A0AA82N7J5_SCHMA Loading...

Neuron navigator 2 AlphaSync

AlphaFold DB , UniProt , Accession A0AA82N7J5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,312 aa.

						>A0AA82N7J5_SCHMA|A0AA82N7J5
MERFYPNFYSYTKSHYEPLVSNLLIKSESEHSCKPNTDGDEIHSNDNTNNNTDKIKSDWYSGIDCENYSENSNRNEQKHTIASSDINRQRMFKTKQSRGQLVDLTINESQRWARENSDPLRHNELIDDEILTDYDSMRSVQSFISPYIKINEHLTSEHKVKQNASYGTIENNANNLISASYSDIRCNIIPNYQHCPDLMSTSLTKDSSFIKRKSRSLHKQSNDHELHCTNHIDKTDSNALFGNGNRSKRLPSPCVLLRTAQETGKGPKLLPGHVQNTAISNYDLRPKRLIETERMVRQELASTRQKSVTYNNTISNNNSNIFLSKNCRKPVKQTSPRSLKKPYFNEKKHIIRSLNRSKYIMSDKGLSDNELHENNSTILINSRTNLSSKFENITTISNEMNYGNKSETEKILKDNKIETLEETMESMVVRIEQLQALDNFKNSEIHELQSIINQLRGDDMNSKSLASSPSHFQPKPPRSTSCRTLPDAMYQDLQDAISLNSFTSGTSAGSQDPSIHSQQKQKTNSKSDDKCSSQIDSSASALDTERSYVKHSHWLRASFSKAFRKRAKSNIRPNDSEILMNGSSTTNLQPTVHDQVTANNQKLQCEQQLDRLHLTVSRMRWQMDLLEARNKKLQEIILKYNPDELLRNELYTVKLEKKVSLYDLSTHHFQDSCQFVQVFVHTESICYRNLDKISNISQCRDQSAANDNSADTPINCIRSFKIGCTGLLDEMTWEDLDERLQKLIQYYINFLDPNNQLQLESLELQAYQLNFTLTEQSEIKTQSIVRSFTTTTLSSSSAESQSQISCTVLLPIPYTDEQINSQSPIVWINDMINKYNAKHYTLSIQIHLKGCTMKFPLQKDQKPPHQHVFEQKEMLKYVCFGSLIPLITLSTYLSTIRDNSIVIIYGASGTGKSQLVNDLTKILVTNPHSKNTVYNFRFKHDGSTTVKELKSVLTQQLNSFTNNGYPEVINLLNIQHFQGSFSDLFSKLKFSSNCPKIVGTSGTGNIELEKFLIENQIKVINHLSDINDAKEYLERSLNRKLIQYRLFNEFYSSHGFNEDKDSLNKYVTQVEDKNLNQLVSWLTEFWNQLNEIPYSLLQSNQFTIFGIRTFLTCPMHSQLSLNWFLDLWNNMLVPILFKDIKNITTSTMPTKKEPLNSIFKTLNNILGWITITWPWNPTIVNFPKSIREPKITLTQNSISMMKNYQLTLSTLCNSDVETCQHRTSMDSGIILDGINPTSNNLFNCFENNSNIMYGNNYYSHYHYPYGIGDNYNVQQHVANITDCNQLTTTTSHQMKNENCTRSNCTKTVTSMK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	40.4	Very low	48.7	Very low	144 Å²	144	120.4 Å²	120.4	71%	0.709	55%	0.551	S	S	*	*				0	-79	0	-77.7	-56.3	-176.6	0	0	112.6	R3 F4 Y5 Y9	M1-R3 PolarHBondContact O-N 3.36Å; M1-R3 VanDerWaalsContact O-N 3.11Å; M1-F4 PolarHBondContact O-N 2.86Å; M1-Y5 PolarHBondContact O-N 2.74Å; M1-Y5 HydrophobicContact SD-CD2 4.09Å; M1-Y9 HydrophobicContact CB-CD2 4.21Å
2	E	42.5	Very low	49.2	Very low	124 Å²	124	113.1 Å²	113.1	58%	0.579	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.5	-46	-167.9	-171.1	171.8	-132.8	0	0	116	F4 P6 Y9	E2-F4 VanDerWaalsContact C-N 3.32Å; E2-F4 PolarHBondContact O-N 3.48Å; E2-P6 WeakPolarHBondContact O-CA 3.37Å; E2-P6 WeakPolarHBondContact O-CD 3.4Å; E2-Y9 HydrophobicContact CB-CD1 3.69Å; E2-Y9 HydrophobicContact CB-CE1 4.1Å; E2-Y9 HydrophobicContact CB-CG 3.95Å; E2-Y9 HydrophobicContact CG-CD1 3.57Å; E2-Y9 HydrophobicContact CG-CE1 4Å; E2-Y9 HydrophobicContact CG-CG 4.26Å; E2-Y9 WeakPolarHBondContact OE1-CD1 3.27Å; E2-Y9 VanDerWaalsContact OE1-CE1 3.26Å; E2-Y9 WeakPolarHBondContact OE1-CE1 3.49Å
3	R	37.7	Very low	50.4	Low	243 Å²	243	111.6 Å²	111.6	92%	0.917	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-22.5	177.3	-79.6	-173.1	175.9	174.7	0.1	116	M1	M1-R3 PolarHBondContact O-N 3.36Å; M1-R3 VanDerWaalsContact O-N 3.11Å
4	F	38.1	Very low	51.6	Low	166 Å²	166	108.8 Å²	108.8	73%	0.728	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	-32.2	-175	-71.4	-84.5	0	0	0	112.4	M1 E2	M1-F4 PolarHBondContact O-N 2.86Å; E2-F4 VanDerWaalsContact C-N 3.32Å; E2-F4 PolarHBondContact O-N 3.48Å
5	Y	47.7	Very low	52	Low	146 Å²	146	108.1 Å²	108.1	57%	0.573	51%	0.509	S	S	*	.			trans	-135.2	64.7	179.8	-53.2	-84.3	0	0	0	110.7	M1 N7 F8 Y9	M1-Y5 PolarHBondContact O-N 2.74Å; M1-Y5 HydrophobicContact SD-CD2 4.09Å; Y5-N7 VanDerWaalsContact C-N 3.29Å; Y5-N7 PolarHBondContact O-N 3.47Å; Y5-F8 PolarHBondContact O-N 3.34Å; Y5-Y9 PolarHBondContact O-N 3.13Å
6	P	51.8	Low	52.1	Low	73 Å²	73	108.8 Å²	108.8	47%	0.474	51%	0.506	S	S	.	.	H	α-helix	trans	-59.9	-37.9	-175.4	22.6	-33.4	0	0	0	112.6	E2 F8 Y9 S10	E2-P6 WeakPolarHBondContact O-CA 3.37Å; E2-P6 WeakPolarHBondContact O-CD 3.4Å; P6-F8 VanDerWaalsContact C-N 3.34Å; P6-F8 PolarHBondContact O-N 2.92Å; P6-Y9 PolarHBondContact O-N 3.37Å; P6-S10 WeakPolarHBondContact O-CB 3.42Å; P6-S10 PolarHBondContact O-N 2.76Å; P6-S10 PolarHBondContact O-OG 3.34Å
7	N	47.9	Very low	52.2	Low	115 Å²	115	108.6 Å²	108.6	62%	0.615	51%	0.505	S	S	*	.	H	α-helix	trans	-67.5	-33.3	175.6	-65.5	0.1	0	0	0	112.3	Y5 S10 Y11	Y5-N7 VanDerWaalsContact C-N 3.29Å; Y5-N7 PolarHBondContact O-N 3.47Å; N7-S10 WeakPolarHBondContact CA-OG 3.47Å; N7-S10 PolarHBondContact O-OG 3.28Å; N7-Y11 WeakPolarHBondContact O-CB 3.14Å; N7-Y11 PolarHBondContact O-N 3.25Å; N7-Y11 VanDerWaalsContact O-N 3.13Å
8	F	51.5	Low	52.3	Low	82 Å²	82	106.2 Å²	106.2	36%	0.36	50%	0.5	S	S	.	.	H	α-helix	trans	-74.7	-42	175.8	-170	-104.8	0	0	0	111.1	Y5 P6 Y11 T12	Y5-F8 PolarHBondContact O-N 3.34Å; P6-F8 VanDerWaalsContact C-N 3.34Å; P6-F8 PolarHBondContact O-N 2.92Å; F8-Y11 PolarHBondContact O-N 3.31Å; F8-T12 HydrophobicContact CD1-CG2 4.06Å; F8-T12 HydrophobicContact CE1-CG2 3.71Å; F8-T12 HydrophobicContact CE2-CG2 4.26Å; F8-T12 HydrophobicContact CG-CG2 4.48Å; F8-T12 HydrophobicContact CZ-CG2 3.82Å; F8-T12 WeakPolarHBondContact O-CG2 3.3Å; F8-T12 PolarHBondContact O-N 3.11Å; F8-T12 PolarHBondContact O-OG1 3.41Å; F8-T12 VanDerWaalsContact O-OG1 3.08Å
9	Y	56.1	Low	51.8	Low	86 Å²	86	105.8 Å²	105.8	34%	0.337	50%	0.501	S	S	.	.	H	α-helix	trans	-67	-39.6	178.9	-173.9	-107.5	0	0	0	112.6	M1 E2 Y5 P6 T12 K13	M1-Y9 HydrophobicContact CB-CD2 4.21Å; E2-Y9 HydrophobicContact CB-CD1 3.69Å; E2-Y9 HydrophobicContact CB-CE1 4.1Å; E2-Y9 HydrophobicContact CB-CG 3.95Å; E2-Y9 HydrophobicContact CG-CD1 3.57Å; E2-Y9 HydrophobicContact CG-CE1 4Å; E2-Y9 HydrophobicContact CG-CG 4.26Å; E2-Y9 WeakPolarHBondContact OE1-CD1 3.27Å; E2-Y9 VanDerWaalsContact OE1-CE1 3.26Å; E2-Y9 WeakPolarHBondContact OE1-CE1 3.49Å; Y5-Y9 PolarHBondContact O-N 3.13Å; P6-Y9 PolarHBondContact O-N 3.37Å; Y9-T12 PolarHBondContact O-OG1 3.05Å; Y9-K13 WeakPolarHBondContact O-CB 3.41Å; Y9-K13 PolarHBondContact O-N 3.39Å
10	S	64.2	Low	51.7	Low	64 Å²	64	104.3 Å²	104.3	45%	0.448	50%	0.499	S	S	.	.	H	α-helix	trans	-67.8	-37.7	172.7	49.2	0	0	0	0	112.5	P6 N7 S14	P6-S10 WeakPolarHBondContact O-CB 3.42Å; P6-S10 PolarHBondContact O-N 2.76Å; P6-S10 PolarHBondContact O-OG 3.34Å; N7-S10 WeakPolarHBondContact CA-OG 3.47Å; N7-S10 PolarHBondContact O-OG 3.28Å; S10-S14 VanDerWaalsContact O-CB 3.31Å; S10-S14 WeakPolarHBondContact O-CB 3.23Å; S10-S14 PolarHBondContact O-N 3.35Å; S10-S14 PolarHBondContact O-OG 3.48Å
11	Y	57.6	Low	51.5	Low	81 Å²	81	102 Å²	102	32%	0.318	50%	0.495	S	S	.	.	H	α-helix	trans	-66.4	-47.8	173.8	-179.4	-102.2	0	0	0	112.6	N7 F8 S14 H15	N7-Y11 WeakPolarHBondContact O-CB 3.14Å; N7-Y11 PolarHBondContact O-N 3.25Å; N7-Y11 VanDerWaalsContact O-N 3.13Å; F8-Y11 PolarHBondContact O-N 3.31Å; Y11-S14 PolarHBondContact O-N 3.14Å; Y11-S14 PolarHBondContact O-OG 3.09Å; Y11-H15 AromaticContact CD2-CD2 3.62Å; Y11-H15 AromaticContact CE2-CD2 3.37Å; Y11-H15 WeakPolarHBondContact CE2-CD2 3.37Å; Y11-H15 AromaticContact CE2-NE2 3.53Å; Y11-H15 AromaticContact CZ-CD2 3.86Å; Y11-H15 WeakPolarHBondContact O-CB 3.35Å; Y11-H15 PolarHBondContact O-N 3.47Å
12	T	55.2	Low	51.7	Low	33 Å²	33	99.8 Å²	99.8	20%	0.202	49%	0.485	C	S	.	.	H	α-helix	trans	-66.2	-40.9	177.9	55.1	0	0	0	0	111.5	F8 Y9 Y16	F8-T12 HydrophobicContact CD1-CG2 4.06Å; F8-T12 HydrophobicContact CE1-CG2 3.71Å; F8-T12 HydrophobicContact CE2-CG2 4.26Å; F8-T12 HydrophobicContact CG-CG2 4.48Å; F8-T12 HydrophobicContact CZ-CG2 3.82Å; F8-T12 WeakPolarHBondContact O-CG2 3.3Å; F8-T12 PolarHBondContact O-N 3.11Å; F8-T12 PolarHBondContact O-OG1 3.41Å; F8-T12 VanDerWaalsContact O-OG1 3.08Å; Y9-T12 PolarHBondContact O-OG1 3.05Å; T12-Y16 VanDerWaalsContact O-CB 3.29Å; T12-Y16 WeakPolarHBondContact O-CB 3.47Å; T12-Y16 PolarHBondContact O-N 2.98Å
13	K	64.3	Low	51.7	Low	94 Å²	94	99.7 Å²	99.7	41%	0.409	49%	0.488	S	S	.	.	H	α-helix	trans	-60.4	-52.1	175.1	-170	170.8	-171.4	176.3	0	111.6	Y9 H15 E17	Y9-K13 WeakPolarHBondContact O-CB 3.41Å; Y9-K13 PolarHBondContact O-N 3.39Å; K13-H15 VanDerWaalsContact C-N 3.34Å; K13-H15 PolarHBondContact O-N 3.01Å; K13-E17 WeakPolarHBondContact CE-OE1 3.34Å; K13-E17 WeakPolarHBondContact CE-OE2 3.19Å; K13-E17 HydrophobicContact CG-CG 4.01Å; K13-E17 VanDerWaalsContact CG-OE2 3.3Å; K13-E17 WeakPolarHBondContact CG-OE2 3.41Å; K13-E17 IonicContact NZ-OE1 3.53Å; K13-E17 WeakPolarHBondContact O-CB 3.43Å; K13-E17 PolarHBondContact O-N 3.46Å
14	S	68	Low	52	Low	72 Å²	72	92.3 Å²	92.3	50%	0.503	47%	0.466	S	S	.	.	H	α-helix	trans	-66.7	-27.6	-178	56.1	0	0	0	0	114.8	S10 Y11 P18	S10-S14 VanDerWaalsContact O-CB 3.31Å; S10-S14 WeakPolarHBondContact O-CB 3.23Å; S10-S14 PolarHBondContact O-N 3.35Å; S10-S14 PolarHBondContact O-OG 3.48Å; Y11-S14 PolarHBondContact O-N 3.14Å; Y11-S14 PolarHBondContact O-OG 3.09Å; S14-P18 VanDerWaalsContact O-CD 3.28Å; S14-P18 WeakPolarHBondContact O-CD 3.29Å; S14-P18 WeakPolarHBondContact O-CG 3.44Å
15	H	56.4	Low	52.3	Low	99 Å²	99	89.3 Å²	89.3	46%	0.458	46%	0.457	S	S	.	.	H	α-helix	trans	-91.7	-35.3	175.5	-85.3	-78.6	0	0	0	114.8	Y11 K13 L19	Y11-H15 AromaticContact CD2-CD2 3.62Å; Y11-H15 AromaticContact CE2-CD2 3.37Å; Y11-H15 WeakPolarHBondContact CE2-CD2 3.37Å; Y11-H15 AromaticContact CE2-NE2 3.53Å; Y11-H15 AromaticContact CZ-CD2 3.86Å; Y11-H15 WeakPolarHBondContact O-CB 3.35Å; Y11-H15 PolarHBondContact O-N 3.47Å; K13-H15 VanDerWaalsContact C-N 3.34Å; K13-H15 PolarHBondContact O-N 3.01Å; H15-L19 WeakPolarHBondContact O-CD1 3.37Å; H15-L19 WeakPolarHBondContact O-CG 3.48Å
16	Y	54.6	Low	51.9	Low	119 Å²	119	89.8 Å²	89.8	47%	0.467	46%	0.462	S	S	.	.	H	α-helix	trans	-91.3	-30	-177.5	-79.2	-85.2	0	0	0	114.5	T12 L19 V20	T12-Y16 VanDerWaalsContact O-CB 3.29Å; T12-Y16 WeakPolarHBondContact O-CB 3.47Å; T12-Y16 PolarHBondContact O-N 2.98Å; Y16-L19 PolarHBondContact O-N 3.41Å; Y16-L19 VanDerWaalsContact O-N 3.16Å; Y16-V20 WeakPolarHBondContact O-CB 3.38Å; Y16-V20 WeakPolarHBondContact O-CG2 3.2Å; Y16-V20 PolarHBondContact O-N 3.4Å
17	E	54.1	Low	51.4	Low	106 Å²	106	90.1 Å²	90.1	50%	0.495	47%	0.466	S	S	.	.	H	α-helix	trans	-57.2	-45.6	174.2	-79.9	-175.2	150.4	0	0	111.9	K13 L19 S21	K13-E17 WeakPolarHBondContact CE-OE1 3.34Å; K13-E17 WeakPolarHBondContact CE-OE2 3.19Å; K13-E17 HydrophobicContact CG-CG 4.01Å; K13-E17 VanDerWaalsContact CG-OE2 3.3Å; K13-E17 WeakPolarHBondContact CG-OE2 3.41Å; K13-E17 IonicContact NZ-OE1 3.53Å; K13-E17 WeakPolarHBondContact O-CB 3.43Å; K13-E17 PolarHBondContact O-N 3.46Å; E17-L19 VanDerWaalsContact C-N 3.34Å; E17-L19 PolarHBondContact O-N 3.42Å; E17-S21 VanDerWaalsContact O-CB 3.24Å; E17-S21 WeakPolarHBondContact O-CB 2.95Å; E17-S21 PolarHBondContact O-N 3.33Å; E17-S21 PolarHBondContact O-OG 2.91Å
18	P	52.7	Low	51.1	Low	64 Å²	64	91.3 Å²	91.3	42%	0.416	47%	0.468	S	S	.	.	H	α-helix	trans	-66.1	-31.9	176.1	-23.1	35.6	0	0	0	113.9	S14 N22	S14-P18 VanDerWaalsContact O-CD 3.28Å; S14-P18 WeakPolarHBondContact O-CD 3.29Å; S14-P18 WeakPolarHBondContact O-CG 3.44Å; P18-N22 WeakPolarHBondContact O-CB 3.33Å; P18-N22 PolarHBondContact O-N 3.23Å; P18-N22 PolarHBondContact O-ND2 3.29Å
19	L	43.8	Very low	50.5	Low	99 Å²	99	91.6 Å²	91.6	52%	0.518	48%	0.48	S	S	.	.	H	α-helix	trans	-76.4	-42.4	178.7	-73.7	173.3	0	0	0	112.1	H15 Y16 E17 S21 N22 L23	H15-L19 WeakPolarHBondContact O-CD1 3.37Å; H15-L19 WeakPolarHBondContact O-CG 3.48Å; Y16-L19 PolarHBondContact O-N 3.41Å; Y16-L19 VanDerWaalsContact O-N 3.16Å; E17-L19 VanDerWaalsContact C-N 3.34Å; E17-L19 PolarHBondContact O-N 3.42Å; L19-S21 VanDerWaalsContact C-N 3.33Å; L19-N22 PolarHBondContact O-N 2.65Å; L19-L23 WeakPolarHBondContact O-CB 3.47Å; L19-L23 WeakPolarHBondContact O-CG 3.35Å; L19-L23 PolarHBondContact O-N 3.17Å
20	V	50.1	Low	49.3	Very low	76 Å²	76	95 Å²	95	46%	0.461	50%	0.499	S	S	.	.	H	α-helix	trans	-65.2	-39.5	173.2	174.7	0	0	0	0	110.1	Y16 L23 L24	Y16-V20 WeakPolarHBondContact O-CB 3.38Å; Y16-V20 WeakPolarHBondContact O-CG2 3.2Å; Y16-V20 PolarHBondContact O-N 3.4Å; V20-L23 PolarHBondContact O-N 2.93Å; V20-L24 HydrophobicContact CG1-CD1 3.93Å; V20-L24 HydrophobicContact CG1-CG 4.41Å; V20-L24 WeakPolarHBondContact O-CB 3.33Å; V20-L24 WeakPolarHBondContact O-CG 3.47Å; V20-L24 PolarHBondContact O-N 3.27Å
21	S	47.7	Very low	47.8	Very low	57 Å²	57	101.2 Å²	101.2	40%	0.399	52%	0.521	S	S	.	.	H	α-helix	trans	-61.1	-46.1	172.2	-58	0	0	0	0	111.8	E17 L19 L23 L24 I25	E17-S21 VanDerWaalsContact O-CB 3.24Å; E17-S21 WeakPolarHBondContact O-CB 2.95Å; E17-S21 PolarHBondContact O-N 3.33Å; E17-S21 PolarHBondContact O-OG 2.91Å; L19-S21 VanDerWaalsContact C-N 3.33Å; S21-L23 VanDerWaalsContact C-N 3.31Å; S21-L23 PolarHBondContact O-N 3.03Å; S21-L24 PolarHBondContact O-N 3.49Å; S21-I25 VanDerWaalsContact O-CB 3.27Å; S21-I25 WeakPolarHBondContact O-CB 3.15Å; S21-I25 WeakPolarHBondContact O-CD1 3.42Å; S21-I25 WeakPolarHBondContact O-CG1 3.22Å; S21-I25 PolarHBondContact O-N 3Å
22	N	43.9	Very low	46.4	Very low	97 Å²	97	102.7 Å²	102.7	52%	0.519	54%	0.543	S	S	.	.	H	α-helix	trans	-71.6	-22.6	178.8	-83.2	-75.7	0	0	0	113.9	P18 L19 K26	P18-N22 WeakPolarHBondContact O-CB 3.33Å; P18-N22 PolarHBondContact O-N 3.23Å; P18-N22 PolarHBondContact O-ND2 3.29Å; L19-N22 PolarHBondContact O-N 2.65Å; N22-K26 WeakPolarHBondContact O-CG 3.48Å; N22-K26 PolarHBondContact O-N 2.98Å
23	L	42.5	Very low	45.3	Very low	122 Å²	122	105 Å²	105	64%	0.639	56%	0.56	S	S	*	*	H	α-helix	trans	-77.8	-44.9	170.8	-78.9	164.5	0	0	0	111.1	L19 V20 S21 K26 S27	L19-L23 WeakPolarHBondContact O-CB 3.47Å; L19-L23 WeakPolarHBondContact O-CG 3.35Å; L19-L23 PolarHBondContact O-N 3.17Å; V20-L23 PolarHBondContact O-N 2.93Å; S21-L23 VanDerWaalsContact C-N 3.31Å; S21-L23 PolarHBondContact O-N 3.03Å; L23-K26 PolarHBondContact O-N 3.02Å; L23-K26 VanDerWaalsContact O-N 3.08Å; L23-S27 PolarHBondContact O-N 3.46Å; L23-S27 PolarHBondContact O-OG 2.94Å
24	L	42.9	Very low	43.8	Very low	87 Å²	87	106.4 Å²	106.4	46%	0.455	57%	0.565	S	S	.	*	H	α-helix	trans	-58.8	-50.2	173.7	-76.7	169.1	0	0	0	111.3	V20 S21 K26 S27 E28	V20-L24 HydrophobicContact CG1-CD1 3.93Å; V20-L24 HydrophobicContact CG1-CG 4.41Å; V20-L24 WeakPolarHBondContact O-CB 3.33Å; V20-L24 WeakPolarHBondContact O-CG 3.47Å; V20-L24 PolarHBondContact O-N 3.27Å; S21-L24 PolarHBondContact O-N 3.49Å; L24-K26 PolarHBondContact O-N 2.94Å; L24-K26 VanDerWaalsContact O-N 3.07Å; L24-S27 WeakPolarHBondContact CA-OG 3.48Å; L24-S27 CarbonylContact O-C 3.56Å; L24-S27 PolarHBondContact O-N 3.06Å; L24-S27 PolarHBondContact O-OG 3.35Å; L24-E28 VanDerWaalsContact O-CB 3.32Å; L24-E28 WeakPolarHBondContact O-CB 3.5Å; L24-E28 VanDerWaalsContact O-CG 3.29Å; L24-E28 WeakPolarHBondContact O-CG 3.29Å; L24-E28 PolarHBondContact O-N 3.24Å
25	I	44.9	Very low	42.3	Very low	104 Å²	104	106.4 Å²	106.4	53%	0.533	56%	0.564	S	S	.	*	H	α-helix	trans	-58.7	-24.1	176.1	-69.9	164.9	0	0	0	112.3	S21 S29	S21-I25 VanDerWaalsContact O-CB 3.27Å; S21-I25 WeakPolarHBondContact O-CB 3.15Å; S21-I25 WeakPolarHBondContact O-CD1 3.42Å; S21-I25 WeakPolarHBondContact O-CG1 3.22Å; S21-I25 PolarHBondContact O-N 3Å; I25-S29 WeakPolarHBondContact O-CB 3.41Å; I25-S29 PolarHBondContact O-N 3.26Å
26	K	40.5	Very low	41.2	Very low	156 Å²	156	105.8 Å²	105.8	68%	0.678	56%	0.564	S	S	*	*	H	α-helix	trans	-85.8	-38.8	172.9	-79.2	-173.9	173	-169.4	0	113.4	N22 L23 L24 E28 S29	N22-K26 WeakPolarHBondContact O-CG 3.48Å; N22-K26 PolarHBondContact O-N 2.98Å; L23-K26 PolarHBondContact O-N 3.02Å; L23-K26 VanDerWaalsContact O-N 3.08Å; L24-K26 PolarHBondContact O-N 2.94Å; L24-K26 VanDerWaalsContact O-N 3.07Å; K26-E28 VanDerWaalsContact C-N 3.3Å; K26-S29 PolarHBondContact O-N 2.97Å; K26-S29 PolarHBondContact O-OG 2.78Å
27	S	41.2	Very low	40.3	Very low	80 Å²	80	104.3 Å²	104.3	56%	0.559	57%	0.567	S	S	*	*	H	α-helix	trans	-70	-25.2	171.4	49.8	0	0	0	0	113.6	L23 L24 S29	L23-S27 PolarHBondContact O-N 3.46Å; L23-S27 PolarHBondContact O-OG 2.94Å; L24-S27 WeakPolarHBondContact CA-OG 3.48Å; L24-S27 CarbonylContact O-C 3.56Å; L24-S27 PolarHBondContact O-N 3.06Å; L24-S27 PolarHBondContact O-OG 3.35Å; S27-S29 VanDerWaalsContact C-N 3.33Å
28	E	40	Very low	39.4	Very low	139 Å²	139	106.9 Å²	106.9	65%	0.65	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-5.1	175.6	-67.4	174.5	156.8	0	0	112.4	L24 K26	L24-E28 VanDerWaalsContact O-CB 3.32Å; L24-E28 WeakPolarHBondContact O-CB 3.5Å; L24-E28 VanDerWaalsContact O-CG 3.29Å; L24-E28 WeakPolarHBondContact O-CG 3.29Å; L24-E28 PolarHBondContact O-N 3.24Å; K26-E28 VanDerWaalsContact C-N 3.3Å
29	S	38.9	Very low	38.5	Very low	88 Å²	88	107 Å²	107	62%	0.615	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-5.9	177.2	69.6	0	0	0	0	114.4	I25 K26 S27	I25-S29 WeakPolarHBondContact O-CB 3.41Å; I25-S29 PolarHBondContact O-N 3.26Å; K26-S29 PolarHBondContact O-N 2.97Å; K26-S29 PolarHBondContact O-OG 2.78Å; S27-S29 VanDerWaalsContact C-N 3.33Å
30	E	31.5	Very low	38.1	Very low	158 Å²	158	110 Å²	110	74%	0.738	61%	0.614	S	S	*	*	S	Bend	trans	-123	133.4	171.2	-64.8	-173.3	162.8	0	0	110
31	H	32.5	Very low	37.2	Very low	195 Å²	195	114.3 Å²	114.3	90%	0.903	63%	0.629	S	S	*	*			trans	69.6	83.8	-178.2	-58.4	-25	0	0	0	118.4
32	S	28.9	Very low	36.6	Very low	111 Å²	111	117.8 Å²	117.8	78%	0.776	64%	0.642	S	S	*	*			trans	-126.4	163.9	145.8	60.8	0	0	0	0	110.6
33	C	31.7	Very low	36.1	Very low	83 Å²	83	121.2 Å²	121.2	56%	0.561	65%	0.654	S	S	*	*			trans	111.6	28.3	173.8	-55.7	0	0	0	0	121.5
34	K	33.9	Very low	35.6	Very low	122 Å²	122	120 Å²	120	53%	0.53	66%	0.656	S	S	.	*				67.3	169.8	121.7	-57.9	174.9	125.5	-155.4	0	121.5	S1291 H1292 Q1293	K34-S1291 VanDerWaalsContact CE-O 3.26Å; K34-S1291 WeakPolarHBondContact CE-O 3.3Å; K34-S1291 WeakPolarHBondContact CE-OG 3.37Å; K34-S1291 WeakPolarHBondContact CG-O 3.42Å; K34-S1291 PolarHBondContact NZ-OG 3.3Å; K34-H1292 VanDerWaalsContact CE-N 3.34Å; K34-Q1293 WeakPolarHBondContact O-CA 3.36Å; K34-Q1293 VanDerWaalsContact O-CG 3.24Å; K34-Q1293 WeakPolarHBondContact O-CG 3.45Å
35	P	35.4	Very low	34.9	Very low	72 Å²	72	122.4 Å²	122.4	47%	0.468	67%	0.669	S	S	.	*			trans	-115.1	-175.9	-173.3	1.8	23.3	0	0	0	118.5	S1291 H1292 Q1293	P35-S1291 WeakPolarHBondContact CD-O 3.32Å; P35-H1292 CarbonylContact O-C 3.58Å; P35-H1292 WeakPolarHBondContact O-CA 3.32Å; P35-H1292 PolarHBondContact O-ND1 3.07Å; P35-Q1293 VanDerWaalsContact C-CD 3.49Å; P35-Q1293 VanDerWaalsContact C-CG 3.41Å; P35-Q1293 WeakPolarHBondContact O-CB 3.01Å; P35-Q1293 WeakPolarHBondContact O-CG 3.39Å; P35-Q1293 PolarHBondContact O-N 3.18Å
36	N	34.2	Very low	34.3	Very low	87 Å²	87	124.1 Å²	124.1	47%	0.465	68%	0.68	S	S	.	*			trans	-177.8	152.7	162	-103.3	32.6	0	0	0	108.5	H1292	N36-H1292 WeakPolarHBondContact OD1-CB 3.45Å; N36-H1292 PolarHBondContact OD1-ND1 3.31Å
37	T	35.1	Very low	33.8	Very low	87 Å²	87	122.5 Å²	122.5	53%	0.534	68%	0.678	S	S	.	*			cis	-159.3	-177.3	-31.6	37.2	0	0	0	0	107.9
38	D	35.3	Very low	33.3	Very low	160 Å²	160	123.9 Å²	123.9	86%	0.856	68%	0.683	S	S	*	*			trans	82.6	129.6	167	-40.3	-1.4	0	0	0	114.9
39	G	33.9	Very low	32.9	Very low	66 Å²	66	123.4 Å²	123.4	68%	0.68	69%	0.686	S	S	*	*			cis	-173.9	160.4	-8.1	0	0	0	0	0	113.1
40	D	35.4	Very low	32.3	Very low	164 Å²	164	125.5 Å²	125.5	88%	0.877	69%	0.69	S	S	*	*			trans	55.8	157.9	156.2	-48.9	-13.8	0	0	0	121.9
41	E	31.7	Very low	32.4	Very low	166 Å²	166	124.7 Å²	124.7	78%	0.776	69%	0.69	S	S	*	*			cis	-165.3	-164.6	-46.1	-148.1	-171.9	-147.2	0	0	109.2
42	I	33.5	Very low	32.4	Very low	130 Å²	130	120.9 Å²	120.9	67%	0.667	68%	0.681	S	S	*	*			trans	79.1	104.3	156.9	-66.5	154.6	0	0	0	119.9
43	H	34.3	Very low	32.6	Very low	168 Å²	168	121.8 Å²	121.8	78%	0.778	68%	0.677	S	S	*	*				49	155.2	125.3	-61.4	-52.3	0	0	0	123.4
44	S	32.6	Very low	32.7	Very low	96 Å²	96	126.3 Å²	126.3	67%	0.671	69%	0.687	S	S	*	*			cis	-169.3	163.4	-11	47.1	0	0	0	0	112.6
45	N	28.6	Very low	32.7	Very low	139 Å²	139	128.2 Å²	128.2	74%	0.743	70%	0.702	S	S	*	*			trans	8.5	134.5	151.6	-51.8	-5.2	0	0	0	121.1
46	D	32.4	Very low	32.4	Very low	140 Å²	140	133.2 Å²	133.2	75%	0.749	72%	0.716	S	S	*	*				160.1	162.2	112.6	-90.4	-24.8	0	0	0	110
47	N	29.2	Very low	32.3	Very low	121 Å²	121	133 Å²	133	65%	0.647	72%	0.721	S	S	*	*			cis	177.2	157.2	-35.8	-126.6	-47.2	0	0	0	105.3
48	T	30.9	Very low	32.1	Very low	109 Å²	109	134.7 Å²	134.7	67%	0.669	73%	0.727	S	S	*	*			trans	65	124.9	156.2	54.4	0	0	0	0	123.6
49	N	30.4	Very low	31.7	Very low	130 Å²	130	137.1 Å²	137.1	70%	0.695	73%	0.725	S	S	*	*				83.2	120.7	128.4	-63.7	-6.7	0	0	0	123.8
50	N	27.8	Very low	31.4	Very low	131 Å²	131	142.9 Å²	142.9	70%	0.701	73%	0.727	S	S	*	*				58.4	113.8	128.9	-53.6	-11	0	0	0	121
51	N	32.6	Very low	30.9	Very low	141 Å²	141	140.7 Å²	140.7	75%	0.754	72%	0.724	S	S	*	*				174.6	103.9	113.1	-86.9	-18.7	0	0	0	110.3
52	T	32.2	Very low	30.8	Very low	116 Å²	116	136 Å²	136	71%	0.712	72%	0.721	S	S	*	*				78.2	126.2	96	57.5	0	0	0	0	117
53	D	33.5	Very low	30.5	Very low	130 Å²	130	137.4 Å²	137.4	70%	0.695	73%	0.728	S	S	*	*			trans	91.2	132.6	144.9	-82.2	22.7	0	0	0	123.3
54	K	33.3	Very low	30.2	Very low	177 Å²	177	137 Å²	137	77%	0.77	73%	0.732	S	S	*	*			trans	77	125	158	-68	157.1	-170.1	167.7	0	116.5
55	I	33.8	Very low	29.8	Very low	162 Å²	162	137.9 Å²	137.9	83%	0.831	74%	0.737	S	S	*	*			cis	-140.1	157.9	7.9	-97.7	146.4	0	0	0	112.3
56	K	30.8	Very low	29.8	Very low	177 Å²	177	139.2 Å²	139.2	77%	0.77	74%	0.738	S	S	*	*			trans	-60.4	150	-177.3	-76.9	-172.4	175.9	-171.2	0	114.9
57	S	30.1	Very low	29.4	Very low	82 Å²	82	138.2 Å²	138.2	57%	0.573	73%	0.733	S	S	*	*				69.3	142.1	57.4	90.8	0	0	0	0	112.7
58	D	31.6	Very low	29.4	Very low	124 Å²	124	143.3 Å²	143.3	66%	0.663	75%	0.745	S	S	*	*			cis	-150.4	144.9	31.3	-81.8	-63.7	0	0	0	111.3
59	W	27	Very low	29.2	Very low	210 Å²	210	142.5 Å²	142.5	80%	0.795	74%	0.744	S	S	*	*				77.9	121	77.7	-78.7	57.9	0	0	0	119.3
60	Y	27.7	Very low	29.1	Very low	188 Å²	188	145.2 Å²	145.2	74%	0.737	75%	0.752	S	S	*	*			trans	55.7	125.2	141.8	-82.8	-101.4	0	0	0	125.8
61	S	25.8	Very low	29	Very low	117 Å²	117	145.7 Å²	145.7	82%	0.818	76%	0.755	S	S	*	*			trans	75.6	161.7	132.9	72.3	0	0	0	0	122.8
62	G	28.7	Very low	28.9	Very low	69 Å²	69	144.9 Å²	144.9	71%	0.711	76%	0.76	S	S	*	*			trans	95.4	126.6	-171.4	0	0	0	0	0	111.3
63	I	27.3	Very low	28.6	Very low	159 Å²	159	146.4 Å²	146.4	82%	0.815	76%	0.764	S	S	*	*			cis	60.2	99	30.4	-46.2	178.8	0	0	0	112.7
64	D	28.7	Very low	28.5	Very low	158 Å²	158	150.9 Å²	150.9	85%	0.845	77%	0.771	S	S	*	*				-169.8	172.9	114.1	-104.8	-37	0	0	0	111.9
65	C	24.3	Very low	28.3	Very low	115 Å²	115	148 Å²	148	78%	0.777	77%	0.765	S	S	*	*			trans	-118	-179.8	-176.3	-72.5	0	0	0	0	112.6
66	E	26.9	Very low	28.2	Very low	167 Å²	167	147.5 Å²	147.5	78%	0.78	76%	0.759	S	S	*	*			trans	90.5	114	157.3	-54.2	-150.8	167.5	0	0	120.8
67	N	24.4	Very low	28.3	Very low	120 Å²	120	145.6 Å²	145.6	64%	0.642	75%	0.752	S	S	*	*				50.4	103.8	120	-49	-35.1	0	0	0	121
68	Y	30.5	Very low	28.4	Very low	227 Å²	227	149.4 Å²	149.4	89%	0.89	76%	0.758	S	S	*	*			trans	-160.2	107.5	132.6	-84.9	-72.5	0	0	0	106.3
69	S	25	Very low	28.6	Very low	93 Å²	93	151.1 Å²	151.1	65%	0.65	76%	0.762	S	S	*	*				54.9	103.8	61	82.9	0	0	0	0	114.6
70	E	29.9	Very low	28.9	Very low	186 Å²	186	146.6 Å²	146.6	87%	0.869	76%	0.758	S	S	*	*				-172.6	168.8	112.9	-104.3	-173.7	173.7	0	0	114.9
71	N	25	Very low	29.2	Very low	142 Å²	142	145.3 Å²	145.3	76%	0.759	76%	0.762	S	S	*	*			trans	-75.9	155.8	-167.9	-51.8	-83.1	0	0	0	114.6
72	S	30.8	Very low	29.5	Very low	123 Å²	123	143.8 Å²	143.8	86%	0.86	76%	0.756	S	S	*	*				-174.7	150.6	109.8	41.1	0	0	0	0	114.9
73	N	26.2	Very low	29.7	Very low	148 Å²	148	145.1 Å²	145.1	79%	0.791	76%	0.755	S	S	*	*			trans	-76	155	-177.8	-49	-81.2	0	0	0	113.2
74	R	30.5	Very low	30.1	Very low	224 Å²	224	142 Å²	142	85%	0.845	75%	0.747	S	S	*	*				178	127.2	104.7	-96.3	173.1	-176.3	178.9	2.9	116
75	N	28.8	Very low	30.2	Very low	118 Å²	118	141.1 Å²	141.1	63%	0.631	74%	0.743	S	S	*	*			trans	72.9	142	130.9	-72.5	28.1	0	0	0	124.5
76	E	33	Very low	30.6	Very low	151 Å²	151	141.4 Å²	141.4	71%	0.706	74%	0.735	S	S	*	*			trans	81.7	136.2	140.1	-76.8	160.7	-122.9	0	0	120.8
77	Q	31.3	Very low	30.7	Very low	137 Å²	137	139.4 Å²	139.4	64%	0.64	73%	0.73	S	S	*	*			cis	-169.6	160.5	-19.2	-143.2	-179.4	59	0	0	113.5
78	K	33.3	Very low	30.9	Very low	161 Å²	161	142.3 Å²	142.3	70%	0.7	73%	0.732	S	S	*	*			trans	71.6	154.3	162.7	-51.5	175.5	-167.4	177	0	116.6
79	H	35.7	Very low	30.7	Very low	161 Å²	161	138.5 Å²	138.5	75%	0.745	72%	0.722	S	S	*	*			cis	-162.6	169.6	-31.1	-92.4	-45.2	0	0	0	105.1
80	T	33	Very low	30.9	Very low	114 Å²	114	146.2 Å²	146.2	70%	0.699	74%	0.737	S	S	*	*			cis	-168.4	128.9	40.6	-33.5	0	0	0	0	110.4
81	I	33.8	Very low	30.7	Very low	161 Å²	161	145.3 Å²	145.3	83%	0.826	74%	0.735	S	S	*	*			trans	43.6	139.5	138.3	-58.7	176.7	0	0	0	120.4
82	A	33.4	Very low	30.9	Very low	85 Å²	85	147 Å²	147	70%	0.702	74%	0.736	S	S	*	*			cis	-178.5	-170.1	-19.3	0	0	0	0	0	106.6
83	S	33.1	Very low	30.6	Very low	97 Å²	97	149.9 Å²	149.9	68%	0.678	73%	0.733	S	S	*	*			cis	-168	171.9	-12.1	38.2	0	0	0	0	108.5
84	S	34	Very low	30.5	Very low	93 Å²	93	148.9 Å²	148.9	65%	0.65	73%	0.732	S	S	*	*			trans	66.3	150.1	142	58.4	0	0	0	0	120.4
85	D	31.3	Very low	30.2	Very low	141 Å²	141	146.2 Å²	146.2	75%	0.754	73%	0.727	S	S	*	*			cis	179.9	164.2	-11.3	-98.7	-14.4	0	0	0	108
86	I	32.5	Very low	30.1	Very low	120 Å²	120	148.5 Å²	148.5	62%	0.615	73%	0.734	S	S	*	*			cis	-164.3	162.7	-13.5	-120.8	168.7	0	0	0	108.7
87	N	30.4	Very low	30	Very low	125 Å²	125	147.4 Å²	147.4	67%	0.668	74%	0.742	S	S	*	*			trans	65.9	162	163.9	-75.9	-21.9	0	0	0	118.8
88	R	27.7	Very low	29.7	Very low	182 Å²	182	151.4 Å²	151.4	69%	0.687	75%	0.752	S	S	*	*			cis	-164.9	151.2	-26	-113.1	170.6	-169.2	-123.1	9.9	112
89	Q	26.8	Very low	29.6	Very low	147 Å²	147	147.7 Å²	147.7	69%	0.687	76%	0.759	S	S	*	*			trans	31.4	121.5	138.5	-61.6	167	-36.6	0	0	120.5
90	R	29.4	Very low	29.1	Very low	255 Å²	255	146.7 Å²	146.7	96%	0.962	76%	0.755	S	S	*	*				-165.1	157.1	114	-107.8	165.2	-171.6	-177.9	2.9	114.8
91	M	25.4	Very low	28.9	Very low	166 Å²	166	149.4 Å²	149.4	82%	0.818	76%	0.764	S	S	*	*			trans	-108.4	-170.2	179.3	-106.6	-164.9	-179.9	0	0	111.1
92	F	28.2	Very low	28.5	Very low	179 Å²	179	146.5 Å²	146.5	79%	0.785	75%	0.754	S	S	*	*			trans	86.2	117.6	172.2	-54.4	-81.6	0	0	0	114.3
93	K	24.5	Very low	28.1	Very low	182 Å²	182	149.3 Å²	149.3	79%	0.791	76%	0.757	S	S	*	*				75.7	145.8	56.7	-84	-173.6	172.3	173.8	0	113.8
94	T	25	Very low	27.8	Very low	128 Å²	128	152.8 Å²	152.8	79%	0.785	77%	0.767	S	S	*	*			trans	63.5	153.9	171.7	48.3	0	0	0	0	116.2
95	K	24.2	Very low	27.5	Very low	167 Å²	167	153.6 Å²	153.6	73%	0.726	77%	0.768	S	S	*	*			cis	-171.5	152.2	-33.1	-119.9	-179.2	173.2	-171	0	105.6
96	Q	25.5	Very low	27.2	Very low	167 Å²	167	153.9 Å²	153.9	78%	0.78	77%	0.768	S	S	*	*			trans	36.7	113.5	151.7	-61.7	171.1	-92.7	0	0	119.4
97	S	31	Very low	27	Very low	127 Å²	127	154.3 Å²	154.3	89%	0.888	77%	0.772	S	S	*	*			trans	-131.2	149.8	130.9	68.7	0	0	0	0	109.3
98	R	25.8	Very low	26.8	Very low	221 Å²	221	156.8 Å²	156.8	83%	0.834	78%	0.779	S	S	*	*			trans	-142	101.4	-172.1	-174.1	178.9	-178.2	168.9	0.2	107.8
99	G	30.8	Very low	26.7	Very low	83 Å²	83	153 Å²	153	86%	0.856	78%	0.781	S	S	*	*			trans	-101.1	125.2	176.6	0	0	0	0	0	110.8
100	Q	25.8	Very low	26.9	Very low	140 Å²	140	153.3 Å²	153.3	65%	0.654	78%	0.782	S	S	*	*			trans	-122.2	129.6	170.8	-74.4	176.1	-120	0	0	109
101	L	28.2	Very low	26.8	Very low	171 Å²	171	151 Å²	151	90%	0.895	77%	0.774	S	S	*	*			trans	-160.6	101.7	148.3	-94.9	136.1	0	0	0	104.2
102	V	26	Very low	27	Very low	101 Å²	101	155.4 Å²	155.4	61%	0.612	78%	0.781	S	S	*	*				77.6	112.6	64	176.1	0	0	0	0	111.1
103	D	24.4	Very low	27.3	Very low	144 Å²	144	150.7 Å²	150.7	77%	0.77	78%	0.775	S	S	*	*			trans	35.2	123.5	152.9	-48	-16.1	0	0	0	119.6
104	L	27	Very low	27.6	Very low	170 Å²	170	152.4 Å²	152.4	89%	0.89	78%	0.777	S	S	*	*				-163.2	171.2	103.7	-102.3	164.6	0	0	0	112.4
105	T	27.6	Very low	27.7	Very low	110 Å²	110	152.6 Å²	152.6	68%	0.675	77%	0.769	S	S	*	*			trans	-118	162	-167	52.5	0	0	0	0	112.7
106	I	25.4	Very low	28	Very low	146 Å²	146	151.6 Å²	151.6	75%	0.749	77%	0.771	S	S	*	*			trans	79.6	121.9	158	-66.4	153.8	0	0	0	117
107	N	27.8	Very low	28.3	Very low	130 Å²	130	148.3 Å²	148.3	70%	0.695	77%	0.767	S	S	*	*			trans	48.2	156.4	150.3	-66.8	5.3	0	0	0	123.2
108	E	26.1	Very low	28.1	Very low	177 Å²	177	150.1 Å²	150.1	83%	0.827	77%	0.767	S	S	*	*			trans	66.6	153.9	157.1	-72.4	157.1	-136.4	0	0	117.6
109	S	27	Very low	28.7	Very low	102 Å²	102	145.1 Å²	145.1	71%	0.713	76%	0.763	S	S	*	*			cis	-158.8	163.7	-31.3	60.6	0	0	0	0	111
110	Q	31	Very low	28.7	Very low	153 Å²	153	149.6 Å²	149.6	72%	0.715	77%	0.766	S	S	*	*			trans	13.4	148.6	154.8	-62.5	-167.6	6.8	0	0	123.3
111	R	26.9	Very low	28.8	Very low	208 Å²	208	153.6 Å²	153.6	79%	0.785	78%	0.775	S	S	*	*			trans	80.1	110.9	149.7	-67.1	143.4	177.7	-99.1	-0.1	119.6
112	W	28.8	Very low	29	Very low	257 Å²	257	153.4 Å²	153.4	97%	0.973	77%	0.77	S	S	*	*				-178.8	153.4	107.1	-86.5	-13.3	0	0	0	108
113	A	35	Very low	29.1	Very low	81 Å²	81	153.7 Å²	153.7	67%	0.669	77%	0.768	S	S	*	*			cis	-154.2	148.9	-23.5	0	0	0	0	0	105.8
114	R	30	Very low	29.1	Very low	217 Å²	217	153.9 Å²	153.9	82%	0.819	76%	0.764	S	S	*	*				34.9	142.1	101.2	-54.6	-157	-175.8	-175.6	-3.8	115.8
115	E	26.9	Very low	29.1	Very low	132 Å²	132	152.6 Å²	152.6	62%	0.617	76%	0.757	S	S	*	*			cis	-161.2	173.1	29.8	-138	139	-134	0	0	111.7
116	N	31	Very low	29.2	Very low	146 Å²	146	153.5 Å²	153.5	78%	0.781	76%	0.757	S	S	*	*			trans	74.4	149.4	165.3	-50.3	-32.9	0	0	0	119.7
117	S	31.2	Very low	29.3	Very low	99 Å²	99	152.8 Å²	152.8	69%	0.692	75%	0.754	S	S	*	*			cis	-171.4	120.7	-29.3	51.7	0	0	0	0	112.3
118	D	28.5	Very low	29.4	Very low	165 Å²	165	153.6 Å²	153.6	88%	0.882	76%	0.759	S	S	*	*			trans	53.1	159.8	149.1	-67.8	-33.8	0	0	0	123.9
119	P	37.5	Very low	29.6	Very low	116 Å²	116	152.8 Å²	152.8	75%	0.753	76%	0.755	S	S	*	*			trans	-115.5	179	-167.3	43.1	-32.5	0	0	0	114.8
120	L	31.7	Very low	29.7	Very low	176 Å²	176	153.7 Å²	153.7	92%	0.921	75%	0.75	S	S	*	*			trans	-128.8	137.1	165	-79.9	171.7	0	0	0	112.5
121	R	26.5	Very low	29.6	Very low	225 Å²	225	153.4 Å²	153.4	85%	0.849	75%	0.753	S	S	*	*			trans	-102.6	150.6	160.9	-72.8	179.1	168.9	-167.2	-2.7	108.8
122	H	33.7	Very low	29.8	Very low	167 Å²	167	147.7 Å²	147.7	77%	0.773	74%	0.741	S	S	*	*			trans	-165	136.7	133.9	-92.9	-48.4	0	0	0	107.3
123	N	26.6	Very low	30.2	Very low	107 Å²	107	142.7 Å²	142.7	57%	0.572	73%	0.734	S	S	*	*				58.9	134.5	77.5	-60.1	62	0	0	0	112.4
124	E	25.7	Very low	30.1	Very low	148 Å²	148	148.6 Å²	148.6	69%	0.692	74%	0.74	S	S	*	*			cis	-168.2	149.7	-10.5	-120.7	166.4	148.7	0	0	108.6
125	L	27.6	Very low	30	Very low	142 Å²	142	144.6 Å²	144.6	74%	0.743	74%	0.735	S	S	*	*			trans	60.4	152.6	148.3	-72.1	165.8	0	0	0	122.5
126	I	28.1	Very low	30.1	Very low	130 Å²	130	142.9 Å²	142.9	67%	0.667	74%	0.738	S	S	*	*			trans	83.1	98.4	144.7	-77.8	162.1	0	0	0	119
127	D	28.2	Very low	29.9	Very low	131 Å²	131	144 Å²	144	70%	0.701	74%	0.74	S	S	*	*				79.8	123.5	124.2	-52.2	-8.4	0	0	0	122.8
128	D	29.3	Very low	29.7	Very low	147 Å²	147	150.8 Å²	150.8	79%	0.786	75%	0.751	S	S	*	*				102.2	135.5	127.8	-84.4	-16.2	0	0	0	124.1
129	E	31	Very low	29.6	Very low	160 Å²	160	147.5 Å²	147.5	75%	0.748	74%	0.741	S	S	*	*			trans	74.2	112.3	150.3	-72.4	-162.6	145.4	0	0	123.4
130	I	29.3	Very low	29	Very low	120 Å²	120	148.3 Å²	148.3	62%	0.615	74%	0.743	S	S	*	*				101	120.9	117.3	-80	174.6	0	0	0	120.7
131	L	29.1	Very low	28.6	Very low	147 Å²	147	148.2 Å²	148.2	77%	0.77	74%	0.738	S	S	*	*			trans	61.2	142.7	152.5	-90.4	44.1	0	0	0	119.4
132	T	30.7	Very low	28.7	Very low	89 Å²	89	142.9 Å²	142.9	55%	0.546	74%	0.735	S	S	.	*			cis	-160.3	141.7	-14.6	-2.4	0	0	0	0	109.8	Y134	T132-Y134 HydrophobicContact CG2-CD2 3.95Å; T132-Y134 HydrophobicContact CG2-CE2 3.98Å
133	D	36.4	Very low	28.3	Very low	152 Å²	152	144.3 Å²	144.3	81%	0.813	74%	0.74	S	S	*	*			trans	165.7	88.9	138	-89.7	-8.7	0	0	0	107.7
134	Y	33.9	Very low	28.3	Very low	204 Å²	204	146.4 Å²	146.4	80%	0.8	75%	0.749	S	S	*	*				60	129.2	88.9	-89.2	-81.6	0	0	0	115.8	T132	T132-Y134 HydrophobicContact CG2-CD2 3.95Å; T132-Y134 HydrophobicContact CG2-CE2 3.98Å
135	D	27.2	Very low	28.3	Very low	133 Å²	133	144 Å²	144	71%	0.711	75%	0.749	S	S	*	*			cis	-166	171.7	-40.5	-151.6	-22.1	0	0	0	108
136	S	29.3	Very low	28.7	Very low	97 Å²	97	142.6 Å²	142.6	68%	0.678	75%	0.748	S	S	*	*			trans	70.6	123	164.3	74.9	0	0	0	0	116.2
137	M	26.1	Very low	28.5	Very low	169 Å²	169	143.8 Å²	143.8	83%	0.833	75%	0.746	S	S	*	*			cis	61.6	88.6	30.7	-60.8	-90.5	99.6	0	0	115
138	R	27.2	Very low	28.5	Very low	241 Å²	241	145.1 Å²	145.1	91%	0.909	75%	0.751	S	S	*	*			trans	-176.7	152.5	146	-99.7	159.4	-163.7	-123.5	5	108.9
139	S	26.3	Very low	28.5	Very low	97 Å²	97	148 Å²	148	68%	0.678	76%	0.757	S	S	*	*			cis	-176.9	153.3	-29	46.4	0	0	0	0	106.6
140	V	25.5	Very low	28.3	Very low	133 Å²	133	145.8 Å²	145.8	81%	0.806	75%	0.749	S	S	*	*			trans	-61	155.8	169.8	-173.5	0	0	0	0	110.8
141	Q	23.7	Very low	28.1	Very low	174 Å²	174	146.8 Å²	146.8	81%	0.813	76%	0.755	S	S	*	*			trans	111.4	157.1	165.6	-59.5	176.3	-14.9	0	0	117.2
142	S	28.5	Very low	27.9	Very low	113 Å²	113	148.2 Å²	148.2	79%	0.79	76%	0.758	S	S	*	*			trans	63.5	118.9	-162.9	69.1	0	0	0	0	113.5
143	F	23.9	Very low	27.7	Very low	196 Å²	196	152 Å²	152	86%	0.86	77%	0.769	S	S	*	*			cis	73.1	122.6	13.6	-99.7	-79.9	0	0	0	116.8
144	I	27.2	Very low	27.1	Very low	151 Å²	151	152.9 Å²	152.9	77%	0.774	77%	0.773	S	S	*	*			trans	85.4	98.9	158.8	-52.3	175.3	0	0	0	119.2
145	S	26.5	Very low	26.8	Very low	99 Å²	99	147.5 Å²	147.5	69%	0.692	76%	0.761	S	S	*	*			trans	52.6	176.4	132.5	-89.4	0	0	0	0	121.9
146	P	34.7	Very low	26.8	Very low	112 Å²	112	145.6 Å²	145.6	73%	0.727	76%	0.759	S	S	*	*			cis	-114.5	156.1	-4.6	20.1	3.8	0	0	0	113.6
147	Y	24.4	Very low	26.7	Very low	155 Å²	155	147.6 Å²	147.6	61%	0.608	76%	0.757	S	S	*	*				46.1	114.9	83.7	-92	-96.8	0	0	0	115.5	I150	Y147-I150 HydrophobicContact CD1-CD1 3.85Å; Y147-I150 HydrophobicContact CE1-CD1 3.55Å
148	I	27.6	Very low	26.8	Very low	159 Å²	159	146.5 Å²	146.5	82%	0.815	75%	0.75	S	S	*	*				166.6	102.4	124.4	-81.6	153.3	0	0	0	110.3
149	K	30.9	Very low	27	Very low	207 Å²	207	143 Å²	143	90%	0.9	74%	0.741	S	S	*	*			trans	-165	88.3	132.7	-118.1	-179.1	178.9	-179.3	0	108.1
150	I	25.5	Very low	26.9	Very low	114 Å²	114	144.8 Å²	144.8	59%	0.585	75%	0.748	S	S	*	*			trans	-114.6	143.1	-176.2	-78.4	176.2	0	0	0	108.4	Y147	Y147-I150 HydrophobicContact CD1-CD1 3.85Å; Y147-I150 HydrophobicContact CE1-CD1 3.55Å
151	N	25.1	Very low	27.1	Very low	140 Å²	140	146.9 Å²	146.9	75%	0.749	75%	0.746	S	S	*	*			trans	30.8	111	161.2	-55.8	-5.5	0	0	0	119.4
152	E	24.7	Very low	27.3	Very low	178 Å²	178	145.7 Å²	145.7	83%	0.832	74%	0.74	S	S	*	*			trans	-177.7	138	130.7	-98.7	158.4	-148.7	0	0	106.2
153	H	27.4	Very low	27.4	Very low	167 Å²	167	147.5 Å²	147.5	77%	0.773	74%	0.741	S	S	*	*			cis	-137.8	128.9	24.4	-61	-87.6	0	0	0	113.7
154	L	24.4	Very low	27.6	Very low	172 Å²	172	142.7 Å²	142.7	90%	0.901	74%	0.738	S	S	*	*	S	Bend	trans	-150.8	81.1	153.6	-92.9	-179.6	0	0	0	109
155	T	26.8	Very low	27.8	Very low	90 Å²	90	140.7 Å²	140.7	55%	0.552	74%	0.737	S	S	*	*	S	Bend	trans	175.5	152.1	151.2	30.3	0	0	0	0	111.7
156	S	27.6	Very low	27.9	Very low	94 Å²	94	146.8 Å²	146.8	66%	0.657	75%	0.747	S	S	*	*			trans	52.8	99.2	155.1	63.2	0	0	0	0	121.3
157	E	25.8	Very low	27.8	Very low	138 Å²	138	145.2 Å²	145.2	65%	0.645	75%	0.751	S	S	*	*				49.6	132.9	119.7	-60.5	-176.1	137.1	0	0	123.7
158	H	30.1	Very low	27.9	Very low	147 Å²	147	143.2 Å²	143.2	68%	0.681	76%	0.755	S	S	*	*			trans	84.7	114.9	142.2	-81.5	-15.5	0	0	0	123.7
159	K	29.9	Very low	28.2	Very low	167 Å²	167	144.1 Å²	144.1	73%	0.726	76%	0.759	S	S	*	*			trans	81.6	86.3	132	-67.2	174.1	-178.3	166.1	0	121.2
160	V	25.4	Very low	28.1	Very low	135 Å²	135	141.2 Å²	141.2	82%	0.818	75%	0.749	S	S	*	*				34.4	109.6	116.3	-171.6	0	0	0	0	118.6
161	K	29.9	Very low	28.4	Very low	176 Å²	176	141.6 Å²	141.6	77%	0.765	75%	0.752	S	S	*	*				176.5	116.4	128.2	-98.6	178.4	-179.6	-178.1	0	109.9
162	Q	27.9	Very low	28.8	Very low	149 Å²	149	143.5 Å²	143.5	70%	0.696	76%	0.762	S	S	*	*				88.2	141.7	85.3	-85.7	-172.3	-40.8	0	0	114.8
163	N	29.8	Very low	29	Very low	152 Å²	152	138.5 Å²	138.5	81%	0.813	75%	0.752	S	S	*	*			trans	74.7	120.4	174.4	-48.6	-19.3	0	0	0	115
164	A	28.2	Very low	29	Very low	95 Å²	95	137.3 Å²	137.3	79%	0.785	75%	0.751	S	S	*	*			cis	99.3	104.2	12.8	0	0	0	0	0	117.1
165	S	31.3	Very low	29.3	Very low	108 Å²	108	137 Å²	137	76%	0.755	75%	0.75	S	S	*	*			trans	-168.1	104.4	154.1	54.4	0	0	0	0	108.5
166	Y	28.1	Very low	29.6	Very low	228 Å²	228	140.9 Å²	140.9	89%	0.894	77%	0.767	S	S	*	*				70.7	123.3	89.2	-86.3	-70.7	0	0	0	115.2
167	G	32	Very low	29.4	Very low	79 Å²	79	143.6 Å²	143.6	81%	0.814	77%	0.772	S	S	*	*			trans	172.3	46	-176.8	0	0	0	0	0	114.4
168	T	27.4	Very low	29.4	Very low	113 Å²	113	142.6 Å²	142.6	69%	0.693	78%	0.78	S	S	*	*			trans	-77.8	133.7	-178.1	42.4	0	0	0	0	113.4
169	I	33.3	Very low	29.3	Very low	177 Å²	177	139.6 Å²	139.6	91%	0.908	78%	0.781	S	S	*	*			trans	-127	140.7	149.3	-64.3	-177	0	0	0	107
170	E	30.1	Very low	29.1	Very low	146 Å²	146	135.6 Å²	135.6	68%	0.682	77%	0.774	S	S	*	*			trans	-125.1	161.4	-159.2	-135.7	-179.9	-121.1	0	0	111.9
171	N	31.3	Very low	29.2	Very low	123 Å²	123	141.2 Å²	141.2	66%	0.658	78%	0.782	S	S	*	*			trans	56	102.4	157.4	-54.1	-34.8	0	0	0	119.3
172	N	33.3	Very low	29	Very low	179 Å²	179	137 Å²	137	96%	0.957	78%	0.775	S	S	*	*				-139.3	114	122.5	-111.1	-29.4	0	0	0	108.7
173	A	28.8	Very low	28.9	Very low	74 Å²	74	135.6 Å²	135.6	61%	0.612	77%	0.773	S	S	*	*			trans	-109	170	-173.1	0	0	0	0	0	111.8
174	N	27.8	Very low	28.7	Very low	141 Å²	141	135.7 Å²	135.7	75%	0.754	77%	0.771	S	S	*	*			trans	69	78.2	164.4	-51.6	-29.5	0	0	0	116.6
175	N	31	Very low	28.5	Very low	165 Å²	165	141 Å²	141	88%	0.882	77%	0.771	S	S	*	*	S	Bend	trans	-152.8	150.6	130.3	-102.1	-42	0	0	0	111.1
176	L	32.3	Very low	28.2	Very low	172 Å²	172	140.8 Å²	140.8	90%	0.901	77%	0.768	S	S	*	*			trans	58.9	76.9	179.3	-68.5	165.5	0	0	0	116
177	I	24.1	Very low	28	Very low	152 Å²	152	136.7 Å²	136.7	78%	0.779	76%	0.762	S	S	*	*			trans	-74.6	163.4	156.7	-69.4	165	0	0	0	109.5
178	S	25.6	Very low	27.7	Very low	116 Å²	116	140.4 Å²	140.4	81%	0.811	76%	0.762	S	S	*	*			trans	87.3	133.5	-179.1	78.4	0	0	0	0	114.9
179	A	28.1	Very low	27.6	Very low	85 Å²	85	141.4 Å²	141.4	70%	0.702	76%	0.761	S	S	*	*			cis	-135.4	133.2	2.7	0	0	0	0	0	113.2
180	S	25.9	Very low	27.2	Very low	82 Å²	82	138.6 Å²	138.6	57%	0.573	76%	0.755	S	S	*	*			trans	4.7	136.2	140.5	53.8	0	0	0	0	117.9	S182	S180-S182 WeakPolarHBondContact CB-OG 3.47Å; S180-S182 PolarHBondContact OG-OG 3.45Å
181	Y	27.1	Very low	26.9	Very low	253 Å²	253	137.5 Å²	137.5	99%	0.992	75%	0.753	S	S	*	*			cis	37.6	61.6	34.7	-104.9	-72.3	0	0	0	113.7
182	S	26	Very low	26.7	Very low	88 Å²	88	142.7 Å²	142.7	62%	0.615	77%	0.765	S	S	*	*			trans	-144.8	146.9	170.8	49.1	0	0	0	0	110.9	S180	S180-S182 WeakPolarHBondContact CB-OG 3.47Å; S180-S182 PolarHBondContact OG-OG 3.45Å
183	D	24.8	Very low	26.3	Very low	120 Å²	120	142 Å²	142	64%	0.642	76%	0.756	S	S	*	*			trans	-41.7	141.1	-177.4	-58	-99.9	0	0	0	117
184	I	27.2	Very low	26.1	Very low	153 Å²	153	147.6 Å²	147.6	79%	0.785	77%	0.769	S	S	*	*				-123.7	102.5	100.3	-58.4	-174.1	0	0	0	109.8	C186	I184-C186 HydrophobicContact CG2-CB 4.41Å; I184-C186 VanDerWaalsContact CG2-SG 3.56Å; I184-C186 PolarHBondContact O-N 2.92Å; I184-C186 VanDerWaalsContact O-N 3.08Å
185	R	22.7	Very low	25.9	Very low	207 Å²	207	146.9 Å²	146.9	78%	0.781	77%	0.774	S	S	*	*			trans	-65.6	96.3	156.2	-88	172.9	148.4	179.7	-3	109.5
186	C	26	Very low	25.9	Very low	103 Å²	103	143.9 Å²	143.9	70%	0.696	76%	0.764	S	S	*	*			trans	-96.8	93.8	160.5	-88.7	0	0	0	0	109.7	I184 I188	I184-C186 HydrophobicContact CG2-CB 4.41Å; I184-C186 VanDerWaalsContact CG2-SG 3.56Å; I184-C186 PolarHBondContact O-N 2.92Å; I184-C186 VanDerWaalsContact O-N 3.08Å; C186-I188 PolarHBondContact O-N 3.47Å; C186-I188 VanDerWaalsContact O-N 3.1Å
187	N	23.3	Very low	25.5	Very low	143 Å²	143	142.3 Å²	142.3	77%	0.765	76%	0.756	S	S	*	*			trans	-62.1	108.6	169.3	-69.6	-24.9	0	0	0	109.7
188	I	26	Very low	25.8	Very low	157 Å²	157	143.2 Å²	143.2	81%	0.805	76%	0.762	S	S	*	*			trans	-121.4	99.6	159.4	-58.3	-175.2	0	0	0	108	C186	C186-I188 PolarHBondContact O-N 3.47Å; C186-I188 VanDerWaalsContact O-N 3.1Å
189	I	25.6	Very low	25.8	Very low	133 Å²	133	144.4 Å²	144.4	68%	0.682	76%	0.756	S	S	*	*			trans	-66	137.4	176	-63	168.2	0	0	0	108.5	N191	I189-N191 PolarHBondContact O-N 3.47Å
190	P	24.7	Very low	25.6	Very low	119 Å²	119	146.5 Å²	146.5	77%	0.773	77%	0.766	S	S	*	*	S	Bend	trans	-73.5	94.3	177.4	29.9	-34.8	0	0	0	111.1
191	N	23.1	Very low	25.7	Very low	123 Å²	123	146.8 Å²	146.8	66%	0.658	76%	0.764	S	S	*	*			trans	-165.1	110.2	166.3	-100.6	-33.7	0	0	0	113.2	I189	I189-N191 PolarHBondContact O-N 3.47Å
192	Y	26.9	Very low	25.6	Very low	231 Å²	231	140.3 Å²	140.3	91%	0.906	76%	0.756	S	S	*	*			trans	-173.8	102.5	150.4	-91.3	-66.1	0	0	0	104.6
193	Q	25.3	Very low	25.6	Very low	164 Å²	164	143.3 Å²	143.3	77%	0.766	76%	0.764	S	S	*	*			cis	66.7	126.7	40.2	-142.9	173.9	17.5	0	0	112.1
194	H	24.2	Very low	25.9	Very low	192 Å²	192	143.8 Å²	143.8	89%	0.889	77%	0.772	S	S	*	*			trans	-53.1	139.9	-165.6	-74.3	-82.6	0	0	0	115.6
195	C	24.8	Very low	25.9	Very low	127 Å²	127	146 Å²	146	86%	0.858	78%	0.775	S	S	*	*			trans	-151.4	149.7	142	-121.5	0	0	0	0	111.7
196	P	30.1	Very low	26.3	Very low	101 Å²	101	143.5 Å²	143.5	66%	0.656	78%	0.777	S	S	*	*			trans	-107.4	-171.6	-177.8	42.2	-35.2	0	0	0	113.6
197	D	24.6	Very low	26.3	Very low	139 Å²	139	143.7 Å²	143.7	74%	0.743	78%	0.78	S	S	*	*			trans	69.1	153.2	170.9	-60.6	-35.6	0	0	0	114.1
198	L	29.3	Very low	26.6	Very low	171 Å²	171	142.4 Å²	142.4	90%	0.895	78%	0.783	S	S	*	*			cis	-128.8	142.3	44.8	-74.8	159.3	0	0	0	115.5
199	M	25.5	Very low	26.5	Very low	142 Å²	142	144.3 Å²	144.3	70%	0.7	79%	0.785	S	S	*	*			trans	-77.4	135.4	158.9	-73.7	-177.6	158.2	0	0	111.2	T201	M199-T201 PolarHBondContact O-N 3.27Å; M199-T201 PolarHBondContact SD-OG1 2.89Å
200	S	25.1	Very low	26.8	Very low	129 Å²	129	145.1 Å²	145.1	90%	0.902	79%	0.789	S	S	*	*			trans	-90.2	43.4	160.5	52.2	0	0	0	0	112.5
201	T	27.4	Very low	26.8	Very low	88 Å²	88	148.6 Å²	148.6	54%	0.54	79%	0.792	S	S	.	*			trans	-115.8	97.9	169	57.7	0	0	0	0	110	M199 L203	M199-T201 PolarHBondContact O-N 3.27Å; M199-T201 PolarHBondContact SD-OG1 2.89Å; T201-L203 PolarHBondContact O-N 3.49Å; T201-L203 VanDerWaalsContact O-N 3.07Å
202	S	25.7	Very low	27.1	Very low	116 Å²	116	153.1 Å²	153.1	81%	0.811	80%	0.8	S	S	*	*			trans	-66.1	103.3	179.6	36.7	0	0	0	0	111.8
203	L	26.2	Very low	27	Very low	152 Å²	152	151.9 Å²	151.9	80%	0.796	80%	0.8	S	S	*	*			trans	-105.4	60	172.5	-89.3	170.8	0	0	0	111.5	T201 K205	T201-L203 PolarHBondContact O-N 3.49Å; T201-L203 VanDerWaalsContact O-N 3.07Å; L203-K205 PolarHBondContact O-N 3.5Å; L203-K205 VanDerWaalsContact O-N 3.1Å
204	T	31.1	Very low	27.2	Very low	130 Å²	130	149 Å²	149	80%	0.798	80%	0.797	S	S	*	*			trans	-69.6	100.8	156.3	43.9	0	0	0	0	108.2	D206	T204-D206 PolarHBondContact O-N 2.8Å; T204-D206 VanDerWaalsContact O-N 3.16Å
205	K	27	Very low	27.4	Very low	199 Å²	199	150.9 Å²	150.9	87%	0.865	80%	0.797	S	S	*	*			trans	-64.2	110.1	161	-76.1	178.4	179.3	173.3	0	107.4	L203	L203-K205 PolarHBondContact O-N 3.5Å; L203-K205 VanDerWaalsContact O-N 3.1Å
206	D	30.8	Very low	27.5	Very low	154 Å²	154	150.3 Å²	150.3	82%	0.824	79%	0.794	S	S	*	*			trans	-140.2	150.9	154.6	-123.6	-39.2	0	0	0	111.9	T204	T204-D206 PolarHBondContact O-N 2.8Å; T204-D206 VanDerWaalsContact O-N 3.16Å
207	S	25.9	Very low	27.4	Very low	107 Å²	107	153.5 Å²	153.5	75%	0.748	81%	0.805	S	S	*	*			trans	-85.8	127.9	-166.7	59.4	0	0	0	0	112.8
208	S	29	Very low	27.6	Very low	117 Å²	117	155.6 Å²	155.6	82%	0.818	81%	0.81	S	S	*	*				-168.9	149	127.4	40.3	0	0	0	0	113.1
209	F	25.1	Very low	27.6	Very low	197 Å²	197	156.5 Å²	156.5	86%	0.864	81%	0.806	S	S	*	*			trans	-72.7	146.9	164.6	-72.7	-119.8	0	0	0	109.4
210	I	30.2	Very low	27.6	Very low	150 Å²	150	158.1 Å²	158.1	77%	0.769	81%	0.812	S	S	*	*				-165	137.9	124.8	-102.2	151.7	0	0	0	111.8
211	K	25.3	Very low	27.9	Very low	191 Å²	191	156.7 Å²	156.7	83%	0.83	80%	0.802	S	S	*	*			trans	-86.4	124	174	-63	166.4	-179.5	167.3	0	110.4
212	R	29.1	Very low	28	Very low	219 Å²	219	158.2 Å²	158.2	83%	0.826	81%	0.807	S	S	*	*			trans	-159.5	124.3	152.1	-89.1	128.9	-173.1	-159.7	4.3	106.1
213	K	25.3	Very low	28	Very low	205 Å²	205	158.8 Å²	158.8	89%	0.891	80%	0.801	S	S	*	*			cis	74.1	53.8	14.9	-139.8	-176.1	-171.4	-175.8	0	115.9
214	S	29.3	Very low	28.3	Very low	103 Å²	103	160.8 Å²	160.8	72%	0.72	81%	0.806	S	S	*	*			trans	-132.1	100.6	158.2	43.5	0	0	0	0	107.3
215	R	29.4	Very low	28.1	Very low	232 Å²	232	162 Å²	162	88%	0.875	80%	0.803	S	S	*	*				74.4	116.5	77.9	-80.6	-175.3	165	171.2	-4.6	112.8
216	S	25.7	Very low	28.3	Very low	115 Å²	115	161.1 Å²	161.1	80%	0.804	81%	0.806	S	S	*	*			trans	-48.7	138.4	153.2	50.8	0	0	0	0	111.9
217	L	29.4	Very low	28.2	Very low	168 Å²	168	161.1 Å²	161.1	88%	0.88	80%	0.801	S	S	*	*			trans	-135.6	126.7	158.1	-87.1	174.7	0	0	0	109.9
218	H	26.8	Very low	28.5	Very low	182 Å²	182	161.5 Å²	161.5	84%	0.843	80%	0.802	S	S	*	*			trans	-73.2	137.2	158.6	-82.5	-62.5	0	0	0	109.6
219	K	30.2	Very low	28.6	Very low	190 Å²	190	160.9 Å²	160.9	83%	0.826	79%	0.794	S	S	*	*			trans	-173.6	130.1	149	-98.8	173	-179.4	-169.1	0	104.4
220	Q	26.5	Very low	28.7	Very low	177 Å²	177	157.7 Å²	157.7	83%	0.827	79%	0.786	S	S	*	*			cis	66.2	76.7	13.5	-141.5	177.2	16.3	0	0	114.6
221	S	31	Very low	28.9	Very low	98 Å²	98	159.5 Å²	159.5	69%	0.685	79%	0.79	S	S	*	*			trans	-160.7	97.3	154.9	49	0	0	0	0	104.5
222	N	28.2	Very low	29.1	Very low	121 Å²	121	156 Å²	156	65%	0.647	78%	0.78	S	S	*	*				75.2	114.9	83.7	-80.2	70.6	0	0	0	112.5
223	D	27	Very low	29.3	Very low	128 Å²	128	151.3 Å²	151.3	68%	0.684	77%	0.771	S	S	*	*			trans	55.6	118.8	134.8	-37.2	-31.5	0	0	0	119.3
224	H	33.2	Very low	29.6	Very low	193 Å²	193	149.4 Å²	149.4	89%	0.894	76%	0.763	S	S	*	*				-154.2	135.1	105.7	-103.3	-69.5	0	0	0	111.2
225	E	26	Very low	29.7	Very low	157 Å²	157	150 Å²	150	73%	0.734	76%	0.762	S	S	*	*			trans	-77.7	154.4	170.9	-58.8	170.4	102.6	0	0	111.2	H227	E225-H227 IonicContact OE1-CD2 3.92Å
226	L	31.6	Very low	29.9	Very low	179 Å²	179	145.3 Å²	145.3	94%	0.937	76%	0.755	S	S	*	*			trans	-134.5	93.7	150.2	-91.5	175.2	0	0	0	109.6
227	H	27.4	Very low	30.1	Very low	155 Å²	155	143.7 Å²	143.7	72%	0.718	74%	0.743	S	S	*	*			trans	-93.1	128.1	171.2	-109.6	-61.8	0	0	0	110.2	E225	E225-H227 IonicContact OE1-CD2 3.92Å
228	C	32.4	Very low	30	Very low	114 Å²	114	142.9 Å²	142.9	77%	0.77	74%	0.739	S	S	*	*			trans	-131	91.4	160.8	-66.9	0	0	0	0	107.5
229	T	31.3	Very low	30.1	Very low	104 Å²	104	138.5 Å²	138.5	64%	0.638	74%	0.735	S	S	*	*				89.2	99.9	74.9	55.4	0	0	0	0	114.5
230	N	27	Very low	30.1	Very low	131 Å²	131	137 Å²	137	70%	0.701	74%	0.735	S	S	*	*			trans	43.9	122.9	135.5	-55.2	-12.6	0	0	0	121.7
231	H	34.4	Very low	30.2	Very low	187 Å²	187	138 Å²	138	87%	0.866	74%	0.737	S	S	*	*				-174.5	117.4	124.3	-96.3	-75.4	0	0	0	105.8
232	I	29.5	Very low	30.2	Very low	118 Å²	118	137 Å²	137	61%	0.605	74%	0.742	S	S	*	*			cis	74.4	87.4	43.6	-52.3	178.5	0	0	0	113.4
233	D	34.2	Very low	30.3	Very low	121 Å²	121	139.6 Å²	139.6	65%	0.647	76%	0.756	S	S	*	*				-171.1	141.3	116.3	-94.6	-33.2	0	0	0	108.6
234	K	30.5	Very low	30.5	Very low	164 Å²	164	137.2 Å²	137.2	71%	0.713	76%	0.761	S	S	*	*				57.5	132.3	74.7	-56.4	-163.6	-153.4	93.8	0	113.3
235	T	32.7	Very low	30.3	Very low	115 Å²	115	135.9 Å²	135.9	71%	0.706	76%	0.761	S	S	*	*			cis	-164.5	175.3	-1.7	14.2	0	0	0	0	108
236	D	33.1	Very low	30.4	Very low	135 Å²	135	140.2 Å²	140.2	72%	0.722	77%	0.771	S	S	*	*			cis	-155.5	170.8	4	-132.9	-38.4	0	0	0	115.2
237	S	28.7	Very low	30.2	Very low	80 Å²	80	137 Å²	137	56%	0.559	76%	0.764	S	S	*	*			trans	20.3	148	147.8	84	0	0	0	0	126.7
238	N	28.3	Very low	30.3	Very low	151 Å²	151	139.7 Å²	139.7	81%	0.807	77%	0.773	S	S	*	*			trans	90.4	137.1	138	-67.6	-31.3	0	0	0	123.4
239	A	29.8	Very low	30.2	Very low	91 Å²	91	145 Å²	145	75%	0.752	78%	0.777	S	S	*	*			trans	67.3	141	158.2	0	0	0	0	0	119.7
240	L	29.6	Very low	30	Very low	159 Å²	159	147.6 Å²	147.6	83%	0.832	79%	0.786	S	S	*	*			cis	-154.3	176.3	-17.6	-139.8	107.4	0	0	0	110.8
241	F	27.8	Very low	30.2	Very low	197 Å²	197	147.2 Å²	147.2	86%	0.864	79%	0.791	S	S	*	*			trans	-47	149.1	-175.4	-73.5	-104.8	0	0	0	118.4
242	G	31.7	Very low	29.9	Very low	76 Å²	76	143.1 Å²	143.1	78%	0.784	78%	0.783	S	S	*	*			trans	-178.7	104.7	162.4	0	0	0	0	0	114.5
243	N	30.2	Very low	30.2	Very low	177 Å²	177	142.9 Å²	142.9	95%	0.947	79%	0.789	S	S	*	*			trans	-83.9	148	-178.8	-80.9	-33.5	0	0	0	113.3
244	G	31.5	Very low	29.9	Very low	77 Å²	77	142.6 Å²	142.6	79%	0.794	80%	0.795	S	S	*	*			trans	178.3	87.4	173.1	0	0	0	0	0	115.1
245	N	29.4	Very low	29.8	Very low	166 Å²	166	140.7 Å²	140.7	89%	0.888	80%	0.797	S	S	*	*			trans	-64.2	132.2	-175.1	-75.6	-39.5	0	0	0	114.9
246	R	27.2	Very low	29.6	Very low	247 Å²	247	142.5 Å²	142.5	93%	0.932	80%	0.802	S	S	*	*				-170.5	145.7	126.5	-107.7	173.3	-169.3	-160.1	4.4	113.7
247	S	27.5	Very low	29.4	Very low	113 Å²	113	142.6 Å²	142.6	79%	0.79	80%	0.801	S	S	*	*			trans	66.6	120.2	162.1	-154.2	0	0	0	0	118.7
248	K	30	Very low	29.4	Very low	210 Å²	210	149.5 Å²	149.5	91%	0.913	82%	0.815	S	S	*	*			trans	-126.4	129.9	154.1	-86.6	-170	174.7	-178.8	0	109.9
249	R	28.9	Very low	29.4	Very low	227 Å²	227	148.7 Å²	148.7	86%	0.857	82%	0.816	S	S	*	*			trans	-75.5	169.1	164.7	-75.5	175.6	167.8	167.4	-5.4	110.3
250	L	28.8	Very low	29.6	Very low	157 Å²	157	148.5 Å²	148.5	82%	0.822	81%	0.814	S	S	*	*			trans	-33.7	152.3	160.7	-65.1	143.5	0	0	0	113.9
251	P	31.4	Very low	29.8	Very low	124 Å²	124	149.2 Å²	149.2	81%	0.805	81%	0.813	S	S	*	*				-130.5	176.8	102.3	38.8	-32.7	0	0	0	114.4
252	S	27.5	Very low	30.1	Very low	100 Å²	100	148 Å²	148	70%	0.699	81%	0.81	S	S	*	*			trans	-97.3	-159	176.1	-56.4	0	0	0	0	110.8
253	P	35.4	Very low	30.2	Very low	113 Å²	113	150.9 Å²	150.9	73%	0.734	81%	0.813	S	S	*	*				-125.5	-168.7	-90	39.5	-23.7	0	0	0	113.9
254	C	28.2	Very low	30.4	Very low	116 Å²	116	145.9 Å²	145.9	78%	0.784	80%	0.803	S	S	*	*			trans	87.9	131.8	154.6	-74.3	0	0	0	0	121.7
255	V	29.1	Very low	30.6	Very low	123 Å²	123	152.9 Å²	152.9	75%	0.745	81%	0.811	S	S	*	*			trans	94.7	103.2	136.8	170.2	0	0	0	0	121.7
256	L	27.8	Very low	30.6	Very low	154 Å²	154	148.4 Å²	148.4	81%	0.806	81%	0.805	S	S	*	*			trans	84.1	151.9	134	-87.5	178	0	0	0	125.9
257	L	28.4	Very low	31.2	Very low	136 Å²	136	142.4 Å²	142.4	71%	0.712	80%	0.798	S	S	*	*			trans	71.6	124.3	167.2	-62.4	163.1	0	0	0	116.6
258	R	28.4	Very low	31.5	Very low	226 Å²	226	146.7 Å²	146.7	85%	0.853	80%	0.802	S	S	*	*				69.2	139.4	64.6	-76.6	-169.2	176.5	170.1	-1.9	112.9
259	T	29.9	Very low	31.3	Very low	134 Å²	134	144.6 Å²	144.6	82%	0.822	80%	0.8	S	S	*	*			cis	-107.3	-142.2	20.4	45.9	0	0	0	0	113.1
260	A	34.2	Very low	31.3	Very low	87 Å²	87	142.1 Å²	142.1	72%	0.719	80%	0.803	S	S	*	*			cis	-153.4	-147.5	9.4	0	0	0	0	0	115.7
261	Q	32.5	Very low	31.4	Very low	174 Å²	174	140.5 Å²	140.5	81%	0.813	80%	0.802	S	S	*	*			trans	-99.1	175.1	-163.6	-66	150.6	-97.9	0	0	112.3
262	E	34	Very low	31.3	Very low	170 Å²	170	138.2 Å²	138.2	79%	0.794	80%	0.801	S	S	*	*			cis	-140.7	164.8	27.6	-78.8	-172.1	133.5	0	0	117
263	T	35	Very low	31.5	Very low	138 Å²	138	142.2 Å²	142.2	85%	0.847	81%	0.808	S	S	*	*			trans	-4.4	150.8	165.9	62.8	0	0	0	0	122.6
264	G	33.4	Very low	31	Very low	71 Å²	71	141.7 Å²	141.7	73%	0.732	80%	0.803	S	S	*	*			cis	158.2	-179.6	-4.1	0	0	0	0	0	115.6
265	K	35	Very low	31.2	Very low	224 Å²	224	145.1 Å²	145.1	97%	0.974	81%	0.807	S	S	*	*			trans	75.8	120.7	172.6	-57.3	179.7	-178.3	175.6	0	119.3
266	G	30.7	Very low	31	Very low	73 Å²	73	146.3 Å²	146.3	75%	0.753	81%	0.809	S	S	*	*			trans	-115.3	-131.3	154.5	0	0	0	0	0	108.9
267	P	39.8	Very low	31.1	Very low	120 Å²	120	145.7 Å²	145.7	78%	0.779	81%	0.813	S	S	*	*			cis	-136.4	-172.1	-32.6	42.4	-27.2	0	0	0	112.1
268	K	32.3	Very low	31.1	Very low	204 Å²	204	143 Å²	143	89%	0.887	81%	0.809	S	S	*	*			trans	-178.5	153.7	137.3	-102.8	161.3	-175.3	179.6	0	114.2
269	L	26.8	Very low	31	Very low	166 Å²	166	140 Å²	140	87%	0.869	81%	0.809	S	S	*	*			trans	-122	164.7	174.1	-70.7	106.8	0	0	0	111
270	L	29.6	Very low	30.9	Very low	175 Å²	175	138.5 Å²	138.5	92%	0.916	80%	0.804	S	S	*	*			trans	-155.4	128.2	154.4	-108.5	165.7	0	0	0	110.9
271	P	30.4	Very low	30.7	Very low	122 Å²	122	141.9 Å²	141.9	79%	0.792	81%	0.81	S	S	*	*			trans	-123.2	166.8	-176.9	41.8	-31.8	0	0	0	115.9
272	G	30	Very low	30.5	Very low	77 Å²	77	144 Å²	144	79%	0.794	81%	0.812	S	S	*	*			trans	147.2	143.5	171.6	0	0	0	0	0	110.9
273	H	31.1	Very low	30.3	Very low	183 Å²	183	141 Å²	141	85%	0.847	80%	0.801	S	S	*	*			cis	-147	165.1	21.3	-153	-75.7	0	0	0	111.4
274	V	25.1	Very low	30.2	Very low	102 Å²	102	142.1 Å²	142.1	62%	0.618	80%	0.801	S	S	*	*			trans	-113.2	146.8	175.1	174.1	0	0	0	0	111
275	Q	30.9	Very low	30.3	Very low	188 Å²	188	145.4 Å²	145.4	88%	0.879	79%	0.791	S	S	*	*			trans	-140.1	149.8	151.1	-75.9	-163.7	-14.3	0	0	110.1
276	N	24.9	Very low	30.6	Very low	148 Å²	148	139.2 Å²	139.2	79%	0.791	77%	0.774	S	S	*	*			trans	-120	134.5	-172.7	-72.8	-38.7	0	0	0	112.1
277	T	30.8	Very low	31.1	Very low	142 Å²	142	144 Å²	144	87%	0.871	77%	0.774	S	S	*	*			trans	-154.8	147.5	147.5	40.7	0	0	0	0	107.8
278	A	28	Very low	31.2	Very low	78 Å²	78	148.4 Å²	148.4	65%	0.645	78%	0.775	S	S	*	*			cis	160.8	115.3	-25.3	0	0	0	0	0	105.1
279	I	26.9	Very low	31.9	Very low	164 Å²	164	142.7 Å²	142.7	84%	0.841	75%	0.754	S	S	*	*			trans	64.6	102.9	156.4	-50.8	164.7	0	0	0	117.1
280	S	28.2	Very low	33.3	Very low	102 Å²	102	138.3 Å²	138.3	71%	0.713	73%	0.731	S	S	*	*				-179	151.5	100.2	42.5	0	0	0	0	113.4
281	N	29.3	Very low	34.5	Very low	158 Å²	158	135.3 Å²	135.3	85%	0.845	71%	0.712	S	S	*	*			trans	52.8	121.6	159.2	-61	-6.5	0	0	0	120.9
282	Y	27.7	Very low	35.6	Very low	219 Å²	219	133.3 Å²	133.3	86%	0.859	70%	0.697	S	S	*	*			trans	-63.2	140.6	174.9	-64.3	-103.1	0	0	0	113.2
283	D	29.9	Very low	37	Very low	106 Å²	106	133.3 Å²	133.3	57%	0.567	68%	0.677	S	S	*	*			trans	-138.5	106.4	155.4	-170	-6.4	0	0	0	108.8	R285	D283-R285 VanDerWaalsContact C-N 3.33Å; D283-R285 PolarHBondContact O-N 3.31Å; D283-R285 VanDerWaalsContact O-N 3.08Å; D283-R285 WeakPolarHBondContact OD1-CG 3.45Å; D283-R285 IonicContact OD1-NE 2.67Å; D283-R285 IonicContact OD2-CZ 2.73Å; D283-R285 IonicContact OD2-NE 3.09Å; D283-R285 PolarHBondContact OD2-NE 3.09Å; D283-R285 IonicContact OD2-NH2 2.94Å; D283-R285 PolarHBondContact OD2-NH2 2.99Å
284	L	32.4	Very low	38.5	Very low	162 Å²	162	132.5 Å²	132.5	85%	0.848	67%	0.666	S	S	*	*			trans	-86.8	64.9	-169.8	-85.1	166	0	0	0	112
285	R	35.9	Very low	40.2	Very low	141 Å²	141	133.8 Å²	133.8	53%	0.532	67%	0.667	S	S	.	*			trans	-82.7	133.3	176	-55.3	-168.3	-166.4	-174.5	5.7	111.7	D283	D283-R285 VanDerWaalsContact C-N 3.33Å; D283-R285 PolarHBondContact O-N 3.31Å; D283-R285 VanDerWaalsContact O-N 3.08Å; D283-R285 WeakPolarHBondContact OD1-CG 3.45Å; D283-R285 IonicContact OD1-NE 2.67Å; D283-R285 IonicContact OD2-CZ 2.73Å; D283-R285 IonicContact OD2-NE 3.09Å; D283-R285 PolarHBondContact OD2-NE 3.09Å; D283-R285 IonicContact OD2-NH2 2.94Å; D283-R285 PolarHBondContact OD2-NH2 2.99Å
286	P	41.9	Very low	41.6	Very low	93 Å²	93	128.5 Å²	128.5	60%	0.604	65%	0.648	S	S	*	*			trans	-60.5	139.1	177.3	-24.7	34.4	0	0	0	112.8	R288 L289	P286-R288 VanDerWaalsContact C-N 3.25Å; P286-R288 PolarHBondContact O-N 3.27Å; P286-R288 VanDerWaalsContact O-N 3.13Å; P286-L289 WeakPolarHBondContact O-CB 3.45Å; P286-L289 PolarHBondContact O-N 3.27Å
287	K	41.5	Very low	43.3	Very low	173 Å²	173	129.2 Å²	129.2	75%	0.752	64%	0.639	S	S	*	*	H	α-helix	trans	-50.8	-40.8	-178.5	-73.9	-176.1	177.5	178.3	0	113.8	L289 I290 E291	K287-L289 PolarHBondContact O-N 3.01Å; K287-I290 WeakPolarHBondContact O-CB 3.36Å; K287-I290 PolarHBondContact O-N 3.48Å; K287-E291 PolarHBondContact O-N 3.02Å
288	R	41.7	Very low	44.8	Very low	213 Å²	213	129.3 Å²	129.3	80%	0.804	63%	0.63	S	S	*	*	H	α-helix	trans	-54.8	-35.2	177.3	-75.8	-176.1	175.7	161.8	0.4	113	P286 E291 T292	P286-R288 VanDerWaalsContact C-N 3.25Å; P286-R288 PolarHBondContact O-N 3.27Å; P286-R288 VanDerWaalsContact O-N 3.13Å; R288-E291 PolarHBondContact O-N 2.91Å; R288-T292 PolarHBondContact O-N 3.45Å; R288-T292 PolarHBondContact O-OG1 3.12Å
289	L	46.8	Very low	45.8	Very low	85 Å²	85	131.9 Å²	131.9	45%	0.445	63%	0.628	S	S	.	*	H	α-helix	trans	-69.6	-35.9	177.9	-158.5	81.8	0	0	0	111.7	P286 K287 E291 T292 E293	P286-L289 WeakPolarHBondContact O-CB 3.45Å; P286-L289 PolarHBondContact O-N 3.27Å; K287-L289 PolarHBondContact O-N 3.01Å; L289-E291 VanDerWaalsContact C-N 3.33Å; L289-T292 PolarHBondContact O-OG1 2.98Å; L289-E293 WeakPolarHBondContact O-CB 3.47Å; L289-E293 PolarHBondContact O-N 3.5Å
290	I	55.8	Low	47.1	Very low	74 Å²	74	128.9 Å²	128.9	38%	0.379	61%	0.614	S	S	.	*	H	α-helix	trans	-71.4	-32.9	176.8	-58	173.4	0	0	0	110.4	K287 R294	K287-I290 WeakPolarHBondContact O-CB 3.36Å; K287-I290 PolarHBondContact O-N 3.48Å; I290-R294 VanDerWaalsContact O-CB 3.28Å; I290-R294 WeakPolarHBondContact O-CB 3.44Å; I290-R294 WeakPolarHBondContact O-CG 3.49Å; I290-R294 PolarHBondContact O-N 3.44Å
291	E	55.3	Low	48.5	Very low	112 Å²	112	126.4 Å²	126.4	52%	0.523	60%	0.599	S	S	.	*	H	α-helix	trans	-75.9	-42.2	177.4	-72.9	169.7	145.4	0	0	112.3	K287 R288 L289 R294 M295	K287-E291 PolarHBondContact O-N 3.02Å; R288-E291 PolarHBondContact O-N 2.91Å; L289-E291 VanDerWaalsContact C-N 3.33Å; E291-R294 PolarHBondContact O-N 2.83Å; E291-M295 WeakPolarHBondContact O-CG 3.39Å; E291-M295 PolarHBondContact O-N 2.96Å
292	T	54.5	Low	49.8	Very low	79 Å²	79	121.1 Å²	121.1	49%	0.485	57%	0.574	S	S	.	*	H	α-helix	trans	-64.8	-42.8	171.5	54.1	0	0	0	0	111.7	R288 L289 R294 M295 V296	R288-T292 PolarHBondContact O-N 3.45Å; R288-T292 PolarHBondContact O-OG1 3.12Å; L289-T292 PolarHBondContact O-OG1 2.98Å; T292-R294 VanDerWaalsContact C-N 3.28Å; T292-R294 PolarHBondContact O-N 3.41Å; T292-M295 PolarHBondContact O-N 3.36Å; T292-V296 WeakPolarHBondContact O-CG2 3.22Å; T292-V296 PolarHBondContact O-N 3.44Å
