V1086 HydrophobicContact CB-CG2 3.89Å; W989-V1086 HydrophobicContact CG-CG1 4.28Å
990	M	87.5	Confident	86.1	Confident	20 Å²	20	51.5 Å²	51.5	10%	0.099	27%	0.267	C	S	.	.	H	α-helix	trans	-65.6	-39.8	-179	-70.8	-59.7	-60	0	0	112.3	F988 F993 Y994 E1082 R1085 V1086	F988-M990 PolarHBondContact O-N 2.85Å; M990-F993 PolarHBondContact O-N 2.87Å; M990-Y994 HydrophobicContact CB-CE2 4.27Å; M990-Y994 HydrophobicContact CE-CE2 3.77Å; M990-Y994 WeakPolarHBondContact CE-OH 3.04Å; M990-Y994 WeakPolarHBondContact O-CD2 3.23Å; M990-Y994 PolarHBondContact O-N 2.98Å; M990-E1082 VanDerWaalsContact CG-OE2 3.26Å; M990-E1082 WeakPolarHBondContact CG-OE2 3.27Å; M990-R1085 HydrophobicContact SD-CB 4.12Å; M990-V1086 HydrophobicContact SD-CB 4.46Å; M990-V1086 HydrophobicContact SD-CG2 4.32Å
991	N	86.4	Confident	85.5	Confident	75 Å²	75	57.1 Å²	57.1	40%	0.401	30%	0.297	S	S	.	.	H	α-helix	trans	-68	-40.4	177.7	-69.5	-23.7	0	0	0	111.7	L983 F988 W989 Q995	L983-N991 HydrophobicContact CD1-CB 4.24Å; L983-N991 HydrophobicContact CD2-CB 3.91Å; F988-N991 HydrophobicContact CB-CB 4.25Å; F988-N991 PolarHBondContact O-N 3.01Å; F988-N991 VanDerWaalsContact O-N 3.11Å; W989-N991 PolarHBondContact O-N 2.76Å; N991-Q995 WeakPolarHBondContact O-CB 3.22Å; N991-Q995 PolarHBondContact O-N 2.79Å; N991-Q995 VanDerWaalsContact O-N 3.08Å
992	A	88.1	Confident	85	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-63	-44.4	173.2	0	0	0	0	0	110.8	L983 I984 F988 W989 Q995 V996 L1009	L983-A992 HydrophobicContact CB-CB 4.02Å; I984-A992 HydrophobicContact CG1-CB 3.85Å; F988-A992 WeakPolarHBondContact O-CB 3.18Å; F988-A992 PolarHBondContact O-N 3.25Å; W989-A992 PolarHBondContact O-N 2.9Å; A992-Q995 PolarHBondContact O-N 3.31Å; A992-V996 WeakPolarHBondContact O-CB 3.26Å; A992-V996 VanDerWaalsContact O-CG2 3.26Å; A992-V996 WeakPolarHBondContact O-CG2 2.99Å; A992-V996 PolarHBondContact O-N 2.99Å; A992-L1009 HydrophobicContact CB-CD1 3.97Å
993	F	88.2	Confident	84.9	Confident	26 Å²	26	62.5 Å²	62.5	11%	0.114	33%	0.326	C	S	.	.	H	α-helix	trans	-58.5	-51.1	175.5	178	-99.3	0	0	0	111.3	W989 M990 Q995 V996 N997 L1009 V1086 H1089 M1090	W989-F993 WeakPolarHBondContact O-CB 3.41Å; W989-F993 PolarHBondContact O-N 3.49Å; M990-F993 PolarHBondContact O-N 2.87Å; F993-Q995 VanDerWaalsContact C-N 3.27Å; F993-Q995 PolarHBondContact O-N 3.36Å; F993-V996 CarbonylContact O-C 3.56Å; F993-V996 PolarHBondContact O-N 3.46Å; F993-V996 VanDerWaalsContact O-N 3.1Å; F993-N997 HydrophobicContact CD1-CB 4.46Å; F993-N997 HydrophobicContact CE1-CB 4.18Å; F993-N997 HydrophobicContact CE2-CB 4.42Å; F993-N997 HydrophobicContact CZ-CB 4.15Å; F993-N997 VanDerWaalsContact CZ-OD1 3.26Å; F993-N997 WeakPolarHBondContact CZ-OD1 3.22Å; F993-N997 WeakPolarHBondContact O-CB 3.44Å; F993-N997 PolarHBondContact O-N 3.44Å; F993-L1009 HydrophobicContact CB-CD2 4.24Å; F993-L1009 HydrophobicContact CD2-CD2 4.38Å; F993-V1086 HydrophobicContact CB-CG2 3.88Å; F993-V1086 HydrophobicContact CG-CG2 4.33Å; F993-H1089 HydrophobicContact CE1-CB 4.19Å; F993-H1089 HydrophobicContact CE2-CB 4.38Å; F993-H1089 HydrophobicContact CZ-CB 4.04Å; F993-M1090 HydrophobicContact CD2-CG 4.14Å; F993-M1090 HydrophobicContact CE2-CG 4.12Å
994	Y	86.8	Confident	84.8	Confident	148 Å²	148	66.7 Å²	66.7	58%	0.58	35%	0.353	S	S	*	.	H	α-helix	trans	-60.8	-35.1	178.6	-70.7	-53.1	0	0	0	113.6	M990 V996	M990-Y994 HydrophobicContact CB-CE2 4.27Å; M990-Y994 HydrophobicContact CE-CE2 3.77Å; M990-Y994 WeakPolarHBondContact CE-OH 3.04Å; M990-Y994 WeakPolarHBondContact O-CD2 3.23Å; M990-Y994 PolarHBondContact O-N 2.98Å; Y994-V996 VanDerWaalsContact C-N 3.33Å
995	Q	83.5	Confident	84.6	Confident	65 Å²	65	67 Å²	67	30%	0.304	36%	0.355	S	S	.	.	H	α-helix	trans	-71.7	-28.9	178	-165	68.8	19.4	0	0	112.6	A980 N991 A992 F993	A980-Q995 HydrophobicContact CB-CG 3.86Å; N991-Q995 WeakPolarHBondContact O-CB 3.22Å; N991-Q995 PolarHBondContact O-N 2.79Å; N991-Q995 VanDerWaalsContact O-N 3.08Å; A992-Q995 PolarHBondContact O-N 3.31Å; F993-Q995 VanDerWaalsContact C-N 3.27Å; F993-Q995 PolarHBondContact O-N 3.36Å
996	V	86.1	Confident	84.6	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.012	34%	0.337	C	S	.	.	H	α-helix	trans	-103.4	-21.1	-173.3	175.7	0	0	0	0	112.8	A980 A992 F993 Y994 S998 L999 L1005 T1006	A980-V996 HydrophobicContact CB-CG2 4.46Å; A992-V996 WeakPolarHBondContact O-CB 3.26Å; A992-V996 VanDerWaalsContact O-CG2 3.26Å; A992-V996 WeakPolarHBondContact O-CG2 2.99Å; A992-V996 PolarHBondContact O-N 2.99Å; F993-V996 CarbonylContact O-C 3.56Å; F993-V996 PolarHBondContact O-N 3.46Å; F993-V996 VanDerWaalsContact O-N 3.1Å; Y994-V996 VanDerWaalsContact C-N 3.33Å; V996-S998 PolarHBondContact O-N 2.98Å; V996-L999 HydrophobicContact CB-CD1 4.45Å; V996-L999 HydrophobicContact CG1-CD1 4.25Å; V996-L999 HydrophobicContact CG2-CD1 4.49Å; V996-L999 WeakPolarHBondContact O-CA 3.39Å; V996-L999 VanDerWaalsContact O-CB 3.23Å; V996-L999 WeakPolarHBondContact O-CB 3.47Å; V996-L999 WeakPolarHBondContact O-CG 3.28Å; V996-L999 PolarHBondContact O-N 3.45Å; V996-L1005 HydrophobicContact CG1-CB 4.29Å; V996-L1005 HydrophobicContact CG2-CB 3.99Å; V996-T1006 HydrophobicContact CG1-CG2 4.24Å; V996-T1006 VanDerWaalsContact CG1-OG1 3.24Å; V996-T1006 WeakPolarHBondContact CG1-OG1 3.31Å
997	N	81.2	Confident	84.7	Confident	105 Å²	105	66.1 Å²	66.1	56%	0.561	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-18.2	-174.5	-177	66.8	0	0	0	114.2	F993 L999	F993-N997 HydrophobicContact CD1-CB 4.46Å; F993-N997 HydrophobicContact CE1-CB 4.18Å; F993-N997 HydrophobicContact CE2-CB 4.42Å; F993-N997 HydrophobicContact CZ-CB 4.15Å; F993-N997 VanDerWaalsContact CZ-OD1 3.26Å; F993-N997 WeakPolarHBondContact CZ-OD1 3.22Å; F993-N997 WeakPolarHBondContact O-CB 3.44Å; F993-N997 PolarHBondContact O-N 3.44Å; N997-L999 VanDerWaalsContact C-N 3.34Å
998	S	80.4	Confident	84.7	Confident	107 Å²	107	67.7 Å²	67.7	75%	0.748	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-5.9	172.4	59.9	0	0	0	0	114.2	V996	V996-S998 PolarHBondContact O-N 2.98Å
999	L	82.1	Confident	84.8	Confident	60 Å²	60	64.6 Å²	64.6	31%	0.314	34%	0.339	S	S	.	.	S	Bend	trans	-96.1	152.8	-178.3	-53.8	173.4	0	0	0	109.9	V996 N997 H1003 L1005	V996-L999 HydrophobicContact CB-CD1 4.45Å; V996-L999 HydrophobicContact CG1-CD1 4.25Å; V996-L999 HydrophobicContact CG2-CD1 4.49Å; V996-L999 WeakPolarHBondContact O-CA 3.39Å; V996-L999 VanDerWaalsContact O-CB 3.23Å; V996-L999 WeakPolarHBondContact O-CB 3.47Å; V996-L999 WeakPolarHBondContact O-CG 3.28Å; V996-L999 PolarHBondContact O-N 3.45Å; N997-L999 VanDerWaalsContact C-N 3.34Å; L999-H1003 HydrophobicContact CB-CB 3.95Å; L999-L1005 HydrophobicContact CD1-CB 4.39Å; L999-L1005 HydrophobicContact CD1-CD1 4.05Å
1000	D	79.7	Confident	84.8	Confident	133 Å²	133	69.3 Å²	69.3	71%	0.711	36%	0.357	S	S	*	.			trans	-60.6	153.4	177.9	-64.2	-38.4	0	0	0	112	D1002 H1003 T1006	D1000-D1002 PolarHBondContact O-N 3.48Å; D1000-H1003 WeakPolarHBondContact O-CB 3.34Å; D1000-H1003 PolarHBondContact O-N 3.07Å; D1000-T1006 PolarHBondContact O-OG1 3.31Å
1001	D	72.7	Confident	84.9	Confident	121 Å²	121	72.6 Å²	72.6	65%	0.647	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-29.1	177.5	-82.6	-29.8	0	0	0	113	H1003 Q1007	D1001-H1003 VanDerWaalsContact C-N 3.31Å; D1001-Q1007 PolarHBondContact O-NE2 3.38Å
1002	D	78.6	Confident	85.2	Confident	148 Å²	148	73.3 Å²	73.3	79%	0.791	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-5.5	177.2	-71	-25.8	0	0	0	113.3	D1000	D1000-D1002 PolarHBondContact O-N 3.48Å
1003	H	86.7	Confident	85.3	Confident	62 Å²	62	73.3 Å²	73.3	29%	0.287	38%	0.377	S	S	.	.	S	Bend	trans	-65.2	137.5	179.9	-168.1	-85.4	0	0	0	110.4	L999 D1000 D1001 L1005 T1006 Q1007	L999-H1003 HydrophobicContact CB-CB 3.95Å; D1000-H1003 WeakPolarHBondContact O-CB 3.34Å; D1000-H1003 PolarHBondContact O-N 3.07Å; D1001-H1003 VanDerWaalsContact C-N 3.31Å; H1003-L1005 PolarHBondContact ND1-N 3.48Å; H1003-L1005 PolarHBondContact O-N 3.35Å; H1003-L1005 VanDerWaalsContact O-N 3.14Å; H1003-T1006 WeakPolarHBondContact O-CB 3.46Å; H1003-T1006 PolarHBondContact O-N 3.21Å; H1003-Q1007 PolarHBondContact O-N 3Å; H1003-Q1007 VanDerWaalsContact O-N 3.09Å
1004	P	86.7	Confident	85.4	Confident	91 Å²	91	73.8 Å²	73.8	59%	0.591	38%	0.381	S	S	*	.	H	α-helix	trans	-56.5	-35.7	-175.9	19.2	-33.2	0	0	0	113.5	M1008	P1004-M1008 WeakPolarHBondContact O-CB 3.29Å; P1004-M1008 PolarHBondContact O-N 2.94Å
1005	L	86.5	Confident	85.6	Confident	9 Å²	9	69.2 Å²	69.2	5%	0.047	37%	0.371	C	S	.	.	H	α-helix	trans	-67.3	-36.4	175.5	-62.9	174	0	0	0	112.7	A980 E981 I984 V996 L999 H1003 M1008 L1009	A980-L1005 HydrophobicContact CB-CD1 3.89Å; E981-L1005 HydrophobicContact CG-CD2 3.73Å; I984-L1005 HydrophobicContact CD1-CD2 4.31Å; V996-L1005 HydrophobicContact CG1-CB 4.29Å; V996-L1005 HydrophobicContact CG2-CB 3.99Å; L999-L1005 HydrophobicContact CD1-CB 4.39Å; L999-L1005 HydrophobicContact CD1-CD1 4.05Å; H1003-L1005 PolarHBondContact ND1-N 3.48Å; H1003-L1005 PolarHBondContact O-N 3.35Å; H1003-L1005 VanDerWaalsContact O-N 3.14Å; L1005-M1008 HydrophobicContact CD2-CE 4.47Å; L1005-M1008 PolarHBondContact O-N 3.38Å; L1005-L1009 WeakPolarHBondContact O-CB 3.18Å; L1005-L1009 PolarHBondContact O-N 3.32Å
1006	T	85.6	Confident	86	Confident	18 Å²	18	66.4 Å²	66.4	11%	0.11	36%	0.358	C	S	.	.	H	α-helix	trans	-67.5	-44.5	177.6	-45.4	0	0	0	0	110.9	V996 D1000 H1003 L1009 R1010	V996-T1006 HydrophobicContact CG1-CG2 4.24Å; V996-T1006 VanDerWaalsContact CG1-OG1 3.24Å; V996-T1006 WeakPolarHBondContact CG1-OG1 3.31Å; D1000-T1006 PolarHBondContact O-OG1 3.31Å; H1003-T1006 WeakPolarHBondContact O-CB 3.46Å; H1003-T1006 PolarHBondContact O-N 3.21Å; T1006-L1009 PolarHBondContact O-N 3.49Å; T1006-R1010 WeakPolarHBondContact O-CB 3.16Å; T1006-R1010 PolarHBondContact O-N 3.13Å
1007	Q	86.4	Confident	86.2	Confident	84 Å²	84	66.4 Å²	66.4	39%	0.393	36%	0.358	S	S	.	.	H	α-helix	trans	-65.3	-38.8	174.1	-68.4	-62.4	-26.6	0	0	112.3	D1001 H1003 R1010 T1011	D1001-Q1007 PolarHBondContact O-NE2 3.38Å; H1003-Q1007 PolarHBondContact O-N 3Å; H1003-Q1007 VanDerWaalsContact O-N 3.09Å; Q1007-R1010 PolarHBondContact O-N 2.84Å; Q1007-T1011 WeakPolarHBondContact O-CB 3.48Å; Q1007-T1011 PolarHBondContact O-N 2.82Å; Q1007-T1011 PolarHBondContact O-OG1 2.82Å
1008	M	89	Confident	86.7	Confident	77 Å²	77	66.6 Å²	66.6	38%	0.379	36%	0.356	S	S	.	.	H	α-helix	trans	-62.8	-46	175.6	-169.4	-172.5	-59.9	0	0	111.2	I984 P1004 L1005 K1012	I984-M1008 HydrophobicContact CD1-CB 4.46Å; I984-M1008 HydrophobicContact CD1-CG 4.49Å; I984-M1008 HydrophobicContact CD1-SD 4.19Å; I984-M1008 HydrophobicContact CG2-CG 4.05Å; I984-M1008 HydrophobicContact CG2-SD 4.18Å; P1004-M1008 WeakPolarHBondContact O-CB 3.29Å; P1004-M1008 PolarHBondContact O-N 2.94Å; L1005-M1008 HydrophobicContact CD2-CE 4.47Å; L1005-M1008 PolarHBondContact O-N 3.38Å; M1008-K1012 WeakPolarHBondContact O-CB 3.21Å; M1008-K1012 PolarHBondContact O-N 3.05Å
1009	L	89.8	Confident	87.2	Confident	3 Å²	3	65.7 Å²	65.7	2%	0.016	34%	0.336	C	S	.	.	H	α-helix	trans	-60.1	-51.5	175.4	179.1	64	0	0	0	110.9	I984 W989 A992 F993 L1005 T1006 T1011 K1012 V1013 M1090	I984-L1009 HydrophobicContact CD1-CB 4.35Å; I984-L1009 HydrophobicContact CG1-CB 4.46Å; I984-L1009 HydrophobicContact CG1-CD1 4.33Å; W989-L1009 HydrophobicContact CE3-CD1 4.3Å; A992-L1009 HydrophobicContact CB-CD1 3.97Å; F993-L1009 HydrophobicContact CB-CD2 4.24Å; F993-L1009 HydrophobicContact CD2-CD2 4.38Å; L1005-L1009 WeakPolarHBondContact O-CB 3.18Å; L1005-L1009 PolarHBondContact O-N 3.32Å; T1006-L1009 PolarHBondContact O-N 3.49Å; L1009-T1011 PolarHBondContact O-N 2.82Å; L1009-K1012 PolarHBondContact O-N 3.26Å; L1009-V1013 HydrophobicContact CD1-CG2 3.84Å; L1009-V1013 HydrophobicContact CG-CG2 4.27Å; L1009-V1013 WeakPolarHBondContact O-CB 3.29Å; L1009-V1013 VanDerWaalsContact O-CG2 3.25Å; L1009-V1013 WeakPolarHBondContact O-CG2 3.45Å; L1009-V1013 PolarHBondContact O-N 3.29Å; L1009-M1090 HydrophobicContact CD2-SD 4.41Å; L1009-M1090 HydrophobicContact CG-SD 4.37Å
1010	R	88.9	Confident	87.6	Confident	101 Å²	101	63 Å²	63	38%	0.381	32%	0.321	S	S	.	.	H	α-helix	trans	-58	-48.6	-178.6	-169.3	176.4	-172.8	127.8	3.8	112.4	T1006 Q1007 K1012 V1013 I1014 M1090	T1006-R1010 WeakPolarHBondContact O-CB 3.16Å; T1006-R1010 PolarHBondContact O-N 3.13Å; Q1007-R1010 PolarHBondContact O-N 2.84Å; R1010-K1012 VanDerWaalsContact C-N 3.34Å; R1010-K1012 PolarHBondContact O-N 3.4Å; R1010-V1013 PolarHBondContact O-N 2.89Å; R1010-I1014 HydrophobicContact CG-CD1 4.09Å; R1010-I1014 WeakPolarHBondContact O-CG1 3.42Å; R1010-I1014 PolarHBondContact O-N 3.04Å; R1010-I1014 VanDerWaalsContact O-N 3.14Å; R1010-M1090 HydrophobicContact CB-CE 3.74Å; R1010-M1090 HydrophobicContact CG-CE 3.93Å
1011	T	90.5	Very high	88.1	Confident	89 Å²	89	58.3 Å²	58.3	55%	0.546	30%	0.296	S	S	.	.	H	α-helix	trans	-63.5	-41.8	179.4	-54.3	0	0	0	0	111.3	Q1007 L1009 S1015	Q1007-T1011 WeakPolarHBondContact O-CB 3.48Å; Q1007-T1011 PolarHBondContact O-N 2.82Å; Q1007-T1011 PolarHBondContact O-OG1 2.82Å; L1009-T1011 PolarHBondContact O-N 2.82Å; T1011-S1015 WeakPolarHBondContact O-CB 3.29Å; T1011-S1015 PolarHBondContact O-N 2.84Å; T1011-S1015 VanDerWaalsContact O-N 3.09Å; T1011-S1015 PolarHBondContact O-OG 2.73Å
1012	K	90.7	Very high	88.9	Confident	90 Å²	90	59 Å²	59	39%	0.391	30%	0.296	S	S	.	.	H	α-helix	trans	-70.6	-39.1	-178.5	-169.3	64.7	175.5	179.8	0	112.3	I984 W989 M1008 L1009 R1010 S1015 T1016	I984-K1012 HydrophobicContact CG2-CB 4.24Å; I984-K1012 HydrophobicContact CG2-CG 4.3Å; W989-K1012 HydrophobicContact CH2-CG 4.03Å; W989-K1012 HydrophobicContact CZ3-CB 4.5Å; W989-K1012 HydrophobicContact CZ3-CG 4.02Å; M1008-K1012 WeakPolarHBondContact O-CB 3.21Å; M1008-K1012 PolarHBondContact O-N 3.05Å; L1009-K1012 PolarHBondContact O-N 3.26Å; R1010-K1012 VanDerWaalsContact C-N 3.34Å; R1010-K1012 PolarHBondContact O-N 3.4Å; K1012-S1015 WeakPolarHBondContact CA-OG 3.36Å; K1012-S1015 PolarHBondContact O-OG 2.87Å; K1012-S1015 VanDerWaalsContact O-OG 3.09Å; K1012-T1016 VanDerWaalsContact O-CB 3.3Å; K1012-T1016 WeakPolarHBondContact O-CB 3.08Å; K1012-T1016 PolarHBondContact O-N 3.03Å; K1012-T1016 PolarHBondContact O-OG1 3.42Å
1013	V	90.9	Very high	89.5	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.7	-50.6	176.6	165.4	0	0	0	0	110.9	W989 L1009 R1010 T1016 A1017 L1083 V1086 L1087 M1090	W989-V1013 HydrophobicContact CD2-CG2 4.36Å; W989-V1013 HydrophobicContact CE3-CG2 3.59Å; W989-V1013 HydrophobicContact CZ3-CG2 3.78Å; L1009-V1013 HydrophobicContact CD1-CG2 3.84Å; L1009-V1013 HydrophobicContact CG-CG2 4.27Å; L1009-V1013 WeakPolarHBondContact O-CB 3.29Å; L1009-V1013 VanDerWaalsContact O-CG2 3.25Å; L1009-V1013 WeakPolarHBondContact O-CG2 3.45Å; L1009-V1013 PolarHBondContact O-N 3.29Å; R1010-V1013 PolarHBondContact O-N 2.89Å; V1013-T1016 PolarHBondContact O-N 2.85Å; V1013-A1017 PolarHBondContact O-N 3.24Å; V1013-L1083 HydrophobicContact CG1-CD1 3.91Å; V1013-V1086 HydrophobicContact CB-CG1 4.39Å; V1013-V1086 HydrophobicContact CG1-CG1 3.67Å; V1013-V1086 HydrophobicContact CG2-CG1 3.72Å; V1013-L1087 HydrophobicContact CG1-CD2 3.46Å; V1013-L1087 VanDerWaalsContact CG1-CD2 3.46Å; V1013-L1087 HydrophobicContact CG1-CG 3.93Å; V1013-M1090 HydrophobicContact CG2-SD 4.37Å
1014	I	90.4	Very high	89.6	Confident	37 Å²	37	51.7 Å²	51.7	19%	0.19	26%	0.257	C	S	.	.	H	α-helix	trans	-62.5	-49.4	-179.4	-66.5	169	0	0	0	111.1	R1010 T1016 A1017 Q1018 L1092	R1010-I1014 HydrophobicContact CG-CD1 4.09Å; R1010-I1014 WeakPolarHBondContact O-CG1 3.42Å; R1010-I1014 PolarHBondContact O-N 3.04Å; R1010-I1014 VanDerWaalsContact O-N 3.14Å; I1014-T1016 VanDerWaalsContact C-N 3.25Å; I1014-T1016 PolarHBondContact O-N 2.9Å; I1014-A1017 PolarHBondContact O-N 2.94Å; I1014-Q1018 WeakPolarHBondContact O-CG 3.16Å; I1014-Q1018 PolarHBondContact O-N 2.57Å; I1014-L1092 HydrophobicContact CD1-CD1 4.12Å; I1014-L1092 HydrophobicContact CD1-CD2 4.46Å; I1014-L1092 HydrophobicContact CG1-CD1 3.87Å
1015	S	92.1	Very high	89.7	Confident	52 Å²	52	51 Å²	51	36%	0.364	25%	0.249	S	C	.	.	H	α-helix	trans	-62.6	-33.1	179.1	55.3	0	0	0	0	112.6	T1011 K1012 R1019	T1011-S1015 WeakPolarHBondContact O-CB 3.29Å; T1011-S1015 PolarHBondContact O-N 2.84Å; T1011-S1015 VanDerWaalsContact O-N 3.09Å; T1011-S1015 PolarHBondContact O-OG 2.73Å; K1012-S1015 WeakPolarHBondContact CA-OG 3.36Å; K1012-S1015 PolarHBondContact O-OG 2.87Å; K1012-S1015 VanDerWaalsContact O-OG 3.09Å; S1015-R1019 WeakPolarHBondContact O-CB 3.39Å; S1015-R1019 PolarHBondContact O-N 3.43Å; S1015-R1019 VanDerWaalsContact O-N 3.07Å
1016	T	90.8	Very high	89.9	Confident	6 Å²	6	56.7 Å²	56.7	4%	0.037	27%	0.273	C	S	.	.	H	α-helix	trans	-72.1	-39.7	176	-52.9	0	0	0	0	111.7	W989 K1012 V1013 I1014 R1019 I1020 L1083	W989-T1016 HydrophobicContact CH2-CG2 4.3Å; W989-T1016 HydrophobicContact CZ2-CG2 3.85Å; K1012-T1016 VanDerWaalsContact O-CB 3.3Å; K1012-T1016 WeakPolarHBondContact O-CB 3.08Å; K1012-T1016 PolarHBondContact O-N 3.03Å; K1012-T1016 PolarHBondContact O-OG1 3.42Å; V1013-T1016 PolarHBondContact O-N 2.85Å; I1014-T1016 VanDerWaalsContact C-N 3.25Å; I1014-T1016 PolarHBondContact O-N 2.9Å; T1016-R1019 PolarHBondContact O-N 3.41Å; T1016-I1020 HydrophobicContact CG2-CD1 4.11Å; T1016-I1020 WeakPolarHBondContact O-CG1 3.38Å; T1016-I1020 PolarHBondContact O-N 2.94Å; T1016-L1083 HydrophobicContact CG2-CD2 4.35Å
1017	A	89.7	Confident	90.1	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.008	27%	0.274	C	S	.	.	H	α-helix	trans	-61.3	-47.2	175	0	0	0	0	0	111.6	V1013 I1014 R1019 I1020 I1021 L1083 L1087 L1099	V1013-A1017 PolarHBondContact O-N 3.24Å; I1014-A1017 PolarHBondContact O-N 2.94Å; A1017-R1019 PolarHBondContact O-N 3.44Å; A1017-I1020 PolarHBondContact O-N 2.84Å; A1017-I1021 VanDerWaalsContact O-CG1 3.31Å; A1017-I1021 WeakPolarHBondContact O-CG1 3.14Å; A1017-I1021 PolarHBondContact O-N 2.95Å; A1017-L1083 HydrophobicContact CB-CD2 4Å; A1017-L1087 HydrophobicContact CB-CD1 4.14Å; A1017-L1099 HydrophobicContact CB-CD2 4.44Å
1018	Q	91.9	Very high	90.2	Very high	110 Å²	110	55.8 Å²	55.8	51%	0.514	27%	0.268	S	S	.	.	H	α-helix	trans	-59.5	-45.6	176.5	-72.3	175.2	-19.1	0	0	112.1	I1014 I1020 I1021 E1022	I1014-Q1018 WeakPolarHBondContact O-CG 3.16Å; I1014-Q1018 PolarHBondContact O-N 2.57Å; Q1018-I1020 VanDerWaalsContact C-N 3.33Å; Q1018-I1020 PolarHBondContact O-N 3Å; Q1018-I1021 WeakPolarHBondContact O-CB 3.48Å; Q1018-I1021 PolarHBondContact O-N 3.14Å; Q1018-E1022 WeakPolarHBondContact O-CG 3.25Å; Q1018-E1022 PolarHBondContact O-N 2.99Å
1019	R	91.8	Very high	90.2	Very high	88 Å²	88	58.8 Å²	58.8	33%	0.332	28%	0.281	S	S	.	.	H	α-helix	trans	-58.1	-44.3	175.8	-177.7	-170.5	63.6	83.2	1.3	112	S1015 T1016 A1017 I1021 E1022 E1023 E1079	S1015-R1019 WeakPolarHBondContact O-CB 3.39Å; S1015-R1019 PolarHBondContact O-N 3.43Å; S1015-R1019 VanDerWaalsContact O-N 3.07Å; T1016-R1019 PolarHBondContact O-N 3.41Å; A1017-R1019 PolarHBondContact O-N 3.44Å; R1019-I1021 VanDerWaalsContact C-N 3.33Å; R1019-E1022 PolarHBondContact O-N 3.36Å; R1019-E1023 WeakPolarHBondContact CG-OE1 3.5Å; R1019-E1023 IonicContact CZ-OE1 3.84Å; R1019-E1023 IonicContact NH1-OE1 3.34Å; R1019-E1023 PolarHBondContact NH1-OE1 3.19Å; R1019-E1023 IonicContact NH1-OE2 2.69Å; R1019-E1023 PolarHBondContact NH1-OE2 2.9Å; R1019-E1023 WeakPolarHBondContact O-CB 3.36Å; R1019-E1023 VanDerWaalsContact O-CG 3.31Å; R1019-E1023 WeakPolarHBondContact O-CG 3.47Å; R1019-E1023 PolarHBondContact O-N 3.02Å; R1019-E1079 IonicContact NH2-OE1 3.78Å; R1019-E1079 PolarHBondContact NH2-OE1 2.67Å
1020	I	90.1	Very high	90.2	Very high	3 Å²	3	61 Å²	61	2%	0.015	29%	0.293	C	S	.	.	H	α-helix	trans	-66.2	-37.9	179.5	-67.6	170.5	0	0	0	111	T1016 A1017 Q1018 E1023 A1024 E1079 V1080 L1083 L1099	T1016-I1020 HydrophobicContact CG2-CD1 4.11Å; T1016-I1020 WeakPolarHBondContact O-CG1 3.38Å; T1016-I1020 PolarHBondContact O-N 2.94Å; A1017-I1020 PolarHBondContact O-N 2.84Å; Q1018-I1020 VanDerWaalsContact C-N 3.33Å; Q1018-I1020 PolarHBondContact O-N 3Å; I1020-E1023 PolarHBondContact O-N 3.5Å; I1020-A1024 VanDerWaalsContact O-CB 3.31Å; I1020-A1024 WeakPolarHBondContact O-CB 3.26Å; I1020-A1024 PolarHBondContact O-N 2.82Å; I1020-E1079 HydrophobicContact CD1-CG 4.31Å; I1020-V1080 HydrophobicContact CG2-CG2 4.16Å; I1020-L1083 HydrophobicContact CD1-CD2 3.72Å; I1020-L1099 HydrophobicContact CB-CD1 3.97Å; I1020-L1099 HydrophobicContact CG2-CD1 3.63Å