293	E	57.4	Low	50.7	Low	78 Å²	78	114.1 Å²	114.1	36%	0.364	56%	0.555	S	S	.	*	H	α-helix	trans	-64.1	-33.4	175.9	-161.6	-172.7	170.8	0	0	111.9	L289 R297	L289-E293 WeakPolarHBondContact O-CB 3.47Å; L289-E293 PolarHBondContact O-N 3.5Å; E293-R297 VanDerWaalsContact O-CB 3.25Å; E293-R297 WeakPolarHBondContact O-CB 3.32Å; E293-R297 WeakPolarHBondContact O-CD 3.44Å; E293-R297 WeakPolarHBondContact O-CG 3.36Å; E293-R297 PolarHBondContact O-N 3.48Å; E293-R297 IonicContact OE1-CZ 3.23Å; E293-R297 VanDerWaalsContact OE1-CZ 3.23Å; E293-R297 IonicContact OE1-NE 3.77Å; E293-R297 PolarHBondContact OE1-NE 3.49Å; E293-R297 IonicContact OE1-NH2 2.65Å; E293-R297 PolarHBondContact OE1-NH2 3.3Å
294	R	62.9	Low	51.4	Low	165 Å²	165	118.1 Å²	118.1	62%	0.623	56%	0.562	S	S	*	*	H	α-helix	trans	-67.2	-43.2	171.6	-83.3	172.5	173.9	-171.2	-2.3	112.8	I290 E291 T292 R297 Q298	I290-R294 VanDerWaalsContact O-CB 3.28Å; I290-R294 WeakPolarHBondContact O-CB 3.44Å; I290-R294 WeakPolarHBondContact O-CG 3.49Å; I290-R294 PolarHBondContact O-N 3.44Å; E291-R294 PolarHBondContact O-N 2.83Å; T292-R294 VanDerWaalsContact C-N 3.28Å; T292-R294 PolarHBondContact O-N 3.41Å; R294-R297 PolarHBondContact O-N 3.42Å; R294-Q298 WeakPolarHBondContact O-CG 3.41Å; R294-Q298 PolarHBondContact O-N 2.74Å
295	M	61.6	Low	52.1	Low	129 Å²	129	117.6 Å²	117.6	64%	0.635	56%	0.555	S	S	*	*	H	α-helix	trans	-61.2	-50.7	176	-73.8	-179.4	65.7	0	0	110.9	E291 T292 R297 Q298 E299	E291-M295 WeakPolarHBondContact O-CG 3.39Å; E291-M295 PolarHBondContact O-N 2.96Å; T292-M295 PolarHBondContact O-N 3.36Å; M295-R297 VanDerWaalsContact C-N 3.32Å; M295-R297 PolarHBondContact O-N 3.04Å; M295-Q298 PolarHBondContact O-N 3.04Å; M295-Q298 VanDerWaalsContact O-N 3.07Å; M295-E299 WeakPolarHBondContact O-CB 3.47Å; M295-E299 PolarHBondContact O-N 2.77Å
296	V	59.6	Low	52.5	Low	78 Å²	78	118.3 Å²	118.3	47%	0.473	56%	0.562	S	S	.	*	H	α-helix	trans	-59.2	-41	177	173.3	0	0	0	0	111.5	T292 E299 L300	T292-V296 WeakPolarHBondContact O-CG2 3.22Å; T292-V296 PolarHBondContact O-N 3.44Å; V296-E299 PolarHBondContact O-N 3.36Å; V296-L300 HydrophobicContact CG1-CD1 3.85Å; V296-L300 HydrophobicContact CG1-CG 4.38Å; V296-L300 VanDerWaalsContact O-CB 3.32Å; V296-L300 WeakPolarHBondContact O-CB 3.27Å; V296-L300 VanDerWaalsContact O-CG 3.27Å; V296-L300 WeakPolarHBondContact O-CG 3.3Å; V296-L300 PolarHBondContact O-N 2.83Å
297	R	60.9	Low	52.5	Low	162 Å²	162	117.4 Å²	117.4	61%	0.611	56%	0.558	S	S	*	*	H	α-helix	trans	-66.6	-34.9	175	-74.5	169.3	179.5	-129.3	9	113.1	E293 R294 M295 A301	E293-R297 VanDerWaalsContact O-CB 3.25Å; E293-R297 WeakPolarHBondContact O-CB 3.32Å; E293-R297 WeakPolarHBondContact O-CD 3.44Å; E293-R297 WeakPolarHBondContact O-CG 3.36Å; E293-R297 PolarHBondContact O-N 3.48Å; E293-R297 IonicContact OE1-CZ 3.23Å; E293-R297 VanDerWaalsContact OE1-CZ 3.23Å; E293-R297 IonicContact OE1-NE 3.77Å; E293-R297 PolarHBondContact OE1-NE 3.49Å; E293-R297 IonicContact OE1-NH2 2.65Å; E293-R297 PolarHBondContact OE1-NH2 3.3Å; R294-R297 PolarHBondContact O-N 3.42Å; M295-R297 VanDerWaalsContact C-N 3.32Å; M295-R297 PolarHBondContact O-N 3.04Å; R297-A301 WeakPolarHBondContact O-CB 3.04Å; R297-A301 PolarHBondContact O-N 3.04Å; R297-A301 VanDerWaalsContact O-N 3.08Å
298	Q	63.6	Low	52.5	Low	144 Å²	144	114.7 Å²	114.7	67%	0.673	56%	0.556	S	S	*	*	H	α-helix	trans	-70.5	-39.9	173.9	-78.4	-177.5	-33.4	0	0	111.9	R294 M295 A301 S302	R294-Q298 WeakPolarHBondContact O-CG 3.41Å; R294-Q298 PolarHBondContact O-N 2.74Å; M295-Q298 PolarHBondContact O-N 3.04Å; M295-Q298 VanDerWaalsContact O-N 3.07Å; Q298-A301 WeakPolarHBondContact O-CB 3.24Å; Q298-A301 PolarHBondContact O-N 3.39Å; Q298-S302 PolarHBondContact O-N 3.08Å
299	E	48.6	Very low	52.2	Low	132 Å²	132	109.5 Å²	109.5	62%	0.617	55%	0.548	S	S	*	.	H	α-helix	trans	-67	-46.4	178.9	-167.7	152.5	-126.3	0	0	111.5	M295 V296 A301 S302 T303	M295-E299 WeakPolarHBondContact O-CB 3.47Å; M295-E299 PolarHBondContact O-N 2.77Å; V296-E299 PolarHBondContact O-N 3.36Å; E299-A301 VanDerWaalsContact C-N 3.29Å; E299-A301 PolarHBondContact O-N 3.3Å; E299-S302 PolarHBondContact O-N 3.3Å; E299-S302 VanDerWaalsContact O-N 3.08Å; E299-S302 PolarHBondContact O-OG 3.26Å; E299-T303 PolarHBondContact O-N 2.99Å; E299-T303 PolarHBondContact O-OG1 3.05Å
300	L	52.9	Low	51.6	Low	102 Å²	102	115 Å²	115	53%	0.534	56%	0.564	S	S	.	*	H	α-helix	trans	-61	-31.9	170.9	-72.9	171.2	0	0	0	113.3	V296 T303 R304	V296-L300 HydrophobicContact CG1-CD1 3.85Å; V296-L300 HydrophobicContact CG1-CG 4.38Å; V296-L300 VanDerWaalsContact O-CB 3.32Å; V296-L300 WeakPolarHBondContact O-CB 3.27Å; V296-L300 VanDerWaalsContact O-CG 3.27Å; V296-L300 WeakPolarHBondContact O-CG 3.3Å; V296-L300 PolarHBondContact O-N 2.83Å; L300-T303 WeakPolarHBondContact CA-OG1 3.35Å; L300-T303 PolarHBondContact O-OG1 2.83Å; L300-R304 WeakPolarHBondContact O-CB 3.35Å; L300-R304 VanDerWaalsContact O-CG 3.32Å; L300-R304 WeakPolarHBondContact O-CG 3.21Å; L300-R304 PolarHBondContact O-N 3.32Å; L300-R304 VanDerWaalsContact O-N 3.17Å
301	A	57.8	Low	50.5	Low	49 Å²	49	118.5 Å²	118.5	41%	0.405	58%	0.584	S	S	.	*	H	α-helix	trans	-70	-39.9	172.1	0	0	0	0	0	111.6	R297 Q298 E299 R304 Q305	R297-A301 WeakPolarHBondContact O-CB 3.04Å; R297-A301 PolarHBondContact O-N 3.04Å; R297-A301 VanDerWaalsContact O-N 3.08Å; Q298-A301 WeakPolarHBondContact O-CB 3.24Å; Q298-A301 PolarHBondContact O-N 3.39Å; E299-A301 VanDerWaalsContact C-N 3.29Å; E299-A301 PolarHBondContact O-N 3.3Å; A301-R304 PolarHBondContact O-N 2.95Å; A301-Q305 PolarHBondContact O-N 3.32Å
302	S	57.2	Low	49.4	Very low	47 Å²	47	120.7 Å²	120.7	33%	0.329	60%	0.599	S	S	.	*	H	α-helix	trans	-67.8	-38.9	179.8	84.5	0	0	0	0	112.9	Q298 E299 Q305 K306	Q298-S302 PolarHBondContact O-N 3.08Å; E299-S302 PolarHBondContact O-N 3.3Å; E299-S302 VanDerWaalsContact O-N 3.08Å; E299-S302 PolarHBondContact O-OG 3.26Å; S302-Q305 PolarHBondContact O-N 3.23Å; S302-K306 WeakPolarHBondContact O-CG 3.49Å; S302-K306 PolarHBondContact O-N 2.91Å; S302-K306 VanDerWaalsContact O-N 3.1Å
303	T	47	Very low	48.3	Very low	72 Å²	72	123 Å²	123	44%	0.442	61%	0.613	S	S	.	*	H	α-helix	trans	-72.2	-35.4	176	49	0	0	0	0	111.7	E299 L300 K306 S307	E299-T303 PolarHBondContact O-N 2.99Å; E299-T303 PolarHBondContact O-OG1 3.05Å; L300-T303 WeakPolarHBondContact CA-OG1 3.35Å; L300-T303 PolarHBondContact O-OG1 2.83Å; T303-K306 PolarHBondContact O-N 3.5Å; T303-S307 WeakPolarHBondContact O-CB 3.18Å; T303-S307 PolarHBondContact O-N 2.89Å; T303-S307 PolarHBondContact O-OG 3.2Å
304	R	45	Very low	46.9	Very low	190 Å²	190	127.7 Å²	127.7	72%	0.717	64%	0.639	S	S	*	*	H	α-helix	trans	-64.6	-37.1	169.8	-78.4	-178.1	170.2	-164.1	-3.2	113.3	L300 A301 S307 V308	L300-R304 WeakPolarHBondContact O-CB 3.35Å; L300-R304 VanDerWaalsContact O-CG 3.32Å; L300-R304 WeakPolarHBondContact O-CG 3.21Å; L300-R304 PolarHBondContact O-N 3.32Å; L300-R304 VanDerWaalsContact O-N 3.17Å; A301-R304 PolarHBondContact O-N 2.95Å; R304-S307 WeakPolarHBondContact CA-OG 3.22Å; R304-S307 PolarHBondContact O-OG 3.01Å; R304-V308 VanDerWaalsContact O-CG2 3.29Å; R304-V308 WeakPolarHBondContact O-CG2 3.26Å; R304-V308 PolarHBondContact O-N 2.89Å
305	Q	47.2	Very low	45.4	Very low	151 Å²	151	124.4 Å²	124.4	71%	0.706	64%	0.641	S	S	*	*	H	α-helix	trans	-69.7	-37.1	175	-76.3	-175	-15.5	0	0	113.1	A301 S302 T309	A301-Q305 PolarHBondContact O-N 3.32Å; S302-Q305 PolarHBondContact O-N 3.23Å; Q305-T309 PolarHBondContact O-OG1 3.06Å; Q305-T309 VanDerWaalsContact O-OG1 3.04Å
306	K	43.8	Very low	43.9	Very low	156 Å²	156	125.1 Å²	125.1	68%	0.678	65%	0.647	S	S	*	*	H	α-helix	trans	-72.3	-30.6	177.5	-72.3	173.6	179.7	173.5	0	113.8	S302 T303 T309	S302-K306 WeakPolarHBondContact O-CG 3.49Å; S302-K306 PolarHBondContact O-N 2.91Å; S302-K306 VanDerWaalsContact O-N 3.1Å; T303-K306 PolarHBondContact O-N 3.5Å; K306-T309 PolarHBondContact O-OG1 3.21Å
307	S	41.1	Very low	42.7	Very low	74 Å²	74	129 Å²	129	52%	0.517	67%	0.666	S	S	.	*	H	α-helix	trans	-80.5	-25.7	179.6	45.5	0	0	0	0	113.7	T303 R304	T303-S307 WeakPolarHBondContact O-CB 3.18Å; T303-S307 PolarHBondContact O-N 2.89Å; T303-S307 PolarHBondContact O-OG 3.2Å; R304-S307 WeakPolarHBondContact CA-OG 3.22Å; R304-S307 PolarHBondContact O-OG 3.01Å
308	V	41.1	Very low	41.1	Very low	117 Å²	117	129.3 Å²	129.3	71%	0.709	68%	0.679	S	S	*	*	H	α-helix	trans	-76.9	-20.5	177.9	170.7	0	0	0	0	113.1	R304	R304-V308 VanDerWaalsContact O-CG2 3.29Å; R304-V308 WeakPolarHBondContact O-CG2 3.26Å; R304-V308 PolarHBondContact O-N 2.89Å
309	T	37.1	Very low	39.7	Very low	104 Å²	104	128 Å²	128	64%	0.638	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-7	-176.4	17.7	0	0	0	0	115.6	Q305 K306	Q305-T309 PolarHBondContact O-OG1 3.06Å; Q305-T309 VanDerWaalsContact O-OG1 3.04Å; K306-T309 PolarHBondContact O-OG1 3.21Å
310	Y	33.9	Very low	38.7	Very low	200 Å²	200	128.7 Å²	128.7	78%	0.784	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	1.3	-168.7	-121.2	-85.6	0	0	0	116.7
311	N	32.9	Very low	37.8	Very low	148 Å²	148	131.7 Å²	131.7	79%	0.791	71%	0.709	S	S	*	*	S	Bend	trans	-122.9	18.8	-171.7	-86.9	-31.3	0	0	0	115.1
312	N	30.6	Very low	36.5	Very low	158 Å²	158	137 Å²	137	85%	0.845	72%	0.723	S	S	*	*	S	Bend	trans	-142.9	42	-175.1	-104.3	-26.4	0	0	0	115.1
313	T	32.1	Very low	35.1	Very low	127 Å²	127	141.4 Å²	141.4	78%	0.779	74%	0.742	S	S	*	*			trans	-143.5	48.6	175.6	32.5	0	0	0	0	113.4
314	I	29	Very low	34.3	Very low	176 Å²	176	142.5 Å²	142.5	90%	0.903	75%	0.753	S	S	*	*			trans	-105.6	78.1	167.1	-51.7	-177.7	0	0	0	110.2
315	S	31.7	Very low	33.5	Very low	97 Å²	97	141.9 Å²	141.9	68%	0.678	76%	0.755	S	S	*	*			trans	-170	133.3	160	59.1	0	0	0	0	111
316	N	29.9	Very low	32.7	Very low	143 Å²	143	141.8 Å²	141.8	77%	0.765	76%	0.76	S	S	*	*			trans	45.2	113.1	155.1	-53.2	-17.2	0	0	0	117.2
317	N	33.5	Very low	32.2	Very low	160 Å²	160	140.5 Å²	140.5	86%	0.856	77%	0.769	S	S	*	*				-159.4	138.8	80.3	-86.1	-36	0	0	0	113.4
318	N	27.8	Very low	31.5	Very low	169 Å²	169	148.4 Å²	148.4	90%	0.904	79%	0.788	S	S	*	*			trans	-95	131.2	168.1	-71.3	-44.7	0	0	0	110.4
319	S	33	Very low	31	Very low	117 Å²	117	153 Å²	153	82%	0.818	80%	0.798	S	S	*	*			trans	-160.4	124.4	157.8	57.2	0	0	0	0	111.7
320	N	28.8	Very low	30.8	Very low	146 Å²	146	153.9 Å²	153.9	78%	0.781	81%	0.806	S	S	*	*			trans	-89.9	140.9	-178.3	-59.8	-70.4	0	0	0	112.7	F322	N320-F322 HydrophobicContact CB-CD2 4.44Å
321	I	33.3	Very low	30.8	Very low	164 Å²	164	151.2 Å²	151.2	84%	0.841	81%	0.81	S	S	*	*			trans	-142.3	94.8	152.7	-53.2	-178.4	0	0	0	106.4
322	F	29.9	Very low	30.7	Very low	160 Å²	160	152.5 Å²	152.5	70%	0.702	81%	0.808	S	S	*	*				52.8	108.1	96.5	-81.1	-108.5	0	0	0	113.6	N320	N320-F322 HydrophobicContact CB-CD2 4.44Å
323	L	27.7	Very low	30.7	Very low	140 Å²	140	153 Å²	153	73%	0.733	81%	0.805	S	S	*	*				67.6	136.7	92.3	-78	162.1	0	0	0	113.3
324	S	30.6	Very low	30.7	Very low	96 Å²	96	153.7 Å²	153.7	67%	0.671	81%	0.81	S	S	*	*			cis	-161.5	147.2	27.1	61	0	0	0	0	116.8
325	K	27.9	Very low	30.5	Very low	176 Å²	176	150.4 Å²	150.4	77%	0.765	80%	0.802	S	S	*	*			trans	38.5	156.9	132.8	-65.9	-177.3	176.2	175.7	0	124.2
326	N	31.9	Very low	30.7	Very low	150 Å²	150	151.1 Å²	151.1	80%	0.802	81%	0.805	S	S	*	*			trans	89.9	142.2	165	-52.6	-30	0	0	0	115
327	C	31.8	Very low	30.8	Very low	129 Å²	129	156.3 Å²	156.3	87%	0.872	81%	0.814	S	S	*	*			cis	-130.7	165.8	12.4	-80.7	0	0	0	0	114.2
328	R	28.1	Very low	30.5	Very low	239 Å²	239	153.7 Å²	153.7	90%	0.902	81%	0.808	S	S	*	*			trans	-121.7	146.3	164.7	-72.6	178.5	172.6	175.8	-3.1	110.5
329	K	30.4	Very low	30.6	Very low	214 Å²	214	153 Å²	153	93%	0.93	80%	0.803	S	S	*	*			trans	-152.7	130.1	153.6	-78.8	-162.9	177.8	179.2	0	111.9
330	P	33.1	Very low	30.4	Very low	123 Å²	123	156.6 Å²	156.6	80%	0.799	80%	0.804	S	S	*	*			trans	-124.3	156	173.2	39.6	-28.5	0	0	0	114.9
331	V	32.4	Very low	30.3	Very low	144 Å²	144	157.8 Å²	157.8	87%	0.873	80%	0.803	S	S	*	*			trans	-144.3	118.4	165.2	-176.5	0	0	0	0	106.4
332	K	30.5	Very low	30.2	Very low	174 Å²	174	155.8 Å²	155.8	76%	0.757	80%	0.801	S	S	*	*				88.5	103.4	54.8	-108.4	-164.7	175.6	-167.3	0	115.3
333	Q	30.7	Very low	30	Very low	168 Å²	168	157.6 Å²	157.6	79%	0.785	80%	0.804	S	S	*	*			trans	65.6	145.8	153.8	-64.1	163.4	-67.8	0	0	116
334	T	32.9	Very low	30.2	Very low	142 Å²	142	160.6 Å²	160.6	87%	0.871	81%	0.812	S	S	*	*			cis	-135.4	-179	33.2	53.5	0	0	0	0	114.9
335	S	25.5	Very low	30.1	Very low	107 Å²	107	163 Å²	163	75%	0.748	82%	0.817	S	S	*	*			trans	-140.9	-175.8	173.4	63	0	0	0	0	107.9
336	P	34.8	Very low	30.3	Very low	113 Å²	113	162.4 Å²	162.4	73%	0.734	82%	0.817	S	S	*	*			cis	-134.5	169.4	-6.6	41.5	-25.7	0	0	0	115.2
337	R	32	Very low	30.3	Very low	251 Å²	251	163.6 Å²	163.6	95%	0.947	82%	0.815	S	S	*	*			trans	-162.4	143.7	136.3	-119.2	173.4	-179.8	173.2	0.3	112.3
338	S	26.7	Very low	30.4	Very low	105 Å²	105	165.7 Å²	165.7	73%	0.734	81%	0.809	S	S	*	*			trans	-92.9	143.9	-177.4	53.2	0	0	0	0	112.7
339	L	30	Very low	30.6	Very low	154 Å²	154	161.6 Å²	161.6	81%	0.806	80%	0.8	S	S	*	*			trans	-171	137.6	145.7	-104.5	159.3	0	0	0	113.1
340	K	29.8	Very low	30.7	Very low	193 Å²	193	156.7 Å²	156.7	84%	0.839	78%	0.783	S	S	*	*			trans	61.1	118.2	159.5	-70.1	171.7	-179	179.3	0	120.3
341	K	25.9	Very low	30.8	Very low	171 Å²	171	156 Å²	156	74%	0.743	77%	0.772	S	S	*	*			trans	-70.6	148.4	166.2	-51.6	168.7	-178.3	176	0	111.1	Y343	K341-Y343 PolarHBondContact O-N 2.86Å
342	P	31.3	Very low	30.9	Very low	123 Å²	123	155.6 Å²	155.6	80%	0.799	75%	0.754	S	S	*	*			trans	-77.7	113.6	159.1	31.1	-30.4	0	0	0	110.4	F344	P342-F344 PolarHBondContact O-N 2.82Å
343	Y	26.4	Very low	30.9	Very low	197 Å²	197	150.9 Å²	150.9	77%	0.773	74%	0.743	S	S	*	*			trans	-79.4	111.2	167.3	-100.8	-98.3	0	0	0	109.3	K341	K341-Y343 PolarHBondContact O-N 2.86Å
344	F	31.7	Very low	31	Very low	204 Å²	204	148.5 Å²	148.5	90%	0.895	74%	0.735	S	S	*	*			trans	-139.2	72.1	170.2	-108	-79.7	0	0	0	111.5	P342	P342-F344 PolarHBondContact O-N 2.82Å
345	N	29.2	Very low	31	Very low	147 Å²	147	148.2 Å²	148.2	79%	0.786	73%	0.728	S	S	*	*	S	Bend	trans	-145.9	173.1	169.5	-121	-16.7	0	0	0	110.6	K347	N345-K347 VanDerWaalsContact C-N 3.31Å; N345-K347 PolarHBondContact O-N 3.12Å
346	E	31.4	Very low	31.3	Very low	163 Å²	163	152.8 Å²	152.8	76%	0.762	73%	0.729	S	S	*	*	S	Bend	trans	68	-33	169.7	-60.8	179.2	144.3	0	0	119.2	K348	E346-K348 VanDerWaalsContact C-N 3.3Å; E346-K348 PolarHBondContact O-N 3.42Å; E346-K348 VanDerWaalsContact O-N 3.12Å
347	K	31.3	Very low	30.9	Very low	174 Å²	174	151.5 Å²	151.5	76%	0.757	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-0.3	-174.2	-108.1	-175.4	-179.6	-176.4	0	117.5	N345	N345-K347 VanDerWaalsContact C-N 3.31Å; N345-K347 PolarHBondContact O-N 3.12Å
348	K	34.4	Very low	30.7	Very low	173 Å²	173	147.9 Å²	147.9	75%	0.752	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	0.1	-177.9	-101	-176	177	179.4	0	116.5	E346 R352	E346-K348 VanDerWaalsContact C-N 3.3Å; E346-K348 PolarHBondContact O-N 3.42Å; E346-K348 VanDerWaalsContact O-N 3.12Å; K348-R352 PolarHBondContact O-NH1 3.12Å; K348-R352 VanDerWaalsContact O-NH1 3.11Å
349	H	33.3	Very low	30.8	Very low	153 Å²	153	153.2 Å²	153.2	71%	0.708	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	-40.3	171	-87.7	-88.3	0	0	0	113.3	I351 R352	H349-I351 VanDerWaalsContact C-N 3.28Å; H349-I351 PolarHBondContact O-N 3.36Å; H349-R352 PolarHBondContact O-N 3Å
350	I	32.5	Very low	30.6	Very low	111 Å²	111	151.5 Å²	151.5	57%	0.569	71%	0.71	S	S	*	*	H	α-helix	trans	-65.8	-28.6	-175.6	-60.9	173.2	0	0	0	112.7	R352 S353 L354	I350-R352 VanDerWaalsContact C-N 3.27Å; I350-R352 PolarHBondContact O-N 3.28Å; I350-S353 PolarHBondContact O-OG 3.47Å; I350-L354 HydrophobicContact CG2-CD1 4.42Å
351	I	35.2	Very low	30.5	Very low	110 Å²	110	151.5 Å²	151.5	56%	0.564	72%	0.715	S	S	*	*	H	α-helix	trans	-74.6	-17.6	175.9	-62.2	175.2	0	0	0	111.9	H349	H349-I351 VanDerWaalsContact C-N 3.28Å; H349-I351 PolarHBondContact O-N 3.36Å
352	R	32.5	Very low	30.6	Very low	135 Å²	135	147.9 Å²	147.9	51%	0.509	71%	0.712	S	S	.	*	H	α-helix	trans	-88.9	-15	179	-72.9	-175.8	169.1	123.6	-22.1	114.4	K348 H349 I350	K348-R352 PolarHBondContact O-NH1 3.12Å; K348-R352 VanDerWaalsContact O-NH1 3.11Å; H349-R352 PolarHBondContact O-N 3Å; I350-R352 VanDerWaalsContact C-N 3.27Å; I350-R352 PolarHBondContact O-N 3.28Å
353	S	32.1	Very low	30.4	Very low	75 Å²	75	147.8 Å²	147.8	52%	0.524	70%	0.704	S	S	.	*	H	α-helix	trans	-83.8	-42.5	170.7	47.3	0	0	0	0	111.9	I350 N355 R356	I350-S353 PolarHBondContact O-OG 3.47Å; S353-N355 VanDerWaalsContact C-N 3.34Å; S353-N355 PolarHBondContact O-N 3.21Å; S353-R356 PolarHBondContact O-N 2.98Å; S353-R356 VanDerWaalsContact O-N 3.15Å
354	L	32.1	Very low	30.7	Very low	117 Å²	117	146 Å²	146	61%	0.613	70%	0.701	S	S	*	*	H	α-helix	trans	-69.9	-22.4	-176.1	-80.5	159.4	0	0	0	115.2	I350 S357	I350-L354 HydrophobicContact CG2-CD1 4.42Å; L354-S357 PolarHBondContact O-OG 3.27Å
355	N	33	Very low	30.4	Very low	136 Å²	136	139.3 Å²	139.3	73%	0.727	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-2.7	173.3	-77.8	10.3	0	0	0	113.6	S353	S353-N355 VanDerWaalsContact C-N 3.34Å; S353-N355 PolarHBondContact O-N 3.21Å
356	R	30.8	Very low	30.4	Very low	204 Å²	204	137 Å²	137	77%	0.77	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	13.3	177.4	-108.9	-177.5	177.4	-164.4	-2.7	113.6	S353	S353-R356 PolarHBondContact O-N 2.98Å; S353-R356 VanDerWaalsContact O-N 3.15Å
357	S	28	Very low	30.2	Very low	86 Å²	86	132.5 Å²	132.5	60%	0.601	66%	0.663	S	S	*	*	S	Bend	trans	-127.7	24.1	-176.8	63	0	0	0	0	114.1	L354	L354-S357 PolarHBondContact O-OG 3.27Å
358	K	27.7	Very low	30	Very low	174 Å²	174	131.7 Å²	131.7	76%	0.757	67%	0.667	S	S	*	*	S	Bend	trans	-113	146.4	156.6	-71.6	-175.1	175.4	-176.4	0	107.5
359	Y	27.3	Very low	29.6	Very low	217 Å²	217	130.1 Å²	130.1	85%	0.851	67%	0.666	S	S	*	*			trans	64.7	69.5	-170.9	-55.3	-75.5	0	0	0	115.5
360	I	27.8	Very low	29.2	Very low	118 Å²	118	131.6 Å²	131.6	61%	0.605	67%	0.673	S	S	*	*			trans	-131	77.2	144.3	-53.2	-179.8	0	0	0	107.9
361	M	26.2	Very low	29	Very low	193 Å²	193	133.5 Å²	133.5	95%	0.951	68%	0.684	S	S	*	*			trans	-152.7	61.5	158	-83.7	-143.1	74.1	0	0	107.5
362	S	27.5	Very low	28.8	Very low	96 Å²	96	136.5 Å²	136.5	67%	0.671	70%	0.695	S	S	*	*			trans	-92.7	155	163.9	51.3	0	0	0	0	109.5
363	D	28.4	Very low	28.5	Very low	121 Å²	121	138.1 Å²	138.1	65%	0.647	71%	0.709	S	S	*	*			trans	78.6	129.7	156.3	-83.7	31.7	0	0	0	120.8
364	K	31.8	Very low	28.6	Very low	160 Å²	160	140.7 Å²	140.7	70%	0.696	72%	0.717	S	S	*	*			trans	65.2	106	148	-58.6	168.9	-168.8	100.4	0	116.7
365	G	26.8	Very low	28.6	Very low	62 Å²	62	141.3 Å²	141.3	64%	0.639	72%	0.721	S	S	*	*			trans	-64.4	162	135.8	0	0	0	0	0	109.7
366	L	28.4	Very low	28.6	Very low	98 Å²	98	139 Å²	139	51%	0.513	72%	0.715	S	S	.	*				-167.9	151.9	91.3	-96.9	162.1	0	0	0	116.2	T652 V653	L366-T652 WeakPolarHBondContact CD2-O 3.43Å; L366-V653 HydrophobicContact CD1-CG2 4.02Å
367	S	27	Very low	28.7	Very low	70 Å²	70	133.6 Å²	133.6	49%	0.49	71%	0.705	S	S	.	*			trans	21.7	113	158	58.6	0	0	0	0	118
368	D	27.6	Very low	29	Very low	157 Å²	157	134.7 Å²	134.7	84%	0.84	70%	0.703	S	S	*	*				-136.9	176.1	110.9	-109.7	-44.5	0	0	0	109.7
369	N	26.2	Very low	29.3	Very low	140 Å²	140	131.8 Å²	131.8	75%	0.749	70%	0.695	S	S	*	*			trans	-92.6	168.2	-153.9	-64.1	-82.5	0	0	0	115.4
370	E	24.6	Very low	29.8	Very low	183 Å²	183	127.3 Å²	127.3	86%	0.855	68%	0.684	S	S	*	*			trans	77.9	146.8	164	-54.2	-172.9	159.7	0	0	119
371	L	27.2	Very low	30	Very low	152 Å²	152	126.3 Å²	126.3	80%	0.796	68%	0.68	S	S	*	*			trans	75.7	117.9	168.7	-59.5	174.8	0	0	0	120.5
372	H	31.3	Very low	30.5	Very low	173 Å²	173	119.4 Å²	119.4	80%	0.801	65%	0.651	S	S	*	*			trans	73.9	97.8	157.8	-65.5	-62.9	0	0	0	121.3
373	E	27.4	Very low	30.8	Very low	169 Å²	169	124.6 Å²	124.6	79%	0.79	66%	0.656	S	S	*	*			trans	-62.2	-179.2	155.2	-60.7	172.3	107	0	0	113.3
374	N	33.5	Very low	31.4	Very low	129 Å²	129	122.8 Å²	122.8	69%	0.69	65%	0.649	S	S	*	*	S	Bend	trans	94.8	-25.5	168.7	-57.4	-29.7	0	0	0	119.7
375	N	33	Very low	31.6	Very low	130 Å²	130	119.8 Å²	119.8	70%	0.695	64%	0.64	S	S	*	*	S	Bend	trans	-93.8	-16.9	-173.3	-74.8	-35.9	0	0	0	116.3
376	S	31.3	Very low	32	Very low	86 Å²	86	121.7 Å²	121.7	60%	0.601	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-25.6	-172.5	50.4	0	0	0	0	115.6	I378	S376-I378 VanDerWaalsContact C-N 3.34Å
377	T	33.6	Very low	32.5	Very low	91 Å²	91	120.4 Å²	120.4	56%	0.558	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-30.4	178.7	33.7	0	0	0	0	112.8	L379 N381	T377-L379 PolarHBondContact O-N 2.94Å; T377-N381 PolarHBondContact O-N 2.85Å
378	I	35.2	Very low	33.2	Very low	110 Å²	110	119.4 Å²	119.4	56%	0.564	63%	0.628	S	S	*	*	H	α-helix	trans	-67.5	-34.7	-178.8	-57.8	175.2	0	0	0	111.5	S376 I380 S382	S376-I378 VanDerWaalsContact C-N 3.34Å; I378-I380 PolarHBondContact O-N 3.48Å; I378-S382 VanDerWaalsContact O-CB 3.3Å; I378-S382 WeakPolarHBondContact O-CB 3.26Å; I378-S382 PolarHBondContact O-N 2.72Å; I378-S382 PolarHBondContact O-OG 3.49Å
379	L	33.3	Very low	33.7	Very low	113 Å²	113	117.9 Å²	117.9	59%	0.592	61%	0.614	S	S	*	*	H	α-helix	trans	-77.9	-15.2	-175.8	-84.9	165.4	0	0	0	115.2	T377	T377-L379 PolarHBondContact O-N 2.94Å
380	I	37	Very low	34.5	Very low	122 Å²	122	117.9 Å²	117.9	63%	0.626	61%	0.607	S	S	*	*	H	α-helix	trans	-93.9	-47	174.5	-60.4	179.1	0	0	0	109.7	I378 S382 R383 T384	I378-I380 PolarHBondContact O-N 3.48Å; I380-S382 VanDerWaalsContact C-N 3.31Å; I380-S382 PolarHBondContact O-N 3.32Å; I380-R383 WeakPolarHBondContact O-CB 3.15Å; I380-R383 PolarHBondContact O-N 3.45Å; I380-T384 PolarHBondContact O-N 2.73Å
381	N	33.3	Very low	35.4	Very low	98 Å²	98	115.2 Å²	115.2	52%	0.524	60%	0.595	S	S	.	*	H	α-helix	trans	-65.7	-29	178.3	-72.1	-1.9	0	0	0	113.5	T377 R383 T384 N385	T377-N381 PolarHBondContact O-N 2.85Å; N381-R383 VanDerWaalsContact C-N 3.32Å; N381-T384 PolarHBondContact O-OG1 2.92Å; N381-T384 VanDerWaalsContact O-OG1 3.07Å; N381-N385 VanDerWaalsContact O-CB 3.23Å; N381-N385 WeakPolarHBondContact O-CB 3.33Å; N381-N385 VanDerWaalsContact O-CG 3.29Å; N381-N385 PolarHBondContact O-N 3.38Å; N381-N385 PolarHBondContact O-ND2 2.83Å
382	S	35.3	Very low	36.3	Very low	47 Å²	47	112.5 Å²	112.5	33%	0.329	58%	0.581	S	S	.	*	H	α-helix	trans	-70	-27.9	172.2	49.1	0	0	0	0	113	I378 I380 L386	I378-S382 VanDerWaalsContact O-CB 3.3Å; I378-S382 WeakPolarHBondContact O-CB 3.26Å; I378-S382 PolarHBondContact O-N 2.72Å; I378-S382 PolarHBondContact O-OG 3.49Å; I380-S382 VanDerWaalsContact C-N 3.31Å; I380-S382 PolarHBondContact O-N 3.32Å; S382-L386 WeakPolarHBondContact O-CB 3.46Å; S382-L386 VanDerWaalsContact O-CG 3.3Å; S382-L386 WeakPolarHBondContact O-CG 3.19Å; S382-L386 PolarHBondContact O-N 3.28Å
383	R	34.7	Very low	36.9	Very low	206 Å²	206	108.9 Å²	108.9	78%	0.777	57%	0.567	S	S	*	*	H	α-helix	trans	-77.6	-35.1	-180	-156.9	173.3	-172.6	178.1	-0.3	112.2	I380 N381 S387	I380-R383 WeakPolarHBondContact O-CB 3.15Å; I380-R383 PolarHBondContact O-N 3.45Å; N381-R383 VanDerWaalsContact C-N 3.32Å; R383-S387 PolarHBondContact O-N 3.26Å
384	T	41	Very low	37.8	Very low	83 Å²	83	104.8 Å²	104.8	51%	0.509	55%	0.553	S	S	.	*	H	α-helix	trans	-72.8	-45.1	170.3	49.7	0	0	0	0	111.7	I380 N381 L386 S387 S388	I380-T384 PolarHBondContact O-N 2.73Å; N381-T384 PolarHBondContact O-OG1 2.92Å; N381-T384 VanDerWaalsContact O-OG1 3.07Å; T384-L386 VanDerWaalsContact C-N 3.29Å; T384-L386 PolarHBondContact O-N 3.06Å; T384-S387 WeakPolarHBondContact O-CB 3.2Å; T384-S387 PolarHBondContact O-N 3Å; T384-S388 PolarHBondContact O-N 3.07Å; T384-S388 VanDerWaalsContact O-N 3.07Å; T384-S388 PolarHBondContact O-OG 3.16Å
385	N	35	Very low	38.5	Very low	96 Å²	96	102.1 Å²	102.1	51%	0.513	54%	0.542	S	S	.	.	H	α-helix	trans	-64	-29.4	176.9	-78.1	-19.8	0	0	0	113.7	N381 S388 K389	N381-N385 VanDerWaalsContact O-CB 3.23Å; N381-N385 WeakPolarHBondContact O-CB 3.33Å; N381-N385 VanDerWaalsContact O-CG 3.29Å; N381-N385 PolarHBondContact O-N 3.38Å; N381-N385 PolarHBondContact O-ND2 2.83Å; N385-S388 PolarHBondContact O-OG 3.1Å; N385-K389 VanDerWaalsContact O-CB 3.29Å; N385-K389 WeakPolarHBondContact O-CB 3.07Å; N385-K389 VanDerWaalsContact O-CG 3.31Å; N385-K389 WeakPolarHBondContact O-CG 3.47Å; N385-K389 PolarHBondContact O-N 3.08Å
386	L	36.3	Very low	39.2	Very low	103 Å²	103	100.3 Å²	100.3	54%	0.539	53%	0.531	S	S	.	.	H	α-helix	trans	-70	-35.6	170.3	-81.7	166.9	0	0	0	112	S382 T384 F390	S382-L386 WeakPolarHBondContact O-CB 3.46Å; S382-L386 VanDerWaalsContact O-CG 3.3Å; S382-L386 WeakPolarHBondContact O-CG 3.19Å; S382-L386 PolarHBondContact O-N 3.28Å; T384-L386 VanDerWaalsContact C-N 3.29Å; T384-L386 PolarHBondContact O-N 3.06Å; L386-F390 WeakPolarHBondContact O-CB 3.37Å; L386-F390 WeakPolarHBondContact O-CD2 3.28Å; L386-F390 PolarHBondContact O-N 3.01Å
387	S	39.1	Very low	39.8	Very low	71 Å²	71	99.3 Å²	99.3	50%	0.497	52%	0.524	S	S	.	.	H	α-helix	trans	-64.6	-48.4	176.4	-160.3	0	0	0	0	111.5	R383 T384 F390 E391	R383-S387 PolarHBondContact O-N 3.26Å; T384-S387 WeakPolarHBondContact O-CB 3.2Å; T384-S387 PolarHBondContact O-N 3Å; S387-F390 PolarHBondContact O-N 3.32Å; S387-F390 VanDerWaalsContact O-N 3.16Å; S387-E391 PolarHBondContact O-N 3Å
388	S	41.3	Very low	40.4	Very low	49 Å²	49	101.2 Å²	101.2	34%	0.343	53%	0.531	S	S	.	.	H	α-helix	trans	-67.9	-37.1	178.1	58.1	0	0	0	0	112.8	T384 N385 F390 E391 N392	T384-S388 PolarHBondContact O-N 3.07Å; T384-S388 VanDerWaalsContact O-N 3.07Å; T384-S388 PolarHBondContact O-OG 3.16Å; N385-S388 PolarHBondContact O-OG 3.1Å; S388-F390 VanDerWaalsContact C-N 3.31Å; S388-F390 PolarHBondContact O-N 2.95Å; S388-E391 PolarHBondContact O-N 3.05Å; S388-N392 PolarHBondContact O-N 3.4Å
389	K	39.1	Very low	40.8	Very low	124 Å²	124	103 Å²	103	54%	0.539	54%	0.537	S	S	.	.	H	α-helix	trans	-61.2	-36.9	169.9	-79.7	-173.5	173.4	-168.2	0	112	N385 I393	N385-K389 VanDerWaalsContact O-CB 3.29Å; N385-K389 WeakPolarHBondContact O-CB 3.07Å; N385-K389 VanDerWaalsContact O-CG 3.31Å; N385-K389 WeakPolarHBondContact O-CG 3.47Å; N385-K389 PolarHBondContact O-N 3.08Å; K389-I393 WeakPolarHBondContact O-CG1 3.45Å; K389-I393 PolarHBondContact O-N 3.44Å; K389-I393 VanDerWaalsContact O-N 3.16Å
390	F	42	Very low	41.1	Very low	140 Å²	140	102.6 Å²	102.6	61%	0.614	53%	0.533	S	S	*	.	H	α-helix	trans	-69	-39.9	175.3	-101.4	-80	0	0	0	113	L386 S387 S388 I393 T394	L386-F390 WeakPolarHBondContact O-CB 3.37Å; L386-F390 WeakPolarHBondContact O-CD2 3.28Å; L386-F390 PolarHBondContact O-N 3.01Å; S387-F390 PolarHBondContact O-N 3.32Å; S387-F390 VanDerWaalsContact O-N 3.16Å; S388-F390 VanDerWaalsContact C-N 3.31Å; S388-F390 PolarHBondContact O-N 2.95Å; F390-I393 PolarHBondContact O-N 3.08Å; F390-T394 PolarHBondContact O-N 3.43Å; F390-T394 PolarHBondContact O-OG1 3.28Å
391	E	44	Very low	41.4	Very low	128 Å²	128	103.5 Å²	103.5	60%	0.598	54%	0.54	S	S	*	.	H	α-helix	trans	-63.6	-41	175.2	-72.7	-177.9	126.7	0	0	111.8	S387 S388 I393 T394 T395	S387-E391 PolarHBondContact O-N 3Å; S388-E391 PolarHBondContact O-N 3.05Å; E391-I393 VanDerWaalsContact C-N 3.31Å; E391-I393 PolarHBondContact O-N 3.05Å; E391-T394 WeakPolarHBondContact CA-OG1 3.48Å; E391-T394 PolarHBondContact O-N 3.1Å; E391-T394 PolarHBondContact O-OG1 2.78Å; E391-T395 PolarHBondContact O-N 2.98Å
392	N	45	Very low	41.8	Very low	95 Å²	95	109.7 Å²	109.7	51%	0.508	56%	0.557	S	S	.	*	H	α-helix	trans	-62.2	-34.3	173.8	-73.3	-12	0	0	0	113.2	S388 T394 T395 I396	S388-N392 PolarHBondContact O-N 3.4Å; N392-T394 VanDerWaalsContact C-N 3.31Å; N392-T394 PolarHBondContact O-N 2.75Å; N392-T395 WeakPolarHBondContact CA-OG1 3.38Å; N392-T395 PolarHBondContact O-N 2.72Å; N392-T395 PolarHBondContact O-OG1 2.83Å; N392-I396 WeakPolarHBondContact O-CD1 3.42Å; N392-I396 VanDerWaalsContact O-CG1 3.26Å; N392-I396 WeakPolarHBondContact O-CG1 3.37Å; N392-I396 PolarHBondContact O-N 3.24Å; N392-I396 VanDerWaalsContact O-N 3.1Å
393	I	45.4	Very low	41.7	Very low	96 Å²	96	110.5 Å²	110.5	49%	0.492	57%	0.572	S	S	.	*	H	α-helix	trans	-66.9	-34.5	173.8	-69.9	163.8	0	0	0	110.8	K389 F390 E391 S397	K389-I393 WeakPolarHBondContact O-CG1 3.45Å; K389-I393 PolarHBondContact O-N 3.44Å; K389-I393 VanDerWaalsContact O-N 3.16Å; F390-I393 PolarHBondContact O-N 3.08Å; E391-I393 VanDerWaalsContact C-N 3.31Å; E391-I393 PolarHBondContact O-N 3.05Å; I393-S397 WeakPolarHBondContact O-CB 3.42Å; I393-S397 PolarHBondContact O-N 2.8Å; I393-S397 VanDerWaalsContact O-N 3.08Å; I393-S397 PolarHBondContact O-OG 3.02Å
394	T	46	Very low	42	Very low	83 Å²	83	106.3 Å²	106.3	51%	0.509	57%	0.566	S	S	.	*	H	α-helix	trans	-74.6	-31.3	175.1	42.1	0	0	0	0	114.5	F390 E391 N392 N398	F390-T394 PolarHBondContact O-N 3.43Å; F390-T394 PolarHBondContact O-OG1 3.28Å; E391-T394 WeakPolarHBondContact CA-OG1 3.48Å; E391-T394 PolarHBondContact O-N 3.1Å; E391-T394 PolarHBondContact O-OG1 2.78Å; N392-T394 VanDerWaalsContact C-N 3.31Å; N392-T394 PolarHBondContact O-N 2.75Å; T394-N398 PolarHBondContact O-N 3.18Å; T394-N398 PolarHBondContact O-ND2 3.41Å
395	T	48.2	Very low	42.2	Very low	73 Å²	73	111.2 Å²	111.2	45%	0.448	58%	0.58	S	S	.	*	H	α-helix	trans	-69.8	-48.1	172.7	48.8	0	0	0	0	111.4	E391 N392 S397 N398 E399	E391-T395 PolarHBondContact O-N 2.98Å; N392-T395 WeakPolarHBondContact CA-OG1 3.38Å; N392-T395 PolarHBondContact O-N 2.72Å; N392-T395 PolarHBondContact O-OG1 2.83Å; T395-S397 PolarHBondContact O-N 3.42Å; T395-N398 WeakPolarHBondContact O-CA 3.27Å; T395-N398 WeakPolarHBondContact O-CB 3.5Å; T395-N398 PolarHBondContact O-N 2.71Å; T395-E399 PolarHBondContact O-N 3.18Å
396	I	46.4	Very low	43	Very low	92 Å²	92	111 Å²	111	47%	0.472	59%	0.586	S	S	.	*	H	α-helix	trans	-57.5	-36	174.9	-65.1	166.1	0	0	0	111.1	N392 N398 E399 M400	N392-I396 WeakPolarHBondContact O-CD1 3.42Å; N392-I396 VanDerWaalsContact O-CG1 3.26Å; N392-I396 WeakPolarHBondContact O-CG1 3.37Å; N392-I396 PolarHBondContact O-N 3.24Å; N392-I396 VanDerWaalsContact O-N 3.1Å; I396-N398 PolarHBondContact O-N 3.41Å; I396-E399 PolarHBondContact O-N 2.88Å; I396-M400 HydrophobicContact CG2-CE 4.37Å; I396-M400 WeakPolarHBondContact O-CG 3.47Å; I396-M400 PolarHBondContact O-N 2.97Å
397	S	45.5	Very low	43.6	Very low	66 Å²	66	112.2 Å²	112.2	46%	0.462	59%	0.589	S	S	.	*	H	α-helix	trans	-64	-24.5	175.1	-63.4	0	0	0	0	114.3	I393 T395	I393-S397 WeakPolarHBondContact O-CB 3.42Å; I393-S397 PolarHBondContact O-N 2.8Å; I393-S397 VanDerWaalsContact O-N 3.08Å; I393-S397 PolarHBondContact O-OG 3.02Å; T395-S397 PolarHBondContact O-N 3.42Å
398	N	45.1	Very low	44	Very low	131 Å²	131	111.8 Å²	111.8	70%	0.701	58%	0.584	S	S	*	*	H	α-helix	trans	-88.8	-25	176.3	-67.1	-33.8	0	0	0	112.6	T394 T395 I396	T394-N398 PolarHBondContact O-N 3.18Å; T394-N398 PolarHBondContact O-ND2 3.41Å; T395-N398 WeakPolarHBondContact O-CA 3.27Å; T395-N398 WeakPolarHBondContact O-CB 3.5Å; T395-N398 PolarHBondContact O-N 2.71Å; I396-N398 PolarHBondContact O-N 3.41Å
399	E	43.6	Very low	44.2	Very low	148 Å²	148	115.2 Å²	115.2	69%	0.692	59%	0.594	S	S	*	*	H	α-helix	trans	-78.8	-24.4	177.9	-67.5	-179.2	153.4	0	0	113.2	T395 I396 N401	T395-E399 PolarHBondContact O-N 3.18Å; I396-E399 PolarHBondContact O-N 2.88Å; E399-N401 PolarHBondContact O-N 3.29Å
400	M	40	Very low	45.4	Very low	104 Å²	104	116 Å²	116	51%	0.512	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.9	22.8	-178.9	-79.1	-168.3	-72.1	0	0	116.3	I396	I396-M400 HydrophobicContact CG2-CE 4.37Å; I396-M400 WeakPolarHBondContact O-CG 3.47Å; I396-M400 PolarHBondContact O-N 2.97Å
401	N	43.8	Very low	46.4	Very low	141 Å²	141	113.8 Å²	113.8	75%	0.754	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	-5.2	-178.1	-128.2	-15.4	0	0	0	114.3	E399	E399-N401 PolarHBondContact O-N 3.29Å
402	Y	40.5	Very low	46.7	Very low	228 Å²	228	111.3 Å²	111.3	89%	0.894	58%	0.581	S	S	*	*	S	Bend	trans	-139.4	117.8	174.6	-78.9	-90.8	0	0	0	111.7
403	G	33.4	Very low	47.9	Very low	63 Å²	63	111.7 Å²	111.7	65%	0.649	58%	0.579	S	S	*	*	S	Bend	trans	126.6	135.7	166.5	0	0	0	0	0	116.5
404	N	41.8	Very low	49.1	Very low	118 Å²	118	110.9 Å²	110.9	63%	0.631	58%	0.575	S	S	*	*			trans	12.1	102.6	163.7	-61.1	-1.8	0	0	0	118.8	S406 T408	N404-S406 PolarHBondContact O-N 3.4Å; N404-T408 WeakPolarHBondContact O-CG2 3.34Å; N404-T408 PolarHBondContact O-OG1 3.35Å
405	K	45.4	Very low	50.2	Low	187 Å²	187	111 Å²	111	81%	0.813	57%	0.573	S	S	*	*	H	α-helix	trans	-75.4	-10.3	179.7	-72.3	-173.2	173.5	-176.5	0	116.5	T408 E409	K405-T408 WeakPolarHBondContact CA-OG1 3.38Å; K405-T408 PolarHBondContact O-OG1 3.14Å; K405-E409 WeakPolarHBondContact O-CB 3.46Å
406	S	51.3	Low	51.1	Low	92 Å²	92	113.5 Å²	113.5	64%	0.643	58%	0.578	S	S	*	*	H	α-helix	trans	-90	-38.6	-170.4	47	0	0	0	0	114.5	N404	N404-S406 PolarHBondContact O-N 3.4Å
407	E	49.7	Very low	52.5	Low	127 Å²	127	113.3 Å²	113.3	59%	0.593	58%	0.577	S	S	*	*	H	α-helix	trans	-85.6	-38.5	179.8	-68.5	169	120.1	0	0	111.1	E409 K410 I411	E407-E409 VanDerWaalsContact C-N 3.28Å; E407-E409 PolarHBondContact O-N 3.17Å; E407-K410 WeakPolarHBondContact O-CA 3.45Å; E407-K410 WeakPolarHBondContact O-CB 3.42Å; E407-K410 PolarHBondContact O-N 2.9Å; E407-I411 WeakPolarHBondContact O-CG1 3.43Å; E407-I411 PolarHBondContact O-N 3.5Å
408	T	46.1	Very low	53.8	Low	63 Å²	63	115.9 Å²	115.9	39%	0.387	58%	0.581	S	S	.	*	H	α-helix	trans	-56.6	-39.9	172.6	46.6	0	0	0	0	112.2	N404 K405 K410 L412	N404-T408 WeakPolarHBondContact O-CG2 3.34Å; N404-T408 PolarHBondContact O-OG1 3.35Å; K405-T408 WeakPolarHBondContact CA-OG1 3.38Å; K405-T408 PolarHBondContact O-OG1 3.14Å; T408-K410 PolarHBondContact O-N 2.94Å; T408-L412 WeakPolarHBondContact O-CB 3.2Å; T408-L412 PolarHBondContact O-N 3.36Å
409	E	46.8	Very low	55	Low	120 Å²	120	113.1 Å²	113.1	56%	0.561	57%	0.569	S	S	*	*	H	α-helix	trans	-74.3	-8	176.1	-141.9	-160.2	-111	0	0	113.9	K405 E407 K413	K405-E409 WeakPolarHBondContact O-CB 3.46Å; E407-E409 VanDerWaalsContact C-N 3.28Å; E407-E409 PolarHBondContact O-N 3.17Å; E409-K413 WeakPolarHBondContact O-CD 3.15Å; E409-K413 WeakPolarHBondContact O-CE 3.22Å; E409-K413 VanDerWaalsContact O-CG 3.31Å; E409-K413 WeakPolarHBondContact O-CG 3.22Å; E409-K413 PolarHBondContact O-NZ 3.33Å; E409-K413 IonicContact OE2-NZ 3.97Å; E409-K413 PolarHBondContact OE2-NZ 2.99Å
410	K	62.8	Low	56.4	Low	140 Å²	140	110.7 Å²	110.7	61%	0.609	56%	0.561	S	S	*	*	H	α-helix	trans	-92.9	-52.3	172.8	-151.6	-175.6	-179	-164.3	0	110.3	E407 T408 L412 K413 D414	E407-K410 WeakPolarHBondContact O-CA 3.45Å; E407-K410 WeakPolarHBondContact O-CB 3.42Å; E407-K410 PolarHBondContact O-N 2.9Å; T408-K410 PolarHBondContact O-N 2.94Å; K410-L412 PolarHBondContact O-N 3.24Å; K410-K413 WeakPolarHBondContact O-CA 3.49Å; K410-K413 WeakPolarHBondContact O-CB 3.34Å; K410-K413 PolarHBondContact O-N 2.88Å; K410-D414 VanDerWaalsContact O-CG 3.23Å; K410-D414 PolarHBondContact O-N 3.4Å
411	I	63.5	Low	58.2	Low	94 Å²	94	111 Å²	111	48%	0.482	56%	0.561	S	S	.	*	H	α-helix	trans	-53.8	-41.3	172.5	-61.5	163.5	0	0	0	110.9	E407 K413 D414 N415	E407-I411 WeakPolarHBondContact O-CG1 3.43Å; E407-I411 PolarHBondContact O-N 3.5Å; I411-K413 PolarHBondContact O-N 3.39Å; I411-D414 PolarHBondContact O-N 2.8Å; I411-N415 WeakPolarHBondContact O-CB 3.28Å; I411-N415 VanDerWaalsContact O-CG 3.25Å; I411-N415 PolarHBondContact O-N 3.35Å; I411-N415 PolarHBondContact O-OD1 3.14Å
412	L	50.3	Low	59.7	Low	76 Å²	76	109.6 Å²	109.6	40%	0.398	55%	0.549	S	S	.	.	H	α-helix	trans	-76	-3.9	177.7	-167.9	131	0	0	0	114.5	T408 K410 K416	T408-L412 WeakPolarHBondContact O-CB 3.2Å; T408-L412 PolarHBondContact O-N 3.36Å; K410-L412 PolarHBondContact O-N 3.24Å; L412-K416 VanDerWaalsContact CD2-NZ 3.33Å; L412-K416 WeakPolarHBondContact O-CD 3.48Å; L412-K416 WeakPolarHBondContact O-CE 3.34Å; L412-K416 VanDerWaalsContact O-CG 3.26Å; L412-K416 WeakPolarHBondContact O-CG 3.38Å
413	K	69.3	Low	61.5	Low	103 Å²	103	102.4 Å²	102.4	45%	0.448	53%	0.53	S	S	.	.	H	α-helix	trans	-94.8	-45.3	164.2	-69.5	176.7	-170.3	104	0	110.2	E409 K410 I411 K416 I417	E409-K413 WeakPolarHBondContact O-CD 3.15Å; E409-K413 WeakPolarHBondContact O-CE 3.22Å; E409-K413 VanDerWaalsContact O-CG 3.31Å; E409-K413 WeakPolarHBondContact O-CG 3.22Å; E409-K413 PolarHBondContact O-NZ 3.33Å; E409-K413 IonicContact OE2-NZ 3.97Å; E409-K413 PolarHBondContact OE2-NZ 2.99Å; K410-K413 WeakPolarHBondContact O-CA 3.49Å; K410-K413 WeakPolarHBondContact O-CB 3.34Å; K410-K413 PolarHBondContact O-N 2.88Å; I411-K413 PolarHBondContact O-N 3.39Å; K413-K416 CarbonylContact O-C 3.57Å; K413-K416 WeakPolarHBondContact O-CA 3.39Å; K413-K416 WeakPolarHBondContact O-CB 3.47Å; K413-K416 PolarHBondContact O-N 3.41Å; K413-I417 WeakPolarHBondContact O-CG1 3.42Å; K413-I417 PolarHBondContact O-N 3.25Å
414	D	70.6	Confident	63.5	Low	79 Å²	79	104.5 Å²	104.5	42%	0.422	52%	0.524	S	S	.	.	H	α-helix	trans	-62.2	-49.1	-178.3	-55.8	-26.2	0	0	0	110.6	K410 I411 K416 I417 E418	K410-D414 VanDerWaalsContact O-CG 3.23Å; K410-D414 PolarHBondContact O-N 3.4Å; I411-D414 PolarHBondContact O-N 2.8Å; D414-K416 PolarHBondContact O-N 2.99Å; D414-K416 VanDerWaalsContact O-N 3.12Å; D414-I417 WeakPolarHBondContact O-CB 3.27Å; D414-I417 PolarHBondContact O-N 3.32Å; D414-E418 PolarHBondContact O-N 2.8Å
415	N	69	Low	65.2	Low	85 Å²	85	105.5 Å²	105.5	46%	0.455	53%	0.525	S	S	.	.	H	α-helix	trans	-62.6	-21	173.8	-63.1	24.7	0	0	0	113.6	I411 T419	I411-N415 WeakPolarHBondContact O-CB 3.28Å; I411-N415 VanDerWaalsContact O-CG 3.25Å; I411-N415 PolarHBondContact O-N 3.35Å; I411-N415 PolarHBondContact O-OD1 3.14Å; N415-T419 WeakPolarHBondContact O-CB 3.08Å; N415-T419 WeakPolarHBondContact O-CG2 3.38Å; N415-T419 PolarHBondContact O-N 3.31Å; N415-T419 PolarHBondContact O-OG1 3.25Å
416	K	68.3	Low	66.6	Low	127 Å²	127	99.6 Å²	99.6	55%	0.552	51%	0.507	S	S	*	.	H	α-helix	trans	-86.5	-19.4	174.4	-76.2	-176.9	-172.2	171.5	0	113.2	L412 K413 D414 L420	L412-K416 VanDerWaalsContact CD2-NZ 3.33Å; L412-K416 WeakPolarHBondContact O-CD 3.48Å; L412-K416 WeakPolarHBondContact O-CE 3.34Å; L412-K416 VanDerWaalsContact O-CG 3.26Å; L412-K416 WeakPolarHBondContact O-CG 3.38Å; K413-K416 CarbonylContact O-C 3.57Å; K413-K416 WeakPolarHBondContact O-CA 3.39Å; K413-K416 WeakPolarHBondContact O-CB 3.47Å; K413-K416 PolarHBondContact O-N 3.41Å; D414-K416 PolarHBondContact O-N 2.99Å; D414-K416 VanDerWaalsContact O-N 3.12Å; K416-L420 VanDerWaalsContact O-CB 3.3Å; K416-L420 WeakPolarHBondContact O-CB 3.41Å
417	I	74.7	Confident	67.5	Low	88 Å²	88	100.2 Å²	100.2	45%	0.451	50%	0.501	S	S	.	.	H	α-helix	trans	-79.3	-50.8	170	-67.7	162.8	0	0	0	107.7	K413 D414 T419 L420 E421	K413-I417 WeakPolarHBondContact O-CG1 3.42Å; K413-I417 PolarHBondContact O-N 3.25Å; D414-I417 WeakPolarHBondContact O-CB 3.27Å; D414-I417 PolarHBondContact O-N 3.32Å; I417-T419 PolarHBondContact O-N 2.88Å; I417-L420 CarbonylContact O-C 3.5Å; I417-L420 WeakPolarHBondContact O-CA 3.44Å; I417-L420 WeakPolarHBondContact O-CB 3.18Å; I417-L420 PolarHBondContact O-N 2.94Å; I417-E421 HydrophobicContact CG2-CG 4.3Å; I417-E421 WeakPolarHBondContact O-CG 3.32Å; I417-E421 PolarHBondContact O-N 3.34Å
418	E	73.7	Confident	69	Low	120 Å²	120	97.9 Å²	97.9	56%	0.561	50%	0.495	S	S	*	.	H	α-helix	trans	-54.9	-47.9	178	-172.8	176.9	-138.2	0	0	112.6	D414 L420 E421 E422	D414-E418 PolarHBondContact O-N 2.8Å; E418-L420 VanDerWaalsContact C-N 3.26Å; E418-L420 PolarHBondContact O-N 3.26Å; E418-E421 PolarHBondContact O-N 3.47Å; E418-E422 PolarHBondContact O-N 3.34Å
419	T	70.2	Confident	70.7	Confident	73 Å²	73	98.2 Å²	98.2	45%	0.448	50%	0.497	S	S	.	.	H	α-helix	trans	-70.1	-18.3	175.5	50	0	0	0	0	114.4	N415 I417 T423	N415-T419 WeakPolarHBondContact O-CB 3.08Å; N415-T419 WeakPolarHBondContact O-CG2 3.38Å; N415-T419 PolarHBondContact O-N 3.31Å; N415-T419 PolarHBondContact O-OG1 3.25Å; I417-T419 PolarHBondContact O-N 2.88Å; T419-T423 WeakPolarHBondContact O-CG2 3.1Å; T419-T423 PolarHBondContact O-N 3.16Å; T419-T423 PolarHBondContact O-OG1 3.46Å
420	L	73.1	Confident	72	Confident	97 Å²	97	98.5 Å²	98.5	51%	0.508	49%	0.493	S	S	.	.	H	α-helix	trans	-84.2	-32.5	171.7	-172.3	142.3	0	0	0	111.4	K416 I417 E418 T423 M424	K416-L420 VanDerWaalsContact O-CB 3.3Å; K416-L420 WeakPolarHBondContact O-CB 3.41Å; I417-L420 CarbonylContact O-C 3.5Å; I417-L420 WeakPolarHBondContact O-CA 3.44Å; I417-L420 WeakPolarHBondContact O-CB 3.18Å; I417-L420 PolarHBondContact O-N 2.94Å; E418-L420 VanDerWaalsContact C-N 3.26Å; E418-L420 PolarHBondContact O-N 3.26Å; L420-T423 WeakPolarHBondContact CA-OG1 3.27Å; L420-T423 PolarHBondContact O-OG1 3.35Å; L420-M424 HydrophobicContact CD2-CG 4.32Å; L420-M424 HydrophobicContact CD2-SD 3.67Å; L420-M424 WeakPolarHBondContact O-CB 3.28Å; L420-M424 WeakPolarHBondContact O-CG 3.27Å; L420-M424 PolarHBondContact O-N 3.41Å
421	E	77.7	Confident	72.7	Confident	111 Å²	111	96.2 Å²	96.2	52%	0.519	49%	0.486	S	S	.	.	H	α-helix	trans	-70.2	-48.9	173.2	-70.9	173.5	159.9	0	0	110.7	I417 E418 T423 M424 E425	I417-E421 HydrophobicContact CG2-CG 4.3Å; I417-E421 WeakPolarHBondContact O-CG 3.32Å; I417-E421 PolarHBondContact O-N 3.34Å; E418-E421 PolarHBondContact O-N 3.47Å; E421-T423 VanDerWaalsContact C-N 3.25Å; E421-T423 PolarHBondContact O-N 2.8Å; E421-M424 PolarHBondContact O-N 3.44Å; E421-E425 PolarHBondContact O-N 3.22Å
422	E	76.1	Confident	73.5	Confident	110 Å²	110	97.4 Å²	97.4	51%	0.514	49%	0.49	S	S	.	.	H	α-helix	trans	-51.5	-43.5	171.1	-78.1	-166.8	142.7	0	0	112	E418 S426	E418-E422 PolarHBondContact O-N 3.34Å; E422-S426 VanDerWaalsContact O-CB 3.31Å; E422-S426 WeakPolarHBondContact O-CB 3.31Å; E422-S426 PolarHBondContact O-N 3.43Å
423	T	77.3	Confident	74.8	Confident	78 Å²	78	99.7 Å²	99.7	48%	0.479	50%	0.499	S	S	.	.	H	α-helix	trans	-77.7	-26.4	-179.2	51.8	0	0	0	0	113.1	T419 L420 E421 M427	T419-T423 WeakPolarHBondContact O-CG2 3.1Å; T419-T423 PolarHBondContact O-N 3.16Å; T419-T423 PolarHBondContact O-OG1 3.46Å; L420-T423 WeakPolarHBondContact CA-OG1 3.27Å; L420-T423 PolarHBondContact O-OG1 3.35Å; E421-T423 VanDerWaalsContact C-N 3.25Å; E421-T423 PolarHBondContact O-N 2.8Å; T423-M427 WeakPolarHBondContact O-CE 3.45Å; T423-M427 WeakPolarHBondContact O-CG 3.4Å; T423-M427 PolarHBondContact O-N 2.95Å; T423-M427 VanDerWaalsContact O-N 3.14Å
424	M	75.6	Confident	75.1	Confident	106 Å²	106	99.7 Å²	99.7	52%	0.522	50%	0.503	S	S	.	.	H	α-helix	trans	-70	-46.5	168.9	-82.4	-177.1	51.8	0	0	111.9	L420 E421 S426 M427 V428	L420-M424 HydrophobicContact CD2-CG 4.32Å; L420-M424 HydrophobicContact CD2-SD 3.67Å; L420-M424 WeakPolarHBondContact O-CB 3.28Å; L420-M424 WeakPolarHBondContact O-CG 3.27Å; L420-M424 PolarHBondContact O-N 3.41Å; E421-M424 PolarHBondContact O-N 3.44Å; M424-S426 VanDerWaalsContact C-N 3.34Å; M424-S426 PolarHBondContact O-N 3.14Å; M424-M427 HydrophobicContact CG-CE 4.31Å; M424-M427 CarbonylContact O-C 3.55Å; M424-M427 WeakPolarHBondContact O-CA 3.3Å; M424-M427 WeakPolarHBondContact O-CB 3.26Å; M424-M427 PolarHBondContact O-N 3.21Å; M424-V428 WeakPolarHBondContact O-CG2 3.25Å; M424-V428 PolarHBondContact O-N 3.37Å
425	E	78.1	Confident	75.5	Confident	140 Å²	140	101.5 Å²	101.5	65%	0.654	51%	0.509	S	S	*	.	H	α-helix	trans	-60.4	-43.9	175.2	-68.8	-169.6	160.5	0	0	111.4	E421 M427 V428 V429	E421-E425 PolarHBondContact O-N 3.22Å; E425-M427 PolarHBondContact O-N 3.11Å; E425-V428 PolarHBondContact O-N 3.01Å; E425-V428 VanDerWaalsContact O-N 3.11Å; E425-V429 WeakPolarHBondContact O-CG2 3.27Å; E425-V429 PolarHBondContact O-N 3.23Å
426	S	73.4	Confident	75.8	Confident	63 Å²	63	100.4 Å²	100.4	44%	0.441	51%	0.511	S	S	.	.	H	α-helix	trans	-61.7	-27	174.1	-166.1	0	0	0	0	113.6	E422 M424 R430	E422-S426 VanDerWaalsContact O-CB 3.31Å; E422-S426 WeakPolarHBondContact O-CB 3.31Å; E422-S426 PolarHBondContact O-N 3.43Å; M424-S426 VanDerWaalsContact C-N 3.34Å; M424-S426 PolarHBondContact O-N 3.14Å; S426-R430 VanDerWaalsContact O-CB 3.25Å; S426-R430 WeakPolarHBondContact O-CB 3.44Å; S426-R430 PolarHBondContact O-N 3.24Å; S426-R430 PolarHBondContact O-NH1 3.35Å
427	M	70.7	Confident	76.3	Confident	104 Å²	104	98.3 Å²	98.3	51%	0.512	51%	0.506	S	S	.	.	H	α-helix	trans	-79.2	-39.5	171.4	-78.6	-171.7	-69.6	0	0	112.5	T423 M424 E425 R430 I431	T423-M427 WeakPolarHBondContact O-CE 3.45Å; T423-M427 WeakPolarHBondContact O-CG 3.4Å; T423-M427 PolarHBondContact O-N 2.95Å; T423-M427 VanDerWaalsContact O-N 3.14Å; M424-M427 HydrophobicContact CG-CE 4.31Å; M424-M427 CarbonylContact O-C 3.55Å; M424-M427 WeakPolarHBondContact O-CA 3.3Å; M424-M427 WeakPolarHBondContact O-CB 3.26Å; M424-M427 PolarHBondContact O-N 3.21Å; E425-M427 PolarHBondContact O-N 3.11Å; M427-R430 PolarHBondContact O-N 3.15Å; M427-I431 VanDerWaalsContact O-CG1 3.26Å; M427-I431 WeakPolarHBondContact O-CG1 3.27Å; M427-I431 PolarHBondContact O-N 2.9Å
428	V	81.1	Confident	76.4	Confident	78 Å²	78	98.6 Å²	98.6	47%	0.473	51%	0.508	S	S	.	.	H	α-helix	trans	-61.3	-53	176.3	172.4	0	0	0	0	110.5	M424 E425 R430 I431 E432	M424-V428 WeakPolarHBondContact O-CG2 3.25Å; M424-V428 PolarHBondContact O-N 3.37Å; E425-V428 PolarHBondContact O-N 3.01Å; E425-V428 VanDerWaalsContact O-N 3.11Å; V428-R430 VanDerWaalsContact C-N 3.25Å; V428-R430 PolarHBondContact O-N 3.15Å; V428-I431 WeakPolarHBondContact O-CA 3.3Å; V428-I431 WeakPolarHBondContact O-CB 3.48Å; V428-I431 PolarHBondContact O-N 2.95Å; V428-E432 PolarHBondContact O-N 2.92Å
429	V	81.4	Confident	76.5	Confident	71 Å²	71	98 Å²	98	43%	0.43	51%	0.509	S	S	.	.	H	α-helix	trans	-58.4	-38.4	177.8	174.6	0	0	0	0	111.4	E425 E432 Q433	E425-V429 WeakPolarHBondContact O-CG2 3.27Å; E425-V429 PolarHBondContact O-N 3.23Å; V429-E432 PolarHBondContact O-N 2.85Å; V429-Q433 WeakPolarHBondContact O-CB 3.48Å; V429-Q433 VanDerWaalsContact O-CG 3.27Å; V429-Q433 WeakPolarHBondContact O-CG 3.11Å; V429-Q433 PolarHBondContact O-N 3.29Å
430	R	74.7	Confident	76.9	Confident	126 Å²	126	100.4 Å²	100.4	48%	0.475	51%	0.513	S	S	.	.	H	α-helix	trans	-68	-34	175.2	179.6	176.9	-87.1	102.2	-7.6	112.6	S426 M427 V428 L434	S426-R430 VanDerWaalsContact O-CB 3.25Å; S426-R430 WeakPolarHBondContact O-CB 3.44Å; S426-R430 PolarHBondContact O-N 3.24Å; S426-R430 PolarHBondContact O-NH1 3.35Å; M427-R430 PolarHBondContact O-N 3.15Å; V428-R430 VanDerWaalsContact C-N 3.25Å; V428-R430 PolarHBondContact O-N 3.15Å; R430-L434 HydrophobicContact CG-CD1 4.19Å; R430-L434 WeakPolarHBondContact O-CB 3.41Å; R430-L434 WeakPolarHBondContact O-CD1 3.48Å; R430-L434 WeakPolarHBondContact O-CG 3.44Å; R430-L434 PolarHBondContact O-N 2.95Å
431	I	78.6	Confident	77.2	Confident	91 Å²	91	100.1 Å²	100.1	47%	0.467	51%	0.508	S	S	.	.	H	α-helix	trans	-69.1	-43.2	175	-72.4	163.1	0	0	0	110.5	M427 V428 L434 Q435	M427-I431 VanDerWaalsContact O-CG1 3.26Å; M427-I431 WeakPolarHBondContact O-CG1 3.27Å; M427-I431 PolarHBondContact O-N 2.9Å; V428-I431 WeakPolarHBondContact O-CA 3.3Å; V428-I431 WeakPolarHBondContact O-CB 3.48Å; V428-I431 PolarHBondContact O-N 2.95Å; I431-L434 PolarHBondContact O-N 3.01Å; I431-Q435 HydrophobicContact CG2-CG 4.49Å; I431-Q435 WeakPolarHBondContact O-CG 3.08Å; I431-Q435 PolarHBondContact O-N 3.15Å
432	E	79.5	Confident	77.2	Confident	119 Å²	119	98.7 Å²	98.7	56%	0.556	50%	0.504	S	S	*	.	H	α-helix	trans	-62.3	-44.8	175.9	-67.7	-179.2	152.9	0	0	111.7	V428 V429 L434 Q435 A436	V428-E432 PolarHBondContact O-N 2.92Å; V429-E432 PolarHBondContact O-N 2.85Å; E432-L434 VanDerWaalsContact C-N 3.33Å; E432-L434 PolarHBondContact O-N 3.31Å; E432-Q435 PolarHBondContact O-N 2.86Å; E432-A436 PolarHBondContact O-N 3.06Å
433	Q	78.5	Confident	77.4	Confident	125 Å²	125	96.6 Å²	96.6	58%	0.584	50%	0.502	S	S	*	.	H	α-helix	trans	-60.7	-39.4	173.6	-73.5	175.4	1.9	0	0	112.5	V429 L437	V429-Q433 WeakPolarHBondContact O-CB 3.48Å; V429-Q433 VanDerWaalsContact O-CG 3.27Å; V429-Q433 WeakPolarHBondContact O-CG 3.11Å; V429-Q433 PolarHBondContact O-N 3.29Å; Q433-L437 WeakPolarHBondContact O-CB 3.22Å; Q433-L437 PolarHBondContact O-N 3.07Å
434	L	75.2	Confident	77.4	Confident	103 Å²	103	97.1 Å²	97.1	54%	0.539	50%	0.499	S	S	.	.	H	α-helix	trans	-68.1	-38.3	175.3	-76.1	169.1	0	0	0	112.2	R430 I431 E432 L437 D438	R430-L434 HydrophobicContact CG-CD1 4.19Å; R430-L434 WeakPolarHBondContact O-CB 3.41Å; R430-L434 WeakPolarHBondContact O-CD1 3.48Å; R430-L434 WeakPolarHBondContact O-CG 3.44Å; R430-L434 PolarHBondContact O-N 2.95Å; I431-L434 PolarHBondContact O-N 3.01Å; E432-L434 VanDerWaalsContact C-N 3.33Å; E432-L434 PolarHBondContact O-N 3.31Å; L434-L437 PolarHBondContact O-N 3.33Å; L434-D438 WeakPolarHBondContact O-CB 3.17Å; L434-D438 PolarHBondContact O-N 3.35Å
435	Q	78	Confident	77.6	Confident	117 Å²	117	96.2 Å²	96.2	55%	0.547	50%	0.495	S	S	.	.	H	α-helix	trans	-66.3	-41.7	175	-73.3	176.8	2.5	0	0	111.9	I431 E432 D438 N439	I431-Q435 HydrophobicContact CG2-CG 4.49Å; I431-Q435 WeakPolarHBondContact O-CG 3.08Å; I431-Q435 PolarHBondContact O-N 3.15Å; E432-Q435 PolarHBondContact O-N 2.86Å; Q435-D438 PolarHBondContact O-N 3.31Å; Q435-N439 WeakPolarHBondContact O-CB 3.15Å; Q435-N439 VanDerWaalsContact O-CG 3.24Å; Q435-N439 PolarHBondContact O-N 2.94Å; Q435-N439 PolarHBondContact O-ND2 3.39Å
436	A	77	Confident	77.8	Confident	61 Å²	61	96.1 Å²	96.1	50%	0.504	49%	0.494	S	S	.	.	H	α-helix	trans	-61	-43.9	173.7	0	0	0	0	0	111.8	E432 N439 F440	E432-A436 PolarHBondContact O-N 3.06Å; A436-N439 PolarHBondContact O-N 2.81Å; A436-F440 PolarHBondContact O-N 2.93Å
437	L	77.9	Confident	78.2	Confident	83 Å²	83	99.4 Å²	99.4	44%	0.435	50%	0.503	S	S	.	.	H	α-helix	trans	-67.1	-38	177.7	-170.7	71.1	0	0	0	112.8	Q433 L434 F440 K441	Q433-L437 WeakPolarHBondContact O-CB 3.22Å; Q433-L437 PolarHBondContact O-N 3.07Å; L434-L437 PolarHBondContact O-N 3.33Å; L437-F440 PolarHBondContact O-N 2.86Å; L437-K441 HydrophobicContact CG-CD 4.37Å; L437-K441 WeakPolarHBondContact O-CB 3.47Å; L437-K441 WeakPolarHBondContact O-CG 3.39Å; L437-K441 PolarHBondContact O-N 3.43Å
438	D	76.2	Confident	78.5	Confident	95 Å²	95	99.3 Å²	99.3	51%	0.508	50%	0.503	S	S	.	.	H	α-helix	trans	-71	-38.9	177.2	-153.9	63	0	0	0	111	L434 Q435 F440 K441 N442	L434-D438 WeakPolarHBondContact O-CB 3.17Å; L434-D438 PolarHBondContact O-N 3.35Å; Q435-D438 PolarHBondContact O-N 3.31Å; D438-F440 PolarHBondContact O-N 3.08Å; D438-K441 PolarHBondContact O-N 3.27Å; D438-N442 WeakPolarHBondContact O-CB 3.19Å; D438-N442 VanDerWaalsContact O-CG 3.3Å; D438-N442 PolarHBondContact O-N 3.22Å; D438-N442 PolarHBondContact O-ND2 2.99Å; D438-N442 PolarHBondContact OD2-ND2 3.23Å
439	N	76	Confident	78.5	Confident	108 Å²	108	100.7 Å²	100.7	58%	0.578	51%	0.505	S	S	*	.	H	α-helix	trans	-59	-46.7	171.2	-74.7	-26.9	0	0	0	111.8	Q435 A436 K441 N442 S443	Q435-N439 WeakPolarHBondContact O-CB 3.15Å; Q435-N439 VanDerWaalsContact O-CG 3.24Å; Q435-N439 PolarHBondContact O-N 2.94Å; Q435-N439 PolarHBondContact O-ND2 3.39Å; A436-N439 PolarHBondContact O-N 2.81Å; N439-K441 PolarHBondContact O-N 3.08Å; N439-N442 PolarHBondContact O-N 3.17Å; N439-S443 PolarHBondContact O-N 2.93Å; N439-S443 VanDerWaalsContact O-N 3.07Å; N439-S443 PolarHBondContact O-OG 2.78Å
440	F	78.8	Confident	78.5	Confident	122 Å²	122	100.3 Å²	100.3	54%	0.535	51%	0.505	S	S	.	.	H	α-helix	trans	-60.2	-46.1	177.2	-173.6	-94	0	0	0	112.2	A436 L437 D438 N442 S443 E444	A436-F440 PolarHBondContact O-N 2.93Å; L437-F440 PolarHBondContact O-N 2.86Å; D438-F440 PolarHBondContact O-N 3.08Å; F440-N442 VanDerWaalsContact C-N 3.31Å; F440-N442 PolarHBondContact O-N 3.15Å; F440-S443 WeakPolarHBondContact CA-OG 3.49Å; F440-S443 PolarHBondContact O-N 2.78Å; F440-S443 VanDerWaalsContact O-N 3.15Å; F440-S443 PolarHBondContact O-OG 2.82Å; F440-E444 HydrophobicContact CD1-CG 4.19Å; F440-E444 VanDerWaalsContact CE1-CD 3.46Å; F440-E444 HydrophobicContact CE1-CG 3.86Å; F440-E444 WeakPolarHBondContact CE1-OE1 3.37Å; F440-E444 HydrophobicContact CZ-CG 4.45Å; F440-E444 PolarHBondContact O-N 2.67Å
441	K	78.8	Confident	78.7	Confident	92 Å²	92	97.9 Å²	97.9	40%	0.4	50%	0.501	S	S	.	.	H	α-helix	trans	-63.3	-35.5	175.3	-74.6	170.7	179.5	173.2	0	112.6	L437 D438 N439 S443 E444 I445	L437-K441 HydrophobicContact CG-CD 4.37Å; L437-K441 WeakPolarHBondContact O-CB 3.47Å; L437-K441 WeakPolarHBondContact O-CG 3.39Å; L437-K441 PolarHBondContact O-N 3.43Å; D438-K441 PolarHBondContact O-N 3.27Å; N439-K441 PolarHBondContact O-N 3.08Å; K441-S443 VanDerWaalsContact C-N 3.33Å; K441-E444 PolarHBondContact O-N 3.37Å; K441-I445 WeakPolarHBondContact O-CB 3.41Å; K441-I445 WeakPolarHBondContact O-CD1 3.28Å; K441-I445 WeakPolarHBondContact O-CG1 3.44Å; K441-I445 PolarHBondContact O-N 3.31Å
442	N	78.6	Confident	78.7	Confident	80 Å²	80	97.4 Å²	97.4	43%	0.428	50%	0.498	S	S	.	.	H	α-helix	trans	-66	-34.5	175	-77.9	-55.4	0	0	0	111.8	D438 N439 F440 H446	D438-N442 WeakPolarHBondContact O-CB 3.19Å; D438-N442 VanDerWaalsContact O-CG 3.3Å; D438-N442 PolarHBondContact O-N 3.22Å; D438-N442 PolarHBondContact O-ND2 2.99Å; D438-N442 PolarHBondContact OD2-ND2 3.23Å; N439-N442 PolarHBondContact O-N 3.17Å; F440-N442 VanDerWaalsContact C-N 3.31Å; F440-N442 PolarHBondContact O-N 3.15Å; N442-H446 WeakPolarHBondContact O-CB 3.47Å; N442-H446 PolarHBondContact O-N 2.65Å
443	S	79.4	Confident	78.7	Confident	67 Å²	67	96.5 Å²	96.5	47%	0.469	50%	0.498	S	S	.	.	H	α-helix	trans	-65.7	-49.1	168.9	28.8	0	0	0	0	113	N439 F440 K441 I445 H446 E447	N439-S443 PolarHBondContact O-N 2.93Å; N439-S443 VanDerWaalsContact O-N 3.07Å; N439-S443 PolarHBondContact O-OG 2.78Å; F440-S443 WeakPolarHBondContact CA-OG 3.49Å; F440-S443 PolarHBondContact O-N 2.78Å; F440-S443 VanDerWaalsContact O-N 3.15Å; F440-S443 PolarHBondContact O-OG 2.82Å; K441-S443 VanDerWaalsContact C-N 3.33Å; S443-I445 VanDerWaalsContact C-N 3.3Å; S443-I445 PolarHBondContact O-N 3.27Å; S443-H446 WeakPolarHBondContact O-CB 3.36Å; S443-H446 PolarHBondContact O-N 3.1Å; S443-E447 PolarHBondContact O-N 3.19Å
444	E	78	Confident	78.5	Confident	89 Å²	89	96.8 Å²	96.8	42%	0.416	50%	0.499	S	S	.	.	H	α-helix	trans	-57.8	-42.8	176.2	-66.6	-179.2	124.7	0	0	111.7	F440 K441 H446 E447 L448	F440-E444 HydrophobicContact CD1-CG 4.19Å; F440-E444 VanDerWaalsContact CE1-CD 3.46Å; F440-E444 HydrophobicContact CE1-CG 3.86Å; F440-E444 WeakPolarHBondContact CE1-OE1 3.37Å; F440-E444 HydrophobicContact CZ-CG 4.45Å; F440-E444 PolarHBondContact O-N 2.67Å; K441-E444 PolarHBondContact O-N 3.37Å; E444-H446 VanDerWaalsContact C-N 3.29Å; E444-H446 PolarHBondContact O-N 3.1Å; E444-E447 PolarHBondContact O-N 2.83Å; E444-L448 WeakPolarHBondContact O-CB 3.33Å; E444-L448 VanDerWaalsContact O-CG 3.28Å; E444-L448 WeakPolarHBondContact O-CG 3.38Å; E444-L448 PolarHBondContact O-N 2.97Å
445	I	80.6	Confident	78.2	Confident	86 Å²	86	97 Å²	97	44%	0.441	50%	0.5	S	S	.	.	H	α-helix	trans	-64.4	-32.6	177.4	-74.9	167.1	0	0	0	111.7	K441 S443 Q449	K441-I445 WeakPolarHBondContact O-CB 3.41Å; K441-I445 WeakPolarHBondContact O-CD1 3.28Å; K441-I445 WeakPolarHBondContact O-CG1 3.44Å; K441-I445 PolarHBondContact O-N 3.31Å; S443-I445 VanDerWaalsContact C-N 3.3Å; S443-I445 PolarHBondContact O-N 3.27Å; I445-Q449 WeakPolarHBondContact O-CB 3.4Å; I445-Q449 VanDerWaalsContact O-CG 3.22Å; I445-Q449 WeakPolarHBondContact O-CG 3.44Å; I445-Q449 PolarHBondContact O-N 2.9Å; I445-Q449 VanDerWaalsContact O-N 3.15Å; I445-Q449 PolarHBondContact O-NE2 3.17Å
446	H	81.6	Confident	78	Confident	139 Å²	139	99.7 Å²	99.7	64%	0.644	51%	0.505	S	S	*	.	H	α-helix	trans	-74.4	-40.3	175.7	-167.6	-80.2	0	0	0	111.7	N442 S443 E444 Q449 S450	N442-H446 WeakPolarHBondContact O-CB 3.47Å; N442-H446 PolarHBondContact O-N 2.65Å; S443-H446 WeakPolarHBondContact O-CB 3.36Å; S443-H446 PolarHBondContact O-N 3.1Å; E444-H446 VanDerWaalsContact C-N 3.29Å; E444-H446 PolarHBondContact O-N 3.1Å; H446-Q449 WeakPolarHBondContact O-CB 3.19Å; H446-Q449 PolarHBondContact O-N 2.89Å; H446-S450 PolarHBondContact O-N 3.39Å
447	E	80.9	Confident	77.4	Confident	132 Å²	132	98.7 Å²	98.7	62%	0.617	50%	0.501	S	S	*	.	H	α-helix	trans	-67.2	-45.8	176.7	-170.4	164.5	-127.5	0	0	111.9	S443 E444 Q449 S450 I451	S443-E447 PolarHBondContact O-N 3.19Å; E444-E447 PolarHBondContact O-N 2.83Å; E447-Q449 VanDerWaalsContact C-N 3.27Å; E447-Q449 PolarHBondContact O-N 3.01Å; E447-S450 WeakPolarHBondContact O-CA 3.31Å; E447-S450 VanDerWaalsContact O-CB 3.22Å; E447-S450 WeakPolarHBondContact O-CB 2.95Å; E447-S450 PolarHBondContact O-N 3.14Å; E447-I451 HydrophobicContact CG-CD1 4.37Å; E447-I451 WeakPolarHBondContact O-CG1 3.48Å; E447-I451 PolarHBondContact O-N 3.03Å
448	L	78.7	Confident	76.5	Confident	101 Å²	101	99.9 Å²	99.9	53%	0.529	51%	0.508	S	S	.	.	H	α-helix	trans	-60.3	-34.4	172.4	-71.4	171.4	0	0	0	112.5	E444 I452	E444-L448 WeakPolarHBondContact O-CB 3.33Å; E444-L448 VanDerWaalsContact O-CG 3.28Å; E444-L448 WeakPolarHBondContact O-CG 3.38Å; E444-L448 PolarHBondContact O-N 2.97Å; L448-I452 WeakPolarHBondContact O-CB 3.31Å; L448-I452 WeakPolarHBondContact O-CD1 3.49Å; L448-I452 WeakPolarHBondContact O-CG1 3.31Å; L448-I452 PolarHBondContact O-N 3.38Å
449	Q	80.5	Confident	75.4	Confident	107 Å²	107	100.8 Å²	100.8	50%	0.5	51%	0.513	S	S	.	.	H	α-helix	trans	-66.4	-37.1	172.1	-83.1	174.2	72.1	0	0	112.5	I445 H446 E447 N453	I445-Q449 WeakPolarHBondContact O-CB 3.4Å; I445-Q449 VanDerWaalsContact O-CG 3.22Å; I445-Q449 WeakPolarHBondContact O-CG 3.44Å; I445-Q449 PolarHBondContact O-N 2.9Å; I445-Q449 VanDerWaalsContact O-N 3.15Å; I445-Q449 PolarHBondContact O-NE2 3.17Å; H446-Q449 WeakPolarHBondContact O-CB 3.19Å; H446-Q449 PolarHBondContact O-N 2.89Å; E447-Q449 VanDerWaalsContact C-N 3.27Å; E447-Q449 PolarHBondContact O-N 3.01Å; Q449-N453 WeakPolarHBondContact O-CB 3.5Å; Q449-N453 PolarHBondContact O-N 3.11Å; Q449-N453 VanDerWaalsContact O-N 3.1Å; Q449-N453 PolarHBondContact O-ND2 3.24Å; Q449-N453 VanDerWaalsContact O-ND2 3.08Å
450	S	80.3	Confident	74.3	Confident	63 Å²	63	102.7 Å²	102.7	44%	0.441	52%	0.52	S	S	.	.	H	α-helix	trans	-60.9	-50.8	173.2	-164.1	0	0	0	0	111.2	H446 E447 I452 N453 Q454	H446-S450 PolarHBondContact O-N 3.39Å; E447-S450 WeakPolarHBondContact O-CA 3.31Å; E447-S450 VanDerWaalsContact O-CB 3.22Å; E447-S450 WeakPolarHBondContact O-CB 2.95Å; E447-S450 PolarHBondContact O-N 3.14Å; S450-I452 PolarHBondContact O-N 3.35Å; S450-N453 PolarHBondContact O-N 2.91Å; S450-Q454 PolarHBondContact O-N 2.61Å
451	I	80.4	Confident	72.8	Confident	75 Å²	75	103.8 Å²	103.8	39%	0.385	53%	0.531	S	S	.	.	H	α-helix	trans	-61.8	-43.3	179.8	-63.3	164.9	0	0	0	111.4	E447 N453 Q454 L455	E447-I451 HydrophobicContact CG-CD1 4.37Å; E447-I451 WeakPolarHBondContact O-CG1 3.48Å; E447-I451 PolarHBondContact O-N 3.03Å; I451-N453 PolarHBondContact O-N 3.37Å; I451-Q454 PolarHBondContact O-N 2.87Å; I451-L455 HydrophobicContact CG2-CD1 3.97Å; I451-L455 HydrophobicContact CG2-CG 4.45Å; I451-L455 WeakPolarHBondContact O-CG 3.49Å; I451-L455 PolarHBondContact O-N 3.39Å