1021	I	89.8	Confident	90.1	Very high	35 Å²	35	56.4 Å²	56.4	18%	0.179	28%	0.276	C	S	.	.	H	α-helix	trans	-61.8	-48.1	175.2	-68.2	163	0	0	0	110.9	A1017 Q1018 R1019 E1023 A1024 N1025 C1098 L1099 A1102	A1017-I1021 VanDerWaalsContact O-CG1 3.31Å; A1017-I1021 WeakPolarHBondContact O-CG1 3.14Å; A1017-I1021 PolarHBondContact O-N 2.95Å; Q1018-I1021 WeakPolarHBondContact O-CB 3.48Å; Q1018-I1021 PolarHBondContact O-N 3.14Å; R1019-I1021 VanDerWaalsContact C-N 3.33Å; I1021-E1023 VanDerWaalsContact C-N 3.35Å; I1021-E1023 PolarHBondContact O-N 2.83Å; I1021-A1024 PolarHBondContact O-N 2.89Å; I1021-N1025 PolarHBondContact O-N 2.88Å; I1021-N1025 VanDerWaalsContact O-N 3.12Å; I1021-N1025 PolarHBondContact O-ND2 3.22Å; I1021-C1098 HydrophobicContact CD1-CB 3.9Å; I1021-L1099 HydrophobicContact CD1-CB 4.28Å; I1021-L1099 HydrophobicContact CG1-CB 4.34Å; I1021-L1099 HydrophobicContact CG1-CD1 4Å; I1021-A1102 HydrophobicContact CB-CB 4.49Å; I1021-A1102 HydrophobicContact CG1-CB 4.25Å; I1021-A1102 HydrophobicContact CG2-CB 4.09Å
1022	E	91	Very high	90	Very high	136 Å²	136	54 Å²	54	64%	0.636	27%	0.265	S	S	*	.	H	α-helix	trans	-61.1	-42.9	176.9	-71.1	175.1	-178.4	0	0	112	Q1018 R1019 N1025 K1026	Q1018-E1022 WeakPolarHBondContact O-CG 3.25Å; Q1018-E1022 PolarHBondContact O-N 2.99Å; R1019-E1022 PolarHBondContact O-N 3.36Å; E1022-N1025 PolarHBondContact O-N 3.1Å; E1022-K1026 PolarHBondContact O-N 2.86Å; E1022-K1026 VanDerWaalsContact O-N 3.12Å
1023	E	90.1	Very high	89.9	Confident	54 Å²	54	52.7 Å²	52.7	25%	0.252	27%	0.271	S	S	.	.	H	α-helix	trans	-66	-38.8	176.8	-74.6	176.7	-165.2	0	0	112.3	R1019 I1020 I1021 K1026 Q1027 R1076	R1019-E1023 WeakPolarHBondContact CG-OE1 3.5Å; R1019-E1023 IonicContact CZ-OE1 3.84Å; R1019-E1023 IonicContact NH1-OE1 3.34Å; R1019-E1023 PolarHBondContact NH1-OE1 3.19Å; R1019-E1023 IonicContact NH1-OE2 2.69Å; R1019-E1023 PolarHBondContact NH1-OE2 2.9Å; R1019-E1023 WeakPolarHBondContact O-CB 3.36Å; R1019-E1023 VanDerWaalsContact O-CG 3.31Å; R1019-E1023 WeakPolarHBondContact O-CG 3.47Å; R1019-E1023 PolarHBondContact O-N 3.02Å; I1020-E1023 PolarHBondContact O-N 3.5Å; I1021-E1023 VanDerWaalsContact C-N 3.35Å; I1021-E1023 PolarHBondContact O-N 2.83Å; E1023-K1026 PolarHBondContact O-N 2.88Å; E1023-Q1027 WeakPolarHBondContact O-CB 3.44Å; E1023-Q1027 VanDerWaalsContact O-CG 3.27Å; E1023-Q1027 WeakPolarHBondContact O-CG 3.31Å; E1023-Q1027 PolarHBondContact O-N 2.72Å; E1023-R1076 IonicContact OE2-CZ 3.02Å; E1023-R1076 IonicContact OE2-NH1 2.89Å; E1023-R1076 PolarHBondContact OE2-NH1 2.8Å; E1023-R1076 IonicContact OE2-NH2 3.47Å; E1023-R1076 PolarHBondContact OE2-NH2 2.8Å
1024	A	88.7	Confident	89.8	Confident	2 Å²	2	53.7 Å²	53.7	2%	0.017	28%	0.278	C	S	.	.	H	α-helix	trans	-61.6	-45.8	177.2	0	0	0	0	0	111.3	I1020 I1021 K1026 Q1027 M1028 L1106	I1020-A1024 VanDerWaalsContact O-CB 3.31Å; I1020-A1024 WeakPolarHBondContact O-CB 3.26Å; I1020-A1024 PolarHBondContact O-N 2.82Å; I1021-A1024 PolarHBondContact O-N 2.89Å; A1024-K1026 PolarHBondContact O-N 2.88Å; A1024-Q1027 PolarHBondContact O-N 3.25Å; A1024-M1028 WeakPolarHBondContact O-CG 3.4Å; A1024-M1028 PolarHBondContact O-N 3.42Å; A1024-L1106 HydrophobicContact CB-CB 4.48Å; A1024-L1106 HydrophobicContact CB-CD2 3.93Å
1025	N	89.6	Confident	89.7	Confident	77 Å²	77	52 Å²	52	41%	0.412	27%	0.269	S	S	.	.	H	α-helix	trans	-60.3	-45.3	176.1	-69.8	-34.7	0	0	0	111.7	I1021 E1022 Q1027 M1028 E1029	I1021-N1025 PolarHBondContact O-N 2.88Å; I1021-N1025 VanDerWaalsContact O-N 3.12Å; I1021-N1025 PolarHBondContact O-ND2 3.22Å; E1022-N1025 PolarHBondContact O-N 3.1Å; N1025-Q1027 PolarHBondContact O-N 3.28Å; N1025-M1028 WeakPolarHBondContact O-CB 3.46Å; N1025-M1028 PolarHBondContact O-N 2.76Å; N1025-E1029 PolarHBondContact O-N 3.31Å
1026	K	90.5	Very high	89.6	Confident	128 Å²	128	53.4 Å²	53.4	56%	0.557	27%	0.272	S	S	*	.	H	α-helix	trans	-63.6	-41.1	176.6	-175.5	179.7	177.1	-179.6	0	112.6	E1022 E1023 A1024 M1028 E1029 D1030	E1022-K1026 PolarHBondContact O-N 2.86Å; E1022-K1026 VanDerWaalsContact O-N 3.12Å; E1023-K1026 PolarHBondContact O-N 2.88Å; A1024-K1026 PolarHBondContact O-N 2.88Å; K1026-M1028 VanDerWaalsContact C-N 3.28Å; K1026-M1028 PolarHBondContact O-N 3.13Å; K1026-E1029 PolarHBondContact O-N 3.48Å; K1026-D1030 PolarHBondContact O-N 2.88Å
1027	Q	90.3	Very high	89.5	Confident	27 Å²	27	57.4 Å²	57.4	13%	0.126	29%	0.287	C	S	.	.	H	α-helix	trans	-64.4	-33.7	177.2	-75.6	-179.7	-44.8	0	0	112	E1023 A1024 N1025 L1031 L1069 L1106	E1023-Q1027 WeakPolarHBondContact O-CB 3.44Å; E1023-Q1027 VanDerWaalsContact O-CG 3.27Å; E1023-Q1027 WeakPolarHBondContact O-CG 3.31Å; E1023-Q1027 PolarHBondContact O-N 2.72Å; A1024-Q1027 PolarHBondContact O-N 3.25Å; N1025-Q1027 PolarHBondContact O-N 3.28Å; Q1027-L1031 VanDerWaalsContact O-CB 3.24Å; Q1027-L1031 WeakPolarHBondContact O-CB 3.32Å; Q1027-L1031 PolarHBondContact O-N 2.69Å; Q1027-L1069 HydrophobicContact CG-CD2 4.38Å; Q1027-L1106 HydrophobicContact CB-CD1 3.85Å; Q1027-L1106 HydrophobicContact CB-CD2 4.48Å
1028	M	88	Confident	89.3	Confident	56 Å²	56	57.5 Å²	57.5	28%	0.276	29%	0.287	S	S	.	.	H	α-helix	trans	-63.7	-43.6	172.3	-70.4	175	59.2	0	0	111.8	A1024 N1025 K1026 L1031 A1032 L1105 L1106	A1024-M1028 WeakPolarHBondContact O-CG 3.4Å; A1024-M1028 PolarHBondContact O-N 3.42Å; N1025-M1028 WeakPolarHBondContact O-CB 3.46Å; N1025-M1028 PolarHBondContact O-N 2.76Å; K1026-M1028 VanDerWaalsContact C-N 3.28Å; K1026-M1028 PolarHBondContact O-N 3.13Å; M1028-L1031 PolarHBondContact O-N 3.14Å; M1028-A1032 PolarHBondContact O-N 2.9Å; M1028-A1032 VanDerWaalsContact O-N 3.08Å; M1028-L1105 HydrophobicContact CE-CB 4.17Å; M1028-L1105 HydrophobicContact SD-CB 4.06Å; M1028-L1106 HydrophobicContact CB-CD1 4.44Å; M1028-L1106 HydrophobicContact CG-CB 4.05Å; M1028-L1106 HydrophobicContact CG-CD1 3.48Å; M1028-L1106 VanDerWaalsContact CG-CD1 3.48Å; M1028-L1106 HydrophobicContact CG-CG 4.37Å; M1028-L1106 HydrophobicContact SD-CB 4.26Å
1029	E	89.6	Confident	89	Confident	139 Å²	139	54.7 Å²	54.7	65%	0.65	28%	0.276	S	S	*	.	H	α-helix	trans	-62.5	-47.4	176	-68	177	178.2	0	0	111.7	N1025 K1026 L1031 A1032 A1033	N1025-E1029 PolarHBondContact O-N 3.31Å; K1026-E1029 PolarHBondContact O-N 3.48Å; E1029-L1031 VanDerWaalsContact C-N 3.35Å; E1029-L1031 PolarHBondContact O-N 2.97Å; E1029-A1032 PolarHBondContact O-N 2.68Å; E1029-A1033 WeakPolarHBondContact O-CB 3.46Å; E1029-A1033 PolarHBondContact O-N 2.86Å
1030	D	88.3	Confident	88.7	Confident	50 Å²	50	53.5 Å²	53.5	27%	0.267	28%	0.278	S	S	.	.	H	α-helix	trans	-61.3	-41.9	178.2	-76.4	-14.1	0	0	0	111.6	K1026 A1033 C1034 L1069	K1026-D1030 PolarHBondContact O-N 2.88Å; D1030-A1033 PolarHBondContact O-N 3.02Å; D1030-C1034 WeakPolarHBondContact O-CB 3.45Å; D1030-C1034 PolarHBondContact O-N 2.82Å; D1030-C1034 PolarHBondContact O-SG 3.03Å; D1030-L1069 HydrophobicContact CB-CD1 4.25Å
1031	L	88.3	Confident	88.4	Confident	4 Å²	4	53.4 Å²	53.4	2%	0.021	28%	0.278	C	S	.	.	H	α-helix	trans	-61.7	-45.3	177.3	-176.8	76.1	0	0	0	111.2	Q1027 M1028 E1029 S1035 L1066 A1109 V1110 I1117	Q1027-L1031 VanDerWaalsContact O-CB 3.24Å; Q1027-L1031 WeakPolarHBondContact O-CB 3.32Å; Q1027-L1031 PolarHBondContact O-N 2.69Å; M1028-L1031 PolarHBondContact O-N 3.14Å; E1029-L1031 VanDerWaalsContact C-N 3.35Å; E1029-L1031 PolarHBondContact O-N 2.97Å; L1031-S1035 WeakPolarHBondContact O-CB 3.39Å; L1031-S1035 PolarHBondContact O-N 3.44Å; L1031-L1066 HydrophobicContact CD1-CD2 3.84Å; L1031-A1109 HydrophobicContact CD2-CB 4.17Å; L1031-V1110 HydrophobicContact CD2-CG2 3.91Å; L1031-I1117 HydrophobicContact CD1-CD1 4.31Å
1032	A	87.3	Confident	88	Confident	38 Å²	38	52.9 Å²	52.9	31%	0.314	27%	0.274	S	S	.	.	H	α-helix	trans	-63.1	-50	177.5	0	0	0	0	0	111.2	M1028 E1029 C1034 S1035 D1036	M1028-A1032 PolarHBondContact O-N 2.9Å; M1028-A1032 VanDerWaalsContact O-N 3.08Å; E1029-A1032 PolarHBondContact O-N 2.68Å; A1032-C1034 PolarHBondContact O-N 2.74Å; A1032-S1035 PolarHBondContact O-N 2.76Å; A1032-D1036 WeakPolarHBondContact O-CB 3.39Å; A1032-D1036 PolarHBondContact O-N 2.98Å
1033	A	89.5	Confident	87.5	Confident	63 Å²	63	52.8 Å²	52.8	52%	0.521	27%	0.273	S	S	.	.	H	α-helix	trans	-60.4	-45.1	-179.1	0	0	0	0	0	112.8	E1029 D1030 R1037	E1029-A1033 WeakPolarHBondContact O-CB 3.46Å; E1029-A1033 PolarHBondContact O-N 2.86Å; D1030-A1033 PolarHBondContact O-N 3.02Å; A1033-R1037 WeakPolarHBondContact O-CB 3.38Å; A1033-R1037 PolarHBondContact O-N 3.22Å; A1033-R1037 VanDerWaalsContact O-N 3.07Å
1034	C	88.9	Confident	87	Confident	22 Å²	22	52.4 Å²	52.4	15%	0.149	27%	0.271	C	S	.	.	H	α-helix	trans	-68.9	-42.2	179.5	-65.7	0	0	0	0	112	D1030 A1032 R1037 L1038 L1062 L1066	D1030-C1034 WeakPolarHBondContact O-CB 3.45Å; D1030-C1034 PolarHBondContact O-N 2.82Å; D1030-C1034 PolarHBondContact O-SG 3.03Å; A1032-C1034 PolarHBondContact O-N 2.74Å; C1034-R1037 PolarHBondContact O-N 3.36Å; C1034-L1038 WeakPolarHBondContact O-CB 3.37Å; C1034-L1038 PolarHBondContact O-N 2.86Å; C1034-L1062 HydrophobicContact CB-CD2 4.13Å; C1034-L1066 HydrophobicContact CB-CD1 4.3Å; C1034-L1066 HydrophobicContact CB-CD2 3.58Å; C1034-L1066 HydrophobicContact CB-CG 3.88Å
1035	S	88.3	Confident	86.3	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.007	27%	0.273	C	S	.	.	H	α-helix	trans	-63.9	-43.7	178.1	176.7	0	0	0	0	111.9	L1031 A1032 L1038 N1039	L1031-S1035 WeakPolarHBondContact O-CB 3.39Å; L1031-S1035 PolarHBondContact O-N 3.44Å; A1032-S1035 PolarHBondContact O-N 2.76Å; S1035-L1038 PolarHBondContact O-N 2.65Å; S1035-N1039 PolarHBondContact O-N 3.45Å; S1035-N1039 VanDerWaalsContact O-N 3.08Å; S1035-N1039 PolarHBondContact O-ND2 2.82Å
1036	D	88.2	Confident	85.5	Confident	81 Å²	81	52.8 Å²	52.8	43%	0.433	27%	0.272	S	S	.	.	H	α-helix	trans	-68.7	-39	-179.3	-65.6	-12.2	0	0	0	110.8	A1032 N1039 V1040 K1113	A1032-D1036 WeakPolarHBondContact O-CB 3.39Å; A1032-D1036 PolarHBondContact O-N 2.98Å; D1036-N1039 PolarHBondContact O-N 3.16Å; D1036-V1040 WeakPolarHBondContact O-CG2 3.49Å; D1036-V1040 PolarHBondContact O-N 3.19Å; D1036-V1040 VanDerWaalsContact O-N 3.12Å; D1036-K1113 IonicContact OD1-NZ 3.85Å; D1036-K1113 PolarHBondContact OD1-NZ 2.98Å
1037	R	89.4	Confident	84.8	Confident	91 Å²	91	53 Å²	53	34%	0.343	28%	0.279	S	S	.	.	H	α-helix	trans	-63.1	-42.4	173.6	-176.9	61	178.4	158.5	5.3	112.5	A1033 C1034 N1039 V1040 I1041 E1058 L1062	A1033-R1037 WeakPolarHBondContact O-CB 3.38Å; A1033-R1037 PolarHBondContact O-N 3.22Å; A1033-R1037 VanDerWaalsContact O-N 3.07Å; C1034-R1037 PolarHBondContact O-N 3.36Å; R1037-N1039 VanDerWaalsContact C-N 3.31Å; R1037-N1039 PolarHBondContact O-N 3.16Å; R1037-V1040 PolarHBondContact O-N 2.85Å; R1037-I1041 HydrophobicContact CG-CD1 4.29Å; R1037-I1041 WeakPolarHBondContact O-CG1 3.39Å; R1037-I1041 PolarHBondContact O-N 2.96Å; R1037-I1041 VanDerWaalsContact O-N 3.1Å; R1037-E1058 IonicContact CZ-OE1 2.68Å; R1037-E1058 IonicContact CZ-OE2 3.57Å; R1037-E1058 IonicContact NE-OE1 3.85Å; R1037-E1058 PolarHBondContact NE-OE1 3.48Å; R1037-E1058 VanDerWaalsContact NH2-CD 3.32Å; R1037-E1058 IonicContact NH2-OE1 3.63Å; R1037-E1058 PolarHBondContact NH2-OE1 3.41Å; R1037-E1058 IonicContact NH2-OE2 3.51Å; R1037-E1058 PolarHBondContact NH2-OE2 3.22Å; R1037-L1062 HydrophobicContact CB-CD1 4.18Å; R1037-L1062 HydrophobicContact CG-CD1 3.68Å; R1037-L1062 HydrophobicContact CG-CD2 4.44Å
1038	L	86.4	Confident	83.4	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.01	30%	0.3	C	S	.	.	H	α-helix	trans	-61.3	-40.4	176.8	-178.5	66.1	0	0	0	111.6	C1034 S1035 I1041 R1042 D1059 L1062 L1063 L1066 I1117	C1034-L1038 WeakPolarHBondContact O-CB 3.37Å; C1034-L1038 PolarHBondContact O-N 2.86Å; S1035-L1038 PolarHBondContact O-N 2.65Å; L1038-I1041 PolarHBondContact O-N 3.4Å; L1038-R1042 WeakPolarHBondContact O-CG 3.36Å; L1038-R1042 PolarHBondContact O-N 3.19Å; L1038-D1059 HydrophobicContact CD1-CB 4.24Å; L1038-L1062 HydrophobicContact CB-CD1 4.42Å; L1038-L1062 HydrophobicContact CD1-CB 4.41Å; L1038-L1063 HydrophobicContact CD1-CG 4.31Å; L1038-L1063 HydrophobicContact CD2-CD2 3.75Å; L1038-L1063 HydrophobicContact CD2-CG 4.31Å; L1038-L1066 HydrophobicContact CD2-CD1 3.96Å; L1038-I1117 HydrophobicContact CD2-CG2 4.03Å
1039	N	85.6	Confident	81.7	Confident	52 Å²	52	64.6 Å²	64.6	28%	0.278	33%	0.327	S	S	.	.	H	α-helix	trans	-63.8	-40.9	176.3	-75.9	-28	0	0	0	112.5	S1035 D1036 R1037 R1042 Q1043 V1116	S1035-N1039 PolarHBondContact O-N 3.45Å; S1035-N1039 VanDerWaalsContact O-N 3.08Å; S1035-N1039 PolarHBondContact O-ND2 2.82Å; D1036-N1039 PolarHBondContact O-N 3.16Å; R1037-N1039 VanDerWaalsContact C-N 3.31Å; R1037-N1039 PolarHBondContact O-N 3.16Å; N1039-R1042 PolarHBondContact O-N 3.12Å; N1039-Q1043 PolarHBondContact O-N 2.97Å; N1039-V1116 WeakPolarHBondContact ND2-CG1 3.22Å; N1039-V1116 WeakPolarHBondContact OD1-CG1 3.33Å
1040	V	85.6	Confident	79.9	Confident	63 Å²	63	61.1 Å²	61.1	38%	0.382	33%	0.328	S	S	.	.	H	α-helix	trans	-59.9	-46.9	174.8	172.8	0	0	0	0	110.8	D1036 R1037 R1042 Q1043 E1044	D1036-V1040 WeakPolarHBondContact O-CG2 3.49Å; D1036-V1040 PolarHBondContact O-N 3.19Å; D1036-V1040 VanDerWaalsContact O-N 3.12Å; R1037-V1040 PolarHBondContact O-N 2.85Å; V1040-R1042 VanDerWaalsContact C-N 3.34Å; V1040-R1042 PolarHBondContact O-N 3.22Å; V1040-Q1043 PolarHBondContact O-N 2.97Å; V1040-E1044 HydrophobicContact CG1-CG 4.45Å; V1040-E1044 WeakPolarHBondContact O-CG 3.47Å; V1040-E1044 PolarHBondContact O-N 3.28Å
1041	I	82.9	Confident	77.9	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.005	36%	0.357	C	S	.	.	H	α-helix	trans	-62.7	-41.2	178.8	-64.7	167.7	0	0	0	111.3	R1037 L1038 Q1043 E1044 K1045 E1058 D1059 L1062	R1037-I1041 HydrophobicContact CG-CD1 4.29Å; R1037-I1041 WeakPolarHBondContact O-CG1 3.39Å; R1037-I1041 PolarHBondContact O-N 2.96Å; R1037-I1041 VanDerWaalsContact O-N 3.1Å; L1038-I1041 PolarHBondContact O-N 3.4Å; I1041-Q1043 VanDerWaalsContact C-N 3.33Å; I1041-Q1043 PolarHBondContact O-N 3.42Å; I1041-E1044 PolarHBondContact O-N 3.31Å; I1041-K1045 WeakPolarHBondContact O-CB 3.3Å; I1041-K1045 WeakPolarHBondContact O-CG 3.46Å; I1041-K1045 PolarHBondContact O-N 3.09Å; I1041-E1058 HydrophobicContact CD1-CB 4.08Å; I1041-E1058 HydrophobicContact CD1-CG 3.71Å; I1041-D1059 HydrophobicContact CG2-CB 4.23Å; I1041-L1062 HydrophobicContact CD1-CD1 3.58Å
1042	R	80.7	Confident	76.2	Confident	24 Å²	24	68.5 Å²	68.5	9%	0.091	37%	0.366	C	S	.	.	H	α-helix	trans	-64.1	-34.7	176.3	-77.2	178	172.9	165.4	0.2	113	L1038 N1039 V1040 L1046 V1116 I1117	L1038-R1042 WeakPolarHBondContact O-CG 3.36Å; L1038-R1042 PolarHBondContact O-N 3.19Å; N1039-R1042 PolarHBondContact O-N 3.12Å; V1040-R1042 VanDerWaalsContact C-N 3.34Å; V1040-R1042 PolarHBondContact O-N 3.22Å; R1042-L1046 WeakPolarHBondContact O-CG 3.46Å; R1042-L1046 PolarHBondContact O-N 3.22Å; R1042-V1116 PolarHBondContact NH1-O 3.25Å; R1042-I1117 VanDerWaalsContact CZ-O 3.28Å; R1042-I1117 PolarHBondContact NH1-O 3.36Å; R1042-I1117 PolarHBondContact NH2-O 3.22Å
1043	Q	81	Confident	74.4	Confident	133 Å²	133	72.4 Å²	72.4	62%	0.621	39%	0.389	S	S	*	.	H	α-helix	trans	-71.9	-45.4	173.1	-75.7	-164.1	-16.3	0	0	111.8	N1039 V1040 I1041 K1045 L1046 D1047	N1039-Q1043 PolarHBondContact O-N 2.97Å; V1040-Q1043 PolarHBondContact O-N 2.97Å; I1041-Q1043 VanDerWaalsContact C-N 3.33Å; I1041-Q1043 PolarHBondContact O-N 3.42Å; Q1043-K1045 PolarHBondContact O-N 2.96Å; Q1043-L1046 WeakPolarHBondContact O-CB 3.38Å; Q1043-L1046 PolarHBondContact O-N 3.47Å; Q1043-D1047 PolarHBondContact O-N 2.93Å
1044	E	79.4	Confident	72.8	Confident	47 Å²	47	72.6 Å²	72.6	22%	0.22	40%	0.397	C	S	.	.	H	α-helix	trans	-58.1	-37.1	176.5	-72.8	-175.6	179.8	0	0	112.2	V1040 I1041 R1048 F1052 Y1055	V1040-E1044 HydrophobicContact CG1-CG 4.45Å; V1040-E1044 WeakPolarHBondContact O-CG 3.47Å; V1040-E1044 PolarHBondContact O-N 3.28Å; I1041-E1044 PolarHBondContact O-N 3.31Å; E1044-R1048 PolarHBondContact O-N 3.25Å; E1044-F1052 WeakPolarHBondContact O-CZ 3.31Å; E1044-Y1055 PolarHBondContact OE2-OH 2.8Å
1045	K	74.1	Confident	71.4	Confident	10 Å²	10	74.4 Å²	74.4	4%	0.043	40%	0.401	C	S	.	.	H	α-helix	trans	-67.3	-31.8	174.1	-80.8	-172.1	167.4	-169.4	0	113.9	I1041 Q1043 F1052 D1059 L1127 T1129	I1041-K1045 WeakPolarHBondContact O-CB 3.3Å; I1041-K1045 WeakPolarHBondContact O-CG 3.46Å; I1041-K1045 PolarHBondContact O-N 3.09Å; Q1043-K1045 PolarHBondContact O-N 2.96Å; K1045-F1052 HydrophobicContact CB-CZ 4.44Å; K1045-F1052 HydrophobicContact CG-CD1 4.4Å; K1045-F1052 HydrophobicContact CG-CE1 4.03Å; K1045-F1052 HydrophobicContact CG-CE2 4.23Å; K1045-F1052 HydrophobicContact CG-CZ 3.94Å; K1045-D1059 IonicContact NZ-OD2 2.8Å; K1045-D1059 PolarHBondContact NZ-OD2 2.98Å; K1045-L1127 PolarHBondContact NZ-O 3.36Å; K1045-T1129 PolarHBondContact NZ-OG1 2.91Å
1046	L	73.7	Confident	69.8	Low	76 Å²	76	74.8 Å²	74.8	40%	0.398	41%	0.405	S	S	.	.	H	α-helix	trans	-72.8	-39.9	175.4	-76.4	171.1	0	0	0	111.7	R1042 Q1043 Q1126	R1042-L1046 WeakPolarHBondContact O-CG 3.46Å; R1042-L1046 PolarHBondContact O-N 3.22Å; Q1043-L1046 WeakPolarHBondContact O-CB 3.38Å; Q1043-L1046 PolarHBondContact O-N 3.47Å; L1046-Q1126 HydrophobicContact CD2-CG 3.85Å; L1046-Q1126 HydrophobicContact CG-CG 3.94Å
1047	D	75.4	Confident	68.8	Low	132 Å²	132	77.8 Å²	77.8	71%	0.706	41%	0.411	S	S	*	.	H	α-helix	trans	-74.4	-28.8	-174.4	-69.6	-18.1	0	0	0	113.4	Q1043	Q1043-D1047 PolarHBondContact O-N 2.93Å
1048	R	61.8	Low	68.2	Low	148 Å²	148	76.6 Å²	76.6	56%	0.558	41%	0.409	S	S	*	.	S	Bend	trans	-110.3	86.8	-175.8	-65.5	-179.9	-175.1	160.5	5.4	111.3	E1044 G1050 F1052	E1044-R1048 PolarHBondContact O-N 3.25Å; R1048-G1050 PolarHBondContact O-N 3.47Å; R1048-G1050 VanDerWaalsContact O-N 3.07Å; R1048-F1052 HydrophobicContact CB-CE2 3.74Å; R1048-F1052 HydrophobicContact CB-CZ 4.2Å
1049	Q	52.3	Low	67.8	Low	180 Å²	180	76.8 Å²	76.8	84%	0.841	41%	0.411	S	S	*	.			trans	-65.6	100.6	171.2	-67.3	-177.5	-8.4	0	0	110.9
1050	G	50.9	Low	67.4	Low	66 Å²	66	75.8 Å²	75.8	68%	0.68	41%	0.405	S	S	*	.	S	Bend	trans	128.1	0.9	147.7	0	0	0	0	0	122	R1048	R1048-G1050 PolarHBondContact O-N 3.47Å; R1048-G1050 VanDerWaalsContact O-N 3.07Å
1051	D	47	Very low	67.2	Low	165 Å²	165	75.6 Å²	75.6	88%	0.882	41%	0.41	S	S	*	.			trans	-156	99.4	173	-99.2	-31.7	0	0	0	112
1052	F	51.7	Low	67.3	Low	44 Å²	44	76.6 Å²	76.6	19%	0.193	42%	0.415	C	S	.	.			trans	-123.7	85.5	-178.6	-96.2	-90.4	0	0	0	112	E1044 K1045 R1048 Y1055	E1044-F1052 WeakPolarHBondContact O-CZ 3.31Å; K1045-F1052 HydrophobicContact CB-CZ 4.44Å; K1045-F1052 HydrophobicContact CG-CD1 4.4Å; K1045-F1052 HydrophobicContact CG-CE1 4.03Å; K1045-F1052 HydrophobicContact CG-CE2 4.23Å; K1045-F1052 HydrophobicContact CG-CZ 3.94Å; R1048-F1052 HydrophobicContact CB-CE2 3.74Å; R1048-F1052 HydrophobicContact CB-CZ 4.2Å; F1052-Y1055 AromaticContact CD1-CD2 3.63Å; F1052-Y1055 HydrophobicContact CD1-CD2 3.63Å; F1052-Y1055 HydrophobicContact CD1-CE2 4.33Å; F1052-Y1055 HydrophobicContact CD1-CG 4.5Å; F1052-Y1055 AromaticContact CE1-CD2 3.46Å; F1052-Y1055 HydrophobicContact CE1-CD2 3.46Å; F1052-Y1055 VanDerWaalsContact CE1-CD2 3.46Å; F1052-Y1055 AromaticContact CE1-CE2 3.8Å; F1052-Y1055 HydrophobicContact CE1-CE2 3.8Å; F1052-Y1055 HydrophobicContact CE1-CG 4.4Å
1053	C	50.4	Low	67.6	Low	119 Å²	119	75.6 Å²	75.6	80%	0.804	41%	0.411	S	S	*	.			trans	-97.3	-10.5	163.2	-86.5	0	0	0	0	113.4
1054	G	55.9	Low	67.7	Low	68 Å²	68	72.8 Å²	72.8	70%	0.701	40%	0.401	S	S	*	.	S	Bend	trans	-83.6	-18.2	-169	0	0	0	0	0	117
1055	Y	58.5	Low	68	Low	59 Å²	59	76.5 Å²	76.5	23%	0.231	41%	0.413	C	S	.	.	S	Bend	trans	-131	17.6	-170.6	-58.3	-90.8	0	0	0	113	E1044 F1052 Y1057 E1058	E1044-Y1055 PolarHBondContact OE2-OH 2.8Å; F1052-Y1055 AromaticContact CD1-CD2 3.63Å; F1052-Y1055 HydrophobicContact CD1-CD2 3.63Å; F1052-Y1055 HydrophobicContact CD1-CE2 4.33Å; F1052-Y1055 HydrophobicContact CD1-CG 4.5Å; F1052-Y1055 AromaticContact CE1-CD2 3.46Å; F1052-Y1055 HydrophobicContact CE1-CD2 3.46Å; F1052-Y1055 VanDerWaalsContact CE1-CD2 3.46Å; F1052-Y1055 AromaticContact CE1-CE2 3.8Å; F1052-Y1055 HydrophobicContact CE1-CE2 3.8Å; F1052-Y1055 HydrophobicContact CE1-CG 4.4Å; Y1055-Y1057 PolarHBondContact O-N 3.25Å; Y1055-E1058 WeakPolarHBondContact CD1-OE2 3.43Å; Y1055-E1058 PolarHBondContact O-N 3.29Å; Y1055-E1058 VanDerWaalsContact O-N 3.08Å
1056	A	55.2	Low	68.7	Low	9 Å²	9	76 Å²	76	7%	0.074	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-4.3	-161.1	0	0	0	0	0	116.5
1057	Y	66.4	Low	69.3	Low	144 Å²	144	73.2 Å²	73.2	57%	0.565	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.7	-6	178	-55.2	-76.2	0	0	0	113.9	Y1055 A1061	Y1055-Y1057 PolarHBondContact O-N 3.25Å; Y1057-A1061 VanDerWaalsContact O-CB 3.24Å; Y1057-A1061 WeakPolarHBondContact O-CB 3.44Å; Y1057-A1061 PolarHBondContact O-N 3.4Å