452	I	78.8	Confident	71	Confident	81 Å²	81	103.4 Å²	103.4	42%	0.415	54%	0.541	S	S	.	.	H	α-helix	trans	-62.7	-31.7	176	-72.8	166.8	0	0	0	111.8	L448 S450 R456	L448-I452 WeakPolarHBondContact O-CB 3.31Å; L448-I452 WeakPolarHBondContact O-CD1 3.49Å; L448-I452 WeakPolarHBondContact O-CG1 3.31Å; L448-I452 PolarHBondContact O-N 3.38Å; S450-I452 PolarHBondContact O-N 3.35Å; I452-R456 WeakPolarHBondContact O-CB 3.42Å; I452-R456 WeakPolarHBondContact O-CD 3.5Å; I452-R456 WeakPolarHBondContact O-CG 3.35Å; I452-R456 PolarHBondContact O-N 3.07Å
453	N	77.7	Confident	68.9	Low	101 Å²	101	107 Å²	107	54%	0.54	55%	0.552	S	S	.	*	H	α-helix	trans	-77.1	-35.2	176.9	-71.6	-29	0	0	0	112.5	Q449 S450 I451 G457	Q449-N453 WeakPolarHBondContact O-CB 3.5Å; Q449-N453 PolarHBondContact O-N 3.11Å; Q449-N453 VanDerWaalsContact O-N 3.1Å; Q449-N453 PolarHBondContact O-ND2 3.24Å; Q449-N453 VanDerWaalsContact O-ND2 3.08Å; S450-N453 PolarHBondContact O-N 2.91Å; I451-N453 PolarHBondContact O-N 3.37Å; N453-G457 PolarHBondContact O-N 3.29Å
454	Q	75	Confident	66.6	Low	130 Å²	130	108.8 Å²	108.8	61%	0.607	57%	0.565	S	S	*	*	H	α-helix	trans	-61.2	-55.1	170.1	-75.4	-178.6	-32.1	0	0	111.3	S450 I451 R456 G457 D458	S450-Q454 PolarHBondContact O-N 2.61Å; I451-Q454 PolarHBondContact O-N 2.87Å; Q454-R456 PolarHBondContact O-N 3.45Å; Q454-R456 VanDerWaalsContact O-N 3.08Å; Q454-G457 WeakPolarHBondContact O-CA 3.41Å; Q454-G457 PolarHBondContact O-N 3.02Å; Q454-D458 PolarHBondContact O-N 3.29Å
455	L	70	Confident	64.4	Low	109 Å²	109	112.4 Å²	112.4	57%	0.571	59%	0.586	S	S	*	*	H	α-helix	trans	-59.6	-25.9	-178.6	-67.8	171.3	0	0	0	113.4	I451 D459	I451-L455 HydrophobicContact CG2-CD1 3.97Å; I451-L455 HydrophobicContact CG2-CG 4.45Å; I451-L455 WeakPolarHBondContact O-CG 3.49Å; I451-L455 PolarHBondContact O-N 3.39Å; L455-D459 PolarHBondContact O-N 3.03Å
456	R	73.1	Confident	62	Low	172 Å²	172	112.9 Å²	112.9	65%	0.649	60%	0.603	S	S	*	*	H	α-helix	trans	-77.7	-18.1	173.6	-79	173.2	175.1	177.1	1.2	114.4	I452 Q454	I452-R456 WeakPolarHBondContact O-CB 3.42Å; I452-R456 WeakPolarHBondContact O-CD 3.5Å; I452-R456 WeakPolarHBondContact O-CG 3.35Å; I452-R456 PolarHBondContact O-N 3.07Å; Q454-R456 PolarHBondContact O-N 3.45Å; Q454-R456 VanDerWaalsContact O-N 3.08Å
457	G	63.6	Low	59.6	Low	41 Å²	41	111.8 Å²	111.8	42%	0.423	61%	0.611	S	S	.	*	H	α-helix	trans	-72.3	-47.8	169.7	0	0	0	0	0	111.4	N453 Q454 D459 M460	N453-G457 PolarHBondContact O-N 3.29Å; Q454-G457 WeakPolarHBondContact O-CA 3.41Å; Q454-G457 PolarHBondContact O-N 3.02Å; G457-D459 PolarHBondContact O-N 3.39Å; G457-M460 PolarHBondContact O-N 2.72Å
458	D	59.5	Low	57.3	Low	108 Å²	108	111 Å²	111	58%	0.578	62%	0.621	S	S	*	*	H	α-helix	trans	-66.6	-40.3	-173.7	-58.1	-40.4	0	0	0	112.9	Q454 M460 N461	Q454-D458 PolarHBondContact O-N 3.29Å; D458-M460 PolarHBondContact O-N 3.23Å; D458-N461 PolarHBondContact O-N 2.98Å; D458-N461 VanDerWaalsContact O-N 3.12Å
459	D	52.8	Low	55.3	Low	113 Å²	113	111.5 Å²	111.5	60%	0.604	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	-2.1	-174.7	-143.4	24.6	0	0	0	114.2	L455 G457 K463	L455-D459 PolarHBondContact O-N 3.03Å; G457-D459 PolarHBondContact O-N 3.39Å; D459-K463 PolarHBondContact O-NZ 3.19Å
460	M	52.3	Low	53	Low	149 Å²	149	111.2 Å²	111.2	73%	0.734	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-22.1	173.3	-75.1	-65.7	178.6	0	0	114	G457 D458 S462	G457-M460 PolarHBondContact O-N 2.72Å; D458-M460 PolarHBondContact O-N 3.23Å; M460-S462 PolarHBondContact O-N 3.24Å
461	N	48.2	Very low	50.8	Low	144 Å²	144	117 Å²	117	77%	0.77	66%	0.659	S	S	*	*	S	Bend	trans	-87.3	-3.9	-169.1	-69.6	-33.1	0	0	0	115.3	D458	D458-N461 PolarHBondContact O-N 2.98Å; D458-N461 VanDerWaalsContact O-N 3.12Å
462	S	40.6	Very low	48.5	Very low	85 Å²	85	120.9 Å²	120.9	59%	0.594	67%	0.673	S	S	*	*			trans	-120.9	59	-163.7	53.1	0	0	0	0	115	M460	M460-S462 PolarHBondContact O-N 3.24Å
463	K	34.2	Very low	46.3	Very low	154 Å²	154	125 Å²	125	67%	0.67	69%	0.691	S	S	*	*			trans	-140.8	103.2	178.2	-64.9	-179.2	-174.9	61.7	0	114.7	D459	D459-K463 PolarHBondContact O-NZ 3.19Å
464	S	31.8	Very low	44.2	Very low	106 Å²	106	125.8 Å²	125.8	74%	0.741	70%	0.701	S	S	*	*			trans	-155.3	151.7	159.2	65.9	0	0	0	0	111.7
465	L	30.8	Very low	42.1	Very low	164 Å²	164	129 Å²	129	86%	0.859	71%	0.713	S	S	*	*			trans	65.6	117.4	174.2	-51.2	165	0	0	0	115.1
466	A	30.4	Very low	40.2	Very low	96 Å²	96	129.5 Å²	129.5	79%	0.793	72%	0.724	S	S	*	*			cis	81	137.8	37.7	0	0	0	0	0	113.7
467	S	32.6	Very low	38.2	Very low	117 Å²	117	127.2 Å²	127.2	82%	0.818	73%	0.731	S	S	*	*			cis	-161.9	-174.5	1.5	53.2	0	0	0	0	112.9
468	S	32	Very low	36.4	Very low	116 Å²	116	137.1 Å²	137.1	81%	0.811	76%	0.755	S	S	*	*			trans	-166.1	-167.3	-176.4	-47.3	0	0	0	0	110.8
469	P	35.9	Very low	35	Very low	111 Å²	111	137.7 Å²	137.7	72%	0.721	77%	0.768	S	S	*	*			cis	-147	176.5	-5.5	43.4	-23	0	0	0	119.8
470	S	34	Very low	33.8	Very low	100 Å²	100	138.8 Å²	138.8	70%	0.699	78%	0.779	S	S	*	*			trans	72.7	145	139.6	72.1	0	0	0	0	126.4
471	H	33.7	Very low	32.7	Very low	184 Å²	184	136.9 Å²	136.9	85%	0.852	78%	0.78	S	S	*	*			trans	-158.8	-170.8	137.6	-133	60.8	0	0	0	116.6
472	F	31.4	Very low	31.8	Very low	157 Å²	157	134.7 Å²	134.7	69%	0.689	78%	0.775	S	S	*	*			trans	-144.8	142.9	-144.2	-112.4	-113.1	0	0	0	119.4
473	Q	32	Very low	31.3	Very low	167 Å²	167	140.9 Å²	140.9	78%	0.78	79%	0.786	S	S	*	*			trans	60.8	177	143	-84.4	-170	25.6	0	0	121.4
474	P	33.8	Very low	31.2	Very low	118 Å²	118	138.9 Å²	138.9	77%	0.766	79%	0.786	S	S	*	*			cis	-134.9	-158	11.8	44.2	-23.9	0	0	0	118.1
475	K	30.9	Very low	31	Very low	197 Å²	197	140.5 Å²	140.5	86%	0.857	79%	0.786	S	S	*	*			trans	-127	160.3	-176.9	-67.7	-179.4	175.4	-179.5	0	114.5
476	P	30.4	Very low	31	Very low	121 Å²	121	138.5 Å²	138.5	79%	0.786	78%	0.782	S	S	*	*			trans	-138.9	-162.6	143.9	37.3	-19.1	0	0	0	113.2
477	P	31.4	Very low	30.8	Very low	124 Å²	124	140.6 Å²	140.6	81%	0.805	78%	0.78	S	S	*	*				-123.8	-163.2	-69.8	40.3	-25.4	0	0	0	114.3
478	R	26.4	Very low	30.6	Very low	248 Å²	248	139.9 Å²	139.9	94%	0.936	78%	0.781	S	S	*	*			trans	-109	162.9	179.1	-85.7	-176.7	168.5	128.5	-6.3	113.5
479	S	29.6	Very low	30.4	Very low	120 Å²	120	139.9 Å²	139.9	84%	0.839	77%	0.77	S	S	*	*			trans	-146.1	173.8	163.8	-166.5	0	0	0	0	112.2
480	T	27	Very low	30.1	Very low	136 Å²	136	144.1 Å²	144.1	83%	0.834	77%	0.773	S	S	*	*			trans	-144.6	141.7	-162.3	51.2	0	0	0	0	114.9
481	S	29.5	Very low	29.9	Very low	110 Å²	110	143.7 Å²	143.7	77%	0.769	76%	0.76	S	S	*	*			trans	-168.9	137.6	156.1	-157.1	0	0	0	0	115
482	C	29.6	Very low	29.7	Very low	97 Å²	97	136.4 Å²	136.4	66%	0.655	73%	0.727	S	S	*	*			trans	36.8	153.7	143.8	-59.6	0	0	0	0	124.4
483	R	30.2	Very low	29.5	Very low	216 Å²	216	131.8 Å²	131.8	82%	0.815	71%	0.71	S	S	*	*			cis	-169.6	145.6	-17.4	-109.1	173.1	-173.5	174.7	2.5	110.6
484	T	31.6	Very low	29.5	Very low	111 Å²	111	128.5 Å²	128.5	68%	0.681	69%	0.694	S	S	*	*			trans	49	110.7	148.7	57.2	0	0	0	0	121.4
485	L	27.9	Very low	29.3	Very low	141 Å²	141	130.9 Å²	130.9	74%	0.738	70%	0.701	S	S	*	*				87.7	160.9	90	-79.1	169.5	0	0	0	114.4	D487	L485-D487 WeakPolarHBondContact CD2-OD2 3.42Å
486	P	31.1	Very low	29.2	Very low	121 Å²	121	125 Å²	125	79%	0.786	69%	0.689	S	S	*	*			cis	-127.3	165.3	10.4	41.1	-25.6	0	0	0	117.7
487	D	25.4	Very low	29.1	Very low	140 Å²	140	125.9 Å²	125.9	75%	0.749	69%	0.685	S	S	*	*			trans	-77.6	142.8	174.6	-51.1	-88.2	0	0	0	113.6	L485	L485-D487 WeakPolarHBondContact CD2-OD2 3.42Å
488	A	28.1	Very low	29	Very low	102 Å²	102	125 Å²	125	84%	0.843	68%	0.682	S	S	*	*			trans	-157.1	-12	172.6	0	0	0	0	0	117
489	M	29.2	Very low	29.1	Very low	116 Å²	116	120 Å²	120	57%	0.571	67%	0.674	S	S	*	*	S	Bend	trans	-119.7	-31	-169.2	-65	179.8	60.7	0	0	115.2	Q491 D1215 T1218	M489-Q491 PolarHBondContact O-N 2.82Å; M489-D1215 VanDerWaalsContact C-OD2 3.23Å; M489-D1215 WeakPolarHBondContact O-CB 3.38Å; M489-T1218 HydrophobicContact CE-CG2 4.32Å
490	Y	29.6	Very low	29	Very low	201 Å²	201	120.2 Å²	120.2	79%	0.788	67%	0.665	S	S	*	*			trans	-72.1	69.8	175.8	-85.2	-63.3	0	0	0	112.6	D1215	Y490-D1215 VanDerWaalsContact CA-OD2 3.27Å; Y490-D1215 WeakPolarHBondContact CA-OD2 3.38Å; Y490-D1215 WeakPolarHBondContact CD1-OD2 3.09Å; Y490-D1215 WeakPolarHBondContact CE1-OD2 3.47Å; Y490-D1215 VanDerWaalsContact CG-OD2 3.24Å; Y490-D1215 PolarHBondContact N-OD2 3.48Å
491	Q	29.1	Very low	29.2	Very low	90 Å²	90	118.1 Å²	118.1	42%	0.421	66%	0.656	S	S	.	*	S	Bend	trans	-116.6	5.2	164.2	-169.2	45.7	48.9	0	0	111.3	M489 T1210 L1211 C1212	M489-Q491 PolarHBondContact O-N 2.82Å; Q491-T1210 PolarHBondContact NE2-O 2.92Å; Q491-L1211 VanDerWaalsContact C-C 3.5Å; Q491-L1211 CarbonylContact O-C 2.86Å; Q491-L1211 WeakPolarHBondContact O-CA 3.44Å; Q491-C1212 PolarHBondContact O-N 3.2Å
492	D	28.4	Very low	29.2	Very low	31 Å²	31	122.2 Å²	122.2	17%	0.166	66%	0.66	C	S	.	*			trans	-159.7	89.8	-155.2	-80.7	-58.8	0	0	0	119.7	L1211 C1212 N1213 S1214 D1215	D492-L1211 CarbonylContact C-O 3.41Å; D492-L1211 VanDerWaalsContact CA-O 3.24Å; D492-L1211 WeakPolarHBondContact CA-O 3.37Å; D492-L1211 PolarHBondContact N-O 2.89Å; D492-C1212 VanDerWaalsContact CA-N 3.33Å; D492-C1212 PolarHBondContact OD1-N 3.37Å; D492-N1213 VanDerWaalsContact CA-N 3.33Å; D492-N1213 HydrophobicContact CB-CB 4.15Å; D492-N1213 VanDerWaalsContact CB-N 3.26Å; D492-N1213 VanDerWaalsContact OD1-CB 3.3Å; D492-N1213 WeakPolarHBondContact OD1-CB 3.25Å; D492-N1213 PolarHBondContact OD1-N 3.03Å; D492-N1213 PolarHBondContact OD1-ND2 3.27Å; D492-S1214 VanDerWaalsContact CB-N 3.33Å; D492-S1214 WeakPolarHBondContact CB-OG 3.13Å; D492-S1214 CarbonylContact O-C 3.56Å; D492-S1214 PolarHBondContact O-N 2.92Å; D492-D1215 PolarHBondContact O-N 3.44Å
493	L	29.1	Very low	29.1	Very low	61 Å²	61	123.7 Å²	123.7	32%	0.319	67%	0.666	S	S	.	*			trans	-166.5	113.1	137.7	-161.2	80.7	0	0	0	118.2	K1138 L1211 C1212 V1216	L493-K1138 PolarHBondContact O-NZ 3.46Å; L493-L1211 PolarHBondContact N-O 2.91Å; L493-C1212 CarbonylContact C-O 3.59Å; L493-C1212 WeakPolarHBondContact CA-O 3.43Å; L493-C1212 VanDerWaalsContact N-CA 3.27Å; L493-V1216 HydrophobicContact CB-CG2 4.21Å; L493-V1216 HydrophobicContact CD2-CB 3.98Å; L493-V1216 HydrophobicContact CD2-CG1 4.48Å; L493-V1216 HydrophobicContact CD2-CG2 3.58Å; L493-V1216 HydrophobicContact CG-CG2 4.33Å
494	Q	31.3	Very low	29.2	Very low	98 Å²	98	119.2 Å²	119.2	46%	0.458	67%	0.668	S	S	.	*			trans	-156.1	126.7	157.6	-64.6	165.4	9.7	0	0	111.1	C1212	Q494-C1212 HydrophobicContact CB-CB 3.78Å; Q494-C1212 WeakPolarHBondContact CB-SG 3.3Å; Q494-C1212 HydrophobicContact CG-CB 4.29Å; Q494-C1212 WeakPolarHBondContact CG-SG 3.49Å; Q494-C1212 PolarHBondContact N-O 3.44Å; Q494-C1212 PolarHBondContact OE1-SG 2.88Å; Q494-C1212 VanDerWaalsContact OE1-SG 3.32Å
495	D	28.5	Very low	29.2	Very low	168 Å²	168	117 Å²	117	90%	0.898	67%	0.667	S	S	*	*			trans	-167	150.9	132.2	-114.9	-22.5	0	0	0	110.5
496	A	30.1	Very low	29.2	Very low	74 Å²	74	116.8 Å²	116.8	61%	0.612	67%	0.672	S	S	*	*	S	Bend	trans	103.1	15	178.2	0	0	0	0	0	120.8
497	I	28.8	Very low	29.3	Very low	138 Å²	138	116.3 Å²	116.3	71%	0.708	67%	0.671	S	S	*	*	S	Bend	trans	-131.1	66.1	161.1	-47.4	-178.9	0	0	0	111.9
498	S	28.8	Very low	29.7	Very low	105 Å²	105	114.5 Å²	114.5	73%	0.734	68%	0.676	S	S	*	*			trans	178.3	149.4	163.9	-86.1	0	0	0	0	107.2
499	L	28.8	Very low	29.9	Very low	145 Å²	145	113.4 Å²	113.4	76%	0.759	67%	0.674	S	S	*	*			cis	-132.3	157.5	9.5	-66.8	166.1	0	0	0	110.7
500	N	27.2	Very low	30.1	Very low	123 Å²	123	112.5 Å²	112.5	66%	0.658	68%	0.679	S	S	*	*			trans	-154.4	75.9	163.2	-142.8	17.6	0	0	0	112.8
501	S	31.5	Very low	30.4	Very low	92 Å²	92	110.9 Å²	110.9	64%	0.643	68%	0.679	S	S	*	*			trans	175.6	129.7	158.6	45	0	0	0	0	107.8
502	F	28.9	Very low	30.5	Very low	197 Å²	197	113.8 Å²	113.8	86%	0.864	70%	0.698	S	S	*	*			cis	-154.7	157.4	39.9	-90.9	-81.7	0	0	0	111.9
503	T	28	Very low	30.9	Very low	127 Å²	127	117.5 Å²	117.5	78%	0.779	72%	0.724	S	S	*	*			trans	-136.8	154.6	165.6	53.8	0	0	0	0	111.1
504	S	31.5	Very low	30.8	Very low	123 Å²	123	119.4 Å²	119.4	86%	0.86	74%	0.742	S	S	*	*			trans	86.4	140.4	165.2	-39	0	0	0	0	118.9
505	G	31.1	Very low	30.9	Very low	63 Å²	63	121.8 Å²	121.8	65%	0.649	76%	0.756	S	S	*	*			trans	96.7	116.9	176.3	0	0	0	0	0	113.6
506	T	29.1	Very low	31.1	Very low	137 Å²	137	121.9 Å²	121.9	84%	0.84	75%	0.751	S	S	*	*			cis	58.9	131.7	18.9	76.8	0	0	0	0	115.2
507	S	32.8	Very low	31.2	Very low	111 Å²	111	123.3 Å²	123.3	78%	0.776	76%	0.757	S	S	*	*			cis	177.6	155.9	-9.6	44.7	0	0	0	0	109.5
508	A	34.1	Very low	31.3	Very low	102 Å²	102	124 Å²	124	84%	0.843	76%	0.757	S	S	*	*			cis	-173.4	163	-19.6	0	0	0	0	0	109.2
509	G	31.4	Very low	31.6	Very low	79 Å²	79	126.7 Å²	126.7	81%	0.814	76%	0.758	S	S	*	*			trans	100.3	163.4	179.9	0	0	0	0	0	113.9
510	S	35	Very low	31.7	Very low	97 Å²	97	128.2 Å²	128.2	68%	0.678	76%	0.758	S	S	*	*			cis	-159.5	148.7	-2.7	-175.2	0	0	0	0	110.9
511	Q	35.1	Very low	32	Very low	167 Å²	167	129.8 Å²	129.8	78%	0.78	76%	0.762	S	S	*	*			trans	59.4	121.9	163.7	-72.9	149.4	-27.4	0	0	117.7
512	D	30.6	Very low	32	Very low	151 Å²	151	134.3 Å²	134.3	81%	0.807	77%	0.77	S	S	*	*				85.3	144.9	59	-77.2	-39.6	0	0	0	113.8
513	P	36.3	Very low	32.3	Very low	110 Å²	110	131.9 Å²	131.9	71%	0.714	77%	0.771	S	S	*	*				-133.8	-167.7	-125.8	43.2	-28.5	0	0	0	115.9
514	S	28.7	Very low	32.4	Very low	100 Å²	100	132.3 Å²	132.3	70%	0.699	77%	0.768	S	S	*	*			trans	114.5	163.6	141.9	80.1	0	0	0	0	119.4
515	I	33.3	Very low	32.7	Very low	149 Å²	149	131.6 Å²	131.6	76%	0.764	76%	0.763	S	S	*	*			trans	79.2	94.8	161.7	-60.4	165.4	0	0	0	118.4
516	H	32	Very low	32.7	Very low	170 Å²	170	137.6 Å²	137.6	79%	0.787	77%	0.772	S	S	*	*				47.2	135.1	128.8	-88.4	-80.4	0	0	0	124.2
517	S	31.4	Very low	33	Very low	104 Å²	104	136.3 Å²	136.3	73%	0.727	77%	0.768	S	S	*	*			trans	75.9	157	140.6	86.7	0	0	0	0	117.1
518	Q	32.2	Very low	32.9	Very low	153 Å²	153	138.1 Å²	138.1	72%	0.715	77%	0.769	S	S	*	*			cis	-163.8	170.2	-15.9	-125.8	-169.9	39.2	0	0	109.4
519	Q	34.2	Very low	33.1	Very low	161 Å²	161	141.2 Å²	141.2	75%	0.752	77%	0.772	S	S	*	*			trans	69.6	161.3	159.5	-68.8	174	52.2	0	0	118.7
520	K	30.8	Very low	33	Very low	177 Å²	177	147 Å²	147	77%	0.77	77%	0.774	S	S	*	*			cis	-172.7	170.5	-35.4	-154.7	169	-169.7	172.3	0	109.5
521	Q	35.3	Very low	32.7	Very low	156 Å²	156	148.2 Å²	148.2	73%	0.729	78%	0.782	S	S	*	*			trans	85.3	122	164.5	-46.5	-147	58.7	0	0	115.9
522	K	31.2	Very low	32.3	Very low	187 Å²	187	144.8 Å²	144.8	81%	0.813	78%	0.776	S	S	*	*				86.8	150.2	68.4	-77.2	-179	175.3	-175.9	0	112.9
523	T	35.1	Very low	32.5	Very low	145 Å²	145	142.7 Å²	142.7	89%	0.89	77%	0.773	S	S	*	*			cis	-122.3	-140.5	29.7	61.6	0	0	0	0	115.6
524	N	29.8	Very low	32.3	Very low	136 Å²	136	145.3 Å²	145.3	73%	0.727	78%	0.776	S	S	*	*			trans	-170.2	130.2	-159.5	164.8	104.3	0	0	0	115.1
525	S	36.7	Very low	32.6	Very low	108 Å²	108	147.5 Å²	147.5	76%	0.755	78%	0.778	S	S	*	*			trans	-167	133.5	159.6	43.9	0	0	0	0	110.2
526	K	32	Very low	32.4	Very low	190 Å²	190	147.1 Å²	147.1	83%	0.826	78%	0.778	S	S	*	*				74.5	139.8	57.9	-73.3	-167.7	173.3	-168.1	0	113.5
527	S	34.4	Very low	32.5	Very low	110 Å²	110	143.8 Å²	143.8	77%	0.769	77%	0.774	S	S	*	*			cis	-151.8	175.1	7.9	48.4	0	0	0	0	114.5
528	D	31.9	Very low	32.6	Very low	148 Å²	148	144.6 Å²	144.6	79%	0.791	78%	0.779	S	S	*	*			trans	-70.9	166	-177.7	-42.1	-104.8	0	0	0	116.1
529	D	37	Very low	32.6	Very low	167 Å²	167	141.5 Å²	141.5	89%	0.893	78%	0.78	S	S	*	*				-169.5	176.3	120.8	-119.5	-38.7	0	0	0	115.4
530	K	29.4	Very low	32.5	Very low	200 Å²	200	139.1 Å²	139.1	87%	0.87	78%	0.781	S	S	*	*			trans	-127.7	176.4	-169	-65.6	175.8	179.5	171.2	0	115.6
531	C	28.5	Very low	32.7	Very low	124 Å²	124	134.8 Å²	134.8	84%	0.838	78%	0.778	S	S	*	*			trans	126	166.8	149	-154.3	0	0	0	0	115.4
532	S	28.1	Very low	32.6	Very low	94 Å²	94	134.7 Å²	134.7	66%	0.657	78%	0.782	S	S	*	*				-157.8	178.5	-96.9	68.3	0	0	0	0	112.3
533	S	34.4	Very low	32.7	Very low	107 Å²	107	131.8 Å²	131.8	75%	0.748	78%	0.776	S	S	*	*			trans	71.4	159.2	163.8	74.4	0	0	0	0	119.5
534	Q	32	Very low	32.5	Very low	166 Å²	166	130.7 Å²	130.7	78%	0.776	77%	0.769	S	S	*	*			cis	-175.9	173.7	-30.9	-169.1	167.1	-1.9	0	0	109.7
535	I	34.5	Very low	32.4	Very low	146 Å²	146	130.9 Å²	130.9	75%	0.749	77%	0.765	S	S	*	*			trans	80.7	120.5	166.6	-49.5	173.4	0	0	0	114.5
536	D	30.6	Very low	31.9	Very low	140 Å²	140	135.5 Å²	135.5	75%	0.749	77%	0.766	S	S	*	*			cis	97.9	137.1	24.7	-67.6	-66.2	0	0	0	114.4
537	S	33.9	Very low	31.8	Very low	101 Å²	101	132 Å²	132	71%	0.706	77%	0.766	S	S	*	*			cis	-163.8	-164.2	-1.4	60.3	0	0	0	0	112
538	S	32.1	Very low	31.6	Very low	120 Å²	120	138 Å²	138	84%	0.839	77%	0.773	S	S	*	*			trans	76.1	168.3	170.6	86.1	0	0	0	0	117.2
539	A	32.9	Very low	31.6	Very low	89 Å²	89	138 Å²	138	74%	0.736	78%	0.778	S	S	*	*			cis	-177.9	169.5	-23.2	0	0	0	0	0	109
540	S	31.8	Very low	31.4	Very low	111 Å²	111	138.4 Å²	138.4	78%	0.776	77%	0.772	S	S	*	*			cis	-173.4	156.5	-26.6	56.8	0	0	0	0	112.7
541	A	34.3	Very low	31.4	Very low	86 Å²	86	136 Å²	136	71%	0.711	76%	0.763	S	S	*	*			trans	77	119.8	157.5	0	0	0	0	0	123.8
542	L	33.6	Very low	31.6	Very low	153 Å²	153	136 Å²	136	80%	0.801	76%	0.764	S	S	*	*			trans	59.7	149	143.1	-54.3	175.8	0	0	0	120.5
543	D	32.9	Very low	31.9	Very low	127 Å²	127	139.5 Å²	139.5	68%	0.679	77%	0.77	S	S	*	*			cis	-156.1	161.5	1.9	-128.8	-29.1	0	0	0	115.6
544	T	30.8	Very low	31.9	Very low	121 Å²	121	145 Å²	145	74%	0.742	77%	0.774	S	S	*	*			trans	36	142.6	161.6	20.3	0	0	0	0	128.6
545	E	27.6	Very low	32.2	Very low	140 Å²	140	143.1 Å²	143.1	65%	0.654	77%	0.769	S	S	*	*			trans	83.7	123.7	145.8	-73.7	-114.2	107.7	0	0	124.8
546	R	27.4	Very low	32.2	Very low	205 Å²	205	148.5 Å²	148.5	77%	0.774	78%	0.78	S	S	*	*			trans	51.4	109.3	147.1	-58.2	179.8	-167.8	-159.3	5.2	122.6
547	S	29.3	Very low	32.3	Very low	117 Å²	117	145.8 Å²	145.8	82%	0.818	78%	0.777	S	S	*	*				-176.1	170.3	127.7	47	0	0	0	0	114.1
548	Y	29.7	Very low	32.4	Very low	237 Å²	237	145.6 Å²	145.6	93%	0.929	78%	0.776	S	S	*	*			trans	-68.5	139.5	-171.4	-66.3	-97.2	0	0	0	115.1
549	V	33.4	Very low	32.6	Very low	146 Å²	146	149.2 Å²	149.2	89%	0.885	78%	0.777	S	S	*	*			trans	-94.3	132.2	178.4	179	0	0	0	0	112.7
550	K	32	Very low	32.8	Very low	177 Å²	177	150.6 Å²	150.6	77%	0.77	78%	0.781	S	S	*	*			trans	-104.9	152.8	173.1	-90.9	178.3	177.6	171.4	0	112
551	H	30.6	Very low	33	Very low	150 Å²	150	154.5 Å²	154.5	69%	0.694	78%	0.784	S	S	*	*			trans	50	122.7	156.5	-65.6	-66.2	0	0	0	120.8
552	S	32.4	Very low	33.2	Very low	123 Å²	123	154 Å²	154	86%	0.86	78%	0.78	S	S	*	*			trans	-104.4	88.3	146.5	61.1	0	0	0	0	110.5	W554	S552-W554 PolarHBondContact O-N 3.09Å
553	H	32.7	Very low	33.4	Very low	167 Å²	167	155.8 Å²	155.8	77%	0.773	78%	0.781	S	S	*	*			trans	-75.9	116.8	168.7	-99.7	-59.8	0	0	0	109.9
554	W	35.9	Very low	33.6	Very low	222 Å²	222	161 Å²	161	84%	0.841	79%	0.792	S	S	*	*			trans	-126.3	143.8	171.3	-159.4	43	0	0	0	111	S552	S552-W554 PolarHBondContact O-N 3.09Å
555	L	38.5	Very low	33.8	Very low	127 Å²	127	165.3 Å²	165.3	67%	0.665	80%	0.8	S	S	*	*			trans	61.3	63.2	171.2	-53.7	179.9	0	0	0	118.7	A557	L555-A557 VanDerWaalsContact C-N 3.33Å; L555-A557 PolarHBondContact O-N 2.91Å; L555-A557 VanDerWaalsContact O-N 3.11Å
556	R	34.6	Very low	34.1	Very low	260 Å²	260	171 Å²	171	98%	0.981	82%	0.815	S	S	*	*			trans	-70.7	84.3	145.5	-87.3	-170.6	171.4	-166.8	0.3	110.2
557	A	31.4	Very low	34.5	Very low	83 Å²	83	165.7 Å²	165.7	69%	0.686	82%	0.816	S	S	*	*			trans	-169	72.5	164.6	0	0	0	0	0	115	L555	L555-A557 VanDerWaalsContact C-N 3.33Å; L555-A557 PolarHBondContact O-N 2.91Å; L555-A557 VanDerWaalsContact O-N 3.11Å
558	S	35.5	Very low	34.7	Very low	97 Å²	97	170.1 Å²	170.1	68%	0.678	82%	0.82	S	S	*	*	S	Bend	trans	-150.2	-55.6	164.9	-80.5	0	0	0	0	114.5	S560	S558-S560 PolarHBondContact O-N 3.06Å
559	F	36.6	Very low	35.1	Very low	196 Å²	196	164.1 Å²	164.1	86%	0.86	81%	0.813	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-8	-161.4	-87	-87	0	0	0	117.3
560	S	37.3	Very low	35.1	Very low	118 Å²	118	163.9 Å²	163.9	83%	0.825	81%	0.807	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	3.4	177.8	51.4	0	0	0	0	114.7	S558	S558-S560 PolarHBondContact O-N 3.06Å
561	K	36.5	Very low	35.3	Very low	193 Å²	193	162.5 Å²	162.5	84%	0.839	81%	0.806	S	S	*	*	S	Bend	trans	-105.1	-6.2	-174.8	-132.4	175.5	-174.8	178.9	0	115.2
562	A	38.2	Very low	35.4	Very low	75 Å²	75	167 Å²	167	62%	0.62	82%	0.817	S	S	*	*	S	Bend	trans	-78.5	-23.4	-179.2	0	0	0	0	0	114.3
563	F	38.3	Very low	35.6	Very low	190 Å²	190	165.9 Å²	165.9	83%	0.833	81%	0.807	S	S	*	*	S	Bend	trans	-133.4	53.3	-167.5	-64.3	-74.6	0	0	0	114.6
564	R	36.7	Very low	35.8	Very low	238 Å²	238	163.9 Å²	163.9	90%	0.898	80%	0.802	S	S	*	*			trans	-174.9	100.4	156.6	-107.4	164.9	-170.8	-154.6	2.9	113.3
565	K	35	Very low	35.8	Very low	211 Å²	211	159.5 Å²	159.5	92%	0.917	80%	0.795	S	S	*	*			trans	157.7	104.2	138.2	-91.5	-175.2	175.8	-174.1	0	112.2
566	R	35	Very low	35.9	Very low	259 Å²	259	158.7 Å²	158.7	98%	0.977	80%	0.8	S	S	*	*			trans	-137.4	121.9	140.5	-84.5	-168.9	174.9	177.7	-0.9	107.3
567	A	36	Very low	36.1	Very low	94 Å²	94	154.1 Å²	154.1	78%	0.777	79%	0.79	S	S	*	*			trans	-147.2	120.9	176.8	0	0	0	0	0	109.4
568	K	33.6	Very low	36.4	Very low	210 Å²	210	156.9 Å²	156.9	91%	0.913	79%	0.791	S	S	*	*			trans	38.3	118.5	159.4	-61.6	-176.8	176.8	-177	0	119.9
569	S	36.9	Very low	36.4	Very low	111 Å²	111	158.5 Å²	158.5	78%	0.776	79%	0.791	S	S	*	*				-159.6	113.5	127.5	53.7	0	0	0	0	113.1
570	N	33.5	Very low	36.5	Very low	141 Å²	141	156 Å²	156	75%	0.754	78%	0.784	S	S	*	*			trans	56.4	101.3	142.5	-57.3	2.5	0	0	0	123.2
571	I	35.9	Very low	36.5	Very low	147 Å²	147	157.5 Å²	157.5	75%	0.754	78%	0.783	S	S	*	*				54.3	113.3	111.9	-57.3	154.6	0	0	0	119.4
572	R	33.4	Very low	36.5	Very low	245 Å²	245	151.1 Å²	151.1	93%	0.925	77%	0.772	S	S	*	*				-161.4	134.9	114.3	-124.7	179.7	-177.3	176.7	0.5	111.5
573	P	36.3	Very low	36.2	Very low	100 Å²	100	153.8 Å²	153.8	65%	0.649	79%	0.787	S	S	*	*			trans	-114.2	-172.8	179.9	42	-34.3	0	0	0	114.3
574	N	36.6	Very low	36.1	Very low	124 Å²	124	149.4 Å²	149.4	66%	0.663	78%	0.78	S	S	*	*			trans	95.7	110	159.4	-74.8	54.2	0	0	0	120.8
575	D	36.9	Very low	36.1	Very low	131 Å²	131	143.9 Å²	143.9	70%	0.701	77%	0.772	S	S	*	*				95.3	150.3	118.4	-59.1	-7	0	0	0	124
576	S	39.7	Very low	36.3	Very low	110 Å²	110	139.2 Å²	139.2	77%	0.769	76%	0.761	S	S	*	*			trans	74.8	138.5	165.5	69.1	0	0	0	0	119.4
577	E	38.8	Very low	36.3	Very low	164 Å²	164	133.6 Å²	133.6	77%	0.766	75%	0.751	S	S	*	*			cis	-173.4	168.1	-30.7	-126.2	176.5	178.4	0	0	110.5
578	I	38.4	Very low	36.3	Very low	140 Å²	140	136.8 Å²	136.8	72%	0.718	75%	0.754	S	S	*	*			trans	63.5	149	146	-74.1	165	0	0	0	119.6
579	L	35.3	Very low	36.4	Very low	131 Å²	131	135.5 Å²	135.5	69%	0.686	75%	0.751	S	S	*	*			cis	-173.7	-178.8	-37.2	-129.3	177.1	0	0	0	108.2
580	M	38.4	Very low	36.3	Very low	143 Å²	143	135.8 Å²	135.8	70%	0.704	75%	0.751	S	S	*	*			trans	70.5	153.4	168.5	-46	-50	-161.7	0	0	117.3
581	N	37.5	Very low	36.4	Very low	150 Å²	150	135.6 Å²	135.6	80%	0.802	76%	0.755	S	S	*	*			cis	-166.5	169.2	-23.3	-99.9	-15.9	0	0	0	108
582	G	35.5	Very low	36.4	Very low	60 Å²	60	134 Å²	134	62%	0.619	75%	0.751	S	S	*	*			cis	152.5	117.9	-7.9	0	0	0	0	0	113.3
583	S	32.3	Very low	36.5	Very low	131 Å²	131	131 Å²	131	92%	0.916	75%	0.748	S	S	*	*			trans	69.1	163.1	171.5	-47.9	0	0	0	0	116.4
584	S	36.9	Very low	36.6	Very low	98 Å²	98	132.4 Å²	132.4	69%	0.685	75%	0.75	S	S	*	*			cis	-154.3	147.7	10.1	54.9	0	0	0	0	115.4
585	T	36.5	Very low	36.8	Very low	121 Å²	121	133.5 Å²	133.5	74%	0.742	75%	0.751	S	S	*	*			trans	69.1	134.4	141.3	51	0	0	0	0	125.8
586	T	37.9	Very low	37.1	Very low	113 Å²	113	132.2 Å²	132.2	69%	0.693	75%	0.747	S	S	*	*			trans	81	100.8	141	46.2	0	0	0	0	124
587	N	35.3	Very low	37.4	Very low	142 Å²	142	131 Å²	131	76%	0.759	74%	0.735	S	S	*	*				60.3	106.6	120.7	-58.5	-0.7	0	0	0	121.9
588	L	36.2	Very low	37.7	Very low	161 Å²	161	125.8 Å²	125.8	84%	0.843	72%	0.721	S	S	*	*				178.7	139.9	96.6	-97.4	162.8	0	0	0	114.7
589	Q	36.5	Very low	38.1	Very low	182 Å²	182	124.5 Å²	124.5	85%	0.85	72%	0.715	S	S	*	*			trans	65.9	153.5	162.7	-70.7	-170.4	-13.3	0	0	120.4
590	P	35	Very low	38.8	Very low	118 Å²	118	123.6 Å²	123.6	77%	0.766	71%	0.711	S	S	*	*			trans	-115.6	146	-153	39	-27.5	0	0	0	115.2
591	T	35.4	Very low	39.7	Very low	136 Å²	136	122.7 Å²	122.7	83%	0.834	71%	0.705	S	S	*	*			trans	-145.9	135	164.9	37.9	0	0	0	0	112.9
592	V	36.1	Very low	40.8	Very low	113 Å²	113	122.6 Å²	122.6	69%	0.685	70%	0.698	S	S	*	*			trans	50.4	107.9	158.6	-172.2	0	0	0	0	117.9
593	H	34.4	Very low	42	Very low	184 Å²	184	124.2 Å²	124.2	85%	0.852	69%	0.691	S	S	*	*			trans	-136.6	72.2	163.7	-155.5	57.6	0	0	0	111.8
594	D	38.3	Very low	43.7	Very low	128 Å²	128	123.5 Å²	123.5	68%	0.684	67%	0.674	S	S	*	*			trans	-154.1	38.2	-178.5	-144.8	-2.6	0	0	0	114.1
595	Q	42.2	Very low	45.2	Very low	148 Å²	148	122.1 Å²	122.1	69%	0.692	66%	0.663	S	S	*	*	S	Bend	trans	-119.2	-7.4	-179.9	-70.6	-168.9	-1.7	0	0	115.1
596	V	43.3	Very low	46.8	Very low	103 Å²	103	121.5 Å²	121.5	62%	0.624	65%	0.652	S	S	*	*	H	α-helix	trans	-84.1	-36.7	-178.4	-176.9	0	0	0	0	111.3
597	T	45	Very low	48.6	Very low	84 Å²	84	122 Å²	122	52%	0.515	65%	0.646	S	S	.	*	H	α-helix	trans	-64.2	-42.2	-178.1	-0.2	0	0	0	0	113.1	N599 N600 Q601	T597-N599 PolarHBondContact O-N 3.42Å; T597-N600 PolarHBondContact O-N 3.04Å; T597-Q601 PolarHBondContact O-N 3.19Å
598	A	45.4	Very low	50.6	Low	56 Å²	56	120.7 Å²	120.7	46%	0.463	64%	0.635	S	S	.	*	H	α-helix	trans	-65.6	-34	-174.9	0	0	0	0	0	113.9	K602	A598-K602 PolarHBondContact O-N 2.99Å; A598-K602 VanDerWaalsContact O-N 3.09Å
599	N	47.6	Very low	52.6	Low	113 Å²	113	118.6 Å²	118.6	60%	0.604	63%	0.625	S	S	*	*	H	α-helix	trans	-70.1	-36	-178.9	-74.9	-31.1	0	0	0	112.4	T597 K602 L603	T597-N599 PolarHBondContact O-N 3.42Å; N599-K602 PolarHBondContact O-N 3.39Å; N599-L603 PolarHBondContact O-N 2.82Å; N599-L603 VanDerWaalsContact O-N 3.14Å
600	N	49.8	Very low	54.6	Low	112 Å²	112	115.2 Å²	115.2	60%	0.599	61%	0.612	S	S	*	*	H	α-helix	trans	-68	-42.7	176	-75.8	-12.4	0	0	0	111.7	T597 K602 L603 Q604	T597-N600 PolarHBondContact O-N 3.04Å; N600-K602 VanDerWaalsContact C-N 3.35Å; N600-K602 PolarHBondContact O-N 2.97Å; N600-L603 PolarHBondContact O-N 2.89Å; N600-Q604 WeakPolarHBondContact O-CB 3.45Å; N600-Q604 PolarHBondContact O-N 3.02Å
601	Q	57.4	Low	56.8	Low	124 Å²	124	119 Å²	119	58%	0.579	61%	0.611	S	S	*	*	H	α-helix	trans	-60.4	-43.7	175.2	-71.6	-178.8	-14.6	0	0	111.7	T597 L603 Q604 C605	T597-Q601 PolarHBondContact O-N 3.19Å; Q601-L603 PolarHBondContact O-N 2.81Å; Q601-Q604 PolarHBondContact O-N 2.86Å; Q601-C605 PolarHBondContact O-N 3.27Å; Q601-C605 PolarHBondContact O-SG 3.08Å; Q601-C605 VanDerWaalsContact O-SG 3.42Å
602	K	60	Low	59	Low	148 Å²	148	117.7 Å²	117.7	64%	0.643	60%	0.599	S	S	*	*	H	α-helix	trans	-60	-46.4	177.8	-169.2	-176.9	176.6	-167.4	0	111.9	A598 N599 N600 Q604 C605 E606	A598-K602 PolarHBondContact O-N 2.99Å; A598-K602 VanDerWaalsContact O-N 3.09Å; N599-K602 PolarHBondContact O-N 3.39Å; N600-K602 VanDerWaalsContact C-N 3.35Å; N600-K602 PolarHBondContact O-N 2.97Å; K602-Q604 VanDerWaalsContact C-N 3.3Å; K602-Q604 PolarHBondContact O-N 3.14Å; K602-C605 PolarHBondContact O-N 2.95Å; K602-E606 WeakPolarHBondContact O-CB 3.49Å; K602-E606 PolarHBondContact O-N 3.23Å
603	L	61.4	Low	61.1	Low	93 Å²	93	118.3 Å²	118.3	49%	0.487	59%	0.594	S	S	.	*	H	α-helix	trans	-64.2	-35.7	178	-158.7	79	0	0	0	112.1	N599 N600 Q601 E606 Q607	N599-L603 PolarHBondContact O-N 2.82Å; N599-L603 VanDerWaalsContact O-N 3.14Å; N600-L603 PolarHBondContact O-N 2.89Å; Q601-L603 PolarHBondContact O-N 2.81Å; L603-E606 PolarHBondContact O-N 3.43Å; L603-Q607 WeakPolarHBondContact O-CG 3.43Å; L603-Q607 PolarHBondContact O-N 2.9Å
604	Q	67.8	Low	63.4	Low	117 Å²	117	115.8 Å²	115.8	55%	0.547	59%	0.586	S	S	.	*	H	α-helix	trans	-68.6	-41.1	177.4	-168.4	174.1	13.1	0	0	112.1	N600 Q601 K602 Q607 Q608	N600-Q604 WeakPolarHBondContact O-CB 3.45Å; N600-Q604 PolarHBondContact O-N 3.02Å; Q601-Q604 PolarHBondContact O-N 2.86Å; K602-Q604 VanDerWaalsContact C-N 3.3Å; K602-Q604 PolarHBondContact O-N 3.14Å; Q604-Q607 PolarHBondContact O-N 3.45Å; Q604-Q608 WeakPolarHBondContact O-CG 3.33Å; Q604-Q608 PolarHBondContact O-N 3.44Å
605	C	67.4	Low	65.5	Low	68 Å²	68	112.9 Å²	112.9	46%	0.459	57%	0.573	S	S	.	*	H	α-helix	trans	-64.6	-38.7	172.3	-68	0	0	0	0	112.2	Q601 K602 Q608 L609	Q601-C605 PolarHBondContact O-N 3.27Å; Q601-C605 PolarHBondContact O-SG 3.08Å; Q601-C605 VanDerWaalsContact O-SG 3.42Å; K602-C605 PolarHBondContact O-N 2.95Å; C605-Q608 PolarHBondContact O-N 3.14Å; C605-L609 WeakPolarHBondContact O-CG 3.44Å; C605-L609 PolarHBondContact O-N 3.33Å
606	E	70.2	Confident	67.5	Low	109 Å²	109	109.2 Å²	109.2	51%	0.509	56%	0.561	S	S	.	*	H	α-helix	trans	-63.6	-44.1	177.1	-162	157.1	-141.9	0	0	111.1	K602 L603 Q608 L609 D610	K602-E606 WeakPolarHBondContact O-CB 3.49Å; K602-E606 PolarHBondContact O-N 3.23Å; L603-E606 PolarHBondContact O-N 3.43Å; E606-Q608 PolarHBondContact O-N 2.86Å; E606-L609 PolarHBondContact O-N 2.81Å; E606-D610 PolarHBondContact O-N 3.39Å
607	Q	76.1	Confident	69.2	Low	123 Å²	123	107 Å²	107	58%	0.575	55%	0.549	S	S	*	.	H	α-helix	trans	-64.6	-34.5	172.6	-71.1	177.2	10.5	0	0	113.7	L603 Q604 R611	L603-Q607 WeakPolarHBondContact O-CG 3.43Å; L603-Q607 PolarHBondContact O-N 2.9Å; Q604-Q607 PolarHBondContact O-N 3.45Å; Q607-R611 WeakPolarHBondContact O-CB 3.2Å; Q607-R611 PolarHBondContact O-N 3.04Å; Q607-R611 VanDerWaalsContact O-N 3.09Å
608	Q	76.8	Confident	71.1	Confident	114 Å²	114	111 Å²	111	53%	0.533	56%	0.555	S	S	.	*	H	α-helix	trans	-68.2	-40.2	173.7	-77.1	179.5	-12	0	0	111.9	Q604 C605 E606 R611 L612	Q604-Q608 WeakPolarHBondContact O-CG 3.33Å; Q604-Q608 PolarHBondContact O-N 3.44Å; C605-Q608 PolarHBondContact O-N 3.14Å; E606-Q608 PolarHBondContact O-N 2.86Å; Q608-R611 PolarHBondContact O-N 3.49Å; Q608-L612 WeakPolarHBondContact O-CG 3.49Å; Q608-L612 PolarHBondContact O-N 3.38Å
609	L	77.8	Confident	72.8	Confident	118 Å²	118	114.2 Å²	114.2	62%	0.618	56%	0.562	S	S	*	*	H	α-helix	trans	-63.7	-44	175.4	-75.5	167.1	0	0	0	112	C605 E606 R611 L612 H613	C605-L609 WeakPolarHBondContact O-CG 3.44Å; C605-L609 PolarHBondContact O-N 3.33Å; E606-L609 PolarHBondContact O-N 2.81Å; L609-R611 VanDerWaalsContact C-N 3.33Å; L609-R611 PolarHBondContact O-N 2.85Å; L609-L612 PolarHBondContact O-N 2.87Å; L609-H613 WeakPolarHBondContact O-CB 3.34Å; L609-H613 PolarHBondContact O-N 3.5Å
610	D	79.5	Confident	74.4	Confident	110 Å²	110	115.7 Å²	115.7	59%	0.588	56%	0.559	S	S	*	*	H	α-helix	trans	-60	-42.7	173.4	-88.1	-16	0	0	0	111.7	E606 L612 H613 L614	E606-D610 PolarHBondContact O-N 3.39Å; D610-L612 PolarHBondContact O-N 3.19Å; D610-H613 PolarHBondContact O-N 2.86Å; D610-L614 WeakPolarHBondContact O-CB 3.19Å; D610-L614 PolarHBondContact O-N 3.4Å
611	R	80.2	Confident	76	Confident	198 Å²	198	118.1 Å²	118.1	75%	0.747	56%	0.56	S	S	*	*	H	α-helix	trans	-66.1	-37.3	179	-162.6	175.1	-173.1	-174.8	0.7	112.3	Q607 Q608 L609 T615	Q607-R611 WeakPolarHBondContact O-CB 3.2Å; Q607-R611 PolarHBondContact O-N 3.04Å; Q607-R611 VanDerWaalsContact O-N 3.09Å; Q608-R611 PolarHBondContact O-N 3.49Å; L609-R611 VanDerWaalsContact C-N 3.33Å; L609-R611 PolarHBondContact O-N 2.85Å; R611-T615 WeakPolarHBondContact O-CB 3.1Å; R611-T615 PolarHBondContact O-N 3.39Å; R611-T615 VanDerWaalsContact O-N 3.16Å; R611-T615 PolarHBondContact O-OG1 3.05Å
612	L	82	Confident	77.2	Confident	108 Å²	108	116 Å²	116	57%	0.565	55%	0.55	S	S	*	.	H	α-helix	trans	-66.3	-46.5	170.6	-76.9	167.6	0	0	0	111.4	Q608 L609 D610 L614 T615 V616	Q608-L612 WeakPolarHBondContact O-CG 3.49Å; Q608-L612 PolarHBondContact O-N 3.38Å; L609-L612 PolarHBondContact O-N 2.87Å; D610-L612 PolarHBondContact O-N 3.19Å; L612-L614 VanDerWaalsContact C-N 3.33Å; L612-L614 PolarHBondContact O-N 2.9Å; L612-T615 WeakPolarHBondContact O-CB 3.19Å; L612-T615 PolarHBondContact O-N 3.42Å; L612-V616 WeakPolarHBondContact O-CG2 3.39Å; L612-V616 PolarHBondContact O-N 2.67Å
613	H	80.5	Confident	78.2	Confident	127 Å²	127	113.6 Å²	113.6	59%	0.588	54%	0.542	S	S	*	.	H	α-helix	trans	-60.7	-40.8	179.4	-172.8	-89.1	0	0	0	112.1	L609 D610 T615 S617	L609-H613 WeakPolarHBondContact O-CB 3.34Å; L609-H613 PolarHBondContact O-N 3.5Å; D610-H613 PolarHBondContact O-N 2.86Å; H613-T615 VanDerWaalsContact C-N 3.34Å; H613-S617 VanDerWaalsContact O-CB 3.3Å; H613-S617 WeakPolarHBondContact O-CB 3.21Å; H613-S617 PolarHBondContact O-N 3.22Å; H613-S617 PolarHBondContact O-OG 3Å
614	L	82.2	Confident	79.1	Confident	131 Å²	131	113.7 Å²	113.7	69%	0.686	54%	0.543	S	S	*	.	H	α-helix	trans	-63.4	-39.6	173.3	-135.2	79.2	0	0	0	112	D610 L612 S617 R618	D610-L614 WeakPolarHBondContact O-CB 3.19Å; D610-L614 PolarHBondContact O-N 3.4Å; L612-L614 VanDerWaalsContact C-N 3.33Å; L612-L614 PolarHBondContact O-N 2.9Å; L614-S617 PolarHBondContact O-N 3.15Å; L614-R618 WeakPolarHBondContact O-CB 3.19Å; L614-R618 PolarHBondContact O-N 2.92Å
615	T	83.9	Confident	79.9	Confident	67 Å²	67	111.6 Å²	111.6	41%	0.411	54%	0.535	S	S	.	.	H	α-helix	trans	-68.6	-46	179.7	-56.9	0	0	0	0	111.4	R611 L612 H613 S617 R618 M619	R611-T615 WeakPolarHBondContact O-CB 3.1Å; R611-T615 PolarHBondContact O-N 3.39Å; R611-T615 VanDerWaalsContact O-N 3.16Å; R611-T615 PolarHBondContact O-OG1 3.05Å; L612-T615 WeakPolarHBondContact O-CB 3.19Å; L612-T615 PolarHBondContact O-N 3.42Å; H613-T615 VanDerWaalsContact C-N 3.34Å; T615-S617 VanDerWaalsContact C-N 3.35Å; T615-S617 PolarHBondContact O-N 3.07Å; T615-R618 PolarHBondContact O-N 3.46Å; T615-M619 HydrophobicContact CG2-SD 4.41Å; T615-M619 WeakPolarHBondContact O-CG 3.5Å; T615-M619 PolarHBondContact O-N 2.9Å
616	V	83.8	Confident	80.6	Confident	71 Å²	71	112.3 Å²	112.3	43%	0.43	53%	0.534	S	S	.	.	H	α-helix	trans	-62.3	-41.2	174.3	173	0	0	0	0	111.2	L612 R618 M619 R620	L612-V616 WeakPolarHBondContact O-CG2 3.39Å; L612-V616 PolarHBondContact O-N 2.67Å; V616-R618 VanDerWaalsContact C-N 3.34Å; V616-R618 PolarHBondContact O-N 3.24Å; V616-M619 PolarHBondContact O-N 3.07Å; V616-R620 WeakPolarHBondContact O-CG 3.27Å; V616-R620 PolarHBondContact O-N 3.41Å
617	S	79.6	Confident	81.3	Confident	55 Å²	55	112.6 Å²	112.6	39%	0.385	54%	0.536	S	S	.	.	H	α-helix	trans	-62.2	-41.3	176.3	-59.9	0	0	0	0	112	H613 L614 T615 W621	H613-S617 VanDerWaalsContact O-CB 3.3Å; H613-S617 WeakPolarHBondContact O-CB 3.21Å; H613-S617 PolarHBondContact O-N 3.22Å; H613-S617 PolarHBondContact O-OG 3Å; L614-S617 PolarHBondContact O-N 3.15Å; T615-S617 VanDerWaalsContact C-N 3.35Å; T615-S617 PolarHBondContact O-N 3.07Å; S617-W621 PolarHBondContact O-N 3.5Å
618	R	83.5	Confident	81.6	Confident	168 Å²	168	109.8 Å²	109.8	63%	0.634	53%	0.533	S	S	*	.	H	α-helix	trans	-66.4	-43.4	173.8	171.4	179.9	158	-171.5	-9.9	112	L614 T615 V616 W621 Q622	L614-R618 WeakPolarHBondContact O-CB 3.19Å; L614-R618 PolarHBondContact O-N 2.92Å; T615-R618 PolarHBondContact O-N 3.46Å; V616-R618 VanDerWaalsContact C-N 3.34Å; V616-R618 PolarHBondContact O-N 3.24Å; R618-W621 PolarHBondContact O-N 3.19Å; R618-Q622 WeakPolarHBondContact O-CG 3.15Å; R618-Q622 PolarHBondContact O-N 3.04Å
619	M	81.1	Confident	81.8	Confident	124 Å²	124	112 Å²	112	61%	0.611	54%	0.537	S	S	*	.	H	α-helix	trans	-61.2	-43.5	178.2	-80	177.8	152.9	0	0	111.7	T615 V616 Q622 M623	T615-M619 HydrophobicContact CG2-SD 4.41Å; T615-M619 WeakPolarHBondContact O-CG 3.5Å; T615-M619 PolarHBondContact O-N 2.9Å; V616-M619 PolarHBondContact O-N 3.07Å; M619-Q622 PolarHBondContact O-N 3.31Å; M619-M623 PolarHBondContact O-N 3.34Å
620	R	81.1	Confident	81.9	Confident	145 Å²	145	111.1 Å²	111.1	55%	0.547	53%	0.533	S	S	.	.	H	α-helix	trans	-56.9	-52.6	173.2	-74.5	179.6	177.1	-173.7	-2	111.7	V616 Q622 M623 D624	V616-R620 WeakPolarHBondContact O-CG 3.27Å; V616-R620 PolarHBondContact O-N 3.41Å; R620-Q622 VanDerWaalsContact C-N 3.26Å; R620-Q622 PolarHBondContact O-N 3.02Å; R620-M623 CarbonylContact O-C 3.5Å; R620-M623 WeakPolarHBondContact O-CA 3.46Å; R620-M623 WeakPolarHBondContact O-CB 3.35Å; R620-M623 PolarHBondContact O-N 2.86Å; R620-D624 PolarHBondContact O-N 2.75Å
621	W	83.1	Confident	82	Confident	162 Å²	162	112 Å²	112	61%	0.614	53%	0.531	S	S	*	.	H	α-helix	trans	-59.6	-34.4	177.9	-178.3	78.8	0	0	0	113.5	S617 R618 D624 L625	S617-W621 PolarHBondContact O-N 3.5Å; R618-W621 PolarHBondContact O-N 3.19Å; W621-D624 WeakPolarHBondContact CA-OD2 3.48Å; W621-L625 HydrophobicContact CH2-CD2 3.85Å; W621-L625 HydrophobicContact CZ2-CD2 4.31Å; W621-L625 HydrophobicContact CZ3-CD2 4.16Å; W621-L625 WeakPolarHBondContact O-CB 3.43Å; W621-L625 PolarHBondContact O-N 3.33Å
622	Q	83.5	Confident	82.1	Confident	79 Å²	79	108.8 Å²	108.8	37%	0.369	52%	0.523	S	S	.	.	H	α-helix	trans	-69.6	-33.5	172.7	-73	-172	-120.4	0	0	112.2	R618 M619 R620 L626	R618-Q622 WeakPolarHBondContact O-CG 3.15Å; R618-Q622 PolarHBondContact O-N 3.04Å; M619-Q622 PolarHBondContact O-N 3.31Å; R620-Q622 VanDerWaalsContact C-N 3.26Å; R620-Q622 PolarHBondContact O-N 3.02Å; Q622-L626 WeakPolarHBondContact O-CD1 3.49Å; Q622-L626 VanDerWaalsContact O-CG 3.27Å; Q622-L626 WeakPolarHBondContact O-CG 3.27Å; Q622-L626 PolarHBondContact O-N 2.99Å; Q622-L626 VanDerWaalsContact O-N 3.15Å
623	M	81	Confident	82	Confident	98 Å²	98	108.1 Å²	108.1	48%	0.483	52%	0.519	S	S	.	.	H	α-helix	trans	-68.8	-49.9	173.1	-122.7	-56.2	117.9	0	0	111.7	M619 R620 L625 L626 E627	M619-M623 PolarHBondContact O-N 3.34Å; R620-M623 CarbonylContact O-C 3.5Å; R620-M623 WeakPolarHBondContact O-CA 3.46Å; R620-M623 WeakPolarHBondContact O-CB 3.35Å; R620-M623 PolarHBondContact O-N 2.86Å; M623-L625 PolarHBondContact O-N 3.24Å; M623-L625 VanDerWaalsContact O-N 3.14Å; M623-L626 HydrophobicContact CE-CB 3.92Å; M623-L626 HydrophobicContact CE-CD1 3.94Å; M623-L626 CarbonylContact O-C 3.55Å; M623-L626 WeakPolarHBondContact O-CA 3.48Å; M623-L626 WeakPolarHBondContact O-CB 3.5Å; M623-L626 PolarHBondContact O-N 3.15Å; M623-E627 PolarHBondContact O-N 3.46Å; M623-E627 HydrophobicContact SD-CG 4.02Å
624	D	79.9	Confident	81.7	Confident	95 Å²	95	107.7 Å²	107.7	51%	0.508	52%	0.518	S	S	.	.	H	α-helix	trans	-52.7	-39.9	177	-52.5	-29.6	0	0	0	111.3	R620 W621 A628	R620-D624 PolarHBondContact O-N 2.75Å; W621-D624 WeakPolarHBondContact CA-OD2 3.48Å; D624-A628 VanDerWaalsContact O-CB 3.31Å; D624-A628 WeakPolarHBondContact O-CB 3.21Å; D624-A628 PolarHBondContact O-N 3.29Å; D624-A628 VanDerWaalsContact O-N 3.14Å
625	L	85.8	Confident	81.4	Confident	73 Å²	73	106.7 Å²	106.7	38%	0.382	51%	0.509	S	S	.	.	H	α-helix	trans	-72.2	-30.7	177.2	-176.1	64.2	0	0	0	113.3	W621 M623 R629	W621-L625 HydrophobicContact CH2-CD2 3.85Å; W621-L625 HydrophobicContact CZ2-CD2 4.31Å; W621-L625 HydrophobicContact CZ3-CD2 4.16Å; W621-L625 WeakPolarHBondContact O-CB 3.43Å; W621-L625 PolarHBondContact O-N 3.33Å; M623-L625 PolarHBondContact O-N 3.24Å; M623-L625 VanDerWaalsContact O-N 3.14Å; L625-R629 WeakPolarHBondContact O-CB 3.24Å; L625-R629 VanDerWaalsContact O-CG 3.31Å; L625-R629 WeakPolarHBondContact O-CG 3.46Å; L625-R629 PolarHBondContact O-N 2.89Å
626	L	82	Confident	81.1	Confident	83 Å²	83	107 Å²	107	44%	0.435	51%	0.508	S	S	.	.	H	α-helix	trans	-77.5	-43.6	176.2	-77.1	167.3	0	0	0	111.5	Q622 M623 A628 R629 N630	Q622-L626 WeakPolarHBondContact O-CD1 3.49Å; Q622-L626 VanDerWaalsContact O-CG 3.27Å; Q622-L626 WeakPolarHBondContact O-CG 3.27Å; Q622-L626 PolarHBondContact O-N 2.99Å; Q622-L626 VanDerWaalsContact O-N 3.15Å; M623-L626 HydrophobicContact CE-CB 3.92Å; M623-L626 HydrophobicContact CE-CD1 3.94Å; M623-L626 CarbonylContact O-C 3.55Å; M623-L626 WeakPolarHBondContact O-CA 3.48Å; M623-L626 WeakPolarHBondContact O-CB 3.5Å; M623-L626 PolarHBondContact O-N 3.15Å; L626-A628 VanDerWaalsContact C-N 3.34Å; L626-A628 PolarHBondContact O-N 3.27Å; L626-R629 CarbonylContact O-C 3.57Å; L626-R629 WeakPolarHBondContact O-CB 3.35Å; L626-R629 PolarHBondContact O-N 3.3Å; L626-R629 VanDerWaalsContact O-N 3.08Å; L626-N630 PolarHBondContact O-N 2.8Å
627	E	83.2	Confident	80.7	Confident	116 Å²	116	108 Å²	108	54%	0.542	51%	0.51	S	S	.	.	H	α-helix	trans	-57.8	-46.6	172.5	-69.2	-164.5	169.5	0	0	111.3	M623 R629 N630 K631	M623-E627 PolarHBondContact O-N 3.46Å; M623-E627 HydrophobicContact SD-CG 4.02Å; E627-R629 PolarHBondContact O-N 3.24Å; E627-N630 PolarHBondContact O-N 3.21Å; E627-K631 WeakPolarHBondContact O-CB 3.46Å; E627-K631 PolarHBondContact O-N 3.22Å
628	A	82.8	Confident	80.2	Confident	63 Å²	63	109.9 Å²	109.9	52%	0.521	52%	0.515	S	S	.	.	H	α-helix	trans	-62.7	-27.7	176.5	0	0	0	0	0	113.3	D624 L626 K632	D624-A628 VanDerWaalsContact O-CB 3.31Å; D624-A628 WeakPolarHBondContact O-CB 3.21Å; D624-A628 PolarHBondContact O-N 3.29Å; D624-A628 VanDerWaalsContact O-N 3.14Å; L626-A628 VanDerWaalsContact C-N 3.34Å; L626-A628 PolarHBondContact O-N 3.27Å; A628-K632 WeakPolarHBondContact O-CB 3.34Å; A628-K632 PolarHBondContact O-N 3.34Å
629	R	81.1	Confident	79.8	Confident	161 Å²	161	110 Å²	110	61%	0.608	52%	0.52	S	S	*	.	H	α-helix	trans	-78.9	-44.6	172.9	-81.3	176.3	169.7	-161.1	-4.2	112.2	L625 L626 E627 K632 L633	L625-R629 WeakPolarHBondContact O-CB 3.24Å; L625-R629 VanDerWaalsContact O-CG 3.31Å; L625-R629 WeakPolarHBondContact O-CG 3.46Å; L625-R629 PolarHBondContact O-N 2.89Å; L626-R629 CarbonylContact O-C 3.57Å; L626-R629 WeakPolarHBondContact O-CB 3.35Å; L626-R629 PolarHBondContact O-N 3.3Å; L626-R629 VanDerWaalsContact O-N 3.08Å; E627-R629 PolarHBondContact O-N 3.24Å; R629-K632 CarbonylContact O-C 3.58Å; R629-K632 PolarHBondContact O-N 2.75Å; R629-K632 VanDerWaalsContact O-N 3.16Å; R629-L633 WeakPolarHBondContact O-CG 3.3Å; R629-L633 PolarHBondContact O-N 3.42Å
630	N	80.9	Confident	79.1	Confident	99 Å²	99	113.1 Å²	113.1	53%	0.529	53%	0.526	S	S	.	.	H	α-helix	trans	-61.8	-44.7	177.5	-91.2	9.5	0	0	0	111.5	L626 E627 K632 L633 Q634	L626-N630 PolarHBondContact O-N 2.8Å; E627-N630 PolarHBondContact O-N 3.21Å; N630-K632 VanDerWaalsContact C-N 3.28Å; N630-K632 PolarHBondContact O-N 2.92Å; N630-L633 PolarHBondContact O-N 3.47Å; N630-L633 VanDerWaalsContact O-N 3.1Å; N630-Q634 WeakPolarHBondContact O-CG 3.5Å; N630-Q634 PolarHBondContact O-N 3.05Å
631	K	80.9	Confident	78	Confident	130 Å²	130	110.2 Å²	110.2	57%	0.565	52%	0.522	S	S	*	.	H	α-helix	trans	-57.7	-42.3	173.6	-176.5	173.7	178.7	177.2	0	111.7	E627 Q634 E635	E627-K631 WeakPolarHBondContact O-CB 3.46Å; E627-K631 PolarHBondContact O-N 3.22Å; K631-Q634 PolarHBondContact O-N 2.93Å; K631-E635 VanDerWaalsContact CE-OE1 3.26Å; K631-E635 WeakPolarHBondContact CE-OE1 3.31Å; K631-E635 WeakPolarHBondContact O-CG 3.25Å; K631-E635 PolarHBondContact O-N 3.27Å
632	K	81.7	Confident	76.5	Confident	130 Å²	130	106.2 Å²	106.2	57%	0.565	52%	0.517	S	S	*	.	H	α-helix	trans	-68.5	-32.7	176.8	-171.6	178.4	178.1	-173	0	113	A628 R629 N630 I636	A628-K632 WeakPolarHBondContact O-CB 3.34Å; A628-K632 PolarHBondContact O-N 3.34Å; R629-K632 CarbonylContact O-C 3.58Å; R629-K632 PolarHBondContact O-N 2.75Å; R629-K632 VanDerWaalsContact O-N 3.16Å; N630-K632 VanDerWaalsContact C-N 3.28Å; N630-K632 PolarHBondContact O-N 2.92Å; K632-I636 HydrophobicContact CG-CD1 4.29Å; K632-I636 WeakPolarHBondContact O-CD1 3.44Å; K632-I636 VanDerWaalsContact O-CG1 3.26Å; K632-I636 WeakPolarHBondContact O-CG1 3.37Å; K632-I636 PolarHBondContact O-N 3.49Å; K632-I636 VanDerWaalsContact O-N 3.11Å
633	L	79.7	Confident	74.9	Confident	94 Å²	94	109.5 Å²	109.5	49%	0.492	54%	0.537	S	S	.	.	H	α-helix	trans	-68.4	-43.1	173.4	-73.7	168	0	0	0	110.8	R629 N630 E635 I636 I637	R629-L633 WeakPolarHBondContact O-CG 3.3Å; R629-L633 PolarHBondContact O-N 3.42Å; N630-L633 PolarHBondContact O-N 3.47Å; N630-L633 VanDerWaalsContact O-N 3.1Å; L633-E635 PolarHBondContact O-N 2.82Å; L633-I636 WeakPolarHBondContact O-CA 3.33Å; L633-I636 WeakPolarHBondContact O-CB 3.26Å; L633-I636 PolarHBondContact O-N 2.86Å; L633-I637 WeakPolarHBondContact O-CG1 3.31Å; L633-I637 PolarHBondContact O-N 3.21Å
634	Q	74.9	Confident	73.5	Confident	118 Å²	118	108 Å²	108	55%	0.551	53%	0.529	S	S	*	.	H	α-helix	trans	-58.6	-46	171.8	-70.1	170.9	-21.5	0	0	111.6	N630 K631 I636 I637 L638	N630-Q634 WeakPolarHBondContact O-CG 3.5Å; N630-Q634 PolarHBondContact O-N 3.05Å; K631-Q634 PolarHBondContact O-N 2.93Å; Q634-I636 PolarHBondContact O-N 3.22Å; Q634-I637 PolarHBondContact O-N 3.09Å; Q634-L638 WeakPolarHBondContact O-CB 3.26Å; Q634-L638 VanDerWaalsContact O-CG 3.25Å; Q634-L638 WeakPolarHBondContact O-CG 3.3Å; Q634-L638 PolarHBondContact O-N 2.99Å
635	E	76.3	Confident	72	Confident	109 Å²	109	107.6 Å²	107.6	51%	0.509	53%	0.526	S	S	.	.	H	α-helix	trans	-60.6	-23.3	173.3	-74.9	171.8	-168	0	0	113.9	K631 L633 K639	K631-E635 VanDerWaalsContact CE-OE1 3.26Å; K631-E635 WeakPolarHBondContact CE-OE1 3.31Å; K631-E635 WeakPolarHBondContact O-CG 3.25Å; K631-E635 PolarHBondContact O-N 3.27Å; L633-E635 PolarHBondContact O-N 2.82Å; E635-K639 WeakPolarHBondContact O-CB 3.49Å
636	I	78.2	Confident	70.1	Confident	75 Å²	75	111.2 Å²	111.2	39%	0.385	55%	0.545	S	S	.	.	H	α-helix	trans	-85.6	-44.9	174.7	-71.8	165.1	0	0	0	110.7	K632 L633 Q634 L638 K639 Y640	K632-I636 HydrophobicContact CG-CD1 4.29Å; K632-I636 WeakPolarHBondContact O-CD1 3.44Å; K632-I636 VanDerWaalsContact O-CG1 3.26Å; K632-I636 WeakPolarHBondContact O-CG1 3.37Å; K632-I636 PolarHBondContact O-N 3.49Å; K632-I636 VanDerWaalsContact O-N 3.11Å; L633-I636 WeakPolarHBondContact O-CA 3.33Å; L633-I636 WeakPolarHBondContact O-CB 3.26Å; L633-I636 PolarHBondContact O-N 2.86Å; Q634-I636 PolarHBondContact O-N 3.22Å; I636-L638 PolarHBondContact O-N 3.49Å; I636-K639 WeakPolarHBondContact O-CA 3.48Å; I636-K639 WeakPolarHBondContact O-CB 3.49Å; I636-K639 PolarHBondContact O-N 3.44Å; I636-Y640 HydrophobicContact CG2-CD2 3.95Å; I636-Y640 HydrophobicContact CG2-CE2 4.06Å; I636-Y640 WeakPolarHBondContact O-CD2 3.42Å; I636-Y640 PolarHBondContact O-N 3.34Å
637	I	74.6	Confident	68.1	Low	91 Å²	91	113.9 Å²	113.9	47%	0.467	55%	0.549	S	S	.	.	H	α-helix	trans	-58.8	-49.8	178.1	-67.7	161.4	0	0	0	110.1	L633 Q634 K639 Y640 N641	L633-I637 WeakPolarHBondContact O-CG1 3.31Å; L633-I637 PolarHBondContact O-N 3.21Å; Q634-I637 PolarHBondContact O-N 3.09Å; I637-K639 PolarHBondContact O-N 3.38Å; I637-Y640 PolarHBondContact O-N 3.01Å; I637-N641 PolarHBondContact O-N 3.16Å
638	L	69.3	Low	66	Low	95 Å²	95	111.5 Å²	111.5	50%	0.497	54%	0.54	S	S	.	.	H	α-helix	trans	-59.7	-13.6	174.9	-69.5	173	0	0	0	114.3	Q634 I636 L645	Q634-L638 WeakPolarHBondContact O-CB 3.26Å; Q634-L638 VanDerWaalsContact O-CG 3.25Å; Q634-L638 WeakPolarHBondContact O-CG 3.3Å; Q634-L638 PolarHBondContact O-N 2.99Å; I636-L638 PolarHBondContact O-N 3.49Å; L638-L645 HydrophobicContact CD2-CD1 4.43Å; L638-L645 HydrophobicContact CD2-CD2 3.58Å; L638-L645 HydrophobicContact CD2-CG 3.84Å
639	K	73.8	Confident	64.1	Low	171 Å²	171	115.3 Å²	115.3	74%	0.743	55%	0.547	S	S	*	.	H	α-helix	trans	-100.1	-11.9	179.3	-163.6	171.1	-176	177.3	0	113.6	E635 I636 I637	E635-K639 WeakPolarHBondContact O-CB 3.49Å; I636-K639 WeakPolarHBondContact O-CA 3.48Å; I636-K639 WeakPolarHBondContact O-CB 3.49Å; I636-K639 PolarHBondContact O-N 3.44Å; I637-K639 PolarHBondContact O-N 3.38Å
640	Y	68.2	Low	62.1	Low	188 Å²	188	113.8 Å²	113.8	74%	0.737	55%	0.55	S	S	*	*	H	α-helix	trans	-112	-32	176.3	-76.8	-75.8	0	0	0	113.2	I636 I637	I636-Y640 HydrophobicContact CG2-CD2 3.95Å; I636-Y640 HydrophobicContact CG2-CE2 4.06Å; I636-Y640 WeakPolarHBondContact O-CD2 3.42Å; I636-Y640 PolarHBondContact O-N 3.34Å; I637-Y640 PolarHBondContact O-N 3.01Å
641	N	56.4	Low	60.2	Low	84 Å²	84	117.5 Å²	117.5	45%	0.449	56%	0.558	S	S	.	*			trans	-118.2	89.3	173.2	-82	-1.9	0	0	0	110.9	I637 D643 E644	I637-N641 PolarHBondContact O-N 3.16Å; N641-D643 VanDerWaalsContact C-N 3.35Å; N641-E644 HydrophobicContact CB-CB 4.37Å; N641-E644 HydrophobicContact CB-CG 4.32Å; N641-E644 WeakPolarHBondContact CB-OE2 3.48Å; N641-E644 PolarHBondContact ND2-OE2 3.19Å
642	P	53.5	Low	58	Low	79 Å²	79	113.2 Å²	113.2	51%	0.513	54%	0.543	S	S	.	.	S	Bend	trans	-68.4	-33.2	174.2	27.9	-33.7	0	0	0	112.5	E644 L645	P642-E644 VanDerWaalsContact C-N 3.29Å; P642-E644 PolarHBondContact O-N 2.78Å; P642-L645 WeakPolarHBondContact O-CB 3.44Å; P642-L645 PolarHBondContact O-N 3.29Å
643	D	48.2	Very low	55.9	Low	148 Å²	148	110.9 Å²	110.9	79%	0.791	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-15.4	-171.7	-58.6	-37	0	0	0	113.9	N641 L645	N641-D643 VanDerWaalsContact C-N 3.35Å; D643-L645 VanDerWaalsContact C-N 3.27Å; D643-L645 PolarHBondContact O-N 3.15Å
644	E	51.4	Low	53.6	Low	67 Å²	67	115.5 Å²	115.5	31%	0.313	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.8	-15	174.8	-85.3	-169.7	97.9	0	0	113.7	N641 P642 L646 R647 N648	N641-E644 HydrophobicContact CB-CB 4.37Å; N641-E644 HydrophobicContact CB-CG 4.32Å; N641-E644 WeakPolarHBondContact CB-OE2 3.48Å; N641-E644 PolarHBondContact ND2-OE2 3.19Å; P642-E644 VanDerWaalsContact C-N 3.29Å; P642-E644 PolarHBondContact O-N 2.78Å; E644-L646 PolarHBondContact O-N 3.32Å; E644-L646 VanDerWaalsContact O-N 3.17Å; E644-R647 PolarHBondContact O-N 3.49Å; E644-N648 PolarHBondContact O-N 3.42Å; E644-N648 PolarHBondContact OE1-ND2 3.36Å
645	L	48.7	Very low	51.7	Low	85 Å²	85	115.7 Å²	115.7	45%	0.445	56%	0.56	S	S	.	*	H	α-helix	trans	-53.5	-37.8	-179.9	-89.8	162.1	0	0	0	112.8	L638 P642 D643	L638-L645 HydrophobicContact CD2-CD1 4.43Å; L638-L645 HydrophobicContact CD2-CD2 3.58Å; L638-L645 HydrophobicContact CD2-CG 3.84Å; P642-L645 WeakPolarHBondContact O-CB 3.44Å; P642-L645 PolarHBondContact O-N 3.29Å; D643-L645 VanDerWaalsContact C-N 3.27Å; D643-L645 PolarHBondContact O-N 3.15Å
646	L	45.5	Very low	49.7	Very low	149 Å²	149	118.7 Å²	118.7	78%	0.78	57%	0.574	S	S	*	*	H	α-helix	trans	-80	-13.7	179.5	-74.1	169	0	0	0	114.5	E644 L650	E644-L646 PolarHBondContact O-N 3.32Å; E644-L646 VanDerWaalsContact O-N 3.17Å; L646-L650 WeakPolarHBondContact O-CD1 3.37Å
647	R	41	Very low	48.2	Very low	140 Å²	140	123.8 Å²	123.8	53%	0.528	59%	0.593	S	S	.	*	H	α-helix	trans	-101.6	-43.3	176.9	-83.7	-177.5	170.7	-100.4	-2.1	112.3	E644 E649 L650 Y651	E644-R647 PolarHBondContact O-N 3.49Å; R647-E649 PolarHBondContact O-N 3.45Å; R647-L650 WeakPolarHBondContact O-CB 3.49Å; R647-L650 PolarHBondContact O-N 3.43Å; R647-Y651 WeakPolarHBondContact O-CD2 3.22Å; R647-Y651 PolarHBondContact O-N 2.94Å
648	N	39.7	Very low	47.5	Very low	66 Å²	66	127.8 Å²	127.8	35%	0.353	61%	0.607	S	S	.	*	H	α-helix	trans	-79	-18.6	-172.1	-68.3	-11.8	0	0	0	113	E644 L650 T652	E644-N648 PolarHBondContact O-N 3.42Å; E644-N648 PolarHBondContact OE1-ND2 3.36Å; N648-L650 VanDerWaalsContact C-N 3.29Å; N648-T652 HydrophobicContact CB-CG2 4.45Å; N648-T652 WeakPolarHBondContact O-CB 3.4Å; N648-T652 WeakPolarHBondContact O-CG2 3.41Å; N648-T652 PolarHBondContact O-OG1 3.44Å
649	E	42	Very low	47.5	Very low	143 Å²	143	124.2 Å²	124.2	67%	0.668	59%	0.589	S	S	*	*	H	α-helix	trans	-69.3	-24.6	164.1	-71.4	-163.2	154.3	0	0	112.9	R647	R647-E649 PolarHBondContact O-N 3.45Å
650	L	38.3	Very low	47.3	Very low	128 Å²	128	118.2 Å²	118.2	67%	0.67	57%	0.569	S	S	*	*	H	α-helix	trans	-89.8	-38.3	-179.2	-68.5	175.1	0	0	0	114	L646 R647 N648	L646-L650 WeakPolarHBondContact O-CD1 3.37Å; R647-L650 WeakPolarHBondContact O-CB 3.49Å; R647-L650 PolarHBondContact O-N 3.43Å; N648-L650 VanDerWaalsContact C-N 3.29Å
651	Y	41.1	Very low	47.5	Very low	177 Å²	177	109.6 Å²	109.6	69%	0.694	54%	0.535	S	S	*	.	H	α-helix	trans	-91.2	-11.3	-173.5	-80.7	-74.4	0	0	0	115.1	R647	R647-Y651 WeakPolarHBondContact O-CD2 3.22Å; R647-Y651 PolarHBondContact O-N 2.94Å
652	T	36.6	Very low	48.1	Very low	41 Å²	41	108.1 Å²	108.1	25%	0.252	52%	0.524	S	S	.	.	S	Bend	trans	-92.1	-78.6	-175.4	64.7	0	0	0	0	111	L366 N648 K654	L366-T652 WeakPolarHBondContact CD2-O 3.43Å; N648-T652 HydrophobicContact CB-CG2 4.45Å; N648-T652 WeakPolarHBondContact O-CB 3.4Å; N648-T652 WeakPolarHBondContact O-CG2 3.41Å; N648-T652 PolarHBondContact O-OG1 3.44Å; T652-K654 PolarHBondContact O-N 3.38Å; T652-K654 VanDerWaalsContact O-N 3.12Å
653	V	36	Very low	49	Very low	80 Å²	80	106 Å²	106	49%	0.485	51%	0.508	S	S	.	.	S	Bend	trans	-52.6	119.7	-168.8	-177.7	0	0	0	0	111.9	L366 L655	L366-V653 HydrophobicContact CD1-CG2 4.02Å; V653-L655 VanDerWaalsContact C-N 3.3Å; V653-L655 HydrophobicContact CG1-CG 4.5Å; V653-L655 PolarHBondContact O-N 2.83Å
654	K	31.9	Very low	50.2	Low	191 Å²	191	99 Å²	99	83%	0.83	47%	0.471	S	S	*	.			trans	-60.2	98.3	158.9	-83.9	-171.9	175.2	-178.5	0	107	T652 E656	T652-K654 PolarHBondContact O-N 3.38Å; T652-K654 VanDerWaalsContact O-N 3.12Å; K654-E656 PolarHBondContact O-N 2.89Å
655	L	34.3	Very low	51.1	Low	122 Å²	122	96 Å²	96	64%	0.639	46%	0.457	S	S	*	.			trans	-69.5	80.5	-176.8	-93.3	113.1	0	0	0	111.2	V653 K657	V653-L655 VanDerWaalsContact C-N 3.3Å; V653-L655 HydrophobicContact CG1-CG 4.5Å; V653-L655 PolarHBondContact O-N 2.83Å; L655-K657 VanDerWaalsContact C-N 3.3Å; L655-K657 PolarHBondContact O-N 2.8Å
656	E	36	Very low	51.7	Low	173 Å²	173	93.4 Å²	93.4	81%	0.808	45%	0.445	S	S	*	.			trans	-50.6	105.8	135.5	-69.1	179	171.7	0	0	106.3	K654 K658	K654-E656 PolarHBondContact O-N 2.89Å; E656-K658 VanDerWaalsContact C-N 3.3Å; E656-K658 PolarHBondContact O-N 2.8Å
657	K	45.5	Very low	52.1	Low	182 Å²	182	91.1 Å²	91.1	79%	0.791	43%	0.43	S	S	*	.			trans	-65.4	88.2	-173.9	-72.5	-173.6	176.1	-174.6	0	110	L655 V659	L655-K657 VanDerWaalsContact C-N 3.3Å; L655-K657 PolarHBondContact O-N 2.8Å; K657-V659 PolarHBondContact O-N 2.94Å
658	K	61.1	Low	52.8	Low	175 Å²	175	85.5 Å²	85.5	76%	0.761	41%	0.41	S	S	*	.			trans	-62.4	103.1	167.7	-74.3	-165.1	173.7	-170.3	0	108.3	E656 S660	E656-K658 VanDerWaalsContact C-N 3.3Å; E656-K658 PolarHBondContact O-N 2.8Å; K658-S660 PolarHBondContact O-N 2.9Å
659	V	68.3	Low	53.6	Low	19 Å²	19	84.5 Å²	84.5	12%	0.115	40%	0.402	C	S	.	.			trans	-54.7	130.5	173.7	-177.4	0	0	0	0	108.2	K657 D663 L664 Y746 N749 F750	K657-V659 PolarHBondContact O-N 2.94Å; V659-D663 HydrophobicContact CG1-CB 3.83Å; V659-L664 HydrophobicContact CG1-CG 4.48Å; V659-Y746 HydrophobicContact CG2-CD1 3.97Å; V659-N749 HydrophobicContact CB-CB 4.47Å; V659-N749 HydrophobicContact CG2-CB 3.69Å; V659-F750 HydrophobicContact CB-CB 4.45Å; V659-F750 HydrophobicContact CG1-CB 4.33Å; V659-F750 VanDerWaalsContact O-CD2 3.28Å; V659-F750 WeakPolarHBondContact O-CD2 3.36Å
660	S	69.3	Low	54.1	Low	46 Å²	46	84.8 Å²	84.8	32%	0.322	40%	0.404	S	S	.	.			trans	-101.4	166.2	178.5	68.8	0	0	0	0	110.5	K658 Y662 D663	K658-S660 PolarHBondContact O-N 2.9Å; S660-Y662 PolarHBondContact O-N 2.82Å; S660-Y662 WeakPolarHBondContact OG-CB 3.26Å; S660-D663 WeakPolarHBondContact CB-OD2 3.46Å; S660-D663 PolarHBondContact N-OD2 3.15Å; S660-D663 WeakPolarHBondContact O-CB 3.47Å; S660-D663 PolarHBondContact O-N 3.05Å; S660-D663 VanDerWaalsContact O-N 3.09Å; S660-D663 VanDerWaalsContact OG-CG 3.22Å; S660-D663 PolarHBondContact OG-N 3.32Å; S660-D663 PolarHBondContact OG-OD2 3.22Å
661	L	73.2	Confident	54.9	Low	6 Å²	6	85.8 Å²	85.8	3%	0.031	41%	0.41	C	S	.	.	H	α-helix	trans	-62.1	-30.9	173.5	-69.5	166.9	0	0	0	111.6	D663 L664 S665 F750 L1041 I1042 R1045 D1072	L661-D663 VanDerWaalsContact C-N 3.28Å; L661-D663 PolarHBondContact O-N 3.07Å; L661-L664 PolarHBondContact O-N 2.8Å; L661-S665 PolarHBondContact O-N 3.46Å; L661-S665 VanDerWaalsContact O-N 3.12Å; L661-S665 PolarHBondContact O-OG 3.21Å; L661-F750 HydrophobicContact CD1-CZ 4.27Å; L661-F750 HydrophobicContact CD2-CD2 4.4Å; L661-F750 HydrophobicContact CD2-CE1 3.96Å; L661-F750 HydrophobicContact CD2-CE2 3.7Å; L661-F750 HydrophobicContact CD2-CZ 3.44Å; L661-F750 VanDerWaalsContact CD2-CZ 3.44Å; L661-F750 HydrophobicContact CG-CE2 3.63Å; L661-F750 HydrophobicContact CG-CZ 3.62Å; L661-L1041 HydrophobicContact CD1-CD1 4.19Å; L661-L1041 HydrophobicContact CD1-CD2 4.07Å; L661-L1041 HydrophobicContact CD1-CG 3.87Å; L661-I1042 HydrophobicContact CD2-CG1 3.88Å; L661-R1045 HydrophobicContact CB-CG 4.35Å; L661-R1045 HydrophobicContact CD1-CG 4.36Å; L661-D1072 HydrophobicContact CD1-CB 4.03Å; L661-D1072 WeakPolarHBondContact CD1-OD1 3.23Å
662	Y	69.4	Low	55.9	Low	53 Å²	53	78 Å²	78	21%	0.208	38%	0.381	C	S	.	.	H	α-helix	trans	-57.7	-38.9	172.6	-171.8	-90.4	0	0	0	112.3	S660 L664 S665 T666 H667 K1065	S660-Y662 PolarHBondContact O-N 2.82Å; S660-Y662 WeakPolarHBondContact OG-CB 3.26Å; Y662-L664 VanDerWaalsContact C-N 3.28Å; Y662-L664 PolarHBondContact O-N 2.67Å; Y662-S665 PolarHBondContact O-N 2.77Å; Y662-T666 WeakPolarHBondContact CD2-OG1 3.45Å; Y662-T666 HydrophobicContact CE2-CG2 4.47Å; Y662-T666 WeakPolarHBondContact CE2-OG1 3.2Å; Y662-T666 VanDerWaalsContact CG-OG1 3.31Å; Y662-T666 VanDerWaalsContact CZ-OG1 3.25Å; Y662-T666 PolarHBondContact O-N 3.03Å; Y662-T666 PolarHBondContact O-OG1 3.13Å; Y662-H667 PolarHBondContact O-N 3.43Å; Y662-K1065 VanDerWaalsContact OH-CE 3.28Å; Y662-K1065 WeakPolarHBondContact OH-CE 3.41Å; Y662-K1065 PolarHBondContact OH-NZ 3.35Å
663	D	70.8	Confident	57.1	Low	36 Å²	36	79.4 Å²	79.4	19%	0.193	39%	0.392	C	S	.	.	H	α-helix	trans	-68.3	-29.6	-179.2	-58.4	-51	0	0	0	112.5	V659 S660 L661 H667	V659-D663 HydrophobicContact CG1-CB 3.83Å; S660-D663 WeakPolarHBondContact CB-OD2 3.46Å; S660-D663 PolarHBondContact N-OD2 3.15Å; S660-D663 WeakPolarHBondContact O-CB 3.47Å; S660-D663 PolarHBondContact O-N 3.05Å; S660-D663 VanDerWaalsContact O-N 3.09Å; S660-D663 VanDerWaalsContact OG-CG 3.22Å; S660-D663 PolarHBondContact OG-N 3.32Å; S660-D663 PolarHBondContact OG-OD2 3.22Å; L661-D663 VanDerWaalsContact C-N 3.28Å; L661-D663 PolarHBondContact O-N 3.07Å; D663-H667 IonicContact OD1-CD2 3.65Å; D663-H667 PolarHBondContact OD1-CD2 3.04Å
664	L	74.9	Confident	58.7	Low	1 Å²	1	76.6 Å²	76.6	1%	0.005	37%	0.373	C	S	.	.	H	α-helix	trans	-81.8	-22.9	174.6	-59.2	175.8	0	0	0	113.2	V659 L661 Y662 G723 C724 F750 I1042	V659-L664 HydrophobicContact CG1-CG 4.48Å; L661-L664 PolarHBondContact O-N 2.8Å; Y662-L664 VanDerWaalsContact C-N 3.28Å; Y662-L664 PolarHBondContact O-N 2.67Å; L664-G723 WeakPolarHBondContact O-CA 3.47Å; L664-C724 PolarHBondContact O-N 2.76Å; L664-F750 HydrophobicContact CD1-CB 4.12Å; L664-F750 HydrophobicContact CD1-CD2 4.36Å; L664-F750 HydrophobicContact CD1-CG 4.13Å; L664-I1042 HydrophobicContact CD1-CD1 4.13Å; L664-I1042 HydrophobicContact CD1-CG1 3.95Å; L664-I1042 HydrophobicContact CD1-CG2 4.18Å
665	S	68.8	Low	60.8	Low	3 Å²	3	72.2 Å²	72.2	2%	0.021	35%	0.354	C	S	.	.	H	α-helix	trans	-108.2	-25.8	-171.6	78.2	0	0	0	0	116.1	L661 Y662 F669 E1049	L661-S665 PolarHBondContact O-N 3.46Å; L661-S665 VanDerWaalsContact O-N 3.12Å; L661-S665 PolarHBondContact O-OG 3.21Å; Y662-S665 PolarHBondContact O-N 2.77Å; S665-F669 WeakPolarHBondContact O-CD2 3.46Å; S665-F669 WeakPolarHBondContact O-CE2 3.34Å; S665-F669 WeakPolarHBondContact O-CZ 3.4Å; S665-E1049 WeakPolarHBondContact CB-OE1 3.36Å; S665-E1049 WeakPolarHBondContact CB-OE2 3.41Å; S665-E1049 PolarHBondContact OG-OE1 3.41Å; S665-E1049 PolarHBondContact OG-OE2 3.05Å
666	T	61.2	Low	63	Low	31 Å²	31	66.4 Å²	66.4	19%	0.19	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-147.8	-8.6	-165.3	42.2	0	0	0	0	116.4	Y662 H668 F669	Y662-T666 WeakPolarHBondContact CD2-OG1 3.45Å; Y662-T666 HydrophobicContact CE2-CG2 4.47Å; Y662-T666 WeakPolarHBondContact CE2-OG1 3.2Å; Y662-T666 VanDerWaalsContact CG-OG1 3.31Å; Y662-T666 VanDerWaalsContact CZ-OG1 3.25Å; Y662-T666 PolarHBondContact O-N 3.03Å; Y662-T666 PolarHBondContact O-OG1 3.13Å; T666-H668 PolarHBondContact O-N 3.11Å; T666-F669 HydrophobicContact CG2-CG 4.48Å; T666-F669 WeakPolarHBondContact O-CB 3.18Å; T666-F669 PolarHBondContact O-N 2.85Å
667	H	55	Low	65.3	Low	100 Å²	100	59.6 Å²	59.6	46%	0.463	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-9.9	175.3	-165.1	-39.2	0	0	0	113.7	Y662 D663	Y662-H667 PolarHBondContact O-N 3.43Å; D663-H667 IonicContact OD1-CD2 3.65Å; D663-H667 PolarHBondContact OD1-CD2 3.04Å
668	H	56.2	Low	67.2	Low	22 Å²	22	50.9 Å²	50.9	10%	0.102	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	19.7	-178	-72	-19.8	0	0	0	114.1	T666 G726 R739	T666-H668 PolarHBondContact O-N 3.11Å; H668-G726 VanDerWaalsContact O-CA 3.26Å; H668-G726 WeakPolarHBondContact O-CA 3.38Å; H668-G726 PolarHBondContact O-N 3.22Å; H668-G726 VanDerWaalsContact O-N 3.11Å; H668-R739 PolarHBondContact O-NH2 3.1Å; H668-R739 VanDerWaalsContact O-NH2 3.1Å
669	F	55.4	Low	68.4	Low	46 Å²	46	43 Å²	43	20%	0.202	22%	0.22	C	C	.	.			trans	-109.4	-19.9	-170.3	-80.8	-126.7	0	0	0	114.6	S665 T666 D671 S672 F675 C724	S665-F669 WeakPolarHBondContact O-CD2 3.46Å; S665-F669 WeakPolarHBondContact O-CE2 3.34Å; S665-F669 WeakPolarHBondContact O-CZ 3.4Å; T666-F669 HydrophobicContact CG2-CG 4.48Å; T666-F669 WeakPolarHBondContact O-CB 3.18Å; T666-F669 PolarHBondContact O-N 2.85Å; F669-D671 PolarHBondContact O-N 3.16Å; F669-S672 PolarHBondContact O-OG 2.91Å; F669-F675 HydrophobicContact CB-CE1 4.06Å; F669-F675 AromaticContact CD1-CD1 3.51Å; F669-F675 HydrophobicContact CD1-CD1 3.51Å; F669-F675 AromaticContact CD1-CE1 3.29Å; F669-F675 HydrophobicContact CD1-CE1 3.29Å; F669-F675 HydrophobicContact CD1-CG 4.48Å; F669-F675 HydrophobicContact CD1-CZ 4.13Å; F669-F675 HydrophobicContact CD2-CD1 4.38Å; F669-F675 AromaticContact CE1-CD1 3.49Å; F669-F675 HydrophobicContact CE1-CD1 3.49Å; F669-F675 VanDerWaalsContact CE1-CD1 3.49Å; F669-F675 AromaticContact CE1-CE1 3.77Å; F669-F675 HydrophobicContact CE1-CE1 3.77Å; F669-F675 HydrophobicContact CE1-CG 4.13Å; F669-F675 HydrophobicContact CE2-CD1 4.34Å; F669-F675 AromaticContact CG-CD1 3.97Å; F669-F675 HydrophobicContact CG-CD1 3.97Å; F669-F675 AromaticContact CG-CE1 3.73Å; F669-F675 HydrophobicContact CG-CE1 3.73Å; F669-F675 AromaticContact CZ-CD1 3.93Å; F669-F675 HydrophobicContact CZ-CD1 3.93Å; F669-C724 HydrophobicContact CE2-CB 3.58Å; F669-C724 HydrophobicContact CZ-CB 3.53Å
670	Q	52.2	Low	69.1	Low	148 Å²	148	42 Å²	42	69%	0.692	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	132.9	172.4	-64.8	-179.6	-86.4	0	0	108.1	S672	Q670-S672 PolarHBondContact O-N 3.34Å
671	D	55.7	Low	69.3	Low	150 Å²	150	40.2 Å²	40.2	80%	0.802	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.9	11.8	177.4	-41	-39.6	0	0	0	116.5	F669 L728	F669-D671 PolarHBondContact O-N 3.16Å; D671-L728 HydrophobicContact CB-CD2 4.47Å; D671-L728 WeakPolarHBondContact O-CD2 3.39Å
672	S	63.2	Low	68.9	Low	13 Å²	13	40.7 Å²	40.7	9%	0.091	20%	0.204	C	C	.	.			trans	-93.7	126.4	-179.2	66.5	0	0	0	0	114.7	F669 Q670 F675 G726 L727	F669-S672 PolarHBondContact O-OG 2.91Å; Q670-S672 PolarHBondContact O-N 3.34Å; S672-F675 VanDerWaalsContact OG-CE1 3.24Å; S672-F675 WeakPolarHBondContact OG-CE1 3.41Å; S672-G726 VanDerWaalsContact CB-CA 3.47Å; S672-L727 CarbonylContact C-O 3.54Å; S672-L727 WeakPolarHBondContact CA-O 3.15Å; S672-L727 WeakPolarHBondContact CB-O 3.15Å
673	C	61.6	Low	68.5	Low	71 Å²	71	40.3 Å²	40.3	48%	0.48	20%	0.204	S	C	.	.	S	Bend	trans	-76.3	-24.4	-175.4	-58.7	0	0	0	0	114.3	L727 D729	C673-L727 PolarHBondContact N-O 3.38Å; C673-D729 WeakPolarHBondContact CB-OD1 3.28Å; C673-D729 PolarHBondContact SG-OD1 2.91Å; C673-D729 PolarHBondContact SG-OD2 2.88Å
674	Q	69.9	Low	67.6	Low	20 Å²	20	39.5 Å²	39.5	9%	0.093	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	140.2	176.9	-61.6	-172.2	19.3	0	0	112.4	G726 L727 I825 N829 L842	Q674-G726 CarbonylContact O-C 3.59Å; Q674-G726 WeakPolarHBondContact O-CA 3.35Å; Q674-L727 PolarHBondContact O-N 2.99Å; Q674-I825 HydrophobicContact CB-CD1 4.33Å; Q674-I825 VanDerWaalsContact CD-CD1 3.5Å; Q674-I825 HydrophobicContact CG-CD1 3.84Å; Q674-N829 PolarHBondContact NE2-OD1 3.26Å; Q674-N829 VanDerWaalsContact NE2-OD1 3.17Å; Q674-L842 HydrophobicContact CB-CD1 4.29Å
675	F	74.9	Confident	66.2	Low	99 Å²	99	39.8 Å²	39.8	43%	0.434	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	133.1	-179.4	-51.6	-72.5	0	0	0	112	F669 S672	F669-F675 HydrophobicContact CB-CE1 4.06Å; F669-F675 AromaticContact CD1-CD1 3.51Å; F669-F675 HydrophobicContact CD1-CD1 3.51Å; F669-F675 AromaticContact CD1-CE1 3.29Å; F669-F675 HydrophobicContact CD1-CE1 3.29Å; F669-F675 HydrophobicContact CD1-CG 4.48Å; F669-F675 HydrophobicContact CD1-CZ 4.13Å; F669-F675 HydrophobicContact CD2-CD1 4.38Å; F669-F675 AromaticContact CE1-CD1 3.49Å; F669-F675 HydrophobicContact CE1-CD1 3.49Å; F669-F675 VanDerWaalsContact CE1-CD1 3.49Å; F669-F675 AromaticContact CE1-CE1 3.77Å; F669-F675 HydrophobicContact CE1-CE1 3.77Å; F669-F675 HydrophobicContact CE1-CG 4.13Å; F669-F675 HydrophobicContact CE2-CD1 4.34Å; F669-F675 AromaticContact CG-CD1 3.97Å; F669-F675 HydrophobicContact CG-CD1 3.97Å; F669-F675 AromaticContact CG-CE1 3.73Å; F669-F675 HydrophobicContact CG-CE1 3.73Å; F669-F675 AromaticContact CZ-CD1 3.93Å; F669-F675 HydrophobicContact CZ-CD1 3.93Å; S672-F675 VanDerWaalsContact OG-CE1 3.24Å; S672-F675 WeakPolarHBondContact OG-CE1 3.41Å
676	V	81.6	Confident	64.5	Low	1 Å²	1	41 Å²	41	1%	0.006	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	128.5	-177.5	-170.9	0	0	0	0	111	C724 T725 L727 L769 L842 I844	V676-C724 WeakPolarHBondContact O-CA 3.09Å; V676-T725 HydrophobicContact CB-CG2 4.3Å; V676-T725 PolarHBondContact N-O 3.12Å; V676-T725 PolarHBondContact O-N 2.8Å; V676-L727 HydrophobicContact CG2-CD1 3.73Å; V676-L727 HydrophobicContact CG2-CG 3.92Å; V676-L769 HydrophobicContact CG1-CD1 4.02Å; V676-L842 HydrophobicContact CB-CB 4.3Å; V676-L842 HydrophobicContact CG1-CB 3.99Å; V676-L842 HydrophobicContact CG2-CB 3.96Å; V676-L842 HydrophobicContact CG2-CD1 3.85Å; V676-I844 HydrophobicContact CB-CD1 4.31Å; V676-I844 HydrophobicContact CG1-CB 4.34Å; V676-I844 HydrophobicContact CG1-CD1 3.62Å; V676-I844 HydrophobicContact CG1-CG1 3.64Å
677	Q	83.5	Confident	63.2	Low	29 Å²	29	43.7 Å²	43.7	14%	0.136	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	135.1	174.8	-59.4	-165.5	1.7	0	0	111	F679 L842 S843 I844 F1050	Q677-F679 HydrophobicContact CB-CD2 4.28Å; Q677-F679 HydrophobicContact CB-CE2 3.63Å; Q677-F679 HydrophobicContact CB-CZ 4.32Å; Q677-F679 VanDerWaalsContact OE1-CE2 3.32Å; Q677-L842 PolarHBondContact N-O 3.02Å; Q677-S843 CarbonylContact O-C 3.46Å; Q677-S843 WeakPolarHBondContact O-CA 3.33Å; Q677-I844 PolarHBondContact O-N 2.88Å; Q677-F1050 HydrophobicContact CG-CD2 4.33Å; Q677-F1050 HydrophobicContact CG-CE2 4.29Å; Q677-F1050 VanDerWaalsContact NE2-CE1 3.25Å; Q677-F1050 VanDerWaalsContact NE2-CZ 3.29Å
678	V	85.1	Confident	61.9	Low	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	123.9	-179.6	-174	0	0	0	0	110.7	K721 I722 G723 T725 L740 L743 I844 I846	V678-K721 CarbonylContact O-C 3.51Å; V678-K721 WeakPolarHBondContact O-CA 3.16Å; V678-I722 PolarHBondContact O-N 2.89Å; V678-G723 PolarHBondContact N-O 3.01Å; V678-T725 HydrophobicContact CG2-CG2 3.94Å; V678-L740 HydrophobicContact CG1-CD2 3.83Å; V678-L740 HydrophobicContact CG2-CD2 3.82Å; V678-L743 HydrophobicContact CB-CD2 3.72Å; V678-L743 HydrophobicContact CG1-CD2 3.9Å; V678-L743 HydrophobicContact CG2-CD2 3.73Å; V678-I844 HydrophobicContact CG1-CG2 4.47Å; V678-I844 HydrophobicContact CG2-CB 4.49Å; V678-I846 HydrophobicContact CG1-CD1 3.43Å; V678-I846 VanDerWaalsContact CG1-CD1 3.43Å; V678-I846 HydrophobicContact CG1-CG1 3.97Å
679	F	85.5	Confident	60.7	Low	8 Å²	8	53 Å²	53	4%	0.035	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	140.4	-179.7	-62.8	-95.4	0	0	0	111.4	Q677 S719 F720 K721 I844 Q845 I846 I1234	Q677-F679 HydrophobicContact CB-CD2 4.28Å; Q677-F679 HydrophobicContact CB-CE2 3.63Å; Q677-F679 HydrophobicContact CB-CZ 4.32Å; Q677-F679 VanDerWaalsContact OE1-CE2 3.32Å; F679-S719 VanDerWaalsContact CD1-OG 3.3Å; F679-S719 WeakPolarHBondContact CD1-OG 3.08Å; F679-F720 CarbonylContact C-O 3.51Å; F679-F720 VanDerWaalsContact CA-O 3.23Å; F679-F720 WeakPolarHBondContact CA-O 3.4Å; F679-K721 HydrophobicContact CD1-CB 3.93Å; F679-K721 HydrophobicContact CD1-CG 4.45Å; F679-K721 HydrophobicContact CE1-CB 3.92Å; F679-K721 HydrophobicContact CE1-CD 4.47Å; F679-K721 HydrophobicContact CE1-CG 4.3Å; F679-K721 HydrophobicContact CZ-CD 4.48Å; F679-I844 PolarHBondContact N-O 3.22Å; F679-Q845 CarbonylContact O-C 3.58Å; F679-Q845 WeakPolarHBondContact O-CA 3.48Å; F679-I846 PolarHBondContact O-N 2.87Å; F679-I1234 HydrophobicContact CE1-CB 4.26Å; F679-I1234 HydrophobicContact CE1-CD1 3.9Å; F679-I1234 HydrophobicContact CE1-CG2 4.17Å
680	V	83.7	Confident	59.9	Low	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	133.2	167	159.9	0	0	0	0	111.2	T682 S719 F720 I722 I846 L848 F880	V680-T682 HydrophobicContact CG1-CG2 3.81Å; V680-S719 VanDerWaalsContact O-CA 3.24Å; V680-S719 WeakPolarHBondContact O-CA 3.41Å; V680-F720 PolarHBondContact N-O 3.43Å; V680-F720 PolarHBondContact O-N 2.98Å; V680-I722 HydrophobicContact CB-CD1 3.87Å; V680-I722 HydrophobicContact CB-CG1 4.26Å; V680-I722 HydrophobicContact CG2-CD1 3.29Å; V680-I722 HydrophobicContact CG2-CG1 4.06Å; V680-I846 HydrophobicContact CG2-CB 3.67Å; V680-I846 HydrophobicContact CG2-CD1 4.35Å; V680-I846 HydrophobicContact CG2-CG2 3.64Å; V680-L848 HydrophobicContact CG1-CD1 3.65Å; V680-L848 HydrophobicContact CG1-CG 4.02Å; V680-L848 HydrophobicContact CG2-CD1 4.48Å; V680-L848 HydrophobicContact CG2-CD2 4.33Å; V680-L848 HydrophobicContact CG2-CG 4.36Å; V680-F880 HydrophobicContact CB-CE1 4.28Å; V680-F880 HydrophobicContact CB-CZ 4.38Å; V680-F880 HydrophobicContact CG1-CD1 4.33Å; V680-F880 HydrophobicContact CG1-CE1 3.58Å; V680-F880 HydrophobicContact CG1-CZ 4.09Å
681	H	74.1	Confident	59.1	Low	8 Å²	8	53.4 Å²	53.4	4%	0.037	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	106	179.2	-165.1	87.4	0	0	0	112.8	E683 I846 H847 K854 Y877	H681-E683 PolarHBondContact CD2-O 2.9Å; H681-E683 PolarHBondContact NE2-O 3.46Å; H681-I846 PolarHBondContact N-O 3.42Å; H681-H847 AromaticContact CG-CE1 3.91Å; H681-K854 PolarHBondContact CE1-NZ 2.98Å; H681-K854 VanDerWaalsContact CE1-NZ 3.29Å; H681-K854 VanDerWaalsContact NE2-CE 3.33Å; H681-K854 WeakPolarHBondContact NE2-CE 3.27Å; H681-K854 PolarHBondContact NE2-NZ 2.94Å; H681-Y877 PolarHBondContact O-OH 3.23Å
682	T	64.7	Low	58.1	Low	15 Å²	15	54.5 Å²	54.5	9%	0.092	26%	0.264	C	S	.	.			trans	-103	31.2	-174.9	64.3	0	0	0	0	114.4	V680 R718 F720 Y877 F880	V680-T682 HydrophobicContact CG1-CG2 3.81Å; T682-R718 PolarHBondContact N-O 3.09Å; T682-R718 WeakPolarHBondContact OG1-CB 3.09Å; T682-R718 PolarHBondContact OG1-O 2.81Å; T682-F720 HydrophobicContact CG2-CD2 3.48Å; T682-F720 VanDerWaalsContact CG2-CD2 3.48Å; T682-F720 HydrophobicContact CG2-CE2 3.51Å; T682-F720 VanDerWaalsContact OG1-CE2 3.3Å; T682-F720 WeakPolarHBondContact OG1-CE2 3.46Å; T682-Y877 VanDerWaalsContact CA-OH 3.26Å; T682-Y877 WeakPolarHBondContact CA-OH 3.14Å; T682-F880 HydrophobicContact CG2-CD1 3.92Å; T682-F880 HydrophobicContact CG2-CE1 3.72Å
683	E	60.1	Low	56.6	Low	46 Å²	46	60.1 Å²	60.1	22%	0.215	29%	0.292	C	S	.	.			trans	-129.5	136.1	-173	-162.6	-173.4	-95.3	0	0	114.7	H681 I717 R718 K854 Y877	H681-E683 PolarHBondContact CD2-O 2.9Å; H681-E683 PolarHBondContact NE2-O 3.46Å; E683-I717 VanDerWaalsContact OE1-CA 3.28Å; E683-I717 WeakPolarHBondContact OE1-CA 3.31Å; E683-R718 HydrophobicContact CB-CB 4.47Å; E683-R718 PolarHBondContact OE1-N 2.9Å; E683-K854 IonicContact OE2-NZ 2.77Å; E683-K854 PolarHBondContact OE2-NZ 3.25Å; E683-Y877 PolarHBondContact N-OH 2.96Å
684	S	52	Low	55.2	Low	18 Å²	18	60.8 Å²	60.8	13%	0.126	30%	0.297	C	S	.	.			trans	65.9	77.2	171.3	172.3	0	0	0	0	115	C686 Y687 T852	S684-C686 PolarHBondContact O-N 3.11Å; S684-C686 VanDerWaalsContact O-N 3.13Å; S684-C686 PolarHBondContact OG-N 3.35Å; S684-Y687 PolarHBondContact OG-N 2.95Å; S684-T852 PolarHBondContact O-OG1 2.88Å
685	I	47	Very low	53.3	Low	7 Å²	7	67 Å²	67	4%	0.036	33%	0.33	C	S	.	.	S	Bend		-63	99.6	127.6	-56.1	163.9	0	0	0	105.9	M874 Y877 V878 K921	I685-M874 HydrophobicContact CD1-CE 3.99Å; I685-M874 HydrophobicContact CG1-CE 4.39Å; I685-M874 HydrophobicContact CG2-CE 3.7Å; I685-Y877 HydrophobicContact CD1-CD1 3.99Å; I685-Y877 HydrophobicContact CD1-CE1 4.28Å; I685-Y877 HydrophobicContact CG1-CD1 4.26Å; I685-Y877 HydrophobicContact CG1-CE1 4.13Å; I685-V878 HydrophobicContact CD1-CG2 4.37Å; I685-K921 HydrophobicContact CB-CB 4.27Å; I685-K921 HydrophobicContact CB-CD 4.1Å; I685-K921 HydrophobicContact CG2-CB 3.85Å; I685-K921 HydrophobicContact CG2-CD 4.5Å; I685-K921 HydrophobicContact CG2-CG 4.5Å; I685-K921 WeakPolarHBondContact O-CD 3.43Å
686	C	31.5	Very low	51.3	Low	30 Å²	30	69.9 Å²	69.9	20%	0.203	35%	0.349	C	S	.	.	S	Bend	trans	44.9	81.6	176.2	-65.4	0	0	0	0	118.7	S684 P927 H928	S684-C686 PolarHBondContact O-N 3.11Å; S684-C686 VanDerWaalsContact O-N 3.13Å; S684-C686 PolarHBondContact OG-N 3.35Å; C686-P927 HydrophobicContact CB-CB 4Å; C686-P927 WeakPolarHBondContact CB-O 3.42Å; C686-H928 PolarHBondContact SG-CE1 3.03Å; C686-H928 PolarHBondContact SG-ND1 2.65Å
687	Y	35.4	Very low	48.8	Very low	86 Å²	86	74.3 Å²	74.3	34%	0.337	38%	0.38	S	S	.	.			trans	-118.3	108.9	151.4	-82.9	-76.5	0	0	0	111.8	S684 L690	S684-Y687 PolarHBondContact OG-N 2.95Å; Y687-L690 HydrophobicContact CD1-CD1 4.5Å; Y687-L690 HydrophobicContact CE1-CD1 4.38Å
688	R	27	Very low	46.4	Very low	196 Å²	196	81.5 Å²	81.5	74%	0.74	41%	0.413	S	S	*	.	S	Bend	trans	-134.3	107.5	157	-67.6	-171.7	-175.6	-178.1	2.7	109.3
689	N	31.5	Very low	43.7	Very low	123 Å²	123	87.6 Å²	87.6	66%	0.658	46%	0.455	S	S	*	.	S	Bend	trans	74.2	30.5	164	-51.4	-21.9	0	0	0	119.6
690	L	37.8	Very low	40.9	Very low	74 Å²	74	98.1 Å²	98.1	39%	0.387	49%	0.494	S	S	.	.			trans	-74.8	-36.1	175.7	-94.6	160.8	0	0	0	114.1	Y687 K692	Y687-L690 HydrophobicContact CD1-CD1 4.5Å; Y687-L690 HydrophobicContact CE1-CD1 4.38Å; L690-K692 PolarHBondContact O-N 3.39Å; L690-K692 VanDerWaalsContact O-N 3.16Å
691	D	35	Very low	38.2	Very low	127 Å²	127	104.5 Å²	104.5	68%	0.679	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	1.6	-172.4	-51.4	-68	0	0	0	115.1	I693	D691-I693 VanDerWaalsContact C-N 3.33Å
692	K	35.3	Very low	36.3	Very low	173 Å²	173	113.9 Å²	113.9	75%	0.752	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	8.4	176.6	-72.5	-162.6	172.4	-169.7	0	114.4	L690	L690-K692 PolarHBondContact O-N 3.39Å; L690-K692 VanDerWaalsContact O-N 3.16Å
693	I	31.9	Very low	34.6	Very low	132 Å²	132	118.5 Å²	118.5	68%	0.677	61%	0.605	S	S	*	*	S	Bend	trans	-125.7	51	-176.6	-39.3	-176.5	0	0	0	111.7	D691	D691-I693 VanDerWaalsContact C-N 3.33Å
694	S	31.6	Very low	33	Very low	84 Å²	84	121.4 Å²	121.4	59%	0.587	64%	0.637	S	S	*	*	S	Bend	trans	-136.4	153.6	156.8	57.2	0	0	0	0	109.9	I696	S694-I696 PolarHBondContact O-N 3.3Å
695	N	31.1	Very low	31.9	Very low	150 Å²	150	124.7 Å²	124.7	80%	0.802	67%	0.665	S	S	*	*	S	Bend	trans	74.7	-2.5	177.2	-52.5	-17.6	0	0	0	119.6	S697	N695-S697 PolarHBondContact O-N 2.97Å
696	I	31.9	Very low	30.9	Very low	161 Å²	161	131.8 Å²	131.8	83%	0.826	70%	0.703	S	S	*	*			trans	-81.4	61	170.3	-45.9	-178.5	0	0	0	111.2	S694	S694-I696 PolarHBondContact O-N 3.3Å
697	S	30.1	Very low	30.7	Very low	93 Å²	93	137.3 Å²	137.3	65%	0.65	73%	0.731	S	S	*	*	S	Bend	trans	-162.3	36.6	176.9	55.2	0	0	0	0	115	N695	N695-S697 PolarHBondContact O-N 2.97Å
698	Q	32.4	Very low	30.3	Very low	180 Å²	180	141.8 Å²	141.8	84%	0.841	76%	0.761	S	S	*	*	S	Bend	trans	-154.4	159	165	-113.3	142.3	94.7	0	0	111.9
699	C	27.7	Very low	30.4	Very low	129 Å²	129	136 Å²	136	87%	0.872	75%	0.75	S	S	*	*			trans	60.2	87.1	-176.8	-58.5	0	0	0	0	115.7
700	R	26.1	Very low	30.2	Very low	229 Å²	229	134.5 Å²	134.5	86%	0.864	76%	0.755	S	S	*	*			trans	-67.1	166.2	147.4	-107.5	-176.4	-179.6	163.8	-1.5	109.9
701	D	28.1	Very low	29.6	Very low	133 Å²	133	138 Å²	138	71%	0.711	77%	0.774	S	S	*	*			trans	68.4	71.1	159.2	-49.7	-25.3	0	0	0	118.3
702	Q	34.4	Very low	29.2	Very low	205 Å²	205	137.5 Å²	137.5	96%	0.958	78%	0.776	S	S	*	*				-158.2	168.7	122.4	-111.1	148.4	103.8	0	0	114.7
703	S	29.6	Very low	28.7	Very low	112 Å²	112	134.3 Å²	134.3	78%	0.783	77%	0.773	S	S	*	*			trans	-90.9	151.4	-158.3	53.2	0	0	0	0	115.5
704	A	26.2	Very low	28.4	Very low	107 Å²	107	135 Å²	135	88%	0.884	78%	0.777	S	S	*	*			trans	-60.9	138.1	-176.5	0	0	0	0	0	115.5
705	A	28.3	Very low	28.2	Very low	88 Å²	88	136.6 Å²	136.6	73%	0.727	78%	0.778	S	S	*	*			trans	-153.6	131	150.5	0	0	0	0	0	109.6
706	N	26.4	Very low	28.1	Very low	155 Å²	155	131.9 Å²	131.9	83%	0.829	76%	0.756	S	S	*	*			trans	11.4	111.4	164.7	-53.9	-6.4	0	0	0	119.5
707	D	27.8	Very low	28.4	Very low	146 Å²	146	126.5 Å²	126.5	78%	0.781	73%	0.729	S	S	*	*			trans	-136.1	96.8	150.1	-96.2	-41.8	0	0	0	110	S709	D707-S709 VanDerWaalsContact C-N 3.28Å; D707-S709 PolarHBondContact O-N 3.37Å
708	N	26.3	Very low	29.7	Very low	180 Å²	180	124.9 Å²	124.9	96%	0.963	71%	0.708	S	S	*	*			trans	-91.1	59.3	171	-81.8	-10.7	0	0	0	109.9
709	S	28.4	Very low	31.5	Very low	74 Å²	74	116.3 Å²	116.3	52%	0.517	67%	0.669	S	S	.	*			trans	-111.1	102.5	172.5	55.5	0	0	0	0	109.8	D707 D711	D707-S709 VanDerWaalsContact C-N 3.28Å; D707-S709 PolarHBondContact O-N 3.37Å; S709-D711 VanDerWaalsContact C-N 3.34Å; S709-D711 PolarHBondContact O-N 2.94Å
710	A	27.6	Very low	33.9	Very low	93 Å²	93	110.5 Å²	110.5	77%	0.769	63%	0.629	S	S	*	*			trans	-74.4	87.8	174.1	0	0	0	0	0	109.8	T712	A710-T712 VanDerWaalsContact C-N 3.33Å; A710-T712 PolarHBondContact O-N 2.97Å
711	D	26	Very low	36.7	Very low	148 Å²	148	99.8 Å²	99.8	79%	0.791	59%	0.588	S	S	*	*			trans	-59	95.3	171	-79.6	-27.2	0	0	0	109.6	S709	S709-D711 VanDerWaalsContact C-N 3.34Å; S709-D711 PolarHBondContact O-N 2.94Å
712	T	25.7	Very low	39.4	Very low	116 Å²	116	93.4 Å²	93.4	71%	0.712	55%	0.554	S	S	*	*			trans	-69.3	121.1	173.6	36.4	0	0	0	0	108	A710 I714	A710-T712 VanDerWaalsContact C-N 3.33Å; A710-T712 PolarHBondContact O-N 2.97Å; T712-I714 PolarHBondContact O-N 3.21Å; T712-I714 VanDerWaalsContact O-N 3.13Å
713	P	25.8	Very low	41.7	Very low	106 Å²	106	83.7 Å²	83.7	69%	0.688	51%	0.509	S	S	*	.			trans	-68.2	117.9	-173.7	26.2	-33.3	0	0	0	109.7	N715	P713-N715 PolarHBondContact O-N 3.21Å
714	I	25.8	Very low	44.1	Very low	147 Å²	147	79.1 Å²	79.1	75%	0.754	48%	0.477	S	S	*	.			trans	-75.2	58.6	174.4	-46.9	-180	0	0	0	109.8	T712 C716	T712-I714 PolarHBondContact O-N 3.21Å; T712-I714 VanDerWaalsContact O-N 3.13Å; I714-C716 PolarHBondContact O-N 2.94Å
715	N	25.9	Very low	46.8	Very low	116 Å²	116	74 Å²	74	62%	0.62	44%	0.435	S	S	*	.			trans	-89.1	83.7	164	-74.9	-9.2	0	0	0	106.6	P713 I717	P713-N715 PolarHBondContact O-N 3.21Å; N715-I717 PolarHBondContact O-N 2.79Å
716	C	30.2	Very low	49.3	Very low	51 Å²	51	69.9 Å²	69.9	35%	0.345	40%	0.4	S	S	.	.			trans	-60.5	102.5	178.7	-69.2	0	0	0	0	110.4	I714 R718 L1231	I714-C716 PolarHBondContact O-N 2.94Å; C716-R718 PolarHBondContact O-N 2.82Å; C716-L1231 HydrophobicContact CB-CD1 4.31Å
717	I	38.1	Very low	52	Low	48 Å²	48	62.5 Å²	62.5	25%	0.246	36%	0.361	C	S	.	.			trans	-49.8	114	177	-64.2	178.6	0	0	0	108.8	E683 N715 S719 I1234	E683-I717 VanDerWaalsContact OE1-CA 3.28Å; E683-I717 WeakPolarHBondContact OE1-CA 3.31Å; N715-I717 PolarHBondContact O-N 2.79Å; I717-S719 VanDerWaalsContact C-N 3.35Å; I717-S719 PolarHBondContact O-N 2.98Å; I717-I1234 CarbonylContact O-C 3.55Å
718	R	57.1	Low	54.5	Low	59 Å²	59	58.5 Å²	58.5	22%	0.223	34%	0.339	C	S	.	.			trans	-76.6	82.4	175.3	-65.2	-171	-174.8	148.3	2.5	111.5	T682 E683 C716 L1231	T682-R718 PolarHBondContact N-O 3.09Å; T682-R718 WeakPolarHBondContact OG1-CB 3.09Å; T682-R718 PolarHBondContact OG1-O 2.81Å; E683-R718 HydrophobicContact CB-CB 4.47Å; E683-R718 PolarHBondContact OE1-N 2.9Å; C716-R718 PolarHBondContact O-N 2.82Å; R718-L1231 HydrophobicContact CG-CD2 4.19Å
719	S	69.4	Low	56.9	Low	1 Å²	1	54.4 Å²	54.4	1%	0.007	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	138.9	159.5	86.2	0	0	0	0	111	F679 V680 I717 G1233 I1234	F679-S719 VanDerWaalsContact CD1-OG 3.3Å; F679-S719 WeakPolarHBondContact CD1-OG 3.08Å; V680-S719 VanDerWaalsContact O-CA 3.24Å; V680-S719 WeakPolarHBondContact O-CA 3.41Å; I717-S719 VanDerWaalsContact C-N 3.35Å; I717-S719 PolarHBondContact O-N 2.98Å; S719-G1233 CarbonylContact O-C 3.58Å; S719-G1233 VanDerWaalsContact O-CA 3.29Å; S719-G1233 WeakPolarHBondContact O-CA 3.36Å; S719-I1234 PolarHBondContact N-O 2.94Å; S719-I1234 PolarHBondContact O-N 3.43Å; S719-I1234 PolarHBondContact OG-O 2.86Å
720	F	79.1	Confident	59.2	Low	7 Å²	7	59.9 Å²	59.9	3%	0.031	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	127.4	172.5	-60.6	-49.3	0	0	0	108.5	F679 V680 T682 I722 F880 D1232	F679-F720 CarbonylContact C-O 3.51Å; F679-F720 VanDerWaalsContact CA-O 3.23Å; F679-F720 WeakPolarHBondContact CA-O 3.4Å; V680-F720 PolarHBondContact N-O 3.43Å; V680-F720 PolarHBondContact O-N 2.98Å; T682-F720 HydrophobicContact CG2-CD2 3.48Å; T682-F720 VanDerWaalsContact CG2-CD2 3.48Å; T682-F720 HydrophobicContact CG2-CE2 3.51Å; T682-F720 VanDerWaalsContact OG1-CE2 3.3Å; T682-F720 WeakPolarHBondContact OG1-CE2 3.46Å; F720-I722 PolarHBondContact O-N 3.11Å; F720-F880 HydrophobicContact CD2-CE1 4.11Å; F720-D1232 HydrophobicContact CD1-CB 4.34Å; F720-D1232 VanDerWaalsContact CD1-O 3.26Å; F720-D1232 WeakPolarHBondContact CD1-O 3.25Å; F720-D1232 HydrophobicContact CE1-CB 3.82Å
721	K	83.9	Confident	61.8	Low	3 Å²	3	55.8 Å²	55.8	1%	0.013	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	120.9	170.4	-169.4	172.6	175.2	-177.8	0	108	V678 F679 C724 Q1043 L1046 I1234	V678-K721 CarbonylContact O-C 3.51Å; V678-K721 WeakPolarHBondContact O-CA 3.16Å; F679-K721 HydrophobicContact CD1-CB 3.93Å; F679-K721 HydrophobicContact CD1-CG 4.45Å; F679-K721 HydrophobicContact CE1-CB 3.92Å; F679-K721 HydrophobicContact CE1-CD 4.47Å; F679-K721 HydrophobicContact CE1-CG 4.3Å; F679-K721 HydrophobicContact CZ-CD 4.48Å; K721-C724 WeakPolarHBondContact CE-SG 3.37Å; K721-Q1043 PolarHBondContact O-NE2 3.06Å; K721-L1046 HydrophobicContact CB-CD1 4.49Å; K721-L1046 HydrophobicContact CD-CB 3.85Å; K721-L1046 HydrophobicContact CG-CB 4.18Å; K721-L1046 HydrophobicContact CG-CD1 4.1Å; K721-L1046 PolarHBondContact NZ-O 3.19Å; K721-I1234 HydrophobicContact CB-CD1 3.76Å
722	I	84.7	Confident	64.6	Low	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	-34.8	-176	-77.7	-154.9	0	0	0	111.3	V678 V680 F720 L743 Y747 F880	V678-I722 PolarHBondContact O-N 2.89Å; V680-I722 HydrophobicContact CB-CD1 3.87Å; V680-I722 HydrophobicContact CB-CG1 4.26Å; V680-I722 HydrophobicContact CG2-CD1 3.29Å; V680-I722 HydrophobicContact CG2-CG1 4.06Å; F720-I722 PolarHBondContact O-N 3.11Å; I722-L743 HydrophobicContact CG2-CD2 3.92Å; I722-L743 HydrophobicContact CG2-CG 3.92Å; I722-Y747 HydrophobicContact CB-CD2 4.07Å; I722-Y747 HydrophobicContact CB-CE2 4.41Å; I722-Y747 HydrophobicContact CB-CG 4.32Å; I722-Y747 HydrophobicContact CD1-CD1 3.87Å; I722-Y747 HydrophobicContact CD1-CE1 4.07Å; I722-Y747 HydrophobicContact CD1-CG 4.11Å; I722-Y747 HydrophobicContact CG1-CD1 4.17Å; I722-Y747 HydrophobicContact CG1-CD2 3.98Å; I722-Y747 HydrophobicContact CG1-CE1 4.17Å; I722-Y747 HydrophobicContact CG1-CE2 3.98Å; I722-Y747 HydrophobicContact CG1-CG 4.08Å; I722-Y747 HydrophobicContact CG2-CD2 4.02Å; I722-Y747 HydrophobicContact CG2-CG 3.92Å; I722-Y747 WeakPolarHBondContact O-CD2 3.49Å; I722-F880 HydrophobicContact CD1-CE2 4.42Å; I722-F880 HydrophobicContact CD1-CZ 3.94Å
723	G	83.7	Confident	67.4	Low	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.9	-164	179.7	0	0	0	0	0	111.3	L664 V678	L664-G723 WeakPolarHBondContact O-CA 3.47Å; V678-G723 PolarHBondContact N-O 3.01Å
724	C	80.7	Confident	70.1	Confident	16 Å²	16	50.1 Å²	50.1	11%	0.108	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	143.5	169.3	-63.1	0	0	0	0	109	L664 F669 V676 K721	L664-C724 PolarHBondContact O-N 2.76Å; F669-C724 HydrophobicContact CE2-CB 3.58Å; F669-C724 HydrophobicContact CZ-CB 3.53Å; V676-C724 WeakPolarHBondContact O-CA 3.09Å; K721-C724 WeakPolarHBondContact CE-SG 3.37Å
725	T	83	Confident	72.9	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	132.5	169.9	-172.9	0	0	0	0	110.3	V676 V678 L736 R739 I844	V676-T725 HydrophobicContact CB-CG2 4.3Å; V676-T725 PolarHBondContact N-O 3.12Å; V676-T725 PolarHBondContact O-N 2.8Å; V678-T725 HydrophobicContact CG2-CG2 3.94Å; T725-L736 HydrophobicContact CG2-CD1 4.41Å; T725-R739 VanDerWaalsContact OG1-CD 3.25Å; T725-R739 WeakPolarHBondContact OG1-CD 3.48Å; T725-R739 PolarHBondContact OG1-NE 3.44Å; T725-I844 HydrophobicContact CG2-CD1 4.33Å
726	G	80.7	Confident	75.7	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	146.5	160.8	0	0	0	0	0	111.1	H668 S672 Q674 R739	H668-G726 VanDerWaalsContact O-CA 3.26Å; H668-G726 WeakPolarHBondContact O-CA 3.38Å; H668-G726 PolarHBondContact O-N 3.22Å; H668-G726 VanDerWaalsContact O-N 3.11Å; S672-G726 VanDerWaalsContact CB-CA 3.47Å; Q674-G726 CarbonylContact O-C 3.59Å; Q674-G726 WeakPolarHBondContact O-CA 3.35Å; G726-R739 PolarHBondContact O-NE 2.79Å; G726-R739 PolarHBondContact O-NH2 3.06Å
727	L	82.3	Confident	78.4	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	140.8	168.1	-61.1	176.8	0	0	0	109.6	S672 C673 Q674 V676 M731 L736 I828	S672-L727 CarbonylContact C-O 3.54Å; S672-L727 WeakPolarHBondContact CA-O 3.15Å; S672-L727 WeakPolarHBondContact CB-O 3.15Å; C673-L727 PolarHBondContact N-O 3.38Å; Q674-L727 PolarHBondContact O-N 2.99Å; V676-L727 HydrophobicContact CG2-CD1 3.73Å; V676-L727 HydrophobicContact CG2-CG 3.92Å; L727-M731 HydrophobicContact CB-SD 4.45Å; L727-M731 HydrophobicContact CD2-SD 3.74Å; L727-L736 HydrophobicContact CD2-CD1 3.83Å; L727-L736 HydrophobicContact CD2-CD2 4.48Å; L727-I828 HydrophobicContact CD1-CD1 3.36Å
728	L	81.2	Confident	80.6	Confident	62 Å²	62	42.2 Å²	42.2	33%	0.325	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-99.8	156.2	173	-54.1	166.8	0	0	0	109.3	D671 E730 M731	D671-L728 HydrophobicContact CB-CD2 4.47Å; D671-L728 WeakPolarHBondContact O-CD2 3.39Å; L728-E730 PolarHBondContact O-N 2.8Å; L728-M731 HydrophobicContact CB-CB 4.12Å; L728-M731 WeakPolarHBondContact O-CB 3.41Å; L728-M731 PolarHBondContact O-N 3.36Å
729	D	75.3	Confident	81.8	Confident	94 Å²	94	41.4 Å²	41.4	50%	0.503	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-33.2	-177.5	-70.1	-27.4	0	0	0	113.3	C673 M731 I825	C673-D729 WeakPolarHBondContact CB-OD1 3.28Å; C673-D729 PolarHBondContact SG-OD1 2.91Å; C673-D729 PolarHBondContact SG-OD2 2.88Å; D729-M731 VanDerWaalsContact C-N 3.32Å; D729-I825 VanDerWaalsContact O-CG2 3.32Å; D729-I825 WeakPolarHBondContact O-CG2 3.38Å
730	E	77.7	Confident	82.7	Confident	188 Å²	188	41.3 Å²	41.3	88%	0.879	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	1.7	177.5	-59.1	-171.8	157.8	0	0	113.3	L728 T732	L728-E730 PolarHBondContact O-N 2.8Å; E730-T732 PolarHBondContact O-N 3.18Å
731	M	82.3	Confident	83	Confident	8 Å²	8	46 Å²	46	4%	0.039	23%	0.225	C	C	.	.			trans	-65.6	126.7	-170.2	-164.3	172.4	-172.9	0	0	112.7	L727 L728 D729 D735 L736 R739 S823 P824	L727-M731 HydrophobicContact CB-SD 4.45Å; L727-M731 HydrophobicContact CD2-SD 3.74Å; L728-M731 HydrophobicContact CB-CB 4.12Å; L728-M731 WeakPolarHBondContact O-CB 3.41Å; L728-M731 PolarHBondContact O-N 3.36Å; D729-M731 VanDerWaalsContact C-N 3.32Å; M731-D735 HydrophobicContact CE-CB 3.89Å; M731-D735 HydrophobicContact CG-CB 3.82Å; M731-L736 HydrophobicContact CE-CB 3.97Å; M731-L736 HydrophobicContact CE-CD1 4.1Å; M731-R739 HydrophobicContact CE-CB 4.28Å; M731-R739 VanDerWaalsContact CE-CD 3.45Å; M731-S823 WeakPolarHBondContact O-CB 3.47Å; M731-P824 WeakPolarHBondContact O-CD 3.28Å
732	T	84.8	Confident	83	Confident	66 Å²	66	49.8 Å²	49.8	41%	0.405	24%	0.242	S	C	.	.			trans	-79.8	170.4	173	74.4	0	0	0	0	111.8	E730 E734 D735 L736	E730-T732 PolarHBondContact O-N 3.18Å; T732-E734 VanDerWaalsContact C-N 3.27Å; T732-E734 PolarHBondContact OG1-N 3.33Å; T732-D735 WeakPolarHBondContact CA-OD2 3.4Å; T732-D735 VanDerWaalsContact CB-OD2 3.25Å; T732-D735 WeakPolarHBondContact CB-OD2 3.3Å; T732-D735 WeakPolarHBondContact CG2-OD2 3.3Å; T732-D735 PolarHBondContact N-OD2 3.25Å; T732-D735 VanDerWaalsContact OG1-CG 3.22Å; T732-D735 PolarHBondContact OG1-N 2.91Å; T732-D735 VanDerWaalsContact OG1-N 3.11Å; T732-D735 PolarHBondContact OG1-OD2 3.39Å; T732-L736 PolarHBondContact O-N 2.98Å
733	W	82.9	Confident	83.1	Confident	38 Å²	38	49.9 Å²	49.9	14%	0.144	24%	0.243	C	C	.	.	H	α-helix	trans	-64.6	-31	168.6	-83.9	113.4	0	0	0	112.7	L736 D737 Y767 L769 I784 R786 Q822 P824	W733-L736 HydrophobicContact CE3-CD2 4.04Å; W733-L736 HydrophobicContact CZ3-CD2 3.86Å; W733-L736 PolarHBondContact O-N 3.15Å; W733-D737 VanDerWaalsContact O-CG 3.24Å; W733-D737 PolarHBondContact O-N 2.83Å; W733-Y767 HydrophobicContact CZ3-CE2 4.07Å; W733-L769 HydrophobicContact CH2-CD2 4.22Å; W733-I784 HydrophobicContact CH2-CD1 4.28Å; W733-I784 HydrophobicContact CH2-CG2 3.92Å; W733-I784 HydrophobicContact CZ2-CD1 3.95Å; W733-R786 PolarHBondContact O-NH1 3.16Å; W733-Q822 PolarHBondContact NE1-O 3.35Å; W733-P824 HydrophobicContact CD2-CG 3.77Å; W733-P824 HydrophobicContact CE3-CB 4.43Å; W733-P824 HydrophobicContact CE3-CG 3.77Å; W733-P824 HydrophobicContact CG-CG 4.27Å; W733-P824 HydrophobicContact CH2-CB 4.02Å; W733-P824 HydrophobicContact CH2-CG 4.21Å; W733-P824 HydrophobicContact CZ2-CB 4.17Å; W733-P824 HydrophobicContact CZ2-CG 4.21Å; W733-P824 HydrophobicContact CZ3-CB 4.16Å; W733-P824 HydrophobicContact CZ3-CG 4Å
734	E	83	Confident	83.2	Confident	146 Å²	146	50 Å²	50	68%	0.682	24%	0.243	S	C	*	.	H	α-helix	trans	-76.2	-38.8	-177.9	-59.6	-173.6	165.7	0	0	111.2	T732 L736 D737 E738	T732-E734 VanDerWaalsContact C-N 3.27Å; T732-E734 PolarHBondContact OG1-N 3.33Å; E734-L736 PolarHBondContact O-N 3.36Å; E734-D737 WeakPolarHBondContact O-CB 3.41Å; E734-D737 PolarHBondContact O-N 2.91Å; E734-D737 VanDerWaalsContact O-N 3.07Å; E734-E738 PolarHBondContact O-N 2.8Å; E734-E738 VanDerWaalsContact O-N 3.11Å
735	D	84.2	Confident	83.4	Confident	76 Å²	76	51.8 Å²	51.8	41%	0.406	25%	0.25	S	C	.	.	H	α-helix	trans	-57.1	-36.4	170.4	-60.2	-58.7	0	0	0	111.8	M731 T732 D737 R739	M731-D735 HydrophobicContact CE-CB 3.89Å; M731-D735 HydrophobicContact CG-CB 3.82Å; T732-D735 WeakPolarHBondContact CA-OD2 3.4Å; T732-D735 VanDerWaalsContact CB-OD2 3.25Å; T732-D735 WeakPolarHBondContact CB-OD2 3.3Å; T732-D735 WeakPolarHBondContact CG2-OD2 3.3Å; T732-D735 PolarHBondContact N-OD2 3.25Å; T732-D735 VanDerWaalsContact OG1-CG 3.22Å; T732-D735 PolarHBondContact OG1-N 2.91Å; T732-D735 VanDerWaalsContact OG1-N 3.11Å; T732-D735 PolarHBondContact OG1-OD2 3.39Å; D735-D737 VanDerWaalsContact C-N 3.33Å; D735-R739 WeakPolarHBondContact O-CB 3.49Å; D735-R739 PolarHBondContact O-N 2.97Å
736	L	85.7	Confident	83.5	Confident	1 Å²	1	55 Å²	55	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-69	-34.9	179.1	-176.6	58.7	0	0	0	111.2	T725 L727 M731 T732 W733 E734 L740 Y767 P824 I844	T725-L736 HydrophobicContact CG2-CD1 4.41Å; L727-L736 HydrophobicContact CD2-CD1 3.83Å; L727-L736 HydrophobicContact CD2-CD2 4.48Å; M731-L736 HydrophobicContact CE-CB 3.97Å; M731-L736 HydrophobicContact CE-CD1 4.1Å; T732-L736 PolarHBondContact O-N 2.98Å; W733-L736 HydrophobicContact CE3-CD2 4.04Å; W733-L736 HydrophobicContact CZ3-CD2 3.86Å; W733-L736 PolarHBondContact O-N 3.15Å; E734-L736 PolarHBondContact O-N 3.36Å; L736-L740 HydrophobicContact CD1-CD1 4.2Å; L736-L740 HydrophobicContact CD1-CG 4.16Å; L736-L740 HydrophobicContact CG-CD1 3.97Å; L736-L740 HydrophobicContact CG-CG 4.39Å; L736-L740 VanDerWaalsContact O-CB 3.32Å; L736-L740 WeakPolarHBondContact O-CB 3.46Å; L736-L740 WeakPolarHBondContact O-CD1 3.27Å; L736-L740 WeakPolarHBondContact O-CG 3.42Å; L736-L740 PolarHBondContact O-N 2.9Å; L736-Y767 HydrophobicContact CD2-CE2 4.01Å; L736-Y767 HydrophobicContact CG-CE2 4.5Å; L736-P824 HydrophobicContact CD2-CB 4.2Å; L736-P824 HydrophobicContact CD2-CG 3.94Å; L736-I844 HydrophobicContact CD1-CD1 4.3Å
737	D	86	Confident	83.8	Confident	18 Å²	18	55 Å²	55	10%	0.096	26%	0.263	C	S	.	.	H	α-helix	trans	-68.3	-47	177.4	-54.4	-31.7	0	0	0	111.3	W733 E734 D735 R739 L740 Q741 Y767 R786 F788	W733-D737 VanDerWaalsContact O-CG 3.24Å; W733-D737 PolarHBondContact O-N 2.83Å; E734-D737 WeakPolarHBondContact O-CB 3.41Å; E734-D737 PolarHBondContact O-N 2.91Å; E734-D737 VanDerWaalsContact O-N 3.07Å; D735-D737 VanDerWaalsContact C-N 3.33Å; D737-R739 VanDerWaalsContact C-N 3.31Å; D737-R739 PolarHBondContact O-N 3.03Å; D737-L740 PolarHBondContact O-N 3.37Å; D737-Q741 WeakPolarHBondContact O-CB 3.45Å; D737-Q741 PolarHBondContact O-N 3.1Å; D737-Y767 WeakPolarHBondContact OD1-CE1 3.33Å; D737-Y767 VanDerWaalsContact OD1-CZ 3.28Å; D737-Y767 PolarHBondContact OD1-OH 3.48Å; D737-R786 IonicContact OD1-CZ 3.08Å; D737-R786 IonicContact OD1-NH1 2.73Å; D737-R786 PolarHBondContact OD1-NH1 3.19Å; D737-R786 IonicContact OD2-CZ 2.64Å; D737-R786 IonicContact OD2-NH1 3.69Å; D737-R786 PolarHBondContact OD2-NH1 2.96Å; D737-R786 IonicContact OD2-NH2 2.68Å; D737-R786 PolarHBondContact OD2-NH2 2.9Å; D737-F788 HydrophobicContact CB-CE1 4.34Å; D737-F788 HydrophobicContact CB-CZ 4.06Å; D737-F788 VanDerWaalsContact CG-CZ 3.47Å; D737-F788 WeakPolarHBondContact OD1-CZ 3.34Å
738	E	84.1	Confident	84	Confident	101 Å²	101	55.1 Å²	55.1	47%	0.472	26%	0.263	S	S	.	.	H	α-helix	trans	-63.3	-40.3	179.9	-156.8	-137.6	-173.8	0	0	110.7	E734 Q741 K742	E734-E738 PolarHBondContact O-N 2.8Å; E734-E738 VanDerWaalsContact O-N 3.11Å; E738-Q741 PolarHBondContact O-N 3.11Å; E738-K742 WeakPolarHBondContact O-CB 3.32Å; E738-K742 VanDerWaalsContact O-CG 3.25Å; E738-K742 WeakPolarHBondContact O-CG 3.22Å; E738-K742 PolarHBondContact O-N 3.35Å; E738-K742 WeakPolarHBondContact OE1-CE 3.49Å; E738-K742 IonicContact OE1-NZ 3.3Å; E738-K742 PolarHBondContact OE1-NZ 2.63Å; E738-K742 WeakPolarHBondContact OE2-CE 3.48Å; E738-K742 IonicContact OE2-NZ 3Å; E738-K742 PolarHBondContact OE2-NZ 2.89Å
739	R	83.7	Confident	84.2	Confident	42 Å²	42	55.1 Å²	55.1	16%	0.158	26%	0.263	C	S	.	.	H	α-helix	trans	-66.8	-40.8	175.1	-160.8	175.2	-174.8	121.2	-16.4	112.2	H668 T725 G726 M731 D735 D737 L743	H668-R739 PolarHBondContact O-NH2 3.1Å; H668-R739 VanDerWaalsContact O-NH2 3.1Å; T725-R739 VanDerWaalsContact OG1-CD 3.25Å; T725-R739 WeakPolarHBondContact OG1-CD 3.48Å; T725-R739 PolarHBondContact OG1-NE 3.44Å; G726-R739 PolarHBondContact O-NE 2.79Å; G726-R739 PolarHBondContact O-NH2 3.06Å; M731-R739 HydrophobicContact CE-CB 4.28Å; M731-R739 VanDerWaalsContact CE-CD 3.45Å; D735-R739 WeakPolarHBondContact O-CB 3.49Å; D735-R739 PolarHBondContact O-N 2.97Å; D737-R739 VanDerWaalsContact C-N 3.31Å; D737-R739 PolarHBondContact O-N 3.03Å; R739-L743 WeakPolarHBondContact O-CB 3.38Å; R739-L743 PolarHBondContact O-N 3.47Å
740	L	87.2	Confident	84.6	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-67.6	-37.6	174.3	-71	170.2	0	0	0	112.1	V678 L736 D737 L743 I744 Y767 I844 I846	V678-L740 HydrophobicContact CG1-CD2 3.83Å; V678-L740 HydrophobicContact CG2-CD2 3.82Å; L736-L740 HydrophobicContact CD1-CD1 4.2Å; L736-L740 HydrophobicContact CD1-CG 4.16Å; L736-L740 HydrophobicContact CG-CD1 3.97Å; L736-L740 HydrophobicContact CG-CG 4.39Å; L736-L740 VanDerWaalsContact O-CB 3.32Å; L736-L740 WeakPolarHBondContact O-CB 3.46Å; L736-L740 WeakPolarHBondContact O-CD1 3.27Å; L736-L740 WeakPolarHBondContact O-CG 3.42Å; L736-L740 PolarHBondContact O-N 2.9Å; D737-L740 PolarHBondContact O-N 3.37Å; L740-L743 PolarHBondContact O-N 2.95Å; L740-I744 WeakPolarHBondContact O-CG1 3.44Å; L740-I744 PolarHBondContact O-N 3.14Å; L740-Y767 HydrophobicContact CD1-CD1 4.07Å; L740-Y767 HydrophobicContact CD1-CD2 4.02Å; L740-Y767 HydrophobicContact CD1-CE1 3.99Å; L740-Y767 HydrophobicContact CD1-CE2 3.94Å; L740-Y767 HydrophobicContact CD1-CG 4.06Å; L740-I844 HydrophobicContact CD1-CD1 4.48Å; L740-I844 HydrophobicContact CD1-CG2 4.22Å; L740-I844 HydrophobicContact CD2-CD1 4.17Å; L740-I844 HydrophobicContact CD2-CG2 4.16Å; L740-I846 HydrophobicContact CD2-CD1 4.18Å
741	Q	85.8	Confident	84.9	Confident	104 Å²	104	42.5 Å²	42.5	49%	0.486	20%	0.201	S	C	.	.	H	α-helix	trans	-69	-42.3	176.3	-171.5	171	2.3	0	0	111.7	D737 E738 L743 I744 Q745	D737-Q741 WeakPolarHBondContact O-CB 3.45Å; D737-Q741 PolarHBondContact O-N 3.1Å; E738-Q741 PolarHBondContact O-N 3.11Å; Q741-L743 VanDerWaalsContact C-N 3.33Å; Q741-L743 PolarHBondContact O-N 2.86Å; Q741-I744 PolarHBondContact O-N 3.14Å; Q741-Q745 PolarHBondContact O-N 3.49Å; Q741-Q745 VanDerWaalsContact O-N 3.08Å
742	K	84.3	Confident	85	Confident	84 Å²	84	42.6 Å²	42.6	37%	0.365	20%	0.202	S	C	.	.	H	α-helix	trans	-57.4	-44.7	170.1	-76	168.1	178.7	171.9	0	111.5	E738 I744 Q745 Y746	E738-K742 WeakPolarHBondContact O-CB 3.32Å; E738-K742 VanDerWaalsContact O-CG 3.25Å; E738-K742 WeakPolarHBondContact O-CG 3.22Å; E738-K742 PolarHBondContact O-N 3.35Å; E738-K742 WeakPolarHBondContact OE1-CE 3.49Å; E738-K742 IonicContact OE1-NZ 3.3Å; E738-K742 PolarHBondContact OE1-NZ 2.63Å; E738-K742 WeakPolarHBondContact OE2-CE 3.48Å; E738-K742 IonicContact OE2-NZ 3Å; E738-K742 PolarHBondContact OE2-NZ 2.89Å; K742-I744 PolarHBondContact O-N 2.79Å; K742-Q745 PolarHBondContact O-N 3.46Å; K742-Q745 VanDerWaalsContact O-N 3.16Å; K742-Y746 HydrophobicContact CB-CE2 4.03Å; K742-Y746 WeakPolarHBondContact O-CD2 3.46Å; K742-Y746 PolarHBondContact O-N 2.86Å
743	L	85.9	Confident	84.7	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-62.4	-40.2	177.8	-164.7	78.3	0	0	0	112.8	V678 I722 R739 L740 Q741 Y746 Y747	V678-L743 HydrophobicContact CB-CD2 3.72Å; V678-L743 HydrophobicContact CG1-CD2 3.9Å; V678-L743 HydrophobicContact CG2-CD2 3.73Å; I722-L743 HydrophobicContact CG2-CD2 3.92Å; I722-L743 HydrophobicContact CG2-CG 3.92Å; R739-L743 WeakPolarHBondContact O-CB 3.38Å; R739-L743 PolarHBondContact O-N 3.47Å; L740-L743 PolarHBondContact O-N 2.95Å; Q741-L743 VanDerWaalsContact C-N 3.33Å; Q741-L743 PolarHBondContact O-N 2.86Å; L743-Y746 PolarHBondContact O-N 3.15Å; L743-Y747 WeakPolarHBondContact O-CB 3.12Å; L743-Y747 PolarHBondContact O-N 2.93Å
744	I	86.5	Confident	84.6	Confident	3 Å²	3	46.6 Å²	46.6	2%	0.015	23%	0.228	C	C	.	.	H	α-helix	trans	-59.1	-47.1	172.2	-69.4	164.9	0	0	0	110.4	L740 Q741 K742 Y747 I748 L762 I846 L848	L740-I744 WeakPolarHBondContact O-CG1 3.44Å; L740-I744 PolarHBondContact O-N 3.14Å; Q741-I744 PolarHBondContact O-N 3.14Å; K742-I744 PolarHBondContact O-N 2.79Å; I744-Y747 PolarHBondContact O-N 2.99Å; I744-I748 HydrophobicContact CG2-CD1 3.76Å; I744-I748 WeakPolarHBondContact O-CG1 3.43Å; I744-I748 PolarHBondContact O-N 3.13Å; I744-L762 HydrophobicContact CG2-CD2 4.14Å; I744-I846 HydrophobicContact CD1-CD1 4.13Å; I744-I846 HydrophobicContact CD1-CG2 4.34Å; I744-I846 HydrophobicContact CG1-CD1 4.21Å; I744-L848 HydrophobicContact CD1-CD2 4.02Å
745	Q	85.5	Confident	84.6	Confident	52 Å²	52	42 Å²	42	24%	0.243	21%	0.208	C	C	.	.	H	α-helix	trans	-66.2	-41.5	-179.3	-170.1	62.7	44.1	0	0	112.4	Q741 K742 Y747 I748 N749	Q741-Q745 PolarHBondContact O-N 3.49Å; Q741-Q745 VanDerWaalsContact O-N 3.08Å; K742-Q745 PolarHBondContact O-N 3.46Å; K742-Q745 VanDerWaalsContact O-N 3.16Å; Q745-Y747 VanDerWaalsContact C-N 3.32Å; Q745-Y747 PolarHBondContact O-N 2.91Å; Q745-I748 PolarHBondContact O-N 3.45Å; Q745-N749 PolarHBondContact NE2-OD1 3.19Å; Q745-N749 WeakPolarHBondContact O-CB 3.49Å; Q745-N749 VanDerWaalsContact O-CG 3.22Å; Q745-N749 PolarHBondContact O-N 3.26Å; Q745-N749 PolarHBondContact O-OD1 2.84Å
746	Y	84.3	Confident	84.4	Confident	69 Å²	69	42.2 Å²	42.2	27%	0.271	21%	0.207	S	C	.	.	H	α-helix	trans	-59.6	-42.9	174.8	-66.5	-41.7	0	0	0	111.6	V659 K742 L743 N749 F750	V659-Y746 HydrophobicContact CG2-CD1 3.97Å; K742-Y746 HydrophobicContact CB-CE2 4.03Å; K742-Y746 WeakPolarHBondContact O-CD2 3.46Å; K742-Y746 PolarHBondContact O-N 2.86Å; L743-Y746 PolarHBondContact O-N 3.15Å; Y746-N749 PolarHBondContact O-N 2.78Å; Y746-F750 PolarHBondContact O-N 3.4Å
747	Y	86.7	Confident	84.3	Confident	1 Å²	1	42.3 Å²	42.3	0%	0.004	21%	0.207	C	C	.	.	H	α-helix	trans	-65.8	-38.8	177.7	175.7	-87.9	0	0	0	112.6	I722 L743 I744 Q745 F750 L751 F880 I1042	I722-Y747 HydrophobicContact CB-CD2 4.07Å; I722-Y747 HydrophobicContact CB-CE2 4.41Å; I722-Y747 HydrophobicContact CB-CG 4.32Å; I722-Y747 HydrophobicContact CD1-CD1 3.87Å; I722-Y747 HydrophobicContact CD1-CE1 4.07Å; I722-Y747 HydrophobicContact CD1-CG 4.11Å; I722-Y747 HydrophobicContact CG1-CD1 4.17Å; I722-Y747 HydrophobicContact CG1-CD2 3.98Å; I722-Y747 HydrophobicContact CG1-CE1 4.17Å; I722-Y747 HydrophobicContact CG1-CE2 3.98Å; I722-Y747 HydrophobicContact CG1-CG 4.08Å; I722-Y747 HydrophobicContact CG2-CD2 4.02Å; I722-Y747 HydrophobicContact CG2-CG 3.92Å; I722-Y747 WeakPolarHBondContact O-CD2 3.49Å; L743-Y747 WeakPolarHBondContact O-CB 3.12Å; L743-Y747 PolarHBondContact O-N 2.93Å; I744-Y747 PolarHBondContact O-N 2.99Å; Q745-Y747 VanDerWaalsContact C-N 3.32Å; Q745-Y747 PolarHBondContact O-N 2.91Å; Y747-F750 PolarHBondContact O-N 2.86Å; Y747-L751 HydrophobicContact CD1-CD1 3.87Å; Y747-L751 HydrophobicContact CD1-CG 4.37Å; Y747-L751 HydrophobicContact CE1-CD1 3.31Å; Y747-L751 HydrophobicContact CE1-CG 4.08Å; Y747-L751 WeakPolarHBondContact O-CG 3.19Å; Y747-L751 PolarHBondContact O-N 3.22Å; Y747-F880 AromaticContact CD1-CE2 3.93Å; Y747-F880 HydrophobicContact CD1-CE2 3.93Å; Y747-F880 HydrophobicContact CD1-CZ 4.23Å; Y747-F880 AromaticContact CE1-CE2 3.55Å; Y747-F880 HydrophobicContact CE1-CE2 3.55Å; Y747-F880 AromaticContact CE1-CZ 3.55Å; Y747-F880 HydrophobicContact CE1-CZ 3.55Å; Y747-I1042 HydrophobicContact CD2-CD1 3.96Å; Y747-I1042 HydrophobicContact CD2-CG2 4.08Å; Y747-I1042 HydrophobicContact CE2-CB 4.48Å; Y747-I1042 HydrophobicContact CE2-CD1 3.85Å; Y747-I1042 HydrophobicContact CE2-CG2 3.81Å
748	I	85.9	Confident	84.1	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.015	22%	0.223	C	C	.	.	H	α-helix	trans	-63.1	-47.5	172.7	-68.3	163	0	0	0	110.7	I744 Q745 F750 L751 D752 L759 L762	I744-I748 HydrophobicContact CG2-CD1 3.76Å; I744-I748 WeakPolarHBondContact O-CG1 3.43Å; I744-I748 PolarHBondContact O-N 3.13Å; Q745-I748 PolarHBondContact O-N 3.45Å; I748-F750 VanDerWaalsContact C-N 3.28Å; I748-F750 PolarHBondContact O-N 3.33Å; I748-L751 PolarHBondContact O-N 3.09Å; I748-L751 VanDerWaalsContact O-N 3.17Å; I748-D752 PolarHBondContact O-N 3.07Å; I748-L759 HydrophobicContact CD1-CB 4.07Å; I748-L759 HydrophobicContact CG2-CB 4.01Å; I748-L762 HydrophobicContact CD1-CB 4.17Å; I748-L762 HydrophobicContact CD1-CD2 3.9Å
749	N	85.4	Confident	84	Confident	62 Å²	62	41.1 Å²	41.1	33%	0.332	20%	0.201	S	C	.	.	H	α-helix	trans	-63.3	-31.4	179.4	-71	4.9	0	0	0	112.7	V659 Q745 Y746 P753	V659-N749 HydrophobicContact CB-CB 4.47Å; V659-N749 HydrophobicContact CG2-CB 3.69Å; Q745-N749 PolarHBondContact NE2-OD1 3.19Å; Q745-N749 WeakPolarHBondContact O-CB 3.49Å; Q745-N749 VanDerWaalsContact O-CG 3.22Å; Q745-N749 PolarHBondContact O-N 3.26Å; Q745-N749 PolarHBondContact O-OD1 2.84Å; Y746-N749 PolarHBondContact O-N 2.78Å; N749-P753 WeakPolarHBondContact O-CA 3.29Å; N749-P753 WeakPolarHBondContact O-CG 3.38Å
750	F	84.4	Confident	83.4	Confident	13 Å²	13	45.4 Å²	45.4	6%	0.057	22%	0.223	C	C	.	.	H	α-helix	trans	-73	-43.2	172.1	-171.3	-77	0	0	0	111.9	V659 L661 L664 Y746 Y747 I748 N1038 I1042 N1076	V659-F750 HydrophobicContact CB-CB 4.45Å; V659-F750 HydrophobicContact CG1-CB 4.33Å; V659-F750 VanDerWaalsContact O-CD2 3.28Å; V659-F750 WeakPolarHBondContact O-CD2 3.36Å; L661-F750 HydrophobicContact CD1-CZ 4.27Å; L661-F750 HydrophobicContact CD2-CD2 4.4Å; L661-F750 HydrophobicContact CD2-CE1 3.96Å; L661-F750 HydrophobicContact CD2-CE2 3.7Å; L661-F750 HydrophobicContact CD2-CZ 3.44Å; L661-F750 VanDerWaalsContact CD2-CZ 3.44Å; L661-F750 HydrophobicContact CG-CE2 3.63Å; L661-F750 HydrophobicContact CG-CZ 3.62Å; L664-F750 HydrophobicContact CD1-CB 4.12Å; L664-F750 HydrophobicContact CD1-CD2 4.36Å; L664-F750 HydrophobicContact CD1-CG 4.13Å; Y746-F750 PolarHBondContact O-N 3.4Å; Y747-F750 PolarHBondContact O-N 2.86Å; I748-F750 VanDerWaalsContact C-N 3.28Å; I748-F750 PolarHBondContact O-N 3.33Å; F750-N1038 HydrophobicContact CD1-CB 4.4Å; F750-N1038 HydrophobicContact CE1-CB 4.14Å; F750-I1042 HydrophobicContact CB-CD1 4.41Å; F750-I1042 HydrophobicContact CD1-CD1 3.35Å; F750-I1042 HydrophobicContact CD1-CG1 3.59Å; F750-I1042 HydrophobicContact CE1-CD1 3.94Å; F750-I1042 HydrophobicContact CE1-CG1 3.7Å; F750-I1042 HydrophobicContact CG-CD1 4.1Å; F750-I1042 HydrophobicContact CG-CG1 4.35Å; F750-N1076 WeakPolarHBondContact CZ-OD1 3.29Å
751	L	85.3	Confident	82.4	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.021	24%	0.243	C	C	.	.	H	α-helix	trans	-62.8	-47.5	180	-78.8	-177.7	0	0	0	112.3	Y747 I748 L883 R1035 N1038 R1039 I1042	Y747-L751 HydrophobicContact CD1-CD1 3.87Å; Y747-L751 HydrophobicContact CD1-CG 4.37Å; Y747-L751 HydrophobicContact CE1-CD1 3.31Å; Y747-L751 HydrophobicContact CE1-CG 4.08Å; Y747-L751 WeakPolarHBondContact O-CG 3.19Å; Y747-L751 PolarHBondContact O-N 3.22Å; I748-L751 PolarHBondContact O-N 3.09Å; I748-L751 VanDerWaalsContact O-N 3.17Å; L751-L883 HydrophobicContact CD1-CD2 4.16Å; L751-R1035 WeakPolarHBondContact O-CG 3.5Å; L751-N1038 HydrophobicContact CD2-CB 4.28Å; L751-N1038 PolarHBondContact O-ND2 3.36Å; L751-R1039 HydrophobicContact CD2-CB 3.63Å; L751-R1039 HydrophobicContact CD2-CG 4.29Å; L751-I1042 HydrophobicContact CD2-CD1 3.82Å; L751-I1042 HydrophobicContact CG-CD1 4.17Å
752	D	83.9	Confident	81.9	Confident	10 Å²	10	43.9 Å²	43.9	5%	0.053	22%	0.222	C	C	.	.			trans	-133.8	82.7	-177.9	-170.5	-17.8	0	0	0	110.6	I748 N754 N755 Q756 L757 R1035	I748-D752 PolarHBondContact O-N 3.07Å; D752-N754 PolarHBondContact O-N 3.06Å; D752-N754 PolarHBondContact OD1-N 2.95Å; D752-N754 VanDerWaalsContact OD1-N 3.17Å; D752-N755 PolarHBondContact O-N 2.91Å; D752-N755 PolarHBondContact OD1-N 2.75Å; D752-Q756 PolarHBondContact OD1-N 2.87Å; D752-Q756 WeakPolarHBondContact OD2-CA 3.49Å; D752-Q756 WeakPolarHBondContact OD2-CB 3.37Å; D752-Q756 PolarHBondContact OD2-N 3.21Å; D752-L757 HydrophobicContact CB-CD1 4.01Å; D752-L757 HydrophobicContact CB-CG 4.2Å; D752-L757 WeakPolarHBondContact OD2-CG 3.45Å; D752-L757 PolarHBondContact OD2-N 3.4Å; D752-R1035 HydrophobicContact CB-CG 4.3Å; D752-R1035 IonicContact OD2-CZ 3.23Å; D752-R1035 IonicContact OD2-NH1 3.74Å; D752-R1035 PolarHBondContact OD2-NH1 3.26Å
753	P	78.7	Confident	81.6	Confident	77 Å²	77	43.8 Å²	43.8	50%	0.5	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-15.6	177.2	-23.7	34.2	0	0	0	114.2	N749	N749-P753 WeakPolarHBondContact O-CA 3.29Å; N749-P753 WeakPolarHBondContact O-CG 3.38Å
754	N	79.8	Confident	81.5	Confident	111 Å²	111	44.4 Å²	44.4	59%	0.594	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.2	1	179.8	-62.3	-24.1	0	0	0	112.4	D752 Q756	D752-N754 PolarHBondContact O-N 3.06Å; D752-N754 PolarHBondContact OD1-N 2.95Å; D752-N754 VanDerWaalsContact OD1-N 3.17Å; N754-Q756 HydrophobicContact CB-CG 3.99Å; N754-Q756 PolarHBondContact O-N 3.18Å; N754-Q756 VanDerWaalsContact O-N 3.13Å; N754-Q756 PolarHBondContact O-NE2 2.93Å
755	N	83.4	Confident	81.1	Confident	49 Å²	49	45.6 Å²	45.6	26%	0.262	23%	0.232	S	C	.	.			trans	49.4	33.8	-177.9	-170.4	21.9	0	0	0	114.4	D752 L757 Q758 E760	D752-N755 PolarHBondContact O-N 2.91Å; D752-N755 PolarHBondContact OD1-N 2.75Å; N755-L757 VanDerWaalsContact C-N 3.28Å; N755-L757 PolarHBondContact O-N 3.26Å; N755-Q758 PolarHBondContact O-N 2.83Å; N755-Q758 WeakPolarHBondContact OD1-CA 3.39Å; N755-Q758 PolarHBondContact OD1-N 3.03Å; N755-E760 PolarHBondContact ND2-OE1 3.45Å; N755-E760 PolarHBondContact ND2-OE2 3.45Å
756	Q	80.6	Confident	81	Confident	81 Å²	81	43.3 Å²	43.3	38%	0.379	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-22.2	177.9	-59.8	-55	-62.7	0	0	112.3	D752 N754 Q758 P885	D752-Q756 PolarHBondContact OD1-N 2.87Å; D752-Q756 WeakPolarHBondContact OD2-CA 3.49Å; D752-Q756 WeakPolarHBondContact OD2-CB 3.37Å; D752-Q756 PolarHBondContact OD2-N 3.21Å; N754-Q756 HydrophobicContact CB-CG 3.99Å; N754-Q756 PolarHBondContact O-N 3.18Å; N754-Q756 VanDerWaalsContact O-N 3.13Å; N754-Q756 PolarHBondContact O-NE2 2.93Å; Q756-Q758 VanDerWaalsContact C-N 3.32Å; Q756-P885 WeakPolarHBondContact O-CB 3.48Å
757	L	83.5	Confident	81	Confident	3 Å²	3	40 Å²	40	2%	0.016	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-22.3	171.9	-69.7	175.2	0	0	0	114.2	D752 N755 L759 C879 L883 L886	D752-L757 HydrophobicContact CB-CD1 4.01Å; D752-L757 HydrophobicContact CB-CG 4.2Å; D752-L757 WeakPolarHBondContact OD2-CG 3.45Å; D752-L757 PolarHBondContact OD2-N 3.4Å; N755-L757 VanDerWaalsContact C-N 3.28Å; N755-L757 PolarHBondContact O-N 3.26Å; L757-L759 HydrophobicContact CB-CD1 3.9Å; L757-L759 HydrophobicContact CB-CG 3.98Å; L757-L759 HydrophobicContact CD1-CD1 4.08Å; L757-C879 PolarHBondContact O-SG 3.33Å; L757-C879 VanDerWaalsContact O-SG 3.41Å; L757-L883 HydrophobicContact CD1-CD2 4.42Å; L757-L886 WeakPolarHBondContact O-CB 3.38Å
758	Q	81.8	Confident	80.9	Confident	93 Å²	93	40.6 Å²	40.6	44%	0.435	21%	0.212	S	C	.	.			trans	57.5	48.2	-179.5	-55.6	-180	-41.3	0	0	113.7	N755 Q756 L886	N755-Q758 PolarHBondContact O-N 2.83Å; N755-Q758 WeakPolarHBondContact OD1-CA 3.39Å; N755-Q758 PolarHBondContact OD1-N 3.03Å; Q756-Q758 VanDerWaalsContact C-N 3.32Å; Q758-L886 HydrophobicContact CB-CB 4.33Å; Q758-L886 HydrophobicContact CB-CD2 4.47Å
759	L	81.4	Confident	80.8	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	21%	0.212	C	C	.	.			trans	-106	8.2	-171	-74.7	177.4	0	0	0	115.6	I748 L757 S761 L762 K876 C879 F880	I748-L759 HydrophobicContact CD1-CB 4.07Å; I748-L759 HydrophobicContact CG2-CB 4.01Å; L757-L759 HydrophobicContact CB-CD1 3.9Å; L757-L759 HydrophobicContact CB-CG 3.98Å; L757-L759 HydrophobicContact CD1-CD1 4.08Å; L759-S761 PolarHBondContact O-N 3Å; L759-L762 VanDerWaalsContact O-CB 3.23Å; L759-L762 WeakPolarHBondContact O-CB 3.47Å; L759-L762 PolarHBondContact O-N 3Å; L759-K876 HydrophobicContact CD2-CB 4.21Å; L759-K876 HydrophobicContact CD2-CG 4.37Å; L759-C879 HydrophobicContact CD2-CB 4.09Å; L759-F880 HydrophobicContact CD1-CB 4.3Å; L759-F880 HydrophobicContact CD1-CD2 4.48Å
760	E	70.3	Confident	80.8	Confident	132 Å²	132	37.8 Å²	37.8	62%	0.617	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-21	-178.9	-66.1	165.1	136.1	0	0	115	N755	N755-E760 PolarHBondContact ND2-OE1 3.45Å; N755-E760 PolarHBondContact ND2-OE2 3.45Å
761	S	67.4	Low	80.8	Confident	60 Å²	60	37.1 Å²	37.1	42%	0.42	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	34.8	175.3	53.8	0	0	0	0	112.8	L759 E763 K876	L759-S761 PolarHBondContact O-N 3Å; S761-E763 PolarHBondContact O-N 2.96Å; S761-K876 PolarHBondContact O-NZ 3.5Å; S761-K876 WeakPolarHBondContact OG-CE 3.36Å; S761-K876 PolarHBondContact OG-NZ 2.76Å
762	L	76.1	Confident	80.5	Confident	11 Å²	11	38.3 Å²	38.3	6%	0.058	20%	0.201	C	C	.	.			trans	-84.4	97.5	176	-174.2	69.7	0	0	0	110.8	I744 I748 L759 L848 K876 F880	I744-L762 HydrophobicContact CG2-CD2 4.14Å; I748-L762 HydrophobicContact CD1-CB 4.17Å; I748-L762 HydrophobicContact CD1-CD2 3.9Å; L759-L762 VanDerWaalsContact O-CB 3.23Å; L759-L762 WeakPolarHBondContact O-CB 3.47Å; L759-L762 PolarHBondContact O-N 3Å; L762-L848 HydrophobicContact CD1-CB 4.5Å; L762-L848 HydrophobicContact CD1-CD1 4.33Å; L762-L848 HydrophobicContact CD2-CD1 3.9Å; L762-L848 HydrophobicContact CD2-CD2 4.1Å; L762-L848 HydrophobicContact CG-CD1 4.39Å; L762-L848 HydrophobicContact CG-CD2 4.14Å; L762-K876 HydrophobicContact CD1-CB 4.04Å; L762-F880 HydrophobicContact CD2-CD2 3.8Å; L762-F880 HydrophobicContact CD2-CE2 4.39Å; L762-F880 HydrophobicContact CD2-CG 4.36Å
763	E	78	Confident	80.4	Confident	83 Å²	83	38.2 Å²	38.2	39%	0.388	20%	0.201	S	C	.	.			trans	-89	150.4	-174.2	-71.1	163.6	-130.9	0	0	114.2	S761 K849	S761-E763 PolarHBondContact O-N 2.96Å; E763-K849 HydrophobicContact CB-CD 3.86Å; E763-K849 HydrophobicContact CB-CG 4.25Å; E763-K849 PolarHBondContact O-N 2.94Å; E763-K849 VanDerWaalsContact O-N 3.12Å; E763-K849 WeakPolarHBondContact OE2-CE 3.41Å; E763-K849 IonicContact OE2-NZ 3.85Å; E763-K849 PolarHBondContact OE2-NZ 2.99Å
764	L	82.4	Confident	80.1	Confident	14 Å²	14	39.2 Å²	39.2	7%	0.073	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	132.9	173	-174.7	58.1	0	0	0	110.2	Y767 F788 I846	L764-Y767 HydrophobicContact CD1-CD1 4.31Å; L764-Y767 HydrophobicContact CD2-CD1 3.9Å; L764-Y767 HydrophobicContact CD2-CE1 4.1Å; L764-Y767 HydrophobicContact CG-CD1 4.39Å; L764-F788 HydrophobicContact CB-CE2 4.39Å; L764-F788 HydrophobicContact CD2-CD2 4.42Å; L764-F788 HydrophobicContact CD2-CE2 3.47Å; L764-F788 VanDerWaalsContact CD2-CE2 3.47Å; L764-F788 HydrophobicContact CD2-CZ 3.77Å; L764-F788 HydrophobicContact CG-CD2 4.08Å; L764-F788 HydrophobicContact CG-CE2 3.55Å; L764-F788 HydrophobicContact CG-CZ 4.31Å; L764-I846 HydrophobicContact CD1-CB 4.48Å; L764-I846 HydrophobicContact CD1-CG1 4.43Å; L764-I846 HydrophobicContact CD1-CG2 3.59Å
765	Q	79.2	Confident	79.4	Confident	28 Å²	28	37.3 Å²	37.3	13%	0.131	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	-43.9	175.8	-172.7	-177.6	-14.8	0	0	111.9	F788 H847 L848 K849 C851 M853	Q765-F788 WeakPolarHBondContact O-CD2 3.31Å; Q765-F788 PolarHBondContact O-N 3.27Å; Q765-H847 WeakPolarHBondContact CB-O 3.26Å; Q765-H847 PolarHBondContact N-O 2.89Å; Q765-L848 PolarHBondContact OE1-O 3.41Å; Q765-K849 HydrophobicContact CB-CB 4.44Å; Q765-K849 HydrophobicContact CB-CG 3.77Å; Q765-K849 HydrophobicContact CG-CG 4.3Å; Q765-C851 PolarHBondContact OE1-O 3.49Å; Q765-M853 HydrophobicContact CG-CE 4.45Å
766	A	82.1	Confident	78.5	Confident	4 Å²	4	43.1 Å²	43.1	3%	0.033	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	162.4	176.8	0	0	0	0	0	109.4	R786 H847 M853	A766-R786 CarbonylContact C-O 3.54Å; A766-R786 WeakPolarHBondContact CA-O 3.34Å; A766-R786 WeakPolarHBondContact CB-O 3.25Å; A766-H847 HydrophobicContact CB-CB 4.47Å; A766-H847 PolarHBondContact N-O 2.96Å; A766-H847 WeakPolarHBondContact O-CA 3.48Å; A766-H847 PolarHBondContact O-N 3.26Å; A766-H847 VanDerWaalsContact O-O 3.09Å; A766-M853 HydrophobicContact CB-SD 4.2Å
767	Y	85	Confident	77.6	Confident	1 Å²	1	45.4 Å²	45.4	0%	0.004	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	161.2	162.6	60.5	-84.6	0	0	0	111.4	W733 L736 D737 L740 L764 V785 R786 F788 I844 Q845	W733-Y767 HydrophobicContact CZ3-CE2 4.07Å; L736-Y767 HydrophobicContact CD2-CE2 4.01Å; L736-Y767 HydrophobicContact CG-CE2 4.5Å; D737-Y767 WeakPolarHBondContact OD1-CE1 3.33Å; D737-Y767 VanDerWaalsContact OD1-CZ 3.28Å; D737-Y767 PolarHBondContact OD1-OH 3.48Å; L740-Y767 HydrophobicContact CD1-CD1 4.07Å; L740-Y767 HydrophobicContact CD1-CD2 4.02Å; L740-Y767 HydrophobicContact CD1-CE1 3.99Å; L740-Y767 HydrophobicContact CD1-CE2 3.94Å; L740-Y767 HydrophobicContact CD1-CG 4.06Å; L764-Y767 HydrophobicContact CD1-CD1 4.31Å; L764-Y767 HydrophobicContact CD2-CD1 3.9Å; L764-Y767 HydrophobicContact CD2-CE1 4.1Å; L764-Y767 HydrophobicContact CG-CD1 4.39Å; Y767-V785 WeakPolarHBondContact O-CA 3.44Å; Y767-R786 HydrophobicContact CE1-CB 4.4Å; Y767-R786 PolarHBondContact N-O 2.85Å; Y767-R786 PolarHBondContact O-N 3.21Å; Y767-R786 PolarHBondContact OH-NH1 3.38Å; Y767-F788 HydrophobicContact CD1-CE2 4.04Å; Y767-F788 AromaticContact CE1-CE2 3.9Å; Y767-F788 HydrophobicContact CE1-CE2 3.9Å; Y767-F788 AromaticContact CE1-CZ 3.93Å; Y767-F788 HydrophobicContact CE1-CZ 3.93Å; Y767-I844 HydrophobicContact CD2-CG2 4Å; Y767-I844 HydrophobicContact CG-CG2 4.3Å; Y767-Q845 CarbonylContact C-O 3.59Å; Y767-Q845 VanDerWaalsContact CA-O 3.24Å; Y767-Q845 WeakPolarHBondContact CA-O 3.38Å
768	Q	83.6	Confident	76.7	Confident	13 Å²	13	51.4 Å²	51.4	6%	0.061	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	109.6	-179.9	179.9	-171.2	15.3	0	0	108.4	N770 S783 I784 V785 I844 Q845 F855	Q768-N770 WeakPolarHBondContact CG-OD1 3.27Å; Q768-N770 PolarHBondContact NE2-OD1 3.2Å; Q768-N770 PolarHBondContact O-ND2 2.82Å; Q768-N770 VanDerWaalsContact O-ND2 3.11Å; Q768-S783 VanDerWaalsContact NE2-CB 3.3Å; Q768-S783 PolarHBondContact NE2-OG 2.81Å; Q768-I784 CarbonylContact C-O 3.5Å; Q768-I784 WeakPolarHBondContact CA-O 3.45Å; Q768-V785 HydrophobicContact CB-CG2 4.1Å; Q768-V785 HydrophobicContact CG-CG2 3.86Å; Q768-I844 CarbonylContact O-C 3.59Å; Q768-I844 WeakPolarHBondContact O-CA 3.44Å; Q768-Q845 HydrophobicContact CB-CB 4.43Å; Q768-Q845 PolarHBondContact N-O 3.17Å; Q768-Q845 PolarHBondContact O-N 2.7Å; Q768-F855 VanDerWaalsContact OE1-CE2 3.24Å
769	L	85.3	Confident	76.1	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	122.8	169.1	170.7	66	0	0	0	108.1	V676 W733 S783 I784 W827 I828 I844	V676-L769 HydrophobicContact CG1-CD1 4.02Å; W733-L769 HydrophobicContact CH2-CD2 4.22Å; L769-S783 CarbonylContact O-C 3.49Å; L769-S783 VanDerWaalsContact O-CA 3.25Å; L769-S783 WeakPolarHBondContact O-CA 3.25Å; L769-I784 HydrophobicContact CB-CG2 3.78Å; L769-I784 HydrophobicContact CD2-CG2 4.04Å; L769-I784 HydrophobicContact CG-CG2 4.24Å; L769-I784 PolarHBondContact N-O 3.44Å; L769-I784 PolarHBondContact O-N 3.14Å; L769-W827 HydrophobicContact CD2-CE3 3.75Å; L769-W827 HydrophobicContact CD2-CZ3 3.84Å; L769-W827 HydrophobicContact CG-CE3 4.31Å; L769-W827 HydrophobicContact CG-CZ3 3.88Å; L769-I828 HydrophobicContact CD2-CD1 4.23Å; L769-I828 HydrophobicContact CD2-CG1 4.21Å; L769-I844 HydrophobicContact CB-CG1 4.2Å; L769-I844 HydrophobicContact CD1-CD1 4.28Å; L769-I844 HydrophobicContact CD1-CG1 3.69Å