1058	E	78.4	Confident	69.8	Low	66 Å²	66	71.9 Å²	71.9	31%	0.308	39%	0.39	S	S	.	.	H	α-helix	trans	-73.2	-39.2	-172.5	-166.9	-179.9	173.4	0	0	111.2	R1037 I1041 Y1055 L1062	R1037-E1058 IonicContact CZ-OE1 2.68Å; R1037-E1058 IonicContact CZ-OE2 3.57Å; R1037-E1058 IonicContact NE-OE1 3.85Å; R1037-E1058 PolarHBondContact NE-OE1 3.48Å; R1037-E1058 VanDerWaalsContact NH2-CD 3.32Å; R1037-E1058 IonicContact NH2-OE1 3.63Å; R1037-E1058 PolarHBondContact NH2-OE1 3.41Å; R1037-E1058 IonicContact NH2-OE2 3.51Å; R1037-E1058 PolarHBondContact NH2-OE2 3.22Å; I1041-E1058 HydrophobicContact CD1-CB 4.08Å; I1041-E1058 HydrophobicContact CD1-CG 3.71Å; Y1055-E1058 WeakPolarHBondContact CD1-OE2 3.43Å; Y1055-E1058 PolarHBondContact O-N 3.29Å; Y1055-E1058 VanDerWaalsContact O-N 3.08Å; E1058-L1062 HydrophobicContact CG-CD1 4.16Å; E1058-L1062 WeakPolarHBondContact O-CB 3.36Å; E1058-L1062 WeakPolarHBondContact O-CD1 3.09Å; E1058-L1062 WeakPolarHBondContact O-CG 3.44Å; E1058-L1062 PolarHBondContact O-N 2.82Å
1059	D	77.5	Confident	71	Confident	7 Å²	7	65.3 Å²	65.3	4%	0.037	37%	0.366	C	S	.	.	H	α-helix	trans	-67	-42.1	176.2	55.2	-5.4	0	0	0	112.8	L1038 I1041 K1045 L1062 L1063 P1128	L1038-D1059 HydrophobicContact CD1-CB 4.24Å; I1041-D1059 HydrophobicContact CG2-CB 4.23Å; K1045-D1059 IonicContact NZ-OD2 2.8Å; K1045-D1059 PolarHBondContact NZ-OD2 2.98Å; D1059-L1062 PolarHBondContact O-N 3.31Å; D1059-L1063 WeakPolarHBondContact O-CB 3.33Å; D1059-L1063 VanDerWaalsContact O-CG 3.32Å; D1059-L1063 WeakPolarHBondContact O-CG 3.39Å; D1059-L1063 PolarHBondContact O-N 3.27Å; D1059-P1128 VanDerWaalsContact OD2-CA 3.3Å; D1059-P1128 WeakPolarHBondContact OD2-CA 3.43Å
1060	I	76.9	Confident	72.7	Confident	30 Å²	30	56.9 Å²	56.9	15%	0.154	33%	0.327	C	S	.	.	H	α-helix	trans	-62.8	-48.5	174.6	-58.2	-179.4	0	0	0	110.4	L1062 L1063 D1064 P1128 V1130	I1060-L1062 VanDerWaalsContact C-N 3.29Å; I1060-L1062 PolarHBondContact O-N 3.43Å; I1060-L1063 PolarHBondContact O-N 2.98Å; I1060-L1063 VanDerWaalsContact O-N 3.15Å; I1060-D1064 PolarHBondContact O-N 3.34Å; I1060-P1128 HydrophobicContact CD1-CB 3.76Å; I1060-P1128 HydrophobicContact CG1-CB 3.4Å; I1060-P1128 VanDerWaalsContact CG1-CB 3.4Å; I1060-P1128 HydrophobicContact CG1-CG 4.14Å; I1060-V1130 HydrophobicContact CD1-CG2 3.69Å
1061	A	80.4	Confident	74.3	Confident	59 Å²	59	56.2 Å²	56.2	49%	0.488	31%	0.307	S	S	.	.	H	α-helix	trans	-62	-36.6	180	0	0	0	0	0	112.5	Y1057 R1065	Y1057-A1061 VanDerWaalsContact O-CB 3.24Å; Y1057-A1061 WeakPolarHBondContact O-CB 3.44Å; Y1057-A1061 PolarHBondContact O-N 3.4Å; A1061-R1065 VanDerWaalsContact O-CB 3.28Å; A1061-R1065 WeakPolarHBondContact O-CB 3.47Å; A1061-R1065 PolarHBondContact O-N 2.92Å
1062	L	86.8	Confident	76	Confident	22 Å²	22	49.4 Å²	49.4	12%	0.115	28%	0.276	C	S	.	.	H	α-helix	trans	-68.4	-42	174.3	-73.7	167.1	0	0	0	111.9	C1034 R1037 L1038 I1041 E1058 D1059 I1060 R1065 L1066	C1034-L1062 HydrophobicContact CB-CD2 4.13Å; R1037-L1062 HydrophobicContact CB-CD1 4.18Å; R1037-L1062 HydrophobicContact CG-CD1 3.68Å; R1037-L1062 HydrophobicContact CG-CD2 4.44Å; L1038-L1062 HydrophobicContact CB-CD1 4.42Å; L1038-L1062 HydrophobicContact CD1-CB 4.41Å; I1041-L1062 HydrophobicContact CD1-CD1 3.58Å; E1058-L1062 HydrophobicContact CG-CD1 4.16Å; E1058-L1062 WeakPolarHBondContact O-CB 3.36Å; E1058-L1062 WeakPolarHBondContact O-CD1 3.09Å; E1058-L1062 WeakPolarHBondContact O-CG 3.44Å; E1058-L1062 PolarHBondContact O-N 2.82Å; D1059-L1062 PolarHBondContact O-N 3.31Å; I1060-L1062 VanDerWaalsContact C-N 3.29Å; I1060-L1062 PolarHBondContact O-N 3.43Å; L1062-R1065 PolarHBondContact O-N 2.8Å; L1062-L1066 WeakPolarHBondContact O-CB 3.23Å; L1062-L1066 WeakPolarHBondContact O-CD1 3.29Å; L1062-L1066 WeakPolarHBondContact O-CG 3.42Å; L1062-L1066 PolarHBondContact O-N 2.83Å
1063	L	85.8	Confident	77.7	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.016	27%	0.267	C	S	.	.	H	α-helix	trans	-63.6	-43.4	176.1	-75.8	169.8	0	0	0	111.9	L1038 D1059 I1060 R1065 L1066 S1067 I1117 P1128 L1154	L1038-L1063 HydrophobicContact CD1-CG 4.31Å; L1038-L1063 HydrophobicContact CD2-CD2 3.75Å; L1038-L1063 HydrophobicContact CD2-CG 4.31Å; D1059-L1063 WeakPolarHBondContact O-CB 3.33Å; D1059-L1063 VanDerWaalsContact O-CG 3.32Å; D1059-L1063 WeakPolarHBondContact O-CG 3.39Å; D1059-L1063 PolarHBondContact O-N 3.27Å; I1060-L1063 PolarHBondContact O-N 2.98Å; I1060-L1063 VanDerWaalsContact O-N 3.15Å; L1063-R1065 VanDerWaalsContact C-N 3.35Å; L1063-L1066 PolarHBondContact O-N 3.25Å; L1063-S1067 WeakPolarHBondContact O-CB 3.18Å; L1063-S1067 PolarHBondContact O-N 3.27Å; L1063-I1117 HydrophobicContact CD2-CG2 4.02Å; L1063-P1128 HydrophobicContact CD1-CG 4.33Å; L1063-L1154 HydrophobicContact CD1-CD2 3.86Å
1064	D	82.5	Confident	79.2	Confident	74 Å²	74	42.9 Å²	42.9	40%	0.396	24%	0.235	S	C	.	.	H	α-helix	trans	-61	-45.5	174.7	-75.4	-22.5	0	0	0	110.8	I1060 L1066 S1067 D1068 S1153	I1060-D1064 PolarHBondContact O-N 3.34Å; D1064-L1066 VanDerWaalsContact C-N 3.35Å; D1064-L1066 PolarHBondContact O-N 2.9Å; D1064-S1067 WeakPolarHBondContact O-CB 3.38Å; D1064-S1067 PolarHBondContact O-N 2.91Å; D1064-D1068 PolarHBondContact O-N 3.02Å; D1064-S1153 WeakPolarHBondContact OD1-CB 3.47Å
1065	R	86.8	Confident	80.5	Confident	125 Å²	125	48.7 Å²	48.7	47%	0.472	24%	0.235	S	C	.	.	H	α-helix	trans	-62.7	-41.3	178.3	-175.1	59.2	179	177.1	3.8	112.5	A1061 L1062 L1063 L1069	A1061-R1065 VanDerWaalsContact O-CB 3.28Å; A1061-R1065 WeakPolarHBondContact O-CB 3.47Å; A1061-R1065 PolarHBondContact O-N 2.92Å; L1062-R1065 PolarHBondContact O-N 2.8Å; L1063-R1065 VanDerWaalsContact C-N 3.35Å; R1065-L1069 WeakPolarHBondContact O-CG 3.48Å; R1065-L1069 PolarHBondContact O-N 2.98Å
1066	L	89.1	Confident	81.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-67.7	-40.6	177.1	-73.9	167.2	0	0	0	111.3	L1031 C1034 L1038 L1062 L1063 D1064 L1069 V1070 I1117 W1118	L1031-L1066 HydrophobicContact CD1-CD2 3.84Å; C1034-L1066 HydrophobicContact CB-CD1 4.3Å; C1034-L1066 HydrophobicContact CB-CD2 3.58Å; C1034-L1066 HydrophobicContact CB-CG 3.88Å; L1038-L1066 HydrophobicContact CD2-CD1 3.96Å; L1062-L1066 WeakPolarHBondContact O-CB 3.23Å; L1062-L1066 WeakPolarHBondContact O-CD1 3.29Å; L1062-L1066 WeakPolarHBondContact O-CG 3.42Å; L1062-L1066 PolarHBondContact O-N 2.83Å; L1063-L1066 PolarHBondContact O-N 3.25Å; D1064-L1066 VanDerWaalsContact C-N 3.35Å; D1064-L1066 PolarHBondContact O-N 2.9Å; L1066-L1069 PolarHBondContact O-N 3.35Å; L1066-V1070 VanDerWaalsContact O-CG2 3.32Å; L1066-V1070 WeakPolarHBondContact O-CG2 3.41Å; L1066-V1070 PolarHBondContact O-N 3.32Å; L1066-I1117 HydrophobicContact CB-CD1 4.49Å; L1066-I1117 HydrophobicContact CB-CG2 4.26Å; L1066-I1117 HydrophobicContact CD1-CB 4.5Å; L1066-I1117 HydrophobicContact CD1-CD1 4.06Å; L1066-I1117 HydrophobicContact CD1-CG1 4.01Å; L1066-I1117 HydrophobicContact CD1-CG2 3.65Å; L1066-I1117 HydrophobicContact CD2-CD1 3.87Å; L1066-I1117 HydrophobicContact CG-CD1 4.37Å; L1066-W1118 HydrophobicContact CB-CH2 4.06Å
1067	S	86.2	Confident	83.3	Confident	18 Å²	18	48.4 Å²	48.4	13%	0.126	23%	0.232	C	C	.	.	H	α-helix	trans	-59.8	-47.1	174.1	-174.5	0	0	0	0	111.5	L1063 D1064 L1069 V1070 L1071	L1063-S1067 WeakPolarHBondContact O-CB 3.18Å; L1063-S1067 PolarHBondContact O-N 3.27Å; D1064-S1067 WeakPolarHBondContact O-CB 3.38Å; D1064-S1067 PolarHBondContact O-N 2.91Å; S1067-L1069 VanDerWaalsContact C-N 3.35Å; S1067-L1069 PolarHBondContact O-N 3.48Å; S1067-V1070 PolarHBondContact O-N 3.36Å; S1067-L1071 WeakPolarHBondContact O-CB 3.46Å; S1067-L1071 WeakPolarHBondContact O-CG 3.42Å; S1067-L1071 PolarHBondContact O-N 3.43Å
1068	D	85.9	Confident	84.1	Confident	103 Å²	103	46.5 Å²	46.5	55%	0.551	23%	0.229	S	C	*	.	H	α-helix	trans	-60.8	-41	176.8	-81.4	-17.5	0	0	0	112.8	D1064 G1072	D1064-D1068 PolarHBondContact O-N 3.02Å; D1068-G1072 PolarHBondContact O-N 2.85Å
1069	L	87.1	Confident	84.4	Confident	11 Å²	11	46.4 Å²	46.4	6%	0.058	23%	0.228	C	C	.	.	H	α-helix	trans	-63.3	-49.8	176.1	-76.2	171	0	0	0	111.1	Q1027 D1030 R1065 L1066 S1067 G1072 I1073	Q1027-L1069 HydrophobicContact CG-CD2 4.38Å; D1030-L1069 HydrophobicContact CB-CD1 4.25Å; R1065-L1069 WeakPolarHBondContact O-CG 3.48Å; R1065-L1069 PolarHBondContact O-N 2.98Å; L1066-L1069 PolarHBondContact O-N 3.35Å; S1067-L1069 VanDerWaalsContact C-N 3.35Å; S1067-L1069 PolarHBondContact O-N 3.48Å; L1069-G1072 PolarHBondContact O-N 3.46Å; L1069-I1073 WeakPolarHBondContact O-CD1 3.28Å; L1069-I1073 VanDerWaalsContact O-CG1 3.22Å; L1069-I1073 WeakPolarHBondContact O-CG1 3.27Å; L1069-I1073 PolarHBondContact O-N 2.82Å
1070	V	86.5	Confident	85	Confident	2 Å²	2	46 Å²	46	1%	0.012	23%	0.226	C	C	.	.	H	α-helix	trans	-61.6	-48.3	-179.8	172.5	0	0	0	0	111	L1066 S1067 G1072 I1073 E1074 V1110 W1118 P1157	L1066-V1070 VanDerWaalsContact O-CG2 3.32Å; L1066-V1070 WeakPolarHBondContact O-CG2 3.41Å; L1066-V1070 PolarHBondContact O-N 3.32Å; S1067-V1070 PolarHBondContact O-N 3.36Å; V1070-G1072 VanDerWaalsContact C-N 3.31Å; V1070-G1072 PolarHBondContact O-N 3.35Å; V1070-I1073 PolarHBondContact O-N 3.1Å; V1070-E1074 WeakPolarHBondContact O-CG 3.35Å; V1070-E1074 PolarHBondContact O-N 2.81Å; V1070-V1110 HydrophobicContact CG1-CG1 4.18Å; V1070-V1110 HydrophobicContact CG2-CG1 3.96Å; V1070-W1118 HydrophobicContact CG2-CH2 4.38Å; V1070-W1118 HydrophobicContact CG2-CZ3 4.28Å; V1070-P1157 HydrophobicContact CB-CG 4.44Å; V1070-P1157 HydrophobicContact CG1-CB 4.27Å; V1070-P1157 HydrophobicContact CG1-CG 4.28Å
1071	L	84.5	Confident	85.5	Confident	52 Å²	52	45.1 Å²	45.1	27%	0.272	22%	0.223	S	C	.	.	H	α-helix	trans	-64.1	-35.9	177.4	-71.6	173.3	0	0	0	112.3	S1067 R1075 P1157	S1067-L1071 WeakPolarHBondContact O-CB 3.46Å; S1067-L1071 WeakPolarHBondContact O-CG 3.42Å; S1067-L1071 PolarHBondContact O-N 3.43Å; L1071-R1075 VanDerWaalsContact O-CG 3.29Å; L1071-R1075 WeakPolarHBondContact O-CG 3.46Å; L1071-R1075 PolarHBondContact O-N 3.41Å; L1071-R1075 VanDerWaalsContact O-N 3.08Å; L1071-P1157 HydrophobicContact CD2-CB 3.83Å; L1071-P1157 HydrophobicContact CG-CB 3.95Å
1072	G	84.6	Confident	85.8	Confident	22 Å²	22	45.3 Å²	45.3	23%	0.227	21%	0.214	C	C	.	.	H	α-helix	trans	-63.5	-42.1	174.9	0	0	0	0	0	112.6	D1068 L1069 V1070 R1075 R1076	D1068-G1072 PolarHBondContact O-N 2.85Å; L1069-G1072 PolarHBondContact O-N 3.46Å; V1070-G1072 VanDerWaalsContact C-N 3.31Å; V1070-G1072 PolarHBondContact O-N 3.35Å; G1072-R1075 PolarHBondContact O-N 3.37Å; G1072-R1076 WeakPolarHBondContact O-CG 3.45Å; G1072-R1076 PolarHBondContact O-N 3.29Å
1073	I	86.2	Confident	86	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-67.6	-43.7	177.6	-65.6	163	0	0	0	110.7	L1069 V1070 R1075 R1076 F1103 L1106 K1107 V1110	L1069-I1073 WeakPolarHBondContact O-CD1 3.28Å; L1069-I1073 VanDerWaalsContact O-CG1 3.22Å; L1069-I1073 WeakPolarHBondContact O-CG1 3.27Å; L1069-I1073 PolarHBondContact O-N 2.82Å; V1070-I1073 PolarHBondContact O-N 3.1Å; I1073-R1075 VanDerWaalsContact C-N 3.33Å; I1073-R1075 PolarHBondContact O-N 3.49Å; I1073-R1076 PolarHBondContact O-N 2.88Å; I1073-F1103 HydrophobicContact CG2-CE2 4.5Å; I1073-F1103 HydrophobicContact CG2-CZ 4.24Å; I1073-L1106 HydrophobicContact CD1-CD1 3.75Å; I1073-L1106 HydrophobicContact CD1-CD2 4.13Å; I1073-L1106 HydrophobicContact CD1-CG 3.96Å; I1073-L1106 HydrophobicContact CG1-CD1 4.48Å; I1073-L1106 HydrophobicContact CG1-CD2 3.96Å; I1073-L1106 HydrophobicContact CG1-CG 4.3Å; I1073-L1106 HydrophobicContact CG2-CD2 4.14Å; I1073-L1106 HydrophobicContact CG2-CG 4.27Å; I1073-K1107 HydrophobicContact CG2-CG 4.43Å; I1073-V1110 HydrophobicContact CD1-CG2 3.54Å
1074	E	83	Confident	86.1	Confident	25 Å²	25	44.1 Å²	44.1	12%	0.117	21%	0.207	C	C	.	.	H	α-helix	trans	-59.2	-42	176.1	-73.1	-67.3	161.2	0	0	112.2	V1070 R1076 Q1077 H1159	V1070-E1074 WeakPolarHBondContact O-CG 3.35Å; V1070-E1074 PolarHBondContact O-N 2.81Å; E1074-R1076 VanDerWaalsContact C-N 3.32Å; E1074-R1076 PolarHBondContact O-N 2.95Å; E1074-Q1077 VanDerWaalsContact CD-NE2 3.32Å; E1074-Q1077 WeakPolarHBondContact O-CG 3.28Å; E1074-Q1077 PolarHBondContact O-N 3.25Å; E1074-Q1077 PolarHBondContact OE2-NE2 2.95Å; E1074-H1159 IonicContact OE1-CE1 2.63Å; E1074-H1159 IonicContact OE1-ND1 3.09Å; E1074-H1159 PolarHBondContact OE1-ND1 2.75Å
1075	R	82.5	Confident	86.4	Confident	189 Å²	189	46 Å²	46	71%	0.713	21%	0.209	S	C	*	.	H	α-helix	trans	-66.9	-29.4	177.8	-72.4	174	-168.1	172.6	6.7	113.6	L1071 G1072 I1073 Q1077	L1071-R1075 VanDerWaalsContact O-CG 3.29Å; L1071-R1075 WeakPolarHBondContact O-CG 3.46Å; L1071-R1075 PolarHBondContact O-N 3.41Å; L1071-R1075 VanDerWaalsContact O-N 3.08Å; G1072-R1075 PolarHBondContact O-N 3.37Å; I1073-R1075 VanDerWaalsContact C-N 3.33Å; I1073-R1075 PolarHBondContact O-N 3.49Å; R1075-Q1077 VanDerWaalsContact C-N 3.3Å; R1075-Q1077 PolarHBondContact O-N 3Å
1076	R	85.5	Confident	86.5	Confident	58 Å²	58	40.1 Å²	40.1	22%	0.219	19%	0.187	C	C	.	.	H	α-helix	trans	-77	-12.2	-177.9	-76.2	176.4	178.9	-145	-10.4	114.2	E1023 G1072 I1073 E1074 E1078 E1079 V1080 F1103	E1023-R1076 IonicContact OE2-CZ 3.02Å; E1023-R1076 IonicContact OE2-NH1 2.89Å; E1023-R1076 PolarHBondContact OE2-NH1 2.8Å; E1023-R1076 IonicContact OE2-NH2 3.47Å; E1023-R1076 PolarHBondContact OE2-NH2 2.8Å; G1072-R1076 WeakPolarHBondContact O-CG 3.45Å; G1072-R1076 PolarHBondContact O-N 3.29Å; I1073-R1076 PolarHBondContact O-N 2.88Å; E1074-R1076 VanDerWaalsContact C-N 3.32Å; E1074-R1076 PolarHBondContact O-N 2.95Å; R1076-E1078 PolarHBondContact O-N 2.8Å; R1076-E1079 PolarHBondContact O-N 2.98Å; R1076-E1079 VanDerWaalsContact O-N 3.11Å; R1076-V1080 WeakPolarHBondContact O-CG2 3.4Å; R1076-V1080 PolarHBondContact O-N 2.83Å; R1076-F1103 HydrophobicContact CB-CE2 4.23Å; R1076-F1103 HydrophobicContact CB-CZ 4.23Å
1077	Q	86.6	Confident	86.5	Confident	4 Å²	4	40.1 Å²	40.1	2%	0.019	19%	0.187	C	C	.	.	H	α-helix	trans	-56	-38.4	179.5	-69.3	179	25.8	0	0	112.7	E1074 R1075 A1081 F1103 W1165	E1074-Q1077 VanDerWaalsContact CD-NE2 3.32Å; E1074-Q1077 WeakPolarHBondContact O-CG 3.28Å; E1074-Q1077 PolarHBondContact O-N 3.25Å; E1074-Q1077 PolarHBondContact OE2-NE2 2.95Å; R1075-Q1077 VanDerWaalsContact C-N 3.3Å; R1075-Q1077 PolarHBondContact O-N 3Å; Q1077-A1081 VanDerWaalsContact O-CB 3.28Å; Q1077-A1081 WeakPolarHBondContact O-CB 3.22Å; Q1077-A1081 PolarHBondContact O-N 3.22Å; Q1077-F1103 HydrophobicContact CG-CE1 3.94Å; Q1077-F1103 HydrophobicContact CG-CZ 4.18Å; Q1077-W1165 HydrophobicContact CB-CB 4.29Å; Q1077-W1165 HydrophobicContact CB-CG 4.49Å; Q1077-W1165 HydrophobicContact CG-CG 4.5Å
1078	E	83.2	Confident	86.5	Confident	105 Å²	105	39.9 Å²	39.9	49%	0.491	19%	0.186	S	C	.	.	H	α-helix	trans	-67.7	-40.8	178.2	-65.7	176.5	-166.7	0	0	111.8	R1076 A1081 E1082 R1160	R1076-E1078 PolarHBondContact O-N 2.8Å; E1078-A1081 PolarHBondContact O-N 3.46Å; E1078-E1082 PolarHBondContact O-N 2.84Å; E1078-E1082 VanDerWaalsContact O-N 3.12Å; E1078-R1160 IonicContact OE1-NH1 2.71Å; E1078-R1160 PolarHBondContact OE1-NH1 3.34Å
1079	E	85.8	Confident	86.4	Confident	63 Å²	63	39.6 Å²	39.6	29%	0.294	18%	0.181	S	C	.	.	H	α-helix	trans	-64.3	-45.2	177	-175.4	-176.8	176.9	0	0	111.2	R1019 I1020 R1076 L1083	R1019-E1079 IonicContact NH2-OE1 3.78Å; R1019-E1079 PolarHBondContact NH2-OE1 2.67Å; I1020-E1079 HydrophobicContact CD1-CG 4.31Å; R1076-E1079 PolarHBondContact O-N 2.98Å; R1076-E1079 VanDerWaalsContact O-N 3.11Å; E1079-L1083 WeakPolarHBondContact O-CB 3.17Å; E1079-L1083 PolarHBondContact O-N 2.79Å
1080	V	88.9	Confident	86.4	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.5	-41.3	177.9	175.4	0	0	0	0	111	I1020 R1076 L1083 L1084 L1099 F1103 W1165	I1020-V1080 HydrophobicContact CG2-CG2 4.16Å; R1076-V1080 WeakPolarHBondContact O-CG2 3.4Å; R1076-V1080 PolarHBondContact O-N 2.83Å; V1080-L1083 PolarHBondContact O-N 2.86Å; V1080-L1084 HydrophobicContact CG1-CD1 3.83Å; V1080-L1084 HydrophobicContact CG1-CG 4.15Å; V1080-L1084 WeakPolarHBondContact O-CB 3.18Å; V1080-L1084 VanDerWaalsContact O-CG 3.28Å; V1080-L1084 WeakPolarHBondContact O-CG 3.35Å; V1080-L1084 PolarHBondContact O-N 2.83Å; V1080-L1099 HydrophobicContact CG1-CD2 4.41Å; V1080-L1099 HydrophobicContact CG1-CG 4.31Å; V1080-F1103 HydrophobicContact CB-CD1 4.48Å; V1080-F1103 HydrophobicContact CG1-CB 4.42Å; V1080-F1103 HydrophobicContact CG1-CD1 4.16Å; V1080-F1103 HydrophobicContact CG1-CG 4.22Å; V1080-F1103 HydrophobicContact CG2-CD1 4.31Å; V1080-F1103 HydrophobicContact CG2-CD2 3.87Å; V1080-F1103 HydrophobicContact CG2-CE1 4.31Å; V1080-F1103 HydrophobicContact CG2-CE2 3.87Å; V1080-F1103 HydrophobicContact CG2-CG 4.09Å; V1080-F1103 HydrophobicContact CG2-CZ 4.09Å; V1080-W1165 HydrophobicContact CG1-CE3 4.15Å; V1080-W1165 HydrophobicContact CG1-CZ3 4.48Å
1081	A	87.6	Confident	86.3	Confident	11 Å²	11	45.9 Å²	45.9	9%	0.091	21%	0.214	C	C	.	.	H	α-helix	trans	-61.7	-46.4	178.7	0	0	0	0	0	112.4	Q1077 E1078 L1083 R1085 W1165	Q1077-A1081 VanDerWaalsContact O-CB 3.28Å; Q1077-A1081 WeakPolarHBondContact O-CB 3.22Å; Q1077-A1081 PolarHBondContact O-N 3.22Å; E1078-A1081 PolarHBondContact O-N 3.46Å; A1081-L1083 VanDerWaalsContact C-N 3.35Å; A1081-R1085 VanDerWaalsContact O-CG 3.27Å; A1081-R1085 WeakPolarHBondContact O-CG 3.32Å; A1081-R1085 PolarHBondContact O-N 3.29Å; A1081-R1085 VanDerWaalsContact O-N 3.11Å; A1081-W1165 HydrophobicContact CB-CB 4.12Å
1082	E	86.4	Confident	86.4	Confident	62 Å²	62	43.8 Å²	43.8	29%	0.29	20%	0.204	S	C	.	.	H	α-helix	trans	-66.1	-37.4	177	-77.6	-66.3	116.7	0	0	112.1	M990 E1078 R1085 V1086	M990-E1082 VanDerWaalsContact CG-OE2 3.26Å; M990-E1082 WeakPolarHBondContact CG-OE2 3.27Å; E1078-E1082 PolarHBondContact O-N 2.84Å; E1078-E1082 VanDerWaalsContact O-N 3.12Å; E1082-R1085 PolarHBondContact O-N 3.47Å; E1082-R1085 IonicContact OE1-CZ 3.25Å; E1082-R1085 IonicContact OE1-NH1 3.98Å; E1082-R1085 PolarHBondContact OE1-NH1 2.99Å; E1082-V1086 PolarHBondContact O-N 2.88Å; E1082-V1086 VanDerWaalsContact O-N 3.08Å
1083	L	90.5	Very high	86.3	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-69.1	-42.7	177.9	-172.3	60.7	0	0	0	112.1	W989 V1013 T1016 A1017 I1020 E1079 V1080 A1081 R1085 V1086 L1087 L1099	W989-L1083 HydrophobicContact CD2-CD1 4.25Å; W989-L1083 HydrophobicContact CG-CD1 4.48Å; W989-L1083 HydrophobicContact CZ2-CD1 4.28Å; V1013-L1083 HydrophobicContact CG1-CD1 3.91Å; T1016-L1083 HydrophobicContact CG2-CD2 4.35Å; A1017-L1083 HydrophobicContact CB-CD2 4Å; I1020-L1083 HydrophobicContact CD1-CD2 3.72Å; E1079-L1083 WeakPolarHBondContact O-CB 3.17Å; E1079-L1083 PolarHBondContact O-N 2.79Å; V1080-L1083 PolarHBondContact O-N 2.86Å; A1081-L1083 VanDerWaalsContact C-N 3.35Å; L1083-R1085 VanDerWaalsContact C-N 3.3Å; L1083-R1085 PolarHBondContact O-N 3.17Å; L1083-V1086 HydrophobicContact CD1-CG1 4.19Å; L1083-V1086 PolarHBondContact O-N 2.7Å; L1083-L1087 HydrophobicContact CG-CD1 4.12Å; L1083-L1087 WeakPolarHBondContact O-CB 3.43Å; L1083-L1087 VanDerWaalsContact O-CG 3.29Å; L1083-L1087 WeakPolarHBondContact O-CG 3.45Å; L1083-L1087 PolarHBondContact O-N 2.92Å; L1083-L1099 HydrophobicContact CB-CD2 4.29Å; L1083-L1099 HydrophobicContact CD2-CD2 3.71Å; L1083-L1099 HydrophobicContact CG-CD2 3.93Å
1084	L	89.1	Confident	86.1	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.2	-41.9	174.1	-76.7	173.9	0	0	0	111.5	V1080 A1088 A1096 L1099 Q1100 W1165 L1167	V1080-L1084 HydrophobicContact CG1-CD1 3.83Å; V1080-L1084 HydrophobicContact CG1-CG 4.15Å; V1080-L1084 WeakPolarHBondContact O-CB 3.18Å; V1080-L1084 VanDerWaalsContact O-CG 3.28Å; V1080-L1084 WeakPolarHBondContact O-CG 3.35Å; V1080-L1084 PolarHBondContact O-N 2.83Å; L1084-A1088 WeakPolarHBondContact O-CB 3.34Å; L1084-A1088 PolarHBondContact O-N 3.15Å; L1084-A1096 HydrophobicContact CD2-CB 4.2Å; L1084-A1096 WeakPolarHBondContact CD2-O 3.48Å; L1084-L1099 HydrophobicContact CD2-CB 4.19Å; L1084-L1099 HydrophobicContact CD2-CD2 3.92Å; L1084-L1099 HydrophobicContact CD2-CG 4.17Å; L1084-L1099 HydrophobicContact CG-CD2 4.08Å; L1084-Q1100 HydrophobicContact CD1-CB 4.35Å; L1084-Q1100 HydrophobicContact CD2-CB 4.06Å; L1084-W1165 HydrophobicContact CD1-CE3 4.3Å; L1084-W1165 WeakPolarHBondContact CD1-O 3.46Å; L1084-L1167 HydrophobicContact CB-CD1 3.84Å; L1084-L1167 HydrophobicContact CB-CG 4.29Å
1085	R	88	Confident	86.3	Confident	115 Å²	115	52.3 Å²	52.3	43%	0.434	24%	0.236	S	C	.	.	H	α-helix	trans	-60.6	-48.5	175.3	-72.4	169.5	-170.8	175.8	0.3	111.5	M990 A1081 E1082 L1083 A1088 H1089	M990-R1085 HydrophobicContact SD-CB 4.12Å; A1081-R1085 VanDerWaalsContact O-CG 3.27Å; A1081-R1085 WeakPolarHBondContact O-CG 3.32Å; A1081-R1085 PolarHBondContact O-N 3.29Å; A1081-R1085 VanDerWaalsContact O-N 3.11Å; E1082-R1085 PolarHBondContact O-N 3.47Å; E1082-R1085 IonicContact OE1-CZ 3.25Å; E1082-R1085 IonicContact OE1-NH1 3.98Å; E1082-R1085 PolarHBondContact OE1-NH1 2.99Å; L1083-R1085 VanDerWaalsContact C-N 3.3Å; L1083-R1085 PolarHBondContact O-N 3.17Å; R1085-A1088 PolarHBondContact O-N 2.94Å; R1085-H1089 PolarHBondContact O-N 2.84Å; R1085-H1089 PolarHBondContact O-ND1 2.77Å