770	N	84.3	Confident	75.7	Confident	4 Å²	4	55.6 Å²	55.6	2%	0.021	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	127.4	-177.8	-58.4	-76.8	0	0	0	111.1	Q768 T781 Q782 S783 L842 S843	Q768-N770 WeakPolarHBondContact CG-OD1 3.27Å; Q768-N770 PolarHBondContact NE2-OD1 3.2Å; Q768-N770 PolarHBondContact O-ND2 2.82Å; Q768-N770 VanDerWaalsContact O-ND2 3.11Å; N770-T781 HydrophobicContact CB-CG2 4.31Å; N770-Q782 CarbonylContact C-O 3.59Å; N770-Q782 WeakPolarHBondContact CA-O 3.41Å; N770-S783 WeakPolarHBondContact OD1-CB 3.45Å; N770-S783 PolarHBondContact OD1-OG 3.39Å; N770-L842 WeakPolarHBondContact O-CA 3.47Å; N770-S843 WeakPolarHBondContact CB-O 3.43Å; N770-S843 PolarHBondContact N-O 3.38Å; N770-S843 PolarHBondContact ND2-O 3.07Å; N770-S843 PolarHBondContact O-N 2.89Å; N770-S843 VanDerWaalsContact O-N 3.07Å
771	F	83.9	Confident	75.9	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	110	165.5	-171.9	-88.5	0	0	0	108.2	L773 T781 Q782 W827 I828 M831 I832 A837 Y840 L842	F771-L773 HydrophobicContact CD1-CD2 4.1Å; F771-L773 HydrophobicContact CE1-CB 4.18Å; F771-L773 HydrophobicContact CE1-CD2 3.73Å; F771-T781 WeakPolarHBondContact O-CA 3.38Å; F771-Q782 HydrophobicContact CB-CB 4.46Å; F771-Q782 PolarHBondContact N-O 2.95Å; F771-Q782 PolarHBondContact O-N 3.24Å; F771-W827 HydrophobicContact CB-CH2 3.92Å; F771-W827 HydrophobicContact CB-CZ3 4.08Å; F771-I828 HydrophobicContact CD2-CG2 4.01Å; F771-I828 HydrophobicContact CE2-CG2 4.05Å; F771-M831 HydrophobicContact CB-CB 4.43Å; F771-M831 HydrophobicContact CB-CG 4.25Å; F771-M831 HydrophobicContact CD1-CB 3.89Å; F771-M831 HydrophobicContact CD1-CG 4.43Å; F771-M831 HydrophobicContact CD2-CB 3.79Å; F771-M831 HydrophobicContact CD2-CG 4.43Å; F771-M831 HydrophobicContact CE1-CB 4.01Å; F771-M831 HydrophobicContact CE2-CB 3.93Å; F771-M831 HydrophobicContact CG-CB 3.77Å; F771-M831 HydrophobicContact CG-CG 4.13Å; F771-M831 HydrophobicContact CZ-CB 4.03Å; F771-I832 HydrophobicContact CE2-CG1 3.76Å; F771-I832 HydrophobicContact CZ-CG1 4Å; F771-A837 HydrophobicContact CE1-CB 4.32Å; F771-A837 HydrophobicContact CZ-CB 4.13Å; F771-Y840 HydrophobicContact CD2-CD2 4.07Å; F771-Y840 HydrophobicContact CD2-CG 4.47Å; F771-Y840 HydrophobicContact CE2-CD1 4.22Å; F771-Y840 AromaticContact CE2-CD2 3.44Å; F771-Y840 HydrophobicContact CE2-CD2 3.44Å; F771-Y840 VanDerWaalsContact CE2-CD2 3.44Å; F771-Y840 HydrophobicContact CE2-CE2 4.01Å; F771-Y840 AromaticContact CE2-CG 3.57Å; F771-Y840 HydrophobicContact CE2-CG 3.57Å; F771-Y840 HydrophobicContact CZ-CD1 4.1Å; F771-Y840 HydrophobicContact CZ-CD2 4.01Å; F771-Y840 AromaticContact CZ-CG 3.62Å; F771-Y840 HydrophobicContact CZ-CG 3.62Å; F771-L842 HydrophobicContact CD2-CD2 3.6Å; F771-L842 HydrophobicContact CE2-CD2 4.27Å; F771-L842 HydrophobicContact CG-CD2 4.44Å
772	T	80.4	Confident	76.5	Confident	29 Å²	29	51.4 Å²	51.4	18%	0.178	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	134.3	177.9	60.8	0	0	0	0	110.1	T781 Y840 T841	T772-T781 HydrophobicContact CG2-CG2 3.96Å; T772-Y840 CarbonylContact O-C 3.57Å; T772-Y840 WeakPolarHBondContact O-CA 3.49Å; T772-Y840 WeakPolarHBondContact O-CB 3.48Å; T772-T841 PolarHBondContact N-O 2.81Å; T772-T841 PolarHBondContact O-N 3.05Å; T772-T841 PolarHBondContact OG1-O 3.06Å; T772-T841 PolarHBondContact OG1-OG1 3.27Å
773	L	81.3	Confident	76.6	Confident	8 Å²	8	51.9 Å²	51.9	4%	0.042	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	150.7	178	71.7	94	0	0	0	110.5	F771 E775 K780 Y835 A837	F771-L773 HydrophobicContact CD1-CD2 4.1Å; F771-L773 HydrophobicContact CE1-CB 4.18Å; F771-L773 HydrophobicContact CE1-CD2 3.73Å; L773-E775 HydrophobicContact CD1-CB 3.74Å; L773-K780 HydrophobicContact CD1-CB 3.98Å; L773-K780 HydrophobicContact CD1-CD 4.29Å; L773-K780 HydrophobicContact CD2-CB 4.47Å; L773-K780 HydrophobicContact CG-CB 3.98Å; L773-K780 PolarHBondContact N-O 3.45Å; L773-K780 PolarHBondContact O-N 3.21Å; L773-Y835 HydrophobicContact CD2-CD1 3.9Å; L773-Y835 HydrophobicContact CD2-CD2 3.69Å; L773-Y835 HydrophobicContact CD2-CE1 4.41Å; L773-Y835 HydrophobicContact CD2-CE2 4.25Å; L773-Y835 HydrophobicContact CD2-CG 3.51Å; L773-A837 HydrophobicContact CB-CB 4.48Å
774	T	71.9	Confident	76.8	Confident	98 Å²	98	48.2 Å²	48.2	60%	0.601	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.6	118.5	177.2	49.7	0	0	0	0	109.7	E778 I779	T774-E778 WeakPolarHBondContact CA-O 3.38Å; T774-I779 HydrophobicContact CG2-CG1 4.23Å
775	E	65.1	Low	76.6	Confident	70 Å²	70	49 Å²	49	33%	0.327	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	126.4	-175.8	-168.8	-169.4	172	0	0	109.2	L773 S777 E778 K780	L773-E775 HydrophobicContact CD1-CB 3.74Å; E775-S777 PolarHBondContact O-N 2.86Å; E775-S777 VanDerWaalsContact O-N 3.11Å; E775-E778 PolarHBondContact N-O 3.22Å; E775-E778 PolarHBondContact O-N 3.06Å; E775-K780 IonicContact OE1-NZ 3.92Å; E775-K780 WeakPolarHBondContact OE2-CE 3.31Å; E775-K780 IonicContact OE2-NZ 2.68Å; E775-K780 PolarHBondContact OE2-NZ 3Å
776	Q	64.3	Low	76.7	Confident	171 Å²	171	48.2 Å²	48.2	80%	0.799	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	37.6	179.5	-60	-179.9	28.6	0	0	114.1	E778	Q776-E778 PolarHBondContact O-N 2.91Å
777	S	61.4	Low	76.4	Confident	130 Å²	130	49.3 Å²	49.3	91%	0.909	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.9	3.7	-174	71.5	0	0	0	0	117.1	E775	E775-S777 PolarHBondContact O-N 2.86Å; E775-S777 VanDerWaalsContact O-N 3.11Å
778	E	65	Low	76	Confident	128 Å²	128	51 Å²	51	60%	0.598	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.5	145.2	166.2	-62.1	-167	148.6	0	0	111.5	T774 E775 Q776	T774-E778 WeakPolarHBondContact CA-O 3.38Å; E775-E778 PolarHBondContact N-O 3.22Å; E775-E778 PolarHBondContact O-N 3.06Å; Q776-E778 PolarHBondContact O-N 2.91Å
779	I	68.7	Low	74.7	Confident	111 Å²	111	52.7 Å²	52.7	57%	0.569	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.9	107.3	171	-57.4	171.9	0	0	0	107.9	T774	T774-I779 HydrophobicContact CG2-CG1 4.23Å
780	K	74.7	Confident	73	Confident	71 Å²	71	57 Å²	57	31%	0.309	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	130	175.2	-63	177	-172.8	173.5	0	108.7	L773 E775	L773-K780 HydrophobicContact CD1-CB 3.98Å; L773-K780 HydrophobicContact CD1-CD 4.29Å; L773-K780 HydrophobicContact CD2-CB 4.47Å; L773-K780 HydrophobicContact CG-CB 3.98Å; L773-K780 PolarHBondContact N-O 3.45Å; L773-K780 PolarHBondContact O-N 3.21Å; E775-K780 IonicContact OE1-NZ 3.92Å; E775-K780 WeakPolarHBondContact OE2-CE 3.31Å; E775-K780 IonicContact OE2-NZ 2.68Å; E775-K780 PolarHBondContact OE2-NZ 3Å
781	T	74.5	Confident	70.6	Confident	67 Å²	67	60.2 Å²	60.2	41%	0.411	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	124.2	178.1	-55.9	0	0	0	0	109.3	N770 F771 T772	N770-T781 HydrophobicContact CB-CG2 4.31Å; F771-T781 WeakPolarHBondContact O-CA 3.38Å; T772-T781 HydrophobicContact CG2-CG2 3.96Å
782	Q	79.4	Confident	68.1	Low	38 Å²	38	66.4 Å²	66.4	18%	0.178	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	148.7	163.3	-64.5	-62	-18.5	0	0	108.9	N770 F771 W827 M831 Y835	N770-Q782 CarbonylContact C-O 3.59Å; N770-Q782 WeakPolarHBondContact CA-O 3.41Å; F771-Q782 HydrophobicContact CB-CB 4.46Å; F771-Q782 PolarHBondContact N-O 2.95Å; F771-Q782 PolarHBondContact O-N 3.24Å; Q782-W827 HydrophobicContact CB-CZ2 4.45Å; Q782-M831 HydrophobicContact CB-SD 3.96Å; Q782-M831 HydrophobicContact CG-SD 4.01Å; Q782-Y835 HydrophobicContact CG-CE2 3.98Å; Q782-Y835 PolarHBondContact NE2-OH 3.37Å
783	S	78.7	Confident	65.8	Low	20 Å²	20	71.4 Å²	71.4	14%	0.14	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	137.3	-174.8	-53.5	0	0	0	0	110.9	Q768 L769 N770 P811	Q768-S783 VanDerWaalsContact NE2-CB 3.3Å; Q768-S783 PolarHBondContact NE2-OG 2.81Å; L769-S783 CarbonylContact O-C 3.49Å; L769-S783 VanDerWaalsContact O-CA 3.25Å; L769-S783 WeakPolarHBondContact O-CA 3.25Å; N770-S783 WeakPolarHBondContact OD1-CB 3.45Å; N770-S783 PolarHBondContact OD1-OG 3.39Å; S783-P811 WeakPolarHBondContact O-CD 3.15Å; S783-P811 WeakPolarHBondContact O-CG 3.27Å
784	I	80.8	Confident	63.2	Low	6 Å²	6	77 Å²	77	3%	0.031	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	126.7	165.4	-174	165.4	0	0	0	108.7	W733 Q768 L769 V808 L810 W827	W733-I784 HydrophobicContact CH2-CD1 4.28Å; W733-I784 HydrophobicContact CH2-CG2 3.92Å; W733-I784 HydrophobicContact CZ2-CD1 3.95Å; Q768-I784 CarbonylContact C-O 3.5Å; Q768-I784 WeakPolarHBondContact CA-O 3.45Å; L769-I784 HydrophobicContact CB-CG2 3.78Å; L769-I784 HydrophobicContact CD2-CG2 4.04Å; L769-I784 HydrophobicContact CG-CG2 4.24Å; L769-I784 PolarHBondContact N-O 3.44Å; L769-I784 PolarHBondContact O-N 3.14Å; I784-V808 HydrophobicContact CD1-CG1 3.76Å; I784-V808 HydrophobicContact CG1-CG1 3.89Å; I784-L810 HydrophobicContact CD1-CD2 3.7Å; I784-L810 HydrophobicContact CG1-CD2 3.99Å; I784-W827 HydrophobicContact CB-CD2 4.25Å; I784-W827 HydrophobicContact CB-CH2 4.41Å; I784-W827 HydrophobicContact CB-CZ2 3.9Å; I784-W827 HydrophobicContact CD1-CG 4.26Å; I784-W827 HydrophobicContact CG2-CD2 3.8Å; I784-W827 HydrophobicContact CG2-CE3 3.87Å; I784-W827 HydrophobicContact CG2-CG 4.45Å; I784-W827 HydrophobicContact CG2-CH2 4.03Å; I784-W827 HydrophobicContact CG2-CZ2 3.95Å; I784-W827 HydrophobicContact CG2-CZ3 4Å
785	V	79.7	Confident	61.3	Low	32 Å²	32	75.8 Å²	75.8	19%	0.194	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	129.3	-179.3	175.9	0	0	0	0	108.7	Y767 Q768 L809	Y767-V785 WeakPolarHBondContact O-CA 3.44Å; Q768-V785 HydrophobicContact CB-CG2 4.1Å; Q768-V785 HydrophobicContact CG-CG2 3.86Å; V785-L809 HydrophobicContact CB-CB 4.21Å; V785-L809 PolarHBondContact N-O 2.98Å; V785-L809 VanDerWaalsContact N-O 3.16Å; V785-L809 PolarHBondContact O-N 2.69Å
786	R	81.1	Confident	59.5	Low	11 Å²	11	78.5 Å²	78.5	4%	0.042	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	127.2	172.7	-173.4	152.2	168.6	-111	-6	109.7	W733 D737 A766 Y767 C806 T807	W733-R786 PolarHBondContact O-NH1 3.16Å; D737-R786 IonicContact OD1-CZ 3.08Å; D737-R786 IonicContact OD1-NH1 2.73Å; D737-R786 PolarHBondContact OD1-NH1 3.19Å; D737-R786 IonicContact OD2-CZ 2.64Å; D737-R786 IonicContact OD2-NH1 3.69Å; D737-R786 PolarHBondContact OD2-NH1 2.96Å; D737-R786 IonicContact OD2-NH2 2.68Å; D737-R786 PolarHBondContact OD2-NH2 2.9Å; A766-R786 CarbonylContact C-O 3.54Å; A766-R786 WeakPolarHBondContact CA-O 3.34Å; A766-R786 WeakPolarHBondContact CB-O 3.25Å; Y767-R786 HydrophobicContact CE1-CB 4.4Å; Y767-R786 PolarHBondContact N-O 2.85Å; Y767-R786 PolarHBondContact O-N 3.21Å; Y767-R786 PolarHBondContact OH-NH1 3.38Å; R786-C806 PolarHBondContact NH2-SG 2.78Å; R786-C806 VanDerWaalsContact NH2-SG 3.37Å; R786-T807 WeakPolarHBondContact CA-O 3.37Å
787	S	76	Confident	58	Low	26 Å²	26	76 Å²	76	18%	0.182	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	137.8	-178	55.3	0	0	0	0	111.6	T807	S787-T807 PolarHBondContact N-O 3.03Å; S787-T807 PolarHBondContact O-N 3.47Å; S787-T807 PolarHBondContact OG-O 2.78Å
788	F	74.9	Confident	56.4	Low	38 Å²	38	73.6 Å²	73.6	17%	0.167	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	119.2	176.9	-57.5	-91	0	0	0	109.1	D737 L764 Q765 Y767 I804	D737-F788 HydrophobicContact CB-CE1 4.34Å; D737-F788 HydrophobicContact CB-CZ 4.06Å; D737-F788 VanDerWaalsContact CG-CZ 3.47Å; D737-F788 WeakPolarHBondContact OD1-CZ 3.34Å; L764-F788 HydrophobicContact CB-CE2 4.39Å; L764-F788 HydrophobicContact CD2-CD2 4.42Å; L764-F788 HydrophobicContact CD2-CE2 3.47Å; L764-F788 VanDerWaalsContact CD2-CE2 3.47Å; L764-F788 HydrophobicContact CD2-CZ 3.77Å; L764-F788 HydrophobicContact CG-CD2 4.08Å; L764-F788 HydrophobicContact CG-CE2 3.55Å; L764-F788 HydrophobicContact CG-CZ 4.31Å; Q765-F788 WeakPolarHBondContact O-CD2 3.31Å; Q765-F788 PolarHBondContact O-N 3.27Å; Y767-F788 HydrophobicContact CD1-CE2 4.04Å; Y767-F788 AromaticContact CE1-CE2 3.9Å; Y767-F788 HydrophobicContact CE1-CE2 3.9Å; Y767-F788 AromaticContact CE1-CZ 3.93Å; Y767-F788 HydrophobicContact CE1-CZ 3.93Å; F788-I804 HydrophobicContact CB-CG2 4.24Å; F788-I804 HydrophobicContact CD1-CG2 4.08Å
789	T	58.3	Low	54.7	Low	48 Å²	48	76.5 Å²	76.5	29%	0.294	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	122.3	174.2	63.5	0	0	0	0	110.3	T791 S805	T789-T791 PolarHBondContact O-N 2.98Å; T789-S805 PolarHBondContact N-O 2.85Å; T789-S805 VanDerWaalsContact OG1-CB 3.3Å; T789-S805 WeakPolarHBondContact OG1-CB 3.42Å; T789-S805 PolarHBondContact OG1-O 3.28Å
790	T	48.1	Very low	52.8	Low	90 Å²	90	77 Å²	77	55%	0.552	47%	0.474	S	S	*	.			trans	-78.8	110	169.8	47.1	0	0	0	0	108.7	T792	T790-T792 PolarHBondContact O-N 2.72Å
791	T	35.1	Very low	50.7	Low	72 Å²	72	82.7 Å²	82.7	44%	0.442	50%	0.501	S	S	.	.			trans	-72.8	80.3	-171.6	-48.6	0	0	0	0	112.4	T789 L793 S805	T789-T791 PolarHBondContact O-N 2.98Å; T791-L793 HydrophobicContact CG2-CB 4.27Å; T791-L793 HydrophobicContact CG2-CD1 3.66Å; T791-L793 HydrophobicContact CG2-CG 3.73Å; T791-L793 PolarHBondContact O-N 3.48Å; T791-S805 PolarHBondContact OG1-OG 3.39Å
792	T	30	Very low	48.6	Very low	131 Å²	131	85.4 Å²	85.4	80%	0.804	52%	0.523	S	S	*	.			trans	-75.4	68	170.5	58.1	0	0	0	0	110.8	T790 S794	T790-T792 PolarHBondContact O-N 2.72Å; T792-S794 PolarHBondContact O-N 3.11Å; T792-S794 VanDerWaalsContact O-N 3.09Å
793	L	32.1	Very low	46.5	Very low	133 Å²	133	92 Å²	92	70%	0.696	55%	0.554	S	S	*	*			trans	-73.8	95	176.6	-97.6	168.9	0	0	0	110.6	T791 S795	T791-L793 HydrophobicContact CG2-CB 4.27Å; T791-L793 HydrophobicContact CG2-CD1 3.66Å; T791-L793 HydrophobicContact CG2-CG 3.73Å; T791-L793 PolarHBondContact O-N 3.48Å; L793-S795 PolarHBondContact O-N 2.82Å
794	S	28.1	Very low	44.8	Very low	125 Å²	125	96.9 Å²	96.9	87%	0.874	58%	0.577	S	S	*	*			trans	-77.2	58.1	175	63.3	0	0	0	0	112.4	T792	T792-S794 PolarHBondContact O-N 3.11Å; T792-S794 VanDerWaalsContact O-N 3.09Å
795	S	31.2	Very low	42.7	Very low	74 Å²	74	99.1 Å²	99.1	52%	0.517	59%	0.593	S	S	.	*	S	Bend	trans	-163.5	103.4	172.9	57.3	0	0	0	0	114	L793 S797	L793-S795 PolarHBondContact O-N 2.82Å; S795-S797 PolarHBondContact O-N 3.49Å
796	S	28.5	Very low	41.4	Very low	126 Å²	126	100.1 Å²	100.1	88%	0.881	60%	0.601	S	S	*	*			trans	10.2	93.1	148.5	58.9	0	0	0	0	119.6
797	S	31.8	Very low	40.2	Very low	120 Å²	120	102.4 Å²	102.4	84%	0.839	62%	0.616	S	S	*	*			trans	-162	153.2	140.4	47.1	0	0	0	0	109.1	S795	S795-S797 PolarHBondContact O-N 3.49Å
798	A	28.6	Very low	39.1	Very low	79 Å²	79	103.2 Å²	103.2	65%	0.653	62%	0.62	S	S	*	*			trans	-88.3	168.6	-174.8	0	0	0	0	0	112.8
799	E	29.2	Very low	38	Very low	188 Å²	188	104.4 Å²	104.4	88%	0.879	63%	0.628	S	S	*	*			trans	57.7	77.4	156.6	-70.2	161.3	-148.8	0	0	117
800	S	28.7	Very low	37.4	Very low	123 Å²	123	104.4 Å²	104.4	86%	0.86	63%	0.626	S	S	*	*			trans	-150.7	142.8	155	-70.3	0	0	0	0	109.8
801	Q	30.5	Very low	37	Very low	189 Å²	189	101.8 Å²	101.8	88%	0.883	61%	0.61	S	S	*	*			trans	-76.5	159.6	-175.8	-68.3	174.2	-5.7	0	0	112.2	Q803	Q801-Q803 PolarHBondContact O-N 3.1Å
802	S	29.1	Very low	37.6	Very low	125 Å²	125	105.9 Å²	105.9	87%	0.874	63%	0.628	S	S	*	*			trans	-74.5	92.7	-169.1	53.3	0	0	0	0	113.6
803	Q	35.7	Very low	38.1	Very low	177 Å²	177	103.4 Å²	103.4	83%	0.827	61%	0.614	S	S	*	*			trans	-93.5	133.5	165.3	-74.9	-173.3	-32.9	0	0	111.6	Q801 S805	Q801-Q803 PolarHBondContact O-N 3.1Å; Q803-S805 PolarHBondContact O-N 2.9Å
804	I	43.9	Very low	38.5	Very low	122 Å²	122	99.8 Å²	99.8	63%	0.626	59%	0.591	S	S	*	*			trans	-83.5	111.1	174.1	-60	173.7	0	0	0	108.2	F788 C806	F788-I804 HydrophobicContact CB-CG2 4.24Å; F788-I804 HydrophobicContact CD1-CG2 4.08Å; I804-C806 PolarHBondContact O-N 2.92Å
805	S	36.4	Very low	38.8	Very low	53 Å²	53	99 Å²	99	37%	0.371	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-66.8	102.9	178.9	-62.3	0	0	0	0	111.3	T789 T791 Q803	T789-S805 PolarHBondContact N-O 2.85Å; T789-S805 VanDerWaalsContact OG1-CB 3.3Å; T789-S805 WeakPolarHBondContact OG1-CB 3.42Å; T789-S805 PolarHBondContact OG1-O 3.28Å; T791-S805 PolarHBondContact OG1-OG 3.39Å; Q803-S805 PolarHBondContact O-N 2.9Å
806	C	53.1	Low	39.1	Very low	53 Å²	53	103.4 Å²	103.4	36%	0.358	60%	0.599	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.7	144	172.3	-70.7	0	0	0	0	110.6	R786 I804	R786-C806 PolarHBondContact NH2-SG 2.78Å; R786-C806 VanDerWaalsContact NH2-SG 3.37Å; I804-C806 PolarHBondContact O-N 2.92Å
807	T	54	Low	39.7	Very low	58 Å²	58	104.5 Å²	104.5	36%	0.356	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124	128	169.6	-39.3	0	0	0	0	109.8	R786 S787 L809	R786-T807 WeakPolarHBondContact CA-O 3.37Å; S787-T807 PolarHBondContact N-O 3.03Å; S787-T807 PolarHBondContact O-N 3.47Å; S787-T807 PolarHBondContact OG-O 2.78Å; T807-L809 HydrophobicContact CG2-CG 4.49Å
808	V	53.6	Low	40.2	Very low	44 Å²	44	106.4 Å²	106.4	27%	0.267	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.9	132	172.2	178.9	0	0	0	0	108.7	I784 L810	I784-V808 HydrophobicContact CD1-CG1 3.76Å; I784-V808 HydrophobicContact CG1-CG1 3.89Å; V808-L810 HydrophobicContact CG1-CD2 4.36Å; V808-L810 HydrophobicContact CG1-CG 4.44Å
809	L	52	Low	41.2	Very low	62 Å²	62	103.8 Å²	103.8	33%	0.325	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.2	112.6	-178.6	-69.8	166.9	0	0	0	109.4	V785 T807 L857	V785-L809 HydrophobicContact CB-CB 4.21Å; V785-L809 PolarHBondContact N-O 2.98Å; V785-L809 VanDerWaalsContact N-O 3.16Å; V785-L809 PolarHBondContact O-N 2.69Å; T807-L809 HydrophobicContact CG2-CG 4.49Å; L809-L857 HydrophobicContact CD1-CD2 3.47Å; L809-L857 VanDerWaalsContact CD1-CD2 3.47Å
810	L	45.9	Very low	42	Very low	49 Å²	49	100.6 Å²	100.6	26%	0.257	55%	0.55	S	S	.	.			trans	-93.6	154.1	-175.3	-64.5	168.9	0	0	0	112.2	I784 V808 Y814 I819	I784-L810 HydrophobicContact CD1-CD2 3.7Å; I784-L810 HydrophobicContact CG1-CD2 3.99Å; V808-L810 HydrophobicContact CG1-CD2 4.36Å; V808-L810 HydrophobicContact CG1-CG 4.44Å; L810-Y814 HydrophobicContact CD1-CG 4.15Å; L810-I819 HydrophobicContact CD1-CB 4.35Å; L810-I819 HydrophobicContact CD1-CD1 3.76Å; L810-I819 HydrophobicContact CD1-CG1 3.88Å; L810-I819 HydrophobicContact CD2-CD1 4.27Å
811	P	39.5	Very low	43.1	Very low	34 Å²	34	100 Å²	100	22%	0.221	55%	0.546	C	S	.	.			trans	-66.4	165.3	165.4	-19.2	34.2	0	0	0	112.1	S783 P813 Y814	S783-P811 WeakPolarHBondContact O-CD 3.15Å; S783-P811 WeakPolarHBondContact O-CG 3.27Å; P811-P813 VanDerWaalsContact C-N 3.35Å; P811-P813 VanDerWaalsContact O-CD 3.26Å; P811-P813 WeakPolarHBondContact O-CD 3.37Å; P811-P813 VanDerWaalsContact O-N 3.1Å; P811-Y814 PolarHBondContact O-N 3.43Å
812	I	46.7	Very low	44.7	Very low	159 Å²	159	94.5 Å²	94.5	82%	0.815	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-15.6	-166	-65.2	165.2	0	0	0	116.8	Y814	I812-Y814 PolarHBondContact O-N 2.8Å
813	P	41.6	Very low	46.9	Very low	79 Å²	79	89.9 Å²	89.9	51%	0.513	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-8.9	171.7	-20.3	33.9	0	0	0	115.9	P811	P811-P813 VanDerWaalsContact C-N 3.35Å; P811-P813 VanDerWaalsContact O-CD 3.26Å; P811-P813 WeakPolarHBondContact O-CD 3.37Å; P811-P813 VanDerWaalsContact O-N 3.1Å
814	Y	41.2	Very low	49.1	Very low	57 Å²	57	81.5 Å²	81.5	22%	0.224	45%	0.449	C	S	.	.			trans	-111.9	67.3	-178	-64.1	-88.1	0	0	0	111	L810 P811 I812 I819 M831 K834	L810-Y814 HydrophobicContact CD1-CG 4.15Å; P811-Y814 PolarHBondContact O-N 3.43Å; I812-Y814 PolarHBondContact O-N 2.8Å; Y814-I819 HydrophobicContact CD1-CD1 4.12Å; Y814-I819 HydrophobicContact CE1-CD1 4.29Å; Y814-M831 WeakPolarHBondContact OH-CE 3.38Å; Y814-K834 PolarHBondContact OH-NZ 3.04Å; Y814-K834 VanDerWaalsContact OH-NZ 3.07Å
815	T	33.7	Very low	50.9	Low	109 Å²	109	76 Å²	76	67%	0.669	42%	0.42	S	S	*	.			trans	-88.4	128.5	163.3	50.2	0	0	0	0	109.3
816	D	37.1	Very low	53	Low	165 Å²	165	76 Å²	76	88%	0.882	42%	0.418	S	S	*	.	S	Bend	trans	95.7	-12.8	168.5	-51.7	-17.2	0	0	0	118.4
817	E	40.4	Very low	54.4	Low	150 Å²	150	73.7 Å²	73.7	70%	0.701	40%	0.402	S	S	*	.			trans	-107.5	117.8	167.9	-71.5	-171.7	165.3	0	0	112.5	I819	E817-I819 PolarHBondContact O-N 2.81Å
818	Q	42.8	Very low	55.8	Low	159 Å²	159	71 Å²	71	74%	0.743	39%	0.385	S	S	*	.			trans	-79.3	102.9	168	-67.6	-173	11.3	0	0	109.4	N820	Q818-N820 PolarHBondContact O-N 2.64Å; Q818-N820 PolarHBondContact OE1-ND2 3.36Å
819	I	50.7	Low	57.2	Low	25 Å²	25	71.7 Å²	71.7	13%	0.128	39%	0.387	C	S	.	.			trans	-74.5	71.2	173.2	-49.9	178.9	0	0	0	109.6	L810 Y814 E817 S821 Q822	L810-I819 HydrophobicContact CD1-CB 4.35Å; L810-I819 HydrophobicContact CD1-CD1 3.76Å; L810-I819 HydrophobicContact CD1-CG1 3.88Å; L810-I819 HydrophobicContact CD2-CD1 4.27Å; Y814-I819 HydrophobicContact CD1-CD1 4.12Å; Y814-I819 HydrophobicContact CE1-CD1 4.29Å; E817-I819 PolarHBondContact O-N 2.81Å; I819-S821 VanDerWaalsContact C-N 3.29Å; I819-Q822 HydrophobicContact CG2-CB 3.73Å; I819-Q822 HydrophobicContact CG2-CG 3.76Å; I819-Q822 VanDerWaalsContact CG2-OE1 3.26Å
820	N	45.8	Very low	58.6	Low	121 Å²	121	71.8 Å²	71.8	65%	0.647	39%	0.388	S	S	*	.			trans	-86.4	1.8	177.8	-66.3	-17.4	0	0	0	112.5	Q818	Q818-N820 PolarHBondContact O-N 2.64Å; Q818-N820 PolarHBondContact OE1-ND2 3.36Å
821	S	51.5	Low	60.2	Low	111 Å²	111	69.6 Å²	69.6	78%	0.776	38%	0.377	S	S	*	.	S	Bend	trans	-155.9	44.8	-163.3	67	0	0	0	0	115.1	I819	I819-S821 VanDerWaalsContact C-N 3.29Å
822	Q	64.8	Low	62.2	Low	73 Å²	73	69.8 Å²	69.8	34%	0.341	38%	0.375	S	S	.	.			trans	-133.6	146.4	171.2	-70.1	-179.5	-17.3	0	0	109.7	W733 I819 V826	W733-Q822 PolarHBondContact NE1-O 3.35Å; I819-Q822 HydrophobicContact CG2-CB 3.73Å; I819-Q822 HydrophobicContact CG2-CG 3.76Å; I819-Q822 VanDerWaalsContact CG2-OE1 3.26Å; Q822-V826 HydrophobicContact CB-CB 4.41Å; Q822-V826 HydrophobicContact CB-CG1 4.11Å; Q822-V826 HydrophobicContact CG-CG1 4.16Å
823	S	74.7	Confident	63.7	Low	28 Å²	28	67.5 Å²	67.5	20%	0.196	37%	0.365	C	S	.	.			trans	-75	162.1	179	52.1	0	0	0	0	113	M731 I825 V826 W827	M731-S823 WeakPolarHBondContact O-CB 3.47Å; S823-I825 PolarHBondContact O-N 3.29Å; S823-V826 PolarHBondContact O-N 3.49Å; S823-V826 VanDerWaalsContact OG-CG2 3.32Å; S823-V826 WeakPolarHBondContact OG-CG2 3.37Å; S823-W827 PolarHBondContact O-N 2.61Å
824	P	81.7	Confident	65.5	Low	1 Å²	1	68.5 Å²	68.5	1%	0.006	36%	0.361	C	S	.	.	H	α-helix	trans	-58.1	-36.1	177.8	-21.7	32.3	0	0	0	113	M731 W733 L736 W827 I828	M731-P824 WeakPolarHBondContact O-CD 3.28Å; W733-P824 HydrophobicContact CD2-CG 3.77Å; W733-P824 HydrophobicContact CE3-CB 4.43Å; W733-P824 HydrophobicContact CE3-CG 3.77Å; W733-P824 HydrophobicContact CG-CG 4.27Å; W733-P824 HydrophobicContact CH2-CB 4.02Å; W733-P824 HydrophobicContact CH2-CG 4.21Å; W733-P824 HydrophobicContact CZ2-CB 4.17Å; W733-P824 HydrophobicContact CZ2-CG 4.21Å; W733-P824 HydrophobicContact CZ3-CB 4.16Å; W733-P824 HydrophobicContact CZ3-CG 4Å; L736-P824 HydrophobicContact CD2-CB 4.2Å; L736-P824 HydrophobicContact CD2-CG 3.94Å; P824-W827 PolarHBondContact O-N 2.9Å; P824-I828 WeakPolarHBondContact O-CG1 3.38Å; P824-I828 PolarHBondContact O-N 3.02Å
825	I	81.7	Confident	67.1	Low	6 Å²	6	69 Å²	69	3%	0.031	36%	0.363	C	S	.	.	H	α-helix	trans	-70.4	-35.6	-179.6	-164.6	66.4	0	0	0	112.3	Q674 D729 S823 I828 N829	Q674-I825 HydrophobicContact CB-CD1 4.33Å; Q674-I825 VanDerWaalsContact CD-CD1 3.5Å; Q674-I825 HydrophobicContact CG-CD1 3.84Å; D729-I825 VanDerWaalsContact O-CG2 3.32Å; D729-I825 WeakPolarHBondContact O-CG2 3.38Å; S823-I825 PolarHBondContact O-N 3.29Å; I825-I828 PolarHBondContact O-N 2.91Å; I825-N829 WeakPolarHBondContact O-CB 3.1Å; I825-N829 VanDerWaalsContact O-CG 3.23Å; I825-N829 PolarHBondContact O-N 2.89Å
826	V	81.2	Confident	68.8	Low	53 Å²	53	70.4 Å²	70.4	32%	0.321	37%	0.367	S	S	.	.	H	α-helix	trans	-61.7	-45.6	174.4	167.3	0	0	0	0	110.2	Q822 S823 I828 N829 D830	Q822-V826 HydrophobicContact CB-CB 4.41Å; Q822-V826 HydrophobicContact CB-CG1 4.11Å; Q822-V826 HydrophobicContact CG-CG1 4.16Å; S823-V826 PolarHBondContact O-N 3.49Å; S823-V826 VanDerWaalsContact OG-CG2 3.32Å; S823-V826 WeakPolarHBondContact OG-CG2 3.37Å; V826-I828 VanDerWaalsContact C-N 3.31Å; V826-I828 PolarHBondContact O-N 2.8Å; V826-N829 PolarHBondContact O-N 2.96Å; V826-D830 WeakPolarHBondContact O-CB 3.4Å; V826-D830 PolarHBondContact O-N 3.09Å
827	W	82.4	Confident	70.2	Confident	5 Å²	5	63.2 Å²	63.2	2%	0.019	33%	0.33	C	S	.	.	H	α-helix	trans	-60.1	-38.7	175.9	-178.3	82.6	0	0	0	112.8	L769 F771 Q782 I784 S823 P824 M831	L769-W827 HydrophobicContact CD2-CE3 3.75Å; L769-W827 HydrophobicContact CD2-CZ3 3.84Å; L769-W827 HydrophobicContact CG-CE3 4.31Å; L769-W827 HydrophobicContact CG-CZ3 3.88Å; F771-W827 HydrophobicContact CB-CH2 3.92Å; F771-W827 HydrophobicContact CB-CZ3 4.08Å; Q782-W827 HydrophobicContact CB-CZ2 4.45Å; I784-W827 HydrophobicContact CB-CD2 4.25Å; I784-W827 HydrophobicContact CB-CH2 4.41Å; I784-W827 HydrophobicContact CB-CZ2 3.9Å; I784-W827 HydrophobicContact CD1-CG 4.26Å; I784-W827 HydrophobicContact CG2-CD2 3.8Å; I784-W827 HydrophobicContact CG2-CE3 3.87Å; I784-W827 HydrophobicContact CG2-CG 4.45Å; I784-W827 HydrophobicContact CG2-CH2 4.03Å; I784-W827 HydrophobicContact CG2-CZ2 3.95Å; I784-W827 HydrophobicContact CG2-CZ3 4Å; S823-W827 PolarHBondContact O-N 2.61Å; P824-W827 PolarHBondContact O-N 2.9Å; W827-M831 HydrophobicContact CD2-CG 4.37Å; W827-M831 HydrophobicContact CE3-CG 4.45Å; W827-M831 HydrophobicContact CH2-CG 4.15Å; W827-M831 HydrophobicContact CZ2-CG 4.04Å; W827-M831 HydrophobicContact CZ2-SD 4.29Å; W827-M831 HydrophobicContact CZ3-CG 4.35Å; W827-M831 WeakPolarHBondContact O-CG 3.13Å; W827-M831 PolarHBondContact O-N 2.88Å; W827-M831 VanDerWaalsContact O-N 3.11Å
828	I	83	Confident	71.5	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-71.6	-42.6	177.7	-58.2	161.5	0	0	0	111	L727 L769 F771 P824 I825 V826 D830 M831 I832 L842	L727-I828 HydrophobicContact CD1-CD1 3.36Å; L769-I828 HydrophobicContact CD2-CD1 4.23Å; L769-I828 HydrophobicContact CD2-CG1 4.21Å; F771-I828 HydrophobicContact CD2-CG2 4.01Å; F771-I828 HydrophobicContact CE2-CG2 4.05Å; P824-I828 WeakPolarHBondContact O-CG1 3.38Å; P824-I828 PolarHBondContact O-N 3.02Å; I825-I828 PolarHBondContact O-N 2.91Å; V826-I828 VanDerWaalsContact C-N 3.31Å; V826-I828 PolarHBondContact O-N 2.8Å; I828-D830 VanDerWaalsContact C-N 3.3Å; I828-D830 PolarHBondContact O-N 3.35Å; I828-M831 CarbonylContact O-C 3.59Å; I828-M831 WeakPolarHBondContact O-CA 3.32Å; I828-M831 WeakPolarHBondContact O-CB 3.28Å; I828-M831 PolarHBondContact O-N 2.77Å; I828-I832 HydrophobicContact CG2-CD1 3.96Å; I828-I832 HydrophobicContact CG2-CG1 4.31Å; I828-I832 WeakPolarHBondContact O-CG1 3.09Å; I828-I832 PolarHBondContact O-N 3.13Å; I828-L842 HydrophobicContact CD1-CD1 4.08Å; I828-L842 HydrophobicContact CG2-CD1 4.35Å; I828-L842 HydrophobicContact CG2-CD2 4.01Å
829	N	82.5	Confident	72.7	Confident	60 Å²	60	64.8 Å²	64.8	32%	0.321	33%	0.334	S	S	.	.	H	α-helix	trans	-62.5	-38.8	177.3	-69.8	-12.9	0	0	0	111.2	Q674 I825 V826 M831 I832 N833	Q674-N829 PolarHBondContact NE2-OD1 3.26Å; Q674-N829 VanDerWaalsContact NE2-OD1 3.17Å; I825-N829 WeakPolarHBondContact O-CB 3.1Å; I825-N829 VanDerWaalsContact O-CG 3.23Å; I825-N829 PolarHBondContact O-N 2.89Å; V826-N829 PolarHBondContact O-N 2.96Å; N829-M831 PolarHBondContact O-N 3.03Å; N829-I832 PolarHBondContact O-N 3.08Å; N829-N833 WeakPolarHBondContact O-CB 3.19Å; N829-N833 PolarHBondContact O-N 2.74Å; N829-N833 PolarHBondContact O-ND2 3.05Å
830	D	80.8	Confident	74	Confident	64 Å²	64	67 Å²	67	34%	0.342	34%	0.341	S	S	.	.	H	α-helix	trans	-59.6	-41.6	169.5	-84.4	-0.1	0	0	0	112.2	V826 I828 K834	V826-D830 WeakPolarHBondContact O-CB 3.4Å; V826-D830 PolarHBondContact O-N 3.09Å; I828-D830 VanDerWaalsContact C-N 3.3Å; I828-D830 PolarHBondContact O-N 3.35Å; D830-K834 WeakPolarHBondContact O-CB 3.12Å; D830-K834 PolarHBondContact O-N 3.44Å
831	M	79.7	Confident	75.6	Confident	3 Å²	3	64.6 Å²	64.6	2%	0.015	33%	0.331	C	S	.	.	H	α-helix	trans	-66.1	-41.4	174.3	-66.8	-53.7	100.6	0	0	112.2	F771 Q782 Y814 W827 I828 N829 K834 Y835	F771-M831 HydrophobicContact CB-CB 4.43Å; F771-M831 HydrophobicContact CB-CG 4.25Å; F771-M831 HydrophobicContact CD1-CB 3.89Å; F771-M831 HydrophobicContact CD1-CG 4.43Å; F771-M831 HydrophobicContact CD2-CB 3.79Å; F771-M831 HydrophobicContact CD2-CG 4.43Å; F771-M831 HydrophobicContact CE1-CB 4.01Å; F771-M831 HydrophobicContact CE2-CB 3.93Å; F771-M831 HydrophobicContact CG-CB 3.77Å; F771-M831 HydrophobicContact CG-CG 4.13Å; F771-M831 HydrophobicContact CZ-CB 4.03Å; Q782-M831 HydrophobicContact CB-SD 3.96Å; Q782-M831 HydrophobicContact CG-SD 4.01Å; Y814-M831 WeakPolarHBondContact OH-CE 3.38Å; W827-M831 HydrophobicContact CD2-CG 4.37Å; W827-M831 HydrophobicContact CE3-CG 4.45Å; W827-M831 HydrophobicContact CH2-CG 4.15Å; W827-M831 HydrophobicContact CZ2-CG 4.04Å; W827-M831 HydrophobicContact CZ2-SD 4.29Å; W827-M831 HydrophobicContact CZ3-CG 4.35Å; W827-M831 WeakPolarHBondContact O-CG 3.13Å; W827-M831 PolarHBondContact O-N 2.88Å; W827-M831 VanDerWaalsContact O-N 3.11Å; I828-M831 CarbonylContact O-C 3.59Å; I828-M831 WeakPolarHBondContact O-CA 3.32Å; I828-M831 WeakPolarHBondContact O-CB 3.28Å; I828-M831 PolarHBondContact O-N 2.77Å; N829-M831 PolarHBondContact O-N 3.03Å; M831-K834 HydrophobicContact CE-CD 4.2Å; M831-K834 PolarHBondContact O-N 2.84Å; M831-Y835 VanDerWaalsContact O-CD2 3.3Å; M831-Y835 WeakPolarHBondContact O-CD2 3.27Å; M831-Y835 PolarHBondContact O-N 3.49Å; M831-Y835 HydrophobicContact SD-CE2 4.2Å
832	I	81	Confident	77.2	Confident	37 Å²	37	59.9 Å²	59.9	19%	0.19	30%	0.297	C	S	.	.	H	α-helix	trans	-60.7	-50	177.4	-66.5	165.9	0	0	0	110	F771 I828 N829 Y835 N836 A837 Y840	F771-I832 HydrophobicContact CE2-CG1 3.76Å; F771-I832 HydrophobicContact CZ-CG1 4Å; I828-I832 HydrophobicContact CG2-CD1 3.96Å; I828-I832 HydrophobicContact CG2-CG1 4.31Å; I828-I832 WeakPolarHBondContact O-CG1 3.09Å; I828-I832 PolarHBondContact O-N 3.13Å; N829-I832 PolarHBondContact O-N 3.08Å; I832-Y835 PolarHBondContact O-N 2.87Å; I832-N836 WeakPolarHBondContact O-CA 3.22Å; I832-N836 PolarHBondContact O-N 3.03Å; I832-A837 PolarHBondContact O-N 2.87Å; I832-Y840 HydrophobicContact CD1-CE1 3.91Å; I832-Y840 HydrophobicContact CD1-CE2 4.33Å; I832-Y840 WeakPolarHBondContact CD1-OH 3.27Å; I832-Y840 HydrophobicContact CG1-CD1 4.38Å; I832-Y840 HydrophobicContact CG1-CE1 3.93Å
833	N	80.1	Confident	78.2	Confident	112 Å²	112	57 Å²	57	60%	0.599	29%	0.285	S	S	*	.	H	α-helix	trans	-63.3	-41.5	179	-68.9	-25.7	0	0	0	112	N829 Y835	N829-N833 WeakPolarHBondContact O-CB 3.19Å; N829-N833 PolarHBondContact O-N 2.74Å; N829-N833 PolarHBondContact O-ND2 3.05Å; N833-Y835 VanDerWaalsContact C-N 3.31Å; N833-Y835 PolarHBondContact O-N 3.24Å
834	K	79.2	Confident	78.8	Confident	100 Å²	100	55.6 Å²	55.6	44%	0.435	28%	0.276	S	S	.	.	H	α-helix	trans	-67.8	-25.4	-178.4	-175.8	169.1	-171.5	158.4	0	114.2	Y814 D830 M831	Y814-K834 PolarHBondContact OH-NZ 3.04Å; Y814-K834 VanDerWaalsContact OH-NZ 3.07Å; D830-K834 WeakPolarHBondContact O-CB 3.12Å; D830-K834 PolarHBondContact O-N 3.44Å; M831-K834 HydrophobicContact CE-CD 4.2Å; M831-K834 PolarHBondContact O-N 2.84Å
835	Y	74	Confident	78.9	Confident	66 Å²	66	57 Å²	57	26%	0.259	28%	0.282	S	S	.	.	H	α-helix	trans	-116.6	-2.5	-179.1	-66.9	-73.7	0	0	0	114.4	L773 Q782 M831 I832 N833 A837	L773-Y835 HydrophobicContact CD2-CD1 3.9Å; L773-Y835 HydrophobicContact CD2-CD2 3.69Å; L773-Y835 HydrophobicContact CD2-CE1 4.41Å; L773-Y835 HydrophobicContact CD2-CE2 4.25Å; L773-Y835 HydrophobicContact CD2-CG 3.51Å; Q782-Y835 HydrophobicContact CG-CE2 3.98Å; Q782-Y835 PolarHBondContact NE2-OH 3.37Å; M831-Y835 VanDerWaalsContact O-CD2 3.3Å; M831-Y835 WeakPolarHBondContact O-CD2 3.27Å; M831-Y835 PolarHBondContact O-N 3.49Å; M831-Y835 HydrophobicContact SD-CE2 4.2Å; I832-Y835 PolarHBondContact O-N 2.87Å; N833-Y835 VanDerWaalsContact C-N 3.31Å; N833-Y835 PolarHBondContact O-N 3.24Å; Y835-A837 PolarHBondContact O-N 2.79Å; Y835-A837 VanDerWaalsContact O-N 3.14Å
836	N	70.5	Confident	79.1	Confident	140 Å²	140	56.8 Å²	56.8	75%	0.749	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.4	37	-171.6	-72.2	-50.5	0	0	0	112.9	I832 K838	I832-N836 WeakPolarHBondContact O-CA 3.22Å; I832-N836 PolarHBondContact O-N 3.03Å; N836-K838 PolarHBondContact O-N 2.83Å; N836-K838 VanDerWaalsContact O-N 3.12Å
837	A	66.1	Low	79.2	Confident	14 Å²	14	54.5 Å²	54.5	12%	0.116	27%	0.267	C	S	.	.			trans	-79	100	-163	0	0	0	0	0	112.3	F771 L773 I832 Y835 H839 Y840	F771-A837 HydrophobicContact CE1-CB 4.32Å; F771-A837 HydrophobicContact CZ-CB 4.13Å; L773-A837 HydrophobicContact CB-CB 4.48Å; I832-A837 PolarHBondContact O-N 2.87Å; Y835-A837 PolarHBondContact O-N 2.79Å; Y835-A837 VanDerWaalsContact O-N 3.14Å; A837-H839 VanDerWaalsContact C-N 3.25Å; A837-H839 PolarHBondContact O-N 2.89Å; A837-Y840 WeakPolarHBondContact O-CD1 3.21Å
838	K	66.3	Low	79.2	Confident	190 Å²	190	54.3 Å²	54.3	83%	0.826	27%	0.266	S	S	*	.	S	Bend	trans	-67.6	-22.8	173.4	-65.1	-171.7	178	-174.7	0	114	N836	N836-K838 PolarHBondContact O-N 2.83Å; N836-K838 VanDerWaalsContact O-N 3.12Å
839	H	69.8	Low	78.8	Confident	152 Å²	152	56 Å²	56	70%	0.704	27%	0.273	S	S	*	.	S	Bend	trans	-135	107	179.8	-58.4	-45.6	0	0	0	109.8	A837	A837-H839 VanDerWaalsContact C-N 3.25Å; A837-H839 PolarHBondContact O-N 2.89Å
840	Y	77.6	Confident	78	Confident	71 Å²	71	53.1 Å²	53.1	28%	0.278	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	158.7	175.4	62.9	-86.5	0	0	0	109.7	F771 T772 I832 A837 L842	F771-Y840 HydrophobicContact CD2-CD2 4.07Å; F771-Y840 HydrophobicContact CD2-CG 4.47Å; F771-Y840 HydrophobicContact CE2-CD1 4.22Å; F771-Y840 AromaticContact CE2-CD2 3.44Å; F771-Y840 HydrophobicContact CE2-CD2 3.44Å; F771-Y840 VanDerWaalsContact CE2-CD2 3.44Å; F771-Y840 HydrophobicContact CE2-CE2 4.01Å; F771-Y840 AromaticContact CE2-CG 3.57Å; F771-Y840 HydrophobicContact CE2-CG 3.57Å; F771-Y840 HydrophobicContact CZ-CD1 4.1Å; F771-Y840 HydrophobicContact CZ-CD2 4.01Å; F771-Y840 AromaticContact CZ-CG 3.62Å; F771-Y840 HydrophobicContact CZ-CG 3.62Å; T772-Y840 CarbonylContact O-C 3.57Å; T772-Y840 WeakPolarHBondContact O-CA 3.49Å; T772-Y840 WeakPolarHBondContact O-CB 3.48Å; I832-Y840 HydrophobicContact CD1-CE1 3.91Å; I832-Y840 HydrophobicContact CD1-CE2 4.33Å; I832-Y840 WeakPolarHBondContact CD1-OH 3.27Å; I832-Y840 HydrophobicContact CG1-CD1 4.38Å; I832-Y840 HydrophobicContact CG1-CE1 3.93Å; A837-Y840 WeakPolarHBondContact O-CD1 3.21Å; Y840-L842 HydrophobicContact CD2-CD2 3.86Å; Y840-L842 HydrophobicContact CD2-CG 3.96Å; Y840-L842 HydrophobicContact CE2-CD1 4.03Å; Y840-L842 HydrophobicContact CE2-CD2 4.01Å; Y840-L842 HydrophobicContact CE2-CG 3.88Å
841	T	80	Confident	77.3	Confident	70 Å²	70	50.1 Å²	50.1	43%	0.429	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	139.1	169.5	85.8	0	0	0	0	111.2	T772	T772-T841 PolarHBondContact N-O 2.81Å; T772-T841 PolarHBondContact O-N 3.05Å; T772-T841 PolarHBondContact OG1-O 3.06Å; T772-T841 PolarHBondContact OG1-OG1 3.27Å
842	L	84.6	Confident	76.4	Confident	12 Å²	12	51.6 Å²	51.6	6%	0.063	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	129	-176.2	-57.8	177.2	0	0	0	110.7	Q674 V676 Q677 N770 F771 I828 Y840	Q674-L842 HydrophobicContact CB-CD1 4.29Å; V676-L842 HydrophobicContact CB-CB 4.3Å; V676-L842 HydrophobicContact CG1-CB 3.99Å; V676-L842 HydrophobicContact CG2-CB 3.96Å; V676-L842 HydrophobicContact CG2-CD1 3.85Å; Q677-L842 PolarHBondContact N-O 3.02Å; N770-L842 WeakPolarHBondContact O-CA 3.47Å; F771-L842 HydrophobicContact CD2-CD2 3.6Å; F771-L842 HydrophobicContact CE2-CD2 4.27Å; F771-L842 HydrophobicContact CG-CD2 4.44Å; I828-L842 HydrophobicContact CD1-CD1 4.08Å; I828-L842 HydrophobicContact CG2-CD1 4.35Å; I828-L842 HydrophobicContact CG2-CD2 4.01Å; Y840-L842 HydrophobicContact CD2-CD2 3.86Å; Y840-L842 HydrophobicContact CD2-CG 3.96Å; Y840-L842 HydrophobicContact CE2-CD1 4.03Å; Y840-L842 HydrophobicContact CE2-CD2 4.01Å; Y840-L842 HydrophobicContact CE2-CG 3.88Å
843	S	85.3	Confident	75.4	Confident	12 Å²	12	52.8 Å²	52.8	8%	0.084	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	128.8	174.3	58.2	0	0	0	0	113.4	Q677 N770	Q677-S843 CarbonylContact O-C 3.46Å; Q677-S843 WeakPolarHBondContact O-CA 3.33Å; N770-S843 WeakPolarHBondContact CB-O 3.43Å; N770-S843 PolarHBondContact N-O 3.38Å; N770-S843 PolarHBondContact ND2-O 3.07Å; N770-S843 PolarHBondContact O-N 2.89Å; N770-S843 VanDerWaalsContact O-N 3.07Å
844	I	86.4	Confident	74.1	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	122	170.4	-71.1	160.3	0	0	0	108.5	V676 Q677 V678 F679 T725 L736 L740 Y767 Q768 L769 I846	V676-I844 HydrophobicContact CB-CD1 4.31Å; V676-I844 HydrophobicContact CG1-CB 4.34Å; V676-I844 HydrophobicContact CG1-CD1 3.62Å; V676-I844 HydrophobicContact CG1-CG1 3.64Å; Q677-I844 PolarHBondContact O-N 2.88Å; V678-I844 HydrophobicContact CG1-CG2 4.47Å; V678-I844 HydrophobicContact CG2-CB 4.49Å; F679-I844 PolarHBondContact N-O 3.22Å; T725-I844 HydrophobicContact CG2-CD1 4.33Å; L736-I844 HydrophobicContact CD1-CD1 4.3Å; L740-I844 HydrophobicContact CD1-CD1 4.48Å; L740-I844 HydrophobicContact CD1-CG2 4.22Å; L740-I844 HydrophobicContact CD2-CD1 4.17Å; L740-I844 HydrophobicContact CD2-CG2 4.16Å; Y767-I844 HydrophobicContact CD2-CG2 4Å; Y767-I844 HydrophobicContact CG-CG2 4.3Å; Q768-I844 CarbonylContact O-C 3.59Å; Q768-I844 WeakPolarHBondContact O-CA 3.44Å; L769-I844 HydrophobicContact CB-CG1 4.2Å; L769-I844 HydrophobicContact CD1-CD1 4.28Å; L769-I844 HydrophobicContact CD1-CG1 3.69Å; I844-I846 HydrophobicContact CG2-CG1 4.02Å
845	Q	85.5	Confident	72.8	Confident	31 Å²	31	50.4 Å²	50.4	15%	0.145	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	107.6	170.3	-65	-176.5	31.5	0	0	109.1	F679 Y767 Q768	F679-Q845 CarbonylContact O-C 3.58Å; F679-Q845 WeakPolarHBondContact O-CA 3.48Å; Y767-Q845 CarbonylContact C-O 3.59Å; Y767-Q845 VanDerWaalsContact CA-O 3.24Å; Y767-Q845 WeakPolarHBondContact CA-O 3.38Å; Q768-Q845 HydrophobicContact CB-CB 4.43Å; Q768-Q845 PolarHBondContact N-O 3.17Å; Q768-Q845 PolarHBondContact O-N 2.7Å
846	I	86	Confident	71	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	135	176.2	-66.6	-179.1	0	0	0	110.3	V678 F679 V680 H681 L740 I744 L764 I844 L848	V678-I846 HydrophobicContact CG1-CD1 3.43Å; V678-I846 VanDerWaalsContact CG1-CD1 3.43Å; V678-I846 HydrophobicContact CG1-CG1 3.97Å; F679-I846 PolarHBondContact O-N 2.87Å; V680-I846 HydrophobicContact CG2-CB 3.67Å; V680-I846 HydrophobicContact CG2-CD1 4.35Å; V680-I846 HydrophobicContact CG2-CG2 3.64Å; H681-I846 PolarHBondContact N-O 3.42Å; L740-I846 HydrophobicContact CD2-CD1 4.18Å; I744-I846 HydrophobicContact CD1-CD1 4.13Å; I744-I846 HydrophobicContact CD1-CG2 4.34Å; I744-I846 HydrophobicContact CG1-CD1 4.21Å; L764-I846 HydrophobicContact CD1-CB 4.48Å; L764-I846 HydrophobicContact CD1-CG1 4.43Å; L764-I846 HydrophobicContact CD1-CG2 3.59Å; I844-I846 HydrophobicContact CG2-CG1 4.02Å; I846-L848 HydrophobicContact CG2-CD2 3.93Å; I846-L848 HydrophobicContact CG2-CG 4.38Å
847	H	81.9	Confident	69.6	Low	6 Å²	6	50.6 Å²	50.6	3%	0.028	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	120.8	162.8	-62.9	-73.7	0	0	0	110.3	H681 Q765 A766 M853 F855	H681-H847 AromaticContact CG-CE1 3.91Å; Q765-H847 WeakPolarHBondContact CB-O 3.26Å; Q765-H847 PolarHBondContact N-O 2.89Å; A766-H847 HydrophobicContact CB-CB 4.47Å; A766-H847 PolarHBondContact N-O 2.96Å; A766-H847 WeakPolarHBondContact O-CA 3.48Å; A766-H847 PolarHBondContact O-N 3.26Å; A766-H847 VanDerWaalsContact O-O 3.09Å; H847-M853 HydrophobicContact CB-CE 3.58Å; H847-M853 HydrophobicContact CB-SD 3.68Å; H847-M853 VanDerWaalsContact CG-SD 3.58Å; H847-F855 AromaticContact NE2-CE2 3.85Å
848	L	82.4	Confident	68.2	Low	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	153	176.4	-56.3	170.3	0	0	0	110.6	V680 I744 L762 Q765 I846 C851 Y877 F880	V680-L848 HydrophobicContact CG1-CD1 3.65Å; V680-L848 HydrophobicContact CG1-CG 4.02Å; V680-L848 HydrophobicContact CG2-CD1 4.48Å; V680-L848 HydrophobicContact CG2-CD2 4.33Å; V680-L848 HydrophobicContact CG2-CG 4.36Å; I744-L848 HydrophobicContact CD1-CD2 4.02Å; L762-L848 HydrophobicContact CD1-CB 4.5Å; L762-L848 HydrophobicContact CD1-CD1 4.33Å; L762-L848 HydrophobicContact CD2-CD1 3.9Å; L762-L848 HydrophobicContact CD2-CD2 4.1Å; L762-L848 HydrophobicContact CG-CD1 4.39Å; L762-L848 HydrophobicContact CG-CD2 4.14Å; Q765-L848 PolarHBondContact OE1-O 3.41Å; I846-L848 HydrophobicContact CG2-CD2 3.93Å; I846-L848 HydrophobicContact CG2-CG 4.38Å; L848-C851 WeakPolarHBondContact O-CB 3.32Å; L848-C851 PolarHBondContact O-N 3.49Å; L848-Y877 HydrophobicContact CB-CD2 4.25Å; L848-Y877 HydrophobicContact CD1-CD2 4.46Å; L848-F880 HydrophobicContact CD1-CD1 3.98Å; L848-F880 HydrophobicContact CD1-CD2 4.47Å; L848-F880 HydrophobicContact CD1-CE1 4.24Å; L848-F880 HydrophobicContact CD1-CG 4.12Å
849	K	75.2	Confident	66.7	Low	35 Å²	35	56 Å²	56	15%	0.152	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	141.8	174.5	-68.7	-168.3	-176.2	179.8	0	111.6	E763 Q765 E873	E763-K849 HydrophobicContact CB-CD 3.86Å; E763-K849 HydrophobicContact CB-CG 4.25Å; E763-K849 PolarHBondContact O-N 2.94Å; E763-K849 VanDerWaalsContact O-N 3.12Å; E763-K849 WeakPolarHBondContact OE2-CE 3.41Å; E763-K849 IonicContact OE2-NZ 3.85Å; E763-K849 PolarHBondContact OE2-NZ 2.99Å; Q765-K849 HydrophobicContact CB-CB 4.44Å; Q765-K849 HydrophobicContact CB-CG 3.77Å; Q765-K849 HydrophobicContact CG-CG 4.3Å; K849-E873 HydrophobicContact CB-CB 4.49Å; K849-E873 HydrophobicContact CB-CG 4.44Å; K849-E873 VanDerWaalsContact CD-OE1 3.28Å; K849-E873 WeakPolarHBondContact CD-OE1 3.25Å
850	G	65.2	Low	65	Low	1 Å²	1	56.4 Å²	56.4	1%	0.01	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.1	0.1	-173.6	0	0	0	0	0	115.2
851	C	66.5	Low	62.8	Low	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-100.6	137.6	177.3	-173.8	0	0	0	0	112	Q765 L848 M853 F869 Y877	Q765-C851 PolarHBondContact OE1-O 3.49Å; L848-C851 WeakPolarHBondContact O-CB 3.32Å; L848-C851 PolarHBondContact O-N 3.49Å; C851-M853 HydrophobicContact CB-CE 4.26Å; C851-M853 WeakPolarHBondContact O-CE 3.35Å; C851-F869 WeakPolarHBondContact O-CZ 3.45Å; C851-Y877 HydrophobicContact CB-CD2 4.1Å; C851-Y877 HydrophobicContact CB-CE2 3.67Å; C851-Y877 PolarHBondContact SG-OH 3.22Å
852	T	59.8	Low	60.3	Low	34 Å²	34	64.9 Å²	64.9	21%	0.209	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-78.1	124.2	169.1	49.1	0	0	0	0	110.9	S684 F869	S684-T852 PolarHBondContact O-OG1 2.88Å; T852-F869 HydrophobicContact CG2-CE2 4.18Å
853	M	61.9	Low	57.8	Low	63 Å²	63	69.8 Å²	69.8	31%	0.31	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-62.4	140.7	176.1	-57.3	-54.7	103.9	0	0	111.3	Q765 A766 H847 C851	Q765-M853 HydrophobicContact CG-CE 4.45Å; A766-M853 HydrophobicContact CB-SD 4.2Å; H847-M853 HydrophobicContact CB-CE 3.58Å; H847-M853 HydrophobicContact CB-SD 3.68Å; H847-M853 VanDerWaalsContact CG-SD 3.58Å; C851-M853 HydrophobicContact CB-CE 4.26Å; C851-M853 WeakPolarHBondContact O-CE 3.35Å
854	K	51.1	Low	55.3	Low	67 Å²	67	73 Å²	73	29%	0.291	37%	0.369	S	S	.	.			trans	-82	-23.4	176.9	-77.1	178.4	172.8	170.6	0	113.3	H681 E683	H681-K854 PolarHBondContact CE1-NZ 2.98Å; H681-K854 VanDerWaalsContact CE1-NZ 3.29Å; H681-K854 VanDerWaalsContact NE2-CE 3.33Å; H681-K854 WeakPolarHBondContact NE2-CE 3.27Å; H681-K854 PolarHBondContact NE2-NZ 2.94Å; E683-K854 IonicContact OE2-NZ 2.77Å; E683-K854 PolarHBondContact OE2-NZ 3.25Å
855	F	52.3	Low	53	Low	94 Å²	94	81.8 Å²	81.8	41%	0.412	41%	0.41	S	S	.	.	S	Bend	trans	-77.3	136.9	-173.7	-58	-70.9	0	0	0	113.2	Q768 H847 L857	Q768-F855 VanDerWaalsContact OE1-CE2 3.24Å; H847-F855 AromaticContact NE2-CE2 3.85Å; F855-L857 PolarHBondContact O-N 3.03Å
856	P	36.3	Very low	50.7	Low	104 Å²	104	86.1 Å²	86.1	68%	0.675	43%	0.43	S	S	*	.			trans	-79.2	105.5	175.2	31.5	-31.9	0	0	0	110.7	Q858	P856-Q858 PolarHBondContact O-N 2.88Å; P856-Q858 VanDerWaalsContact O-N 3.16Å
857	L	42.4	Very low	48.9	Very low	107 Å²	107	92.2 Å²	92.2	56%	0.56	46%	0.459	S	S	*	.	S	Bend	trans	-55.6	116.9	159	-65.1	171.3	0	0	0	108.2	L809 F855 P864	L809-L857 HydrophobicContact CD1-CD2 3.47Å; L809-L857 VanDerWaalsContact CD1-CD2 3.47Å; F855-L857 PolarHBondContact O-N 3.03Å; L857-P864 HydrophobicContact CD1-CG 3.84Å
858	Q	36.6	Very low	47.5	Very low	119 Å²	119	98.2 Å²	98.2	56%	0.556	50%	0.496	S	S	*	.			trans	25.3	114.9	176.2	-62.6	-171.9	2.3	0	0	117.8	P856 D860 Q861	P856-Q858 PolarHBondContact O-N 2.88Å; P856-Q858 VanDerWaalsContact O-N 3.16Å; Q858-D860 PolarHBondContact O-N 3.05Å; Q858-Q861 HydrophobicContact CB-CG 4.29Å; Q858-Q861 PolarHBondContact O-N 3.22Å
859	K	33.4	Very low	46.4	Very low	199 Å²	199	99.8 Å²	99.8	87%	0.865	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	-27.6	-177.6	-79.9	-179.3	176.3	172.9	0	116.1
860	D	35.3	Very low	46.1	Very low	159 Å²	159	104 Å²	104	85%	0.85	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.2	1.1	-167.8	-63.2	-79.2	0	0	0	114.5	Q858	Q858-D860 PolarHBondContact O-N 3.05Å
861	Q	31.4	Very low	46.5	Very low	134 Å²	134	108.9 Å²	108.9	63%	0.626	55%	0.545	S	S	*	.	S	Bend	trans	-91.6	148.7	166.8	-61.2	-153.8	24.2	0	0	110.6	Q858	Q858-Q861 HydrophobicContact CB-CG 4.29Å; Q858-Q861 PolarHBondContact O-N 3.22Å
862	K	26.9	Very low	47.2	Very low	185 Å²	185	115.2 Å²	115.2	80%	0.804	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-57	144.4	162.5	-68.4	176.6	-174.3	167.6	0	107.5	P864	K862-P864 VanDerWaalsContact O-N 3.17Å
863	P	33.2	Very low	48	Very low	115 Å²	115	115.7 Å²	115.7	75%	0.747	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-53.5	128.8	172.8	23.9	-33.4	0	0	0	108.5
864	P	32.5	Very low	48.9	Very low	79 Å²	79	113.8 Å²	113.8	51%	0.513	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-56.2	151.7	173.2	24.4	-32.7	0	0	0	108.9	L857 K862 Q866	L857-P864 HydrophobicContact CD1-CG 3.84Å; K862-P864 VanDerWaalsContact O-N 3.17Å; P864-Q866 PolarHBondContact O-N 2.96Å
865	H	37.8	Very low	50.5	Low	185 Å²	185	111.2 Å²	111.2	86%	0.856	55%	0.552	S	S	*	*	S	Bend	trans	-44.7	129.2	-169.7	-73.5	-104.8	0	0	0	111.1	H867	H865-H867 PolarHBondContact O-N 3.39Å
866	Q	36.6	Very low	52.1	Low	122 Å²	122	107.8 Å²	107.8	57%	0.57	54%	0.537	S	S	*	.			trans	-46.5	117.7	-173.6	-71.5	171.1	-100.4	0	0	109.9	P864 V868	P864-Q866 PolarHBondContact O-N 2.96Å; Q866-V868 PolarHBondContact O-N 3.3Å
867	H	48.2	Very low	54.3	Low	129 Å²	129	103.6 Å²	103.6	60%	0.597	51%	0.508	S	S	*	.			trans	-65.2	92	166.4	-83.5	-82.7	0	0	0	107.8	H865 F869	H865-H867 PolarHBondContact O-N 3.39Å; H867-F869 HydrophobicContact CB-CZ 4.38Å; H867-F869 PolarHBondContact O-N 3.23Å
868	V	52.3	Low	56.3	Low	132 Å²	132	98.8 Å²	98.8	80%	0.8	48%	0.483	S	S	*	.			trans	-72	87.3	167.3	-178.9	0	0	0	0	105.8	Q866	Q866-V868 PolarHBondContact O-N 3.3Å
869	F	59.9	Low	58.7	Low	33 Å²	33	93.1 Å²	93.1	15%	0.145	46%	0.457	C	S	.	.			trans	-53	144.8	173.5	-65	-70.4	0	0	0	110.3	C851 T852 H867 Q871 M874	C851-F869 WeakPolarHBondContact O-CZ 3.45Å; T852-F869 HydrophobicContact CG2-CE2 4.18Å; H867-F869 HydrophobicContact CB-CZ 4.38Å; H867-F869 PolarHBondContact O-N 3.23Å; F869-Q871 PolarHBondContact O-N 3.29Å; F869-M874 HydrophobicContact CB-CG 3.73Å; F869-M874 HydrophobicContact CB-SD 4.13Å; F869-M874 HydrophobicContact CG-CG 4.47Å
870	E	68.3	Low	61.2	Low	123 Å²	123	83.9 Å²	83.9	58%	0.575	42%	0.417	S	S	*	.			trans	-64.1	139.9	169.2	-70.9	-163.4	172.1	0	0	109.3	K872 E873 M874	E870-K872 HydrophobicContact CB-CB 4.42Å; E870-K872 PolarHBondContact O-N 3.21Å; E870-E873 HydrophobicContact CB-CG 4.14Å; E870-E873 PolarHBondContact N-OE2 2.94Å; E870-E873 VanDerWaalsContact N-OE2 3.09Å; E870-E873 WeakPolarHBondContact O-CB 3.48Å; E870-E873 PolarHBondContact O-N 3.03Å; E870-M874 PolarHBondContact O-N 2.82Å; E870-M874 VanDerWaalsContact O-N 3.17Å
871	Q	75	Confident	63.5	Low	103 Å²	103	77.6 Å²	77.6	48%	0.481	39%	0.39	S	S	.	.	H	α-helix	trans	-57.6	-25.6	177	-61	176	-1.1	0	0	111.7	F869 L875 R897 I922	F869-Q871 PolarHBondContact O-N 3.29Å; Q871-L875 VanDerWaalsContact O-CB 3.29Å; Q871-L875 WeakPolarHBondContact O-CB 3.39Å; Q871-L875 PolarHBondContact O-N 3.16Å; Q871-R897 VanDerWaalsContact CD-NH2 3.3Å; Q871-I922 HydrophobicContact CB-CG2 4.48Å
872	K	79.5	Confident	66	Low	134 Å²	134	72 Å²	72	58%	0.583	37%	0.366	S	S	*	.	H	α-helix	trans	-66.5	-40	173.6	-167.7	179.1	-179.7	-174.2	0	112.5	E870 K876	E870-K872 HydrophobicContact CB-CB 4.42Å; E870-K872 PolarHBondContact O-N 3.21Å; K872-K876 WeakPolarHBondContact O-CG 3.41Å; K872-K876 PolarHBondContact O-N 3.21Å
873	E	77.9	Confident	68.8	Low	43 Å²	43	63.3 Å²	63.3	20%	0.201	33%	0.328	C	S	.	.	H	α-helix	trans	-69.6	-48.2	175.8	-62.4	176.2	129.6	0	0	111.3	K849 E870 L875 K876 Y877	K849-E873 HydrophobicContact CB-CB 4.49Å; K849-E873 HydrophobicContact CB-CG 4.44Å; K849-E873 VanDerWaalsContact CD-OE1 3.28Å; K849-E873 WeakPolarHBondContact CD-OE1 3.25Å; E870-E873 HydrophobicContact CB-CG 4.14Å; E870-E873 PolarHBondContact N-OE2 2.94Å; E870-E873 VanDerWaalsContact N-OE2 3.09Å; E870-E873 WeakPolarHBondContact O-CB 3.48Å; E870-E873 PolarHBondContact O-N 3.03Å; E873-L875 PolarHBondContact O-N 3.25Å; E873-K876 WeakPolarHBondContact O-CB 3.46Å; E873-K876 PolarHBondContact O-N 2.96Å; E873-K876 VanDerWaalsContact O-N 3.08Å; E873-Y877 PolarHBondContact O-N 2.78Å
874	M	80.1	Confident	71.4	Confident	24 Å²	24	58.2 Å²	58.2	12%	0.118	29%	0.294	C	S	.	.	H	α-helix	trans	-59	-33.8	176.6	-59	-176.2	72.9	0	0	111.6	I685 F869 E870 Y877 V878 I922	I685-M874 HydrophobicContact CD1-CE 3.99Å; I685-M874 HydrophobicContact CG1-CE 4.39Å; I685-M874 HydrophobicContact CG2-CE 3.7Å; F869-M874 HydrophobicContact CB-CG 3.73Å; F869-M874 HydrophobicContact CB-SD 4.13Å; F869-M874 HydrophobicContact CG-CG 4.47Å; E870-M874 PolarHBondContact O-N 2.82Å; E870-M874 VanDerWaalsContact O-N 3.17Å; M874-Y877 PolarHBondContact O-N 3.45Å; M874-V878 PolarHBondContact O-N 3Å; M874-V878 VanDerWaalsContact O-N 3.1Å; M874-I922 HydrophobicContact CB-CD1 4.1Å; M874-I922 HydrophobicContact CB-CG1 3.99Å; M874-I922 HydrophobicContact CB-CG2 4.41Å; M874-I922 HydrophobicContact CE-CG1 4.35Å
875	L	84.7	Confident	74.1	Confident	12 Å²	12	55.4 Å²	55.4	6%	0.063	28%	0.276	C	S	.	.	H	α-helix	trans	-72.7	-37.7	175.5	-163.3	65.4	0	0	0	113	Q871 E873 Y877 V878 C879 L886 L889 L893 L919 I922	Q871-L875 VanDerWaalsContact O-CB 3.29Å; Q871-L875 WeakPolarHBondContact O-CB 3.39Å; Q871-L875 PolarHBondContact O-N 3.16Å; E873-L875 PolarHBondContact O-N 3.25Å; L875-Y877 VanDerWaalsContact C-N 3.32Å; L875-Y877 PolarHBondContact O-N 2.89Å; L875-V878 PolarHBondContact O-N 2.96Å; L875-C879 WeakPolarHBondContact O-CB 3.48Å; L875-C879 PolarHBondContact O-N 2.9Å; L875-L886 HydrophobicContact CB-CD1 4.17Å; L875-L886 HydrophobicContact CD2-CD1 3.83Å; L875-L886 HydrophobicContact CG-CD1 3.75Å; L875-L889 HydrophobicContact CD1-CB 3.68Å; L875-L889 HydrophobicContact CD1-CD1 4.49Å; L875-L889 HydrophobicContact CD2-CB 4.41Å; L875-L889 HydrophobicContact CG-CB 4.16Å; L875-L893 HydrophobicContact CD1-CD1 3.59Å; L875-L893 HydrophobicContact CD1-CG 4.18Å; L875-L893 HydrophobicContact CD2-CD1 4.3Å; L875-L893 HydrophobicContact CG-CD1 4.42Å; L875-L919 HydrophobicContact CD1-CD2 4.48Å; L875-I922 HydrophobicContact CD1-CD1 4.04Å
876	K	85.3	Confident	76.5	Confident	23 Å²	23	47.9 Å²	47.9	10%	0.1	24%	0.242	C	C	.	.	H	α-helix	trans	-58.9	-43	170	-74.8	172.5	173.6	179.5	0	111.3	L759 S761 L762 K872 E873 C879 F880 L886	L759-K876 HydrophobicContact CD2-CB 4.21Å; L759-K876 HydrophobicContact CD2-CG 4.37Å; S761-K876 PolarHBondContact O-NZ 3.5Å; S761-K876 WeakPolarHBondContact OG-CE 3.36Å; S761-K876 PolarHBondContact OG-NZ 2.76Å; L762-K876 HydrophobicContact CD1-CB 4.04Å; K872-K876 WeakPolarHBondContact O-CG 3.41Å; K872-K876 PolarHBondContact O-N 3.21Å; E873-K876 WeakPolarHBondContact O-CB 3.46Å; E873-K876 PolarHBondContact O-N 2.96Å; E873-K876 VanDerWaalsContact O-N 3.08Å; K876-C879 WeakPolarHBondContact O-CB 3.31Å; K876-C879 PolarHBondContact O-N 3.41Å; K876-F880 PolarHBondContact O-N 3.48Å; K876-L886 HydrophobicContact CG-CD1 4.37Å
877	Y	83.7	Confident	79	Confident	15 Å²	15	46.8 Å²	46.8	6%	0.059	24%	0.239	C	C	.	.	H	α-helix	trans	-61.3	-43.6	175.9	-177.9	-99.4	0	0	0	112.5	H681 T682 E683 I685 L848 C851 E873 M874 L875 F880 G881	H681-Y877 PolarHBondContact O-OH 3.23Å; T682-Y877 VanDerWaalsContact CA-OH 3.26Å; T682-Y877 WeakPolarHBondContact CA-OH 3.14Å; E683-Y877 PolarHBondContact N-OH 2.96Å; I685-Y877 HydrophobicContact CD1-CD1 3.99Å; I685-Y877 HydrophobicContact CD1-CE1 4.28Å; I685-Y877 HydrophobicContact CG1-CD1 4.26Å; I685-Y877 HydrophobicContact CG1-CE1 4.13Å; L848-Y877 HydrophobicContact CB-CD2 4.25Å; L848-Y877 HydrophobicContact CD1-CD2 4.46Å; C851-Y877 HydrophobicContact CB-CD2 4.1Å; C851-Y877 HydrophobicContact CB-CE2 3.67Å; C851-Y877 PolarHBondContact SG-OH 3.22Å; E873-Y877 PolarHBondContact O-N 2.78Å; M874-Y877 PolarHBondContact O-N 3.45Å; L875-Y877 VanDerWaalsContact C-N 3.32Å; L875-Y877 PolarHBondContact O-N 2.89Å; Y877-F880 PolarHBondContact O-N 3.22Å; Y877-G881 PolarHBondContact O-N 2.93Å
878	V	84	Confident	81	Confident	6 Å²	6	42.5 Å²	42.5	4%	0.036	22%	0.222	C	C	.	.	H	α-helix	trans	-69.7	-34.4	175.1	173.2	0	0	0	0	112.2	I685 M874 L875 G881 S882 L889 D918 I922	I685-V878 HydrophobicContact CD1-CG2 4.37Å; M874-V878 PolarHBondContact O-N 3Å; M874-V878 VanDerWaalsContact O-N 3.1Å; L875-V878 PolarHBondContact O-N 2.96Å; V878-G881 PolarHBondContact O-N 3.5Å; V878-S882 WeakPolarHBondContact O-CB 3.46Å; V878-S882 PolarHBondContact O-N 3.37Å; V878-S882 PolarHBondContact O-OG 3Å; V878-L889 HydrophobicContact CG1-CD1 4.27Å; V878-D918 HydrophobicContact CG1-CB 4.06Å; V878-D918 HydrophobicContact CG2-CB 4.02Å; V878-I922 HydrophobicContact CB-CD1 4.31Å; V878-I922 HydrophobicContact CG2-CD1 3.8Å
879	C	87.6	Confident	82.8	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-56.7	-52.8	170.8	-178.3	0	0	0	0	110.9	L757 L759 L875 K876 G881 S882 L883 I884 L886 L889	L757-C879 PolarHBondContact O-SG 3.33Å; L757-C879 VanDerWaalsContact O-SG 3.41Å; L759-C879 HydrophobicContact CD2-CB 4.09Å; L875-C879 WeakPolarHBondContact O-CB 3.48Å; L875-C879 PolarHBondContact O-N 2.9Å; K876-C879 WeakPolarHBondContact O-CB 3.31Å; K876-C879 PolarHBondContact O-N 3.41Å; C879-G881 PolarHBondContact O-N 2.93Å; C879-S882 PolarHBondContact O-N 3.32Å; C879-L883 WeakPolarHBondContact O-CA 3.2Å; C879-L883 PolarHBondContact O-N 3.19Å; C879-I884 PolarHBondContact SG-O 2.91Å; C879-L886 HydrophobicContact CB-CD1 4.34Å; C879-L889 VanDerWaalsContact CA-CD1 3.49Å; C879-L889 HydrophobicContact CB-CD1 3.82Å
880	F	86	Confident	84.2	Confident	5 Å²	5	36.8 Å²	36.8	2%	0.022	19%	0.192	C	C	.	.	H	α-helix	trans	-58.5	-45	177.1	-178.5	-89.5	0	0	0	113.2	V680 T682 F720 I722 Y747 L759 L762 L848 K876 Y877	V680-F880 HydrophobicContact CB-CE1 4.28Å; V680-F880 HydrophobicContact CB-CZ 4.38Å; V680-F880 HydrophobicContact CG1-CD1 4.33Å; V680-F880 HydrophobicContact CG1-CE1 3.58Å; V680-F880 HydrophobicContact CG1-CZ 4.09Å; T682-F880 HydrophobicContact CG2-CD1 3.92Å; T682-F880 HydrophobicContact CG2-CE1 3.72Å; F720-F880 HydrophobicContact CD2-CE1 4.11Å; I722-F880 HydrophobicContact CD1-CE2 4.42Å; I722-F880 HydrophobicContact CD1-CZ 3.94Å; Y747-F880 AromaticContact CD1-CE2 3.93Å; Y747-F880 HydrophobicContact CD1-CE2 3.93Å; Y747-F880 HydrophobicContact CD1-CZ 4.23Å; Y747-F880 AromaticContact CE1-CE2 3.55Å; Y747-F880 HydrophobicContact CE1-CE2 3.55Å; Y747-F880 AromaticContact CE1-CZ 3.55Å; Y747-F880 HydrophobicContact CE1-CZ 3.55Å; L759-F880 HydrophobicContact CD1-CB 4.3Å; L759-F880 HydrophobicContact CD1-CD2 4.48Å; L762-F880 HydrophobicContact CD2-CD2 3.8Å; L762-F880 HydrophobicContact CD2-CE2 4.39Å; L762-F880 HydrophobicContact CD2-CG 4.36Å; L848-F880 HydrophobicContact CD1-CD1 3.98Å; L848-F880 HydrophobicContact CD1-CD2 4.47Å; L848-F880 HydrophobicContact CD1-CE1 4.24Å; L848-F880 HydrophobicContact CD1-CG 4.12Å; K876-F880 PolarHBondContact O-N 3.48Å; Y877-F880 PolarHBondContact O-N 3.22Å
881	G	82.6	Confident	85.3	Confident	28 Å²	28	34.5 Å²	34.5	29%	0.289	19%	0.186	S	C	.	.	H	α-helix	trans	-69.8	-37.2	179.9	0	0	0	0	0	114.2	Y877 V878 C879 R1039	Y877-G881 PolarHBondContact O-N 2.93Å; V878-G881 PolarHBondContact O-N 3.5Å; C879-G881 PolarHBondContact O-N 2.93Å; G881-R1039 PolarHBondContact O-NH1 3.31Å; G881-R1039 VanDerWaalsContact O-NH1 3.15Å
882	S	83.6	Confident	86.1	Confident	17 Å²	17	30.5 Å²	30.5	12%	0.119	17%	0.167	C	C	.	.	H	α-helix	trans	-95.7	-18.7	-172.3	68.7	0	0	0	0	115.3	V878 C879 I884 Y1032	V878-S882 WeakPolarHBondContact O-CB 3.46Å; V878-S882 PolarHBondContact O-N 3.37Å; V878-S882 PolarHBondContact O-OG 3Å; C879-S882 PolarHBondContact O-N 3.32Å; S882-I884 VanDerWaalsContact C-N 3.29Å; S882-I884 PolarHBondContact O-N 3.25Å; S882-Y1032 WeakPolarHBondContact O-CE2 3.44Å
883	L	86.2	Confident	86.6	Confident	2 Å²	2	24.5 Å²	24.5	1%	0.01	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	32.1	-175.1	-51.6	175.8	0	0	0	114	L751 L757 C879 Y1032 R1035 R1039	L751-L883 HydrophobicContact CD1-CD2 4.16Å; L757-L883 HydrophobicContact CD1-CD2 4.42Å; C879-L883 WeakPolarHBondContact O-CA 3.2Å; C879-L883 PolarHBondContact O-N 3.19Å; L883-Y1032 HydrophobicContact CB-CE2 4.46Å; L883-R1035 HydrophobicContact CB-CB 4.32Å; L883-R1035 HydrophobicContact CD1-CB 4.27Å; L883-R1039 HydrophobicContact CD1-CB 4.4Å
884	I	87.1	Confident	87.2	Confident	7 Å²	7	25.3 Å²	25.3	4%	0.036	15%	0.151	C	C	.	.			trans	-109.9	131.5	176.2	-57.9	160.1	0	0	0	108.4	C879 S882 T888 L889 L915 Y1032	C879-I884 PolarHBondContact SG-O 2.91Å; S882-I884 VanDerWaalsContact C-N 3.29Å; S882-I884 PolarHBondContact O-N 3.25Å; I884-T888 HydrophobicContact CG2-CG2 3.91Å; I884-L889 HydrophobicContact CB-CD1 4.28Å; I884-L889 HydrophobicContact CB-CD2 3.93Å; I884-L889 HydrophobicContact CB-CG 4.02Å; I884-L889 HydrophobicContact CD1-CD2 4.08Å; I884-L889 HydrophobicContact CG2-CD2 3.81Å; I884-L889 HydrophobicContact CG2-CG 3.87Å; I884-L889 WeakPolarHBondContact O-CD1 3.21Å; I884-L915 HydrophobicContact CD1-CD1 3.85Å; I884-L915 HydrophobicContact CD1-CD2 3.82Å; I884-L915 HydrophobicContact CD1-CG 4.35Å; I884-Y1032 HydrophobicContact CG1-CE2 4.44Å
885	P	89.6	Confident	87.6	Confident	20 Å²	20	25.1 Å²	25.1	13%	0.13	15%	0.152	C	C	.	.			trans	-48.5	138.7	-179.5	-33.4	37.8	0	0	0	115.3	Q756 I887 T888 L889	Q756-P885 WeakPolarHBondContact O-CB 3.48Å; P885-I887 HydrophobicContact CB-CG2 4.21Å; P885-I887 PolarHBondContact O-N 2.96Å; P885-T888 WeakPolarHBondContact O-CA 3.34Å; P885-T888 WeakPolarHBondContact O-CB 3.45Å; P885-T888 PolarHBondContact O-N 2.88Å; P885-L889 PolarHBondContact O-N 3.46Å
886	L	88.9	Confident	87.8	Confident	28 Å²	28	24.6 Å²	24.6	15%	0.147	15%	0.149	C	C	.	.	H	α-helix	trans	-55.4	-39.4	-178.6	-173.6	67.4	0	0	0	112.6	L757 Q758 L875 K876 C879 T888 L889 S890	L757-L886 WeakPolarHBondContact O-CB 3.38Å; Q758-L886 HydrophobicContact CB-CB 4.33Å; Q758-L886 HydrophobicContact CB-CD2 4.47Å; L875-L886 HydrophobicContact CB-CD1 4.17Å; L875-L886 HydrophobicContact CD2-CD1 3.83Å; L875-L886 HydrophobicContact CG-CD1 3.75Å; K876-L886 HydrophobicContact CG-CD1 4.37Å; C879-L886 HydrophobicContact CB-CD1 4.34Å; L886-T888 VanDerWaalsContact C-N 3.33Å; L886-T888 PolarHBondContact O-N 2.83Å; L886-L889 PolarHBondContact O-N 3.29Å; L886-S890 WeakPolarHBondContact O-CB 3.39Å; L886-S890 PolarHBondContact O-N 2.74Å; L886-S890 PolarHBondContact O-OG 2.66Å
887	I	89.2	Confident	87.9	Confident	99 Å²	99	27.6 Å²	27.6	51%	0.508	16%	0.16	S	C	.	.	H	α-helix	trans	-66.9	-30.4	177.2	-164.6	165.7	0	0	0	113.5	P885 S890 T891	P885-I887 HydrophobicContact CB-CG2 4.21Å; P885-I887 PolarHBondContact O-N 2.96Å; I887-S890 WeakPolarHBondContact CA-OG 3.47Å; I887-S890 PolarHBondContact O-OG 2.94Å; I887-S890 VanDerWaalsContact O-OG 3.05Å; I887-T891 WeakPolarHBondContact O-CB 3.41Å; I887-T891 PolarHBondContact O-N 2.87Å; I887-T891 PolarHBondContact O-OG1 3.13Å
888	T	89.5	Confident	88	Confident	39 Å²	39	33.1 Å²	33.1	24%	0.239	19%	0.19	C	C	.	.	H	α-helix	trans	-76.1	-44.2	175.4	-59	0	0	0	0	110	I884 P885 L886 S890 T891 Y892	I884-T888 HydrophobicContact CG2-CG2 3.91Å; P885-T888 WeakPolarHBondContact O-CA 3.34Å; P885-T888 WeakPolarHBondContact O-CB 3.45Å; P885-T888 PolarHBondContact O-N 2.88Å; L886-T888 VanDerWaalsContact C-N 3.33Å; L886-T888 PolarHBondContact O-N 2.83Å; T888-S890 PolarHBondContact O-N 2.77Å; T888-T891 WeakPolarHBondContact O-CB 3.37Å; T888-T891 PolarHBondContact O-N 2.74Å; T888-Y892 HydrophobicContact CG2-CD1 4.28Å; T888-Y892 HydrophobicContact CG2-CE1 3.64Å; T888-Y892 HydrophobicContact CG2-CE2 4.07Å; T888-Y892 WeakPolarHBondContact O-CD1 3.42Å; T888-Y892 VanDerWaalsContact O-CG 3.31Å; T888-Y892 PolarHBondContact O-N 3.05Å
889	L	89.9	Confident	88	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.8	-37.9	176.6	-66.6	176.9	0	0	0	112.8	L875 V878 C879 I884 P885 L886 Y892 L893 L915 L919	L875-L889 HydrophobicContact CD1-CB 3.68Å; L875-L889 HydrophobicContact CD1-CD1 4.49Å; L875-L889 HydrophobicContact CD2-CB 4.41Å; L875-L889 HydrophobicContact CG-CB 4.16Å; V878-L889 HydrophobicContact CG1-CD1 4.27Å; C879-L889 VanDerWaalsContact CA-CD1 3.49Å; C879-L889 HydrophobicContact CB-CD1 3.82Å; I884-L889 HydrophobicContact CB-CD1 4.28Å; I884-L889 HydrophobicContact CB-CD2 3.93Å; I884-L889 HydrophobicContact CB-CG 4.02Å; I884-L889 HydrophobicContact CD1-CD2 4.08Å; I884-L889 HydrophobicContact CG2-CD2 3.81Å; I884-L889 HydrophobicContact CG2-CG 3.87Å; I884-L889 WeakPolarHBondContact O-CD1 3.21Å; P885-L889 PolarHBondContact O-N 3.46Å; L886-L889 PolarHBondContact O-N 3.29Å; L889-Y892 PolarHBondContact O-N 2.91Å; L889-L893 PolarHBondContact O-N 2.96Å; L889-L915 HydrophobicContact CD2-CD1 3.55Å; L889-L919 HydrophobicContact CD2-CD2 4.41Å
890	S	90.1	Very high	87.8	Confident	44 Å²	44	39 Å²	39	31%	0.308	23%	0.228	S	C	.	.	H	α-helix	trans	-67.7	-41.9	175.2	66.5	0	0	0	0	111.3	L886 I887 T888 Y892 L893 S894	L886-S890 WeakPolarHBondContact O-CB 3.39Å; L886-S890 PolarHBondContact O-N 2.74Å; L886-S890 PolarHBondContact O-OG 2.66Å; I887-S890 WeakPolarHBondContact CA-OG 3.47Å; I887-S890 PolarHBondContact O-OG 2.94Å; I887-S890 VanDerWaalsContact O-OG 3.05Å; T888-S890 PolarHBondContact O-N 2.77Å; S890-Y892 VanDerWaalsContact C-N 3.28Å; S890-Y892 PolarHBondContact O-N 3.34Å; S890-L893 PolarHBondContact O-N 2.97Å; S890-S894 PolarHBondContact O-N 3.43Å; S890-S894 PolarHBondContact O-OG 2.72Å
891	T	90.6	Very high	87.8	Confident	75 Å²	75	39.5 Å²	39.5	46%	0.46	23%	0.231	S	C	.	.	H	α-helix	trans	-58.7	-39.2	172.4	-60.7	0	0	0	0	111.8	I887 T888 T895	I887-T891 WeakPolarHBondContact O-CB 3.41Å; I887-T891 PolarHBondContact O-N 2.87Å; I887-T891 PolarHBondContact O-OG1 3.13Å; T888-T891 WeakPolarHBondContact O-CB 3.37Å; T888-T891 PolarHBondContact O-N 2.74Å; T891-T895 VanDerWaalsContact O-CB 3.29Å; T891-T895 WeakPolarHBondContact O-CB 3.49Å; T891-T895 PolarHBondContact O-N 3.32Å; T891-T895 PolarHBondContact O-OG1 3.31Å
892	Y	91.9	Very high	88.1	Confident	19 Å²	19	38.2 Å²	38.2	8%	0.075	22%	0.217	C	C	.	.	H	α-helix	trans	-68.4	-44.1	175.8	-68.9	5.7	0	0	0	111.5	T888 L889 S890 T895 I896 L915 L919 I1020 N1021 H1022	T888-Y892 HydrophobicContact CG2-CD1 4.28Å; T888-Y892 HydrophobicContact CG2-CE1 3.64Å; T888-Y892 HydrophobicContact CG2-CE2 4.07Å; T888-Y892 WeakPolarHBondContact O-CD1 3.42Å; T888-Y892 VanDerWaalsContact O-CG 3.31Å; T888-Y892 PolarHBondContact O-N 3.05Å; L889-Y892 PolarHBondContact O-N 2.91Å; S890-Y892 VanDerWaalsContact C-N 3.28Å; S890-Y892 PolarHBondContact O-N 3.34Å; Y892-T895 PolarHBondContact O-N 3.25Å; Y892-I896 WeakPolarHBondContact O-CD1 3.41Å; Y892-I896 VanDerWaalsContact O-CG1 3.27Å; Y892-I896 WeakPolarHBondContact O-CG1 3.42Å; Y892-I896 PolarHBondContact O-N 2.92Å; Y892-L915 HydrophobicContact CD2-CD2 4.07Å; Y892-L915 HydrophobicContact CE2-CD2 4Å; Y892-L919 HydrophobicContact CD2-CD1 4.49Å; Y892-I1020 HydrophobicContact CD1-CD1 4.23Å; Y892-I1020 HydrophobicContact CD1-CG2 3.58Å; Y892-I1020 HydrophobicContact CD2-CG2 4.17Å; Y892-I1020 HydrophobicContact CE1-CG2 3.31Å; Y892-I1020 HydrophobicContact CE2-CG2 3.93Å; Y892-I1020 HydrophobicContact CG-CD1 4.17Å; Y892-I1020 HydrophobicContact CG-CG2 4.02Å; Y892-I1020 VanDerWaalsContact CZ-CG2 3.49Å; Y892-N1021 PolarHBondContact OH-O 3.22Å; Y892-N1021 VanDerWaalsContact OH-O 3.05Å; Y892-H1022 AromaticContact CE2-ND1 3.78Å; Y892-H1022 WeakPolarHBondContact OH-CA 3.26Å
893	L	90.2	Very high	88.3	Confident	8 Å²	8	37.5 Å²	37.5	4%	0.042	21%	0.212	C	C	.	.	H	α-helix	trans	-60.5	-47.6	175.2	-80.1	-173.8	0	0	0	112.5	L875 L889 S890 T895 I896 R897 L919 I922 L923	L875-L893 HydrophobicContact CD1-CD1 3.59Å; L875-L893 HydrophobicContact CD1-CG 4.18Å; L875-L893 HydrophobicContact CD2-CD1 4.3Å; L875-L893 HydrophobicContact CG-CD1 4.42Å; L889-L893 PolarHBondContact O-N 2.96Å; S890-L893 PolarHBondContact O-N 2.97Å; L893-T895 VanDerWaalsContact C-N 3.32Å; L893-T895 PolarHBondContact O-N 3.12Å; L893-I896 PolarHBondContact O-N 2.84Å; L893-R897 VanDerWaalsContact O-CG 3.28Å; L893-R897 WeakPolarHBondContact O-CG 3.47Å; L893-R897 PolarHBondContact O-N 3.22Å; L893-L919 HydrophobicContact CD2-CB 4.1Å; L893-L919 HydrophobicContact CD2-CD2 3.71Å; L893-L919 HydrophobicContact CD2-CG 4.45Å; L893-L919 HydrophobicContact CG-CD2 3.88Å; L893-I922 HydrophobicContact CD1-CB 4.45Å; L893-I922 HydrophobicContact CD1-CD1 4.49Å; L893-I922 HydrophobicContact CD1-CG2 3.84Å; L893-I922 HydrophobicContact CD2-CB 4.44Å; L893-L923 HydrophobicContact CD2-CD1 4.23Å; L893-L923 HydrophobicContact CD2-CD2 4Å; L893-L923 HydrophobicContact CD2-CG 3.86Å
894	S	89.9	Confident	88.5	Confident	60 Å²	60	37.4 Å²	37.4	42%	0.42	21%	0.211	S	C	.	.	H	α-helix	trans	-59.1	-45.8	175.8	-60.5	0	0	0	0	110.7	S890 I896 R897 D898	S890-S894 PolarHBondContact O-N 3.43Å; S890-S894 PolarHBondContact O-OG 2.72Å; S894-I896 VanDerWaalsContact C-N 3.29Å; S894-I896 PolarHBondContact O-N 3.28Å; S894-R897 WeakPolarHBondContact O-CA 3.27Å; S894-R897 WeakPolarHBondContact O-CB 3.38Å; S894-R897 PolarHBondContact O-N 2.79Å; S894-D898 PolarHBondContact O-N 3Å
895	T	89.8	Confident	88.4	Confident	20 Å²	20	37.4 Å²	37.4	12%	0.123	21%	0.211	C	C	.	.	H	α-helix	trans	-57.5	-39.6	176.7	-61.9	0	0	0	0	112.9	T891 Y892 L893 N899 V902 K1018 I1020	T891-T895 VanDerWaalsContact O-CB 3.29Å; T891-T895 WeakPolarHBondContact O-CB 3.49Å; T891-T895 PolarHBondContact O-N 3.32Å; T891-T895 PolarHBondContact O-OG1 3.31Å; Y892-T895 PolarHBondContact O-N 3.25Å; L893-T895 VanDerWaalsContact C-N 3.32Å; L893-T895 PolarHBondContact O-N 3.12Å; T895-N899 PolarHBondContact O-N 3.03Å; T895-N899 PolarHBondContact O-ND2 2.77Å; T895-V902 HydrophobicContact CG2-CG1 4.35Å; T895-V902 HydrophobicContact CG2-CG2 4.5Å; T895-K1018 HydrophobicContact CG2-CD 4.1Å; T895-K1018 VanDerWaalsContact CG2-CE 3.49Å; T895-K1018 HydrophobicContact CG2-CG 3.47Å; T895-K1018 VanDerWaalsContact CG2-CG 3.47Å; T895-I1020 HydrophobicContact CG2-CD1 3.75Å; T895-I1020 HydrophobicContact CG2-CG1 3.73Å
896	I	89	Confident	87.9	Confident	2 Å²	2	36.7 Å²	36.7	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-77.9	-21	176.6	-58.8	160.2	0	0	0	112.2	Y892 L893 S894 V902 L919 L923 V998 I1020	Y892-I896 WeakPolarHBondContact O-CD1 3.41Å; Y892-I896 VanDerWaalsContact O-CG1 3.27Å; Y892-I896 WeakPolarHBondContact O-CG1 3.42Å; Y892-I896 PolarHBondContact O-N 2.92Å; L893-I896 PolarHBondContact O-N 2.84Å; S894-I896 VanDerWaalsContact C-N 3.29Å; S894-I896 PolarHBondContact O-N 3.28Å; I896-V902 HydrophobicContact CB-CG2 4.49Å; I896-V902 HydrophobicContact CG1-CB 4.13Å; I896-V902 HydrophobicContact CG1-CG1 3.97Å; I896-V902 HydrophobicContact CG1-CG2 4.2Å; I896-L919 HydrophobicContact CD1-CD1 3.95Å; I896-L923 HydrophobicContact CB-CD1 4.05Å; I896-L923 HydrophobicContact CG2-CD1 3.38Å; I896-V998 HydrophobicContact CD1-CG1 4.25Å; I896-V998 HydrophobicContact CG2-CG2 3.64Å; I896-I1020 HydrophobicContact CD1-CD1 4.47Å; I896-I1020 HydrophobicContact CG1-CD1 4.2Å
897	R	86	Confident	87.2	Confident	86 Å²	86	35.9 Å²	35.9	33%	0.325	20%	0.204	S	C	.	.	H	α-helix	trans	-73.4	-45.9	171.8	-74.1	166.8	-174.4	-158.7	-4.1	111.4	Q871 L893 S894 N899 L923 K996	Q871-R897 VanDerWaalsContact CD-NH2 3.3Å; L893-R897 VanDerWaalsContact O-CG 3.28Å; L893-R897 WeakPolarHBondContact O-CG 3.47Å; L893-R897 PolarHBondContact O-N 3.22Å; S894-R897 WeakPolarHBondContact O-CA 3.27Å; S894-R897 WeakPolarHBondContact O-CB 3.38Å; S894-R897 PolarHBondContact O-N 2.79Å; R897-N899 VanDerWaalsContact C-N 3.34Å; R897-N899 PolarHBondContact O-N 2.71Å; R897-L923 HydrophobicContact CG-CD2 3.72Å; R897-K996 PolarHBondContact O-NZ 3.35Å
898	D	86.5	Confident	86.3	Confident	130 Å²	130	35 Å²	35	70%	0.695	21%	0.207	S	C	*	.	H	α-helix	trans	-75.4	-19.9	-172.1	-56.6	-22.7	0	0	0	113.9	S894	S894-D898 PolarHBondContact O-N 3Å
899	N	84.7	Confident	85.2	Confident	50 Å²	50	34.1 Å²	34.1	27%	0.267	21%	0.206	S	C	.	.			trans	-121.5	137.7	-171.8	-62.9	-93.9	0	0	0	111.1	T895 R897 V902 K1018	T895-N899 PolarHBondContact O-N 3.03Å; T895-N899 PolarHBondContact O-ND2 2.77Å; R897-N899 VanDerWaalsContact C-N 3.34Å; R897-N899 PolarHBondContact O-N 2.71Å; N899-V902 HydrophobicContact CB-CG2 3.6Å; N899-K1018 HydrophobicContact CB-CB 4.08Å
900	S	81.9	Confident	84.3	Confident	80 Å²	80	34.2 Å²	34.2	56%	0.559	21%	0.207	S	C	*	.	S	Bend	trans	-73	-28.6	178.2	53.7	0	0	0	0	113.6	I997	S900-I997 PolarHBondContact O-N 3.08Å
901	I	85.6	Confident	83.6	Confident	16 Å²	16	33 Å²	33	8%	0.082	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	122.8	177.1	-48.5	-177.2	0	0	0	108.3	F985 I997 I1017	I901-F985 HydrophobicContact CD1-CD1 4.13Å; I901-F985 HydrophobicContact CG2-CD1 4.28Å; I901-F985 HydrophobicContact CG2-CE1 3.9Å; I901-I997 WeakPolarHBondContact CA-O 3.43Å; I901-I997 HydrophobicContact CD1-CD1 4.41Å; I901-I997 HydrophobicContact CG1-CB 4.31Å; I901-I997 HydrophobicContact CG1-CD1 4.3Å; I901-I997 HydrophobicContact CG2-CB 4.25Å; I901-I997 HydrophobicContact CG2-CG2 4.24Å; I901-I1017 HydrophobicContact CB-CG1 4.47Å; I901-I1017 HydrophobicContact CB-CG2 4.06Å; I901-I1017 HydrophobicContact CG2-CD1 4.44Å; I901-I1017 HydrophobicContact CG2-CG1 4.44Å; I901-I1017 HydrophobicContact CG2-CG2 3.66Å
902	V	88.9	Confident	83.4	Confident	1 Å²	1	30 Å²	30	1%	0.006	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	141	175.9	-179.1	0	0	0	0	109.6	T895 I896 N899 I997 V998 G999 K1018 I1020	T895-V902 HydrophobicContact CG2-CG1 4.35Å; T895-V902 HydrophobicContact CG2-CG2 4.5Å; I896-V902 HydrophobicContact CB-CG2 4.49Å; I896-V902 HydrophobicContact CG1-CB 4.13Å; I896-V902 HydrophobicContact CG1-CG1 3.97Å; I896-V902 HydrophobicContact CG1-CG2 4.2Å; N899-V902 HydrophobicContact CB-CG2 3.6Å; V902-I997 PolarHBondContact N-O 3.5Å; V902-V998 CarbonylContact O-C 3.52Å; V902-V998 WeakPolarHBondContact O-CA 3.28Å; V902-G999 PolarHBondContact O-N 3.04Å; V902-K1018 VanDerWaalsContact CA-O 3.32Å; V902-K1018 WeakPolarHBondContact CA-O 3.46Å; V902-K1018 HydrophobicContact CG2-CB 4.26Å; V902-K1018 HydrophobicContact CG2-CG 4.48Å; V902-I1020 HydrophobicContact CG1-CD1 3.56Å; V902-I1020 HydrophobicContact CG1-CG1 3.78Å
903	I	88.4	Confident	82.9	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	126.2	174.4	-52.6	-174.9	0	0	0	110.5	Y905 I974 F985 G999 L1012 I1017 K1018 V1019 I1020	I903-Y905 HydrophobicContact CB-CD2 4.3Å; I903-Y905 HydrophobicContact CB-CE2 3.99Å; I903-Y905 HydrophobicContact CG2-CD2 3.81Å; I903-Y905 HydrophobicContact CG2-CE2 3.48Å; I903-Y905 VanDerWaalsContact CG2-CE2 3.48Å; I903-I974 HydrophobicContact CD1-CD1 3.88Å; I903-I974 HydrophobicContact CG1-CD1 4.36Å; I903-I974 HydrophobicContact CG2-CD1 4.25Å; I903-F985 HydrophobicContact CD1-CE1 4.36Å; I903-F985 HydrophobicContact CD1-CZ 3.73Å; I903-G999 WeakPolarHBondContact CA-O 3.49Å; I903-L1012 HydrophobicContact CD1-CD1 3.84Å; I903-L1012 HydrophobicContact CD1-CD2 3.5Å; I903-L1012 VanDerWaalsContact CD1-CD2 3.5Å; I903-L1012 HydrophobicContact CD1-CG 4.34Å; I903-I1017 HydrophobicContact CD1-CG2 4.49Å; I903-I1017 HydrophobicContact CG1-CG2 4.36Å; I903-K1018 PolarHBondContact N-O 2.69Å; I903-V1019 WeakPolarHBondContact O-CA 3.5Å; I903-I1020 PolarHBondContact O-N 2.98Å
904	I	89.8	Confident	82.4	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	112.6	176.2	-48.1	-166.5	0	0	0	109.4	K912 L915 V916 L919 G999 T1000 S1001 I1020 H1022	I904-K912 HydrophobicContact CG2-CD 4.04Å; I904-K912 HydrophobicContact CG2-CG 4.22Å; I904-L915 HydrophobicContact CD1-CD2 4.4Å; I904-V916 HydrophobicContact CD1-CG2 3.62Å; I904-V916 HydrophobicContact CG1-CG2 4.07Å; I904-L919 HydrophobicContact CD1-CD1 4.35Å; I904-G999 PolarHBondContact N-O 2.89Å; I904-T1000 WeakPolarHBondContact O-CA 3.17Å; I904-S1001 PolarHBondContact O-N 2.94Å; I904-I1020 CarbonylContact C-O 3.44Å; I904-I1020 WeakPolarHBondContact CA-O 3.42Å; I904-I1020 HydrophobicContact CG1-CB 4.32Å; I904-I1020 HydrophobicContact CG1-CD1 4.44Å; I904-I1020 HydrophobicContact CG2-CG2 4.29Å; I904-H1022 HydrophobicContact CG2-CB 3.55Å
905	Y	86.7	Confident	82.3	Confident	8 Å²	8	28.6 Å²	28.6	3%	0.031	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	151.3	176.9	-88	-101.7	0	0	0	111.7	I903 S1001 G1002 L1008 E1009 L1012 V1019 I1020 H1022	I903-Y905 HydrophobicContact CB-CD2 4.3Å; I903-Y905 HydrophobicContact CB-CE2 3.99Å; I903-Y905 HydrophobicContact CG2-CD2 3.81Å; I903-Y905 HydrophobicContact CG2-CE2 3.48Å; I903-Y905 VanDerWaalsContact CG2-CE2 3.48Å; Y905-S1001 WeakPolarHBondContact CA-O 3.49Å; Y905-S1001 WeakPolarHBondContact CE1-OG 3.47Å; Y905-S1001 VanDerWaalsContact CZ-CB 3.5Å; Y905-G1002 WeakPolarHBondContact CE1-O 3.3Å; Y905-L1008 WeakPolarHBondContact OH-CB 3.43Å; Y905-E1009 HydrophobicContact CE1-CG 4.07Å; Y905-L1012 HydrophobicContact CE2-CD1 3.48Å; Y905-L1012 VanDerWaalsContact CE2-CD1 3.48Å; Y905-L1012 WeakPolarHBondContact OH-CD1 3.36Å; Y905-V1019 HydrophobicContact CD2-CB 4.46Å; Y905-V1019 HydrophobicContact CD2-CG1 3.63Å; Y905-V1019 HydrophobicContact CD2-CG2 4.1Å; Y905-V1019 HydrophobicContact CE2-CG1 4.35Å; Y905-V1019 HydrophobicContact CE2-CG2 4Å; Y905-V1019 HydrophobicContact CG-CG1 4.1Å; Y905-I1020 PolarHBondContact N-O 3.36Å; Y905-H1022 WeakPolarHBondContact O-CB 3Å; Y905-H1022 PolarHBondContact O-N 2.98Å
906	G	78.6	Confident	82.1	Confident	5 Å²	5	27.6 Å²	27.6	5%	0.052	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.3	174.4	170.2	0	0	0	0	0	112.2	K912 S1001 T1003	G906-K912 PolarHBondContact O-NZ 3.48Å; G906-S1001 PolarHBondContact N-O 2.89Å; G906-T1003 PolarHBondContact O-N 2.72Å
907	A	73.4	Confident	81.9	Confident	10 Å²	10	28.5 Å²	28.5	8%	0.083	17%	0.169	C	C	.	.			trans	-56.7	157.6	179.7	0	0	0	0	0	113.1	T910 K912	A907-T910 HydrophobicContact CB-CG2 4.01Å; A907-T910 WeakPolarHBondContact O-CG2 3.41Å; A907-T910 PolarHBondContact O-OG1 3.24Å; A907-K912 PolarHBondContact O-NZ 2.94Å
908	S	70.2	Confident	81.8	Confident	80 Å²	80	25.6 Å²	25.6	56%	0.559	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	145.4	178.8	54.3	0	0	0	0	112	T910	S908-T910 VanDerWaalsContact C-N 3.3Å; S908-T910 PolarHBondContact O-N 2.93Å
909	G	66.9	Low	81.8	Confident	22 Å²	22	19.4 Å²	19.4	23%	0.227	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.6	0.8	-179.9	0	0	0	0	0	117	G911	G909-G911 PolarHBondContact O-N 3.19Å
910	T	72.2	Confident	81.8	Confident	2 Å²	2	17 Å²	17	1%	0.012	11%	0.114	C	C	.	.	S	Bend	trans	-73.5	18.9	177.6	51	0	0	0	0	115.1	A907 S908 K912 H1022 L1023 I1107	A907-T910 HydrophobicContact CB-CG2 4.01Å; A907-T910 WeakPolarHBondContact O-CG2 3.41Å; A907-T910 PolarHBondContact O-OG1 3.24Å; S908-T910 VanDerWaalsContact C-N 3.3Å; S908-T910 PolarHBondContact O-N 2.93Å; T910-K912 VanDerWaalsContact C-N 3.27Å; T910-K912 PolarHBondContact O-N 3.13Å; T910-K912 VanDerWaalsContact O-N 3.17Å; T910-K912 PolarHBondContact OG1-NZ 3.08Å; T910-H1022 PolarHBondContact O-CD2 3.33Å; T910-H1022 PolarHBondContact O-NE2 2.94Å; T910-L1023 HydrophobicContact CG2-CD1 4.27Å; T910-I1107 HydrophobicContact CG2-CD1 4.18Å
911	G	75.5	Confident	81.6	Confident	17 Å²	17	14.3 Å²	14.3	18%	0.175	9%	0.092	C	C	.	.	S	Bend	trans	73.4	-2.8	177.8	0	0	0	0	0	117.4	G909 S913 Q914 L915	G909-G911 PolarHBondContact O-N 3.19Å; G911-S913 VanDerWaalsContact C-N 3.29Å; G911-S913 PolarHBondContact O-N 3.4Å; G911-Q914 WeakPolarHBondContact O-CA 3.5Å; G911-Q914 VanDerWaalsContact O-CB 3.28Å; G911-Q914 WeakPolarHBondContact O-CB 3.3Å; G911-Q914 PolarHBondContact O-N 3.06Å; G911-L915 PolarHBondContact O-N 3.32Å
912	K	84.6	Confident	81.4	Confident	12 Å²	12	14 Å²	14	5%	0.052	9%	0.09	C	C	.	.	H	α-helix	trans	-44.4	-43.8	-174.8	-62.1	-171.2	-55.1	-77	0	115.8	I904 G906 A907 T910 Q914 L915 V916 T1000 S1001 H1022	I904-K912 HydrophobicContact CG2-CD 4.04Å; I904-K912 HydrophobicContact CG2-CG 4.22Å; G906-K912 PolarHBondContact O-NZ 3.48Å; A907-K912 PolarHBondContact O-NZ 2.94Å; T910-K912 VanDerWaalsContact C-N 3.27Å; T910-K912 PolarHBondContact O-N 3.13Å; T910-K912 VanDerWaalsContact O-N 3.17Å; T910-K912 PolarHBondContact OG1-NZ 3.08Å; K912-Q914 VanDerWaalsContact C-N 3.34Å; K912-Q914 PolarHBondContact O-N 3.41Å; K912-L915 WeakPolarHBondContact O-CB 3.42Å; K912-L915 PolarHBondContact O-N 2.77Å; K912-V916 PolarHBondContact O-N 3.07Å; K912-T1000 HydrophobicContact CB-CG2 3.94Å; K912-S1001 WeakPolarHBondContact CE-O 3.4Å; K912-H1022 HydrophobicContact CD-CB 4.3Å; K912-H1022 HydrophobicContact CG-CB 4.3Å; K912-H1022 VanDerWaalsContact CG-CD2 3.49Å; K912-H1022 WeakPolarHBondContact CG-CD2 3.46Å
913	S	82.9	Confident	81.1	Confident	13 Å²	13	15.1 Å²	15.1	9%	0.091	10%	0.096	C	C	.	.	H	α-helix	trans	-68.5	-32.4	-179.1	-46.1	0	0	0	0	112.8	G911 N917	G911-S913 VanDerWaalsContact C-N 3.29Å; G911-S913 PolarHBondContact O-N 3.4Å; S913-N917 VanDerWaalsContact O-CG 3.29Å; S913-N917 PolarHBondContact O-N 2.86Å; S913-N917 PolarHBondContact O-ND2 2.96Å
914	Q	79.7	Confident	80.6	Confident	41 Å²	41	15.7 Å²	15.7	19%	0.192	10%	0.1	C	C	.	.	H	α-helix	trans	-70.2	-46.9	170	179.2	67.5	42.5	0	0	110	G911 K912 V916 N917 D918	G911-Q914 WeakPolarHBondContact O-CA 3.5Å; G911-Q914 VanDerWaalsContact O-CB 3.28Å; G911-Q914 WeakPolarHBondContact O-CB 3.3Å; G911-Q914 PolarHBondContact O-N 3.06Å; K912-Q914 VanDerWaalsContact C-N 3.34Å; K912-Q914 PolarHBondContact O-N 3.41Å; Q914-V916 PolarHBondContact O-N 2.86Å; Q914-N917 WeakPolarHBondContact O-CB 3.43Å; Q914-N917 PolarHBondContact O-N 2.84Å; Q914-N917 VanDerWaalsContact O-N 3.12Å; Q914-D918 WeakPolarHBondContact CG-OD2 3.46Å; Q914-D918 VanDerWaalsContact NE2-CG 3.35Å; Q914-D918 PolarHBondContact NE2-OD1 3.43Å; Q914-D918 PolarHBondContact NE2-OD2 3.32Å; Q914-D918 PolarHBondContact O-N 3.31Å
915	L	86.4	Confident	79.3	Confident	4 Å²	4	20.8 Å²	20.8	2%	0.021	13%	0.131	C	C	.	.	H	α-helix	trans	-57.5	-45.4	179.4	178.4	61.9	0	0	0	112.5	I884 L889 Y892 I904 G911 K912 D918 L919	I884-L915 HydrophobicContact CD1-CD1 3.85Å; I884-L915 HydrophobicContact CD1-CD2 3.82Å; I884-L915 HydrophobicContact CD1-CG 4.35Å; L889-L915 HydrophobicContact CD2-CD1 3.55Å; Y892-L915 HydrophobicContact CD2-CD2 4.07Å; Y892-L915 HydrophobicContact CE2-CD2 4Å; I904-L915 HydrophobicContact CD1-CD2 4.4Å; G911-L915 PolarHBondContact O-N 3.32Å; K912-L915 WeakPolarHBondContact O-CB 3.42Å; K912-L915 PolarHBondContact O-N 2.77Å; L915-D918 PolarHBondContact O-N 2.83Å; L915-L919 HydrophobicContact CD1-CD1 3.81Å; L915-L919 HydrophobicContact CD1-CD2 4.31Å; L915-L919 HydrophobicContact CD1-CG 3.82Å; L915-L919 HydrophobicContact CG-CD1 3.81Å; L915-L919 HydrophobicContact CG-CG 4.24Å; L915-L919 WeakPolarHBondContact O-CB 3.18Å; L915-L919 VanDerWaalsContact O-CG 3.29Å; L915-L919 WeakPolarHBondContact O-CG 3.26Å; L915-L919 PolarHBondContact O-N 3.13Å
916	V	87.2	Confident	78.1	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.6	-44.4	174.6	165.3	0	0	0	0	111.5	I904 K912 Q914 D918 T920 N970 L972 V998 T1000	I904-V916 HydrophobicContact CD1-CG2 3.62Å; I904-V916 HydrophobicContact CG1-CG2 4.07Å; K912-V916 PolarHBondContact O-N 3.07Å; Q914-V916 PolarHBondContact O-N 2.86Å; V916-D918 PolarHBondContact O-N 3.01Å; V916-T920 WeakPolarHBondContact O-CB 3.41Å; V916-T920 PolarHBondContact O-N 3.21Å; V916-T920 PolarHBondContact O-OG1 2.82Å; V916-T920 VanDerWaalsContact O-OG1 3.08Å; V916-N970 HydrophobicContact CG1-CB 3.98Å; V916-N970 WeakPolarHBondContact CG1-OD1 3.2Å; V916-L972 HydrophobicContact CB-CD2 4.49Å; V916-L972 HydrophobicContact CG1-CD2 4.28Å; V916-V998 HydrophobicContact CB-CG1 4.25Å; V916-V998 HydrophobicContact CG1-CB 4Å; V916-V998 HydrophobicContact CG1-CG1 3.66Å; V916-V998 HydrophobicContact CG2-CG1 3.68Å; V916-T1000 HydrophobicContact CB-CG2 4.1Å; V916-T1000 HydrophobicContact CG2-CG2 3.43Å; V916-T1000 VanDerWaalsContact CG2-CG2 3.43Å
917	N	84.8	Confident	77.1	Confident	20 Å²	20	25.5 Å²	25.5	11%	0.107	16%	0.158	C	C	.	.	H	α-helix	trans	-60.4	-35.2	175.5	-72.6	-21.7	0	0	0	112.3	S913 Q914 K921 N935 N970	S913-N917 VanDerWaalsContact O-CG 3.29Å; S913-N917 PolarHBondContact O-N 2.86Å; S913-N917 PolarHBondContact O-ND2 2.96Å; Q914-N917 WeakPolarHBondContact O-CB 3.43Å; Q914-N917 PolarHBondContact O-N 2.84Å; Q914-N917 VanDerWaalsContact O-N 3.12Å; N917-K921 WeakPolarHBondContact O-CD 3.46Å; N917-K921 WeakPolarHBondContact O-CE 3.31Å; N917-K921 VanDerWaalsContact O-CG 3.24Å; N917-K921 WeakPolarHBondContact O-CG 3.46Å; N917-N935 PolarHBondContact OD1-OD1 3.41Å; N917-N970 PolarHBondContact OD1-ND2 3.16Å
918	D	82.1	Confident	76.1	Confident	26 Å²	26	30.7 Å²	30.7	14%	0.139	18%	0.18	C	C	.	.	H	α-helix	trans	-81.4	-42	-177.8	-65.6	-25.5	0	0	0	112.9	V878 Q914 L915 V916 K921	V878-D918 HydrophobicContact CG1-CB 4.06Å; V878-D918 HydrophobicContact CG2-CB 4.02Å; Q914-D918 WeakPolarHBondContact CG-OD2 3.46Å; Q914-D918 VanDerWaalsContact NE2-CG 3.35Å; Q914-D918 PolarHBondContact NE2-OD1 3.43Å; Q914-D918 PolarHBondContact NE2-OD2 3.32Å; Q914-D918 PolarHBondContact O-N 3.31Å; L915-D918 PolarHBondContact O-N 2.83Å; V916-D918 PolarHBondContact O-N 3.01Å; D918-K921 PolarHBondContact O-N 2.81Å; D918-K921 IonicContact OD1-NZ 3.49Å; D918-K921 PolarHBondContact OD1-NZ 3.23Å
919	L	86.8	Confident	75.5	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.8	-41.8	173	-66.9	174.6	0	0	0	111.8	L875 L889 Y892 L893 I896 I904 L915 K921 I922 L923	L875-L919 HydrophobicContact CD1-CD2 4.48Å; L889-L919 HydrophobicContact CD2-CD2 4.41Å; Y892-L919 HydrophobicContact CD2-CD1 4.49Å; L893-L919 HydrophobicContact CD2-CB 4.1Å; L893-L919 HydrophobicContact CD2-CD2 3.71Å; L893-L919 HydrophobicContact CD2-CG 4.45Å; L893-L919 HydrophobicContact CG-CD2 3.88Å; I896-L919 HydrophobicContact CD1-CD1 3.95Å; I904-L919 HydrophobicContact CD1-CD1 4.35Å; L915-L919 HydrophobicContact CD1-CD1 3.81Å; L915-L919 HydrophobicContact CD1-CD2 4.31Å; L915-L919 HydrophobicContact CD1-CG 3.82Å; L915-L919 HydrophobicContact CG-CD1 3.81Å; L915-L919 HydrophobicContact CG-CG 4.24Å; L915-L919 WeakPolarHBondContact O-CB 3.18Å; L915-L919 VanDerWaalsContact O-CG 3.29Å; L915-L919 WeakPolarHBondContact O-CG 3.26Å; L915-L919 PolarHBondContact O-N 3.13Å; L919-K921 PolarHBondContact O-N 3.06Å; L919-I922 PolarHBondContact O-N 3.33Å; L919-L923 WeakPolarHBondContact O-CG 3.41Å; L919-L923 PolarHBondContact O-N 2.89Å; L919-L923 VanDerWaalsContact O-N 3.13Å
920	T	84.6	Confident	74.9	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.2	-28.9	178.7	-71.7	0	0	0	0	112.7	V916 I922 L923 V924 V933 V968 N970	V916-T920 WeakPolarHBondContact O-CB 3.41Å; V916-T920 PolarHBondContact O-N 3.21Å; V916-T920 PolarHBondContact O-OG1 2.82Å; V916-T920 VanDerWaalsContact O-OG1 3.08Å; T920-I922 VanDerWaalsContact C-N 3.33Å; T920-I922 PolarHBondContact O-N 2.9Å; T920-L923 PolarHBondContact O-N 3.38Å; T920-V924 WeakPolarHBondContact O-CG2 3.46Å; T920-V924 PolarHBondContact O-N 2.96Å; T920-V933 HydrophobicContact CG2-CB 4.29Å; T920-V933 HydrophobicContact CG2-CG1 3.64Å; T920-V933 HydrophobicContact CG2-CG2 3.63Å; T920-V968 HydrophobicContact CG2-CB 3.63Å; T920-V968 HydrophobicContact CG2-CG1 3.56Å; T920-V968 HydrophobicContact CG2-CG2 4.04Å; T920-N970 PolarHBondContact OG1-OD1 2.95Å
921	K	79	Confident	74.2	Confident	22 Å²	22	40 Å²	40	10%	0.096	21%	0.214	C	C	.	.	H	α-helix	trans	-71.5	-24.6	173.5	-64.6	155.5	-165.8	161.4	0	113.6	I685 N917 D918 L919	I685-K921 HydrophobicContact CB-CB 4.27Å; I685-K921 HydrophobicContact CB-CD 4.1Å; I685-K921 HydrophobicContact CG2-CB 3.85Å; I685-K921 HydrophobicContact CG2-CD 4.5Å; I685-K921 HydrophobicContact CG2-CG 4.5Å; I685-K921 WeakPolarHBondContact O-CD 3.43Å; N917-K921 WeakPolarHBondContact O-CD 3.46Å; N917-K921 WeakPolarHBondContact O-CE 3.31Å; N917-K921 VanDerWaalsContact O-CG 3.24Å; N917-K921 WeakPolarHBondContact O-CG 3.46Å; D918-K921 PolarHBondContact O-N 2.81Å; D918-K921 IonicContact OD1-NZ 3.49Å; D918-K921 PolarHBondContact OD1-NZ 3.23Å; L919-K921 PolarHBondContact O-N 3.06Å
922	I	81.7	Confident	73.9	Confident	9 Å²	9	40.3 Å²	40.3	5%	0.046	21%	0.212	C	C	.	.	H	α-helix	trans	-83.5	-23.4	174.3	-55	176.6	0	0	0	111	Q871 M874 L875 V878 L893 L919 T920	Q871-I922 HydrophobicContact CB-CG2 4.48Å; M874-I922 HydrophobicContact CB-CD1 4.1Å; M874-I922 HydrophobicContact CB-CG1 3.99Å; M874-I922 HydrophobicContact CB-CG2 4.41Å; M874-I922 HydrophobicContact CE-CG1 4.35Å; L875-I922 HydrophobicContact CD1-CD1 4.04Å; V878-I922 HydrophobicContact CB-CD1 4.31Å; V878-I922 HydrophobicContact CG2-CD1 3.8Å; L893-I922 HydrophobicContact CD1-CB 4.45Å; L893-I922 HydrophobicContact CD1-CD1 4.49Å; L893-I922 HydrophobicContact CD1-CG2 3.84Å; L893-I922 HydrophobicContact CD2-CB 4.44Å; L919-I922 PolarHBondContact O-N 3.33Å; T920-I922 VanDerWaalsContact C-N 3.33Å; T920-I922 PolarHBondContact O-N 2.9Å
923	L	82.1	Confident	73.4	Confident	26 Å²	26	40.9 Å²	40.9	14%	0.136	22%	0.217	C	C	.	.	H	α-helix	trans	-83.8	-19.8	-179.8	-70.5	164.7	0	0	0	114	L893 I896 R897 L919 T920	L893-L923 HydrophobicContact CD2-CD1 4.23Å; L893-L923 HydrophobicContact CD2-CD2 4Å; L893-L923 HydrophobicContact CD2-CG 3.86Å; I896-L923 HydrophobicContact CB-CD1 4.05Å; I896-L923 HydrophobicContact CG2-CD1 3.38Å; R897-L923 HydrophobicContact CG-CD2 3.72Å; L919-L923 WeakPolarHBondContact O-CG 3.41Å; L919-L923 PolarHBondContact O-N 2.89Å; L919-L923 VanDerWaalsContact O-N 3.13Å; T920-L923 PolarHBondContact O-N 3.38Å
924	V	77.5	Confident	73.2	Confident	12 Å²	12	42.6 Å²	42.6	7%	0.073	22%	0.222	C	C	.	.			trans	-86.1	126.7	-176.2	159.5	0	0	0	0	111.9	T920 N926 P927 T932 V933 E967 V968	T920-V924 WeakPolarHBondContact O-CG2 3.46Å; T920-V924 PolarHBondContact O-N 2.96Å; V924-N926 VanDerWaalsContact C-N 3.35Å; V924-N926 WeakPolarHBondContact CG1-O 3.4Å; V924-N926 PolarHBondContact O-N 2.98Å; V924-P927 HydrophobicContact CG1-CB 4.49Å; V924-T932 HydrophobicContact CG1-CG2 4.02Å; V924-V933 HydrophobicContact CG2-CG2 3.69Å; V924-E967 VanDerWaalsContact CA-OE2 3.28Å; V924-E967 WeakPolarHBondContact CA-OE2 3.46Å; V924-E967 WeakPolarHBondContact CG1-OE2 3.45Å; V924-E967 HydrophobicContact CG2-CB 4.28Å; V924-E967 HydrophobicContact CG2-CG 4.47Å; V924-V968 HydrophobicContact CG2-CG2 3.98Å
925	T	63.1	Low	73.3	Confident	108 Å²	108	43.4 Å²	43.4	66%	0.663	23%	0.227	S	C	*	.	S	Bend	trans	-71	-27.6	-174.7	-53.3	0	0	0	0	113	E967	T925-E967 WeakPolarHBondContact CB-OE1 3.43Å; T925-E967 PolarHBondContact N-OE1 2.87Å; T925-E967 VanDerWaalsContact N-OE1 3.11Å; T925-E967 PolarHBondContact N-OE2 3.37Å; T925-E967 PolarHBondContact OG1-OE1 2.64Å
926	N	60	Low	72.9	Confident	71 Å²	71	44 Å²	44	38%	0.38	23%	0.23	S	C	.	.			trans	-136	94.1	173.3	-98.2	-65.3	0	0	0	111.5	V924 H928 S929	V924-N926 VanDerWaalsContact C-N 3.35Å; V924-N926 WeakPolarHBondContact CG1-O 3.4Å; V924-N926 PolarHBondContact O-N 2.98Å; N926-H928 PolarHBondContact O-N 3.41Å; N926-H928 VanDerWaalsContact O-N 3.16Å; N926-S929 VanDerWaalsContact CB-OG 3.3Å; N926-S929 WeakPolarHBondContact CB-OG 3.24Å; N926-S929 PolarHBondContact O-N 2.9Å; N926-S929 PolarHBondContact O-OG 3.3Å
927	P	58.5	Low	72.5	Confident	41 Å²	41	48.5 Å²	48.5	27%	0.266	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-3.8	-175.7	31.5	-37.7	0	0	0	113.9	C686 V924	C686-P927 HydrophobicContact CB-CB 4Å; C686-P927 WeakPolarHBondContact CB-O 3.42Å; V924-P927 HydrophobicContact CG1-CB 4.49Å
928	H	52.8	Low	72	Confident	119 Å²	119	47.7 Å²	47.7	55%	0.551	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-16.4	176.3	-57.4	-32.3	0	0	0	113.8	C686 N926 K930	C686-H928 PolarHBondContact SG-CE1 3.03Å; C686-H928 PolarHBondContact SG-ND1 2.65Å; N926-H928 PolarHBondContact O-N 3.41Å; N926-H928 VanDerWaalsContact O-N 3.16Å; H928-K930 PolarHBondContact O-N 2.66Å
929	S	57.7	Low	71.5	Confident	53 Å²	53	51.1 Å²	51.1	37%	0.371	26%	0.256	S	S	.	.	S	Bend	trans	-72.4	118.2	177.8	-3.5	0	0	0	0	110.1	N926 N931 T932	N926-S929 VanDerWaalsContact CB-OG 3.3Å; N926-S929 WeakPolarHBondContact CB-OG 3.24Å; N926-S929 PolarHBondContact O-N 2.9Å; N926-S929 PolarHBondContact O-OG 3.3Å; S929-N931 PolarHBondContact O-N 2.97Å; S929-T932 PolarHBondContact O-N 2.94Å; S929-T932 PolarHBondContact O-OG1 3.19Å; S929-T932 WeakPolarHBondContact OG-CG2 3.3Å
930	K	53.6	Low	70.5	Confident	179 Å²	179	55.9 Å²	55.9	78%	0.778	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	127.6	169.1	-61.7	174.7	-175.6	173.2	0	108	H928	H928-K930 PolarHBondContact O-N 2.66Å
931	N	58.8	Low	69.1	Low	68 Å²	68	60.5 Å²	60.5	36%	0.364	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	87	11.6	179.5	-41.3	-22.9	0	0	0	117.9	S929 F960 P966	S929-N931 PolarHBondContact O-N 2.97Å; N931-F960 HydrophobicContact CB-CE1 4.09Å; N931-F960 HydrophobicContact CB-CZ 4.07Å; N931-P966 WeakPolarHBondContact O-CB 3.42Å
932	T	69	Low	68.1	Low	22 Å²	22	60 Å²	60	14%	0.135	30%	0.304	C	S	.	.	S	Bend	trans	-68.4	-32.6	170.8	40.2	0	0	0	0	114	V924 S929 E967 V968	V924-T932 HydrophobicContact CG1-CG2 4.02Å; S929-T932 PolarHBondContact O-N 2.94Å; S929-T932 PolarHBondContact O-OG1 3.19Å; S929-T932 WeakPolarHBondContact OG-CG2 3.3Å; T932-E967 PolarHBondContact O-N 3.36Å; T932-V968 PolarHBondContact O-N 3.27Å
933	V	74.2	Confident	66.7	Low	24 Å²	24	61.8 Å²	61.8	15%	0.145	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	128.5	177.4	-176.6	0	0	0	0	109.7	T920 V924 V968	T920-V933 HydrophobicContact CG2-CB 4.29Å; T920-V933 HydrophobicContact CG2-CG1 3.64Å; T920-V933 HydrophobicContact CG2-CG2 3.63Å; V924-V933 HydrophobicContact CG2-CG2 3.69Å; V933-V968 WeakPolarHBondContact CA-O 3.32Å
934	Y	78.6	Confident	65.5	Low	50 Å²	50	60.9 Å²	60.9	20%	0.196	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	118.1	172	179.3	-105	0	0	0	111	F936 V952 L953 V968 I969 N970	Y934-F936 HydrophobicContact CE1-CB 4.04Å; Y934-F936 HydrophobicContact CE1-CD2 4.31Å; Y934-V952 HydrophobicContact CE2-CG1 4Å; Y934-V952 WeakPolarHBondContact OH-CG1 3.34Å; Y934-L953 HydrophobicContact CD1-CD2 4.15Å; Y934-L953 HydrophobicContact CE1-CD2 4.03Å; Y934-V968 PolarHBondContact N-O 2.91Å; Y934-I969 HydrophobicContact CD1-CG1 4.44Å; Y934-I969 HydrophobicContact CD1-CG2 4.25Å; Y934-I969 WeakPolarHBondContact O-CA 3.42Å; Y934-N970 PolarHBondContact O-N 3.01Å
935	N	80	Confident	64.5	Low	58 Å²	58	63.3 Å²	63.3	31%	0.31	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	118.1	178.7	-67.6	-31.5	0	0	0	110.4	N917 N970	N917-N935 PolarHBondContact OD1-OD1 3.41Å; N935-N970 WeakPolarHBondContact OD1-CB 3.46Å; N935-N970 PolarHBondContact OD1-ND2 3.38Å
936	F	79.2	Confident	64.3	Low	17 Å²	17	59.8 Å²	59.8	8%	0.075	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	137.3	167.2	-166.4	-88.6	0	0	0	109.8	Y934 F938 L949 N970 L971 L972	Y934-F936 HydrophobicContact CE1-CB 4.04Å; Y934-F936 HydrophobicContact CE1-CD2 4.31Å; F936-F938 HydrophobicContact CD1-CD1 4.27Å; F936-F938 HydrophobicContact CD1-CD2 4.22Å; F936-F938 AromaticContact CD1-CE1 3.96Å; F936-F938 HydrophobicContact CD1-CE1 3.96Å; F936-F938 AromaticContact CD1-CE2 3.91Å; F936-F938 HydrophobicContact CD1-CE2 3.91Å; F936-F938 HydrophobicContact CD1-CG 4.38Å; F936-F938 AromaticContact CD1-CZ 3.76Å; F936-F938 HydrophobicContact CD1-CZ 3.76Å; F936-F938 AromaticContact CE1-CD1 3.65Å; F936-F938 HydrophobicContact CE1-CD1 3.65Å; F936-F938 HydrophobicContact CE1-CD2 4.39Å; F936-F938 AromaticContact CE1-CE1 3.46Å; F936-F938 HydrophobicContact CE1-CE1 3.46Å; F936-F938 VanDerWaalsContact CE1-CE1 3.46Å; F936-F938 HydrophobicContact CE1-CE2 4.24Å; F936-F938 HydrophobicContact CE1-CG 4.1Å; F936-F938 AromaticContact CE1-CZ 3.77Å; F936-F938 HydrophobicContact CE1-CZ 3.77Å; F936-F938 HydrophobicContact CZ-CE1 4.46Å; F936-L949 HydrophobicContact CD1-CD1 3.9Å; F936-L949 HydrophobicContact CD2-CB 4.43Å; F936-L949 HydrophobicContact CD2-CD1 4.43Å; F936-L949 HydrophobicContact CD2-CG 4.2Å; F936-L949 HydrophobicContact CE1-CB 4.39Å; F936-L949 HydrophobicContact CE1-CD1 3.95Å; F936-L949 HydrophobicContact CE1-CG 4.48Å; F936-L949 HydrophobicContact CE2-CB 3.85Å; F936-L949 HydrophobicContact CE2-CD1 4.45Å; F936-L949 HydrophobicContact CE2-CG 4.13Å; F936-L949 HydrophobicContact CG-CD1 4.16Å; F936-L949 HydrophobicContact CG-CG 4.39Å; F936-L949 HydrophobicContact CZ-CB 3.84Å; F936-L949 HydrophobicContact CZ-CD1 4.23Å; F936-L949 HydrophobicContact CZ-CG 4.28Å; F936-N970 PolarHBondContact N-O 3.13Å; F936-L971 HydrophobicContact CB-CD2 3.97Å; F936-L972 WeakPolarHBondContact O-CB 3.29Å; F936-L972 PolarHBondContact O-N 2.89Å
937	R	79.4	Confident	64.3	Low	94 Å²	94	64.4 Å²	64.4	36%	0.355	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	120.4	175.8	179.2	177	-69	-162.3	-10.9	109.7	L972 D1226	R937-L972 HydrophobicContact CB-CB 4.22Å; R937-L972 HydrophobicContact CG-CB 4.35Å; R937-D1226 PolarHBondContact NH2-O 2.92Å
938	F	74.4	Confident	64.6	Low	2 Å²	2	66.2 Å²	66.2	1%	0.009	33%	0.328	C	S	.	.			trans	-72.9	138	169.2	-59.4	-83.2	0	0	0	109.2	F936 L949 L971 L972 N973 I974 H976 F977 L984	F936-F938 HydrophobicContact CD1-CD1 4.27Å; F936-F938 HydrophobicContact CD1-CD2 4.22Å; F936-F938 AromaticContact CD1-CE1 3.96Å; F936-F938 HydrophobicContact CD1-CE1 3.96Å; F936-F938 AromaticContact CD1-CE2 3.91Å; F936-F938 HydrophobicContact CD1-CE2 3.91Å; F936-F938 HydrophobicContact CD1-CG 4.38Å; F936-F938 AromaticContact CD1-CZ 3.76Å; F936-F938 HydrophobicContact CD1-CZ 3.76Å; F936-F938 AromaticContact CE1-CD1 3.65Å; F936-F938 HydrophobicContact CE1-CD1 3.65Å; F936-F938 HydrophobicContact CE1-CD2 4.39Å; F936-F938 AromaticContact CE1-CE1 3.46Å; F936-F938 HydrophobicContact CE1-CE1 3.46Å; F936-F938 VanDerWaalsContact CE1-CE1 3.46Å; F936-F938 HydrophobicContact CE1-CE2 4.24Å; F936-F938 HydrophobicContact CE1-CG 4.1Å; F936-F938 AromaticContact CE1-CZ 3.77Å; F936-F938 HydrophobicContact CE1-CZ 3.77Å; F936-F938 HydrophobicContact CZ-CE1 4.46Å; F938-L949 HydrophobicContact CE1-CD1 4.03Å; F938-L949 HydrophobicContact CZ-CD1 3.64Å; F938-L971 HydrophobicContact CE2-CB 4.39Å; F938-L972 WeakPolarHBondContact CD2-O 3.44Å; F938-L972 PolarHBondContact N-O 2.88Å; F938-N973 WeakPolarHBondContact CB-O 3.17Å; F938-I974 HydrophobicContact CD2-CG1 4.32Å; F938-I974 HydrophobicContact CE2-CG1 4Å; F938-H976 HydrophobicContact CB-CB 4.36Å; F938-F977 HydrophobicContact CD1-CB 4.11Å; F938-F977 AromaticContact CD1-CD2 3.98Å; F938-F977 HydrophobicContact CD1-CD2 3.98Å; F938-F977 HydrophobicContact CE1-CB 4.24Å; F938-F977 AromaticContact CE1-CD2 3.54Å; F938-F977 HydrophobicContact CE1-CD2 3.54Å; F938-F977 HydrophobicContact CE1-CE2 4.34Å; F938-F977 HydrophobicContact CE1-CG 4.28Å; F938-F977 HydrophobicContact CZ-CD2 4.32Å; F938-L984 HydrophobicContact CE1-CD1 4.23Å; F938-L984 HydrophobicContact CZ-CD1 3.78Å
939	K	70.7	Confident	65.2	Low	98 Å²	98	61.2 Å²	61.2	43%	0.426	31%	0.305	S	S	.	.			trans	-94.8	155	179	-66.8	-179.4	-163.4	165.5	0	111.1	D941 G942 S943 T944 H976	K939-D941 WeakPolarHBondContact CB-OD1 3.42Å; K939-D941 WeakPolarHBondContact CD-OD1 3.43Å; K939-D941 WeakPolarHBondContact CD-OD2 3.29Å; K939-D941 IonicContact NZ-OD2 3.13Å; K939-D941 PolarHBondContact O-N 3.23Å; K939-G942 PolarHBondContact O-N 2.74Å; K939-S943 PolarHBondContact NZ-OG 3.04Å; K939-S943 VanDerWaalsContact NZ-OG 3.09Å; K939-T944 HydrophobicContact CB-CG2 4.05Å; K939-T944 HydrophobicContact CD-CG2 4.02Å; K939-T944 HydrophobicContact CG-CG2 3.7Å; K939-T944 PolarHBondContact N-OG1 3.46Å; K939-H976 WeakPolarHBondContact O-CB 3.43Å
940	H	64.9	Low	65.4	Low	100 Å²	100	64.8 Å²	64.8	46%	0.463	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-27.2	173.4	-67.4	-74.5	0	0	0	113.9	G942 H976 D1226	H940-G942 PolarHBondContact O-N 3.33Å; H940-H976 AromaticContact CE1-CD2 3.74Å; H940-H976 AromaticContact CE1-CE1 3.55Å; H940-H976 AromaticContact CE1-NE2 3.12Å; H940-H976 PolarHBondContact CE1-NE2 2.84Å; H940-H976 AromaticContact ND1-CD2 3.61Å; H940-H976 AromaticContact ND1-CE1 3.3Å; H940-H976 PolarHBondContact ND1-CE1 3.44Å; H940-H976 VanDerWaalsContact ND1-CE1 3.3Å; H940-H976 AromaticContact ND1-CG 3.93Å; H940-H976 AromaticContact ND1-ND1 3.73Å; H940-H976 AromaticContact ND1-NE2 3.24Å; H940-H976 PolarHBondContact ND1-NE2 2.95Å; H940-D1226 IonicContact NE2-OD2 2.85Å
941	D	56.3	Low	65.8	Low	98 Å²	98	59.3 Å²	59.3	52%	0.524	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-7.2	-177.5	61.4	16.7	0	0	0	114.5	K939 S943	K939-D941 WeakPolarHBondContact CB-OD1 3.42Å; K939-D941 WeakPolarHBondContact CD-OD1 3.43Å; K939-D941 WeakPolarHBondContact CD-OD2 3.29Å; K939-D941 IonicContact NZ-OD2 3.13Å; K939-D941 PolarHBondContact O-N 3.23Å; D941-S943 PolarHBondContact O-N 3.41Å; D941-S943 VanDerWaalsContact O-N 3.15Å; D941-S943 VanDerWaalsContact OD1-CB 3.27Å; D941-S943 WeakPolarHBondContact OD1-CB 3.32Å; D941-S943 PolarHBondContact OD1-N 2.84Å
942	G	56.8	Low	66	Low	11 Å²	11	58 Å²	58	11%	0.113	29%	0.292	C	S	.	.	S	Bend	trans	68.7	0.3	-174.1	0	0	0	0	0	114.8	K939 H940 T944	K939-G942 PolarHBondContact O-N 2.74Å; H940-G942 PolarHBondContact O-N 3.33Å; G942-T944 PolarHBondContact O-N 3.41Å
943	S	53.1	Low	65.7	Low	46 Å²	46	58 Å²	58	32%	0.322	29%	0.291	S	S	.	.			trans	-64.1	-27.5	-176.6	105.9	0	0	0	0	112.1	K939 D941 T945	K939-S943 PolarHBondContact NZ-OG 3.04Å; K939-S943 VanDerWaalsContact NZ-OG 3.09Å; D941-S943 PolarHBondContact O-N 3.41Å; D941-S943 VanDerWaalsContact O-N 3.15Å; D941-S943 VanDerWaalsContact OD1-CB 3.27Å; D941-S943 WeakPolarHBondContact OD1-CB 3.32Å; D941-S943 PolarHBondContact OD1-N 2.84Å; S943-T945 PolarHBondContact O-N 3.17Å
944	T	57.1	Low	65.1	Low	8 Å²	8	59.5 Å²	59.5	5%	0.049	30%	0.3	C	S	.	.			trans	-73.4	70.8	-178	52.2	0	0	0	0	112	K939 G942 E948	K939-T944 HydrophobicContact CB-CG2 4.05Å; K939-T944 HydrophobicContact CD-CG2 4.02Å; K939-T944 HydrophobicContact CG-CG2 3.7Å; K939-T944 PolarHBondContact N-OG1 3.46Å; G942-T944 PolarHBondContact O-N 3.41Å; T944-E948 WeakPolarHBondContact CA-OE2 3.29Å
945	T	57.3	Low	64.1	Low	62 Å²	62	62.7 Å²	62.7	38%	0.38	32%	0.317	S	S	.	.			trans	-68.4	160.3	179.6	68.4	0	0	0	0	112.2	S943 K947 E948 L949	S943-T945 PolarHBondContact O-N 3.17Å; T945-K947 PolarHBondContact O-N 2.81Å; T945-K947 WeakPolarHBondContact OG1-CB 3.38Å; T945-K947 PolarHBondContact OG1-N 3.02Å; T945-E948 PolarHBondContact O-N 2.89Å; T945-L949 PolarHBondContact O-N 2.9Å
946	V	58.2	Low	62.9	Low	35 Å²	35	62.2 Å²	62.2	21%	0.212	31%	0.313	C	S	.	.	H	α-helix	trans	-49.7	-28.1	167.8	-178.4	0	0	0	0	112.1	E948 K950 F977 K987	V946-E948 VanDerWaalsContact C-N 3.34Å; V946-K950 WeakPolarHBondContact O-CB 3.39Å; V946-K950 PolarHBondContact O-N 3.06Å; V946-F977 HydrophobicContact CG2-CE2 3.38Å; V946-F977 HydrophobicContact CG2-CZ 3.32Å; V946-K987 HydrophobicContact CG1-CD 4.43Å
947	K	60.8	Low	61.7	Low	168 Å²	168	64 Å²	64	73%	0.73	32%	0.323	S	S	*	.	H	α-helix	trans	-67.7	-33.6	-179.5	-58.4	177.7	-178.2	173.8	0	112.1	T945 S951	T945-K947 PolarHBondContact O-N 2.81Å; T945-K947 WeakPolarHBondContact OG1-CB 3.38Å; T945-K947 PolarHBondContact OG1-N 3.02Å; K947-S951 WeakPolarHBondContact O-CA 3.39Å; K947-S951 WeakPolarHBondContact O-CB 3.36Å; K947-S951 PolarHBondContact O-N 3.23Å; K947-S951 PolarHBondContact O-OG 3.46Å; K947-S951 VanDerWaalsContact O-OG 3.11Å
948	E	64.1	Low	60.4	Low	79 Å²	79	65 Å²	65	37%	0.369	34%	0.335	S	S	.	.	H	α-helix	trans	-74.5	-48.2	176.1	-63.1	-173.8	164.5	0	0	111.1	T944 T945 V946 K950 S951 V952	T944-E948 WeakPolarHBondContact CA-OE2 3.29Å; T945-E948 PolarHBondContact O-N 2.89Å; V946-E948 VanDerWaalsContact C-N 3.34Å; E948-K950 VanDerWaalsContact C-N 3.28Å; E948-K950 PolarHBondContact O-N 3Å; E948-S951 WeakPolarHBondContact CA-OG 3.42Å; E948-S951 PolarHBondContact O-N 3.38Å; E948-S951 PolarHBondContact O-OG 3.12Å; E948-S951 VanDerWaalsContact O-OG 3.11Å; E948-V952 WeakPolarHBondContact O-CG2 3.31Å; E948-V952 PolarHBondContact O-N 3.27Å
949	L	65.5	Low	59.3	Low	14 Å²	14	68.3 Å²	68.3	7%	0.073	36%	0.359	C	S	.	.	H	α-helix	trans	-58.6	-43.8	175.3	-167	157.9	0	0	0	110.1	F936 F938 T945 L953 L971 L984	F936-L949 HydrophobicContact CD1-CD1 3.9Å; F936-L949 HydrophobicContact CD2-CB 4.43Å; F936-L949 HydrophobicContact CD2-CD1 4.43Å; F936-L949 HydrophobicContact CD2-CG 4.2Å; F936-L949 HydrophobicContact CE1-CB 4.39Å; F936-L949 HydrophobicContact CE1-CD1 3.95Å; F936-L949 HydrophobicContact CE1-CG 4.48Å; F936-L949 HydrophobicContact CE2-CB 3.85Å; F936-L949 HydrophobicContact CE2-CD1 4.45Å; F936-L949 HydrophobicContact CE2-CG 4.13Å; F936-L949 HydrophobicContact CG-CD1 4.16Å; F936-L949 HydrophobicContact CG-CG 4.39Å; F936-L949 HydrophobicContact CZ-CB 3.84Å; F936-L949 HydrophobicContact CZ-CD1 4.23Å; F936-L949 HydrophobicContact CZ-CG 4.28Å; F938-L949 HydrophobicContact CE1-CD1 4.03Å; F938-L949 HydrophobicContact CZ-CD1 3.64Å; T945-L949 PolarHBondContact O-N 2.9Å; L949-L953 HydrophobicContact CD2-CD1 3.56Å; L949-L953 HydrophobicContact CD2-CG 4.08Å; L949-L953 VanDerWaalsContact O-CB 3.28Å; L949-L953 WeakPolarHBondContact O-CB 3.49Å; L949-L953 WeakPolarHBondContact O-CG 3.47Å; L949-L953 PolarHBondContact O-N 3.36Å; L949-L971 HydrophobicContact CD1-CD2 4.23Å; L949-L984 HydrophobicContact CD1-CD1 4.48Å
950	K	62.1	Low	58.4	Low	127 Å²	127	64.8 Å²	64.8	55%	0.552	34%	0.344	S	S	*	.	H	α-helix	trans	-66.8	-43.3	173.9	-173.4	179.6	179.6	-174.3	0	112.4	V946 E948 T954	V946-K950 WeakPolarHBondContact O-CB 3.39Å; V946-K950 PolarHBondContact O-N 3.06Å; E948-K950 VanDerWaalsContact C-N 3.28Å; E948-K950 PolarHBondContact O-N 3Å; K950-T954 WeakPolarHBondContact O-CB 3.47Å; K950-T954 PolarHBondContact O-N 3.31Å; K950-T954 PolarHBondContact O-OG1 2.73Å
951	S	62.5	Low	57.7	Low	64 Å²	64	65.4 Å²	65.4	45%	0.448	36%	0.355	S	S	.	.	H	α-helix	trans	-67.1	-42.7	-177.9	65.7	0	0	0	0	110.9	K947 E948 T954 Q955	K947-S951 WeakPolarHBondContact O-CA 3.39Å; K947-S951 WeakPolarHBondContact O-CB 3.36Å; K947-S951 PolarHBondContact O-N 3.23Å; K947-S951 PolarHBondContact O-OG 3.46Å; K947-S951 VanDerWaalsContact O-OG 3.11Å; E948-S951 WeakPolarHBondContact CA-OG 3.42Å; E948-S951 PolarHBondContact O-N 3.38Å; E948-S951 PolarHBondContact O-OG 3.12Å; E948-S951 VanDerWaalsContact O-OG 3.11Å; S951-T954 PolarHBondContact O-N 3.15Å; S951-Q955 WeakPolarHBondContact O-CB 3.21Å; S951-Q955 PolarHBondContact O-N 2.91Å
952	V	62	Low	57.2	Low	42 Å²	42	67.4 Å²	67.4	26%	0.255	37%	0.365	S	S	.	.	H	α-helix	trans	-69.5	-46.2	176.3	-174.6	0	0	0	0	110.5	Y934 E948 T954 Q955 Q956	Y934-V952 HydrophobicContact CE2-CG1 4Å; Y934-V952 WeakPolarHBondContact OH-CG1 3.34Å; E948-V952 WeakPolarHBondContact O-CG2 3.31Å; E948-V952 PolarHBondContact O-N 3.27Å; V952-T954 PolarHBondContact O-N 3.19Å; V952-Q955 PolarHBondContact O-N 3.3Å; V952-Q956 HydrophobicContact CG1-CG 3.9Å; V952-Q956 VanDerWaalsContact O-CB 3.27Å; V952-Q956 WeakPolarHBondContact O-CB 3.43Å; V952-Q956 WeakPolarHBondContact O-CG 3.44Å; V952-Q956 PolarHBondContact O-N 2.97Å
953	L	62.9	Low	56.9	Low	20 Å²	20	73.4 Å²	73.4	11%	0.105	40%	0.395	C	S	.	.	H	α-helix	trans	-59.8	-42.8	174.1	-73.6	-172.1	0	0	0	112.3	Y934 L949 Q956 L957 I969 L988	Y934-L953 HydrophobicContact CD1-CD2 4.15Å; Y934-L953 HydrophobicContact CE1-CD2 4.03Å; L949-L953 HydrophobicContact CD2-CD1 3.56Å; L949-L953 HydrophobicContact CD2-CG 4.08Å; L949-L953 VanDerWaalsContact O-CB 3.28Å; L949-L953 WeakPolarHBondContact O-CB 3.49Å; L949-L953 WeakPolarHBondContact O-CG 3.47Å; L949-L953 PolarHBondContact O-N 3.36Å; L953-Q956 PolarHBondContact O-N 2.84Å; L953-L957 WeakPolarHBondContact O-CB 3.37Å; L953-L957 WeakPolarHBondContact O-CD1 3.24Å; L953-L957 WeakPolarHBondContact O-CG 3.48Å; L953-L957 PolarHBondContact O-N 3.3Å; L953-I969 HydrophobicContact CD2-CD1 4.09Å; L953-L988 HydrophobicContact CD1-CD2 3.59Å
954	T	61.6	Low	56.9	Low	56 Å²	56	73.1 Å²	73.1	34%	0.344	40%	0.399	S	S	.	.	H	α-helix	trans	-66.9	-40.2	178.1	-48.8	0	0	0	0	111.4	K950 S951 V952 N958	K950-T954 WeakPolarHBondContact O-CB 3.47Å; K950-T954 PolarHBondContact O-N 3.31Å; K950-T954 PolarHBondContact O-OG1 2.73Å; S951-T954 PolarHBondContact O-N 3.15Å; V952-T954 PolarHBondContact O-N 3.19Å; T954-N958 WeakPolarHBondContact O-CB 3.38Å; T954-N958 PolarHBondContact O-N 3.08Å; T954-N958 PolarHBondContact O-OD1 3.3Å
955	Q	58.3	Low	57.2	Low	118 Å²	118	79.5 Å²	79.5	55%	0.551	42%	0.423	S	S	*	.	H	α-helix	trans	-65.7	-41.8	176.4	-178	179	3	0	0	111.7	S951 V952 S959	S951-Q955 WeakPolarHBondContact O-CB 3.21Å; S951-Q955 PolarHBondContact O-N 2.91Å; V952-Q955 PolarHBondContact O-N 3.3Å; Q955-S959 VanDerWaalsContact O-CB 3.31Å; Q955-S959 WeakPolarHBondContact O-CB 3.43Å; Q955-S959 PolarHBondContact O-N 3.44Å; Q955-S959 PolarHBondContact O-OG 3.49Å
956	Q	53.5	Low	57.7	Low	48 Å²	48	77 Å²	77	22%	0.224	41%	0.408	C	S	.	.	H	α-helix	trans	-67.1	-52	176.2	-67.6	-69.4	-17.4	0	0	110.4	V952 L953 N958 S959 F960	V952-Q956 HydrophobicContact CG1-CG 3.9Å; V952-Q956 VanDerWaalsContact O-CB 3.27Å; V952-Q956 WeakPolarHBondContact O-CB 3.43Å; V952-Q956 WeakPolarHBondContact O-CG 3.44Å; V952-Q956 PolarHBondContact O-N 2.97Å; L953-Q956 PolarHBondContact O-N 2.84Å; Q956-N958 VanDerWaalsContact C-N 3.32Å; Q956-N958 PolarHBondContact O-N 3.4Å; Q956-S959 CarbonylContact O-C 3.55Å; Q956-S959 WeakPolarHBondContact O-CA 3.46Å; Q956-S959 WeakPolarHBondContact O-CB 2.74Å; Q956-S959 PolarHBondContact O-N 3.02Å; Q956-F960 HydrophobicContact CB-CD2 4.28Å; Q956-F960 HydrophobicContact CB-CE2 3.65Å; Q956-F960 HydrophobicContact CB-CZ 3.8Å; Q956-F960 HydrophobicContact CG-CZ 4.38Å; Q956-F960 WeakPolarHBondContact O-CB 3.02Å; Q956-F960 WeakPolarHBondContact O-CD1 3.18Å; Q956-F960 VanDerWaalsContact O-CD2 3.24Å; Q956-F960 WeakPolarHBondContact O-CD2 3.28Å; Q956-F960 WeakPolarHBondContact O-CG 3.03Å; Q956-F960 PolarHBondContact O-N 3.32Å
957	L	54	Low	58.5	Low	53 Å²	53	78.4 Å²	78.4	28%	0.277	41%	0.413	S	S	.	.	H	α-helix	trans	-52.6	-46.2	174.3	-73.2	166.7	0	0	0	112.3	L953 S959 F960 Y965	L953-L957 WeakPolarHBondContact O-CB 3.37Å; L953-L957 WeakPolarHBondContact O-CD1 3.24Å; L953-L957 WeakPolarHBondContact O-CG 3.48Å; L953-L957 PolarHBondContact O-N 3.3Å; L957-S959 VanDerWaalsContact C-N 3.28Å; L957-S959 PolarHBondContact O-N 2.77Å; L957-F960 PolarHBondContact O-N 3.06Å; L957-Y965 HydrophobicContact CD2-CD1 3.71Å; L957-Y965 HydrophobicContact CD2-CE1 3.42Å; L957-Y965 VanDerWaalsContact CD2-CE1 3.42Å
958	N	52.2	Low	59.5	Low	115 Å²	115	70.5 Å²	70.5	62%	0.615	38%	0.378	S	S	*	.	H	α-helix	trans	-69.6	-23.5	176.6	-69.2	-1.1	0	0	0	113.2	T954 Q956	T954-N958 WeakPolarHBondContact O-CB 3.38Å; T954-N958 PolarHBondContact O-N 3.08Å; T954-N958 PolarHBondContact O-OD1 3.3Å; Q956-N958 VanDerWaalsContact C-N 3.32Å; Q956-N958 PolarHBondContact O-N 3.4Å
959	S	50.6	Low	60.4	Low	73 Å²	73	67 Å²	67	51%	0.51	36%	0.362	S	S	.	.	H	α-helix	trans	-85.7	-14	173.5	-56.1	0	0	0	0	112.9	Q955 Q956 L957	Q955-S959 VanDerWaalsContact O-CB 3.31Å; Q955-S959 WeakPolarHBondContact O-CB 3.43Å; Q955-S959 PolarHBondContact O-N 3.44Å; Q955-S959 PolarHBondContact O-OG 3.49Å; Q956-S959 CarbonylContact O-C 3.55Å; Q956-S959 WeakPolarHBondContact O-CA 3.46Å; Q956-S959 WeakPolarHBondContact O-CB 2.74Å; Q956-S959 PolarHBondContact O-N 3.02Å; L957-S959 VanDerWaalsContact C-N 3.28Å; L957-S959 PolarHBondContact O-N 2.77Å
960	F	52.8	Low	61.4	Low	24 Å²	24	66.4 Å²	66.4	11%	0.105	36%	0.359	C	S	.	.			trans	-94.1	0.7	-174.8	-69.2	-19.5	0	0	0	114.5	N931 Q956 L957 N962 N963 G964 P966	N931-F960 HydrophobicContact CB-CE1 4.09Å; N931-F960 HydrophobicContact CB-CZ 4.07Å; Q956-F960 HydrophobicContact CB-CD2 4.28Å; Q956-F960 HydrophobicContact CB-CE2 3.65Å; Q956-F960 HydrophobicContact CB-CZ 3.8Å; Q956-F960 HydrophobicContact CG-CZ 4.38Å; Q956-F960 WeakPolarHBondContact O-CB 3.02Å; Q956-F960 WeakPolarHBondContact O-CD1 3.18Å; Q956-F960 VanDerWaalsContact O-CD2 3.24Å; Q956-F960 WeakPolarHBondContact O-CD2 3.28Å; Q956-F960 WeakPolarHBondContact O-CG 3.03Å; Q956-F960 PolarHBondContact O-N 3.32Å; L957-F960 PolarHBondContact O-N 3.06Å; F960-N962 PolarHBondContact O-N 2.9Å; F960-N963 PolarHBondContact O-N 3.47Å; F960-G964 WeakPolarHBondContact CB-O 3.31Å; F960-G964 WeakPolarHBondContact CG-O 3.42Å; F960-G964 PolarHBondContact O-N 3.04Å; F960-P966 HydrophobicContact CE2-CG 4.41Å
961	T	49.8	Very low	62.6	Low	112 Å²	112	60.4 Å²	60.4	69%	0.687	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-21.6	176.9	60	0	0	0	0	113.8
962	N	47.1	Very low	63.6	Low	140 Å²	140	57.6 Å²	57.6	75%	0.749	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	-10.9	-179.6	-59.3	5.9	0	0	0	113.8	F960	F960-N962 PolarHBondContact O-N 2.9Å
963	N	48.6	Very low	64.5	Low	138 Å²	138	56 Å²	56	74%	0.738	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.7	-8.5	-167.2	-80.6	-16.1	0	0	0	115.6	F960	F960-N963 PolarHBondContact O-N 3.47Å
964	G	55	Low	65.5	Low	39 Å²	39	55 Å²	55	40%	0.402	30%	0.298	S	S	.	.			trans	89.4	166.8	176.4	0	0	0	0	0	115.4	F960	F960-G964 WeakPolarHBondContact CB-O 3.31Å; F960-G964 WeakPolarHBondContact CG-O 3.42Å; F960-G964 PolarHBondContact O-N 3.04Å
965	Y	62	Low	66.2	Low	142 Å²	142	54.4 Å²	54.4	56%	0.557	29%	0.291	S	S	*	.			trans	-72.8	153.4	-179.3	-67.3	-96.3	0	0	0	111.8	L957	L957-Y965 HydrophobicContact CD2-CD1 3.71Å; L957-Y965 HydrophobicContact CD2-CE1 3.42Å; L957-Y965 VanDerWaalsContact CD2-CE1 3.42Å
966	P	69	Low	66.8	Low	11 Å²	11	51 Å²	51	7%	0.071	28%	0.275	C	S	.	.			trans	-61.7	149.5	164.2	28.6	-33.6	0	0	0	109.6	N931 F960 I969 P995	N931-P966 WeakPolarHBondContact O-CB 3.42Å; F960-P966 HydrophobicContact CE2-CG 4.41Å; P966-I969 HydrophobicContact CG-CG1 4.28Å; P966-P995 HydrophobicContact CG-CB 4.35Å; P966-P995 WeakPolarHBondContact O-CB 3.5Å
967	E	74.8	Confident	67.7	Low	64 Å²	64	49.3 Å²	49.3	30%	0.299	27%	0.267	S	S	.	.	S	Bend	trans	-81.6	-34.3	178.7	-169	170.5	-166.2	0	0	110.3	V924 T925 T932 K996	V924-E967 VanDerWaalsContact CA-OE2 3.28Å; V924-E967 WeakPolarHBondContact CA-OE2 3.46Å; V924-E967 WeakPolarHBondContact CG1-OE2 3.45Å; V924-E967 HydrophobicContact CG2-CB 4.28Å; V924-E967 HydrophobicContact CG2-CG 4.47Å; T925-E967 WeakPolarHBondContact CB-OE1 3.43Å; T925-E967 PolarHBondContact N-OE1 2.87Å; T925-E967 VanDerWaalsContact N-OE1 3.11Å; T925-E967 PolarHBondContact N-OE2 3.37Å; T925-E967 PolarHBondContact OG1-OE1 2.64Å; T932-E967 PolarHBondContact O-N 3.36Å; E967-K996 PolarHBondContact O-N 3.3Å
968	V	81.6	Confident	68.1	Low	2 Å²	2	53.9 Å²	53.9	1%	0.012	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	137.1	179.6	-168.7	0	0	0	0	112.4	T920 V924 T932 V933 Y934 K996 V998	T920-V968 HydrophobicContact CG2-CB 3.63Å; T920-V968 HydrophobicContact CG2-CG1 3.56Å; T920-V968 HydrophobicContact CG2-CG2 4.04Å; V924-V968 HydrophobicContact CG2-CG2 3.98Å; T932-V968 PolarHBondContact O-N 3.27Å; V933-V968 WeakPolarHBondContact CA-O 3.32Å; Y934-V968 PolarHBondContact N-O 2.91Å; V968-K996 CarbonylContact C-O 3.48Å; V968-K996 WeakPolarHBondContact CA-O 3.47Å; V968-K996 WeakPolarHBondContact CG1-O 3.45Å; V968-V998 HydrophobicContact CG1-CG2 3.83Å
969	I	83.5	Confident	68.8	Low	5 Å²	5	50.3 Å²	50.3	3%	0.026	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	119.4	169.5	-67.6	174.1	0	0	0	109.1	Y934 L953 P966 L971 P995 K996 I997 V998	Y934-I969 HydrophobicContact CD1-CG1 4.44Å; Y934-I969 HydrophobicContact CD1-CG2 4.25Å; Y934-I969 WeakPolarHBondContact O-CA 3.42Å; L953-I969 HydrophobicContact CD2-CD1 4.09Å; P966-I969 HydrophobicContact CG-CG1 4.28Å; I969-L971 HydrophobicContact CG2-CD2 3.85Å; I969-L971 HydrophobicContact CG2-CG 4.16Å; I969-P995 HydrophobicContact CD1-CB 3.97Å; I969-P995 HydrophobicContact CD1-CG 3.53Å; I969-P995 HydrophobicContact CG1-CB 3.97Å; I969-P995 HydrophobicContact CG1-CG 4.12Å; I969-K996 PolarHBondContact N-O 3.43Å; I969-I997 HydrophobicContact CB-CG1 4.42Å; I969-I997 WeakPolarHBondContact O-CA 3.46Å; I969-V998 PolarHBondContact O-N 3.43Å
970	N	86.4	Confident	69.7	Low	1 Å²	1	49.6 Å²	49.6	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	122.5	174.1	-66.1	-20.8	0	0	0	110	V916 N917 T920 Y934 N935 F936 V998	V916-N970 HydrophobicContact CG1-CB 3.98Å; V916-N970 WeakPolarHBondContact CG1-OD1 3.2Å; N917-N970 PolarHBondContact OD1-ND2 3.16Å; T920-N970 PolarHBondContact OG1-OD1 2.95Å; Y934-N970 PolarHBondContact O-N 3.01Å; N935-N970 WeakPolarHBondContact OD1-CB 3.46Å; N935-N970 PolarHBondContact OD1-ND2 3.38Å; F936-N970 PolarHBondContact N-O 3.13Å; N970-V998 CarbonylContact C-O 3.59Å; N970-V998 WeakPolarHBondContact CA-O 3.46Å
971	L	86.1	Confident	70.6	Confident	2 Å²	2	49 Å²	49	1%	0.01	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	100.2	177.5	-64.4	-175.9	0	0	0	110.2	F936 F938 L949 I969 I974 L984 L988 I997 V998 G999 T1000	F936-L971 HydrophobicContact CB-CD2 3.97Å; F938-L971 HydrophobicContact CE2-CB 4.39Å; L949-L971 HydrophobicContact CD1-CD2 4.23Å; I969-L971 HydrophobicContact CG2-CD2 3.85Å; I969-L971 HydrophobicContact CG2-CG 4.16Å; L971-I974 HydrophobicContact CB-CD1 3.85Å; L971-I974 HydrophobicContact CB-CG1 3.95Å; L971-I974 HydrophobicContact CD1-CD1 4.46Å; L971-L984 HydrophobicContact CD1-CD2 4.34Å; L971-L988 HydrophobicContact CD1-CD1 4.21Å; L971-I997 HydrophobicContact CD1-CG2 3.67Å; L971-I997 HydrophobicContact CG-CG2 4.05Å; L971-V998 PolarHBondContact N-O 2.79Å; L971-G999 CarbonylContact O-C 3.35Å; L971-G999 VanDerWaalsContact O-CA 3.3Å; L971-G999 WeakPolarHBondContact O-CA 3.24Å; L971-T1000 PolarHBondContact O-N 2.98Å
972	L	84.7	Confident	71.5	Confident	4 Å²	4	46.6 Å²	46.6	2%	0.021	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	128.7	-172.5	-56	-177.2	0	0	0	112.4	V916 F936 R937 F938 T1000	V916-L972 HydrophobicContact CB-CD2 4.49Å; V916-L972 HydrophobicContact CG1-CD2 4.28Å; F936-L972 WeakPolarHBondContact O-CB 3.29Å; F936-L972 PolarHBondContact O-N 2.89Å; R937-L972 HydrophobicContact CB-CB 4.22Å; R937-L972 HydrophobicContact CG-CB 4.35Å; F938-L972 WeakPolarHBondContact CD2-O 3.44Å; F938-L972 PolarHBondContact N-O 2.88Å; L972-T1000 WeakPolarHBondContact CA-OG1 3.19Å; L972-T1000 HydrophobicContact CD2-CG2 4.2Å
973	N	80.9	Confident	72.6	Confident	9 Å²	9	43.5 Å²	43.5	5%	0.048	24%	0.24	C	C	.	.			trans	60.9	50.6	178.5	-72.7	-20.5	0	0	0	115.9	F938 Q975 H976 T1000 D1226	F938-N973 WeakPolarHBondContact CB-O 3.17Å; N973-Q975 VanDerWaalsContact C-OE1 3.26Å; N973-Q975 VanDerWaalsContact CB-NE2 3.34Å; N973-Q975 VanDerWaalsContact CG-NE2 3.33Å; N973-Q975 PolarHBondContact O-N 3.06Å; N973-Q975 PolarHBondContact OD1-NE2 3.02Å; N973-H976 PolarHBondContact O-N 3.17Å; N973-H976 VanDerWaalsContact O-N 3.16Å; N973-T1000 PolarHBondContact N-O 3.04Å; N973-T1000 PolarHBondContact N-OG1 3.23Å; N973-D1226 PolarHBondContact ND2-OD1 3.33Å; N973-D1226 PolarHBondContact ND2-OD2 3.1Å
974	I	82.7	Confident	73.6	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-54.6	-25.1	-178.3	-59.1	170.5	0	0	0	112.8	I903 F938 L971 H976 F977 F981 T1000 L1008	I903-I974 HydrophobicContact CD1-CD1 3.88Å; I903-I974 HydrophobicContact CG1-CD1 4.36Å; I903-I974 HydrophobicContact CG2-CD1 4.25Å; F938-I974 HydrophobicContact CD2-CG1 4.32Å; F938-I974 HydrophobicContact CE2-CG1 4Å; L971-I974 HydrophobicContact CB-CD1 3.85Å; L971-I974 HydrophobicContact CB-CG1 3.95Å; L971-I974 HydrophobicContact CD1-CD1 4.46Å; I974-H976 PolarHBondContact O-N 3.06Å; I974-H976 VanDerWaalsContact O-N 3.09Å; I974-F977 WeakPolarHBondContact O-CB 3.44Å; I974-F977 PolarHBondContact O-N 3.47Å; I974-F981 HydrophobicContact CG2-CD1 4.37Å; I974-F981 HydrophobicContact CG2-CE1 3.92Å; I974-T1000 WeakPolarHBondContact CG1-O 3.35Å; I974-T1000 PolarHBondContact N-O 3.41Å; I974-L1008 HydrophobicContact CG2-CD1 4.14Å; I974-L1008 HydrophobicContact CG2-CD2 3.99Å
975	Q	76	Confident	74.5	Confident	42 Å²	42	35.4 Å²	35.4	20%	0.196	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-60.5	-17.3	178.3	72.4	-79.1	-8.7	0	0	115.5	N973 S1001 L1008	N973-Q975 VanDerWaalsContact C-OE1 3.26Å; N973-Q975 VanDerWaalsContact CB-NE2 3.34Å; N973-Q975 VanDerWaalsContact CG-NE2 3.33Å; N973-Q975 PolarHBondContact O-N 3.06Å; N973-Q975 PolarHBondContact OD1-NE2 3.02Å; Q975-S1001 VanDerWaalsContact OE1-CA 3.31Å; Q975-L1008 HydrophobicContact CB-CD1 4.48Å