1086	V	89.1	Confident	86.5	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-68	-38.7	-177.8	98.1	0	0	0	0	111.7	W989 M990 F993 V1013 E1082 L1083 A1088 H1089 M1090	W989-V1086 HydrophobicContact CB-CB 3.76Å; W989-V1086 HydrophobicContact CB-CG1 3.9Å; W989-V1086 HydrophobicContact CB-CG2 3.89Å; W989-V1086 HydrophobicContact CG-CG1 4.28Å; M990-V1086 HydrophobicContact SD-CB 4.46Å; M990-V1086 HydrophobicContact SD-CG2 4.32Å; F993-V1086 HydrophobicContact CB-CG2 3.88Å; F993-V1086 HydrophobicContact CG-CG2 4.33Å; V1013-V1086 HydrophobicContact CB-CG1 4.39Å; V1013-V1086 HydrophobicContact CG1-CG1 3.67Å; V1013-V1086 HydrophobicContact CG2-CG1 3.72Å; E1082-V1086 PolarHBondContact O-N 2.88Å; E1082-V1086 VanDerWaalsContact O-N 3.08Å; L1083-V1086 HydrophobicContact CD1-CG1 4.19Å; L1083-V1086 PolarHBondContact O-N 2.7Å; V1086-A1088 VanDerWaalsContact C-N 3.32Å; V1086-A1088 PolarHBondContact O-N 3.2Å; V1086-H1089 PolarHBondContact O-N 3.17Å; V1086-M1090 WeakPolarHBondContact O-CB 3.23Å; V1086-M1090 VanDerWaalsContact O-CG 3.28Å; V1086-M1090 WeakPolarHBondContact O-CG 3.47Å; V1086-M1090 PolarHBondContact O-N 3.43Å
1087	L	89.2	Confident	86.6	Confident	0 Å²	0	43 Å²	43	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59.3	-43.7	175.4	-74.6	167	0	0	0	111.2	V1013 A1017 L1083 M1090 N1091 L1092 E1095 A1096 L1099	V1013-L1087 HydrophobicContact CG1-CD2 3.46Å; V1013-L1087 VanDerWaalsContact CG1-CD2 3.46Å; V1013-L1087 HydrophobicContact CG1-CG 3.93Å; A1017-L1087 HydrophobicContact CB-CD1 4.14Å; L1083-L1087 HydrophobicContact CG-CD1 4.12Å; L1083-L1087 WeakPolarHBondContact O-CB 3.43Å; L1083-L1087 VanDerWaalsContact O-CG 3.29Å; L1083-L1087 WeakPolarHBondContact O-CG 3.45Å; L1083-L1087 PolarHBondContact O-N 2.92Å; L1087-M1090 PolarHBondContact O-N 3.16Å; L1087-N1091 PolarHBondContact O-N 2.77Å; L1087-L1092 HydrophobicContact CB-CB 4.4Å; L1087-L1092 HydrophobicContact CD2-CB 3.77Å; L1087-L1092 HydrophobicContact CD2-CD1 3.8Å; L1087-L1092 HydrophobicContact CD2-CG 4.45Å; L1087-L1092 PolarHBondContact O-N 3.22Å; L1087-E1095 HydrophobicContact CD2-CB 4.03Å; L1087-A1096 HydrophobicContact CB-CB 3.93Å; L1087-A1096 HydrophobicContact CD1-CB 4.32Å; L1087-L1099 HydrophobicContact CD1-CD2 3.99Å
1088	A	85.4	Confident	86.7	Confident	14 Å²	14	45.8 Å²	45.8	12%	0.116	22%	0.222	C	C	.	.	H	α-helix	trans	-63.8	-42.7	175.9	0	0	0	0	0	112.5	L1084 R1085 V1086 M1090 N1091 L1167	L1084-A1088 WeakPolarHBondContact O-CB 3.34Å; L1084-A1088 PolarHBondContact O-N 3.15Å; R1085-A1088 PolarHBondContact O-N 2.94Å; V1086-A1088 VanDerWaalsContact C-N 3.32Å; V1086-A1088 PolarHBondContact O-N 3.2Å; A1088-M1090 VanDerWaalsContact C-N 3.26Å; A1088-M1090 PolarHBondContact O-N 3.41Å; A1088-N1091 PolarHBondContact O-N 3.35Å; A1088-L1167 HydrophobicContact CB-CD1 4.28Å
1089	H	85.2	Confident	87.1	Confident	97 Å²	97	40.8 Å²	40.8	45%	0.449	20%	0.199	S	C	.	.	H	α-helix	trans	-66.5	-27.6	176.5	-74.7	81.1	0	0	0	113	F993 R1085 V1086 N1091	F993-H1089 HydrophobicContact CE1-CB 4.19Å; F993-H1089 HydrophobicContact CE2-CB 4.38Å; F993-H1089 HydrophobicContact CZ-CB 4.04Å; R1085-H1089 PolarHBondContact O-N 2.84Å; R1085-H1089 PolarHBondContact O-ND1 2.77Å; V1086-H1089 PolarHBondContact O-N 3.17Å; H1089-N1091 VanDerWaalsContact C-N 3.34Å
1090	M	86.2	Confident	87.3	Confident	26 Å²	26	38 Å²	38	13%	0.128	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	6.2	177.4	-65.9	-174.9	73.7	0	0	113.8	F993 L1009 R1010 V1013 V1086 L1087 A1088 L1092	F993-M1090 HydrophobicContact CD2-CG 4.14Å; F993-M1090 HydrophobicContact CE2-CG 4.12Å; L1009-M1090 HydrophobicContact CD2-SD 4.41Å; L1009-M1090 HydrophobicContact CG-SD 4.37Å; R1010-M1090 HydrophobicContact CB-CE 3.74Å; R1010-M1090 HydrophobicContact CG-CE 3.93Å; V1013-M1090 HydrophobicContact CG2-SD 4.37Å; V1086-M1090 WeakPolarHBondContact O-CB 3.23Å; V1086-M1090 VanDerWaalsContact O-CG 3.28Å; V1086-M1090 WeakPolarHBondContact O-CG 3.47Å; V1086-M1090 PolarHBondContact O-N 3.43Å; L1087-M1090 PolarHBondContact O-N 3.16Å; A1088-M1090 VanDerWaalsContact C-N 3.26Å; A1088-M1090 PolarHBondContact O-N 3.41Å; M1090-L1092 VanDerWaalsContact C-N 3.26Å; M1090-L1092 HydrophobicContact CB-CD1 4.1Å; M1090-L1092 HydrophobicContact CB-CG 4.16Å; M1090-L1092 PolarHBondContact O-N 2.81Å
1091	N	85.1	Confident	87.3	Confident	118 Å²	118	41.6 Å²	41.6	63%	0.631	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.9	30.1	-175.5	-58.7	-50.6	0	0	0	114.5	L1087 A1088 H1089 F1093	L1087-N1091 PolarHBondContact O-N 2.77Å; A1088-N1091 PolarHBondContact O-N 3.35Å; H1089-N1091 VanDerWaalsContact C-N 3.34Å; N1091-F1093 HydrophobicContact CB-CE2 3.82Å; N1091-F1093 HydrophobicContact CB-CZ 4.32Å; N1091-F1093 PolarHBondContact O-N 2.93Å
1092	L	85.8	Confident	87.4	Confident	9 Å²	9	41.5 Å²	41.5	5%	0.047	21%	0.205	C	C	.	.			trans	-97.1	64	177.2	-64.4	173.9	0	0	0	110.4	I1014 L1087 M1090 E1095 A1096	I1014-L1092 HydrophobicContact CD1-CD1 4.12Å; I1014-L1092 HydrophobicContact CD1-CD2 4.46Å; I1014-L1092 HydrophobicContact CG1-CD1 3.87Å; L1087-L1092 HydrophobicContact CB-CB 4.4Å; L1087-L1092 HydrophobicContact CD2-CB 3.77Å; L1087-L1092 HydrophobicContact CD2-CD1 3.8Å; L1087-L1092 HydrophobicContact CD2-CG 4.45Å; L1087-L1092 PolarHBondContact O-N 3.22Å; M1090-L1092 VanDerWaalsContact C-N 3.26Å; M1090-L1092 HydrophobicContact CB-CD1 4.1Å; M1090-L1092 HydrophobicContact CB-CG 4.16Å; M1090-L1092 PolarHBondContact O-N 2.81Å; L1092-E1095 WeakPolarHBondContact CB-OE2 3.44Å; L1092-A1096 WeakPolarHBondContact O-CB 3.49Å; L1092-A1096 PolarHBondContact O-N 3.33Å; L1092-A1096 VanDerWaalsContact O-N 3.09Å
1093	F	83.3	Confident	87.6	Confident	55 Å²	55	38.7 Å²	38.7	24%	0.241	19%	0.191	C	C	.	.	H	α-helix	trans	-71.9	-34.4	-169.6	-59.5	-71.6	0	0	0	113.9	N1091 A1096 K1097	N1091-F1093 HydrophobicContact CB-CE2 3.82Å; N1091-F1093 HydrophobicContact CB-CZ 4.32Å; N1091-F1093 PolarHBondContact O-N 2.93Å; F1093-A1096 PolarHBondContact O-N 2.86Å; F1093-K1097 WeakPolarHBondContact O-CB 3.38Å; F1093-K1097 PolarHBondContact O-N 3.05Å
1094	E	82.1	Confident	87.5	Confident	112 Å²	112	39.3 Å²	39.3	52%	0.523	20%	0.196	S	C	.	.	H	α-helix	trans	-64.6	-47.8	176.7	-78.2	-70.6	168.1	0	0	110.7	A1096 K1097 C1098	E1094-A1096 VanDerWaalsContact C-N 3.33Å; E1094-A1096 PolarHBondContact O-N 3.31Å; E1094-K1097 WeakPolarHBondContact O-CB 3.46Å; E1094-K1097 PolarHBondContact O-N 2.82Å; E1094-K1097 VanDerWaalsContact O-N 3.17Å; E1094-C1098 PolarHBondContact O-N 2.78Å; E1094-C1098 PolarHBondContact O-SG 2.91Å; E1094-C1098 VanDerWaalsContact O-SG 3.38Å
1095	E	87.8	Confident	87.6	Confident	60 Å²	60	44.1 Å²	44.1	28%	0.28	22%	0.221	S	C	.	.	H	α-helix	trans	-64.2	-38.6	177.5	-62.8	87.3	164.3	0	0	111.7	L1087 L1092 K1097 L1099	L1087-E1095 HydrophobicContact CD2-CB 4.03Å; L1092-E1095 WeakPolarHBondContact CB-OE2 3.44Å; E1095-K1097 VanDerWaalsContact C-N 3.34Å; E1095-L1099 WeakPolarHBondContact O-CB 3.5Å; E1095-L1099 PolarHBondContact O-N 2.79Å
1096	A	86.5	Confident	87.6	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.008	20%	0.2	C	C	.	.	H	α-helix	trans	-62.2	-42.1	173.6	0	0	0	0	0	111.7	L1084 L1087 L1092 F1093 E1094 L1099 Q1100	L1084-A1096 HydrophobicContact CD2-CB 4.2Å; L1084-A1096 WeakPolarHBondContact CD2-O 3.48Å; L1087-A1096 HydrophobicContact CB-CB 3.93Å; L1087-A1096 HydrophobicContact CD1-CB 4.32Å; L1092-A1096 WeakPolarHBondContact O-CB 3.49Å; L1092-A1096 PolarHBondContact O-N 3.33Å; L1092-A1096 VanDerWaalsContact O-N 3.09Å; F1093-A1096 PolarHBondContact O-N 2.86Å; E1094-A1096 VanDerWaalsContact C-N 3.33Å; E1094-A1096 PolarHBondContact O-N 3.31Å; A1096-L1099 PolarHBondContact O-N 2.9Å; A1096-Q1100 WeakPolarHBondContact O-CB 3.49Å; A1096-Q1100 PolarHBondContact O-N 2.8Å
1097	K	86.2	Confident	87.6	Confident	50 Å²	50	40.1 Å²	40.1	22%	0.217	21%	0.207	C	C	.	.	H	α-helix	trans	-64.1	-51.8	178	-170.5	170.6	178.6	172.6	0	111.7	F1093 E1094 E1095 L1099 Q1100 D1101 L1172 L1176	F1093-K1097 WeakPolarHBondContact O-CB 3.38Å; F1093-K1097 PolarHBondContact O-N 3.05Å; E1094-K1097 WeakPolarHBondContact O-CB 3.46Å; E1094-K1097 PolarHBondContact O-N 2.82Å; E1094-K1097 VanDerWaalsContact O-N 3.17Å; E1095-K1097 VanDerWaalsContact C-N 3.34Å; K1097-L1099 VanDerWaalsContact C-N 3.25Å; K1097-L1099 PolarHBondContact O-N 2.92Å; K1097-Q1100 PolarHBondContact O-N 3.33Å; K1097-D1101 WeakPolarHBondContact O-CB 3.21Å; K1097-D1101 VanDerWaalsContact O-CG 3.31Å; K1097-D1101 PolarHBondContact O-N 3.13Å; K1097-L1172 VanDerWaalsContact CA-CD2 3.41Å; K1097-L1172 HydrophobicContact CB-CD2 3.57Å; K1097-L1172 HydrophobicContact CG-CD2 3.9Å; K1097-L1176 HydrophobicContact CD-CD2 4.44Å
1098	C	89.6	Confident	87.5	Confident	63 Å²	63	44.2 Å²	44.2	43%	0.426	23%	0.229	S	C	.	.	H	α-helix	trans	-57.8	-39.7	178.5	-66.6	0	0	0	0	112.2	I1021 E1094 A1102	I1021-C1098 HydrophobicContact CD1-CB 3.9Å; E1094-C1098 PolarHBondContact O-N 2.78Å; E1094-C1098 PolarHBondContact O-SG 2.91Å; E1094-C1098 VanDerWaalsContact O-SG 3.38Å; C1098-A1102 VanDerWaalsContact O-CB 3.29Å; C1098-A1102 WeakPolarHBondContact O-CB 3.47Å; C1098-A1102 PolarHBondContact O-N 3.09Å
1099	L	90.4	Very high	87.5	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-66.6	-46.7	176.9	179.8	64.2	0	0	0	112.1	A1017 I1020 I1021 V1080 L1083 L1084 L1087 E1095 A1096 K1097 F1103	A1017-L1099 HydrophobicContact CB-CD2 4.44Å; I1020-L1099 HydrophobicContact CB-CD1 3.97Å; I1020-L1099 HydrophobicContact CG2-CD1 3.63Å; I1021-L1099 HydrophobicContact CD1-CB 4.28Å; I1021-L1099 HydrophobicContact CG1-CB 4.34Å; I1021-L1099 HydrophobicContact CG1-CD1 4Å; V1080-L1099 HydrophobicContact CG1-CD2 4.41Å; V1080-L1099 HydrophobicContact CG1-CG 4.31Å; L1083-L1099 HydrophobicContact CB-CD2 4.29Å; L1083-L1099 HydrophobicContact CD2-CD2 3.71Å; L1083-L1099 HydrophobicContact CG-CD2 3.93Å; L1084-L1099 HydrophobicContact CD2-CB 4.19Å; L1084-L1099 HydrophobicContact CD2-CD2 3.92Å; L1084-L1099 HydrophobicContact CD2-CG 4.17Å; L1084-L1099 HydrophobicContact CG-CD2 4.08Å; L1087-L1099 HydrophobicContact CD1-CD2 3.99Å; E1095-L1099 WeakPolarHBondContact O-CB 3.5Å; E1095-L1099 PolarHBondContact O-N 2.79Å; A1096-L1099 PolarHBondContact O-N 2.9Å; K1097-L1099 VanDerWaalsContact C-N 3.25Å; K1097-L1099 PolarHBondContact O-N 2.92Å; L1099-F1103 WeakPolarHBondContact O-CB 3.36Å; L1099-F1103 PolarHBondContact O-N 2.86Å
1100	Q	90.7	Very high	87.6	Confident	3 Å²	3	40.6 Å²	40.6	1%	0.014	21%	0.214	C	C	.	.	H	α-helix	trans	-63.7	-40.7	179.1	178	158.8	-74.1	0	0	112	L1084 A1096 K1097 S1104 W1165 L1167	L1084-Q1100 HydrophobicContact CD1-CB 4.35Å; L1084-Q1100 HydrophobicContact CD2-CB 4.06Å; A1096-Q1100 WeakPolarHBondContact O-CB 3.49Å; A1096-Q1100 PolarHBondContact O-N 2.8Å; K1097-Q1100 PolarHBondContact O-N 3.33Å; Q1100-S1104 VanDerWaalsContact O-CB 3.24Å; Q1100-S1104 WeakPolarHBondContact O-CB 3.23Å; Q1100-S1104 PolarHBondContact O-N 3.2Å; Q1100-S1104 PolarHBondContact O-OG 3.2Å; Q1100-W1165 HydrophobicContact CG-CZ3 4.34Å; Q1100-L1167 PolarHBondContact NE2-O 2.87Å; Q1100-L1167 VanDerWaalsContact NE2-O 3.17Å; Q1100-L1167 PolarHBondContact OE1-O 3.05Å
1101	D	89	Confident	87.5	Confident	77 Å²	77	42.6 Å²	42.6	41%	0.412	23%	0.231	S	C	.	.	H	α-helix	trans	-67.5	-49.9	179.3	-70.7	-15.5	0	0	0	111	K1097 F1103 S1104 L1105	K1097-D1101 WeakPolarHBondContact O-CB 3.21Å; K1097-D1101 VanDerWaalsContact O-CG 3.31Å; K1097-D1101 PolarHBondContact O-N 3.13Å; D1101-F1103 PolarHBondContact O-N 3.39Å; D1101-S1104 PolarHBondContact O-N 3.28Å; D1101-L1105 WeakPolarHBondContact O-CG 3.39Å; D1101-L1105 PolarHBondContact O-N 2.92Å
1102	A	90.1	Very high	87.5	Confident	9 Å²	9	41.5 Å²	41.5	7%	0.074	23%	0.232	C	C	.	.	H	α-helix	trans	-60.7	-43	179.3	0	0	0	0	0	112.3	I1021 C1098 L1105 L1106	I1021-A1102 HydrophobicContact CB-CB 4.49Å; I1021-A1102 HydrophobicContact CG1-CB 4.25Å; I1021-A1102 HydrophobicContact CG2-CB 4.09Å; C1098-A1102 VanDerWaalsContact O-CB 3.29Å; C1098-A1102 WeakPolarHBondContact O-CB 3.47Å; C1098-A1102 PolarHBondContact O-N 3.09Å; A1102-L1105 PolarHBondContact O-N 2.81Å; A1102-L1106 PolarHBondContact O-N 2.83Å; A1102-L1106 VanDerWaalsContact O-N 3.15Å
1103	F	90.7	Very high	87.5	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.009	24%	0.241	C	C	.	.	H	α-helix	trans	-74.2	-30	179.2	-160.6	-102	0	0	0	112.6	I1073 R1076 Q1077 V1080 L1099 D1101 L1106 K1107 W1165	I1073-F1103 HydrophobicContact CG2-CE2 4.5Å; I1073-F1103 HydrophobicContact CG2-CZ 4.24Å; R1076-F1103 HydrophobicContact CB-CE2 4.23Å; R1076-F1103 HydrophobicContact CB-CZ 4.23Å; Q1077-F1103 HydrophobicContact CG-CE1 3.94Å; Q1077-F1103 HydrophobicContact CG-CZ 4.18Å; V1080-F1103 HydrophobicContact CB-CD1 4.48Å; V1080-F1103 HydrophobicContact CG1-CB 4.42Å; V1080-F1103 HydrophobicContact CG1-CD1 4.16Å; V1080-F1103 HydrophobicContact CG1-CG 4.22Å; V1080-F1103 HydrophobicContact CG2-CD1 4.31Å; V1080-F1103 HydrophobicContact CG2-CD2 3.87Å; V1080-F1103 HydrophobicContact CG2-CE1 4.31Å; V1080-F1103 HydrophobicContact CG2-CE2 3.87Å; V1080-F1103 HydrophobicContact CG2-CG 4.09Å; V1080-F1103 HydrophobicContact CG2-CZ 4.09Å; L1099-F1103 WeakPolarHBondContact O-CB 3.36Å; L1099-F1103 PolarHBondContact O-N 2.86Å; D1101-F1103 PolarHBondContact O-N 3.39Å; F1103-L1106 HydrophobicContact CD2-CD2 4.14Å; F1103-L1106 HydrophobicContact CE2-CD2 4.15Å; F1103-L1106 PolarHBondContact O-N 3.36Å; F1103-K1107 HydrophobicContact CD1-CG 4.4Å; F1103-K1107 HydrophobicContact CE1-CD 4.19Å; F1103-K1107 HydrophobicContact CE1-CG 4.16Å; F1103-K1107 PolarHBondContact O-N 3.38Å; F1103-W1165 HydrophobicContact CB-CH2 4.25Å; F1103-W1165 HydrophobicContact CB-CZ3 4.14Å; F1103-W1165 HydrophobicContact CD1-CD2 4.1Å; F1103-W1165 AromaticContact CD1-CE3 3.83Å; F1103-W1165 HydrophobicContact CD1-CE3 3.83Å; F1103-W1165 AromaticContact CD1-CH2 3.68Å; F1103-W1165 HydrophobicContact CD1-CH2 3.68Å; F1103-W1165 AromaticContact CD1-CZ2 3.98Å; F1103-W1165 HydrophobicContact CD1-CZ2 3.98Å; F1103-W1165 AromaticContact CD1-CZ3 3.63Å; F1103-W1165 HydrophobicContact CD1-CZ3 3.63Å; F1103-W1165 HydrophobicContact CE1-CD2 4.31Å; F1103-W1165 HydrophobicContact CE1-CE3 4.41Å; F1103-W1165 HydrophobicContact CG-CH2 4.46Å; F1103-W1165 HydrophobicContact CG-CZ3 4.36Å
1104	S	88.9	Confident	87.5	Confident	14 Å²	14	42.6 Å²	42.6	10%	0.098	24%	0.237	C	C	.	.	H	α-helix	trans	-62.8	-48.7	171.7	-67.1	0	0	0	0	110.7	Q1100 D1101 L1106 K1107 D1108 W1165 K1166	Q1100-S1104 VanDerWaalsContact O-CB 3.24Å; Q1100-S1104 WeakPolarHBondContact O-CB 3.23Å; Q1100-S1104 PolarHBondContact O-N 3.2Å; Q1100-S1104 PolarHBondContact O-OG 3.2Å; D1101-S1104 PolarHBondContact O-N 3.28Å; S1104-L1106 VanDerWaalsContact C-N 3.28Å; S1104-L1106 PolarHBondContact O-N 3.11Å; S1104-K1107 PolarHBondContact O-N 3.18Å; S1104-K1107 VanDerWaalsContact O-N 3.14Å; S1104-D1108 VanDerWaalsContact O-CG 3.26Å; S1104-D1108 PolarHBondContact O-N 2.91Å; S1104-W1165 VanDerWaalsContact OG-CH2 3.27Å; S1104-W1165 WeakPolarHBondContact OG-CH2 3.33Å; S1104-K1166 VanDerWaalsContact OG-CE 3.26Å; S1104-K1166 WeakPolarHBondContact OG-CE 3.16Å; S1104-K1166 PolarHBondContact OG-NZ 3.4Å
1105	L	90.1	Very high	87.4	Confident	100 Å²	100	41 Å²	41	52%	0.524	24%	0.239	S	C	.	.	H	α-helix	trans	-58.1	-40.7	177.4	-71.3	170.7	0	0	0	112.1	M1028 D1101 A1102 D1108 A1109	M1028-L1105 HydrophobicContact CE-CB 4.17Å; M1028-L1105 HydrophobicContact SD-CB 4.06Å; D1101-L1105 WeakPolarHBondContact O-CG 3.39Å; D1101-L1105 PolarHBondContact O-N 2.92Å; A1102-L1105 PolarHBondContact O-N 2.81Å; L1105-D1108 PolarHBondContact O-N 3.45Å; L1105-A1109 WeakPolarHBondContact O-CB 3.23Å; L1105-A1109 PolarHBondContact O-N 3.02Å
1106	L	89.3	Confident	87.2	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.1	-44.8	175.5	177.3	65.6	0	0	0	112.3	A1024 Q1027 M1028 I1073 A1102 F1103 S1104 A1109 V1110	A1024-L1106 HydrophobicContact CB-CB 4.48Å; A1024-L1106 HydrophobicContact CB-CD2 3.93Å; Q1027-L1106 HydrophobicContact CB-CD1 3.85Å; Q1027-L1106 HydrophobicContact CB-CD2 4.48Å; M1028-L1106 HydrophobicContact CB-CD1 4.44Å; M1028-L1106 HydrophobicContact CG-CB 4.05Å; M1028-L1106 HydrophobicContact CG-CD1 3.48Å; M1028-L1106 VanDerWaalsContact CG-CD1 3.48Å; M1028-L1106 HydrophobicContact CG-CG 4.37Å; M1028-L1106 HydrophobicContact SD-CB 4.26Å; I1073-L1106 HydrophobicContact CD1-CD1 3.75Å; I1073-L1106 HydrophobicContact CD1-CD2 4.13Å; I1073-L1106 HydrophobicContact CD1-CG 3.96Å; I1073-L1106 HydrophobicContact CG1-CD1 4.48Å; I1073-L1106 HydrophobicContact CG1-CD2 3.96Å; I1073-L1106 HydrophobicContact CG1-CG 4.3Å; I1073-L1106 HydrophobicContact CG2-CD2 4.14Å; I1073-L1106 HydrophobicContact CG2-CG 4.27Å; A1102-L1106 PolarHBondContact O-N 2.83Å; A1102-L1106 VanDerWaalsContact O-N 3.15Å; F1103-L1106 HydrophobicContact CD2-CD2 4.14Å; F1103-L1106 HydrophobicContact CE2-CD2 4.15Å; F1103-L1106 PolarHBondContact O-N 3.36Å; S1104-L1106 VanDerWaalsContact C-N 3.28Å; S1104-L1106 PolarHBondContact O-N 3.11Å; L1106-A1109 PolarHBondContact O-N 3.43Å; L1106-V1110 WeakPolarHBondContact O-CG2 2.99Å; L1106-V1110 PolarHBondContact O-N 3.32Å; L1106-V1110 VanDerWaalsContact O-N 3.1Å
1107	K	87.8	Confident	87.1	Confident	32 Å²	32	40.7 Å²	40.7	14%	0.139	24%	0.241	C	C	.	.	H	α-helix	trans	-65.9	-39.6	177.2	-79.7	-155.1	67.8	165.4	0	112.8	I1073 F1103 S1104 A1109 V1110 S1111 W1165	I1073-K1107 HydrophobicContact CG2-CG 4.43Å; F1103-K1107 HydrophobicContact CD1-CG 4.4Å; F1103-K1107 HydrophobicContact CE1-CD 4.19Å; F1103-K1107 HydrophobicContact CE1-CG 4.16Å; F1103-K1107 PolarHBondContact O-N 3.38Å; S1104-K1107 PolarHBondContact O-N 3.18Å; S1104-K1107 VanDerWaalsContact O-N 3.14Å; K1107-A1109 VanDerWaalsContact C-N 3.33Å; K1107-V1110 PolarHBondContact O-N 3.04Å; K1107-S1111 PolarHBondContact O-N 3.41Å; K1107-S1111 PolarHBondContact O-OG 2.97Å; K1107-W1165 HydrophobicContact CD-CZ2 3.74Å; K1107-W1165 HydrophobicContact CG-CZ2 4.33Å
1108	D	86.5	Confident	87.1	Confident	86 Å²	86	38.8 Å²	38.8	46%	0.46	23%	0.232	S	C	.	.	H	α-helix	trans	-64.4	-41.5	176.5	-66.4	-18.2	0	0	0	110.3	S1104 L1105 V1110 S1111 C1112	S1104-D1108 VanDerWaalsContact O-CG 3.26Å; S1104-D1108 PolarHBondContact O-N 2.91Å; L1105-D1108 PolarHBondContact O-N 3.45Å; D1108-V1110 PolarHBondContact O-N 3.36Å; D1108-S1111 PolarHBondContact O-N 3.13Å; D1108-C1112 PolarHBondContact O-N 2.68Å; D1108-C1112 PolarHBondContact O-SG 3.22Å; D1108-C1112 VanDerWaalsContact O-SG 3.34Å
1109	A	87	Confident	86.6	Confident	27 Å²	27	37.8 Å²	37.8	22%	0.223	23%	0.225	C	C	.	.	H	α-helix	trans	-60.3	-42.8	175.1	0	0	0	0	0	113.1	L1031 L1105 L1106 K1107 K1113	L1031-A1109 HydrophobicContact CD2-CB 4.17Å; L1105-A1109 WeakPolarHBondContact O-CB 3.23Å; L1105-A1109 PolarHBondContact O-N 3.02Å; L1106-A1109 PolarHBondContact O-N 3.43Å; K1107-A1109 VanDerWaalsContact C-N 3.33Å; A1109-K1113 WeakPolarHBondContact O-CG 3.39Å; A1109-K1113 PolarHBondContact O-N 3.37Å; A1109-K1113 VanDerWaalsContact O-N 3.15Å
1110	V	86.3	Confident	85.8	Confident	7 Å²	7	47.5 Å²	47.5	4%	0.042	27%	0.27	C	S	.	.	H	α-helix	trans	-61	-47.3	173.7	170.3	0	0	0	0	110.8	L1031 V1070 I1073 L1106 K1107 D1108 C1112 K1113 I1114	L1031-V1110 HydrophobicContact CD2-CG2 3.91Å; V1070-V1110 HydrophobicContact CG1-CG1 4.18Å; V1070-V1110 HydrophobicContact CG2-CG1 3.96Å; I1073-V1110 HydrophobicContact CD1-CG2 3.54Å; L1106-V1110 WeakPolarHBondContact O-CG2 2.99Å; L1106-V1110 PolarHBondContact O-N 3.32Å; L1106-V1110 VanDerWaalsContact O-N 3.1Å; K1107-V1110 PolarHBondContact O-N 3.04Å; D1108-V1110 PolarHBondContact O-N 3.36Å; V1110-C1112 VanDerWaalsContact C-N 3.34Å; V1110-C1112 PolarHBondContact O-N 2.91Å; V1110-K1113 PolarHBondContact O-N 3.04Å; V1110-I1114 HydrophobicContact CG1-CD1 4.47Å; V1110-I1114 PolarHBondContact O-N 2.95Å
1111	S	84	Confident	84.7	Confident	69 Å²	69	52.9 Å²	52.9	48%	0.483	30%	0.303	S	S	.	.	H	α-helix	trans	-63.7	-39.7	-177.2	-56	0	0	0	0	111.8	K1107 D1108	K1107-S1111 PolarHBondContact O-N 3.41Å; K1107-S1111 PolarHBondContact O-OG 2.97Å; D1108-S1111 PolarHBondContact O-N 3.13Å
1112	C	85.4	Confident	83.9	Confident	95 Å²	95	51.6 Å²	51.6	64%	0.642	30%	0.296	S	S	*	.	H	α-helix	trans	-67.9	-35.2	176.2	-71.4	0	0	0	0	113.6	D1108 V1110	D1108-C1112 PolarHBondContact O-N 2.68Å; D1108-C1112 PolarHBondContact O-SG 3.22Å; D1108-C1112 VanDerWaalsContact O-SG 3.34Å; V1110-C1112 VanDerWaalsContact C-N 3.34Å; V1110-C1112 PolarHBondContact O-N 2.91Å
1113	K	85.1	Confident	82.7	Confident	55 Å²	55	57.3 Å²	57.3	24%	0.239	32%	0.32	C	S	.	.	H	α-helix	trans	-89	-14.2	-176.7	-69.9	-71.6	-163.3	161.8	0	113.4	D1036 A1109 V1110 S1115 V1116 I1117	D1036-K1113 IonicContact OD1-NZ 3.85Å; D1036-K1113 PolarHBondContact OD1-NZ 2.98Å; A1109-K1113 WeakPolarHBondContact O-CG 3.39Å; A1109-K1113 PolarHBondContact O-N 3.37Å; A1109-K1113 VanDerWaalsContact O-N 3.15Å; V1110-K1113 PolarHBondContact O-N 3.04Å; K1113-S1115 PolarHBondContact O-N 3.45Å; K1113-V1116 WeakPolarHBondContact O-CA 3.47Å; K1113-V1116 WeakPolarHBondContact O-CB 3.47Å; K1113-V1116 PolarHBondContact O-N 3.14Å; K1113-I1117 HydrophobicContact CB-CD1 4.08Å; K1113-I1117 WeakPolarHBondContact O-CG1 3.26Å; K1113-I1117 PolarHBondContact O-N 3.03Å
1114	I	84.8	Confident	81.5	Confident	31 Å²	31	62.5 Å²	62.5	16%	0.159	35%	0.352	C	S	.	.	H	α-helix	trans	-60.7	-42.4	-173.1	-129.5	169.8	0	0	0	113.2	V1110 V1116 I1117 W1118 H1159	V1110-I1114 HydrophobicContact CG1-CD1 4.47Å; V1110-I1114 PolarHBondContact O-N 2.95Å; I1114-V1116 PolarHBondContact O-N 3.33Å; I1114-I1117 PolarHBondContact O-N 3.48Å; I1114-W1118 HydrophobicContact CG1-CE3 4.05Å; I1114-W1118 HydrophobicContact CG1-CZ3 4.2Å; I1114-W1118 PolarHBondContact O-N 3.22Å; I1114-H1159 WeakPolarHBondContact CD1-NE2 3.44Å
1115	S	80.3	Confident	80.3	Confident	80 Å²	80	66.5 Å²	66.5	56%	0.559	37%	0.372	S	S	*	.	H	α-helix	trans	-69.3	-22.5	178.1	55.9	0	0	0	0	112.7	K1113 P1119	K1113-S1115 PolarHBondContact O-N 3.45Å; S1115-P1119 WeakPolarHBondContact O-CA 3.41Å
1116	V	82.6	Confident	79.1	Confident	53 Å²	53	63.3 Å²	63.3	32%	0.321	36%	0.355	S	S	.	.	H	α-helix	trans	-81.8	-43.1	176	-176.7	0	0	0	0	110.4	N1039 R1042 K1113 I1114	N1039-V1116 WeakPolarHBondContact ND2-CG1 3.22Å; N1039-V1116 WeakPolarHBondContact OD1-CG1 3.33Å; R1042-V1116 PolarHBondContact NH1-O 3.25Å; K1113-V1116 WeakPolarHBondContact O-CA 3.47Å; K1113-V1116 WeakPolarHBondContact O-CB 3.47Å; K1113-V1116 PolarHBondContact O-N 3.14Å; I1114-V1116 PolarHBondContact O-N 3.33Å
1117	I	84.3	Confident	78	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	37%	0.37	C	S	.	.	H	α-helix	trans	-72	-46.3	-178.9	-59.8	163.3	0	0	0	110.4	L1031 L1038 R1042 L1063 L1066 K1113 I1114 P1119	L1031-I1117 HydrophobicContact CD1-CD1 4.31Å; L1038-I1117 HydrophobicContact CD2-CG2 4.03Å; R1042-I1117 VanDerWaalsContact CZ-O 3.28Å; R1042-I1117 PolarHBondContact NH1-O 3.36Å; R1042-I1117 PolarHBondContact NH2-O 3.22Å; L1063-I1117 HydrophobicContact CD2-CG2 4.02Å; L1066-I1117 HydrophobicContact CB-CD1 4.49Å; L1066-I1117 HydrophobicContact CB-CG2 4.26Å; L1066-I1117 HydrophobicContact CD1-CB 4.5Å; L1066-I1117 HydrophobicContact CD1-CD1 4.06Å; L1066-I1117 HydrophobicContact CD1-CG1 4.01Å; L1066-I1117 HydrophobicContact CD1-CG2 3.65Å; L1066-I1117 HydrophobicContact CD2-CD1 3.87Å; L1066-I1117 HydrophobicContact CG-CD1 4.37Å; K1113-I1117 HydrophobicContact CB-CD1 4.08Å; K1113-I1117 WeakPolarHBondContact O-CG1 3.26Å; K1113-I1117 PolarHBondContact O-N 3.03Å; I1114-I1117 PolarHBondContact O-N 3.48Å; I1117-P1119 WeakPolarHBondContact O-CD 3.39Å
1118	W	85.9	Confident	76.8	Confident	9 Å²	9	65.9 Å²	65.9	3%	0.034	37%	0.371	C	S	.	.	S	Bend	trans	-122.5	83.7	178.7	-64.9	-85.7	0	0	0	110.7	L1066 V1070 I1114 S1153 I1156 P1157	L1066-W1118 HydrophobicContact CB-CH2 4.06Å; V1070-W1118 HydrophobicContact CG2-CH2 4.38Å; V1070-W1118 HydrophobicContact CG2-CZ3 4.28Å; I1114-W1118 HydrophobicContact CG1-CE3 4.05Å; I1114-W1118 HydrophobicContact CG1-CZ3 4.2Å; I1114-W1118 PolarHBondContact O-N 3.22Å; W1118-S1153 PolarHBondContact NE1-O 3.44Å; W1118-I1156 HydrophobicContact CB-CD1 4.14Å; W1118-I1156 HydrophobicContact CB-CG1 3.4Å; W1118-I1156 VanDerWaalsContact CB-CG1 3.4Å; W1118-I1156 HydrophobicContact CD2-CG1 4.49Å; W1118-I1156 HydrophobicContact CG-CG1 3.83Å; W1118-P1157 HydrophobicContact CH2-CG 3.96Å; W1118-P1157 HydrophobicContact CZ2-CG 4.1Å; W1118-P1157 HydrophobicContact CZ3-CG 4.45Å
1119	P	79.3	Confident	75.3	Confident	43 Å²	43	64.7 Å²	64.7	28%	0.279	37%	0.367	S	S	.	.			trans	-72.5	151.9	178.6	30.6	-34.4	0	0	0	111.2	S1115 I1117 V1121 I1122	S1115-P1119 WeakPolarHBondContact O-CA 3.41Å; I1117-P1119 WeakPolarHBondContact O-CD 3.39Å; P1119-V1121 PolarHBondContact O-N 2.66Å; P1119-I1122 HydrophobicContact CG-CD1 4.37Å; P1119-I1122 HydrophobicContact CG-CG1 3.66Å
1120	E	72.8	Confident	73.5	Confident	204 Å²	204	65.3 Å²	65.3	95%	0.953	37%	0.368	S	S	*	.	S	Bend	trans	-62.5	-24.5	177.9	-67.3	-174.6	167.3	0	0	113
1121	V	69.5	Low	71.4	Confident	117 Å²	117	68 Å²	68	71%	0.709	39%	0.387	S	S	*	.			trans	-129.9	121.1	179.4	-175.5	0	0	0	0	109.4	P1119	P1119-V1121 PolarHBondContact O-N 2.66Å
1122	I	70.4	Confident	69.1	Low	50 Å²	50	73.2 Å²	73.2	26%	0.256	40%	0.403	S	S	.	.			trans	-116.5	127.4	174.9	-62.6	171.7	0	0	0	108.2	P1119 Q1126 L1127 L1154	P1119-I1122 HydrophobicContact CG-CD1 4.37Å; P1119-I1122 HydrophobicContact CG-CG1 3.66Å; I1122-Q1126 HydrophobicContact CG2-CB 3.99Å; I1122-L1127 HydrophobicContact CG2-CD2 4.16Å; I1122-L1127 HydrophobicContact CG2-CG 4.48Å; I1122-L1154 HydrophobicContact CD1-CD2 4.38Å
1123	H	66.3	Low	66.7	Low	128 Å²	128	78 Å²	78	59%	0.593	42%	0.416	S	S	*	.			trans	-69.2	144.8	174.1	-97.1	-79.6	0	0	0	111	N1125 Q1126 L1127	H1123-N1125 PolarHBondContact O-N 2.94Å; H1123-N1125 VanDerWaalsContact O-N 3.09Å; H1123-Q1126 HydrophobicContact CB-CG 4.17Å; H1123-Q1126 WeakPolarHBondContact O-CA 3.24Å; H1123-Q1126 WeakPolarHBondContact O-CB 3.29Å; H1123-Q1126 PolarHBondContact O-N 2.93Å; H1123-L1127 PolarHBondContact O-N 3.44Å
1124	V	64.3	Low	64.2	Low	112 Å²	112	78.8 Å²	78.8	68%	0.679	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-52.4	-37.5	179.9	177.3	0	0	0	0	112.2	Q1126 L1127	V1124-Q1126 PolarHBondContact O-N 3.25Å; V1124-L1127 HydrophobicContact CB-CD1 4.49Å; V1124-L1127 HydrophobicContact CG1-CD1 4.31Å; V1124-L1127 WeakPolarHBondContact O-CB 3.25Å; V1124-L1127 PolarHBondContact O-N 3.48Å
1125	N	63.4	Low	61.7	Low	97 Å²	97	86.3 Å²	86.3	52%	0.519	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-71.5	-13.6	179.8	-58.8	2	0	0	0	113.6	H1123	H1123-N1125 PolarHBondContact O-N 2.94Å; H1123-N1125 VanDerWaalsContact O-N 3.09Å
1126	Q	65.9	Low	59.2	Low	33 Å²	33	91.7 Å²	91.7	15%	0.154	48%	0.482	C	S	.	.	G	3₁₀ helix	trans	-97.5	-4.2	176.3	-59.9	-179.4	-53.6	0	0	112.5	L1046 I1122 H1123 V1124	L1046-Q1126 HydrophobicContact CD2-CG 3.85Å; L1046-Q1126 HydrophobicContact CG-CG 3.94Å; I1122-Q1126 HydrophobicContact CG2-CB 3.99Å; H1123-Q1126 HydrophobicContact CB-CG 4.17Å; H1123-Q1126 WeakPolarHBondContact O-CA 3.24Å; H1123-Q1126 WeakPolarHBondContact O-CB 3.29Å; H1123-Q1126 PolarHBondContact O-N 2.93Å; V1124-Q1126 PolarHBondContact O-N 3.25Å
1127	L	66.7	Low	56.7	Low	62 Å²	62	91.7 Å²	91.7	33%	0.325	49%	0.485	S	S	.	.	S	Bend	trans	-64.3	146	176.3	-71.1	168.2	0	0	0	110.2	K1045 I1122 H1123 V1124 T1129 L1154	K1045-L1127 PolarHBondContact NZ-O 3.36Å; I1122-L1127 HydrophobicContact CG2-CD2 4.16Å; I1122-L1127 HydrophobicContact CG2-CG 4.48Å; H1123-L1127 PolarHBondContact O-N 3.44Å; V1124-L1127 HydrophobicContact CB-CD1 4.49Å; V1124-L1127 HydrophobicContact CG1-CD1 4.31Å; V1124-L1127 WeakPolarHBondContact O-CB 3.25Å; V1124-L1127 PolarHBondContact O-N 3.48Å; L1127-T1129 PolarHBondContact O-N 2.95Å; L1127-L1154 HydrophobicContact CD2-CD1 4.36Å
1128	P	62	Low	54.5	Low	24 Å²	24	94.4 Å²	94.4	16%	0.156	50%	0.503	C	S	.	.			trans	-60.2	127.9	172.2	-18.2	29.5	0	0	0	111.4	D1059 I1060 L1063 L1154	D1059-P1128 VanDerWaalsContact OD2-CA 3.3Å; D1059-P1128 WeakPolarHBondContact OD2-CA 3.43Å; I1060-P1128 HydrophobicContact CD1-CB 3.76Å; I1060-P1128 HydrophobicContact CG1-CB 3.4Å; I1060-P1128 VanDerWaalsContact CG1-CB 3.4Å; I1060-P1128 HydrophobicContact CG1-CG 4.14Å; L1063-P1128 HydrophobicContact CD1-CG 4.33Å; P1128-L1154 HydrophobicContact CG-CD1 4.23Å; P1128-L1154 HydrophobicContact CG-CD2 3.92Å; P1128-L1154 HydrophobicContact CG-CG 4.3Å
1129	T	55.2	Low	52.1	Low	61 Å²	61	101.3 Å²	101.3	37%	0.374	54%	0.54	S	S	.	.			trans	-91.9	102.9	-176	24.6	0	0	0	0	109.4	K1045 L1127	K1045-T1129 PolarHBondContact NZ-OG1 2.91Å; L1127-T1129 PolarHBondContact O-N 2.95Å
1130	V	50.1	Low	50.1	Low	41 Å²	41	102.8 Å²	102.8	25%	0.248	55%	0.548	C	S	.	.			trans	-96.1	111.4	172.9	-164.8	0	0	0	0	109.6	I1060 S1137 C1138	I1060-V1130 HydrophobicContact CD1-CG2 3.69Å; V1130-S1137 WeakPolarHBondContact CG1-OG 3.43Å; V1130-C1138 HydrophobicContact CB-CB 4.23Å; V1130-C1138 HydrophobicContact CG2-CB 3.65Å
1131	S	40.6	Very low	48	Very low	62 Å²	62	102.3 Å²	102.3	43%	0.434	55%	0.546	S	S	.	.			trans	-107.2	137.8	176.2	63.8	0	0	0	0	111.4
1132	H	35.6	Very low	46.1	Very low	180 Å²	180	99.8 Å²	99.8	83%	0.833	54%	0.538	S	S	*	.			trans	-38.3	121.5	-171.8	-70.5	-92.3	0	0	0	117.9
1133	Q	35.5	Very low	44.5	Very low	196 Å²	196	101.7 Å²	101.7	92%	0.916	55%	0.552	S	S	*	*	S	Bend	trans	-174.2	104.4	132.9	-102.1	171.3	36.9	0	0	111
1134	G	31.9	Very low	43.3	Very low	71 Å²	71	102.3 Å²	102.3	73%	0.732	57%	0.565	S	S	*	*	S	Bend	trans	85.7	112.3	168.8	0	0	0	0	0	115.2
1135	E	32.3	Very low	42.3	Very low	189 Å²	189	102.7 Å²	102.7	88%	0.883	56%	0.563	S	S	*	*	S	Bend	trans	68.3	88.6	174.3	-61.1	-175.6	169.1	0	0	116.6	S1137	E1135-S1137 PolarHBondContact O-N 2.94Å
1136	R	27.7	Very low	41.1	Very low	192 Å²	192	101.1 Å²	101.1	73%	0.725	57%	0.57	S	S	*	*			trans	6.1	92.7	160.3	-67.5	-173.5	170.1	172.2	-4.4	116.6	T1140	R1136-T1140 HydrophobicContact CB-CG2 3.93Å; R1136-T1140 HydrophobicContact CG-CG2 3.94Å
1137	S	31.7	Very low	39.8	Very low	54 Å²	54	103.5 Å²	103.5	38%	0.378	59%	0.586	S	S	.	*			trans	-128	116.9	-175.4	54.8	0	0	0	0	111.9	V1130 E1135 L1139	V1130-S1137 WeakPolarHBondContact CG1-OG 3.43Å; E1135-S1137 PolarHBondContact O-N 2.94Å; S1137-L1139 PolarHBondContact O-N 3.34Å
1138	C	36.6	Very low	38.6	Very low	57 Å²	57	105.8 Å²	105.8	39%	0.385	60%	0.602	S	S	.	*	S	Bend	trans	69.4	-25.3	167.8	-57.4	0	0	0	0	121.5	V1130	V1130-C1138 HydrophobicContact CB-CB 4.23Å; V1130-C1138 HydrophobicContact CG2-CB 3.65Å
1139	L	37	Very low	37.9	Very low	155 Å²	155	113.7 Å²	113.7	81%	0.812	63%	0.629	S	S	*	*			trans	-147	64.6	170.7	-73.2	171.6	0	0	0	110.2	S1137	S1137-L1139 PolarHBondContact O-N 3.34Å
1140	T	36.7	Very low	37.8	Very low	73 Å²	73	115.7 Å²	115.7	45%	0.448	64%	0.637	S	S	.	*			trans	-103.9	108.5	172.4	53.2	0	0	0	0	111.4	R1136 A1142	R1136-T1140 HydrophobicContact CB-CG2 3.93Å; R1136-T1140 HydrophobicContact CG-CG2 3.94Å; T1140-A1142 PolarHBondContact O-N 2.92Å
1141	E	29.1	Very low	38.2	Very low	195 Å²	195	114.9 Å²	114.9	91%	0.911	64%	0.635	S	S	*	*			trans	-38.4	105.4	156.2	-65	175.1	149.2	0	0	110.4
1142	A	28.3	Very low	39.2	Very low	64 Å²	64	120.6 Å²	120.6	53%	0.529	65%	0.654	S	S	.	*			trans	161.9	75.4	148.7	0	0	0	0	0	110.9	T1140	T1140-A1142 PolarHBondContact O-N 2.92Å
1143	T	37.8	Very low	40.6	Very low	90 Å²	90	112.3 Å²	112.3	55%	0.552	62%	0.617	S	S	*	*			trans	-153.4	118.3	147.9	48.8	0	0	0	0	109.5	N1145	T1143-N1145 PolarHBondContact O-N 3.22Å
1144	T	40.6	Very low	42.1	Very low	141 Å²	141	104.2 Å²	104.2	87%	0.865	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-25.8	6.6	168.8	34.6	0	0	0	0	121.9
1145	N	44	Very low	43.9	Very low	119 Å²	119	104.3 Å²	104.3	64%	0.636	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.5	13.9	-168.8	-77.6	-20.3	0	0	0	117.7	T1143 V1147	T1143-N1145 PolarHBondContact O-N 3.22Å; N1145-V1147 PolarHBondContact O-N 3.3Å
1146	G	37.4	Very low	46	Very low	65 Å²	65	99.2 Å²	99.2	67%	0.67	54%	0.544	S	S	*	.			trans	63.4	17.3	172	0	0	0	0	0	115.9
1147	V	39.9	Very low	48.1	Very low	82 Å²	82	90.6 Å²	90.6	50%	0.497	51%	0.513	S	S	.	.			trans	-89.5	112.9	174.9	-179.4	0	0	0	0	108.3	N1145 W1149	N1145-V1147 PolarHBondContact O-N 3.3Å; V1147-W1149 HydrophobicContact CG1-CD2 4.38Å; V1147-W1149 HydrophobicContact CG1-CZ2 4.42Å; V1147-W1149 PolarHBondContact O-N 2.5Å
1148	V	41.6	Very low	49.8	Very low	110 Å²	110	99.2 Å²	99.2	67%	0.667	54%	0.537	S	S	*	.			trans	-80	112.7	167.5	180	0	0	0	0	107.2	L1150	V1148-L1150 PolarHBondContact O-N 2.84Å
1149	W	46.5	Very low	50.8	Low	190 Å²	190	100.7 Å²	100.7	72%	0.72	54%	0.538	S	S	*	.			trans	-77.8	102.5	172.7	-64.5	90.6	0	0	0	108.2	V1147	V1147-W1149 HydrophobicContact CG1-CD2 4.38Å; V1147-W1149 HydrophobicContact CG1-CZ2 4.42Å; V1147-W1149 PolarHBondContact O-N 2.5Å
1150	L	52.2	Low	51.8	Low	104 Å²	104	101.1 Å²	101.1	55%	0.545	53%	0.529	S	S	.	.			trans	-60.7	142.1	164.4	-68.2	168.9	0	0	0	108.2	V1148 E1152 L1154 V1155	V1148-L1150 PolarHBondContact O-N 2.84Å; L1150-E1152 PolarHBondContact O-N 3.2Å; L1150-L1154 HydrophobicContact CB-CB 4.38Å; L1150-L1154 HydrophobicContact CD2-CD1 4.2Å; L1150-V1155 HydrophobicContact CB-CG2 4.41Å
1151	A	58.6	Low	52.6	Low	23 Å²	23	105.2 Å²	105.2	19%	0.19	55%	0.548	C	S	.	.			trans	-52.9	140.8	168.5	0	0	0	0	0	109.2	S1153 L1154	A1151-S1153 WeakPolarHBondContact CB-OG 3.17Å; A1151-S1153 PolarHBondContact O-N 2.82Å; A1151-L1154 HydrophobicContact CB-CD1 4.22Å; A1151-L1154 HydrophobicContact CB-CG 4.4Å; A1151-L1154 WeakPolarHBondContact O-CB 3.3Å; A1151-L1154 PolarHBondContact O-N 3.16Å
1152	E	62.9	Low	53.9	Low	182 Å²	182	104.7 Å²	104.7	85%	0.85	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-53.4	-30.4	178.8	-73.9	-174.1	157.5	0	0	111.8	L1150 L1154 V1155	L1150-E1152 PolarHBondContact O-N 3.2Å; E1152-L1154 VanDerWaalsContact C-N 3.3Å; E1152-L1154 PolarHBondContact O-N 3.26Å; E1152-V1155 PolarHBondContact O-N 3.08Å
1153	S	64.4	Low	55.3	Low	6 Å²	6	104.6 Å²	104.6	4%	0.042	54%	0.541	C	S	.	.	G	3₁₀ helix	trans	-65.5	-24.2	176.3	63	0	0	0	0	115.2	D1064 W1118 A1151	D1064-S1153 WeakPolarHBondContact OD1-CB 3.47Å; W1118-S1153 PolarHBondContact NE1-O 3.44Å; A1151-S1153 WeakPolarHBondContact CB-OG 3.17Å; A1151-S1153 PolarHBondContact O-N 2.82Å
1154	L	67.5	Low	56.8	Low	27 Å²	27	103.5 Å²	103.5	14%	0.141	55%	0.547	C	S	.	.	G	3₁₀ helix	trans	-87.6	-9.1	177.5	-70.8	168.4	0	0	0	112.9	L1063 I1122 L1127 P1128 L1150 A1151 E1152	L1063-L1154 HydrophobicContact CD1-CD2 3.86Å; I1122-L1154 HydrophobicContact CD1-CD2 4.38Å; L1127-L1154 HydrophobicContact CD2-CD1 4.36Å; P1128-L1154 HydrophobicContact CG-CD1 4.23Å; P1128-L1154 HydrophobicContact CG-CD2 3.92Å; P1128-L1154 HydrophobicContact CG-CG 4.3Å; L1150-L1154 HydrophobicContact CB-CB 4.38Å; L1150-L1154 HydrophobicContact CD2-CD1 4.2Å; A1151-L1154 HydrophobicContact CB-CD1 4.22Å; A1151-L1154 HydrophobicContact CB-CG 4.4Å; A1151-L1154 WeakPolarHBondContact O-CB 3.3Å; A1151-L1154 PolarHBondContact O-N 3.16Å; E1152-L1154 VanDerWaalsContact C-N 3.3Å; E1152-L1154 PolarHBondContact O-N 3.26Å
1155	V	70.1	Confident	58.8	Low	73 Å²	73	97.6 Å²	97.6	44%	0.442	51%	0.509	S	S	.	.	S	Bend	trans	-90.9	129.8	178.2	-176.9	0	0	0	0	108.9	L1150 E1152	L1150-V1155 HydrophobicContact CB-CG2 4.41Å; E1152-V1155 PolarHBondContact O-N 3.08Å
1156	I	76.3	Confident	60.6	Low	82 Å²	82	97 Å²	97	42%	0.421	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-55.1	127.3	173.8	-61.7	167.9	0	0	0	108.5	W1118 R1158	W1118-I1156 HydrophobicContact CB-CD1 4.14Å; W1118-I1156 HydrophobicContact CB-CG1 3.4Å; W1118-I1156 VanDerWaalsContact CB-CG1 3.4Å; W1118-I1156 HydrophobicContact CD2-CG1 4.49Å; W1118-I1156 HydrophobicContact CG-CG1 3.83Å; I1156-R1158 PolarHBondContact O-N 2.93Å; I1156-R1158 VanDerWaalsContact O-N 3.15Å
1157	P	71.8	Confident	62.7	Low	11 Å²	11	95.3 Å²	95.3	7%	0.071	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-55.4	122.4	174.1	-22.5	31.5	0	0	0	109.7	V1070 L1071 W1118 H1159	V1070-P1157 HydrophobicContact CB-CG 4.44Å; V1070-P1157 HydrophobicContact CG1-CB 4.27Å; V1070-P1157 HydrophobicContact CG1-CG 4.28Å; L1071-P1157 HydrophobicContact CD2-CB 3.83Å; L1071-P1157 HydrophobicContact CG-CB 3.95Å; W1118-P1157 HydrophobicContact CH2-CG 3.96Å; W1118-P1157 HydrophobicContact CZ2-CG 4.1Å; W1118-P1157 HydrophobicContact CZ3-CG 4.45Å; P1157-H1159 PolarHBondContact O-N 3.42Å
1158	R	65.8	Low	64.3	Low	234 Å²	234	95.5 Å²	95.5	88%	0.883	48%	0.479	S	S	*	.			trans	-62.7	110.1	-179.2	-70.7	-175.3	178.5	175.7	0.5	109.6	I1156	I1156-R1158 PolarHBondContact O-N 2.93Å; I1156-R1158 VanDerWaalsContact O-N 3.15Å
1159	H	59.2	Low	65.3	Low	88 Å²	88	95 Å²	95	41%	0.407	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-56.7	137.2	171.7	-75.1	-77.4	0	0	0	110.7	E1074 I1114 P1157	E1074-H1159 IonicContact OE1-CE1 2.63Å; E1074-H1159 IonicContact OE1-ND1 3.09Å; E1074-H1159 PolarHBondContact OE1-ND1 2.75Å; I1114-H1159 WeakPolarHBondContact CD1-NE2 3.44Å; P1157-H1159 PolarHBondContact O-N 3.42Å
1160	R	57.8	Low	65.7	Low	164 Å²	164	91 Å²	91	62%	0.619	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-71.8	132.2	158	-83.3	-173.4	177.7	-170.1	2.1	107	E1078 E1162	E1078-R1160 IonicContact OE1-NH1 2.71Å; E1078-R1160 PolarHBondContact OE1-NH1 3.34Å; R1160-E1162 PolarHBondContact O-N 2.82Å
1161	N	53.3	Low	66	Low	160 Å²	160	93.1 Å²	93.1	86%	0.856	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-46.9	135.8	170.5	-76.8	-16.4	0	0	0	109.8	C1163	N1161-C1163 PolarHBondContact O-N 2.77Å
1162	E	55.1	Low	66	Low	184 Å²	184	92.3 Å²	92.3	86%	0.86	46%	0.463	S	S	*	.			trans	-35	98.5	-173.7	-66.7	-179.9	156.3	0	0	112.9	R1160 G1164	R1160-E1162 PolarHBondContact O-N 2.82Å; E1162-G1164 PolarHBondContact O-N 2.88Å
1163	C	59.1	Low	65.5	Low	62 Å²	62	87.3 Å²	87.3	42%	0.419	44%	0.442	S	S	.	.			trans	-72.4	124.2	169.1	-152	0	0	0	0	106.2	N1161 W1165	N1161-C1163 PolarHBondContact O-N 2.77Å; C1163-W1165 VanDerWaalsContact O-CD1 3.22Å; C1163-W1165 PolarHBondContact O-N 3.06Å
1164	G	68.3	Low	64.8	Low	67 Å²	67	92.3 Å²	92.3	69%	0.691	47%	0.465	S	S	*	.			trans	-67	78.8	-178.4	0	0	0	0	0	112.2	E1162	E1162-G1164 PolarHBondContact O-N 2.88Å
1165	W	82.1	Confident	64	Low	16 Å²	16	94.5 Å²	94.5	6%	0.061	48%	0.479	C	S	.	.			trans	-89.8	-23.9	-176.7	68	-93.5	0	0	0	113	Q1077 V1080 A1081 L1084 Q1100 F1103 S1104 K1107 C1163	Q1077-W1165 HydrophobicContact CB-CB 4.29Å; Q1077-W1165 HydrophobicContact CB-CG 4.49Å; Q1077-W1165 HydrophobicContact CG-CG 4.5Å; V1080-W1165 HydrophobicContact CG1-CE3 4.15Å; V1080-W1165 HydrophobicContact CG1-CZ3 4.48Å; A1081-W1165 HydrophobicContact CB-CB 4.12Å; L1084-W1165 HydrophobicContact CD1-CE3 4.3Å; L1084-W1165 WeakPolarHBondContact CD1-O 3.46Å; Q1100-W1165 HydrophobicContact CG-CZ3 4.34Å; F1103-W1165 HydrophobicContact CB-CH2 4.25Å; F1103-W1165 HydrophobicContact CB-CZ3 4.14Å; F1103-W1165 HydrophobicContact CD1-CD2 4.1Å; F1103-W1165 AromaticContact CD1-CE3 3.83Å; F1103-W1165 HydrophobicContact CD1-CE3 3.83Å; F1103-W1165 AromaticContact CD1-CH2 3.68Å; F1103-W1165 HydrophobicContact CD1-CH2 3.68Å; F1103-W1165 AromaticContact CD1-CZ2 3.98Å; F1103-W1165 HydrophobicContact CD1-CZ2 3.98Å; F1103-W1165 AromaticContact CD1-CZ3 3.63Å; F1103-W1165 HydrophobicContact CD1-CZ3 3.63Å; F1103-W1165 HydrophobicContact CE1-CD2 4.31Å; F1103-W1165 HydrophobicContact CE1-CE3 4.41Å; F1103-W1165 HydrophobicContact CG-CH2 4.46Å; F1103-W1165 HydrophobicContact CG-CZ3 4.36Å; S1104-W1165 VanDerWaalsContact OG-CH2 3.27Å; S1104-W1165 WeakPolarHBondContact OG-CH2 3.33Å; K1107-W1165 HydrophobicContact CD-CZ2 3.74Å; K1107-W1165 HydrophobicContact CG-CZ2 4.33Å; C1163-W1165 VanDerWaalsContact O-CD1 3.22Å; C1163-W1165 PolarHBondContact O-N 3.06Å
1166	K	82.5	Confident	63.1	Low	107 Å²	107	92.9 Å²	92.9	47%	0.465	47%	0.468	S	S	.	.	S	Bend	trans	-75.1	134.9	177.8	-67.9	-170.1	178.3	-169.9	0	111.2	S1104	S1104-K1166 VanDerWaalsContact OG-CE 3.26Å; S1104-K1166 WeakPolarHBondContact OG-CE 3.16Å; S1104-K1166 PolarHBondContact OG-NZ 3.4Å
1167	L	80.6	Confident	61.9	Low	29 Å²	29	90.6 Å²	90.6	15%	0.152	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-74.8	138.4	161.6	-75.1	167.4	0	0	0	108.9	L1084 A1088 Q1100 D1169 L1172	L1084-L1167 HydrophobicContact CB-CD1 3.84Å; L1084-L1167 HydrophobicContact CB-CG 4.29Å; A1088-L1167 HydrophobicContact CB-CD1 4.28Å; Q1100-L1167 PolarHBondContact NE2-O 2.87Å; Q1100-L1167 VanDerWaalsContact NE2-O 3.17Å; Q1100-L1167 PolarHBondContact OE1-O 3.05Å; L1167-D1169 PolarHBondContact O-N 3.48Å; L1167-L1172 HydrophobicContact CB-CD1 3.92Å; L1167-L1172 HydrophobicContact CD1-CD1 4.02Å
1168	P	74.9	Confident	60.9	Low	87 Å²	87	93.5 Å²	93.5	57%	0.565	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-54.9	131.7	177.6	-23.8	32.5	0	0	0	111.5	V1170 Y1171	P1168-V1170 PolarHBondContact O-N 3.02Å; P1168-Y1171 WeakPolarHBondContact O-CA 3.37Å; P1168-Y1171 VanDerWaalsContact O-CB 3.24Å; P1168-Y1171 WeakPolarHBondContact O-CB 3.34Å; P1168-Y1171 PolarHBondContact O-N 3.44Å
1169	D	61.7	Low	60.4	Low	100 Å²	100	89.4 Å²	89.4	54%	0.535	47%	0.472	S	S	.	.	H	α-helix	trans	-57.7	-26.2	-178.2	-71.4	-26.8	0	0	0	113.2	L1167 Y1171 L1172 N1173	L1167-D1169 PolarHBondContact O-N 3.48Å; D1169-Y1171 PolarHBondContact O-N 2.91Å; D1169-L1172 PolarHBondContact O-N 2.62Å; D1169-N1173 VanDerWaalsContact O-CB 3.28Å; D1169-N1173 WeakPolarHBondContact O-CB 3.38Å; D1169-N1173 PolarHBondContact O-N 2.9Å; D1169-N1173 PolarHBondContact O-ND2 2.74Å
1170	V	55.4	Low	60.7	Low	106 Å²	106	89.2 Å²	89.2	64%	0.642	47%	0.474	S	S	*	.	H	α-helix	trans	-59.3	-33.2	172.7	-176.3	0	0	0	0	111.3	P1168 H1174	P1168-V1170 PolarHBondContact O-N 3.02Å; V1170-H1174 WeakPolarHBondContact O-CB 3.16Å; V1170-H1174 PolarHBondContact O-N 2.82Å