976	H	72.2	Confident	74.7	Confident	47 Å²	47	31.5 Å²	31.5	22%	0.218	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-94.4	6.3	176.8	-55.2	-50.3	0	0	0	113.6	F938 K939 H940 N973 I974 Q978	F938-H976 HydrophobicContact CB-CB 4.36Å; K939-H976 WeakPolarHBondContact O-CB 3.43Å; H940-H976 AromaticContact CE1-CD2 3.74Å; H940-H976 AromaticContact CE1-CE1 3.55Å; H940-H976 AromaticContact CE1-NE2 3.12Å; H940-H976 PolarHBondContact CE1-NE2 2.84Å; H940-H976 AromaticContact ND1-CD2 3.61Å; H940-H976 AromaticContact ND1-CE1 3.3Å; H940-H976 PolarHBondContact ND1-CE1 3.44Å; H940-H976 VanDerWaalsContact ND1-CE1 3.3Å; H940-H976 AromaticContact ND1-CG 3.93Å; H940-H976 AromaticContact ND1-ND1 3.73Å; H940-H976 AromaticContact ND1-NE2 3.24Å; H940-H976 PolarHBondContact ND1-NE2 2.95Å; N973-H976 PolarHBondContact O-N 3.17Å; N973-H976 VanDerWaalsContact O-N 3.16Å; I974-H976 PolarHBondContact O-N 3.06Å; I974-H976 VanDerWaalsContact O-N 3.09Å; H976-Q978 PolarHBondContact O-N 3.22Å
977	F	71.1	Confident	74.3	Confident	12 Å²	12	35 Å²	35	5%	0.053	20%	0.195	C	C	.	.			trans	-71.7	109.7	176.2	177	-105.4	0	0	0	111.9	F938 V946 I974 G979 S980 F981 L984	F938-F977 HydrophobicContact CD1-CB 4.11Å; F938-F977 AromaticContact CD1-CD2 3.98Å; F938-F977 HydrophobicContact CD1-CD2 3.98Å; F938-F977 HydrophobicContact CE1-CB 4.24Å; F938-F977 AromaticContact CE1-CD2 3.54Å; F938-F977 HydrophobicContact CE1-CD2 3.54Å; F938-F977 HydrophobicContact CE1-CE2 4.34Å; F938-F977 HydrophobicContact CE1-CG 4.28Å; F938-F977 HydrophobicContact CZ-CD2 4.32Å; V946-F977 HydrophobicContact CG2-CE2 3.38Å; V946-F977 HydrophobicContact CG2-CZ 3.32Å; I974-F977 WeakPolarHBondContact O-CB 3.44Å; I974-F977 PolarHBondContact O-N 3.47Å; F977-G979 VanDerWaalsContact CE1-O 3.27Å; F977-G979 WeakPolarHBondContact CE1-O 3.48Å; F977-G979 PolarHBondContact O-N 3.31Å; F977-S980 WeakPolarHBondContact CE1-O 3.45Å; F977-F981 HydrophobicContact CB-CE1 3.91Å; F977-F981 HydrophobicContact CB-CZ 4.34Å; F977-F981 AromaticContact CD1-CD1 3.68Å; F977-F981 HydrophobicContact CD1-CD1 3.68Å; F977-F981 AromaticContact CD1-CE1 3.37Å; F977-F981 HydrophobicContact CD1-CE1 3.37Å; F977-F981 HydrophobicContact CD1-CG 4.41Å; F977-F981 AromaticContact CD1-CZ 3.83Å; F977-F981 HydrophobicContact CD1-CZ 3.83Å; F977-F981 HydrophobicContact CE1-CD1 4.15Å; F977-F981 HydrophobicContact CE1-CE1 4.27Å; F977-F981 HydrophobicContact CG-CE1 4.05Å; F977-L984 HydrophobicContact CD1-CD1 4.25Å; F977-L984 HydrophobicContact CD2-CD1 3.77Å; F977-L984 HydrophobicContact CE1-CB 4.07Å; F977-L984 HydrophobicContact CE1-CD1 4.1Å; F977-L984 HydrophobicContact CE2-CB 4.47Å; F977-L984 HydrophobicContact CE2-CD1 3.64Å; F977-L984 HydrophobicContact CG-CD1 4.05Å; F977-L984 HydrophobicContact CZ-CB 3.84Å; F977-L984 HydrophobicContact CZ-CD1 3.79Å; F977-L984 HydrophobicContact CZ-CG 4.43Å
978	Q	63.6	Low	73.8	Confident	149 Å²	149	32.2 Å²	32.2	70%	0.696	18%	0.183	S	C	*	.			trans	-85.9	89.4	173.2	-63.3	-176.7	7.7	0	0	110.3	H976	H976-Q978 PolarHBondContact O-N 3.22Å
979	G	66.7	Low	72.7	Confident	40 Å²	40	38 Å²	38	41%	0.412	21%	0.207	S	C	.	.	S	Bend	trans	170.3	177.4	175.7	0	0	0	0	0	114.3	F977 F981	F977-G979 VanDerWaalsContact CE1-O 3.27Å; F977-G979 WeakPolarHBondContact CE1-O 3.48Å; F977-G979 PolarHBondContact O-N 3.31Å; G979-F981 PolarHBondContact O-N 3.43Å
980	S	69.1	Low	71.4	Confident	58 Å²	58	42.3 Å²	42.3	41%	0.406	23%	0.226	S	C	.	.			trans	-65.9	119.4	173.5	160.3	0	0	0	0	110.8	F977 S982 D983 L984	F977-S980 WeakPolarHBondContact CE1-O 3.45Å; S980-S982 PolarHBondContact O-N 2.87Å; S980-S982 WeakPolarHBondContact OG-CB 3.42Å; S980-S982 PolarHBondContact OG-N 3.46Å; S980-D983 WeakPolarHBondContact O-CA 3.38Å; S980-D983 VanDerWaalsContact O-CB 3.27Å; S980-D983 WeakPolarHBondContact O-CB 3.49Å; S980-D983 PolarHBondContact O-N 3.07Å; S980-D983 PolarHBondContact OG-N 3.04Å; S980-D983 VanDerWaalsContact OG-N 3.14Å; S980-D983 PolarHBondContact OG-OD1 3.32Å; S980-L984 PolarHBondContact O-N 3.32Å
981	F	72.5	Confident	69.7	Low	13 Å²	13	46.7 Å²	46.7	6%	0.057	26%	0.257	C	S	.	.	H	α-helix	trans	-63.7	-29.4	174.2	-64.2	-76.4	0	0	0	111.9	I974 F977 G979 D983 L984 F985 L1008 F1011	I974-F981 HydrophobicContact CG2-CD1 4.37Å; I974-F981 HydrophobicContact CG2-CE1 3.92Å; F977-F981 HydrophobicContact CB-CE1 3.91Å; F977-F981 HydrophobicContact CB-CZ 4.34Å; F977-F981 AromaticContact CD1-CD1 3.68Å; F977-F981 HydrophobicContact CD1-CD1 3.68Å; F977-F981 AromaticContact CD1-CE1 3.37Å; F977-F981 HydrophobicContact CD1-CE1 3.37Å; F977-F981 HydrophobicContact CD1-CG 4.41Å; F977-F981 AromaticContact CD1-CZ 3.83Å; F977-F981 HydrophobicContact CD1-CZ 3.83Å; F977-F981 HydrophobicContact CE1-CD1 4.15Å; F977-F981 HydrophobicContact CE1-CE1 4.27Å; F977-F981 HydrophobicContact CG-CE1 4.05Å; G979-F981 PolarHBondContact O-N 3.43Å; F981-D983 VanDerWaalsContact C-N 3.28Å; F981-D983 PolarHBondContact O-N 2.64Å; F981-L984 PolarHBondContact O-N 3.17Å; F981-L984 VanDerWaalsContact O-N 3.11Å; F981-F985 HydrophobicContact CB-CD2 4.33Å; F981-F985 HydrophobicContact CB-CE2 4.47Å; F981-F985 HydrophobicContact CD1-CE2 4.46Å; F981-F985 VanDerWaalsContact O-CD2 3.3Å; F981-F985 WeakPolarHBondContact O-CD2 3.21Å; F981-F985 PolarHBondContact O-N 2.97Å; F981-L1008 HydrophobicContact CD1-CD2 3.5Å; F981-L1008 VanDerWaalsContact CD1-CD2 3.5Å; F981-L1008 HydrophobicContact CD1-CG 3.99Å; F981-L1008 HydrophobicContact CD2-CD2 4.35Å; F981-L1008 HydrophobicContact CD2-CG 4.21Å; F981-L1008 HydrophobicContact CE1-CD1 3.91Å; F981-L1008 HydrophobicContact CE1-CD2 3.48Å; F981-L1008 VanDerWaalsContact CE1-CD2 3.48Å; F981-L1008 HydrophobicContact CE1-CG 3.55Å; F981-L1008 HydrophobicContact CE2-CD2 4.36Å; F981-L1008 HydrophobicContact CE2-CG 3.83Å; F981-L1008 HydrophobicContact CG-CD2 3.96Å; F981-L1008 HydrophobicContact CG-CG 4.32Å; F981-L1008 HydrophobicContact CZ-CD1 3.87Å; F981-L1008 HydrophobicContact CZ-CD2 3.97Å; F981-L1008 HydrophobicContact CZ-CG 3.49Å; F981-L1008 VanDerWaalsContact CZ-CG 3.49Å; F981-F1011 HydrophobicContact CB-CB 4.35Å; F981-F1011 HydrophobicContact CB-CD1 3.75Å; F981-F1011 HydrophobicContact CB-CD2 4Å; F981-F1011 HydrophobicContact CB-CE1 4.12Å; F981-F1011 HydrophobicContact CB-CE2 4.31Å; F981-F1011 HydrophobicContact CB-CG 3.71Å; F981-F1011 HydrophobicContact CB-CZ 4.37Å
982	S	68.7	Low	68.1	Low	60 Å²	60	52 Å²	52	42%	0.42	30%	0.295	S	S	.	.	H	α-helix	trans	-57.5	-42.8	169.7	-167.4	0	0	0	0	111.2	S980 L984 S986 F1011	S980-S982 PolarHBondContact O-N 2.87Å; S980-S982 WeakPolarHBondContact OG-CB 3.42Å; S980-S982 PolarHBondContact OG-N 3.46Å; S982-L984 VanDerWaalsContact C-N 3.3Å; S982-L984 PolarHBondContact O-N 2.98Å; S982-S986 WeakPolarHBondContact O-CB 3.44Å; S982-S986 PolarHBondContact O-N 3.05Å; S982-S986 PolarHBondContact O-OG 3Å; S982-F1011 VanDerWaalsContact N-CE2 3.25Å
983	D	69.1	Low	66.8	Low	75 Å²	75	57.3 Å²	57.3	40%	0.401	32%	0.323	S	S	.	.	H	α-helix	trans	-67.7	-25.3	176.7	-95.5	67.8	0	0	0	114	S980 F981 K987	S980-D983 WeakPolarHBondContact O-CA 3.38Å; S980-D983 VanDerWaalsContact O-CB 3.27Å; S980-D983 WeakPolarHBondContact O-CB 3.49Å; S980-D983 PolarHBondContact O-N 3.07Å; S980-D983 PolarHBondContact OG-N 3.04Å; S980-D983 VanDerWaalsContact OG-N 3.14Å; S980-D983 PolarHBondContact OG-OD1 3.32Å; F981-D983 VanDerWaalsContact C-N 3.28Å; F981-D983 PolarHBondContact O-N 2.64Å; D983-K987 VanDerWaalsContact CB-NZ 3.33Å; D983-K987 WeakPolarHBondContact O-CD 3.37Å; D983-K987 WeakPolarHBondContact O-CE 3.47Å; D983-K987 VanDerWaalsContact O-CG 3.27Å; D983-K987 WeakPolarHBondContact O-CG 3.34Å; D983-K987 PolarHBondContact O-NZ 3.47Å; D983-K987 IonicContact OD2-NZ 2.71Å; D983-K987 PolarHBondContact OD2-NZ 3.12Å
984	L	70.9	Confident	66	Low	7 Å²	7	59.2 Å²	59.2	4%	0.037	34%	0.337	C	S	.	.	H	α-helix	trans	-79.7	-54.2	175	-177.4	148	0	0	0	110.3	F938 L949 L971 F977 S980 F981 S982 K987 L988	F938-L984 HydrophobicContact CE1-CD1 4.23Å; F938-L984 HydrophobicContact CZ-CD1 3.78Å; L949-L984 HydrophobicContact CD1-CD1 4.48Å; L971-L984 HydrophobicContact CD1-CD2 4.34Å; F977-L984 HydrophobicContact CD1-CD1 4.25Å; F977-L984 HydrophobicContact CD2-CD1 3.77Å; F977-L984 HydrophobicContact CE1-CB 4.07Å; F977-L984 HydrophobicContact CE1-CD1 4.1Å; F977-L984 HydrophobicContact CE2-CB 4.47Å; F977-L984 HydrophobicContact CE2-CD1 3.64Å; F977-L984 HydrophobicContact CG-CD1 4.05Å; F977-L984 HydrophobicContact CZ-CB 3.84Å; F977-L984 HydrophobicContact CZ-CD1 3.79Å; F977-L984 HydrophobicContact CZ-CG 4.43Å; S980-L984 PolarHBondContact O-N 3.32Å; F981-L984 PolarHBondContact O-N 3.17Å; F981-L984 VanDerWaalsContact O-N 3.11Å; S982-L984 VanDerWaalsContact C-N 3.3Å; S982-L984 PolarHBondContact O-N 2.98Å; L984-K987 PolarHBondContact O-N 2.85Å; L984-L988 HydrophobicContact CD2-CD1 3.7Å; L984-L988 HydrophobicContact CG-CD1 4.31Å; L984-L988 WeakPolarHBondContact O-CD1 3.46Å; L984-L988 WeakPolarHBondContact O-CG 3.35Å
985	F	72.2	Confident	65.7	Low	1 Å²	1	59.7 Å²	59.7	0%	0.004	34%	0.339	C	S	.	.	H	α-helix	trans	-78.3	-30.1	-173.4	-70.1	-75	0	0	0	113.8	I901 I903 F981 K987 L988 K989 F1011 L1012 I1017	I901-F985 HydrophobicContact CD1-CD1 4.13Å; I901-F985 HydrophobicContact CG2-CD1 4.28Å; I901-F985 HydrophobicContact CG2-CE1 3.9Å; I903-F985 HydrophobicContact CD1-CE1 4.36Å; I903-F985 HydrophobicContact CD1-CZ 3.73Å; F981-F985 HydrophobicContact CB-CD2 4.33Å; F981-F985 HydrophobicContact CB-CE2 4.47Å; F981-F985 HydrophobicContact CD1-CE2 4.46Å; F981-F985 VanDerWaalsContact O-CD2 3.3Å; F981-F985 WeakPolarHBondContact O-CD2 3.21Å; F981-F985 PolarHBondContact O-N 2.97Å; F985-K987 VanDerWaalsContact C-N 3.3Å; F985-K987 PolarHBondContact O-N 2.68Å; F985-L988 HydrophobicContact CD1-CD1 4.46Å; F985-L988 PolarHBondContact O-N 2.78Å; F985-L988 VanDerWaalsContact O-N 3.15Å; F985-K989 WeakPolarHBondContact O-CG 3.45Å; F985-K989 PolarHBondContact O-N 2.67Å; F985-F1011 HydrophobicContact CB-CE1 4.02Å; F985-F1011 HydrophobicContact CB-CZ 4.01Å; F985-F1011 AromaticContact CD2-CD1 3.99Å; F985-F1011 HydrophobicContact CD2-CD1 3.99Å; F985-F1011 AromaticContact CD2-CE1 3.24Å; F985-F1011 HydrophobicContact CD2-CE1 3.24Å; F985-F1011 AromaticContact CD2-CZ 3.92Å; F985-F1011 HydrophobicContact CD2-CZ 3.92Å; F985-F1011 HydrophobicContact CE2-CD1 4.29Å; F985-F1011 AromaticContact CE2-CE1 3.95Å; F985-F1011 HydrophobicContact CE2-CE1 3.95Å; F985-F1011 AromaticContact CG-CE1 3.87Å; F985-F1011 HydrophobicContact CG-CE1 3.87Å; F985-F1011 HydrophobicContact CG-CZ 4.35Å; F985-L1012 HydrophobicContact CE2-CD2 4.35Å; F985-L1012 HydrophobicContact CZ-CD2 4.39Å; F985-I1017 HydrophobicContact CD1-CD1 4.11Å; F985-I1017 HydrophobicContact CE1-CD1 4.42Å; F985-I1017 HydrophobicContact CG-CD1 4.16Å
986	S	66.7	Low	66	Low	60 Å²	60	61.3 Å²	61.3	42%	0.42	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-62.6	-37.1	172.3	59.3	0	0	0	0	112.3	S982 L988 K989	S982-S986 WeakPolarHBondContact O-CB 3.44Å; S982-S986 PolarHBondContact O-N 3.05Å; S982-S986 PolarHBondContact O-OG 3Å; S986-L988 PolarHBondContact O-N 3.4Å; S986-K989 PolarHBondContact O-N 3.06Å
987	K	61.8	Low	66.6	Low	83 Å²	83	59.3 Å²	59.3	36%	0.361	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-78.4	0.8	177.3	-61.5	175.9	-159.4	133.5	0	113.6	V946 D983 L984 F985 F990	V946-K987 HydrophobicContact CG1-CD 4.43Å; D983-K987 VanDerWaalsContact CB-NZ 3.33Å; D983-K987 WeakPolarHBondContact O-CD 3.37Å; D983-K987 WeakPolarHBondContact O-CE 3.47Å; D983-K987 VanDerWaalsContact O-CG 3.27Å; D983-K987 WeakPolarHBondContact O-CG 3.34Å; D983-K987 PolarHBondContact O-NZ 3.47Å; D983-K987 IonicContact OD2-NZ 2.71Å; D983-K987 PolarHBondContact OD2-NZ 3.12Å; L984-K987 PolarHBondContact O-N 2.85Å; F985-K987 VanDerWaalsContact C-N 3.3Å; F985-K987 PolarHBondContact O-N 2.68Å; K987-F990 WeakPolarHBondContact O-CZ 3.34Å
988	L	63.7	Low	67.3	Low	6 Å²	6	58.8 Å²	58.8	3%	0.031	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-113.1	-7.7	174.4	-68.4	169.2	0	0	0	112.8	L953 L971 L984 F985 S986 F990 I997	L953-L988 HydrophobicContact CD1-CD2 3.59Å; L971-L988 HydrophobicContact CD1-CD1 4.21Å; L984-L988 HydrophobicContact CD2-CD1 3.7Å; L984-L988 HydrophobicContact CG-CD1 4.31Å; L984-L988 WeakPolarHBondContact O-CD1 3.46Å; L984-L988 WeakPolarHBondContact O-CG 3.35Å; F985-L988 HydrophobicContact CD1-CD1 4.46Å; F985-L988 PolarHBondContact O-N 2.78Å; F985-L988 VanDerWaalsContact O-N 3.15Å; S986-L988 PolarHBondContact O-N 3.4Å; L988-F990 HydrophobicContact CD2-CE2 4.44Å; L988-F990 VanDerWaalsContact O-CD2 3.3Å; L988-F990 WeakPolarHBondContact O-CD2 3.36Å; L988-F990 PolarHBondContact O-N 3.46Å; L988-F990 VanDerWaalsContact O-N 3.15Å; L988-I997 HydrophobicContact CB-CD1 3.76Å; L988-I997 HydrophobicContact CD1-CD1 4.18Å; L988-I997 HydrophobicContact CD2-CD1 4.27Å; L988-I997 HydrophobicContact CG-CD1 4.29Å
989	K	59.1	Low	68.5	Low	123 Å²	123	51.7 Å²	51.7	54%	0.535	30%	0.301	S	S	.	.			trans	-80.8	86.9	173.5	-74.8	174.4	-174.6	177.1	0	109.7	F985 S986 N1015	F985-K989 WeakPolarHBondContact O-CG 3.45Å; F985-K989 PolarHBondContact O-N 2.67Å; S986-K989 PolarHBondContact O-N 3.06Å; K989-N1015 PolarHBondContact NZ-OD1 2.94Å
990	F	55.9	Low	69.5	Low	97 Å²	97	49.8 Å²	49.8	43%	0.425	28%	0.282	S	S	.	.			trans	-92.6	-174.2	173.2	-54.5	-74.5	0	0	0	111.6	K987 L988 C994	K987-F990 WeakPolarHBondContact O-CZ 3.34Å; L988-F990 HydrophobicContact CD2-CE2 4.44Å; L988-F990 VanDerWaalsContact O-CD2 3.3Å; L988-F990 WeakPolarHBondContact O-CD2 3.36Å; L988-F990 PolarHBondContact O-N 3.46Å; L988-F990 VanDerWaalsContact O-N 3.15Å; F990-C994 VanDerWaalsContact C-SG 3.54Å; F990-C994 PolarHBondContact O-SG 2.97Å
991	S	51.1	Low	70.2	Confident	93 Å²	93	47 Å²	47	65%	0.65	26%	0.262	S	S	*	.	S	Bend	trans	-74.4	-171.7	177.3	55.7	0	0	0	0	112.6	N993 C994	S991-N993 PolarHBondContact O-N 3.04Å; S991-C994 PolarHBondContact O-N 3.35Å; S991-C994 PolarHBondContact O-SG 2.93Å
992	S	51.9	Low	70.4	Confident	114 Å²	114	47.1 Å²	47.1	80%	0.797	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	-19.6	-171.3	53.5	0	0	0	0	117	C994	S992-C994 PolarHBondContact O-N 2.98Å
993	N	57	Low	70.4	Confident	114 Å²	114	47.7 Å²	47.7	61%	0.61	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	37.8	-175.8	-57.8	17.9	0	0	0	111.3	S991	S991-N993 PolarHBondContact O-N 3.04Å
994	C	64.4	Low	70.1	Confident	50 Å²	50	45.1 Å²	45.1	34%	0.338	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-66	141.6	179.3	-79.7	0	0	0	0	112.4	F990 S991 S992	F990-C994 VanDerWaalsContact C-SG 3.54Å; F990-C994 PolarHBondContact O-SG 2.97Å; S991-C994 PolarHBondContact O-N 3.35Å; S991-C994 PolarHBondContact O-SG 2.93Å; S992-C994 PolarHBondContact O-N 2.98Å
995	P	75.5	Confident	70	Confident	9 Å²	9	46.9 Å²	46.9	6%	0.058	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-60.3	146.5	156.5	27.3	-33.5	0	0	0	110	P966 I969	P966-P995 HydrophobicContact CG-CB 4.35Å; P966-P995 WeakPolarHBondContact O-CB 3.5Å; I969-P995 HydrophobicContact CD1-CB 3.97Å; I969-P995 HydrophobicContact CD1-CG 3.53Å; I969-P995 HydrophobicContact CG1-CB 3.97Å; I969-P995 HydrophobicContact CG1-CG 4.12Å
996	K	82.8	Confident	69.8	Low	76 Å²	76	49.7 Å²	49.7	33%	0.33	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	138.2	168.8	-60.7	-163.4	-178.9	-169.3	0	109.7	R897 E967 V968 I969	R897-K996 PolarHBondContact O-NZ 3.35Å; E967-K996 PolarHBondContact O-N 3.3Å; V968-K996 CarbonylContact C-O 3.48Å; V968-K996 WeakPolarHBondContact CA-O 3.47Å; V968-K996 WeakPolarHBondContact CG1-O 3.45Å; I969-K996 PolarHBondContact N-O 3.43Å
997	I	84.2	Confident	69.9	Low	6 Å²	6	53.5 Å²	53.5	3%	0.031	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	115.2	-175.3	-59.5	171.5	0	0	0	109.2	S900 I901 V902 I969 L971 L988	S900-I997 PolarHBondContact O-N 3.08Å; I901-I997 WeakPolarHBondContact CA-O 3.43Å; I901-I997 HydrophobicContact CD1-CD1 4.41Å; I901-I997 HydrophobicContact CG1-CB 4.31Å; I901-I997 HydrophobicContact CG1-CD1 4.3Å; I901-I997 HydrophobicContact CG2-CB 4.25Å; I901-I997 HydrophobicContact CG2-CG2 4.24Å; V902-I997 PolarHBondContact N-O 3.5Å; I969-I997 HydrophobicContact CB-CG1 4.42Å; I969-I997 WeakPolarHBondContact O-CA 3.46Å; L971-I997 HydrophobicContact CD1-CG2 3.67Å; L971-I997 HydrophobicContact CG-CG2 4.05Å; L988-I997 HydrophobicContact CB-CD1 3.76Å; L988-I997 HydrophobicContact CD1-CD1 4.18Å; L988-I997 HydrophobicContact CD2-CD1 4.27Å; L988-I997 HydrophobicContact CG-CD1 4.29Å
998	V	87.4	Confident	70.4	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.006	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	107.1	-179	-167.8	0	0	0	0	109.7	I896 V902 V916 V968 I969 N970 L971	I896-V998 HydrophobicContact CD1-CG1 4.25Å; I896-V998 HydrophobicContact CG2-CG2 3.64Å; V902-V998 CarbonylContact O-C 3.52Å; V902-V998 WeakPolarHBondContact O-CA 3.28Å; V916-V998 HydrophobicContact CB-CG1 4.25Å; V916-V998 HydrophobicContact CG1-CB 4Å; V916-V998 HydrophobicContact CG1-CG1 3.66Å; V916-V998 HydrophobicContact CG2-CG1 3.68Å; V968-V998 HydrophobicContact CG1-CG2 3.83Å; I969-V998 PolarHBondContact O-N 3.43Å; N970-V998 CarbonylContact C-O 3.59Å; N970-V998 WeakPolarHBondContact CA-O 3.46Å; L971-V998 PolarHBondContact N-O 2.79Å
999	G	87.3	Confident	70.8	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	158.1	-179.3	0	0	0	0	0	113.9	V902 I903 I904 L971	V902-G999 PolarHBondContact O-N 3.04Å; I903-G999 WeakPolarHBondContact CA-O 3.49Å; I904-G999 PolarHBondContact N-O 2.89Å; L971-G999 CarbonylContact O-C 3.35Å; L971-G999 VanDerWaalsContact O-CA 3.3Å; L971-G999 WeakPolarHBondContact O-CA 3.24Å
1000	T	87.8	Confident	71.6	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	139.9	160.3	54.5	0	0	0	0	110.3	I904 K912 V916 L971 L972 N973 I974	I904-T1000 WeakPolarHBondContact O-CA 3.17Å; K912-T1000 HydrophobicContact CB-CG2 3.94Å; V916-T1000 HydrophobicContact CB-CG2 4.1Å; V916-T1000 HydrophobicContact CG2-CG2 3.43Å; V916-T1000 VanDerWaalsContact CG2-CG2 3.43Å; L971-T1000 PolarHBondContact O-N 2.98Å; L972-T1000 WeakPolarHBondContact CA-OG1 3.19Å; L972-T1000 HydrophobicContact CD2-CG2 4.2Å; N973-T1000 PolarHBondContact N-O 3.04Å; N973-T1000 PolarHBondContact N-OG1 3.23Å; I974-T1000 WeakPolarHBondContact CG1-O 3.35Å; I974-T1000 PolarHBondContact N-O 3.41Å
1001	S	84.2	Confident	72.5	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	144	175	-171.8	0	0	0	0	112.1	I904 Y905 G906 K912 Q975	I904-S1001 PolarHBondContact O-N 2.94Å; Y905-S1001 WeakPolarHBondContact CA-O 3.49Å; Y905-S1001 WeakPolarHBondContact CE1-OG 3.47Å; Y905-S1001 VanDerWaalsContact CZ-CB 3.5Å; G906-S1001 PolarHBondContact N-O 2.89Å; K912-S1001 WeakPolarHBondContact CE-O 3.4Å; Q975-S1001 VanDerWaalsContact OE1-CA 3.31Å
1002	G	76.7	Confident	73.9	Confident	14 Å²	14	43.7 Å²	43.7	14%	0.144	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	154.3	158.8	0	0	0	0	0	111.7	Y905	Y905-G1002 WeakPolarHBondContact CE1-O 3.3Å
1003	T	68.5	Low	74.9	Confident	73 Å²	73	44.8 Å²	44.8	45%	0.448	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	145.8	167.1	41.2	0	0	0	0	111.4	G906	G906-T1003 PolarHBondContact O-N 2.72Å
1004	G	62.6	Low	75.8	Confident	21 Å²	21	46.1 Å²	46.1	22%	0.216	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	105.8	-7	168	0	0	0	0	0	116.1	I1006 E1009	G1004-I1006 PolarHBondContact O-N 3.28Å; G1004-I1006 VanDerWaalsContact O-N 3.17Å; G1004-E1009 PolarHBondContact N-OE1 2.73Å
1005	N	68.5	Low	76.2	Confident	43 Å²	43	46 Å²	46	23%	0.23	24%	0.235	C	C	.	.			trans	-81.8	94.6	169.4	-173.3	-34.2	0	0	0	109.7	E1007 L1008 E1009	N1005-E1007 VanDerWaalsContact C-N 3.27Å; N1005-E1007 PolarHBondContact O-N 2.89Å; N1005-E1007 PolarHBondContact OD1-N 2.92Å; N1005-E1007 VanDerWaalsContact OD1-N 3.17Å; N1005-L1008 HydrophobicContact CB-CB 4Å; N1005-L1008 HydrophobicContact CB-CD1 4.05Å; N1005-L1008 WeakPolarHBondContact O-CB 3.37Å; N1005-L1008 PolarHBondContact O-N 3.3Å; N1005-L1008 PolarHBondContact OD1-N 3.44Å; N1005-E1009 WeakPolarHBondContact O-CG 3.3Å; N1005-E1009 PolarHBondContact O-N 2.83Å
1006	I	68.4	Low	76.1	Confident	60 Å²	60	54.2 Å²	54.2	31%	0.308	27%	0.272	S	S	.	.	H	α-helix	trans	-62.7	-31.1	-176.7	-60.6	174.3	0	0	0	112.1	G1004 K1010	G1004-I1006 PolarHBondContact O-N 3.28Å; G1004-I1006 VanDerWaalsContact O-N 3.17Å; I1006-K1010 HydrophobicContact CG2-CD 4.04Å; I1006-K1010 HydrophobicContact CG2-CG 4.43Å; I1006-K1010 WeakPolarHBondContact O-CB 3.33Å; I1006-K1010 VanDerWaalsContact O-CG 3.26Å; I1006-K1010 WeakPolarHBondContact O-CG 3.34Å; I1006-K1010 PolarHBondContact O-N 3.49Å
1007	E	68.3	Low	76.1	Confident	141 Å²	141	51.4 Å²	51.4	66%	0.659	26%	0.261	S	S	*	.	H	α-helix	trans	-70.3	-42.5	178.8	-57.8	-166.5	151.9	0	0	111.4	N1005 K1010 F1011	N1005-E1007 VanDerWaalsContact C-N 3.27Å; N1005-E1007 PolarHBondContact O-N 2.89Å; N1005-E1007 PolarHBondContact OD1-N 2.92Å; N1005-E1007 VanDerWaalsContact OD1-N 3.17Å; E1007-K1010 PolarHBondContact O-N 3.03Å; E1007-F1011 VanDerWaalsContact O-CB 3.26Å; E1007-F1011 WeakPolarHBondContact O-CB 3.11Å; E1007-F1011 PolarHBondContact O-N 3.11Å
1008	L	73.3	Confident	76.1	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.3	-50.5	170.6	-102.4	172.7	0	0	0	111.5	Y905 I974 Q975 F981 N1005 K1010 F1011 L1012	Y905-L1008 WeakPolarHBondContact OH-CB 3.43Å; I974-L1008 HydrophobicContact CG2-CD1 4.14Å; I974-L1008 HydrophobicContact CG2-CD2 3.99Å; Q975-L1008 HydrophobicContact CB-CD1 4.48Å; F981-L1008 HydrophobicContact CD1-CD2 3.5Å; F981-L1008 VanDerWaalsContact CD1-CD2 3.5Å; F981-L1008 HydrophobicContact CD1-CG 3.99Å; F981-L1008 HydrophobicContact CD2-CD2 4.35Å; F981-L1008 HydrophobicContact CD2-CG 4.21Å; F981-L1008 HydrophobicContact CE1-CD1 3.91Å; F981-L1008 HydrophobicContact CE1-CD2 3.48Å; F981-L1008 VanDerWaalsContact CE1-CD2 3.48Å; F981-L1008 HydrophobicContact CE1-CG 3.55Å; F981-L1008 HydrophobicContact CE2-CD2 4.36Å; F981-L1008 HydrophobicContact CE2-CG 3.83Å; F981-L1008 HydrophobicContact CG-CD2 3.96Å; F981-L1008 HydrophobicContact CG-CG 4.32Å; F981-L1008 HydrophobicContact CZ-CD1 3.87Å; F981-L1008 HydrophobicContact CZ-CD2 3.97Å; F981-L1008 HydrophobicContact CZ-CG 3.49Å; F981-L1008 VanDerWaalsContact CZ-CG 3.49Å; N1005-L1008 HydrophobicContact CB-CB 4Å; N1005-L1008 HydrophobicContact CB-CD1 4.05Å; N1005-L1008 WeakPolarHBondContact O-CB 3.37Å; N1005-L1008 PolarHBondContact O-N 3.3Å; N1005-L1008 PolarHBondContact OD1-N 3.44Å; L1008-K1010 VanDerWaalsContact C-N 3.34Å; L1008-K1010 PolarHBondContact O-N 3.08Å; L1008-F1011 PolarHBondContact O-N 3.26Å; L1008-L1012 HydrophobicContact CD2-CD1 4.48Å; L1008-L1012 WeakPolarHBondContact O-CG 3.46Å; L1008-L1012 PolarHBondContact O-N 3.41Å
1009	E	73	Confident	76	Confident	78 Å²	78	58 Å²	58	36%	0.364	29%	0.294	S	S	.	.	H	α-helix	trans	-59	-43.3	180	-71.7	173.1	-154.8	0	0	111.8	Y905 G1004 N1005 I1013	Y905-E1009 HydrophobicContact CE1-CG 4.07Å; G1004-E1009 PolarHBondContact N-OE1 2.73Å; N1005-E1009 WeakPolarHBondContact O-CG 3.3Å; N1005-E1009 PolarHBondContact O-N 2.83Å; E1009-I1013 WeakPolarHBondContact O-CD1 3.47Å; E1009-I1013 VanDerWaalsContact O-CG1 3.28Å; E1009-I1013 WeakPolarHBondContact O-CG1 3.39Å; E1009-I1013 PolarHBondContact O-N 3.11Å
1010	K	74.1	Confident	76.1	Confident	98 Å²	98	58.4 Å²	58.4	43%	0.426	30%	0.296	S	S	.	.	H	α-helix	trans	-61.3	-52.6	172.9	-74.7	167.5	-179.6	168	0	111.8	I1006 E1007 L1008 L1012 I1013 E1014	I1006-K1010 HydrophobicContact CG2-CD 4.04Å; I1006-K1010 HydrophobicContact CG2-CG 4.43Å; I1006-K1010 WeakPolarHBondContact O-CB 3.33Å; I1006-K1010 VanDerWaalsContact O-CG 3.26Å; I1006-K1010 WeakPolarHBondContact O-CG 3.34Å; I1006-K1010 PolarHBondContact O-N 3.49Å; E1007-K1010 PolarHBondContact O-N 3.03Å; L1008-K1010 VanDerWaalsContact C-N 3.34Å; L1008-K1010 PolarHBondContact O-N 3.08Å; K1010-L1012 VanDerWaalsContact C-N 3.28Å; K1010-L1012 PolarHBondContact O-N 2.98Å; K1010-I1013 PolarHBondContact O-N 3.39Å; K1010-I1013 VanDerWaalsContact O-N 3.16Å; K1010-E1014 WeakPolarHBondContact O-CG 3.18Å; K1010-E1014 PolarHBondContact O-N 3.16Å
1011	F	75.4	Confident	76	Confident	19 Å²	19	62.5 Å²	62.5	8%	0.083	32%	0.317	C	S	.	.	H	α-helix	trans	-57.2	-40	-175.8	177	-90.1	0	0	0	113	F981 S982 F985 E1007 L1008 E1014 N1015 I1017	F981-F1011 HydrophobicContact CB-CB 4.35Å; F981-F1011 HydrophobicContact CB-CD1 3.75Å; F981-F1011 HydrophobicContact CB-CD2 4Å; F981-F1011 HydrophobicContact CB-CE1 4.12Å; F981-F1011 HydrophobicContact CB-CE2 4.31Å; F981-F1011 HydrophobicContact CB-CG 3.71Å; F981-F1011 HydrophobicContact CB-CZ 4.37Å; S982-F1011 VanDerWaalsContact N-CE2 3.25Å; F985-F1011 HydrophobicContact CB-CE1 4.02Å; F985-F1011 HydrophobicContact CB-CZ 4.01Å; F985-F1011 AromaticContact CD2-CD1 3.99Å; F985-F1011 HydrophobicContact CD2-CD1 3.99Å; F985-F1011 AromaticContact CD2-CE1 3.24Å; F985-F1011 HydrophobicContact CD2-CE1 3.24Å; F985-F1011 AromaticContact CD2-CZ 3.92Å; F985-F1011 HydrophobicContact CD2-CZ 3.92Å; F985-F1011 HydrophobicContact CE2-CD1 4.29Å; F985-F1011 AromaticContact CE2-CE1 3.95Å; F985-F1011 HydrophobicContact CE2-CE1 3.95Å; F985-F1011 AromaticContact CG-CE1 3.87Å; F985-F1011 HydrophobicContact CG-CE1 3.87Å; F985-F1011 HydrophobicContact CG-CZ 4.35Å; E1007-F1011 VanDerWaalsContact O-CB 3.26Å; E1007-F1011 WeakPolarHBondContact O-CB 3.11Å; E1007-F1011 PolarHBondContact O-N 3.11Å; L1008-F1011 PolarHBondContact O-N 3.26Å; F1011-E1014 PolarHBondContact O-N 3.24Å; F1011-N1015 HydrophobicContact CE1-CB 4.3Å; F1011-N1015 WeakPolarHBondContact CE2-ND2 3.34Å; F1011-N1015 HydrophobicContact CZ-CB 4.41Å; F1011-N1015 WeakPolarHBondContact CZ-ND2 3.26Å; F1011-N1015 WeakPolarHBondContact O-CB 2.88Å; F1011-N1015 PolarHBondContact O-N 3.03Å; F1011-N1015 PolarHBondContact O-ND2 3.38Å; F1011-I1017 HydrophobicContact CE1-CD1 4.09Å
1012	L	79.9	Confident	76	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-71.4	-38	-179.5	-62.6	171.6	0	0	0	112.1	I903 Y905 F985 L1008 K1010 N1015 Q1016 I1017 V1019	I903-L1012 HydrophobicContact CD1-CD1 3.84Å; I903-L1012 HydrophobicContact CD1-CD2 3.5Å; I903-L1012 VanDerWaalsContact CD1-CD2 3.5Å; I903-L1012 HydrophobicContact CD1-CG 4.34Å; Y905-L1012 HydrophobicContact CE2-CD1 3.48Å; Y905-L1012 VanDerWaalsContact CE2-CD1 3.48Å; Y905-L1012 WeakPolarHBondContact OH-CD1 3.36Å; F985-L1012 HydrophobicContact CE2-CD2 4.35Å; F985-L1012 HydrophobicContact CZ-CD2 4.39Å; L1008-L1012 HydrophobicContact CD2-CD1 4.48Å; L1008-L1012 WeakPolarHBondContact O-CG 3.46Å; L1008-L1012 PolarHBondContact O-N 3.41Å; K1010-L1012 VanDerWaalsContact C-N 3.28Å; K1010-L1012 PolarHBondContact O-N 2.98Å; L1012-N1015 PolarHBondContact O-N 2.98Å; L1012-Q1016 PolarHBondContact O-N 2.95Å; L1012-I1017 HydrophobicContact CB-CB 4.31Å; L1012-I1017 HydrophobicContact CD2-CB 3.75Å; L1012-I1017 HydrophobicContact CD2-CD1 3.71Å; L1012-I1017 HydrophobicContact CD2-CG1 4.32Å; L1012-I1017 HydrophobicContact CD2-CG2 3.69Å; L1012-I1017 PolarHBondContact O-N 2.93Å; L1012-V1019 HydrophobicContact CB-CG2 4.34Å; L1012-V1019 HydrophobicContact CD1-CG2 3.95Å
1013	I	73.9	Confident	76.3	Confident	136 Å²	136	62.5 Å²	62.5	70%	0.697	31%	0.314	S	S	*	.	H	α-helix	trans	-63.1	-46.3	172.6	-67.1	166.2	0	0	0	110.1	E1009 K1010 N1015 Q1016	E1009-I1013 WeakPolarHBondContact O-CD1 3.47Å; E1009-I1013 VanDerWaalsContact O-CG1 3.28Å; E1009-I1013 WeakPolarHBondContact O-CG1 3.39Å; E1009-I1013 PolarHBondContact O-N 3.11Å; K1010-I1013 PolarHBondContact O-N 3.39Å; K1010-I1013 VanDerWaalsContact O-N 3.16Å; I1013-N1015 VanDerWaalsContact C-N 3.3Å; I1013-N1015 PolarHBondContact O-N 2.64Å; I1013-Q1016 PolarHBondContact O-N 3.31Å
1014	E	75	Confident	76.7	Confident	142 Å²	142	60.5 Å²	60.5	66%	0.664	30%	0.303	S	S	*	.	H	α-helix	trans	-61.6	-35.6	178.2	-72.1	167.7	-169.2	0	0	112.8	K1010 F1011	K1010-E1014 WeakPolarHBondContact O-CG 3.18Å; K1010-E1014 PolarHBondContact O-N 3.16Å; F1011-E1014 PolarHBondContact O-N 3.24Å
1015	N	72.7	Confident	77.5	Confident	49 Å²	49	62.8 Å²	62.8	26%	0.262	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	4.3	179	-79.8	-99.2	0	0	0	114.3	K989 F1011 L1012 I1013 I1017	K989-N1015 PolarHBondContact NZ-OD1 2.94Å; F1011-N1015 HydrophobicContact CE1-CB 4.3Å; F1011-N1015 WeakPolarHBondContact CE2-ND2 3.34Å; F1011-N1015 HydrophobicContact CZ-CB 4.41Å; F1011-N1015 WeakPolarHBondContact CZ-ND2 3.26Å; F1011-N1015 WeakPolarHBondContact O-CB 2.88Å; F1011-N1015 PolarHBondContact O-N 3.03Å; F1011-N1015 PolarHBondContact O-ND2 3.38Å; L1012-N1015 PolarHBondContact O-N 2.98Å; I1013-N1015 VanDerWaalsContact C-N 3.3Å; I1013-N1015 PolarHBondContact O-N 2.64Å; N1015-I1017 HydrophobicContact CB-CD1 3.78Å; N1015-I1017 HydrophobicContact CB-CG1 3.95Å; N1015-I1017 PolarHBondContact O-N 3.15Å
1016	Q	74.3	Confident	78.1	Confident	180 Å²	180	61.5 Å²	61.5	84%	0.841	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	26.9	-175.5	-53.2	-177.9	5.9	0	0	113.9	L1012 I1013	L1012-Q1016 PolarHBondContact O-N 2.95Å; I1013-Q1016 PolarHBondContact O-N 3.31Å
1017	I	81.8	Confident	78.8	Confident	17 Å²	17	63 Å²	63	9%	0.087	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-75.2	131.9	179.5	-67.3	165.4	0	0	0	109.1	I901 I903 F985 F1011 L1012 N1015 V1019	I901-I1017 HydrophobicContact CB-CG1 4.47Å; I901-I1017 HydrophobicContact CB-CG2 4.06Å; I901-I1017 HydrophobicContact CG2-CD1 4.44Å; I901-I1017 HydrophobicContact CG2-CG1 4.44Å; I901-I1017 HydrophobicContact CG2-CG2 3.66Å; I903-I1017 HydrophobicContact CD1-CG2 4.49Å; I903-I1017 HydrophobicContact CG1-CG2 4.36Å; F985-I1017 HydrophobicContact CD1-CD1 4.11Å; F985-I1017 HydrophobicContact CE1-CD1 4.42Å; F985-I1017 HydrophobicContact CG-CD1 4.16Å; F1011-I1017 HydrophobicContact CE1-CD1 4.09Å; L1012-I1017 HydrophobicContact CB-CB 4.31Å; L1012-I1017 HydrophobicContact CD2-CB 3.75Å; L1012-I1017 HydrophobicContact CD2-CD1 3.71Å; L1012-I1017 HydrophobicContact CD2-CG1 4.32Å; L1012-I1017 HydrophobicContact CD2-CG2 3.69Å; L1012-I1017 PolarHBondContact O-N 2.93Å; N1015-I1017 HydrophobicContact CB-CD1 3.78Å; N1015-I1017 HydrophobicContact CB-CG1 3.95Å; N1015-I1017 PolarHBondContact O-N 3.15Å; I1017-V1019 PolarHBondContact O-N 3.34Å
1018	K	85.3	Confident	79.5	Confident	90 Å²	90	59.4 Å²	59.4	39%	0.391	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	120.3	-174.1	-177.5	72.7	-179	-162.2	0	111.1	T895 N899 V902 I903	T895-K1018 HydrophobicContact CG2-CD 4.1Å; T895-K1018 VanDerWaalsContact CG2-CE 3.49Å; T895-K1018 HydrophobicContact CG2-CG 3.47Å; T895-K1018 VanDerWaalsContact CG2-CG 3.47Å; N899-K1018 HydrophobicContact CB-CB 4.08Å; V902-K1018 VanDerWaalsContact CA-O 3.32Å; V902-K1018 WeakPolarHBondContact CA-O 3.46Å; V902-K1018 HydrophobicContact CG2-CB 4.26Å; V902-K1018 HydrophobicContact CG2-CG 4.48Å; I903-K1018 PolarHBondContact N-O 2.69Å
1019	V	85.8	Confident	80	Confident	56 Å²	56	59.5 Å²	59.5	34%	0.339	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	134.6	171.8	170.5	0	0	0	0	110.1	I903 Y905 L1012 I1017 N1021	I903-V1019 WeakPolarHBondContact O-CA 3.5Å; Y905-V1019 HydrophobicContact CD2-CB 4.46Å; Y905-V1019 HydrophobicContact CD2-CG1 3.63Å; Y905-V1019 HydrophobicContact CD2-CG2 4.1Å; Y905-V1019 HydrophobicContact CE2-CG1 4.35Å; Y905-V1019 HydrophobicContact CE2-CG2 4Å; Y905-V1019 HydrophobicContact CG-CG1 4.1Å; L1012-V1019 HydrophobicContact CB-CG2 4.34Å; L1012-V1019 HydrophobicContact CD1-CG2 3.95Å; I1017-V1019 PolarHBondContact O-N 3.34Å; V1019-N1021 WeakPolarHBondContact CG1-OD1 3.06Å
1020	I	88.6	Confident	80.6	Confident	9 Å²	9	58 Å²	58	5%	0.046	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	125.9	164.4	-66.6	176.4	0	0	0	107.1	Y892 T895 I896 V902 I903 I904 Y905	Y892-I1020 HydrophobicContact CD1-CD1 4.23Å; Y892-I1020 HydrophobicContact CD1-CG2 3.58Å; Y892-I1020 HydrophobicContact CD2-CG2 4.17Å; Y892-I1020 HydrophobicContact CE1-CG2 3.31Å; Y892-I1020 HydrophobicContact CE2-CG2 3.93Å; Y892-I1020 HydrophobicContact CG-CD1 4.17Å; Y892-I1020 HydrophobicContact CG-CG2 4.02Å; Y892-I1020 VanDerWaalsContact CZ-CG2 3.49Å; T895-I1020 HydrophobicContact CG2-CD1 3.75Å; T895-I1020 HydrophobicContact CG2-CG1 3.73Å; I896-I1020 HydrophobicContact CD1-CD1 4.47Å; I896-I1020 HydrophobicContact CG1-CD1 4.2Å; V902-I1020 HydrophobicContact CG1-CD1 3.56Å; V902-I1020 HydrophobicContact CG1-CG1 3.78Å; I903-I1020 PolarHBondContact O-N 2.98Å; I904-I1020 CarbonylContact C-O 3.44Å; I904-I1020 WeakPolarHBondContact CA-O 3.42Å; I904-I1020 HydrophobicContact CG1-CB 4.32Å; I904-I1020 HydrophobicContact CG1-CD1 4.44Å; I904-I1020 HydrophobicContact CG2-CG2 4.29Å; Y905-I1020 PolarHBondContact N-O 3.36Å
1021	N	86.5	Confident	81.2	Confident	85 Å²	85	56.1 Å²	56.1	46%	0.455	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	122.6	170.7	-65.5	-17.6	0	0	0	109.1	Y892 V1019 S1024	Y892-N1021 PolarHBondContact OH-O 3.22Å; Y892-N1021 VanDerWaalsContact OH-O 3.05Å; V1019-N1021 WeakPolarHBondContact CG1-OD1 3.06Å; N1021-S1024 VanDerWaalsContact CB-OG 3.31Å; N1021-S1024 WeakPolarHBondContact CB-OG 3.44Å
1022	H	84.6	Confident	81.8	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	28%	0.28	C	S	.	.	S	Bend	trans	-108.4	121.6	-176.9	175.3	73.4	0	0	0	110.8	Y892 I904 Y905 T910 K912 S1024	Y892-H1022 AromaticContact CE2-ND1 3.78Å; Y892-H1022 WeakPolarHBondContact OH-CA 3.26Å; I904-H1022 HydrophobicContact CG2-CB 3.55Å; Y905-H1022 WeakPolarHBondContact O-CB 3Å; Y905-H1022 PolarHBondContact O-N 2.98Å; T910-H1022 PolarHBondContact O-CD2 3.33Å; T910-H1022 PolarHBondContact O-NE2 2.94Å; K912-H1022 HydrophobicContact CD-CB 4.3Å; K912-H1022 HydrophobicContact CG-CB 4.3Å; K912-H1022 VanDerWaalsContact CG-CD2 3.49Å; K912-H1022 WeakPolarHBondContact CG-CD2 3.46Å; H1022-S1024 VanDerWaalsContact C-N 3.34Å; H1022-S1024 PolarHBondContact O-N 3.5Å
1023	L	82.1	Confident	82.2	Confident	14 Å²	14	55.4 Å²	55.4	7%	0.073	28%	0.28	C	S	.	.	S	Bend	trans	49	52.8	-174.2	-57	176.3	0	0	0	112.1	T910 D1028 A1029 Y1032 I1107	T910-L1023 HydrophobicContact CG2-CD1 4.27Å; L1023-D1028 HydrophobicContact CD2-CB 3.99Å; L1023-A1029 HydrophobicContact CB-CB 4.43Å; L1023-Y1032 HydrophobicContact CD1-CD1 3.42Å; L1023-Y1032 VanDerWaalsContact CD1-CD1 3.42Å; L1023-Y1032 HydrophobicContact CD1-CD2 3.87Å; L1023-Y1032 HydrophobicContact CD1-CE1 3.8Å; L1023-Y1032 HydrophobicContact CD1-CE2 4.21Å; L1023-Y1032 HydrophobicContact CD1-CG 3.45Å; L1023-Y1032 VanDerWaalsContact CD1-CG 3.45Å; L1023-Y1032 HydrophobicContact CD2-CD2 4.37Å; L1023-Y1032 HydrophobicContact CD2-CG 4.09Å; L1023-Y1032 HydrophobicContact CG-CG 4.44Å; L1023-I1107 HydrophobicContact CD1-CD1 4.15Å
1024	S	76.1	Confident	82.9	Confident	30 Å²	30	51.7 Å²	51.7	21%	0.21	26%	0.259	C	S	.	.			trans	-100.2	-10.9	-179.8	61.8	0	0	0	0	114.7	N1021 H1022 F1102	N1021-S1024 VanDerWaalsContact CB-OG 3.31Å; N1021-S1024 WeakPolarHBondContact CB-OG 3.44Å; H1022-S1024 VanDerWaalsContact C-N 3.34Å; H1022-S1024 PolarHBondContact O-N 3.5Å; S1024-F1102 VanDerWaalsContact O-CB 3.31Å; S1024-F1102 WeakPolarHBondContact O-CB 3.5Å; S1024-F1102 WeakPolarHBondContact O-CD1 3.23Å; S1024-F1102 WeakPolarHBondContact O-CG 3.42Å
1025	D	80.1	Confident	83.5	Confident	70 Å²	70	45.3 Å²	45.3	37%	0.374	23%	0.229	S	C	.	.	S	Bend	trans	-88.6	148.8	162.1	-165.2	16.3	0	0	0	109.9	N1027 D1028 A1029	D1025-N1027 PolarHBondContact O-N 3.43Å; D1025-N1027 PolarHBondContact OD2-ND2 3.01Å; D1025-D1028 HydrophobicContact CB-CB 4.35Å; D1025-A1029 VanDerWaalsContact O-CB 3.3Å; D1025-A1029 WeakPolarHBondContact O-CB 3.35Å; D1025-A1029 PolarHBondContact O-N 2.9Å; D1025-A1029 VanDerWaalsContact O-N 3.13Å
1026	I	80.2	Confident	84.1	Confident	16 Å²	16	43 Å²	43	8%	0.082	22%	0.217	C	C	.	.	H	α-helix	trans	-62.9	-38	177	-48.1	165.8	0	0	0	109.2	A1029 K1030 W1086 N1087 Y1094	I1026-A1029 PolarHBondContact O-N 3.41Å; I1026-K1030 VanDerWaalsContact O-CB 3.25Å; I1026-K1030 WeakPolarHBondContact O-CB 3.24Å; I1026-K1030 PolarHBondContact O-N 3.33Å; I1026-W1086 HydrophobicContact CG2-CH2 4.39Å; I1026-W1086 HydrophobicContact CG2-CZ3 3.98Å; I1026-N1087 VanDerWaalsContact CG2-OD1 3.3Å; I1026-N1087 WeakPolarHBondContact CG2-OD1 3.19Å; I1026-Y1094 HydrophobicContact CD1-CD2 3.74Å; I1026-Y1094 HydrophobicContact CD1-CE2 3.24Å; I1026-Y1094 HydrophobicContact CG1-CE2 3.6Å; I1026-Y1094 WeakPolarHBondContact CG1-OH 3.3Å
1027	N	83.1	Confident	84.8	Confident	91 Å²	91	34.4 Å²	34.4	49%	0.487	18%	0.177	S	C	.	.	H	α-helix	trans	-66.2	-55.2	-179.6	-53.4	-61.2	0	0	0	111.1	D1025 A1029 K1030 E1031	D1025-N1027 PolarHBondContact O-N 3.43Å; D1025-N1027 PolarHBondContact OD2-ND2 3.01Å; N1027-A1029 PolarHBondContact O-N 3.44Å; N1027-K1030 PolarHBondContact O-N 2.9Å; N1027-E1031 WeakPolarHBondContact O-CG 3.44Å; N1027-E1031 PolarHBondContact O-N 2.71Å
1028	D	83.7	Confident	85.1	Confident	66 Å²	66	34.3 Å²	34.3	35%	0.353	18%	0.176	S	C	.	.	H	α-helix	trans	-47.9	-47	173.6	-61.5	-10.6	0	0	0	111.5	L1023 D1025 Y1032	L1023-D1028 HydrophobicContact CD2-CB 3.99Å; D1025-D1028 HydrophobicContact CB-CB 4.35Å; D1028-Y1032 WeakPolarHBondContact O-CB 3.5Å; D1028-Y1032 PolarHBondContact O-N 2.99Å
1029	A	83.8	Confident	85.2	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.008	16%	0.16	C	C	.	.	H	α-helix	trans	-70.6	-36.6	-178.1	0	0	0	0	0	113.3	L1023 D1025 I1026 N1027 L1033 W1086 I1107	L1023-A1029 HydrophobicContact CB-CB 4.43Å; D1025-A1029 VanDerWaalsContact O-CB 3.3Å; D1025-A1029 WeakPolarHBondContact O-CB 3.35Å; D1025-A1029 PolarHBondContact O-N 2.9Å; D1025-A1029 VanDerWaalsContact O-N 3.13Å; I1026-A1029 PolarHBondContact O-N 3.41Å; N1027-A1029 PolarHBondContact O-N 3.44Å; A1029-L1033 WeakPolarHBondContact O-CB 3.25Å; A1029-L1033 PolarHBondContact O-N 3.27Å; A1029-W1086 HydrophobicContact CB-CH2 3.4Å; A1029-W1086 VanDerWaalsContact CB-CH2 3.4Å; A1029-W1086 HydrophobicContact CB-CZ2 4.15Å; A1029-W1086 HydrophobicContact CB-CZ3 4.04Å; A1029-I1107 HydrophobicContact CB-CD1 3.66Å; A1029-I1107 HydrophobicContact CB-CG1 4.47Å
1030	K	85.8	Confident	85.1	Confident	46 Å²	46	28.7 Å²	28.7	20%	0.2	15%	0.147	C	C	.	.	H	α-helix	trans	-66.9	-50.7	175.1	-174.9	-175.4	176.8	-176.7	0	110.7	I1026 N1027 Y1032 L1033 E1034 E1084 W1086 N1087	I1026-K1030 VanDerWaalsContact O-CB 3.25Å; I1026-K1030 WeakPolarHBondContact O-CB 3.24Å; I1026-K1030 PolarHBondContact O-N 3.33Å; N1027-K1030 PolarHBondContact O-N 2.9Å; K1030-Y1032 VanDerWaalsContact C-N 3.29Å; K1030-Y1032 PolarHBondContact O-N 3.04Å; K1030-L1033 WeakPolarHBondContact O-CB 3.37Å; K1030-L1033 PolarHBondContact O-N 3.28Å; K1030-E1034 WeakPolarHBondContact O-CB 3.46Å; K1030-E1034 PolarHBondContact O-N 3.12Å; K1030-E1084 IonicContact NZ-OE1 2.66Å; K1030-E1084 PolarHBondContact NZ-OE1 2.86Å; K1030-W1086 HydrophobicContact CB-CE3 4.34Å; K1030-W1086 HydrophobicContact CB-CZ3 4.07Å; K1030-N1087 HydrophobicContact CD-CB 4.11Å
1031	E	86.1	Confident	85	Confident	59 Å²	59	28.3 Å²	28.3	28%	0.276	15%	0.145	S	C	.	.	H	α-helix	trans	-63.2	-35.9	176.5	-64.3	178.1	-171.6	0	0	112.2	N1027 E1034 R1035	N1027-E1031 WeakPolarHBondContact O-CG 3.44Å; N1027-E1031 PolarHBondContact O-N 2.71Å; E1031-E1034 PolarHBondContact O-N 3.05Å; E1031-R1035 WeakPolarHBondContact O-CB 3.35Å; E1031-R1035 WeakPolarHBondContact O-CG 3.44Å; E1031-R1035 PolarHBondContact O-N 2.97Å; E1031-R1035 PolarHBondContact O-NE 2.82Å; E1031-R1035 VanDerWaalsContact O-NE 3.16Å; E1031-R1035 IonicContact OE2-CZ 2.65Å; E1031-R1035 IonicContact OE2-NH1 3.52Å; E1031-R1035 IonicContact OE2-NH2 3.03Å; E1031-R1035 PolarHBondContact OE2-NH2 2.83Å
1032	Y	87.6	Confident	84.9	Confident	5 Å²	5	24.2 Å²	24.2	2%	0.02	12%	0.123	C	C	.	.	H	α-helix	trans	-65.4	-42.6	174.6	176	-95.7	0	0	0	111.8	S882 L883 I884 L1023 D1028 K1030 S1036 I1107 L1111 I1229	S882-Y1032 WeakPolarHBondContact O-CE2 3.44Å; L883-Y1032 HydrophobicContact CB-CE2 4.46Å; I884-Y1032 HydrophobicContact CG1-CE2 4.44Å; L1023-Y1032 HydrophobicContact CD1-CD1 3.42Å; L1023-Y1032 VanDerWaalsContact CD1-CD1 3.42Å; L1023-Y1032 HydrophobicContact CD1-CD2 3.87Å; L1023-Y1032 HydrophobicContact CD1-CE1 3.8Å; L1023-Y1032 HydrophobicContact CD1-CE2 4.21Å; L1023-Y1032 HydrophobicContact CD1-CG 3.45Å; L1023-Y1032 VanDerWaalsContact CD1-CG 3.45Å; L1023-Y1032 HydrophobicContact CD2-CD2 4.37Å; L1023-Y1032 HydrophobicContact CD2-CG 4.09Å; L1023-Y1032 HydrophobicContact CG-CG 4.44Å; D1028-Y1032 WeakPolarHBondContact O-CB 3.5Å; D1028-Y1032 PolarHBondContact O-N 2.99Å; K1030-Y1032 VanDerWaalsContact C-N 3.29Å; K1030-Y1032 PolarHBondContact O-N 3.04Å; Y1032-S1036 WeakPolarHBondContact O-CB 3.44Å; Y1032-S1036 PolarHBondContact O-N 3.1Å; Y1032-S1036 PolarHBondContact O-OG 2.66Å; Y1032-I1107 HydrophobicContact CD1-CD1 4.12Å; Y1032-I1107 HydrophobicContact CD1-CG2 4.44Å; Y1032-L1111 HydrophobicContact CE1-CD1 4.48Å; Y1032-I1229 WeakPolarHBondContact OH-CD1 3.38Å
1033	L	88.1	Confident	84.8	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.1	-44.8	173.3	177.8	58.5	0	0	0	110.8	A1029 K1030 S1036 L1037 T1083 W1086 I1107 F1110 L1111	A1029-L1033 WeakPolarHBondContact O-CB 3.25Å; A1029-L1033 PolarHBondContact O-N 3.27Å; K1030-L1033 WeakPolarHBondContact O-CB 3.37Å; K1030-L1033 PolarHBondContact O-N 3.28Å; L1033-S1036 PolarHBondContact O-N 3.32Å; L1033-L1037 HydrophobicContact CD1-CD1 3.8Å; L1033-L1037 HydrophobicContact CD1-CG 3.92Å; L1033-L1037 HydrophobicContact CG-CD1 3.94Å; L1033-L1037 HydrophobicContact CG-CG 4.42Å; L1033-L1037 WeakPolarHBondContact O-CB 3.34Å; L1033-L1037 VanDerWaalsContact O-CG 3.31Å; L1033-L1037 WeakPolarHBondContact O-CG 3.49Å; L1033-L1037 PolarHBondContact O-N 3.11Å; L1033-T1083 HydrophobicContact CD2-CG2 4.31Å; L1033-T1083 HydrophobicContact CG-CG2 4.09Å; L1033-W1086 HydrophobicContact CD2-CB 3.82Å; L1033-W1086 HydrophobicContact CD2-CD2 4.05Å; L1033-W1086 HydrophobicContact CD2-CG 3.71Å; L1033-I1107 HydrophobicContact CB-CG2 3.91Å; L1033-I1107 HydrophobicContact CD1-CG2 3.79Å; L1033-I1107 HydrophobicContact CD2-CG2 4.49Å; L1033-I1107 HydrophobicContact CG-CG2 4.26Å; L1033-F1110 HydrophobicContact CD1-CB 3.82Å; L1033-F1110 HydrophobicContact CD2-CB 4.09Å; L1033-L1111 HydrophobicContact CD1-CD2 3.95Å; L1033-L1111 HydrophobicContact CD1-CG 4.3Å
1034	E	88.9	Confident	84.7	Confident	58 Å²	58	26.4 Å²	26.4	27%	0.271	13%	0.131	S	C	.	.	H	α-helix	trans	-59.9	-56.4	178.9	-163.8	161.9	156.9	0	0	111.9	K1030 E1031 S1036 L1037 N1038 T1083	K1030-E1034 WeakPolarHBondContact O-CB 3.46Å; K1030-E1034 PolarHBondContact O-N 3.12Å; E1031-E1034 PolarHBondContact O-N 3.05Å; E1034-S1036 PolarHBondContact O-N 3.5Å; E1034-L1037 PolarHBondContact O-N 2.76Å; E1034-N1038 WeakPolarHBondContact O-CB 3.36Å; E1034-N1038 VanDerWaalsContact O-CG 3.3Å; E1034-N1038 PolarHBondContact O-N 3.45Å; E1034-T1083 HydrophobicContact CB-CG2 3.74Å; E1034-T1083 HydrophobicContact CG-CG2 4.1Å
1035	R	88.5	Confident	84.8	Confident	8 Å²	8	25.8 Å²	25.8	3%	0.03	12%	0.124	C	C	.	.	H	α-helix	trans	-54	-40.1	174.7	-74	177.6	-79.5	-137.4	-1.7	112.3	L751 D752 L883 E1031 R1039	L751-R1035 WeakPolarHBondContact O-CG 3.5Å; D752-R1035 HydrophobicContact CB-CG 4.3Å; D752-R1035 IonicContact OD2-CZ 3.23Å; D752-R1035 IonicContact OD2-NH1 3.74Å; D752-R1035 PolarHBondContact OD2-NH1 3.26Å; L883-R1035 HydrophobicContact CB-CB 4.32Å; L883-R1035 HydrophobicContact CD1-CB 4.27Å; E1031-R1035 WeakPolarHBondContact O-CB 3.35Å; E1031-R1035 WeakPolarHBondContact O-CG 3.44Å; E1031-R1035 PolarHBondContact O-N 2.97Å; E1031-R1035 PolarHBondContact O-NE 2.82Å; E1031-R1035 VanDerWaalsContact O-NE 3.16Å; E1031-R1035 IonicContact OE2-CZ 2.65Å; E1031-R1035 IonicContact OE2-NH1 3.52Å; E1031-R1035 IonicContact OE2-NH2 3.03Å; E1031-R1035 PolarHBondContact OE2-NH2 2.83Å; R1035-R1039 PolarHBondContact O-N 3.45Å
1036	S	85.8	Confident	84.7	Confident	1 Å²	1	22.6 Å²	22.6	1%	0.007	11%	0.107	C	C	.	.	H	α-helix	trans	-72.6	-29.1	179.8	-61	0	0	0	0	113.9	Y1032 L1033 E1034 K1040 L1111	Y1032-S1036 WeakPolarHBondContact O-CB 3.44Å; Y1032-S1036 PolarHBondContact O-N 3.1Å; Y1032-S1036 PolarHBondContact O-OG 2.66Å; L1033-S1036 PolarHBondContact O-N 3.32Å; E1034-S1036 PolarHBondContact O-N 3.5Å; S1036-K1040 WeakPolarHBondContact O-CG 3.04Å; S1036-L1111 VanDerWaalsContact CB-CD2 3.41Å
1037	L	88.5	Confident	84.4	Confident	0 Å²	0	25 Å²	25	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-81.2	-40.8	173.8	-71	175.8	0	0	0	111	L1033 E1034 R1039 K1040 L1041 V1079 L1082 T1083 M1115	L1033-L1037 HydrophobicContact CD1-CD1 3.8Å; L1033-L1037 HydrophobicContact CD1-CG 3.92Å; L1033-L1037 HydrophobicContact CG-CD1 3.94Å; L1033-L1037 HydrophobicContact CG-CG 4.42Å; L1033-L1037 WeakPolarHBondContact O-CB 3.34Å; L1033-L1037 VanDerWaalsContact O-CG 3.31Å; L1033-L1037 WeakPolarHBondContact O-CG 3.49Å; L1033-L1037 PolarHBondContact O-N 3.11Å; E1034-L1037 PolarHBondContact O-N 2.76Å; L1037-R1039 VanDerWaalsContact C-N 3.3Å; L1037-R1039 PolarHBondContact O-N 3.36Å; L1037-K1040 WeakPolarHBondContact O-CB 3.29Å; L1037-K1040 PolarHBondContact O-N 2.93Å; L1037-L1041 PolarHBondContact O-N 3.17Å; L1037-V1079 HydrophobicContact CB-CB 4.39Å; L1037-V1079 HydrophobicContact CB-CG1 3.52Å; L1037-V1079 HydrophobicContact CB-CG2 4.02Å; L1037-V1079 HydrophobicContact CD1-CG1 4.09Å; L1037-V1079 HydrophobicContact CG-CG1 4.47Å; L1037-L1082 HydrophobicContact CD1-CB 4.34Å; L1037-T1083 HydrophobicContact CD1-CG2 4.32Å; L1037-M1115 HydrophobicContact CD2-CE 3.85Å
1038	N	88.8	Confident	83.7	Confident	14 Å²	14	23.8 Å²	23.8	8%	0.075	11%	0.111	C	C	.	.	H	α-helix	trans	-55.9	-43.9	172.5	-69.9	-6.6	0	0	0	111.1	F750 L751 E1034 K1040 L1041 I1042 V1079	F750-N1038 HydrophobicContact CD1-CB 4.4Å; F750-N1038 HydrophobicContact CE1-CB 4.14Å; L751-N1038 HydrophobicContact CD2-CB 4.28Å; L751-N1038 PolarHBondContact O-ND2 3.36Å; E1034-N1038 WeakPolarHBondContact O-CB 3.36Å; E1034-N1038 VanDerWaalsContact O-CG 3.3Å; E1034-N1038 PolarHBondContact O-N 3.45Å; N1038-K1040 VanDerWaalsContact C-N 3.33Å; N1038-K1040 PolarHBondContact O-N 3.33Å; N1038-L1041 PolarHBondContact O-N 3Å; N1038-I1042 WeakPolarHBondContact O-CG1 3.26Å; N1038-I1042 PolarHBondContact O-N 3.01Å; N1038-V1079 WeakPolarHBondContact OD1-CG1 3.39Å
1039	R	86.9	Confident	82.8	Confident	13 Å²	13	22.2 Å²	22.2	5%	0.049	10%	0.101	C	C	.	.	H	α-helix	trans	-58.2	-43.4	174.6	-170.4	169.6	71.5	-172.1	2.4	112.5	L751 G881 L883 R1035 L1037 I1042 Q1043 D1232	L751-R1039 HydrophobicContact CD2-CB 3.63Å; L751-R1039 HydrophobicContact CD2-CG 4.29Å; G881-R1039 PolarHBondContact O-NH1 3.31Å; G881-R1039 VanDerWaalsContact O-NH1 3.15Å; L883-R1039 HydrophobicContact CD1-CB 4.4Å; R1035-R1039 PolarHBondContact O-N 3.45Å; L1037-R1039 VanDerWaalsContact C-N 3.3Å; L1037-R1039 PolarHBondContact O-N 3.36Å; R1039-I1042 PolarHBondContact O-N 3.29Å; R1039-Q1043 WeakPolarHBondContact O-CG 3.35Å; R1039-Q1043 PolarHBondContact O-N 3.5Å; R1039-D1232 IonicContact CZ-OD2 2.61Å; R1039-D1232 VanDerWaalsContact CZ-OD2 3.3Å; R1039-D1232 IonicContact NE-OD2 2.64Å; R1039-D1232 PolarHBondContact NE-OD2 3.18Å; R1039-D1232 IonicContact NH2-OD2 2.68Å; R1039-D1232 PolarHBondContact NH2-OD2 3.38Å
1040	K	84.3	Confident	81.7	Confident	16 Å²	16	24.8 Å²	24.8	7%	0.07	11%	0.112	C	C	.	.	H	α-helix	trans	-67.4	-39.1	178.7	-74.4	168.1	179.7	162.6	0	112.3	S1036 L1037 N1038 Q1043 Y1044 L1111 M1115 D1232	S1036-K1040 WeakPolarHBondContact O-CG 3.04Å; L1037-K1040 WeakPolarHBondContact O-CB 3.29Å; L1037-K1040 PolarHBondContact O-N 2.93Å; N1038-K1040 VanDerWaalsContact C-N 3.33Å; N1038-K1040 PolarHBondContact O-N 3.33Å; K1040-Q1043 PolarHBondContact O-N 2.99Å; K1040-Y1044 WeakPolarHBondContact O-CB 3.36Å; K1040-Y1044 PolarHBondContact O-N 3.08Å; K1040-L1111 PolarHBondContact NZ-O 3.18Å; K1040-M1115 HydrophobicContact CB-CG 3.65Å; K1040-M1115 HydrophobicContact CB-SD 4.06Å; K1040-D1232 WeakPolarHBondContact CE-OD1 3.35Å; K1040-D1232 VanDerWaalsContact CG-OD1 3.31Å; K1040-D1232 WeakPolarHBondContact CG-OD1 3.48Å; K1040-D1232 IonicContact NZ-OD1 3.47Å
1041	L	85.8	Confident	80.2	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61.7	-45.2	175.8	179.9	53.4	0	0	0	110.7	L661 L1037 N1038 Y1044 R1045 L1075 N1076 V1079 M1115	L661-L1041 HydrophobicContact CD1-CD1 4.19Å; L661-L1041 HydrophobicContact CD1-CD2 4.07Å; L661-L1041 HydrophobicContact CD1-CG 3.87Å; L1037-L1041 PolarHBondContact O-N 3.17Å; N1038-L1041 PolarHBondContact O-N 3Å; L1041-Y1044 PolarHBondContact O-N 3.21Å; L1041-R1045 WeakPolarHBondContact O-CB 3.3Å; L1041-R1045 PolarHBondContact O-N 2.96Å; L1041-L1075 HydrophobicContact CD1-CB 3.62Å; L1041-L1075 HydrophobicContact CD1-CD1 3.79Å; L1041-L1075 HydrophobicContact CD1-CG 4.26Å; L1041-L1075 HydrophobicContact CD2-CB 4.23Å; L1041-N1076 WeakPolarHBondContact CD2-OD1 3.43Å; L1041-V1079 HydrophobicContact CD2-CG2 4.27Å; L1041-M1115 HydrophobicContact CB-SD 4.19Å
1042	I	83.5	Confident	78.6	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-58.4	-50.5	172.5	-64.5	159.7	0	0	0	111.4	L661 L664 Y747 F750 L751 N1038 R1039 Y1044 R1045 L1046	L661-I1042 HydrophobicContact CD2-CG1 3.88Å; L664-I1042 HydrophobicContact CD1-CD1 4.13Å; L664-I1042 HydrophobicContact CD1-CG1 3.95Å; L664-I1042 HydrophobicContact CD1-CG2 4.18Å; Y747-I1042 HydrophobicContact CD2-CD1 3.96Å; Y747-I1042 HydrophobicContact CD2-CG2 4.08Å; Y747-I1042 HydrophobicContact CE2-CB 4.48Å; Y747-I1042 HydrophobicContact CE2-CD1 3.85Å; Y747-I1042 HydrophobicContact CE2-CG2 3.81Å; F750-I1042 HydrophobicContact CB-CD1 4.41Å; F750-I1042 HydrophobicContact CD1-CD1 3.35Å; F750-I1042 HydrophobicContact CD1-CG1 3.59Å; F750-I1042 HydrophobicContact CE1-CD1 3.94Å; F750-I1042 HydrophobicContact CE1-CG1 3.7Å; F750-I1042 HydrophobicContact CG-CD1 4.1Å; F750-I1042 HydrophobicContact CG-CG1 4.35Å; L751-I1042 HydrophobicContact CD2-CD1 3.82Å; L751-I1042 HydrophobicContact CG-CD1 4.17Å; N1038-I1042 WeakPolarHBondContact O-CG1 3.26Å; N1038-I1042 PolarHBondContact O-N 3.01Å; R1039-I1042 PolarHBondContact O-N 3.29Å; I1042-Y1044 PolarHBondContact O-N 3.06Å; I1042-R1045 PolarHBondContact O-N 2.81Å; I1042-L1046 HydrophobicContact CG2-CD1 3.44Å; I1042-L1046 VanDerWaalsContact CG2-CD1 3.44Å; I1042-L1046 HydrophobicContact CG2-CG 4.1Å; I1042-L1046 WeakPolarHBondContact O-CB 3.43Å; I1042-L1046 WeakPolarHBondContact O-CG 3.28Å; I1042-L1046 PolarHBondContact O-N 3.04Å
1043	Q	83	Confident	76.8	Confident	10 Å²	10	34.3 Å²	34.3	5%	0.047	17%	0.169	C	C	.	.	H	α-helix	trans	-59.1	-46.6	-179.7	-65.2	-43	-76.9	0	0	111.7	K721 R1039 K1040 F1047 D1232	K721-Q1043 PolarHBondContact O-NE2 3.06Å; R1039-Q1043 WeakPolarHBondContact O-CG 3.35Å; R1039-Q1043 PolarHBondContact O-N 3.5Å; K1040-Q1043 PolarHBondContact O-N 2.99Å; Q1043-F1047 WeakPolarHBondContact O-CB 3.47Å; Q1043-F1047 VanDerWaalsContact O-CD2 3.23Å; Q1043-F1047 WeakPolarHBondContact O-CD2 3.48Å; Q1043-F1047 PolarHBondContact O-N 3.29Å; Q1043-D1232 WeakPolarHBondContact CG-O 3.47Å
1044	Y	80.5	Confident	74.9	Confident	50 Å²	50	40.4 Å²	40.4	20%	0.196	20%	0.197	C	C	.	.	H	α-helix	trans	-59.4	-47.6	178.1	171.9	-95.7	0	0	0	112.1	K1040 L1041 I1042 F1047 N1048 L1075 M1115 H1116	K1040-Y1044 WeakPolarHBondContact O-CB 3.36Å; K1040-Y1044 PolarHBondContact O-N 3.08Å; L1041-Y1044 PolarHBondContact O-N 3.21Å; I1042-Y1044 PolarHBondContact O-N 3.06Å; Y1044-F1047 WeakPolarHBondContact O-CB 3.4Å; Y1044-F1047 PolarHBondContact O-N 3.42Å; Y1044-N1048 WeakPolarHBondContact CE1-ND2 3.47Å; Y1044-N1048 WeakPolarHBondContact CE2-ND2 3.19Å; Y1044-N1048 PolarHBondContact O-N 3.33Å; Y1044-N1048 VanDerWaalsContact O-N 3.14Å; Y1044-N1048 PolarHBondContact OH-ND2 2.76Å; Y1044-L1075 HydrophobicContact CD1-CD1 4.36Å; Y1044-L1075 HydrophobicContact CE1-CD1 3.99Å; Y1044-M1115 HydrophobicContact CD1-CB 4.17Å; Y1044-M1115 WeakPolarHBondContact CD1-O 3.35Å; Y1044-M1115 HydrophobicContact CD2-CB 4.26Å; Y1044-M1115 WeakPolarHBondContact CE1-O 3.41Å; Y1044-M1115 HydrophobicContact CG-CB 3.82Å; Y1044-M1115 VanDerWaalsContact CZ-O 3.29Å; Y1044-H1116 HydrophobicContact CE2-CB 4.12Å; Y1044-H1116 PolarHBondContact OH-CD2 2.96Å
1045	R	78.5	Confident	72.4	Confident	18 Å²	18	39.4 Å²	39.4	7%	0.068	20%	0.202	C	C	.	.	H	α-helix	trans	-66.3	-49.4	-176.1	-169.5	55.7	161.3	87	37.6	111.8	L661 L1041 I1042 F1047 N1048 E1049 D1072	L661-R1045 HydrophobicContact CB-CG 4.35Å; L661-R1045 HydrophobicContact CD1-CG 4.36Å; L1041-R1045 WeakPolarHBondContact O-CB 3.3Å; L1041-R1045 PolarHBondContact O-N 2.96Å; I1042-R1045 PolarHBondContact O-N 2.81Å; R1045-F1047 PolarHBondContact O-N 3.07Å; R1045-N1048 PolarHBondContact O-N 3.01Å; R1045-N1048 VanDerWaalsContact O-N 3.14Å; R1045-E1049 IonicContact CZ-OE1 3.53Å; R1045-E1049 IonicContact NH1-OE1 2.89Å; R1045-E1049 PolarHBondContact NH1-OE1 2.98Å; R1045-E1049 IonicContact NH1-OE2 2.66Å; R1045-E1049 IonicContact NH2-OE1 2.77Å; R1045-E1049 PolarHBondContact NH2-OE1 2.99Å; R1045-E1049 VanDerWaalsContact NH2-OE1 3.09Å; R1045-E1049 WeakPolarHBondContact O-CG 3.38Å; R1045-E1049 PolarHBondContact O-N 2.7Å; R1045-E1049 VanDerWaalsContact O-N 3.11Å; R1045-D1072 VanDerWaalsContact CD-OD1 3.22Å; R1045-D1072 WeakPolarHBondContact CD-OD1 3.4Å; R1045-D1072 IonicContact CZ-OD1 2.78Å; R1045-D1072 IonicContact CZ-OD2 3.9Å; R1045-D1072 VanDerWaalsContact CZ-OD2 3.23Å; R1045-D1072 IonicContact NE-OD1 3.16Å; R1045-D1072 PolarHBondContact NE-OD1 3.29Å; R1045-D1072 IonicContact NE-OD2 2.71Å; R1045-D1072 PolarHBondContact NE-OD2 2.91Å; R1045-D1072 IonicContact NH2-OD2 2.71Å; R1045-D1072 PolarHBondContact NH2-OD2 2.85Å
1046	L	77.6	Confident	69.8	Low	3 Å²	3	48.6 Å²	48.6	2%	0.016	24%	0.243	C	C	.	.	H	α-helix	trans	-67.3	-19.8	178.7	-64.2	177.1	0	0	0	113.4	K721 I1042	K721-L1046 HydrophobicContact CB-CD1 4.49Å; K721-L1046 HydrophobicContact CD-CB 3.85Å; K721-L1046 HydrophobicContact CG-CB 4.18Å; K721-L1046 HydrophobicContact CG-CD1 4.1Å; K721-L1046 PolarHBondContact NZ-O 3.19Å; I1042-L1046 HydrophobicContact CG2-CD1 3.44Å; I1042-L1046 VanDerWaalsContact CG2-CD1 3.44Å; I1042-L1046 HydrophobicContact CG2-CG 4.1Å; I1042-L1046 WeakPolarHBondContact O-CB 3.43Å; I1042-L1046 WeakPolarHBondContact O-CG 3.28Å; I1042-L1046 PolarHBondContact O-N 3.04Å
1047	F	72.8	Confident	67.4	Low	66 Å²	66	51.8 Å²	51.8	29%	0.289	26%	0.26	S	S	.	.	H	α-helix	trans	-71.2	-54.7	167	-98.1	-57.7	0	0	0	111.3	Q1043 Y1044 R1045 E1049 F1050 Y1051 I1234 L1241	Q1043-F1047 WeakPolarHBondContact O-CB 3.47Å; Q1043-F1047 VanDerWaalsContact O-CD2 3.23Å; Q1043-F1047 WeakPolarHBondContact O-CD2 3.48Å; Q1043-F1047 PolarHBondContact O-N 3.29Å; Y1044-F1047 WeakPolarHBondContact O-CB 3.4Å; Y1044-F1047 PolarHBondContact O-N 3.42Å; R1045-F1047 PolarHBondContact O-N 3.07Å; F1047-E1049 PolarHBondContact O-N 3.46Å; F1047-F1050 PolarHBondContact O-N 3.21Å; F1047-Y1051 WeakPolarHBondContact O-CD2 3.28Å; F1047-I1234 HydrophobicContact CD2-CD1 4.16Å; F1047-I1234 HydrophobicContact CE1-CD1 3.99Å; F1047-I1234 HydrophobicContact CE1-CG1 4.42Å; F1047-I1234 HydrophobicContact CE1-CG2 4.27Å; F1047-I1234 HydrophobicContact CE2-CD1 3.47Å; F1047-I1234 VanDerWaalsContact CE2-CD1 3.47Å; F1047-I1234 HydrophobicContact CE2-CG1 3.57Å; F1047-I1234 HydrophobicContact CZ-CB 4.18Å; F1047-I1234 HydrophobicContact CZ-CD1 3.38Å; F1047-I1234 HydrophobicContact CZ-CG1 3.44Å; F1047-I1234 VanDerWaalsContact CZ-CG1 3.44Å; F1047-I1234 HydrophobicContact CZ-CG2 3.78Å; F1047-L1241 HydrophobicContact CE1-CD1 4.43Å; F1047-L1241 HydrophobicContact CZ-CD1 3.86Å
1048	N	69.1	Low	65.3	Low	65 Å²	65	59.9 Å²	59.9	35%	0.348	30%	0.298	S	S	.	.	H	α-helix	trans	-64.3	-38.8	-172.1	-71.2	1.2	0	0	0	113	Y1044 R1045 F1050 Y1051 S1052	Y1044-N1048 WeakPolarHBondContact CE1-ND2 3.47Å; Y1044-N1048 WeakPolarHBondContact CE2-ND2 3.19Å; Y1044-N1048 PolarHBondContact O-N 3.33Å; Y1044-N1048 VanDerWaalsContact O-N 3.14Å; Y1044-N1048 PolarHBondContact OH-ND2 2.76Å; R1045-N1048 PolarHBondContact O-N 3.01Å; R1045-N1048 VanDerWaalsContact O-N 3.14Å; N1048-F1050 VanDerWaalsContact C-N 3.26Å; N1048-F1050 PolarHBondContact O-N 3.34Å; N1048-Y1051 PolarHBondContact O-N 3.16Å; N1048-S1052 PolarHBondContact O-N 3.03Å; N1048-S1052 PolarHBondContact O-OG 3.01Å
1049	E	65.6	Low	63.3	Low	34 Å²	34	66.7 Å²	66.7	16%	0.159	33%	0.334	C	S	.	.	H	α-helix	trans	-60.9	-35.3	179.5	-74.1	171.1	129.9	0	0	112.7	S665 R1045 F1047 Y1051 S1052 S1053	S665-E1049 WeakPolarHBondContact CB-OE1 3.36Å; S665-E1049 WeakPolarHBondContact CB-OE2 3.41Å; S665-E1049 PolarHBondContact OG-OE1 3.41Å; S665-E1049 PolarHBondContact OG-OE2 3.05Å; R1045-E1049 IonicContact CZ-OE1 3.53Å; R1045-E1049 IonicContact NH1-OE1 2.89Å; R1045-E1049 PolarHBondContact NH1-OE1 2.98Å; R1045-E1049 IonicContact NH1-OE2 2.66Å; R1045-E1049 IonicContact NH2-OE1 2.77Å; R1045-E1049 PolarHBondContact NH2-OE1 2.99Å; R1045-E1049 VanDerWaalsContact NH2-OE1 3.09Å; R1045-E1049 WeakPolarHBondContact O-CG 3.38Å; R1045-E1049 PolarHBondContact O-N 2.7Å; R1045-E1049 VanDerWaalsContact O-N 3.11Å; F1047-E1049 PolarHBondContact O-N 3.46Å; E1049-Y1051 PolarHBondContact O-N 3.49Å; E1049-S1052 PolarHBondContact O-N 3.38Å; E1049-S1053 WeakPolarHBondContact O-CB 3.42Å; E1049-S1053 PolarHBondContact O-N 3.24Å
1050	F	59.8	Low	61.4	Low	54 Å²	54	71.4 Å²	71.4	24%	0.237	36%	0.355	C	S	.	.	H	α-helix	trans	-67.3	-37.1	-178.5	-177.1	-113.7	0	0	0	112.9	Q677 F1047 N1048 S1052 H1054	Q677-F1050 HydrophobicContact CG-CD2 4.33Å; Q677-F1050 HydrophobicContact CG-CE2 4.29Å; Q677-F1050 VanDerWaalsContact NE2-CE1 3.25Å; Q677-F1050 VanDerWaalsContact NE2-CZ 3.29Å; F1047-F1050 PolarHBondContact O-N 3.21Å; N1048-F1050 VanDerWaalsContact C-N 3.26Å; N1048-F1050 PolarHBondContact O-N 3.34Å; F1050-S1052 VanDerWaalsContact C-N 3.34Å; F1050-H1054 AromaticContact CE2-CD2 3.72Å; F1050-H1054 AromaticContact CE2-NE2 3.25Å; F1050-H1054 VanDerWaalsContact CE2-NE2 3.25Å; F1050-H1054 WeakPolarHBondContact CE2-NE2 3.34Å; F1050-H1054 AromaticContact CZ-CD2 3.72Å; F1050-H1054 AromaticContact CZ-NE2 3.3Å; F1050-H1054 VanDerWaalsContact CZ-NE2 3.3Å; F1050-H1054 WeakPolarHBondContact CZ-NE2 3.42Å; F1050-H1054 PolarHBondContact O-CD2 3.42Å
1051	Y	54.7	Low	59.9	Low	159 Å²	159	74.5 Å²	74.5	62%	0.624	37%	0.372	S	S	*	.	H	α-helix	trans	-74.2	-27.6	174.7	-67.9	-73.4	0	0	0	112.5	F1047 N1048 E1049	F1047-Y1051 WeakPolarHBondContact O-CD2 3.28Å; N1048-Y1051 PolarHBondContact O-N 3.16Å; E1049-Y1051 PolarHBondContact O-N 3.49Å
1052	S	51.6	Low	58.2	Low	79 Å²	79	78.9 Å²	78.9	55%	0.552	40%	0.403	S	S	*	.	H	α-helix	trans	-72	-45.1	175	-52.4	0	0	0	0	111.3	N1048 E1049 F1050 H1054 G1055	N1048-S1052 PolarHBondContact O-N 3.03Å; N1048-S1052 PolarHBondContact O-OG 3.01Å; E1049-S1052 PolarHBondContact O-N 3.38Å; F1050-S1052 VanDerWaalsContact C-N 3.34Å; S1052-H1054 PolarHBondContact O-N 3.46Å; S1052-H1054 VanDerWaalsContact O-N 3.12Å; S1052-G1055 PolarHBondContact O-N 3.3Å