1171	Y	59.3	Low	61.5	Low	148 Å²	148	83 Å²	83	58%	0.58	45%	0.451	S	S	*	.	H	α-helix	trans	-76.5	-28.4	-178.6	-146.7	-93.4	0	0	0	113	P1168 D1169 T1175	P1168-Y1171 WeakPolarHBondContact O-CA 3.37Å; P1168-Y1171 VanDerWaalsContact O-CB 3.24Å; P1168-Y1171 WeakPolarHBondContact O-CB 3.34Å; P1168-Y1171 PolarHBondContact O-N 3.44Å; D1169-Y1171 PolarHBondContact O-N 2.91Å; Y1171-T1175 PolarHBondContact O-OG1 2.84Å
1172	L	58.4	Low	62.8	Low	5 Å²	5	79.1 Å²	79.1	3%	0.026	43%	0.431	C	S	.	.	H	α-helix	trans	-94.6	-34.4	178.8	-96.3	82.9	0	0	0	113.4	K1097 L1167 D1169	K1097-L1172 VanDerWaalsContact CA-CD2 3.41Å; K1097-L1172 HydrophobicContact CB-CD2 3.57Å; K1097-L1172 HydrophobicContact CG-CD2 3.9Å; L1167-L1172 HydrophobicContact CB-CD1 3.92Å; L1167-L1172 HydrophobicContact CD1-CD1 4.02Å; D1169-L1172 PolarHBondContact O-N 2.62Å
1173	N	52.1	Low	64	Low	77 Å²	77	74.9 Å²	74.9	41%	0.412	41%	0.414	S	S	.	.	H	α-helix	trans	-88.3	-29.6	-173.3	-71.9	-34.2	0	0	0	113.6	D1169 T1175 L1176 A1177	D1169-N1173 VanDerWaalsContact O-CB 3.28Å; D1169-N1173 WeakPolarHBondContact O-CB 3.38Å; D1169-N1173 PolarHBondContact O-N 2.9Å; D1169-N1173 PolarHBondContact O-ND2 2.74Å; N1173-T1175 VanDerWaalsContact C-N 3.27Å; N1173-T1175 PolarHBondContact O-N 3.48Å; N1173-L1176 PolarHBondContact O-N 2.99Å; N1173-A1177 WeakPolarHBondContact O-CB 2.95Å; N1173-A1177 PolarHBondContact O-N 3.32Å
1174	H	50	Low	65.2	Low	112 Å²	112	74.8 Å²	74.8	52%	0.519	41%	0.411	S	S	.	.	H	α-helix	trans	-71.9	-21.2	-176.8	-145.9	-48.3	0	0	0	113	V1170 V1178 D1243	V1170-H1174 WeakPolarHBondContact O-CB 3.16Å; V1170-H1174 PolarHBondContact O-N 2.82Å; H1174-V1178 WeakPolarHBondContact O-CG2 3.46Å; H1174-D1243 IonicContact CE1-OD2 3.96Å
1175	T	50.5	Low	66	Low	72 Å²	72	71.7 Å²	71.7	44%	0.442	38%	0.379	S	S	.	.	H	α-helix	trans	-93.2	-25	175.4	37.1	0	0	0	0	113.1	Y1171 N1173	Y1171-T1175 PolarHBondContact O-OG1 2.84Å; N1173-T1175 VanDerWaalsContact C-N 3.27Å; N1173-T1175 PolarHBondContact O-N 3.48Å
1176	L	51.4	Low	66.3	Low	39 Å²	39	75 Å²	75	20%	0.204	40%	0.397	C	S	.	.	H	α-helix	trans	-80.8	-29.6	172.5	-110.4	96.4	0	0	0	113.2	K1097 N1173 M1179 N1180	K1097-L1176 HydrophobicContact CD-CD2 4.44Å; N1173-L1176 PolarHBondContact O-N 2.99Å; L1176-M1179 PolarHBondContact O-N 2.92Å; L1176-N1180 PolarHBondContact O-ND2 3.35Å
1177	A	50.3	Low	66.5	Low	34 Å²	34	73.9 Å²	73.9	28%	0.281	40%	0.399	S	S	.	.	H	α-helix	trans	-67.2	-39.9	179.9	0	0	0	0	0	112.5	N1173 M1179 N1180 H1181	N1173-A1177 WeakPolarHBondContact O-CB 2.95Å; N1173-A1177 PolarHBondContact O-N 3.32Å; A1177-M1179 PolarHBondContact O-N 3.31Å; A1177-M1179 VanDerWaalsContact O-N 3.13Å; A1177-N1180 PolarHBondContact O-N 3.3Å; A1177-H1181 PolarHBondContact O-CD2 2.98Å
1178	V	51.2	Low	67	Low	73 Å²	73	72.8 Å²	72.8	44%	0.442	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-19.9	179.6	178.9	0	0	0	0	112.7	H1174	H1174-V1178 WeakPolarHBondContact O-CG2 3.46Å
1179	M	55.3	Low	67.8	Low	148 Å²	148	72.6 Å²	72.6	73%	0.729	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-4.7	174.8	-71.4	-174.3	75.1	0	0	114.3	L1176 A1177 N1183	L1176-M1179 PolarHBondContact O-N 2.92Å; A1177-M1179 PolarHBondContact O-N 3.31Å; A1177-M1179 VanDerWaalsContact O-N 3.13Å; M1179-N1183 PolarHBondContact O-ND2 3.48Å
1180	N	66.3	Low	69.1	Low	84 Å²	84	71.1 Å²	71.1	45%	0.449	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-21.7	-174.2	-82.8	-32.8	0	0	0	114.8	L1176 A1177 N1183 T1184	L1176-N1180 PolarHBondContact O-ND2 3.35Å; A1177-N1180 PolarHBondContact O-N 3.3Å; N1180-N1183 PolarHBondContact O-N 3.01Å; N1180-T1184 WeakPolarHBondContact O-CB 3.02Å; N1180-T1184 VanDerWaalsContact O-CG2 3.26Å; N1180-T1184 WeakPolarHBondContact O-CG2 3.44Å; N1180-T1184 PolarHBondContact O-N 3.41Å; N1180-T1184 PolarHBondContact O-OG1 2.97Å
1181	H	74.3	Confident	70.9	Confident	32 Å²	32	70 Å²	70	15%	0.148	37%	0.372	C	S	.	.	H	α-helix	trans	-66.7	-46	-177.7	-69	-68.7	0	0	0	112.2	A1177 N1183 T1184 S1185 E1239 D1243	A1177-H1181 PolarHBondContact O-CD2 2.98Å; H1181-N1183 PolarHBondContact O-N 2.6Å; H1181-T1184 PolarHBondContact O-N 3.38Å; H1181-T1184 PolarHBondContact O-OG1 2.9Å; H1181-S1185 WeakPolarHBondContact O-CB 3.13Å; H1181-S1185 PolarHBondContact O-N 3.29Å; H1181-E1239 HydrophobicContact CB-CB 4.23Å; H1181-E1239 WeakPolarHBondContact CB-OE2 3.26Å; H1181-D1243 IonicContact CD2-OD1 3.41Å; H1181-D1243 IonicContact NE2-OD1 2.82Å; H1181-D1243 PolarHBondContact NE2-OD1 2.51Å
1182	L	79.9	Confident	72.4	Confident	80 Å²	80	63.6 Å²	63.6	42%	0.419	35%	0.348	S	S	.	.	H	α-helix	trans	-58.9	-47.4	173.4	-173.7	64	0	0	0	113.4	T1184 S1185 I1186 E1239	L1182-T1184 PolarHBondContact O-N 2.91Å; L1182-S1185 WeakPolarHBondContact O-CB 3.31Å; L1182-S1185 PolarHBondContact O-N 2.81Å; L1182-I1186 HydrophobicContact CD1-CD1 4.48Å; L1182-I1186 HydrophobicContact CG-CD1 4.15Å; L1182-I1186 WeakPolarHBondContact O-CG1 3.29Å; L1182-I1186 PolarHBondContact O-N 2.67Å; L1182-E1239 HydrophobicContact CB-CG 4.31Å; L1182-E1239 PolarHBondContact N-OE2 3.03Å
1183	N	80.4	Confident	73.9	Confident	94 Å²	94	68.1 Å²	68.1	50%	0.503	38%	0.376	S	S	.	.	H	α-helix	trans	-62.9	-43.3	-178.9	-77.3	-30	0	0	0	111.9	M1179 N1180 H1181 S1185 I1186 V1187	M1179-N1183 PolarHBondContact O-ND2 3.48Å; N1180-N1183 PolarHBondContact O-N 3.01Å; H1181-N1183 PolarHBondContact O-N 2.6Å; N1183-S1185 VanDerWaalsContact C-N 3.35Å; N1183-I1186 PolarHBondContact O-N 3.1Å; N1183-V1187 WeakPolarHBondContact O-CG2 3.47Å; N1183-V1187 PolarHBondContact O-N 3.05Å
1184	T	83.8	Confident	75.8	Confident	60 Å²	60	69.9 Å²	69.9	37%	0.368	39%	0.385	S	S	.	.	H	α-helix	trans	-68.4	-33.1	177.9	53.7	0	0	0	0	112.2	N1180 H1181 L1182 S1188 N1235	N1180-T1184 WeakPolarHBondContact O-CB 3.02Å; N1180-T1184 VanDerWaalsContact O-CG2 3.26Å; N1180-T1184 WeakPolarHBondContact O-CG2 3.44Å; N1180-T1184 PolarHBondContact O-N 3.41Å; N1180-T1184 PolarHBondContact O-OG1 2.97Å; H1181-T1184 PolarHBondContact O-N 3.38Å; H1181-T1184 PolarHBondContact O-OG1 2.9Å; L1182-T1184 PolarHBondContact O-N 2.91Å; T1184-S1188 WeakPolarHBondContact O-CB 3.37Å; T1184-S1188 PolarHBondContact O-N 2.95Å; T1184-N1235 WeakPolarHBondContact CB-ND2 3.41Å; T1184-N1235 PolarHBondContact OG1-ND2 3.49Å; T1184-N1235 VanDerWaalsContact OG1-ND2 3.08Å
1185	S	86.5	Confident	77.7	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.021	37%	0.37	C	S	.	.	H	α-helix	trans	-62.3	-45.6	170.9	-174.1	0	0	0	0	112.1	H1181 L1182 N1183 S1188 L1189 A1232	H1181-S1185 WeakPolarHBondContact O-CB 3.13Å; H1181-S1185 PolarHBondContact O-N 3.29Å; L1182-S1185 WeakPolarHBondContact O-CB 3.31Å; L1182-S1185 PolarHBondContact O-N 2.81Å; N1183-S1185 VanDerWaalsContact C-N 3.35Å; S1185-S1188 PolarHBondContact O-N 3.02Å; S1185-L1189 PolarHBondContact O-N 3.49Å; S1185-A1232 PolarHBondContact OG-O 3.41Å
1186	I	86.9	Confident	79.6	Confident	86 Å²	86	66.6 Å²	66.6	44%	0.441	37%	0.365	S	S	.	.	H	α-helix	trans	-62.9	-44.8	177.2	-66.2	166.2	0	0	0	111.2	L1182 N1183 S1188 L1189 T1190	L1182-I1186 HydrophobicContact CD1-CD1 4.48Å; L1182-I1186 HydrophobicContact CG-CD1 4.15Å; L1182-I1186 WeakPolarHBondContact O-CG1 3.29Å; L1182-I1186 PolarHBondContact O-N 2.67Å; N1183-I1186 PolarHBondContact O-N 3.1Å; I1186-S1188 VanDerWaalsContact C-N 3.32Å; I1186-S1188 PolarHBondContact O-N 3.19Å; I1186-L1189 PolarHBondContact O-N 3.06Å; I1186-T1190 HydrophobicContact CG2-CG2 4.45Å; I1186-T1190 WeakPolarHBondContact O-CG2 3.45Å; I1186-T1190 PolarHBondContact O-N 2.85Å; I1186-T1190 PolarHBondContact O-OG1 3.42Å; I1186-T1190 VanDerWaalsContact O-OG1 3.08Å
1187	V	88.3	Confident	81.4	Confident	82 Å²	82	66.9 Å²	66.9	50%	0.497	37%	0.372	S	S	.	.	H	α-helix	trans	-61.1	-41.9	176.9	172.2	0	0	0	0	111.1	N1183 T1190 L1191	N1183-V1187 WeakPolarHBondContact O-CG2 3.47Å; N1183-V1187 PolarHBondContact O-N 3.05Å; V1187-T1190 WeakPolarHBondContact CA-OG1 3.43Å; V1187-T1190 PolarHBondContact O-N 2.97Å; V1187-T1190 PolarHBondContact O-OG1 2.74Å; V1187-L1191 HydrophobicContact CG1-CD1 4.01Å; V1187-L1191 WeakPolarHBondContact O-CB 3.36Å; V1187-L1191 WeakPolarHBondContact O-CG 3.44Å; V1187-L1191 PolarHBondContact O-N 3.19Å
1188	S	90.3	Very high	83.1	Confident	6 Å²	6	67.2 Å²	67.2	4%	0.042	38%	0.376	C	S	.	.	H	α-helix	trans	-67.4	-39.3	178.7	-159.8	0	0	0	0	112.8	T1184 S1185 I1186 T1192 L1228	T1184-S1188 WeakPolarHBondContact O-CB 3.37Å; T1184-S1188 PolarHBondContact O-N 2.95Å; S1185-S1188 PolarHBondContact O-N 3.02Å; I1186-S1188 VanDerWaalsContact C-N 3.32Å; I1186-S1188 PolarHBondContact O-N 3.19Å; S1188-T1192 PolarHBondContact O-N 3.16Å; S1188-T1192 PolarHBondContact O-OG1 3.31Å; S1188-L1228 WeakPolarHBondContact OG-CA 3.47Å; S1188-L1228 PolarHBondContact OG-O 3.49Å
1189	L	91.4	Very high	84.7	Confident	84 Å²	84	63.9 Å²	63.9	44%	0.44	36%	0.355	S	S	.	.	H	α-helix	trans	-64	-43.9	174	-79.2	165.4	0	0	0	112.3	S1185 I1186 T1192 V1193 A1232	S1185-L1189 PolarHBondContact O-N 3.49Å; I1186-L1189 PolarHBondContact O-N 3.06Å; L1189-T1192 WeakPolarHBondContact O-CB 3.38Å; L1189-T1192 PolarHBondContact O-N 3.36Å; L1189-V1193 WeakPolarHBondContact O-CG2 3.45Å; L1189-V1193 PolarHBondContact O-N 3.12Å; L1189-V1193 VanDerWaalsContact O-N 3.08Å; L1189-A1232 HydrophobicContact CD2-CB 4.08Å; L1189-A1232 HydrophobicContact CG-CB 3.77Å
1190	T	90.2	Very high	86.3	Confident	69 Å²	69	61.6 Å²	61.6	42%	0.423	34%	0.338	S	S	.	.	H	α-helix	trans	-64.9	-42.3	178.6	53	0	0	0	0	112	I1186 V1187 T1192 V1193 L1194	I1186-T1190 HydrophobicContact CG2-CG2 4.45Å; I1186-T1190 WeakPolarHBondContact O-CG2 3.45Å; I1186-T1190 PolarHBondContact O-N 2.85Å; I1186-T1190 PolarHBondContact O-OG1 3.42Å; I1186-T1190 VanDerWaalsContact O-OG1 3.08Å; V1187-T1190 WeakPolarHBondContact CA-OG1 3.43Å; V1187-T1190 PolarHBondContact O-N 2.97Å; V1187-T1190 PolarHBondContact O-OG1 2.74Å; T1190-T1192 VanDerWaalsContact C-N 3.34Å; T1190-T1192 PolarHBondContact O-N 3.18Å; T1190-V1193 PolarHBondContact O-N 3.21Å; T1190-L1194 WeakPolarHBondContact O-CG 3.47Å; T1190-L1194 PolarHBondContact O-N 3.18Å
1191	L	91.2	Very high	87.2	Confident	82 Å²	82	64.6 Å²	64.6	43%	0.429	35%	0.353	S	S	.	.	H	α-helix	trans	-61.5	-39.9	172.9	-77.1	168.9	0	0	0	112.4	V1187 V1193 L1194 L1195 L1228	V1187-L1191 HydrophobicContact CG1-CD1 4.01Å; V1187-L1191 WeakPolarHBondContact O-CB 3.36Å; V1187-L1191 WeakPolarHBondContact O-CG 3.44Å; V1187-L1191 PolarHBondContact O-N 3.19Å; L1191-V1193 VanDerWaalsContact C-N 3.34Å; L1191-V1193 PolarHBondContact O-N 3.43Å; L1191-L1194 PolarHBondContact O-N 3.15Å; L1191-L1195 VanDerWaalsContact O-CB 3.26Å; L1191-L1195 WeakPolarHBondContact O-CB 3.4Å; L1191-L1195 PolarHBondContact O-N 3.04Å; L1191-L1228 HydrophobicContact CB-CD1 3.98Å; L1191-L1228 HydrophobicContact CB-CD2 4.06Å; L1191-L1228 HydrophobicContact CD1-CD2 4.2Å
1192	T	91.8	Very high	87.6	Confident	13 Å²	13	67.1 Å²	67.1	8%	0.08	37%	0.367	C	S	.	.	H	α-helix	trans	-58.8	-46.6	176	-56.4	0	0	0	0	111.1	S1188 L1189 T1190 L1195 F1196 I1225 L1228 L1229	S1188-T1192 PolarHBondContact O-N 3.16Å; S1188-T1192 PolarHBondContact O-OG1 3.31Å; L1189-T1192 WeakPolarHBondContact O-CB 3.38Å; L1189-T1192 PolarHBondContact O-N 3.36Å; T1190-T1192 VanDerWaalsContact C-N 3.34Å; T1190-T1192 PolarHBondContact O-N 3.18Å; T1192-L1195 PolarHBondContact O-N 3.04Å; T1192-F1196 WeakPolarHBondContact O-CB 3.43Å; T1192-F1196 PolarHBondContact O-N 3.43Å; T1192-I1225 HydrophobicContact CG2-CG2 4.16Å; T1192-L1228 WeakPolarHBondContact OG1-CB 3.45Å; T1192-L1229 HydrophobicContact CG2-CD1 4.43Å; T1192-L1229 HydrophobicContact CG2-CD2 3.93Å; T1192-L1229 HydrophobicContact CG2-CG 3.81Å
1193	V	90.6	Very high	87.7	Confident	100 Å²	100	66.8 Å²	66.8	61%	0.606	36%	0.363	S	S	*	.	H	α-helix	trans	-65.1	-44.1	179.2	173	0	0	0	0	111.4	L1189 T1190 L1191 F1196 A1197	L1189-V1193 WeakPolarHBondContact O-CG2 3.45Å; L1189-V1193 PolarHBondContact O-N 3.12Å; L1189-V1193 VanDerWaalsContact O-N 3.08Å; T1190-V1193 PolarHBondContact O-N 3.21Å; L1191-V1193 VanDerWaalsContact C-N 3.34Å; L1191-V1193 PolarHBondContact O-N 3.43Å; V1193-F1196 PolarHBondContact O-N 3.08Å; V1193-A1197 WeakPolarHBondContact O-CB 3.04Å; V1193-A1197 PolarHBondContact O-N 2.9Å
1194	L	91.2	Very high	87.7	Confident	115 Å²	115	67.9 Å²	67.9	60%	0.602	37%	0.373	S	S	*	.	H	α-helix	trans	-63.8	-43.5	177.9	-72.6	171.5	0	0	0	112.1	T1190 L1191 A1197 A1198	T1190-L1194 WeakPolarHBondContact O-CG 3.47Å; T1190-L1194 PolarHBondContact O-N 3.18Å; L1191-L1194 PolarHBondContact O-N 3.15Å; L1194-A1197 PolarHBondContact O-N 2.75Å; L1194-A1198 WeakPolarHBondContact O-CB 3.23Å; L1194-A1198 PolarHBondContact O-N 2.9Å
1195	L	90.7	Very high	87.4	Confident	38 Å²	38	71.2 Å²	71.2	20%	0.199	39%	0.385	C	S	.	.	H	α-helix	trans	-64.3	-44.2	177.9	-175.1	63.2	0	0	0	111.1	L1191 T1192 A1197 A1198 I1199 L1221 N1224 I1225 L1228	L1191-L1195 VanDerWaalsContact O-CB 3.26Å; L1191-L1195 WeakPolarHBondContact O-CB 3.4Å; L1191-L1195 PolarHBondContact O-N 3.04Å; T1192-L1195 PolarHBondContact O-N 3.04Å; L1195-A1197 VanDerWaalsContact C-N 3.34Å; L1195-A1197 PolarHBondContact O-N 3.18Å; L1195-A1198 WeakPolarHBondContact O-CB 3.3Å; L1195-A1198 PolarHBondContact O-N 2.86Å; L1195-I1199 HydrophobicContact CG-CD1 4.5Å; L1195-I1199 WeakPolarHBondContact O-CG1 3.3Å; L1195-I1199 PolarHBondContact O-N 3.19Å; L1195-L1221 HydrophobicContact CD1-CD2 3.87Å; L1195-N1224 HydrophobicContact CD2-CB 3.57Å; L1195-I1225 HydrophobicContact CB-CG1 4.47Å; L1195-I1225 HydrophobicContact CD2-CG1 3.67Å; L1195-I1225 HydrophobicContact CG-CG1 4.05Å; L1195-L1228 HydrophobicContact CD2-CD1 3.99Å
1196	F	90.4	Very high	86.8	Confident	77 Å²	77	71.5 Å²	71.5	34%	0.338	39%	0.386	S	S	.	.	H	α-helix	trans	-62.2	-41.5	175	-175.5	-102.1	0	0	0	112	T1192 V1193 A1198 I1199 R1200 I1225 A1263	T1192-F1196 WeakPolarHBondContact O-CB 3.43Å; T1192-F1196 PolarHBondContact O-N 3.43Å; V1193-F1196 PolarHBondContact O-N 3.08Å; F1196-A1198 VanDerWaalsContact C-N 3.34Å; F1196-A1198 PolarHBondContact O-N 3.44Å; F1196-I1199 PolarHBondContact O-N 2.85Å; F1196-R1200 HydrophobicContact CD1-CG 4.45Å; F1196-R1200 HydrophobicContact CE1-CG 4.18Å; F1196-R1200 HydrophobicContact CZ-CG 4.43Å; F1196-R1200 WeakPolarHBondContact O-CG 3.41Å; F1196-R1200 PolarHBondContact O-N 2.77Å; F1196-R1200 VanDerWaalsContact O-N 3.09Å; F1196-I1225 HydrophobicContact CB-CD1 4.05Å; F1196-I1225 HydrophobicContact CD2-CD1 4Å; F1196-A1263 HydrophobicContact CD2-CB 3.94Å; F1196-A1263 HydrophobicContact CE2-CB 4Å
1197	A	87.9	Confident	86.1	Confident	44 Å²	44	69.3 Å²	69.3	36%	0.364	38%	0.378	S	S	.	.	H	α-helix	trans	-61.8	-40.5	174.3	0	0	0	0	0	112.1	V1193 L1194 L1195 R1200 L1201	V1193-A1197 WeakPolarHBondContact O-CB 3.04Å; V1193-A1197 PolarHBondContact O-N 2.9Å; L1194-A1197 PolarHBondContact O-N 2.75Å; L1195-A1197 VanDerWaalsContact C-N 3.34Å; L1195-A1197 PolarHBondContact O-N 3.18Å; A1197-R1200 PolarHBondContact O-N 3.44Å; A1197-L1201 WeakPolarHBondContact O-CG 3.36Å; A1197-L1201 PolarHBondContact O-N 2.98Å
1198	A	86.1	Confident	85.2	Confident	42 Å²	42	66.9 Å²	66.9	35%	0.347	37%	0.367	S	S	.	.	H	α-helix	trans	-63.9	-43.9	175.8	0	0	0	0	0	112.4	L1194 L1195 F1196 R1200 L1201 M1202	L1194-A1198 WeakPolarHBondContact O-CB 3.23Å; L1194-A1198 PolarHBondContact O-N 2.9Å; L1195-A1198 WeakPolarHBondContact O-CB 3.3Å; L1195-A1198 PolarHBondContact O-N 2.86Å; F1196-A1198 VanDerWaalsContact C-N 3.34Å; F1196-A1198 PolarHBondContact O-N 3.44Å; A1198-R1200 PolarHBondContact O-N 2.88Å; A1198-L1201 PolarHBondContact O-N 3.38Å; A1198-M1202 WeakPolarHBondContact O-CG 3.11Å; A1198-M1202 PolarHBondContact O-N 3.2Å
1199	I	86	Confident	84	Confident	2 Å²	2	75 Å²	75	1%	0.01	40%	0.404	C	S	.	.	H	α-helix	trans	-57.3	-39.9	174.3	-67.7	170.5	0	0	0	110.7	L1195 F1196 M1202 Q1203 L1221 I1225 V1267	L1195-I1199 HydrophobicContact CG-CD1 4.5Å; L1195-I1199 WeakPolarHBondContact O-CG1 3.3Å; L1195-I1199 PolarHBondContact O-N 3.19Å; F1196-I1199 PolarHBondContact O-N 2.85Å; I1199-M1202 PolarHBondContact O-N 3.24Å; I1199-Q1203 PolarHBondContact O-N 3.09Å; I1199-Q1203 VanDerWaalsContact O-N 3.11Å; I1199-L1221 HydrophobicContact CD1-CB 3.62Å; I1199-L1221 HydrophobicContact CG1-CB 3.79Å; I1199-L1221 HydrophobicContact CG1-CD1 3.98Å; I1199-L1221 HydrophobicContact CG1-CG 4.41Å; I1199-I1225 HydrophobicContact CD1-CD1 3.45Å; I1199-I1225 VanDerWaalsContact CD1-CD1 3.45Å; I1199-I1225 HydrophobicContact CD1-CG1 4.35Å; I1199-V1267 HydrophobicContact CG2-CG2 3.31Å
1200	R	87.4	Confident	82.8	Confident	101 Å²	101	77.5 Å²	77.5	38%	0.381	42%	0.423	S	S	.	.	H	α-helix	trans	-69.3	-40.1	177.6	-69.1	-56.7	-172.1	152.7	6.7	113.6	F1196 A1197 A1198 M1202 Q1203 T1266	F1196-R1200 HydrophobicContact CD1-CG 4.45Å; F1196-R1200 HydrophobicContact CE1-CG 4.18Å; F1196-R1200 HydrophobicContact CZ-CG 4.43Å; F1196-R1200 WeakPolarHBondContact O-CG 3.41Å; F1196-R1200 PolarHBondContact O-N 2.77Å; F1196-R1200 VanDerWaalsContact O-N 3.09Å; A1197-R1200 PolarHBondContact O-N 3.44Å; A1198-R1200 PolarHBondContact O-N 2.88Å; R1200-M1202 VanDerWaalsContact C-N 3.27Å; R1200-M1202 PolarHBondContact O-N 3.15Å; R1200-Q1203 WeakPolarHBondContact O-CB 3.04Å; R1200-Q1203 PolarHBondContact O-N 3.47Å; R1200-T1266 VanDerWaalsContact NH2-CB 3.25Å
1201	L	86	Confident	81.7	Confident	146 Å²	146	77.2 Å²	77.2	76%	0.764	42%	0.424	S	S	*	.	H	α-helix	trans	-63.9	-35.1	175.5	-73.3	166.7	0	0	0	111.9	A1197 A1198	A1197-L1201 WeakPolarHBondContact O-CG 3.36Å; A1197-L1201 PolarHBondContact O-N 2.98Å; A1198-L1201 PolarHBondContact O-N 3.38Å
1202	M	82.6	Confident	80.9	Confident	86 Å²	86	82.8 Å²	82.8	42%	0.424	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	8.4	-178.5	-61.7	-173.4	72.2	0	0	113.9	A1198 I1199 R1200 T1204 Q1205 L1206	A1198-M1202 WeakPolarHBondContact O-CG 3.11Å; A1198-M1202 PolarHBondContact O-N 3.2Å; I1199-M1202 PolarHBondContact O-N 3.24Å; R1200-M1202 VanDerWaalsContact C-N 3.27Å; R1200-M1202 PolarHBondContact O-N 3.15Å; M1202-T1204 VanDerWaalsContact C-N 3.29Å; M1202-T1204 PolarHBondContact O-N 3.17Å; M1202-Q1205 PolarHBondContact O-N 3.43Å; M1202-L1206 HydrophobicContact CB-CD1 3.75Å; M1202-L1206 HydrophobicContact CB-CG 4.11Å; M1202-L1206 WeakPolarHBondContact O-CG 3.38Å; M1202-L1206 PolarHBondContact O-N 3.39Å
1203	Q	82.7	Confident	80.3	Confident	72 Å²	72	87.5 Å²	87.5	34%	0.336	47%	0.468	S	S	.	.	H	α-helix	trans	-55.7	-40	-171.8	-173.3	-178.2	-13.2	0	0	113.1	I1199 R1200 Q1205 S1207 T1266	I1199-Q1203 PolarHBondContact O-N 3.09Å; I1199-Q1203 VanDerWaalsContact O-N 3.11Å; R1200-Q1203 WeakPolarHBondContact O-CB 3.04Å; R1200-Q1203 PolarHBondContact O-N 3.47Å; Q1203-Q1205 VanDerWaalsContact C-N 3.34Å; Q1203-Q1205 PolarHBondContact O-N 3.23Å; Q1203-S1207 VanDerWaalsContact O-CB 3.29Å; Q1203-S1207 WeakPolarHBondContact O-CB 3.32Å; Q1203-S1207 PolarHBondContact O-N 3.06Å; Q1203-S1207 PolarHBondContact O-OG 3.27Å; Q1203-T1266 VanDerWaalsContact CD-O 3.32Å; Q1203-T1266 PolarHBondContact NE2-O 2.99Å
1204	T	79.2	Confident	79.9	Confident	118 Å²	118	83.7 Å²	83.7	72%	0.724	45%	0.446	S	S	*	.	H	α-helix	trans	-69.6	-29.2	178.7	50.4	0	0	0	0	113.1	M1202 S1207	M1202-T1204 VanDerWaalsContact C-N 3.29Å; M1202-T1204 PolarHBondContact O-N 3.17Å; T1204-S1207 PolarHBondContact O-OG 3.3Å
1205	Q	78.8	Confident	79.4	Confident	130 Å²	130	78.7 Å²	78.7	61%	0.607	42%	0.42	S	S	*	.	H	α-helix	trans	-82.6	-37.1	177.1	-65.7	-175.5	-20.1	0	0	111.5	M1202 Q1203 S1207 P1214	M1202-Q1205 PolarHBondContact O-N 3.43Å; Q1203-Q1205 VanDerWaalsContact C-N 3.34Å; Q1203-Q1205 PolarHBondContact O-N 3.23Å; Q1205-S1207 VanDerWaalsContact C-N 3.31Å; Q1205-P1214 WeakPolarHBondContact O-CB 3.26Å
1206	L	73.7	Confident	79.1	Confident	8 Å²	8	82.5 Å²	82.5	4%	0.042	44%	0.436	C	S	.	.	H	α-helix	trans	-76.3	-16.2	179.1	-67	167.4	0	0	0	113.2	M1202 P1214 L1217 L1221 V1267	M1202-L1206 HydrophobicContact CB-CD1 3.75Å; M1202-L1206 HydrophobicContact CB-CG 4.11Å; M1202-L1206 WeakPolarHBondContact O-CG 3.38Å; M1202-L1206 PolarHBondContact O-N 3.39Å; L1206-P1214 CarbonylContact O-C 3.59Å; L1206-P1214 VanDerWaalsContact O-C 3.31Å; L1206-P1214 WeakPolarHBondContact O-CB 3.43Å; L1206-L1217 HydrophobicContact CD2-CB 3.73Å; L1206-L1221 HydrophobicContact CD1-CD1 4.02Å; L1206-L1221 HydrophobicContact CD2-CD1 4.44Å; L1206-V1267 HydrophobicContact CB-CG1 3.45Å; L1206-V1267 VanDerWaalsContact CB-CG1 3.45Å
1207	S	71.4	Confident	78.8	Confident	40 Å²	40	82.3 Å²	82.3	28%	0.28	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	3.9	175.8	54.2	0	0	0	0	114.5	Q1203 T1204 Q1205 E1209	Q1203-S1207 VanDerWaalsContact O-CB 3.29Å; Q1203-S1207 WeakPolarHBondContact O-CB 3.32Å; Q1203-S1207 PolarHBondContact O-N 3.06Å; Q1203-S1207 PolarHBondContact O-OG 3.27Å; T1204-S1207 PolarHBondContact O-OG 3.3Å; Q1205-S1207 VanDerWaalsContact C-N 3.31Å; S1207-E1209 PolarHBondContact O-N 3.29Å
1208	A	70.8	Confident	78.6	Confident	32 Å²	32	80.2 Å²	80.2	26%	0.264	42%	0.42	S	S	.	.			trans	-68	120.9	-176	0	0	0	0	0	112.9	T1210	A1208-T1210 PolarHBondContact O-N 2.97Å
1209	E	64.9	Low	78.6	Confident	176 Å²	176	78.3 Å²	78.3	82%	0.822	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	1.3	-177.9	-66	-176.6	162.3	0	0	114.4	S1207 S1211	S1207-E1209 PolarHBondContact O-N 3.29Å; E1209-S1211 PolarHBondContact O-N 2.9Å
1210	T	65.8	Low	78.7	Confident	137 Å²	137	83.7 Å²	83.7	84%	0.84	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-13.5	-173.2	51.7	0	0	0	0	114.3	A1208	A1208-T1210 PolarHBondContact O-N 2.97Å
1211	S	67.7	Low	78.8	Confident	62 Å²	62	80.5 Å²	80.5	43%	0.434	42%	0.418	S	S	.	.			trans	-154.2	162	173	72.7	0	0	0	0	111.9	E1209 L1213 P1214	E1209-S1211 PolarHBondContact O-N 2.9Å; S1211-L1213 PolarHBondContact O-N 3.11Å; S1211-P1214 VanDerWaalsContact O-CD 3.31Å; S1211-P1214 WeakPolarHBondContact O-CD 3.42Å; S1211-P1214 WeakPolarHBondContact OG-CD 3.39Å
1212	K	72.9	Confident	78.8	Confident	199 Å²	199	73.6 Å²	73.6	87%	0.865	38%	0.382	S	S	*	.	S	Bend	trans	-73.3	-11.2	179	-65.7	-176.6	179.2	-179.3	0	113.9
1213	L	80.6	Confident	79.2	Confident	112 Å²	112	71.3 Å²	71.3	59%	0.586	38%	0.375	S	S	*	.	H	α-helix	trans	-77.9	-42.7	-169.7	-166.1	75.5	0	0	0	114.2	S1211 F1216 L1217	S1211-L1213 PolarHBondContact O-N 3.11Å; L1213-F1216 WeakPolarHBondContact O-CB 3.3Å; L1213-F1216 PolarHBondContact O-N 3.41Å; L1213-L1217 HydrophobicContact CD2-CD1 4.41Å; L1213-L1217 HydrophobicContact CG-CD1 4.02Å; L1213-L1217 PolarHBondContact O-N 2.84Å
1214	P	80.8	Confident	79.5	Confident	20 Å²	20	70.4 Å²	70.4	13%	0.13	37%	0.372	C	S	.	.	H	α-helix	trans	-62.6	-42.7	-177.8	-19.3	30.2	0	0	0	114.4	Q1205 L1206 S1211 F1216 L1217 G1218	Q1205-P1214 WeakPolarHBondContact O-CB 3.26Å; L1206-P1214 CarbonylContact O-C 3.59Å; L1206-P1214 VanDerWaalsContact O-C 3.31Å; L1206-P1214 WeakPolarHBondContact O-CB 3.43Å; S1211-P1214 VanDerWaalsContact O-CD 3.31Å; S1211-P1214 WeakPolarHBondContact O-CD 3.42Å; S1211-P1214 WeakPolarHBondContact OG-CD 3.39Å; P1214-F1216 VanDerWaalsContact C-N 3.28Å; P1214-F1216 PolarHBondContact O-N 3.12Å; P1214-L1217 PolarHBondContact O-N 3.35Å; P1214-G1218 PolarHBondContact O-N 3.19Å
1215	P	80.1	Confident	80.1	Confident	11 Å²	11	65 Å²	65	7%	0.071	34%	0.339	C	S	.	.	H	α-helix	trans	-64.2	-30.8	173.9	-24.2	35.4	0	0	0	113.8	G1218 G1219 I1270 S1271 L1274	P1215-G1218 PolarHBondContact O-N 3.2Å; P1215-G1219 PolarHBondContact O-N 3.29Å; P1215-G1219 VanDerWaalsContact O-N 3.12Å; P1215-I1270 HydrophobicContact CB-CB 4.23Å; P1215-I1270 HydrophobicContact CB-CG2 4.04Å; P1215-S1271 WeakPolarHBondContact CA-OG 3.46Å; P1215-S1271 PolarHBondContact O-OG 2.6Å; P1215-L1274 HydrophobicContact CB-CD1 4.16Å
1216	F	85.2	Confident	80.7	Confident	118 Å²	118	61.1 Å²	61.1	52%	0.518	32%	0.32	S	S	.	.	H	α-helix	trans	-67.9	-44.7	175	-178.6	-87.8	0	0	0	111.8	L1213 P1214 G1218 G1219 F1220 L1274	L1213-F1216 WeakPolarHBondContact O-CB 3.3Å; L1213-F1216 PolarHBondContact O-N 3.41Å; P1214-F1216 VanDerWaalsContact C-N 3.28Å; P1214-F1216 PolarHBondContact O-N 3.12Å; F1216-G1218 PolarHBondContact O-N 2.98Å; F1216-G1219 PolarHBondContact O-N 3.38Å; F1216-G1219 VanDerWaalsContact O-N 3.16Å; F1216-F1220 PolarHBondContact O-N 3.28Å; F1216-L1274 HydrophobicContact CB-CD1 4.2Å; F1216-L1274 HydrophobicContact CD2-CD2 4.4Å
1217	L	84.2	Confident	81.6	Confident	73 Å²	73	65.2 Å²	65.2	38%	0.382	34%	0.341	S	S	.	.	H	α-helix	trans	-58	-38.2	170.3	-90.7	135.9	0	0	0	111.6	L1206 L1213 P1214 F1220 L1221	L1206-L1217 HydrophobicContact CD2-CB 3.73Å; L1213-L1217 HydrophobicContact CD2-CD1 4.41Å; L1213-L1217 HydrophobicContact CG-CD1 4.02Å; L1213-L1217 PolarHBondContact O-N 2.84Å; P1214-L1217 PolarHBondContact O-N 3.35Å; L1217-F1220 PolarHBondContact O-N 3.47Å; L1217-L1221 WeakPolarHBondContact O-CB 3.21Å; L1217-L1221 VanDerWaalsContact O-CG 3.22Å; L1217-L1221 WeakPolarHBondContact O-CG 3.35Å; L1217-L1221 PolarHBondContact O-N 3.33Å
1218	G	84	Confident	82.6	Confident	0 Å²	0	65 Å²	65	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-59.6	-44.1	173.4	0	0	0	0	0	113.8	P1214 P1215 F1216 G1222	P1214-G1218 PolarHBondContact O-N 3.19Å; P1215-G1218 PolarHBondContact O-N 3.2Å; F1216-G1218 PolarHBondContact O-N 2.98Å; G1218-G1222 PolarHBondContact O-N 3.29Å; G1218-G1222 VanDerWaalsContact O-N 3.13Å
1219	G	86.2	Confident	83.6	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.01	33%	0.33	C	S	.	.	H	α-helix	trans	-65.9	-44.2	175.4	0	0	0	0	0	112.6	P1215 F1216 L1221 G1222 S1223	P1215-G1219 PolarHBondContact O-N 3.29Å; P1215-G1219 VanDerWaalsContact O-N 3.12Å; F1216-G1219 PolarHBondContact O-N 3.38Å; F1216-G1219 VanDerWaalsContact O-N 3.16Å; G1219-L1221 PolarHBondContact O-N 3.38Å; G1219-G1222 WeakPolarHBondContact O-CA 3.49Å; G1219-G1222 PolarHBondContact O-N 3.46Å; G1219-G1222 VanDerWaalsContact O-N 3.14Å; G1219-S1223 PolarHBondContact O-N 2.96Å
1220	F	88.2	Confident	85	Confident	116 Å²	116	58.6 Å²	58.6	51%	0.509	30%	0.303	S	S	.	.	H	α-helix	trans	-60.9	-41.3	175.7	177.5	-100.1	0	0	0	112.9	F1216 L1217 G1222 S1223 N1224	F1216-F1220 PolarHBondContact O-N 3.28Å; L1217-F1220 PolarHBondContact O-N 3.47Å; F1220-G1222 VanDerWaalsContact C-N 3.31Å; F1220-G1222 PolarHBondContact O-N 2.84Å; F1220-S1223 PolarHBondContact O-N 3.26Å; F1220-S1223 PolarHBondContact O-OG 2.73Å; F1220-N1224 WeakPolarHBondContact CE1-ND2 3.48Å; F1220-N1224 WeakPolarHBondContact CZ-ND2 3.34Å; F1220-N1224 PolarHBondContact O-N 3.1Å; F1220-N1224 PolarHBondContact O-ND2 3.42Å
1221	L	88.2	Confident	86.1	Confident	34 Å²	34	54.7 Å²	54.7	18%	0.178	28%	0.279	C	S	.	.	H	α-helix	trans	-68.1	-33.5	176	-67.5	167.6	0	0	0	111.5	L1195 I1199 L1206 L1217 G1219 S1223 N1224 I1225	L1195-L1221 HydrophobicContact CD1-CD2 3.87Å; I1199-L1221 HydrophobicContact CD1-CB 3.62Å; I1199-L1221 HydrophobicContact CG1-CB 3.79Å; I1199-L1221 HydrophobicContact CG1-CD1 3.98Å; I1199-L1221 HydrophobicContact CG1-CG 4.41Å; L1206-L1221 HydrophobicContact CD1-CD1 4.02Å; L1206-L1221 HydrophobicContact CD2-CD1 4.44Å; L1217-L1221 WeakPolarHBondContact O-CB 3.21Å; L1217-L1221 VanDerWaalsContact O-CG 3.22Å; L1217-L1221 WeakPolarHBondContact O-CG 3.35Å; L1217-L1221 PolarHBondContact O-N 3.33Å; G1219-L1221 PolarHBondContact O-N 3.38Å; L1221-S1223 VanDerWaalsContact C-N 3.35Å; L1221-N1224 PolarHBondContact O-N 2.86Å; L1221-I1225 PolarHBondContact O-N 3.3Å
1222	G	86.6	Confident	87.2	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-63.6	-35	172.1	0	0	0	0	0	113.7	G1218 G1219 F1220 I1225 F1226 W1275	G1218-G1222 PolarHBondContact O-N 3.29Å; G1218-G1222 VanDerWaalsContact O-N 3.13Å; G1219-G1222 WeakPolarHBondContact O-CA 3.49Å; G1219-G1222 PolarHBondContact O-N 3.46Å; G1219-G1222 VanDerWaalsContact O-N 3.14Å; F1220-G1222 VanDerWaalsContact C-N 3.31Å; F1220-G1222 PolarHBondContact O-N 2.84Å; G1222-I1225 PolarHBondContact O-N 3.26Å; G1222-F1226 PolarHBondContact O-N 2.81Å; G1222-W1275 PolarHBondContact O-NE1 2.83Å
1223	S	90.5	Very high	88	Confident	39 Å²	39	44.4 Å²	44.4	27%	0.273	23%	0.231	S	C	.	.	H	α-helix	trans	-72.8	-33.4	177.6	68.5	0	0	0	0	112	G1219 F1220 L1221 F1226 I1227 W1275	G1219-S1223 PolarHBondContact O-N 2.96Å; F1220-S1223 PolarHBondContact O-N 3.26Å; F1220-S1223 PolarHBondContact O-OG 2.73Å; L1221-S1223 VanDerWaalsContact C-N 3.35Å; S1223-F1226 WeakPolarHBondContact O-CB 3.4Å; S1223-F1226 PolarHBondContact O-N 2.86Å; S1223-I1227 WeakPolarHBondContact O-CG1 3.42Å; S1223-I1227 PolarHBondContact O-N 3.29Å; S1223-I1227 VanDerWaalsContact O-N 3.13Å; S1223-W1275 VanDerWaalsContact N-CD1 3.32Å
1224	N	90	Very high	88.4	Confident	52 Å²	52	40.4 Å²	40.4	28%	0.278	21%	0.212	S	C	.	.	H	α-helix	trans	-64.7	-37.6	172.3	-77.5	-86.2	0	0	0	112.3	L1195 F1220 L1221 F1226 I1227 L1228	L1195-N1224 HydrophobicContact CD2-CB 3.57Å; F1220-N1224 WeakPolarHBondContact CE1-ND2 3.48Å; F1220-N1224 WeakPolarHBondContact CZ-ND2 3.34Å; F1220-N1224 PolarHBondContact O-N 3.1Å; F1220-N1224 PolarHBondContact O-ND2 3.42Å; L1221-N1224 PolarHBondContact O-N 2.86Å; N1224-F1226 VanDerWaalsContact C-N 3.33Å; N1224-F1226 PolarHBondContact O-N 2.82Å; N1224-I1227 PolarHBondContact O-N 3.27Å; N1224-L1228 WeakPolarHBondContact O-CG 3.3Å; N1224-L1228 PolarHBondContact O-N 3.07Å; N1224-L1228 VanDerWaalsContact O-N 3.07Å
1225	I	91	Very high	88.7	Confident	5 Å²	5	40.6 Å²	40.6	3%	0.026	21%	0.212	C	C	.	.	H	α-helix	trans	-60.8	-42.4	172.8	-73.9	177.5	0	0	0	111.3	T1192 L1195 F1196 I1199 L1221 G1222 L1228 L1229 A1263	T1192-I1225 HydrophobicContact CG2-CG2 4.16Å; L1195-I1225 HydrophobicContact CB-CG1 4.47Å; L1195-I1225 HydrophobicContact CD2-CG1 3.67Å; L1195-I1225 HydrophobicContact CG-CG1 4.05Å; F1196-I1225 HydrophobicContact CB-CD1 4.05Å; F1196-I1225 HydrophobicContact CD2-CD1 4Å; I1199-I1225 HydrophobicContact CD1-CD1 3.45Å; I1199-I1225 VanDerWaalsContact CD1-CD1 3.45Å; I1199-I1225 HydrophobicContact CD1-CG1 4.35Å; L1221-I1225 PolarHBondContact O-N 3.3Å; G1222-I1225 PolarHBondContact O-N 3.26Å; I1225-L1228 PolarHBondContact O-N 3.26Å; I1225-L1229 HydrophobicContact CG2-CD1 3.81Å; I1225-L1229 HydrophobicContact CG2-CG 4.44Å; I1225-L1229 WeakPolarHBondContact O-CB 3.38Å; I1225-L1229 WeakPolarHBondContact O-CG 3.39Å; I1225-L1229 PolarHBondContact O-N 3.48Å; I1225-A1263 HydrophobicContact CD1-CB 3.56Å; I1225-A1263 HydrophobicContact CG2-CB 4.35Å
1226	F	92.7	Very high	89.1	Confident	49 Å²	49	43.5 Å²	43.5	22%	0.215	23%	0.227	C	C	.	.	H	α-helix	trans	-60	-46.3	176.7	165.1	-105.5	0	0	0	112.1	G1222 S1223 N1224 L1228 L1229 L1230 V1253 C1256 L1257	G1222-F1226 PolarHBondContact O-N 2.81Å; S1223-F1226 WeakPolarHBondContact O-CB 3.4Å; S1223-F1226 PolarHBondContact O-N 2.86Å; N1224-F1226 VanDerWaalsContact C-N 3.33Å; N1224-F1226 PolarHBondContact O-N 2.82Å; F1226-L1228 PolarHBondContact O-N 2.92Å; F1226-L1229 PolarHBondContact O-N 3.46Å; F1226-L1230 HydrophobicContact CE1-CD2 4.48Å; F1226-L1230 HydrophobicContact CZ-CD2 4.1Å; F1226-L1230 WeakPolarHBondContact O-CB 3.27Å; F1226-L1230 PolarHBondContact O-N 3.07Å; F1226-V1253 HydrophobicContact CE2-CG1 4.41Å; F1226-V1253 HydrophobicContact CZ-CG1 4.41Å; F1226-C1256 HydrophobicContact CD2-CB 3.84Å; F1226-C1256 HydrophobicContact CE2-CB 3.95Å; F1226-L1257 HydrophobicContact CD2-CB 4.34Å; F1226-L1257 HydrophobicContact CE2-CB 4.13Å
1227	I	92.1	Very high	89.2	Confident	93 Å²	93	38.8 Å²	38.8	48%	0.477	21%	0.206	S	C	.	.	H	α-helix	trans	-62	-45.2	179.8	-66.2	167	0	0	0	111.1	S1223 N1224 L1230 T1231	S1223-I1227 WeakPolarHBondContact O-CG1 3.42Å; S1223-I1227 PolarHBondContact O-N 3.29Å; S1223-I1227 VanDerWaalsContact O-N 3.13Å; N1224-I1227 PolarHBondContact O-N 3.27Å; I1227-L1230 PolarHBondContact O-N 3.34Å; I1227-T1231 WeakPolarHBondContact O-CB 3.38Å; I1227-T1231 PolarHBondContact O-N 3.28Å; I1227-T1231 PolarHBondContact O-OG1 3.3Å
1228	L	92.5	Very high	89.1	Confident	36 Å²	36	37 Å²	37	19%	0.188	20%	0.196	C	C	.	.	H	α-helix	trans	-67.2	-38.8	-180	-67.6	168.4	0	0	0	112.1	S1188 L1191 T1192 L1195 N1224 I1225 F1226 T1231 A1232	S1188-L1228 WeakPolarHBondContact OG-CA 3.47Å; S1188-L1228 PolarHBondContact OG-O 3.49Å; L1191-L1228 HydrophobicContact CB-CD1 3.98Å; L1191-L1228 HydrophobicContact CB-CD2 4.06Å; L1191-L1228 HydrophobicContact CD1-CD2 4.2Å; T1192-L1228 WeakPolarHBondContact OG1-CB 3.45Å; L1195-L1228 HydrophobicContact CD2-CD1 3.99Å; N1224-L1228 WeakPolarHBondContact O-CG 3.3Å; N1224-L1228 PolarHBondContact O-N 3.07Å; N1224-L1228 VanDerWaalsContact O-N 3.07Å; I1225-L1228 PolarHBondContact O-N 3.26Å; F1226-L1228 PolarHBondContact O-N 2.92Å; L1228-T1231 PolarHBondContact O-N 3.26Å; L1228-A1232 WeakPolarHBondContact O-CB 3.4Å; L1228-A1232 PolarHBondContact O-N 3.44Å
1229	L	92.5	Very high	89	Confident	24 Å²	24	40.7 Å²	40.7	13%	0.126	21%	0.213	C	C	.	.	H	α-helix	trans	-63.9	-45.4	173.7	-78.5	169.5	0	0	0	111.8	T1192 I1225 F1226 T1231 A1232 V1233 C1256 L1259	T1192-L1229 HydrophobicContact CG2-CD1 4.43Å; T1192-L1229 HydrophobicContact CG2-CD2 3.93Å; T1192-L1229 HydrophobicContact CG2-CG 3.81Å; I1225-L1229 HydrophobicContact CG2-CD1 3.81Å; I1225-L1229 HydrophobicContact CG2-CG 4.44Å; I1225-L1229 WeakPolarHBondContact O-CB 3.38Å; I1225-L1229 WeakPolarHBondContact O-CG 3.39Å; I1225-L1229 PolarHBondContact O-N 3.48Å; F1226-L1229 PolarHBondContact O-N 3.46Å; L1229-T1231 VanDerWaalsContact C-N 3.32Å; L1229-T1231 PolarHBondContact O-N 2.99Å; L1229-A1232 WeakPolarHBondContact O-CB 3.39Å; L1229-A1232 PolarHBondContact O-N 3.31Å; L1229-V1233 WeakPolarHBondContact O-CG2 3.43Å; L1229-V1233 PolarHBondContact O-N 3.29Å; L1229-C1256 HydrophobicContact CB-CB 4.08Å; L1229-L1259 HydrophobicContact CD1-CB 3.6Å; L1229-L1259 HydrophobicContact CD1-CD1 3.95Å; L1229-L1259 HydrophobicContact CD1-CG 4.44Å; L1229-L1259 HydrophobicContact CD2-CD1 4.46Å
1230	L	92.4	Very high	88.8	Confident	49 Å²	49	45.7 Å²	45.7	26%	0.257	24%	0.239	S	C	.	.	H	α-helix	trans	-63	-40.7	178.8	-171.8	64.3	0	0	0	111.6	F1226 I1227 V1233 S1234 A1247 V1253	F1226-L1230 HydrophobicContact CE1-CD2 4.48Å; F1226-L1230 HydrophobicContact CZ-CD2 4.1Å; F1226-L1230 WeakPolarHBondContact O-CB 3.27Å; F1226-L1230 PolarHBondContact O-N 3.07Å; I1227-L1230 PolarHBondContact O-N 3.34Å; L1230-V1233 PolarHBondContact O-N 3.4Å; L1230-S1234 VanDerWaalsContact O-CB 3.3Å; L1230-S1234 WeakPolarHBondContact O-CB 3.15Å; L1230-S1234 PolarHBondContact O-N 3.27Å; L1230-A1247 HydrophobicContact CD1-CB 4.42Å; L1230-V1253 HydrophobicContact CD1-CG2 3.86Å
1231	T	90.7	Very high	88.3	Confident	55 Å²	55	46.1 Å²	46.1	34%	0.337	24%	0.241	S	C	.	.	H	α-helix	trans	-64.3	-41.8	176.2	-54	0	0	0	0	111.2	I1227 L1228 L1229 N1235	I1227-T1231 WeakPolarHBondContact O-CB 3.38Å; I1227-T1231 PolarHBondContact O-N 3.28Å; I1227-T1231 PolarHBondContact O-OG1 3.3Å; L1228-T1231 PolarHBondContact O-N 3.26Å; L1229-T1231 VanDerWaalsContact C-N 3.32Å; L1229-T1231 PolarHBondContact O-N 2.99Å; T1231-N1235 WeakPolarHBondContact O-CB 3.43Å; T1231-N1235 VanDerWaalsContact O-CG 3.24Å; T1231-N1235 PolarHBondContact O-N 3.18Å; T1231-N1235 PolarHBondContact O-ND2 3Å
1232	A	90.7	Very high	87.7	Confident	4 Å²	4	48.8 Å²	48.8	3%	0.033	26%	0.255	C	S	.	.	H	α-helix	trans	-61.9	-47.1	176.9	0	0	0	0	0	112.5	S1185 L1189 L1228 L1229 L1236	S1185-A1232 PolarHBondContact OG-O 3.41Å; L1189-A1232 HydrophobicContact CD2-CB 4.08Å; L1189-A1232 HydrophobicContact CG-CB 3.77Å; L1228-A1232 WeakPolarHBondContact O-CB 3.4Å; L1228-A1232 PolarHBondContact O-N 3.44Å; L1229-A1232 WeakPolarHBondContact O-CB 3.39Å; L1229-A1232 PolarHBondContact O-N 3.31Å; A1232-L1236 VanDerWaalsContact O-CB 3.3Å; A1232-L1236 WeakPolarHBondContact O-CB 3.46Å; A1232-L1236 PolarHBondContact O-N 3.27Å
1233	V	89.7	Confident	86.9	Confident	42 Å²	42	51.3 Å²	51.3	26%	0.255	27%	0.269	S	S	.	.	H	α-helix	trans	-65.7	-47.7	179	174.1	0	0	0	0	110.4	L1229 L1230 N1235 L1236 E1237 E1252	L1229-V1233 WeakPolarHBondContact O-CG2 3.43Å; L1229-V1233 PolarHBondContact O-N 3.29Å; L1230-V1233 PolarHBondContact O-N 3.4Å; V1233-N1235 PolarHBondContact O-N 3.26Å; V1233-L1236 WeakPolarHBondContact O-CB 3.28Å; V1233-L1236 PolarHBondContact O-N 2.89Å; V1233-L1236 VanDerWaalsContact O-N 3.17Å; V1233-E1237 HydrophobicContact CG1-CG 4.31Å; V1233-E1237 WeakPolarHBondContact O-CG 3.43Å; V1233-E1237 PolarHBondContact O-N 3.49Å; V1233-E1252 HydrophobicContact CG1-CB 4.14Å; V1233-E1252 HydrophobicContact CG1-CG 4.1Å
1234	S	88.8	Confident	86.2	Confident	28 Å²	28	54.8 Å²	54.8	20%	0.196	29%	0.289	C	S	.	.	H	α-helix	trans	-62.2	-41.6	-178.9	-167.3	0	0	0	0	112.5	L1230 E1237 M1238	L1230-S1234 VanDerWaalsContact O-CB 3.3Å; L1230-S1234 WeakPolarHBondContact O-CB 3.15Å; L1230-S1234 PolarHBondContact O-N 3.27Å; S1234-E1237 PolarHBondContact O-N 3.25Å; S1234-M1238 WeakPolarHBondContact O-CE 3.49Å; S1234-M1238 WeakPolarHBondContact O-CG 3.49Å; S1234-M1238 PolarHBondContact O-N 3.36Å
1235	N	87.1	Confident	85.6	Confident	23 Å²	23	54.5 Å²	54.5	12%	0.123	29%	0.285	C	S	.	.	H	α-helix	trans	-69.3	-34.3	176.9	-70.2	-16	0	0	0	112.2	T1184 T1231 V1233 M1238 E1239	T1184-N1235 WeakPolarHBondContact CB-ND2 3.41Å; T1184-N1235 PolarHBondContact OG1-ND2 3.49Å; T1184-N1235 VanDerWaalsContact OG1-ND2 3.08Å; T1231-N1235 WeakPolarHBondContact O-CB 3.43Å; T1231-N1235 VanDerWaalsContact O-CG 3.24Å; T1231-N1235 PolarHBondContact O-N 3.18Å; T1231-N1235 PolarHBondContact O-ND2 3Å; V1233-N1235 PolarHBondContact O-N 3.26Å; N1235-M1238 VanDerWaalsContact OD1-CE 3.25Å; N1235-M1238 WeakPolarHBondContact OD1-CE 3.27Å; N1235-E1239 PolarHBondContact O-N 3.12Å
1236	L	87.2	Confident	85	Confident	73 Å²	73	61.9 Å²	61.9	38%	0.382	32%	0.319	S	S	.	.	H	α-helix	trans	-68.1	-37.3	174.2	-172.9	68.2	0	0	0	111.5	A1232 V1233 E1239 I1240	A1232-L1236 VanDerWaalsContact O-CB 3.3Å; A1232-L1236 WeakPolarHBondContact O-CB 3.46Å; A1232-L1236 PolarHBondContact O-N 3.27Å; V1233-L1236 WeakPolarHBondContact O-CB 3.28Å; V1233-L1236 PolarHBondContact O-N 2.89Å; V1233-L1236 VanDerWaalsContact O-N 3.17Å; L1236-E1239 WeakPolarHBondContact O-CB 3.49Å; L1236-E1239 PolarHBondContact O-N 3.09Å; L1236-I1240 HydrophobicContact CD1-CD1 4.35Å; L1236-I1240 HydrophobicContact CD2-CD1 4.49Å; L1236-I1240 HydrophobicContact CG-CD1 3.9Å; L1236-I1240 WeakPolarHBondContact O-CD1 3.39Å; L1236-I1240 VanDerWaalsContact O-CG1 3.22Å; L1236-I1240 WeakPolarHBondContact O-CG1 3.48Å; L1236-I1240 PolarHBondContact O-N 2.71Å
1237	E	87.2	Confident	84.4	Confident	19 Å²	19	61 Å²	61	9%	0.089	32%	0.321	C	S	.	.	H	α-helix	trans	-70.7	-37.3	176.8	-72.1	-179.8	149.2	0	0	112.7	V1233 S1234 E1239 I1240 F1241 F1245 A1247 E1252	V1233-E1237 HydrophobicContact CG1-CG 4.31Å; V1233-E1237 WeakPolarHBondContact O-CG 3.43Å; V1233-E1237 PolarHBondContact O-N 3.49Å; S1234-E1237 PolarHBondContact O-N 3.25Å; E1237-E1239 VanDerWaalsContact C-N 3.29Å; E1237-E1239 PolarHBondContact O-N 2.84Å; E1237-I1240 PolarHBondContact O-N 2.83Å; E1237-F1241 HydrophobicContact CB-CD2 4.17Å; E1237-F1241 HydrophobicContact CG-CD2 4.44Å; E1237-F1241 HydrophobicContact CG-CE2 4.39Å; E1237-F1241 WeakPolarHBondContact O-CB 3.24Å; E1237-F1241 WeakPolarHBondContact O-CD2 3.14Å; E1237-F1241 PolarHBondContact O-N 3.47Å; E1237-F1245 HydrophobicContact CB-CD1 3.54Å; E1237-F1245 HydrophobicContact CB-CE1 3.83Å; E1237-F1245 HydrophobicContact CB-CG 4.44Å; E1237-F1245 VanDerWaalsContact CD-CE1 3.47Å; E1237-F1245 HydrophobicContact CG-CD1 4.23Å; E1237-F1245 HydrophobicContact CG-CE1 4Å; E1237-F1245 WeakPolarHBondContact OE2-CE1 3.29Å; E1237-A1247 VanDerWaalsContact OE2-CA 3.27Å; E1237-A1247 WeakPolarHBondContact OE2-CA 3.21Å; E1237-A1247 WeakPolarHBondContact OE2-CB 3.08Å; E1237-E1252 VanDerWaalsContact OE1-CG 3.3Å; E1237-E1252 WeakPolarHBondContact OE1-CG 3.45Å
1238	M	82.3	Confident	84	Confident	35 Å²	35	64.5 Å²	64.5	17%	0.172	33%	0.329	C	S	.	.	H	α-helix	trans	-60.5	-40.1	172	-76.8	-177.6	-98.7	0	0	111.5	S1234 N1235 D1242	S1234-M1238 WeakPolarHBondContact O-CE 3.49Å; S1234-M1238 WeakPolarHBondContact O-CG 3.49Å; S1234-M1238 PolarHBondContact O-N 3.36Å; N1235-M1238 VanDerWaalsContact OD1-CE 3.25Å; N1235-M1238 WeakPolarHBondContact OD1-CE 3.27Å; M1238-D1242 WeakPolarHBondContact CA-O 3.26Å; M1238-D1242 CarbonylContact O-C 3.55Å; M1238-D1242 PolarHBondContact O-N 3.23Å
1239	E	81.8	Confident	83.5	Confident	77 Å²	77	70.4 Å²	70.4	36%	0.36	35%	0.353	S	S	.	.	H	α-helix	trans	-65.1	-37.9	174.1	-173.1	76.9	-160.6	0	0	112.8	H1181 L1182 N1235 L1236 E1237	H1181-E1239 HydrophobicContact CB-CB 4.23Å; H1181-E1239 WeakPolarHBondContact CB-OE2 3.26Å; L1182-E1239 HydrophobicContact CB-CG 4.31Å; L1182-E1239 PolarHBondContact N-OE2 3.03Å; N1235-E1239 PolarHBondContact O-N 3.12Å; L1236-E1239 WeakPolarHBondContact O-CB 3.49Å; L1236-E1239 PolarHBondContact O-N 3.09Å; E1237-E1239 VanDerWaalsContact C-N 3.29Å; E1237-E1239 PolarHBondContact O-N 2.84Å
1240	I	82.5	Confident	83	Confident	106 Å²	106	76.6 Å²	76.6	54%	0.544	38%	0.379	S	S	.	.	H	α-helix	trans	-82.8	-40.7	-174.3	-69.3	167.9	0	0	0	112.6	L1236 E1237	L1236-I1240 HydrophobicContact CD1-CD1 4.35Å; L1236-I1240 HydrophobicContact CD2-CD1 4.49Å; L1236-I1240 HydrophobicContact CG-CD1 3.9Å; L1236-I1240 WeakPolarHBondContact O-CD1 3.39Å; L1236-I1240 VanDerWaalsContact O-CG1 3.22Å; L1236-I1240 WeakPolarHBondContact O-CG1 3.48Å; L1236-I1240 PolarHBondContact O-N 2.71Å; E1237-I1240 PolarHBondContact O-N 2.83Å
1241	F	78.3	Confident	82.6	Confident	126 Å²	126	77.2 Å²	77.2	55%	0.553	39%	0.386	S	S	*	.	H	α-helix	trans	-106.6	-45.9	-166.2	-67.2	-68.3	0	0	0	114	E1237 F1245	E1237-F1241 HydrophobicContact CB-CD2 4.17Å; E1237-F1241 HydrophobicContact CG-CD2 4.44Å; E1237-F1241 HydrophobicContact CG-CE2 4.39Å; E1237-F1241 WeakPolarHBondContact O-CB 3.24Å; E1237-F1241 WeakPolarHBondContact O-CD2 3.14Å; E1237-F1241 PolarHBondContact O-N 3.47Å; F1241-F1245 HydrophobicContact CB-CB 3.88Å; F1241-F1245 HydrophobicContact CB-CD2 3.32Å; F1241-F1245 HydrophobicContact CB-CE2 3.92Å; F1241-F1245 HydrophobicContact CB-CG 3.69Å; F1241-F1245 HydrophobicContact CD1-CD2 4.47Å; F1241-F1245 HydrophobicContact CD1-CE2 4.24Å; F1241-F1245 HydrophobicContact CD2-CD1 4.06Å; F1241-F1245 AromaticContact CD2-CD2 3.77Å; F1241-F1245 HydrophobicContact CD2-CD2 3.77Å; F1241-F1245 AromaticContact CD2-CE1 3.93Å; F1241-F1245 HydrophobicContact CD2-CE1 3.93Å; F1241-F1245 AromaticContact CD2-CE2 3.62Å; F1241-F1245 HydrophobicContact CD2-CE2 3.62Å; F1241-F1245 AromaticContact CD2-CG 3.96Å; F1241-F1245 HydrophobicContact CD2-CG 3.96Å; F1241-F1245 AromaticContact CD2-CZ 3.69Å; F1241-F1245 HydrophobicContact CD2-CZ 3.69Å; F1241-F1245 HydrophobicContact CE2-CE1 4.31Å; F1241-F1245 HydrophobicContact CE2-CE2 4.17Å; F1241-F1245 AromaticContact CE2-CZ 3.93Å; F1241-F1245 HydrophobicContact CE2-CZ 3.93Å; F1241-F1245 AromaticContact CG-CD2 3.62Å; F1241-F1245 HydrophobicContact CG-CD2 3.62Å; F1241-F1245 AromaticContact CG-CE2 3.66Å; F1241-F1245 HydrophobicContact CG-CE2 3.66Å; F1241-F1245 HydrophobicContact CG-CG 4.13Å; F1241-F1245 HydrophobicContact CG-CZ 4.22Å
1242	D	74.6	Confident	82.3	Confident	89 Å²	89	76 Å²	76	48%	0.476	38%	0.376	S	S	.	.			trans	163.4	162.8	172.8	-165.9	11.5	0	0	0	108.4	M1238 T1244 F1245	M1238-D1242 WeakPolarHBondContact CA-O 3.26Å; M1238-D1242 CarbonylContact O-C 3.55Å; M1238-D1242 PolarHBondContact O-N 3.23Å; D1242-T1244 PolarHBondContact O-N 2.74Å; D1242-T1244 PolarHBondContact OD2-OG1 2.98Å; D1242-F1245 WeakPolarHBondContact O-CB 3.36Å; D1242-F1245 PolarHBondContact O-N 3.41Å
1243	D	71	Confident	82.3	Confident	53 Å²	53	77.1 Å²	77.1	28%	0.283	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-13.1	175.8	-68	-11.7	0	0	0	113	H1174 H1181	H1174-D1243 IonicContact CE1-OD2 3.96Å; H1181-D1243 IonicContact CD2-OD1 3.41Å; H1181-D1243 IonicContact NE2-OD1 2.82Å; H1181-D1243 PolarHBondContact NE2-OD1 2.51Å
1244	T	76	Confident	82.2	Confident	113 Å²	113	77.7 Å²	77.7	69%	0.693	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-4.3	-179.9	60.9	0	0	0	0	114.2	D1242	D1242-T1244 PolarHBondContact O-N 2.74Å; D1242-T1244 PolarHBondContact OD2-OG1 2.98Å
1245	F	77.3	Confident	82.2	Confident	46 Å²	46	79.9 Å²	79.9	20%	0.202	40%	0.401	C	S	.	.			trans	-75.4	134.6	-175.8	-163	-85	0	0	0	112.4	E1237 F1241 D1242	E1237-F1245 HydrophobicContact CB-CD1 3.54Å; E1237-F1245 HydrophobicContact CB-CE1 3.83Å; E1237-F1245 HydrophobicContact CB-CG 4.44Å; E1237-F1245 VanDerWaalsContact CD-CE1 3.47Å; E1237-F1245 HydrophobicContact CG-CD1 4.23Å; E1237-F1245 HydrophobicContact CG-CE1 4Å; E1237-F1245 WeakPolarHBondContact OE2-CE1 3.29Å; F1241-F1245 HydrophobicContact CB-CB 3.88Å; F1241-F1245 HydrophobicContact CB-CD2 3.32Å; F1241-F1245 HydrophobicContact CB-CE2 3.92Å; F1241-F1245 HydrophobicContact CB-CG 3.69Å; F1241-F1245 HydrophobicContact CD1-CD2 4.47Å; F1241-F1245 HydrophobicContact CD1-CE2 4.24Å; F1241-F1245 HydrophobicContact CD2-CD1 4.06Å; F1241-F1245 AromaticContact CD2-CD2 3.77Å; F1241-F1245 HydrophobicContact CD2-CD2 3.77Å; F1241-F1245 AromaticContact CD2-CE1 3.93Å; F1241-F1245 HydrophobicContact CD2-CE1 3.93Å; F1241-F1245 AromaticContact CD2-CE2 3.62Å; F1241-F1245 HydrophobicContact CD2-CE2 3.62Å; F1241-F1245 AromaticContact CD2-CG 3.96Å; F1241-F1245 HydrophobicContact CD2-CG 3.96Å; F1241-F1245 AromaticContact CD2-CZ 3.69Å; F1241-F1245 HydrophobicContact CD2-CZ 3.69Å; F1241-F1245 HydrophobicContact CE2-CE1 4.31Å; F1241-F1245 HydrophobicContact CE2-CE2 4.17Å; F1241-F1245 AromaticContact CE2-CZ 3.93Å; F1241-F1245 HydrophobicContact CE2-CZ 3.93Å; F1241-F1245 AromaticContact CG-CD2 3.62Å; F1241-F1245 HydrophobicContact CG-CD2 3.62Å; F1241-F1245 AromaticContact CG-CE2 3.66Å; F1241-F1245 HydrophobicContact CG-CE2 3.66Å; F1241-F1245 HydrophobicContact CG-CG 4.13Å; F1241-F1245 HydrophobicContact CG-CZ 4.22Å; D1242-F1245 WeakPolarHBondContact O-CB 3.36Å; D1242-F1245 PolarHBondContact O-N 3.41Å
1246	Q	78.8	Confident	82.4	Confident	160 Å²	160	79 Å²	79	75%	0.748	40%	0.396	S	S	*	.			trans	-118.8	132.7	178.9	-65	-177.5	-7.2	0	0	110.7	R1248	Q1246-R1248 PolarHBondContact O-N 2.75Å
1247	A	79.7	Confident	82.6	Confident	31 Å²	31	79.1 Å²	79.1	26%	0.256	40%	0.397	S	S	.	.			trans	-57.8	130	176.7	0	0	0	0	0	111.5	L1230 E1237	L1230-A1247 HydrophobicContact CD1-CB 4.42Å; E1237-A1247 VanDerWaalsContact OE2-CA 3.27Å; E1237-A1247 WeakPolarHBondContact OE2-CA 3.21Å; E1237-A1247 WeakPolarHBondContact OE2-CB 3.08Å
1248	R	83.4	Confident	82.7	Confident	166 Å²	166	84.2 Å²	84.2	63%	0.626	42%	0.419	S	S	*	.			trans	-86.8	162	-176.8	-60.9	178.4	179.3	-179.8	1.2	111.4	Q1246 F1250 E1252 V1253	Q1246-R1248 PolarHBondContact O-N 2.75Å; R1248-F1250 VanDerWaalsContact C-N 3.3Å; R1248-F1250 PolarHBondContact O-N 2.8Å; R1248-E1252 WeakPolarHBondContact CB-OE2 3.47Å; R1248-E1252 PolarHBondContact N-OE2 3.08Å; R1248-V1253 VanDerWaalsContact O-CG2 3.32Å; R1248-V1253 WeakPolarHBondContact O-CG2 3.39Å; R1248-V1253 PolarHBondContact O-N 3.26Å
1249	F	81.1	Confident	83	Confident	160 Å²	160	86.5 Å²	86.5	70%	0.702	43%	0.431	S	S	*	.	I	π-helix	trans	-63.9	-36	178.8	-176.9	-102.6	0	0	0	112.4	V1253 V1254	F1249-V1253 HydrophobicContact CD2-CG1 4.4Å; F1249-V1254 HydrophobicContact CE1-CG2 4.31Å; F1249-V1254 WeakPolarHBondContact O-CG2 3.28Å; F1249-V1254 PolarHBondContact O-N 2.86Å
1250	F	82.2	Confident	83.3	Confident	153 Å²	153	82.8 Å²	82.8	67%	0.671	41%	0.414	S	S	*	.	I	π-helix	trans	-134.7	132.4	175.5	-173.9	-85.3	0	0	0	109.3	R1248 E1252 V1254	R1248-F1250 VanDerWaalsContact C-N 3.3Å; R1248-F1250 PolarHBondContact O-N 2.8Å; F1250-E1252 VanDerWaalsContact C-OE2 3.24Å; F1250-V1254 HydrophobicContact CD2-CB 4.25Å; F1250-V1254 HydrophobicContact CD2-CG1 4.42Å; F1250-V1254 HydrophobicContact CD2-CG2 4.13Å
1251	P	84.4	Confident	83.6	Confident	62 Å²	62	78.8 Å²	78.8	40%	0.403	40%	0.397	S	S	.	.	I	π-helix	cis	-87.6	-10.4	4.6	34.3	-38.4	0	0	0	116.8	C1255	P1251-C1255 WeakPolarHBondContact O-CB 3.46Å; P1251-C1255 PolarHBondContact O-N 2.8Å; P1251-C1255 PolarHBondContact O-SG 3.31Å
1252	E	85.4	Confident	84.1	Confident	30 Å²	30	76.5 Å²	76.5	14%	0.14	39%	0.39	C	S	.	.	I	π-helix	trans	-69.7	-57.8	-160.2	-56.1	77.2	-170.3	0	0	112.8	V1233 E1237 R1248 F1250 V1254 C1255 C1256	V1233-E1252 HydrophobicContact CG1-CB 4.14Å; V1233-E1252 HydrophobicContact CG1-CG 4.1Å; E1237-E1252 VanDerWaalsContact OE1-CG 3.3Å; E1237-E1252 WeakPolarHBondContact OE1-CG 3.45Å; R1248-E1252 WeakPolarHBondContact CB-OE2 3.47Å; R1248-E1252 PolarHBondContact N-OE2 3.08Å; F1250-E1252 VanDerWaalsContact C-OE2 3.24Å; E1252-V1254 VanDerWaalsContact C-N 3.31Å; E1252-V1254 PolarHBondContact O-N 2.98Å; E1252-C1255 PolarHBondContact O-N 2.89Å; E1252-C1256 PolarHBondContact O-N 2.61Å; E1252-C1256 PolarHBondContact O-SG 3.32Å
1253	V	89	Confident	84.6	Confident	28 Å²	28	72.3 Å²	72.3	17%	0.17	37%	0.368	C	S	.	.	I	π-helix	trans	-62.1	-42.1	179.7	173.7	0	0	0	0	110.1	F1226 L1230 R1248 F1249 C1255 C1256 L1257	F1226-V1253 HydrophobicContact CE2-CG1 4.41Å; F1226-V1253 HydrophobicContact CZ-CG1 4.41Å; L1230-V1253 HydrophobicContact CD1-CG2 3.86Å; R1248-V1253 VanDerWaalsContact O-CG2 3.32Å; R1248-V1253 WeakPolarHBondContact O-CG2 3.39Å; R1248-V1253 PolarHBondContact O-N 3.26Å; F1249-V1253 HydrophobicContact CD2-CG1 4.4Å; V1253-C1255 PolarHBondContact O-N 2.84Å; V1253-C1256 PolarHBondContact O-N 3.17Å; V1253-L1257 WeakPolarHBondContact O-CB 3.31Å; V1253-L1257 PolarHBondContact O-N 3.17Å
1254	V	88.8	Confident	85.3	Confident	54 Å²	54	69.9 Å²	69.9	33%	0.327	36%	0.355	S	S	.	.	H	α-helix	trans	-62	-42.7	177.9	169.3	0	0	0	0	112.3	F1249 F1250 E1252 L1257 F1258	F1249-V1254 HydrophobicContact CE1-CG2 4.31Å; F1249-V1254 WeakPolarHBondContact O-CG2 3.28Å; F1249-V1254 PolarHBondContact O-N 2.86Å; F1250-V1254 HydrophobicContact CD2-CB 4.25Å; F1250-V1254 HydrophobicContact CD2-CG1 4.42Å; F1250-V1254 HydrophobicContact CD2-CG2 4.13Å; E1252-V1254 VanDerWaalsContact C-N 3.31Å; E1252-V1254 PolarHBondContact O-N 2.98Å; V1254-L1257 PolarHBondContact O-N 2.69Å; V1254-F1258 WeakPolarHBondContact O-CB 3.39Å; V1254-F1258 PolarHBondContact O-N 3.37Å
1255	C	89.1	Confident	85.8	Confident	73 Å²	73	67 Å²	67	49%	0.493	34%	0.34	S	S	.	.	H	α-helix	trans	-64	-45.6	176	-78.6	0	0	0	0	112.1	P1251 E1252 V1253 L1257 F1258 L1259	P1251-C1255 WeakPolarHBondContact O-CB 3.46Å; P1251-C1255 PolarHBondContact O-N 2.8Å; P1251-C1255 PolarHBondContact O-SG 3.31Å; E1252-C1255 PolarHBondContact O-N 2.89Å; V1253-C1255 PolarHBondContact O-N 2.84Å; C1255-L1257 VanDerWaalsContact C-N 3.33Å; C1255-L1257 PolarHBondContact O-N 3.39Å; C1255-F1258 PolarHBondContact O-N 2.8Å; C1255-L1259 WeakPolarHBondContact O-CG 3Å; C1255-L1259 PolarHBondContact O-N 3.27Å
1256	C	91.1	Very high	86.1	Confident	4 Å²	4	66.3 Å²	66.3	3%	0.027	34%	0.339	C	S	.	.	H	α-helix	trans	-63.9	-40.5	177.7	-62.8	0	0	0	0	111.5	F1226 L1229 E1252 V1253 L1259 G1260	F1226-C1256 HydrophobicContact CD2-CB 3.84Å; F1226-C1256 HydrophobicContact CE2-CB 3.95Å; L1229-C1256 HydrophobicContact CB-CB 4.08Å; E1252-C1256 PolarHBondContact O-N 2.61Å; E1252-C1256 PolarHBondContact O-SG 3.32Å; V1253-C1256 PolarHBondContact O-N 3.17Å; C1256-L1259 PolarHBondContact O-N 2.61Å; C1256-G1260 PolarHBondContact O-N 2.95Å
1257	L	90.1	Very high	86.2	Confident	76 Å²	76	59 Å²	59	40%	0.398	31%	0.305	S	S	.	.	H	α-helix	trans	-62	-47.2	176.8	-169.1	152.5	0	0	0	109.9	F1226 V1253 V1254 C1255 L1259 G1260 A1261 W1275	F1226-L1257 HydrophobicContact CD2-CB 4.34Å; F1226-L1257 HydrophobicContact CE2-CB 4.13Å; V1253-L1257 WeakPolarHBondContact O-CB 3.31Å; V1253-L1257 PolarHBondContact O-N 3.17Å; V1254-L1257 PolarHBondContact O-N 2.69Å; C1255-L1257 VanDerWaalsContact C-N 3.33Å; C1255-L1257 PolarHBondContact O-N 3.39Å; L1257-L1259 PolarHBondContact O-N 3.35Å; L1257-G1260 PolarHBondContact O-N 3.46Å; L1257-A1261 WeakPolarHBondContact O-CB 3.43Å; L1257-A1261 PolarHBondContact O-N 2.97Å; L1257-W1275 HydrophobicContact CB-CH2 4.24Å; L1257-W1275 HydrophobicContact CD2-CH2 3.52Å; L1257-W1275 HydrophobicContact CD2-CZ3 4.06Å; L1257-W1275 HydrophobicContact CG-CH2 3.45Å; L1257-W1275 VanDerWaalsContact CG-CH2 3.45Å; L1257-W1275 HydrophobicContact CG-CZ2 4.14Å; L1257-W1275 HydrophobicContact CG-CZ3 4.36Å; L1257-W1275 WeakPolarHBondContact O-CH2 3.37Å; L1257-W1275 VanDerWaalsContact O-CZ2 3.23Å; L1257-W1275 WeakPolarHBondContact O-CZ2 3.31Å
1258	F	90	Very high	86.2	Confident	126 Å²	126	59.8 Å²	59.8	55%	0.553	30%	0.304	S	S	*	.	H	α-helix	trans	-61.1	-42.1	175.7	-175.2	-105.2	0	0	0	113	V1254 C1255 A1261 L1262	V1254-F1258 WeakPolarHBondContact O-CB 3.39Å; V1254-F1258 PolarHBondContact O-N 3.37Å; C1255-F1258 PolarHBondContact O-N 2.8Å; F1258-A1261 PolarHBondContact O-N 2.92Å; F1258-L1262 HydrophobicContact CD1-CD1 3.76Å; F1258-L1262 HydrophobicContact CD1-CG 4.36Å; F1258-L1262 HydrophobicContact CE1-CD1 3.34Å; F1258-L1262 HydrophobicContact CE1-CG 4.06Å; F1258-L1262 HydrophobicContact CZ-CD1 3.88Å; F1258-L1262 HydrophobicContact CZ-CD2 4.42Å; F1258-L1262 HydrophobicContact CZ-CG 4.19Å; F1258-L1262 WeakPolarHBondContact O-CB 3.31Å; F1258-L1262 WeakPolarHBondContact O-CG 3.26Å; F1258-L1262 PolarHBondContact O-N 3.13Å
1259	L	89.3	Confident	86.2	Confident	83 Å²	83	62.6 Å²	62.6	44%	0.435	31%	0.314	S	S	.	.	H	α-helix	trans	-67.1	-39.2	177.2	-71.9	171.8	0	0	0	112.6	L1229 C1255 C1256 L1257 L1262 A1263	L1229-L1259 HydrophobicContact CD1-CB 3.6Å; L1229-L1259 HydrophobicContact CD1-CD1 3.95Å; L1229-L1259 HydrophobicContact CD1-CG 4.44Å; L1229-L1259 HydrophobicContact CD2-CD1 4.46Å; C1255-L1259 WeakPolarHBondContact O-CG 3Å; C1255-L1259 PolarHBondContact O-N 3.27Å; C1256-L1259 PolarHBondContact O-N 2.61Å; L1257-L1259 PolarHBondContact O-N 3.35Å; L1259-L1262 PolarHBondContact O-N 3.46Å; L1259-A1263 PolarHBondContact O-N 2.8Å
1260	G	88	Confident	86.3	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62	-45.7	173	0	0	0	0	0	112.5	C1256 L1257 L1262 A1263 A1264	C1256-G1260 PolarHBondContact O-N 2.95Å; L1257-G1260 PolarHBondContact O-N 3.46Å; G1260-L1262 PolarHBondContact O-N 3.24Å; G1260-A1263 PolarHBondContact O-N 2.76Å; G1260-A1264 PolarHBondContact O-N 3.36Å
1261	A	87.9	Confident	86.1	Confident	21 Å²	21	51.8 Å²	51.8	17%	0.174	27%	0.27	C	S	.	.	H	α-helix	trans	-61.5	-43.1	175.5	0	0	0	0	0	112.3	L1257 F1258 A1263 A1264 S1265 W1275	L1257-A1261 WeakPolarHBondContact O-CB 3.43Å; L1257-A1261 PolarHBondContact O-N 2.97Å; F1258-A1261 PolarHBondContact O-N 2.92Å; A1261-A1263 VanDerWaalsContact C-N 3.34Å; A1261-A1263 PolarHBondContact O-N 3.23Å; A1261-A1264 PolarHBondContact O-N 3.02Å; A1261-S1265 WeakPolarHBondContact O-CB 3.21Å; A1261-S1265 PolarHBondContact O-N 2.75Å; A1261-W1275 HydrophobicContact CB-CE3 4.03Å; A1261-W1275 HydrophobicContact CB-CH2 3.73Å; A1261-W1275 HydrophobicContact CB-CZ2 4.34Å; A1261-W1275 HydrophobicContact CB-CZ3 3.61Å
1262	L	88.4	Confident	86.1	Confident	78 Å²	78	51.3 Å²	51.3	41%	0.408	27%	0.266	S	S	.	.	H	α-helix	trans	-61	-42.7	175	-79.8	176.6	0	0	0	111.3	F1258 L1259 G1260 S1265 T1266	F1258-L1262 HydrophobicContact CD1-CD1 3.76Å; F1258-L1262 HydrophobicContact CD1-CG 4.36Å; F1258-L1262 HydrophobicContact CE1-CD1 3.34Å; F1258-L1262 HydrophobicContact CE1-CG 4.06Å; F1258-L1262 HydrophobicContact CZ-CD1 3.88Å; F1258-L1262 HydrophobicContact CZ-CD2 4.42Å; F1258-L1262 HydrophobicContact CZ-CG 4.19Å; F1258-L1262 WeakPolarHBondContact O-CB 3.31Å; F1258-L1262 WeakPolarHBondContact O-CG 3.26Å; F1258-L1262 PolarHBondContact O-N 3.13Å; L1259-L1262 PolarHBondContact O-N 3.46Å; G1260-L1262 PolarHBondContact O-N 3.24Å; L1262-S1265 PolarHBondContact O-N 3.11Å; L1262-S1265 PolarHBondContact O-OG 3.48Å; L1262-T1266 WeakPolarHBondContact O-CG2 3.29Å; L1262-T1266 PolarHBondContact O-N 3.45Å
1263	A	85.8	Confident	86	Confident	2 Å²	2	55.4 Å²	55.4	2%	0.017	29%	0.293	C	S	.	.	H	α-helix	trans	-61.2	-45.9	176.1	0	0	0	0	0	112	F1196 I1225 L1259 G1260 A1261 S1265 T1266	F1196-A1263 HydrophobicContact CD2-CB 3.94Å; F1196-A1263 HydrophobicContact CE2-CB 4Å; I1225-A1263 HydrophobicContact CD1-CB 3.56Å; I1225-A1263 HydrophobicContact CG2-CB 4.35Å; L1259-A1263 PolarHBondContact O-N 2.8Å; G1260-A1263 PolarHBondContact O-N 2.76Å; A1261-A1263 VanDerWaalsContact C-N 3.34Å; A1261-A1263 PolarHBondContact O-N 3.23Å; A1263-S1265 VanDerWaalsContact C-N 3.3Å; A1263-S1265 PolarHBondContact O-N 3.44Å; A1263-T1266 PolarHBondContact O-N 3.08Å; A1263-T1266 PolarHBondContact O-OG1 3.37Å
1264	A	85.2	Confident	85.5	Confident	1 Å²	1	58 Å²	58	1%	0.008	31%	0.305	C	S	.	.	H	α-helix	trans	-61.3	-36.5	175.6	0	0	0	0	0	112.6	G1260 A1261 T1266 V1267 S1271 W1275	G1260-A1264 PolarHBondContact O-N 3.36Å; A1261-A1264 PolarHBondContact O-N 3.02Å; A1264-T1266 PolarHBondContact O-N 3.31Å; A1264-V1267 PolarHBondContact O-N 2.87Å; A1264-S1271 WeakPolarHBondContact O-CB 3.41Å; A1264-W1275 HydrophobicContact CB-CB 4.07Å; A1264-W1275 HydrophobicContact CB-CG 4.35Å
1265	S	86	Confident	84.9	Confident	54 Å²	54	60 Å²	60	38%	0.378	31%	0.307	S	S	.	.	H	α-helix	trans	-63.3	-22.8	179.1	80.7	0	0	0	0	114.4	A1261 L1262 A1263 V1267	A1261-S1265 WeakPolarHBondContact O-CB 3.21Å; A1261-S1265 PolarHBondContact O-N 2.75Å; L1262-S1265 PolarHBondContact O-N 3.11Å; L1262-S1265 PolarHBondContact O-OG 3.48Å; A1263-S1265 VanDerWaalsContact C-N 3.3Å; A1263-S1265 PolarHBondContact O-N 3.44Å; S1265-V1267 VanDerWaalsContact C-N 3.3Å
1266	T	85.1	Confident	84.7	Confident	30 Å²	30	59.3 Å²	59.3	18%	0.184	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-12	-176.8	69.1	0	0	0	0	113.2	R1200 Q1203 L1262 A1263 A1264	R1200-T1266 VanDerWaalsContact NH2-CB 3.25Å; Q1203-T1266 VanDerWaalsContact CD-O 3.32Å; Q1203-T1266 PolarHBondContact NE2-O 2.99Å; L1262-T1266 WeakPolarHBondContact O-CG2 3.29Å; L1262-T1266 PolarHBondContact O-N 3.45Å; A1263-T1266 PolarHBondContact O-N 3.08Å; A1263-T1266 PolarHBondContact O-OG1 3.37Å; A1264-T1266 PolarHBondContact O-N 3.31Å
1267	V	80.4	Confident	84.4	Confident	7 Å²	7	62.2 Å²	62.2	4%	0.042	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-62.6	174.6	179.3	0	0	0	0	110.5	I1199 L1206 A1264 S1265	I1199-V1267 HydrophobicContact CG2-CG2 3.31Å; L1206-V1267 HydrophobicContact CB-CG1 3.45Å; L1206-V1267 VanDerWaalsContact CB-CG1 3.45Å; A1264-V1267 PolarHBondContact O-N 2.87Å; S1265-V1267 VanDerWaalsContact C-N 3.3Å
1268	H	80.2	Confident	84.1	Confident	48 Å²	48	61.4 Å²	61.4	22%	0.222	31%	0.307	C	S	.	.			trans	-161.3	154.2	179.4	-166.9	-101	0	0	0	109.7	I1270 S1271	H1268-I1270 WeakPolarHBondContact ND1-CB 3.44Å; H1268-I1270 WeakPolarHBondContact ND1-CG1 3.35Å; H1268-I1270 PolarHBondContact ND1-N 3.24Å; H1268-I1270 PolarHBondContact O-N 3.03Å; H1268-S1271 WeakPolarHBondContact O-CB 3.43Å; H1268-S1271 PolarHBondContact O-N 3.27Å
1269	R	83.2	Confident	83.7	Confident	225 Å²	225	57.6 Å²	57.6	85%	0.849	29%	0.292	S	S	*	.	H	α-helix	trans	-59.6	-31.1	178.1	-66.7	-177.8	179.9	-177.6	0.3	112.9	S1271	R1269-S1271 VanDerWaalsContact C-N 3.34Å
1270	I	81.9	Confident	83.4	Confident	86 Å²	86	56.1 Å²	56.1	44%	0.441	28%	0.284	S	S	.	.	H	α-helix	trans	-72.1	-26.4	176.8	-60.3	171.5	0	0	0	111.8	P1215 H1268 V1272 T1273 L1274	P1215-I1270 HydrophobicContact CB-CB 4.23Å; P1215-I1270 HydrophobicContact CB-CG2 4.04Å; H1268-I1270 WeakPolarHBondContact ND1-CB 3.44Å; H1268-I1270 WeakPolarHBondContact ND1-CG1 3.35Å; H1268-I1270 PolarHBondContact ND1-N 3.24Å; H1268-I1270 PolarHBondContact O-N 3.03Å; I1270-V1272 VanDerWaalsContact C-N 3.29Å; I1270-V1272 PolarHBondContact O-N 3.22Å; I1270-T1273 WeakPolarHBondContact CA-OG1 3.37Å; I1270-T1273 PolarHBondContact O-N 3.05Å; I1270-T1273 PolarHBondContact O-OG1 3.44Å; I1270-L1274 HydrophobicContact CG2-CD1 3.79Å; I1270-L1274 HydrophobicContact CG2-CG 4.29Å; I1270-L1274 WeakPolarHBondContact O-CG 3.42Å; I1270-L1274 PolarHBondContact O-N 3.16Å
1271	S	79.3	Confident	83.1	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-70.1	-26.7	179.4	-61.8	0	0	0	0	112.6	P1215 A1264 H1268 R1269 L1274 W1275	P1215-S1271 WeakPolarHBondContact CA-OG 3.46Å; P1215-S1271 PolarHBondContact O-OG 2.6Å; A1264-S1271 WeakPolarHBondContact O-CB 3.41Å; H1268-S1271 WeakPolarHBondContact O-CB 3.43Å; H1268-S1271 PolarHBondContact O-N 3.27Å; R1269-S1271 VanDerWaalsContact C-N 3.34Å; S1271-L1274 PolarHBondContact O-N 3.38Å; S1271-W1275 PolarHBondContact O-N 3.04Å; S1271-W1275 VanDerWaalsContact O-N 3.08Å
1272	V	83	Confident	82.7	Confident	52 Å²	52	62.6 Å²	62.6	32%	0.315	31%	0.312	S	S	.	.	H	α-helix	trans	-69.5	-35.2	173.2	-176	0	0	0	0	111.9	I1270 L1274	I1270-V1272 VanDerWaalsContact C-N 3.29Å; I1270-V1272 PolarHBondContact O-N 3.22Å; V1272-L1274 VanDerWaalsContact C-N 3.32Å
1273	T	84	Confident	82.3	Confident	116 Å²	116	61.4 Å²	61.4	71%	0.712	30%	0.304	S	S	*	.	H	α-helix	trans	-79.4	-16.4	177.2	23	0	0	0	0	113.3	I1270	I1270-T1273 WeakPolarHBondContact CA-OG1 3.37Å; I1270-T1273 PolarHBondContact O-N 3.05Å; I1270-T1273 PolarHBondContact O-OG1 3.44Å
1274	L	78.3	Confident	82	Confident	81 Å²	81	66.3 Å²	66.3	42%	0.424	33%	0.328	S	S	.	.	H	α-helix	trans	-94.7	-19.1	176.3	-71.6	170	0	0	0	113.2	P1215 F1216 I1270 S1271 V1272	P1215-L1274 HydrophobicContact CB-CD1 4.16Å; F1216-L1274 HydrophobicContact CB-CD1 4.2Å; F1216-L1274 HydrophobicContact CD2-CD2 4.4Å; I1270-L1274 HydrophobicContact CG2-CD1 3.79Å; I1270-L1274 HydrophobicContact CG2-CG 4.29Å; I1270-L1274 WeakPolarHBondContact O-CG 3.42Å; I1270-L1274 PolarHBondContact O-N 3.16Å; S1271-L1274 PolarHBondContact O-N 3.38Å; V1272-L1274 VanDerWaalsContact C-N 3.32Å
1275	W	77.5	Confident	81.7	Confident	96 Å²	96	72.3 Å²	72.3	36%	0.364	36%	0.357	S	S	.	.			trans	-73.9	0	165.6	178.4	84.8	0	0	0	109.6	G1222 S1223 L1257 A1261 A1264 S1271	G1222-W1275 PolarHBondContact O-NE1 2.83Å; S1223-W1275 VanDerWaalsContact N-CD1 3.32Å; L1257-W1275 HydrophobicContact CB-CH2 4.24Å; L1257-W1275 HydrophobicContact CD2-CH2 3.52Å; L1257-W1275 HydrophobicContact CD2-CZ3 4.06Å; L1257-W1275 HydrophobicContact CG-CH2 3.45Å; L1257-W1275 VanDerWaalsContact CG-CH2 3.45Å; L1257-W1275 HydrophobicContact CG-CZ2 4.14Å; L1257-W1275 HydrophobicContact CG-CZ3 4.36Å; L1257-W1275 WeakPolarHBondContact O-CH2 3.37Å; L1257-W1275 VanDerWaalsContact O-CZ2 3.23Å; L1257-W1275 WeakPolarHBondContact O-CZ2 3.31Å; A1261-W1275 HydrophobicContact CB-CE3 4.03Å; A1261-W1275 HydrophobicContact CB-CH2 3.73Å; A1261-W1275 HydrophobicContact CB-CZ2 4.34Å; A1261-W1275 HydrophobicContact CB-CZ3 3.61Å; A1264-W1275 HydrophobicContact CB-CB 4.07Å; A1264-W1275 HydrophobicContact CB-CG 4.35Å; S1271-W1275 PolarHBondContact O-N 3.04Å; S1271-W1275 VanDerWaalsContact O-N 3.08Å

Retrieved 1,275 of 1,275 residues in 1970.3 ms (Link to these results)

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