1053	S	51.5	Low	56.4	Low	72 Å²	72	84.5 Å²	84.5	50%	0.503	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-6.2	-174.1	-167.3	0	0	0	0	115.4	E1049	E1049-S1053 WeakPolarHBondContact O-CB 3.42Å; E1049-S1053 PolarHBondContact O-N 3.24Å
1054	H	48	Very low	55.1	Low	128 Å²	128	88 Å²	88	59%	0.593	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	3.2	175.8	-84.9	-59.1	0	0	0	113.9	F1050 S1052	F1050-H1054 AromaticContact CE2-CD2 3.72Å; F1050-H1054 AromaticContact CE2-NE2 3.25Å; F1050-H1054 VanDerWaalsContact CE2-NE2 3.25Å; F1050-H1054 WeakPolarHBondContact CE2-NE2 3.34Å; F1050-H1054 AromaticContact CZ-CD2 3.72Å; F1050-H1054 AromaticContact CZ-NE2 3.3Å; F1050-H1054 VanDerWaalsContact CZ-NE2 3.3Å; F1050-H1054 WeakPolarHBondContact CZ-NE2 3.42Å; F1050-H1054 PolarHBondContact O-CD2 3.42Å; S1052-H1054 PolarHBondContact O-N 3.46Å; S1052-H1054 VanDerWaalsContact O-N 3.12Å
1055	G	36.4	Very low	54.1	Low	37 Å²	37	90 Å²	90	38%	0.381	46%	0.461	S	S	.	.	S	Bend	trans	-107.8	81.9	-179.4	0	0	0	0	0	114.2	S1052 N1057	S1052-G1055 PolarHBondContact O-N 3.3Å; G1055-N1057 PolarHBondContact O-N 2.9Å; G1055-N1057 PolarHBondContact O-ND2 3.37Å
1056	F	32.6	Very low	52.8	Low	201 Å²	201	96.4 Å²	96.4	88%	0.882	49%	0.486	S	S	*	.			trans	-35.8	99.2	176.6	-66.4	-92.8	0	0	0	114.3
1057	N	36	Very low	52	Low	68 Å²	68	99.6 Å²	99.6	36%	0.364	51%	0.506	S	S	.	.			trans	-152.7	63.5	175.5	-73.9	-100.2	0	0	0	109.7	G1055 D1059 K1060	G1055-N1057 PolarHBondContact O-N 2.9Å; G1055-N1057 PolarHBondContact O-ND2 3.37Å; N1057-D1059 PolarHBondContact O-N 3.07Å; N1057-K1060 HydrophobicContact CB-CB 4.11Å; N1057-K1060 HydrophobicContact CB-CD 3.99Å; N1057-K1060 HydrophobicContact CB-CG 4.23Å; N1057-K1060 PolarHBondContact O-N 3.37Å; N1057-K1060 PolarHBondContact OD1-NZ 3.16Å
1058	E	44.5	Very low	51.6	Low	171 Å²	171	98.2 Å²	98.2	80%	0.799	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-51.5	-33.9	-169.7	-60.7	173.6	154.6	0	0	113.7	K1060	E1058-K1060 PolarHBondContact O-N 3Å
1059	D	46.8	Very low	51.5	Low	157 Å²	157	99.1 Å²	99.1	84%	0.84	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-72.3	-19.8	176.8	-64.9	-48.5	0	0	0	115.4	N1057	N1057-D1059 PolarHBondContact O-N 3.07Å
1060	K	47.7	Very low	51.6	Low	112 Å²	112	100.2 Å²	100.2	49%	0.487	51%	0.514	S	S	.	.	G	3₁₀ helix	trans	-94	-15.2	-175.4	-66.4	-179.7	-171.7	150.6	0	113.6	N1057 E1058 S1062 L1063 N1064	N1057-K1060 HydrophobicContact CB-CB 4.11Å; N1057-K1060 HydrophobicContact CB-CD 3.99Å; N1057-K1060 HydrophobicContact CB-CG 4.23Å; N1057-K1060 PolarHBondContact O-N 3.37Å; N1057-K1060 PolarHBondContact OD1-NZ 3.16Å; E1058-K1060 PolarHBondContact O-N 3Å; K1060-S1062 VanDerWaalsContact C-N 3.3Å; K1060-S1062 PolarHBondContact O-N 3.24Å; K1060-L1063 PolarHBondContact O-N 3.02Å; K1060-N1064 PolarHBondContact O-N 3.42Å; K1060-N1064 PolarHBondContact O-ND2 3.44Å
1061	D	51.8	Low	52.2	Low	81 Å²	81	101.2 Å²	101.2	43%	0.433	52%	0.519	S	S	.	.	H	α-helix	trans	-70.1	-27	-168.1	-69.6	-34	0	0	0	113.3	K1065	D1061-K1065 WeakPolarHBondContact O-CB 3.44Å; D1061-K1065 PolarHBondContact O-N 3.11Å
1062	S	50.4	Low	53.2	Low	91 Å²	91	94.2 Å²	94.2	64%	0.636	49%	0.492	S	S	*	.	H	α-helix	trans	-61.5	-46.4	172.7	60.5	0	0	0	0	112.7	K1060 Y1066	K1060-S1062 VanDerWaalsContact C-N 3.3Å; K1060-S1062 PolarHBondContact O-N 3.24Å; S1062-Y1066 PolarHBondContact O-N 3.1Å; S1062-Y1066 VanDerWaalsContact O-N 3.15Å
1063	L	45.2	Very low	54.5	Low	118 Å²	118	97.8 Å²	97.8	62%	0.618	50%	0.498	S	S	*	.	H	α-helix	trans	-72.4	-42.9	179	-175.4	63	0	0	0	111.3	K1060 K1065 Y1066 V1067	K1060-L1063 PolarHBondContact O-N 3.02Å; L1063-K1065 VanDerWaalsContact C-N 3.31Å; L1063-K1065 PolarHBondContact O-N 3.08Å; L1063-Y1066 PolarHBondContact O-N 3.27Å; L1063-V1067 WeakPolarHBondContact O-CG2 3.35Å; L1063-V1067 PolarHBondContact O-N 2.79Å
1064	N	55.4	Low	55.9	Low	83 Å²	83	96.7 Å²	96.7	44%	0.444	49%	0.486	S	S	.	.	H	α-helix	trans	-57.6	-44.3	174.3	-72.2	-25.6	0	0	0	111.3	K1060 V1067 T1068	K1060-N1064 PolarHBondContact O-N 3.42Å; K1060-N1064 PolarHBondContact O-ND2 3.44Å; N1064-V1067 PolarHBondContact O-N 2.82Å; N1064-T1068 WeakPolarHBondContact O-CG2 3.29Å; N1064-T1068 PolarHBondContact O-N 3.02Å; N1064-T1068 PolarHBondContact O-OG1 2.7Å; N1064-T1068 VanDerWaalsContact O-OG1 3.09Å
1065	K	59.2	Low	57.6	Low	94 Å²	94	91 Å²	91	41%	0.409	46%	0.46	S	S	.	.	H	α-helix	trans	-61.6	-41.5	177.4	-173.1	-180	-162.1	178	0	112.5	Y662 D1061 L1063 T1068 Q1069	Y662-K1065 VanDerWaalsContact OH-CE 3.28Å; Y662-K1065 WeakPolarHBondContact OH-CE 3.41Å; Y662-K1065 PolarHBondContact OH-NZ 3.35Å; D1061-K1065 WeakPolarHBondContact O-CB 3.44Å; D1061-K1065 PolarHBondContact O-N 3.11Å; L1063-K1065 VanDerWaalsContact C-N 3.31Å; L1063-K1065 PolarHBondContact O-N 3.08Å; K1065-T1068 PolarHBondContact O-OG1 3.13Å; K1065-Q1069 VanDerWaalsContact O-CG 3.3Å; K1065-Q1069 WeakPolarHBondContact O-CG 3.44Å; K1065-Q1069 PolarHBondContact O-N 3.48Å; K1065-Q1069 VanDerWaalsContact O-N 3.12Å
1066	Y	53.2	Low	59.8	Low	152 Å²	152	91.5 Å²	91.5	60%	0.596	45%	0.454	S	S	*	.	H	α-helix	trans	-66.9	-46.4	174.9	-177.5	-95.3	0	0	0	112	S1062 L1063 T1068 Q1069 V1070	S1062-Y1066 PolarHBondContact O-N 3.1Å; S1062-Y1066 VanDerWaalsContact O-N 3.15Å; L1063-Y1066 PolarHBondContact O-N 3.27Å; Y1066-T1068 VanDerWaalsContact C-N 3.34Å; Y1066-T1068 PolarHBondContact O-N 3.13Å; Y1066-Q1069 PolarHBondContact O-N 2.78Å; Y1066-V1070 HydrophobicContact CD1-CG2 4.25Å; Y1066-V1070 HydrophobicContact CE1-CG2 3.79Å; Y1066-V1070 WeakPolarHBondContact O-CG2 3.36Å; Y1066-V1070 PolarHBondContact O-N 2.94Å
1067	V	58.9	Low	62.3	Low	70 Å²	70	86.6 Å²	86.6	42%	0.424	43%	0.434	S	S	.	.	H	α-helix	trans	-58.7	-45.9	178.2	169.8	0	0	0	0	110.9	L1063 N1064 Q1069 V1070 E1071	L1063-V1067 WeakPolarHBondContact O-CG2 3.35Å; L1063-V1067 PolarHBondContact O-N 2.79Å; N1064-V1067 PolarHBondContact O-N 2.82Å; V1067-Q1069 PolarHBondContact O-N 2.98Å; V1067-V1070 PolarHBondContact O-N 2.88Å; V1067-E1071 PolarHBondContact O-N 3.14Å
1068	T	65.9	Low	64.7	Low	37 Å²	37	83.5 Å²	83.5	23%	0.227	42%	0.417	C	S	.	.	H	α-helix	trans	-68.2	-34.1	179.5	56.8	0	0	0	0	113.2	N1064 K1065 Y1066 V1070 E1071 D1072	N1064-T1068 WeakPolarHBondContact O-CG2 3.29Å; N1064-T1068 PolarHBondContact O-N 3.02Å; N1064-T1068 PolarHBondContact O-OG1 2.7Å; N1064-T1068 VanDerWaalsContact O-OG1 3.09Å; K1065-T1068 PolarHBondContact O-OG1 3.13Å; Y1066-T1068 VanDerWaalsContact C-N 3.34Å; Y1066-T1068 PolarHBondContact O-N 3.13Å; T1068-V1070 VanDerWaalsContact C-N 3.34Å; T1068-E1071 PolarHBondContact O-N 3.35Å; T1068-D1072 WeakPolarHBondContact O-CB 3.34Å; T1068-D1072 VanDerWaalsContact O-CG 3.31Å; T1068-D1072 PolarHBondContact O-N 3.38Å
1069	Q	67.5	Low	66.7	Low	83 Å²	83	75.4 Å²	75.4	39%	0.388	38%	0.38	S	S	.	.	H	α-helix	trans	-64.7	-36.3	171.5	-75.9	177.7	-8.7	0	0	112.7	K1065 Y1066 V1067 K1073	K1065-Q1069 VanDerWaalsContact O-CG 3.3Å; K1065-Q1069 WeakPolarHBondContact O-CG 3.44Å; K1065-Q1069 PolarHBondContact O-N 3.48Å; K1065-Q1069 VanDerWaalsContact O-N 3.12Å; Y1066-Q1069 PolarHBondContact O-N 2.78Å; V1067-Q1069 PolarHBondContact O-N 2.98Å; Q1069-K1073 PolarHBondContact O-N 2.87Å
1070	V	66	Low	68.6	Low	58 Å²	58	70.9 Å²	70.9	35%	0.352	36%	0.361	S	S	.	.	H	α-helix	trans	-68.5	-42.2	173.5	172.5	0	0	0	0	111	Y1066 V1067 T1068 K1073 N1074	Y1066-V1070 HydrophobicContact CD1-CG2 4.25Å; Y1066-V1070 HydrophobicContact CE1-CG2 3.79Å; Y1066-V1070 WeakPolarHBondContact O-CG2 3.36Å; Y1066-V1070 PolarHBondContact O-N 2.94Å; V1067-V1070 PolarHBondContact O-N 2.88Å; T1068-V1070 VanDerWaalsContact C-N 3.34Å; V1070-K1073 PolarHBondContact O-N 3.05Å; V1070-N1074 PolarHBondContact O-N 3.14Å; V1070-N1074 PolarHBondContact O-ND2 2.89Å
1071	E	72.8	Confident	70.6	Confident	75 Å²	75	66.2 Å²	66.2	35%	0.35	34%	0.34	S	S	.	.	H	α-helix	trans	-62.5	-42.4	173.1	-68.5	-154	128.9	0	0	112.4	V1067 T1068 K1073 N1074 L1075	V1067-E1071 PolarHBondContact O-N 3.14Å; T1068-E1071 PolarHBondContact O-N 3.35Å; E1071-K1073 PolarHBondContact O-N 3.06Å; E1071-N1074 PolarHBondContact O-N 3.26Å; E1071-L1075 WeakPolarHBondContact O-CB 3.4Å; E1071-L1075 VanDerWaalsContact O-CG 3.32Å; E1071-L1075 WeakPolarHBondContact O-CG 3.31Å; E1071-L1075 PolarHBondContact O-N 2.8Å
1072	D	76.8	Confident	72.4	Confident	12 Å²	12	62.4 Å²	62.4	6%	0.064	32%	0.319	C	S	.	.	H	α-helix	trans	-58.9	-46.1	174.9	-79.4	-25.2	0	0	0	111.8	L661 R1045 T1068 N1074 L1075 N1076	L661-D1072 HydrophobicContact CD1-CB 4.03Å; L661-D1072 WeakPolarHBondContact CD1-OD1 3.23Å; R1045-D1072 VanDerWaalsContact CD-OD1 3.22Å; R1045-D1072 WeakPolarHBondContact CD-OD1 3.4Å; R1045-D1072 IonicContact CZ-OD1 2.78Å; R1045-D1072 IonicContact CZ-OD2 3.9Å; R1045-D1072 VanDerWaalsContact CZ-OD2 3.23Å; R1045-D1072 IonicContact NE-OD1 3.16Å; R1045-D1072 PolarHBondContact NE-OD1 3.29Å; R1045-D1072 IonicContact NE-OD2 2.71Å; R1045-D1072 PolarHBondContact NE-OD2 2.91Å; R1045-D1072 IonicContact NH2-OD2 2.71Å; R1045-D1072 PolarHBondContact NH2-OD2 2.85Å; T1068-D1072 WeakPolarHBondContact O-CB 3.34Å; T1068-D1072 VanDerWaalsContact O-CG 3.31Å; T1068-D1072 PolarHBondContact O-N 3.38Å; D1072-N1074 VanDerWaalsContact C-N 3.32Å; D1072-N1074 PolarHBondContact O-N 3.24Å; D1072-L1075 PolarHBondContact O-N 3.41Å; D1072-N1076 WeakPolarHBondContact O-CB 3.5Å; D1072-N1076 PolarHBondContact O-N 2.97Å; D1072-N1076 PolarHBondContact O-ND2 2.97Å
1073	K	78.8	Confident	74.2	Confident	153 Å²	153	58.2 Å²	58.2	67%	0.665	29%	0.29	S	S	*	.	H	α-helix	trans	-60.7	-43.1	177.1	-169.5	169.3	-177	170.5	0	111.2	Q1069 V1070 E1071 Q1077	Q1069-K1073 PolarHBondContact O-N 2.87Å; V1070-K1073 PolarHBondContact O-N 3.05Å; E1071-K1073 PolarHBondContact O-N 3.06Å; K1073-Q1077 WeakPolarHBondContact O-CB 3.26Å; K1073-Q1077 PolarHBondContact O-N 3.33Å
1074	N	80	Confident	76.2	Confident	49 Å²	49	55.3 Å²	55.3	26%	0.262	27%	0.273	S	S	.	.	H	α-helix	trans	-66.3	-39.3	176.8	-67.3	-33.7	0	0	0	112.6	V1070 E1071 D1072 Q1077 L1078	V1070-N1074 PolarHBondContact O-N 3.14Å; V1070-N1074 PolarHBondContact O-ND2 2.89Å; E1071-N1074 PolarHBondContact O-N 3.26Å; D1072-N1074 VanDerWaalsContact C-N 3.32Å; D1072-N1074 PolarHBondContact O-N 3.24Å; N1074-Q1077 PolarHBondContact O-N 3.05Å; N1074-L1078 WeakPolarHBondContact O-CB 3.46Å; N1074-L1078 PolarHBondContact O-N 2.66Å
1075	L	83.3	Confident	77.8	Confident	9 Å²	9	51.3 Å²	51.3	5%	0.047	25%	0.252	C	S	.	.	H	α-helix	trans	-72.8	-39.3	179.6	-72.8	172.2	0	0	0	112.3	L1041 Y1044 E1071 D1072 L1078 V1079 M1115	L1041-L1075 HydrophobicContact CD1-CB 3.62Å; L1041-L1075 HydrophobicContact CD1-CD1 3.79Å; L1041-L1075 HydrophobicContact CD1-CG 4.26Å; L1041-L1075 HydrophobicContact CD2-CB 4.23Å; Y1044-L1075 HydrophobicContact CD1-CD1 4.36Å; Y1044-L1075 HydrophobicContact CE1-CD1 3.99Å; E1071-L1075 WeakPolarHBondContact O-CB 3.4Å; E1071-L1075 VanDerWaalsContact O-CG 3.32Å; E1071-L1075 WeakPolarHBondContact O-CG 3.31Å; E1071-L1075 PolarHBondContact O-N 2.8Å; D1072-L1075 PolarHBondContact O-N 3.41Å; L1075-L1078 WeakPolarHBondContact O-CB 3.49Å; L1075-L1078 PolarHBondContact O-N 2.94Å; L1075-V1079 WeakPolarHBondContact O-CG2 3.47Å; L1075-V1079 PolarHBondContact O-N 3.42Å; L1075-M1115 WeakPolarHBondContact CD2-O 3.3Å
1076	N	83.8	Confident	79.1	Confident	47 Å²	47	46.9 Å²	46.9	25%	0.251	23%	0.233	S	C	.	.	H	α-helix	trans	-61.4	-45.3	171	-77.7	-74	0	0	0	110.8	F750 L1041 D1072 L1078 V1079 S1080	F750-N1076 WeakPolarHBondContact CZ-OD1 3.29Å; L1041-N1076 WeakPolarHBondContact CD2-OD1 3.43Å; D1072-N1076 WeakPolarHBondContact O-CB 3.5Å; D1072-N1076 PolarHBondContact O-N 2.97Å; D1072-N1076 PolarHBondContact O-ND2 2.97Å; N1076-L1078 VanDerWaalsContact C-N 3.3Å; N1076-L1078 PolarHBondContact O-N 3.26Å; N1076-V1079 PolarHBondContact O-N 3.09Å; N1076-S1080 PolarHBondContact O-N 3.36Å; N1076-S1080 PolarHBondContact O-OG 3.32Å
1077	Q	84.2	Confident	80.6	Confident	98 Å²	98	41 Å²	41	46%	0.458	21%	0.212	S	C	.	.	H	α-helix	trans	-60.2	-38.5	173.7	-179.6	174.3	-20	0	0	112.3	K1073 N1074 W1081 P1174	K1073-Q1077 WeakPolarHBondContact O-CB 3.26Å; K1073-Q1077 PolarHBondContact O-N 3.33Å; N1074-Q1077 PolarHBondContact O-N 3.05Å; Q1077-W1081 WeakPolarHBondContact O-CB 3.28Å; Q1077-W1081 PolarHBondContact O-N 2.73Å; Q1077-P1174 HydrophobicContact CG-CB 4.45Å
1078	L	86.3	Confident	81.6	Confident	3 Å²	3	39.4 Å²	39.4	2%	0.016	20%	0.2	C	C	.	.	H	α-helix	trans	-64.5	-40.9	175.4	-179.8	124.7	0	0	0	112.2	N1074 L1075 N1076 W1081 L1082 S1120 P1174 W1175	N1074-L1078 WeakPolarHBondContact O-CB 3.46Å; N1074-L1078 PolarHBondContact O-N 2.66Å; L1075-L1078 WeakPolarHBondContact O-CB 3.49Å; L1075-L1078 PolarHBondContact O-N 2.94Å; N1076-L1078 VanDerWaalsContact C-N 3.3Å; N1076-L1078 PolarHBondContact O-N 3.26Å; L1078-W1081 PolarHBondContact O-N 3.41Å; L1078-L1082 HydrophobicContact CD2-CD1 3.74Å; L1078-L1082 HydrophobicContact CG-CD1 4.07Å; L1078-L1082 WeakPolarHBondContact O-CB 3.48Å; L1078-L1082 VanDerWaalsContact O-CG 3.27Å; L1078-L1082 WeakPolarHBondContact O-CG 3.23Å; L1078-L1082 PolarHBondContact O-N 2.92Å; L1078-S1120 WeakPolarHBondContact CD1-OG 3.49Å; L1078-P1174 HydrophobicContact CD1-CG 4.42Å; L1078-W1175 HydrophobicContact CD1-CD2 4.25Å; L1078-W1175 VanDerWaalsContact CD1-CE2 3.42Å; L1078-W1175 HydrophobicContact CD1-CH2 4.42Å; L1078-W1175 HydrophobicContact CD1-CZ2 3.54Å; L1078-W1175 VanDerWaalsContact CD1-NE1 3.33Å
1079	V	86.8	Confident	82.3	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-63.2	-50.6	175.2	172.7	0	0	0	0	110.9	L1037 N1038 L1041 L1075 N1076 W1081 L1082 T1083 M1115	L1037-V1079 HydrophobicContact CB-CB 4.39Å; L1037-V1079 HydrophobicContact CB-CG1 3.52Å; L1037-V1079 HydrophobicContact CB-CG2 4.02Å; L1037-V1079 HydrophobicContact CD1-CG1 4.09Å; L1037-V1079 HydrophobicContact CG-CG1 4.47Å; N1038-V1079 WeakPolarHBondContact OD1-CG1 3.39Å; L1041-V1079 HydrophobicContact CD2-CG2 4.27Å; L1075-V1079 WeakPolarHBondContact O-CG2 3.47Å; L1075-V1079 PolarHBondContact O-N 3.42Å; N1076-V1079 PolarHBondContact O-N 3.09Å; V1079-W1081 VanDerWaalsContact C-N 3.26Å; V1079-W1081 PolarHBondContact O-N 3.49Å; V1079-L1082 PolarHBondContact O-N 2.79Å; V1079-T1083 WeakPolarHBondContact O-CG2 3.42Å; V1079-T1083 PolarHBondContact O-N 3.37Å; V1079-M1115 HydrophobicContact CG2-SD 4.26Å
1080	S	87.2	Confident	82.7	Confident	63 Å²	63	33.7 Å²	33.7	44%	0.441	17%	0.17	S	C	.	.	H	α-helix	trans	-61.9	-32.7	176.6	-54.9	0	0	0	0	112.9	N1076 T1083 E1084	N1076-S1080 PolarHBondContact O-N 3.36Å; N1076-S1080 PolarHBondContact O-OG 3.32Å; S1080-T1083 PolarHBondContact O-OG1 2.85Å; S1080-T1083 VanDerWaalsContact O-OG1 3.09Å; S1080-E1084 PolarHBondContact O-N 2.94Å
1081	W	89.9	Confident	83	Confident	13 Å²	13	35.1 Å²	35.1	5%	0.049	17%	0.173	C	C	.	.	H	α-helix	trans	-71.3	-40.6	175	-174.6	90.8	0	0	0	112.2	Q1077 L1078 V1079 E1084 F1085 F1124 W1168 I1169 T1172 P1174 W1175	Q1077-W1081 WeakPolarHBondContact O-CB 3.28Å; Q1077-W1081 PolarHBondContact O-N 2.73Å; L1078-W1081 PolarHBondContact O-N 3.41Å; V1079-W1081 VanDerWaalsContact C-N 3.26Å; V1079-W1081 PolarHBondContact O-N 3.49Å; W1081-E1084 PolarHBondContact O-N 3.11Å; W1081-F1085 HydrophobicContact CD2-CB 4.43Å; W1081-F1085 HydrophobicContact CE3-CB 4.2Å; W1081-F1085 HydrophobicContact CH2-CB 4.3Å; W1081-F1085 HydrophobicContact CH2-CD2 4.14Å; W1081-F1085 HydrophobicContact CH2-CG 4.07Å; W1081-F1085 HydrophobicContact CZ2-CD2 4.44Å; W1081-F1085 HydrophobicContact CZ3-CB 4.14Å; W1081-F1085 HydrophobicContact CZ3-CD1 4.36Å; W1081-F1085 HydrophobicContact CZ3-CG 4.13Å; W1081-F1085 WeakPolarHBondContact O-CB 3.32Å; W1081-F1085 PolarHBondContact O-N 3Å; W1081-F1124 HydrophobicContact CH2-CD2 4.49Å; W1081-F1124 HydrophobicContact CH2-CE1 4.27Å; W1081-F1124 AromaticContact CH2-CE2 3.69Å; W1081-F1124 HydrophobicContact CH2-CE2 3.69Å; W1081-F1124 AromaticContact CH2-CZ 3.59Å; W1081-F1124 HydrophobicContact CH2-CZ 3.59Å; W1081-F1124 HydrophobicContact CZ3-CD2 4.09Å; W1081-F1124 AromaticContact CZ3-CE2 3.61Å; W1081-F1124 HydrophobicContact CZ3-CE2 3.61Å; W1081-F1124 HydrophobicContact CZ3-CZ 4.01Å; W1081-W1168 AromaticContact CD1-CH2 3.53Å; W1081-W1168 HydrophobicContact CD2-CH2 4.29Å; W1081-W1168 HydrophobicContact CD2-CZ3 4.39Å; W1081-W1168 AromaticContact CE2-CH2 3.79Å; W1081-W1168 AromaticContact CE2-CZ3 3.55Å; W1081-W1168 HydrophobicContact CG-CH2 4.15Å; W1081-W1168 HydrophobicContact CZ2-CH2 4.47Å; W1081-W1168 AromaticContact CZ2-CZ3 3.79Å; W1081-W1168 HydrophobicContact CZ2-CZ3 3.79Å; W1081-W1168 AromaticContact NE1-CH2 3.27Å; W1081-W1168 VanDerWaalsContact NE1-CH2 3.27Å; W1081-W1168 AromaticContact NE1-CZ3 3.32Å; W1081-W1168 VanDerWaalsContact NE1-CZ3 3.32Å; W1081-I1169 HydrophobicContact CZ2-CB 4.49Å; W1081-I1169 HydrophobicContact CZ2-CG1 4.18Å; W1081-I1169 HydrophobicContact CZ2-CG2 4.22Å; W1081-T1172 PolarHBondContact NE1-O 3.01Å; W1081-T1172 VanDerWaalsContact NE1-O 3.15Å; W1081-T1172 PolarHBondContact NE1-OG1 2.94Å; W1081-P1174 HydrophobicContact CB-CB 3.93Å; W1081-P1174 HydrophobicContact CB-CG 4.04Å; W1081-P1174 HydrophobicContact CD2-CB 4.38Å; W1081-P1174 HydrophobicContact CD2-CG 3.58Å; W1081-P1174 HydrophobicContact CE3-CG 3.77Å; W1081-P1174 HydrophobicContact CG-CB 3.95Å; W1081-P1174 HydrophobicContact CG-CG 3.69Å; W1081-P1174 HydrophobicContact CZ3-CG 4.42Å; W1081-W1175 HydrophobicContact CH2-CZ3 4.23Å; W1081-W1175 HydrophobicContact CZ3-CH2 4.02Å; W1081-W1175 HydrophobicContact CZ3-CZ3 4.06Å
1082	L	89.5	Confident	82.7	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-66.8	-35	178	-75.4	169.8	0	0	0	112.3	L1037 L1078 V1079 W1086 F1110 C1113 W1123 F1124	L1037-L1082 HydrophobicContact CD1-CB 4.34Å; L1078-L1082 HydrophobicContact CD2-CD1 3.74Å; L1078-L1082 HydrophobicContact CG-CD1 4.07Å; L1078-L1082 WeakPolarHBondContact O-CB 3.48Å; L1078-L1082 VanDerWaalsContact O-CG 3.27Å; L1078-L1082 WeakPolarHBondContact O-CG 3.23Å; L1078-L1082 PolarHBondContact O-N 2.92Å; V1079-L1082 PolarHBondContact O-N 2.79Å; L1082-W1086 VanDerWaalsContact O-CB 3.24Å; L1082-W1086 WeakPolarHBondContact O-CB 3.24Å; L1082-W1086 PolarHBondContact O-N 2.93Å; L1082-F1110 HydrophobicContact CD2-CD1 4.5Å; L1082-C1113 HydrophobicContact CD1-CB 4.29Å; L1082-W1123 HydrophobicContact CD1-CZ3 4.47Å; L1082-W1123 HydrophobicContact CD2-CH2 4.47Å; L1082-W1123 HydrophobicContact CD2-CZ3 4.02Å; L1082-F1124 HydrophobicContact CD2-CD2 4.3Å
1083	T	88.3	Confident	81.9	Confident	3 Å²	3	31.8 Å²	31.8	2%	0.018	16%	0.158	C	C	.	.	H	α-helix	trans	-71.6	-38.2	175.4	61.5	0	0	0	0	111.8	L1033 E1034 L1037 V1079 S1080 N1087	L1033-T1083 HydrophobicContact CD2-CG2 4.31Å; L1033-T1083 HydrophobicContact CG-CG2 4.09Å; E1034-T1083 HydrophobicContact CB-CG2 3.74Å; E1034-T1083 HydrophobicContact CG-CG2 4.1Å; L1037-T1083 HydrophobicContact CD1-CG2 4.32Å; V1079-T1083 WeakPolarHBondContact O-CG2 3.42Å; V1079-T1083 PolarHBondContact O-N 3.37Å; S1080-T1083 PolarHBondContact O-OG1 2.85Å; S1080-T1083 VanDerWaalsContact O-OG1 3.09Å; T1083-N1087 VanDerWaalsContact O-CB 3.31Å; T1083-N1087 WeakPolarHBondContact O-CB 3.34Å; T1083-N1087 PolarHBondContact O-N 2.84Å; T1083-N1087 VanDerWaalsContact O-N 3.07Å
1084	E	86.9	Confident	80.8	Confident	57 Å²	57	27.9 Å²	27.9	27%	0.266	14%	0.14	S	C	.	.	H	α-helix	trans	-66.8	-44.3	171	-102.5	-58.6	108	0	0	113	K1030 S1080 W1081 W1086 N1087 Q1088 W1168	K1030-E1084 IonicContact NZ-OE1 2.66Å; K1030-E1084 PolarHBondContact NZ-OE1 2.86Å; S1080-E1084 PolarHBondContact O-N 2.94Å; W1081-E1084 PolarHBondContact O-N 3.11Å; E1084-W1086 VanDerWaalsContact C-N 3.35Å; E1084-W1086 PolarHBondContact O-N 3.43Å; E1084-N1087 WeakPolarHBondContact O-CB 3.37Å; E1084-N1087 PolarHBondContact O-N 3.13Å; E1084-N1087 PolarHBondContact OE1-ND2 3.43Å; E1084-Q1088 WeakPolarHBondContact O-CG 3.37Å; E1084-Q1088 PolarHBondContact O-N 3.24Å; E1084-Q1088 PolarHBondContact OE2-NE2 3.16Å; E1084-W1168 HydrophobicContact CB-CH2 4.01Å; E1084-W1168 HydrophobicContact CB-CZ2 3.99Å
1085	F	88.9	Confident	79.5	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-62.3	-41.9	177.3	172.3	-105.8	0	0	0	111.8	W1081 Q1088 L1089 F1110 F1124 W1128 L1132 W1168 I1169	W1081-F1085 HydrophobicContact CD2-CB 4.43Å; W1081-F1085 HydrophobicContact CE3-CB 4.2Å; W1081-F1085 HydrophobicContact CH2-CB 4.3Å; W1081-F1085 HydrophobicContact CH2-CD2 4.14Å; W1081-F1085 HydrophobicContact CH2-CG 4.07Å; W1081-F1085 HydrophobicContact CZ2-CD2 4.44Å; W1081-F1085 HydrophobicContact CZ3-CB 4.14Å; W1081-F1085 HydrophobicContact CZ3-CD1 4.36Å; W1081-F1085 HydrophobicContact CZ3-CG 4.13Å; W1081-F1085 WeakPolarHBondContact O-CB 3.32Å; W1081-F1085 PolarHBondContact O-N 3Å; F1085-Q1088 PolarHBondContact O-N 3.06Å; F1085-L1089 HydrophobicContact CD1-CD1 4Å; F1085-L1089 HydrophobicContact CD1-CG 4.46Å; F1085-L1089 HydrophobicContact CD2-CG 4.41Å; F1085-L1089 HydrophobicContact CE1-CD1 3.34Å; F1085-L1089 HydrophobicContact CE1-CG 4.02Å; F1085-L1089 HydrophobicContact CE2-CD1 4.17Å; F1085-L1089 HydrophobicContact CE2-CD2 4.22Å; F1085-L1089 HydrophobicContact CE2-CG 3.96Å; F1085-L1089 HydrophobicContact CZ-CD1 3.47Å; F1085-L1089 VanDerWaalsContact CZ-CD1 3.47Å; F1085-L1089 HydrophobicContact CZ-CD2 4.07Å; F1085-L1089 HydrophobicContact CZ-CG 3.76Å; F1085-L1089 WeakPolarHBondContact O-CB 2.97Å; F1085-L1089 WeakPolarHBondContact O-CG 3.5Å; F1085-L1089 PolarHBondContact O-N 3.43Å; F1085-F1110 AromaticContact CD1-CE1 3.77Å; F1085-F1110 HydrophobicContact CD1-CE1 3.77Å; F1085-F1110 HydrophobicContact CD1-CZ 4.25Å; F1085-F1110 AromaticContact CE1-CE1 3.81Å; F1085-F1110 HydrophobicContact CE1-CE1 3.81Å; F1085-F1110 AromaticContact CE1-CZ 3.96Å; F1085-F1110 HydrophobicContact CE1-CZ 3.96Å; F1085-F1124 AromaticContact CD1-CE2 3.9Å; F1085-F1124 HydrophobicContact CD1-CE2 3.9Å; F1085-F1124 AromaticContact CE1-CE2 3.45Å; F1085-F1124 HydrophobicContact CE1-CE2 3.45Å; F1085-F1124 VanDerWaalsContact CE1-CE2 3.45Å; F1085-F1124 HydrophobicContact CE1-CZ 4.02Å; F1085-F1124 HydrophobicContact CE2-CE2 4.43Å; F1085-F1124 HydrophobicContact CE2-CZ 4.24Å; F1085-F1124 AromaticContact CZ-CE2 3.74Å; F1085-F1124 HydrophobicContact CZ-CE2 3.74Å; F1085-F1124 AromaticContact CZ-CZ 3.79Å; F1085-F1124 HydrophobicContact CZ-CZ 3.79Å; F1085-W1128 HydrophobicContact CE2-CE3 4.41Å; F1085-W1128 AromaticContact CE2-CZ3 3.89Å; F1085-W1128 HydrophobicContact CE2-CZ3 3.89Å; F1085-W1128 AromaticContact CZ-CE3 3.92Å; F1085-W1128 HydrophobicContact CZ-CE3 3.92Å; F1085-W1128 AromaticContact CZ-CZ3 3.78Å; F1085-W1128 HydrophobicContact CZ-CZ3 3.78Å; F1085-L1132 HydrophobicContact CE1-CD1 3.93Å; F1085-L1132 HydrophobicContact CZ-CD1 3.84Å; F1085-W1168 HydrophobicContact CB-CH2 4.25Å; F1085-W1168 HydrophobicContact CB-CZ3 3.99Å; F1085-W1168 HydrophobicContact CD2-CZ3 4.27Å; F1085-I1169 HydrophobicContact CD2-CD1 4.25Å; F1085-I1169 HydrophobicContact CD2-CG1 4.22Å; F1085-I1169 HydrophobicContact CE2-CD1 3.71Å; F1085-I1169 HydrophobicContact CE2-CG1 4.18Å
1086	W	86.6	Confident	77.9	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.1	-39.7	174.3	178.1	83.5	0	0	0	112.7	I1026 A1029 K1030 L1033 L1082 E1084 N1090 T1103 F1105 I1107 F1110	I1026-W1086 HydrophobicContact CG2-CH2 4.39Å; I1026-W1086 HydrophobicContact CG2-CZ3 3.98Å; A1029-W1086 HydrophobicContact CB-CH2 3.4Å; A1029-W1086 VanDerWaalsContact CB-CH2 3.4Å; A1029-W1086 HydrophobicContact CB-CZ2 4.15Å; A1029-W1086 HydrophobicContact CB-CZ3 4.04Å; K1030-W1086 HydrophobicContact CB-CE3 4.34Å; K1030-W1086 HydrophobicContact CB-CZ3 4.07Å; L1033-W1086 HydrophobicContact CD2-CB 3.82Å; L1033-W1086 HydrophobicContact CD2-CD2 4.05Å; L1033-W1086 HydrophobicContact CD2-CG 3.71Å; L1082-W1086 VanDerWaalsContact O-CB 3.24Å; L1082-W1086 WeakPolarHBondContact O-CB 3.24Å; L1082-W1086 PolarHBondContact O-N 2.93Å; E1084-W1086 VanDerWaalsContact C-N 3.35Å; E1084-W1086 PolarHBondContact O-N 3.43Å; W1086-N1090 VanDerWaalsContact CE2-ND2 3.29Å; W1086-N1090 PolarHBondContact NE1-ND2 3.36Å; W1086-N1090 PolarHBondContact O-N 3.16Å; W1086-N1090 PolarHBondContact O-ND2 2.73Å; W1086-T1103 HydrophobicContact CH2-CG2 3.98Å; W1086-T1103 HydrophobicContact CZ2-CG2 3.48Å; W1086-T1103 VanDerWaalsContact CZ2-CG2 3.48Å; W1086-F1105 PolarHBondContact NE1-O 3.47Å; W1086-I1107 HydrophobicContact CZ2-CG1 3.83Å; W1086-F1110 HydrophobicContact CB-CD1 4.41Å; W1086-F1110 HydrophobicContact CB-CE1 4.45Å; W1086-F1110 AromaticContact CD1-CD2 3.46Å; W1086-F1110 VanDerWaalsContact CD1-CD2 3.46Å; W1086-F1110 AromaticContact CD1-CE2 3.62Å; W1086-F1110 AromaticContact CD1-CG 3.92Å; W1086-F1110 HydrophobicContact CG-CD2 4.45Å
1087	N	85.1	Confident	76.3	Confident	30 Å²	30	32.6 Å²	32.6	16%	0.16	17%	0.171	C	C	.	.	H	α-helix	trans	-60.8	-53.6	174.7	-177	36.7	0	0	0	110.6	I1026 K1030 T1083 E1084 L1089 N1090 E1091	I1026-N1087 VanDerWaalsContact CG2-OD1 3.3Å; I1026-N1087 WeakPolarHBondContact CG2-OD1 3.19Å; K1030-N1087 HydrophobicContact CD-CB 4.11Å; T1083-N1087 VanDerWaalsContact O-CB 3.31Å; T1083-N1087 WeakPolarHBondContact O-CB 3.34Å; T1083-N1087 PolarHBondContact O-N 2.84Å; T1083-N1087 VanDerWaalsContact O-N 3.07Å; E1084-N1087 WeakPolarHBondContact O-CB 3.37Å; E1084-N1087 PolarHBondContact O-N 3.13Å; E1084-N1087 PolarHBondContact OE1-ND2 3.43Å; N1087-L1089 VanDerWaalsContact C-N 3.34Å; N1087-L1089 PolarHBondContact O-N 3.15Å; N1087-N1090 PolarHBondContact O-N 2.89Å; N1087-N1090 VanDerWaalsContact O-N 3.09Å; N1087-E1091 PolarHBondContact O-N 3.4Å
1088	Q	80.2	Confident	74.5	Confident	35 Å²	35	37 Å²	37	16%	0.164	19%	0.192	C	C	.	.	H	α-helix	trans	-63.5	-34.7	179.2	-67.5	178.2	31.6	0	0	113.5	E1084 F1085 N1090 E1091 I1092 I1165 W1168	E1084-Q1088 WeakPolarHBondContact O-CG 3.37Å; E1084-Q1088 PolarHBondContact O-N 3.24Å; E1084-Q1088 PolarHBondContact OE2-NE2 3.16Å; F1085-Q1088 PolarHBondContact O-N 3.06Å; Q1088-N1090 VanDerWaalsContact C-N 3.3Å; Q1088-N1090 PolarHBondContact O-N 3.09Å; Q1088-E1091 PolarHBondContact O-N 2.83Å; Q1088-I1092 WeakPolarHBondContact O-CG1 3.33Å; Q1088-I1092 PolarHBondContact O-N 3.22Å; Q1088-I1165 HydrophobicContact CB-CD1 4.32Å; Q1088-W1168 VanDerWaalsContact NE2-CZ2 3.34Å; Q1088-W1168 VanDerWaalsContact OE1-CD2 3.28Å
1089	L	79.2	Confident	72.6	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-62.6	-33.5	173	-86	-177.4	0	0	0	113.3	F1085 N1087 I1092 P1093 F1105 F1110 L1132 L1136	F1085-L1089 HydrophobicContact CD1-CD1 4Å; F1085-L1089 HydrophobicContact CD1-CG 4.46Å; F1085-L1089 HydrophobicContact CD2-CG 4.41Å; F1085-L1089 HydrophobicContact CE1-CD1 3.34Å; F1085-L1089 HydrophobicContact CE1-CG 4.02Å; F1085-L1089 HydrophobicContact CE2-CD1 4.17Å; F1085-L1089 HydrophobicContact CE2-CD2 4.22Å; F1085-L1089 HydrophobicContact CE2-CG 3.96Å; F1085-L1089 HydrophobicContact CZ-CD1 3.47Å; F1085-L1089 VanDerWaalsContact CZ-CD1 3.47Å; F1085-L1089 HydrophobicContact CZ-CD2 4.07Å; F1085-L1089 HydrophobicContact CZ-CG 3.76Å; F1085-L1089 WeakPolarHBondContact O-CB 2.97Å; F1085-L1089 WeakPolarHBondContact O-CG 3.5Å; F1085-L1089 PolarHBondContact O-N 3.43Å; N1087-L1089 VanDerWaalsContact C-N 3.34Å; N1087-L1089 PolarHBondContact O-N 3.15Å; L1089-I1092 HydrophobicContact CD2-CD1 4.38Å; L1089-P1093 WeakPolarHBondContact O-CD 3.23Å; L1089-F1105 HydrophobicContact CB-CD2 3.96Å; L1089-F1110 HydrophobicContact CD1-CZ 3.78Å; L1089-L1132 HydrophobicContact CD1-CD1 3.92Å; L1089-L1132 HydrophobicContact CD1-CD2 3.8Å; L1089-L1136 HydrophobicContact CD2-CD1 4.4Å
1090	N	76.6	Confident	70.6	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-86.7	-25.7	178.5	-73.8	-77.1	0	0	0	112.5	W1086 N1087 Q1088 I1092 P1093 Y1094 I1104 F1105	W1086-N1090 VanDerWaalsContact CE2-ND2 3.29Å; W1086-N1090 PolarHBondContact NE1-ND2 3.36Å; W1086-N1090 PolarHBondContact O-N 3.16Å; W1086-N1090 PolarHBondContact O-ND2 2.73Å; N1087-N1090 PolarHBondContact O-N 2.89Å; N1087-N1090 VanDerWaalsContact O-N 3.09Å; Q1088-N1090 VanDerWaalsContact C-N 3.3Å; Q1088-N1090 PolarHBondContact O-N 3.09Å; N1090-I1092 VanDerWaalsContact C-N 3.27Å; N1090-I1092 PolarHBondContact O-N 3.39Å; N1090-P1093 WeakPolarHBondContact O-CB 3.4Å; N1090-P1093 WeakPolarHBondContact O-CD 3.26Å; N1090-P1093 WeakPolarHBondContact O-CG 3.42Å; N1090-Y1094 HydrophobicContact CB-CE2 4.08Å; N1090-Y1094 WeakPolarHBondContact O-CD2 3.3Å; N1090-Y1094 WeakPolarHBondContact O-CE2 3.22Å; N1090-Y1094 PolarHBondContact O-N 2.95Å; N1090-I1104 PolarHBondContact OD1-N 3.12Å; N1090-F1105 PolarHBondContact OD1-N 3.02Å
1091	E	72.5	Confident	68.8	Low	88 Å²	88	45.9 Å²	45.9	41%	0.411	24%	0.235	S	C	.	.	H	α-helix	trans	-59.1	-31.7	168.7	-80.9	-67.9	135.9	0	0	113.4	N1087 Q1088 Y1094 S1095	N1087-E1091 PolarHBondContact O-N 3.4Å; Q1088-E1091 PolarHBondContact O-N 2.83Å; E1091-Y1094 PolarHBondContact O-N 3.31Å; E1091-S1095 PolarHBondContact O-N 2.65Å
1092	I	65.7	Low	66.9	Low	4 Å²	4	49.3 Å²	49.3	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-58.4	-58.6	174.5	-24.3	175.4	0	0	0	111	Q1088 L1089 N1090 Y1094 S1095 L1096 L1136 T1161 L1162 I1165	Q1088-I1092 WeakPolarHBondContact O-CG1 3.33Å; Q1088-I1092 PolarHBondContact O-N 3.22Å; L1089-I1092 HydrophobicContact CD2-CD1 4.38Å; N1090-I1092 VanDerWaalsContact C-N 3.27Å; N1090-I1092 PolarHBondContact O-N 3.39Å; I1092-Y1094 PolarHBondContact O-N 3.38Å; I1092-S1095 PolarHBondContact O-N 3.37Å; I1092-S1095 PolarHBondContact O-OG 3.36Å; I1092-L1096 HydrophobicContact CG2-CD1 3.93Å; I1092-L1096 WeakPolarHBondContact O-CD1 3.49Å; I1092-L1096 VanDerWaalsContact O-CG 3.29Å; I1092-L1096 WeakPolarHBondContact O-CG 3.18Å; I1092-L1136 HydrophobicContact CD1-CD2 4.16Å; I1092-T1161 HydrophobicContact CB-CG2 4.46Å; I1092-T1161 HydrophobicContact CG1-CG2 4.35Å; I1092-T1161 HydrophobicContact CG2-CG2 3.85Å; I1092-L1162 HydrophobicContact CD1-CD2 3.89Å; I1092-I1165 HydrophobicContact CD1-CD1 3.47Å; I1092-I1165 VanDerWaalsContact CD1-CD1 3.47Å; I1092-I1165 HydrophobicContact CG1-CD1 3.46Å; I1092-I1165 VanDerWaalsContact CG1-CD1 3.46Å
1093	P	59.3	Low	65.2	Low	13 Å²	13	50.6 Å²	50.6	8%	0.084	26%	0.259	C	S	.	.	H	α-helix	trans	-42.8	-51.3	170.7	-32	31.2	0	0	0	116.6	L1089 N1090 S1095 L1096 L1097 I1104	L1089-P1093 WeakPolarHBondContact O-CD 3.23Å; N1090-P1093 WeakPolarHBondContact O-CB 3.4Å; N1090-P1093 WeakPolarHBondContact O-CD 3.26Å; N1090-P1093 WeakPolarHBondContact O-CG 3.42Å; P1093-S1095 PolarHBondContact O-N 3.09Å; P1093-L1096 PolarHBondContact O-N 3.4Å; P1093-L1097 PolarHBondContact O-N 3.06Å; P1093-I1104 HydrophobicContact CB-CB 4.32Å; P1093-I1104 HydrophobicContact CB-CD1 3.64Å; P1093-I1104 HydrophobicContact CB-CG1 3.77Å; P1093-I1104 HydrophobicContact CG-CB 3.73Å; P1093-I1104 HydrophobicContact CG-CD1 3.78Å; P1093-I1104 HydrophobicContact CG-CG1 3.75Å; P1093-I1104 HydrophobicContact CG-CG2 4.49Å
1094	Y	57.1	Low	63.7	Low	72 Å²	72	52.9 Å²	52.9	28%	0.282	27%	0.27	S	S	.	.	H	α-helix	trans	-62.8	-32.3	-173.3	-66.1	-64.3	0	0	0	112.4	I1026 N1090 E1091 I1092 L1096 F1102	I1026-Y1094 HydrophobicContact CD1-CD2 3.74Å; I1026-Y1094 HydrophobicContact CD1-CE2 3.24Å; I1026-Y1094 HydrophobicContact CG1-CE2 3.6Å; I1026-Y1094 WeakPolarHBondContact CG1-OH 3.3Å; N1090-Y1094 HydrophobicContact CB-CE2 4.08Å; N1090-Y1094 WeakPolarHBondContact O-CD2 3.3Å; N1090-Y1094 WeakPolarHBondContact O-CE2 3.22Å; N1090-Y1094 PolarHBondContact O-N 2.95Å; E1091-Y1094 PolarHBondContact O-N 3.31Å; I1092-Y1094 PolarHBondContact O-N 3.38Å; Y1094-L1096 VanDerWaalsContact C-N 3.27Å; Y1094-L1096 PolarHBondContact O-N 3.34Å; Y1094-F1102 PolarHBondContact OH-O 3.09Å
1095	S	52.8	Low	62.8	Low	78 Å²	78	50.4 Å²	50.4	55%	0.545	26%	0.259	S	S	.	.	H	α-helix	trans	-73.7	-13.5	176.2	72.8	0	0	0	0	114.6	E1091 I1092 P1093	E1091-S1095 PolarHBondContact O-N 2.65Å; I1092-S1095 PolarHBondContact O-N 3.37Å; I1092-S1095 PolarHBondContact O-OG 3.36Å; P1093-S1095 PolarHBondContact O-N 3.09Å
1096	L	49.3	Very low	61.9	Low	50 Å²	50	51.4 Å²	51.4	26%	0.262	27%	0.269	S	S	.	.	H	α-helix	trans	-118.4	-44.9	-165.5	-61.8	175.4	0	0	0	115.1	I1092 P1093 Y1094 I1158	I1092-L1096 HydrophobicContact CG2-CD1 3.93Å; I1092-L1096 WeakPolarHBondContact O-CD1 3.49Å; I1092-L1096 VanDerWaalsContact O-CG 3.29Å; I1092-L1096 WeakPolarHBondContact O-CG 3.18Å; P1093-L1096 PolarHBondContact O-N 3.4Å; Y1094-L1096 VanDerWaalsContact C-N 3.27Å; Y1094-L1096 PolarHBondContact O-N 3.34Å; L1096-I1158 HydrophobicContact CD1-CD1 4.32Å; L1096-I1158 HydrophobicContact CD1-CG1 3.66Å; L1096-I1158 HydrophobicContact CD1-CG2 4.34Å; L1096-I1158 HydrophobicContact CD2-CD1 4.1Å; L1096-I1158 HydrophobicContact CD2-CG1 3.31Å; L1096-I1158 HydrophobicContact CG-CG1 4.09Å
1097	L	50.4	Low	61.6	Low	76 Å²	76	51.5 Å²	51.5	40%	0.398	27%	0.27	S	S	.	.			trans	-98.2	-14.7	-162.1	-75.9	160.3	0	0	0	114.5	P1093 S1099 I1104	P1093-L1097 PolarHBondContact O-N 3.06Å; L1097-S1099 PolarHBondContact O-N 3.43Å; L1097-I1104 HydrophobicContact CD1-CD1 3.4Å; L1097-I1104 VanDerWaalsContact CD1-CD1 3.4Å
1098	Q	46.5	Very low	61.2	Low	191 Å²	191	54.3 Å²	54.3	89%	0.893	28%	0.278	S	S	*	.			trans	49.1	17.3	-174.9	-64.7	-167.5	-13.5	0	0	115
1099	S	45.6	Very low	61.1	Low	50 Å²	50	54.8 Å²	54.8	35%	0.35	28%	0.283	S	S	.	.			trans	-83.1	139.3	-175.7	49.1	0	0	0	0	111.7	L1097 Q1101	L1097-S1099 PolarHBondContact O-N 3.43Å; S1099-Q1101 PolarHBondContact O-N 3.48Å
1100	N	45	Very low	61.4	Low	130 Å²	130	54.8 Å²	54.8	70%	0.695	28%	0.283	S	S	*	.	S	Bend	trans	-70.7	24.1	172.2	-66	-58.9	0	0	0	113.7	F1102	N1100-F1102 WeakPolarHBondContact O-CD2 3.02Å; N1100-F1102 WeakPolarHBondContact O-CE2 3.42Å
1101	Q	49.5	Very low	61.7	Low	72 Å²	72	55.1 Å²	55.1	34%	0.336	29%	0.285	S	S	.	.			trans	-98.1	116.8	176.7	-70.7	-175	-12	0	0	108.8	S1099 T1103	S1099-Q1101 PolarHBondContact O-N 3.48Å; Q1101-T1103 VanDerWaalsContact C-N 3.32Å; Q1101-T1103 PolarHBondContact O-N 3.17Å
1102	F	50.7	Low	62.2	Low	85 Å²	85	53.7 Å²	53.7	37%	0.373	28%	0.282	S	S	.	.	S	Bend	trans	-90.6	22.6	-164.2	-65.7	-93.7	0	0	0	114.4	S1024 Y1094 N1100	S1024-F1102 VanDerWaalsContact O-CB 3.31Å; S1024-F1102 WeakPolarHBondContact O-CB 3.5Å; S1024-F1102 WeakPolarHBondContact O-CD1 3.23Å; S1024-F1102 WeakPolarHBondContact O-CG 3.42Å; Y1094-F1102 PolarHBondContact OH-O 3.09Å; N1100-F1102 WeakPolarHBondContact O-CD2 3.02Å; N1100-F1102 WeakPolarHBondContact O-CE2 3.42Å
1103	T	53.3	Low	63.1	Low	28 Å²	28	53.8 Å²	53.8	17%	0.172	28%	0.283	C	S	.	.			trans	-178.8	130.9	171.9	7.4	0	0	0	0	108.1	W1086 Q1101	W1086-T1103 HydrophobicContact CH2-CG2 3.98Å; W1086-T1103 HydrophobicContact CZ2-CG2 3.48Å; W1086-T1103 VanDerWaalsContact CZ2-CG2 3.48Å; Q1101-T1103 VanDerWaalsContact C-N 3.32Å; Q1101-T1103 PolarHBondContact O-N 3.17Å
1104	I	56.7	Low	64.3	Low	51 Å²	51	55.1 Å²	55.1	26%	0.262	29%	0.292	S	S	.	.	S	Bend	trans	-97.3	-38.2	167.7	-65.7	-159.4	0	0	0	110.1	N1090 P1093 L1097 G1106	N1090-I1104 PolarHBondContact OD1-N 3.12Å; P1093-I1104 HydrophobicContact CB-CB 4.32Å; P1093-I1104 HydrophobicContact CB-CD1 3.64Å; P1093-I1104 HydrophobicContact CB-CG1 3.77Å; P1093-I1104 HydrophobicContact CG-CB 3.73Å; P1093-I1104 HydrophobicContact CG-CD1 3.78Å; P1093-I1104 HydrophobicContact CG-CG1 3.75Å; P1093-I1104 HydrophobicContact CG-CG2 4.49Å; L1097-I1104 HydrophobicContact CD1-CD1 3.4Å; L1097-I1104 VanDerWaalsContact CD1-CD1 3.4Å; I1104-G1106 PolarHBondContact O-N 2.9Å
1105	F	68.5	Low	65.5	Low	6 Å²	6	52.2 Å²	52.2	3%	0.026	28%	0.281	C	S	.	.	S	Bend	trans	-98.1	93.5	177.1	-60.8	-70.1	0	0	0	110.1	W1086 L1089 N1090 L1132 I1135 L1136	W1086-F1105 PolarHBondContact NE1-O 3.47Å; L1089-F1105 HydrophobicContact CB-CD2 3.96Å; N1090-F1105 PolarHBondContact OD1-N 3.02Å; F1105-L1132 HydrophobicContact CD1-CD2 3.41Å; F1105-L1132 VanDerWaalsContact CD1-CD2 3.41Å; F1105-L1132 HydrophobicContact CE1-CD2 3.59Å; F1105-L1132 HydrophobicContact CG-CD2 4.09Å; F1105-L1132 HydrophobicContact CZ-CD2 4.39Å; F1105-I1135 HydrophobicContact CE1-CB 4.08Å; F1105-I1135 HydrophobicContact CE1-CD1 4.18Å; F1105-I1135 HydrophobicContact CE1-CG2 3.72Å; F1105-I1135 HydrophobicContact CZ-CB 4.49Å; F1105-I1135 HydrophobicContact CZ-CG2 3.9Å; F1105-L1136 HydrophobicContact CE2-CD2 3.93Å; F1105-L1136 HydrophobicContact CZ-CD2 3.7Å; F1105-L1136 HydrophobicContact CZ-CG 3.92Å
1106	G	70	Confident	66.8	Low	21 Å²	21	50 Å²	50	22%	0.216	26%	0.262	C	S	.	.			trans	-59.4	135.1	-177.6	0	0	0	0	0	113.4	I1104 R1108 T1109	I1104-G1106 PolarHBondContact O-N 2.9Å; G1106-R1108 PolarHBondContact O-N 2.88Å; G1106-T1109 PolarHBondContact O-N 3.16Å
1107	I	78.9	Confident	68.2	Low	2 Å²	2	49.6 Å²	49.6	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-51.6	-31.7	-177.7	-43	178.2	0	0	0	112.3	T910 L1023 A1029 Y1032 L1033 W1086 T1109 F1110 L1111	T910-I1107 HydrophobicContact CG2-CD1 4.18Å; L1023-I1107 HydrophobicContact CD1-CD1 4.15Å; A1029-I1107 HydrophobicContact CB-CD1 3.66Å; A1029-I1107 HydrophobicContact CB-CG1 4.47Å; Y1032-I1107 HydrophobicContact CD1-CD1 4.12Å; Y1032-I1107 HydrophobicContact CD1-CG2 4.44Å; L1033-I1107 HydrophobicContact CB-CG2 3.91Å; L1033-I1107 HydrophobicContact CD1-CG2 3.79Å; L1033-I1107 HydrophobicContact CD2-CG2 4.49Å; L1033-I1107 HydrophobicContact CG-CG2 4.26Å; W1086-I1107 HydrophobicContact CZ2-CG1 3.83Å; I1107-T1109 PolarHBondContact O-N 3.34Å; I1107-T1109 VanDerWaalsContact O-N 3.1Å; I1107-F1110 PolarHBondContact O-N 2.99Å; I1107-L1111 HydrophobicContact CG2-CD1 4.21Å; I1107-L1111 HydrophobicContact CG2-CG 4.15Å; I1107-L1111 PolarHBondContact O-N 3.08Å; I1107-L1111 VanDerWaalsContact O-N 3.11Å
1108	R	77.2	Confident	69.4	Low	88 Å²	88	49.1 Å²	49.1	33%	0.332	26%	0.259	S	S	.	.	H	α-helix	trans	-47.5	-42.1	-177.8	-167.6	-177	-172.8	-179.5	2.4	113.6	G1106	G1106-R1108 PolarHBondContact O-N 2.88Å
1109	T	79.4	Confident	71.1	Confident	45 Å²	45	43 Å²	43	28%	0.276	23%	0.232	S	C	.	.	H	α-helix	trans	-72.2	-40.3	-176.5	-37	0	0	0	0	111.1	G1106 I1107 L1111 T1112 W1123 L1127 M1131	G1106-T1109 PolarHBondContact O-N 3.16Å; I1107-T1109 PolarHBondContact O-N 3.34Å; I1107-T1109 VanDerWaalsContact O-N 3.1Å; T1109-L1111 VanDerWaalsContact C-N 3.27Å; T1109-L1111 PolarHBondContact O-N 2.7Å; T1109-T1112 WeakPolarHBondContact O-CB 3.44Å; T1109-T1112 PolarHBondContact O-N 2.85Å; T1109-T1112 PolarHBondContact O-OG1 3.26Å; T1109-W1123 WeakPolarHBondContact O-CZ2 3.05Å; T1109-L1127 HydrophobicContact CG2-CD1 3.36Å; T1109-M1131 HydrophobicContact CG2-CE 4.01Å; T1109-M1131 HydrophobicContact CG2-SD 3.83Å
1110	F	84.9	Confident	73	Confident	1 Å²	1	40.6 Å²	40.6	0%	0.004	22%	0.216	C	C	.	.	H	α-helix	trans	-66	-31.4	178.1	-70.3	-93.3	0	0	0	112.4	L1033 L1082 F1085 W1086 L1089 I1107 T1112 C1113 W1123 L1127	L1033-F1110 HydrophobicContact CD1-CB 3.82Å; L1033-F1110 HydrophobicContact CD2-CB 4.09Å; L1082-F1110 HydrophobicContact CD2-CD1 4.5Å; F1085-F1110 AromaticContact CD1-CE1 3.77Å; F1085-F1110 HydrophobicContact CD1-CE1 3.77Å; F1085-F1110 HydrophobicContact CD1-CZ 4.25Å; F1085-F1110 AromaticContact CE1-CE1 3.81Å; F1085-F1110 HydrophobicContact CE1-CE1 3.81Å; F1085-F1110 AromaticContact CE1-CZ 3.96Å; F1085-F1110 HydrophobicContact CE1-CZ 3.96Å; W1086-F1110 HydrophobicContact CB-CD1 4.41Å; W1086-F1110 HydrophobicContact CB-CE1 4.45Å; W1086-F1110 AromaticContact CD1-CD2 3.46Å; W1086-F1110 VanDerWaalsContact CD1-CD2 3.46Å; W1086-F1110 AromaticContact CD1-CE2 3.62Å; W1086-F1110 AromaticContact CD1-CG 3.92Å; W1086-F1110 HydrophobicContact CG-CD2 4.45Å; L1089-F1110 HydrophobicContact CD1-CZ 3.78Å; I1107-F1110 PolarHBondContact O-N 2.99Å; F1110-T1112 PolarHBondContact O-N 3.21Å; F1110-T1112 VanDerWaalsContact O-N 3.08Å; F1110-C1113 WeakPolarHBondContact O-CB 3.41Å; F1110-C1113 PolarHBondContact O-N 3.32Å; F1110-C1113 VanDerWaalsContact O-N 3.13Å; F1110-W1123 HydrophobicContact CD1-CH2 4.13Å; F1110-L1127 HydrophobicContact CE1-CD2 3.9Å; F1110-L1127 HydrophobicContact CZ-CD2 3.94Å
1111	L	83.4	Confident	74.9	Confident	6 Å²	6	34.8 Å²	34.8	3%	0.031	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-8.3	168.9	-65	172.7	0	0	0	114	Y1032 L1033 S1036 K1040 I1107 T1109	Y1032-L1111 HydrophobicContact CE1-CD1 4.48Å; L1033-L1111 HydrophobicContact CD1-CD2 3.95Å; L1033-L1111 HydrophobicContact CD1-CG 4.3Å; S1036-L1111 VanDerWaalsContact CB-CD2 3.41Å; K1040-L1111 PolarHBondContact NZ-O 3.18Å; I1107-L1111 HydrophobicContact CG2-CD1 4.21Å; I1107-L1111 HydrophobicContact CG2-CG 4.15Å; I1107-L1111 PolarHBondContact O-N 3.08Å; I1107-L1111 VanDerWaalsContact O-N 3.11Å; T1109-L1111 VanDerWaalsContact C-N 3.27Å; T1109-L1111 PolarHBondContact O-N 2.7Å
1112	T	83.3	Confident	76.4	Confident	58 Å²	58	34.7 Å²	34.7	36%	0.356	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-0.8	174.1	73.6	0	0	0	0	114.6	T1109 F1110 P1114 W1123 I1230	T1109-T1112 WeakPolarHBondContact O-CB 3.44Å; T1109-T1112 PolarHBondContact O-N 2.85Å; T1109-T1112 PolarHBondContact O-OG1 3.26Å; F1110-T1112 PolarHBondContact O-N 3.21Å; F1110-T1112 VanDerWaalsContact O-N 3.08Å; T1112-P1114 WeakPolarHBondContact O-CD 3.48Å; T1112-W1123 PolarHBondContact OG1-NE1 3.47Å; T1112-I1230 HydrophobicContact CG2-CD1 3.81Å
1113	C	84.4	Confident	78.3	Confident	6 Å²	6	32.5 Å²	32.5	4%	0.041	18%	0.175	C	C	.	.			trans	-59.8	124.4	177.1	-174.1	0	0	0	0	111.3	L1082 F1110 M1115 W1123	L1082-C1113 HydrophobicContact CD1-CB 4.29Å; F1110-C1113 WeakPolarHBondContact O-CB 3.41Å; F1110-C1113 PolarHBondContact O-N 3.32Å; F1110-C1113 VanDerWaalsContact O-N 3.13Å; C1113-M1115 HydrophobicContact CB-CE 3.88Å; C1113-M1115 VanDerWaalsContact O-CE 3.25Å; C1113-M1115 WeakPolarHBondContact O-CE 3.46Å; C1113-W1123 HydrophobicContact CB-CD2 4.13Å; C1113-W1123 HydrophobicContact CB-CE3 3.89Å; C1113-W1123 HydrophobicContact CB-CH2 3.71Å; C1113-W1123 HydrophobicContact CB-CZ2 3.94Å; C1113-W1123 HydrophobicContact CB-CZ3 3.67Å
1114	P	84.6	Confident	79.9	Confident	41 Å²	41	31.1 Å²	31.1	27%	0.266	17%	0.167	S	C	.	.			trans	-72.5	137.6	170.2	30.5	-33.2	0	0	0	109.9	T1112 H1116 L1119 S1120 W1123	T1112-P1114 WeakPolarHBondContact O-CD 3.48Å; P1114-H1116 PolarHBondContact O-N 2.84Å; P1114-L1119 HydrophobicContact CB-CB 3.94Å; P1114-L1119 HydrophobicContact CB-CD1 4.42Å; P1114-L1119 HydrophobicContact CG-CB 3.57Å; P1114-S1120 WeakPolarHBondContact O-CB 3.33Å; P1114-W1123 HydrophobicContact CG-CB 4.11Å
1115	M	81.5	Confident	81.2	Confident	12 Å²	12	30 Å²	30	6%	0.059	16%	0.161	C	C	.	.	S	Bend	trans	-81.7	41.8	-174.5	-63.9	-67.6	98.3	0	0	113.8	L1037 K1040 L1041 Y1044 L1075 V1079 C1113	L1037-M1115 HydrophobicContact CD2-CE 3.85Å; K1040-M1115 HydrophobicContact CB-CG 3.65Å; K1040-M1115 HydrophobicContact CB-SD 4.06Å; L1041-M1115 HydrophobicContact CB-SD 4.19Å; Y1044-M1115 HydrophobicContact CD1-CB 4.17Å; Y1044-M1115 WeakPolarHBondContact CD1-O 3.35Å; Y1044-M1115 HydrophobicContact CD2-CB 4.26Å; Y1044-M1115 WeakPolarHBondContact CE1-O 3.41Å; Y1044-M1115 HydrophobicContact CG-CB 3.82Å; Y1044-M1115 VanDerWaalsContact CZ-O 3.29Å; L1075-M1115 WeakPolarHBondContact CD2-O 3.3Å; V1079-M1115 HydrophobicContact CG2-SD 4.26Å; C1113-M1115 HydrophobicContact CB-CE 3.88Å; C1113-M1115 VanDerWaalsContact O-CE 3.25Å; C1113-M1115 WeakPolarHBondContact O-CE 3.46Å
1116	H	79.7	Confident	81.8	Confident	31 Å²	31	34.3 Å²	34.3	14%	0.144	19%	0.185	C	C	.	.	S	Bend	trans	-131.7	134.5	-179.6	-175.6	-26.3	0	0	0	109.3	Y1044 P1114 Q1118 L1119 S1120 Y1258	Y1044-H1116 HydrophobicContact CE2-CB 4.12Å; Y1044-H1116 PolarHBondContact OH-CD2 2.96Å; P1114-H1116 PolarHBondContact O-N 2.84Å; H1116-Q1118 PolarHBondContact ND1-N 3.27Å; H1116-Q1118 PolarHBondContact O-N 3Å; H1116-L1119 HydrophobicContact CB-CB 4.22Å; H1116-L1119 HydrophobicContact CB-CD1 4.34Å; H1116-L1119 HydrophobicContact CB-CG 4.3Å; H1116-L1119 PolarHBondContact O-N 2.91Å; H1116-S1120 VanDerWaalsContact O-CB 3.26Å; H1116-S1120 WeakPolarHBondContact O-CB 3.38Å; H1116-S1120 PolarHBondContact O-N 3.03Å; H1116-S1120 PolarHBondContact O-OG 3.29Å; H1116-Y1258 PolarHBondContact CD2-OH 2.81Å; H1116-Y1258 AromaticContact NE2-CZ 3.93Å; H1116-Y1258 PolarHBondContact NE2-OH 2.9Å
1117	S	78.6	Confident	82.5	Confident	42 Å²	42	33.8 Å²	33.8	29%	0.294	18%	0.177	S	C	.	.	H	α-helix	trans	-39.9	-61	177.8	49.8	0	0	0	0	114.1	S1120 L1121 W1175	S1117-S1120 PolarHBondContact O-OG 3.12Å; S1117-L1121 PolarHBondContact O-N 2.89Å; S1117-W1175 VanDerWaalsContact O-CD1 3.24Å; S1117-W1175 PolarHBondContact O-NE1 2.71Å; S1117-W1175 VanDerWaalsContact O-NE1 3.09Å
1118	Q	75.5	Confident	82.7	Confident	65 Å²	65	34 Å²	34	30%	0.304	18%	0.177	S	C	.	.	H	α-helix	trans	-74	-35.5	-176.1	-169.4	62.5	11.6	0	0	113.9	H1116 N1122	H1116-Q1118 PolarHBondContact ND1-N 3.27Å; H1116-Q1118 PolarHBondContact O-N 3Å; Q1118-N1122 PolarHBondContact O-N 3.21Å
1119	L	82	Confident	82.7	Confident	63 Å²	63	31.7 Å²	31.7	33%	0.33	17%	0.172	S	C	.	.	H	α-helix	trans	-73.6	-36.6	179.1	-61.5	-176.2	0	0	0	112.2	P1114 H1116 L1121 N1122 W1123 Y1258	P1114-L1119 HydrophobicContact CB-CB 3.94Å; P1114-L1119 HydrophobicContact CB-CD1 4.42Å; P1114-L1119 HydrophobicContact CG-CB 3.57Å; H1116-L1119 HydrophobicContact CB-CB 4.22Å; H1116-L1119 HydrophobicContact CB-CD1 4.34Å; H1116-L1119 HydrophobicContact CB-CG 4.3Å; H1116-L1119 PolarHBondContact O-N 2.91Å; L1119-L1121 VanDerWaalsContact C-N 3.31Å; L1119-L1121 PolarHBondContact O-N 3.16Å; L1119-N1122 PolarHBondContact O-N 3.33Å; L1119-W1123 VanDerWaalsContact O-CB 3.27Å; L1119-W1123 WeakPolarHBondContact O-CB 3.48Å; L1119-W1123 PolarHBondContact O-N 3.33Å; L1119-Y1258 HydrophobicContact CD1-CE2 4.24Å; L1119-Y1258 WeakPolarHBondContact CD1-OH 3.41Å; L1119-Y1258 HydrophobicContact CD2-CE2 4.23Å; L1119-Y1258 WeakPolarHBondContact CG-OH 3.4Å
1120	S	85.8	Confident	82.7	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-65.1	-35.4	176.3	56.8	0	0	0	0	111.6	L1078 P1114 H1116 S1117 F1124 W1175	L1078-S1120 WeakPolarHBondContact CD1-OG 3.49Å; P1114-S1120 WeakPolarHBondContact O-CB 3.33Å; H1116-S1120 VanDerWaalsContact O-CB 3.26Å; H1116-S1120 WeakPolarHBondContact O-CB 3.38Å; H1116-S1120 PolarHBondContact O-N 3.03Å; H1116-S1120 PolarHBondContact O-OG 3.29Å; S1117-S1120 PolarHBondContact O-OG 3.12Å; S1120-F1124 WeakPolarHBondContact O-CB 3.15Å; S1120-F1124 PolarHBondContact O-N 3.3Å; S1120-W1175 PolarHBondContact OG-NE1 2.77Å
1121	L	84.7	Confident	82.4	Confident	8 Å²	8	37.2 Å²	37.2	4%	0.042	20%	0.199	C	C	.	.	H	α-helix	trans	-59.6	-53.2	171.8	175.9	73.3	0	0	0	111.4	S1117 L1119 F1124 L1125 W1173 W1175 V1180 P1183	S1117-L1121 PolarHBondContact O-N 2.89Å; L1119-L1121 VanDerWaalsContact C-N 3.31Å; L1119-L1121 PolarHBondContact O-N 3.16Å; L1121-F1124 PolarHBondContact O-N 3.01Å; L1121-L1125 HydrophobicContact CD1-CD1 4.32Å; L1121-L1125 HydrophobicContact CG-CD1 4.15Å; L1121-L1125 WeakPolarHBondContact O-CG 3.44Å; L1121-L1125 PolarHBondContact O-N 3.21Å; L1121-W1173 HydrophobicContact CD1-CH2 4.23Å; L1121-W1173 HydrophobicContact CD1-CZ2 3.67Å; L1121-W1175 HydrophobicContact CB-CD2 4.41Å; L1121-W1175 HydrophobicContact CB-CG 4.37Å; L1121-W1175 HydrophobicContact CD1-CD2 3.98Å; L1121-W1175 HydrophobicContact CD1-CE3 4.27Å; L1121-W1175 HydrophobicContact CD1-CG 4.15Å; L1121-V1180 HydrophobicContact CD1-CG1 3.91Å; L1121-V1180 HydrophobicContact CD2-CB 4.41Å; L1121-V1180 HydrophobicContact CD2-CG1 3.46Å; L1121-V1180 VanDerWaalsContact CD2-CG1 3.46Å; L1121-V1180 HydrophobicContact CD2-CG2 4.01Å; L1121-V1180 HydrophobicContact CG-CG1 4.33Å; L1121-P1183 HydrophobicContact CD1-CG 4.41Å
1122	N	82.4	Confident	82.2	Confident	69 Å²	69	36.9 Å²	36.9	37%	0.369	20%	0.197	S	C	.	.	H	α-helix	trans	-62.5	-47.9	-178.5	-70.5	-9.5	0	0	0	110.9	Q1118 L1119 F1124 L1125 D1126	Q1118-N1122 PolarHBondContact O-N 3.21Å; L1119-N1122 PolarHBondContact O-N 3.33Å; N1122-F1124 VanDerWaalsContact C-N 3.31Å; N1122-F1124 PolarHBondContact O-N 3.41Å; N1122-L1125 PolarHBondContact O-N 3.33Å; N1122-L1125 VanDerWaalsContact O-N 3.15Å; N1122-D1126 PolarHBondContact O-N 2.92Å
1123	W	88.7	Confident	81.8	Confident	39 Å²	39	34.8 Å²	34.8	15%	0.148	18%	0.184	C	C	.	.	H	α-helix	trans	-55.8	-43.2	173.7	167.8	87.6	0	0	0	112.3	L1082 T1109 F1110 T1112 C1113 P1114 L1119 D1126 L1127	L1082-W1123 HydrophobicContact CD1-CZ3 4.47Å; L1082-W1123 HydrophobicContact CD2-CH2 4.47Å; L1082-W1123 HydrophobicContact CD2-CZ3 4.02Å; T1109-W1123 WeakPolarHBondContact O-CZ2 3.05Å; F1110-W1123 HydrophobicContact CD1-CH2 4.13Å; T1112-W1123 PolarHBondContact OG1-NE1 3.47Å; C1113-W1123 HydrophobicContact CB-CD2 4.13Å; C1113-W1123 HydrophobicContact CB-CE3 3.89Å; C1113-W1123 HydrophobicContact CB-CH2 3.71Å; C1113-W1123 HydrophobicContact CB-CZ2 3.94Å; C1113-W1123 HydrophobicContact CB-CZ3 3.67Å; P1114-W1123 HydrophobicContact CG-CB 4.11Å; L1119-W1123 VanDerWaalsContact O-CB 3.27Å; L1119-W1123 WeakPolarHBondContact O-CB 3.48Å; L1119-W1123 PolarHBondContact O-N 3.33Å; W1123-D1126 PolarHBondContact O-N 3.29Å; W1123-L1127 HydrophobicContact CH2-CD2 3.7Å; W1123-L1127 HydrophobicContact CZ2-CD1 4.05Å; W1123-L1127 HydrophobicContact CZ2-CD2 4.03Å; W1123-L1127 HydrophobicContact CZ2-CG 4.5Å; W1123-L1127 HydrophobicContact CZ3-CD2 4.15Å; W1123-L1127 WeakPolarHBondContact O-CB 3.4Å; W1123-L1127 PolarHBondContact O-N 3.25Å
1124	F	87.5	Confident	81.3	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-67.4	-37	178.2	-179.4	-91.7	0	0	0	112	W1081 L1082 F1085 S1120 L1121 N1122 L1127 W1128 W1173 W1175 I1186	W1081-F1124 HydrophobicContact CH2-CD2 4.49Å; W1081-F1124 HydrophobicContact CH2-CE1 4.27Å; W1081-F1124 AromaticContact CH2-CE2 3.69Å; W1081-F1124 HydrophobicContact CH2-CE2 3.69Å; W1081-F1124 AromaticContact CH2-CZ 3.59Å; W1081-F1124 HydrophobicContact CH2-CZ 3.59Å; W1081-F1124 HydrophobicContact CZ3-CD2 4.09Å; W1081-F1124 AromaticContact CZ3-CE2 3.61Å; W1081-F1124 HydrophobicContact CZ3-CE2 3.61Å; W1081-F1124 HydrophobicContact CZ3-CZ 4.01Å; L1082-F1124 HydrophobicContact CD2-CD2 4.3Å; F1085-F1124 AromaticContact CD1-CE2 3.9Å; F1085-F1124 HydrophobicContact CD1-CE2 3.9Å; F1085-F1124 AromaticContact CE1-CE2 3.45Å; F1085-F1124 HydrophobicContact CE1-CE2 3.45Å; F1085-F1124 VanDerWaalsContact CE1-CE2 3.45Å; F1085-F1124 HydrophobicContact CE1-CZ 4.02Å; F1085-F1124 HydrophobicContact CE2-CE2 4.43Å; F1085-F1124 HydrophobicContact CE2-CZ 4.24Å; F1085-F1124 AromaticContact CZ-CE2 3.74Å; F1085-F1124 HydrophobicContact CZ-CE2 3.74Å; F1085-F1124 AromaticContact CZ-CZ 3.79Å; F1085-F1124 HydrophobicContact CZ-CZ 3.79Å; S1120-F1124 WeakPolarHBondContact O-CB 3.15Å; S1120-F1124 PolarHBondContact O-N 3.3Å; L1121-F1124 PolarHBondContact O-N 3.01Å; N1122-F1124 VanDerWaalsContact C-N 3.31Å; N1122-F1124 PolarHBondContact O-N 3.41Å; F1124-L1127 HydrophobicContact CD2-CD2 4.17Å; F1124-L1127 WeakPolarHBondContact O-CB 2.91Å; F1124-L1127 PolarHBondContact O-N 3.32Å; F1124-W1128 HydrophobicContact CE1-CB 4.33Å; F1124-W1128 HydrophobicContact CZ-CE3 4.25Å; F1124-W1128 WeakPolarHBondContact O-CB 3.19Å; F1124-W1128 PolarHBondContact O-N 3.44Å; F1124-W1173 HydrophobicContact CD1-CH2 4.3Å; F1124-W1173 HydrophobicContact CD1-CZ3 4.46Å; F1124-W1173 HydrophobicContact CE1-CH2 4.34Å; F1124-W1173 HydrophobicContact CE1-CZ3 4.1Å; F1124-W1175 HydrophobicContact CB-CH2 3.65Å; F1124-W1175 HydrophobicContact CB-CZ2 3.94Å; F1124-W1175 AromaticContact CD1-CH2 3.87Å; F1124-W1175 HydrophobicContact CD1-CH2 3.87Å; F1124-W1175 HydrophobicContact CD1-CZ3 4.17Å; F1124-W1175 HydrophobicContact CD2-CH2 4.01Å; F1124-W1175 AromaticContact CG-CH2 3.55Å; F1124-W1175 HydrophobicContact CG-CH2 3.55Å; F1124-W1175 HydrophobicContact CG-CZ2 4.34Å; F1124-W1175 HydrophobicContact CG-CZ3 4.29Å; F1124-I1186 HydrophobicContact CE1-CD1 4.29Å
1125	L	83.4	Confident	80.6	Confident	27 Å²	27	38.3 Å²	38.3	14%	0.141	20%	0.203	C	C	.	.	H	α-helix	trans	-66	-40.9	175.2	-74.2	168.8	0	0	0	111.8	L1121 N1122 W1128 N1129 P1183 I1186	L1121-L1125 HydrophobicContact CD1-CD1 4.32Å; L1121-L1125 HydrophobicContact CG-CD1 4.15Å; L1121-L1125 WeakPolarHBondContact O-CG 3.44Å; L1121-L1125 PolarHBondContact O-N 3.21Å; N1122-L1125 PolarHBondContact O-N 3.33Å; N1122-L1125 VanDerWaalsContact O-N 3.15Å; L1125-W1128 PolarHBondContact O-N 2.77Å; L1125-N1129 WeakPolarHBondContact O-CB 3.41Å; L1125-N1129 PolarHBondContact O-N 2.98Å; L1125-N1129 PolarHBondContact O-ND2 2.75Å; L1125-P1183 HydrophobicContact CD1-CB 4.28Å; L1125-P1183 HydrophobicContact CD1-CG 3.97Å; L1125-P1183 HydrophobicContact CD2-CB 3.72Å; L1125-P1183 HydrophobicContact CD2-CG 3.91Å; L1125-P1183 HydrophobicContact CG-CG 4.44Å; L1125-I1186 HydrophobicContact CD2-CD1 3.85Å; L1125-I1186 HydrophobicContact CD2-CG1 3.9Å
1126	D	82.4	Confident	80.1	Confident	96 Å²	96	38.7 Å²	38.7	51%	0.513	21%	0.205	S	C	.	.	H	α-helix	trans	-68.9	-42.8	174.9	-72.7	-37.7	0	0	0	111.7	N1122 W1123 W1128 N1130	N1122-D1126 PolarHBondContact O-N 2.92Å; W1123-D1126 PolarHBondContact O-N 3.29Å; D1126-W1128 VanDerWaalsContact C-N 3.32Å; D1126-W1128 PolarHBondContact O-N 2.84Å; D1126-N1130 WeakPolarHBondContact O-CA 3.03Å; D1126-N1130 WeakPolarHBondContact O-CB 3.12Å; D1126-N1130 PolarHBondContact O-N 3.03Å; D1126-N1130 PolarHBondContact O-ND2 2.84Å; D1126-N1130 PolarHBondContact OD1-ND2 3.18Å
1127	L	85.1	Confident	79.5	Confident	10 Å²	10	41.1 Å²	41.1	5%	0.052	22%	0.215	C	C	.	.	I	π-helix	trans	-54.4	-47.8	171.8	-177.8	86.2	0	0	0	111.4	T1109 F1110 W1123 F1124 M1131 L1132	T1109-L1127 HydrophobicContact CG2-CD1 3.36Å; F1110-L1127 HydrophobicContact CE1-CD2 3.9Å; F1110-L1127 HydrophobicContact CZ-CD2 3.94Å; W1123-L1127 HydrophobicContact CH2-CD2 3.7Å; W1123-L1127 HydrophobicContact CZ2-CD1 4.05Å; W1123-L1127 HydrophobicContact CZ2-CD2 4.03Å; W1123-L1127 HydrophobicContact CZ2-CG 4.5Å; W1123-L1127 HydrophobicContact CZ3-CD2 4.15Å; W1123-L1127 WeakPolarHBondContact O-CB 3.4Å; W1123-L1127 PolarHBondContact O-N 3.25Å; F1124-L1127 HydrophobicContact CD2-CD2 4.17Å; F1124-L1127 WeakPolarHBondContact O-CB 2.91Å; F1124-L1127 PolarHBondContact O-N 3.32Å; L1127-M1131 HydrophobicContact CD1-CE 3.55Å; L1127-M1131 HydrophobicContact CD1-SD 4.39Å; L1127-M1131 HydrophobicContact CG-CE 4.25Å; L1127-M1131 WeakPolarHBondContact O-CB 3.39Å; L1127-M1131 PolarHBondContact O-N 3.21Å; L1127-L1132 HydrophobicContact CD2-CD1 3.82Å; L1127-L1132 HydrophobicContact CG-CD1 3.88Å; L1127-L1132 HydrophobicContact CG-CG 4.17Å; L1127-L1132 PolarHBondContact O-N 3.19Å
1128	W	82.9	Confident	78.9	Confident	6 Å²	6	44 Å²	44	2%	0.023	22%	0.223	C	C	.	.	I	π-helix	trans	-66.9	-55.7	-178.8	-177.1	-99.5	0	0	0	111.6	F1085 F1124 L1125 D1126 L1132 V1133 L1166 I1169 I1186	F1085-W1128 HydrophobicContact CE2-CE3 4.41Å; F1085-W1128 AromaticContact CE2-CZ3 3.89Å; F1085-W1128 HydrophobicContact CE2-CZ3 3.89Å; F1085-W1128 AromaticContact CZ-CE3 3.92Å; F1085-W1128 HydrophobicContact CZ-CE3 3.92Å; F1085-W1128 AromaticContact CZ-CZ3 3.78Å; F1085-W1128 HydrophobicContact CZ-CZ3 3.78Å; F1124-W1128 HydrophobicContact CE1-CB 4.33Å; F1124-W1128 HydrophobicContact CZ-CE3 4.25Å; F1124-W1128 WeakPolarHBondContact O-CB 3.19Å; F1124-W1128 PolarHBondContact O-N 3.44Å; L1125-W1128 PolarHBondContact O-N 2.77Å; D1126-W1128 VanDerWaalsContact C-N 3.32Å; D1126-W1128 PolarHBondContact O-N 2.84Å; W1128-L1132 HydrophobicContact CE3-CB 4.37Å; W1128-L1132 HydrophobicContact CE3-CD1 3.95Å; W1128-V1133 HydrophobicContact CD2-CG2 4.13Å; W1128-V1133 HydrophobicContact CG-CG2 4.24Å; W1128-V1133 HydrophobicContact CZ2-CG2 4.19Å; W1128-V1133 VanDerWaalsContact O-CB 3.3Å; W1128-V1133 WeakPolarHBondContact O-CB 3.21Å; W1128-V1133 VanDerWaalsContact O-CG2 3.31Å; W1128-V1133 WeakPolarHBondContact O-CG2 3.25Å; W1128-V1133 PolarHBondContact O-N 2.82Å; W1128-L1166 HydrophobicContact CH2-CD1 3.96Å; W1128-L1166 HydrophobicContact CZ2-CD1 3.98Å; W1128-L1166 HydrophobicContact CZ2-CG 4.27Å; W1128-I1169 HydrophobicContact CH2-CD1 3.72Å; W1128-I1169 HydrophobicContact CZ2-CD1 4.48Å; W1128-I1169 HydrophobicContact CZ3-CD1 3.83Å; W1128-I1186 HydrophobicContact CZ2-CG2 4.38Å
1129	N	77.5	Confident	78.2	Confident	41 Å²	41	42.7 Å²	42.7	22%	0.219	22%	0.218	C	C	.	.	I	π-helix	trans	-72.7	-37.7	-172.7	-67.6	-58.9	0	0	0	113.2	L1125 P1134	L1125-N1129 WeakPolarHBondContact O-CB 3.41Å; L1125-N1129 PolarHBondContact O-N 2.98Å; L1125-N1129 PolarHBondContact O-ND2 2.75Å; N1129-P1134 VanDerWaalsContact O-CD 3.27Å; N1129-P1134 WeakPolarHBondContact O-CD 3.5Å
1130	N	78.1	Confident	77.3	Confident	111 Å²	111	40.5 Å²	40.5	59%	0.594	21%	0.206	S	C	*	.	I	π-helix	trans	-102.5	-17.9	-168.3	-49.6	-35.6	0	0	0	113.2	D1126	D1126-N1130 WeakPolarHBondContact O-CA 3.03Å; D1126-N1130 WeakPolarHBondContact O-CB 3.12Å; D1126-N1130 PolarHBondContact O-N 3.03Å; D1126-N1130 PolarHBondContact O-ND2 2.84Å; D1126-N1130 PolarHBondContact OD1-ND2 3.18Å
1131	M	78.2	Confident	75.9	Confident	50 Å²	50	46.3 Å²	46.3	25%	0.246	23%	0.231	C	C	.	.	I	π-helix	trans	-121.6	-59.9	178.8	-169.3	-167.2	75	0	0	113	T1109 L1127 I1135	T1109-M1131 HydrophobicContact CG2-CE 4.01Å; T1109-M1131 HydrophobicContact CG2-SD 3.83Å; L1127-M1131 HydrophobicContact CD1-CE 3.55Å; L1127-M1131 HydrophobicContact CD1-SD 4.39Å; L1127-M1131 HydrophobicContact CG-CE 4.25Å; L1127-M1131 WeakPolarHBondContact O-CB 3.39Å; L1127-M1131 PolarHBondContact O-N 3.21Å; M1131-I1135 HydrophobicContact CG-CD1 3.82Å; M1131-I1135 WeakPolarHBondContact O-CD1 2.99Å; M1131-I1135 VanDerWaalsContact O-CG1 3.25Å; M1131-I1135 WeakPolarHBondContact O-CG1 3.28Å; M1131-I1135 PolarHBondContact O-N 2.97Å; M1131-I1135 VanDerWaalsContact O-N 3.14Å
1132	L	79.7	Confident	74.5	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.25	C	C	.	.	I	π-helix	trans	-68	-50.1	-170.8	-64.3	172.3	0	0	0	112.5	F1085 L1089 F1105 L1127 W1128 I1135 L1136	F1085-L1132 HydrophobicContact CE1-CD1 3.93Å; F1085-L1132 HydrophobicContact CZ-CD1 3.84Å; L1089-L1132 HydrophobicContact CD1-CD1 3.92Å; L1089-L1132 HydrophobicContact CD1-CD2 3.8Å; F1105-L1132 HydrophobicContact CD1-CD2 3.41Å; F1105-L1132 VanDerWaalsContact CD1-CD2 3.41Å; F1105-L1132 HydrophobicContact CE1-CD2 3.59Å; F1105-L1132 HydrophobicContact CG-CD2 4.09Å; F1105-L1132 HydrophobicContact CZ-CD2 4.39Å; L1127-L1132 HydrophobicContact CD2-CD1 3.82Å; L1127-L1132 HydrophobicContact CG-CD1 3.88Å; L1127-L1132 HydrophobicContact CG-CG 4.17Å; L1127-L1132 PolarHBondContact O-N 3.19Å; W1128-L1132 HydrophobicContact CE3-CB 4.37Å; W1128-L1132 HydrophobicContact CE3-CD1 3.95Å; L1132-I1135 PolarHBondContact O-N 2.82Å; L1132-L1136 WeakPolarHBondContact O-CB 3.39Å; L1132-L1136 VanDerWaalsContact O-CG 3.26Å; L1132-L1136 WeakPolarHBondContact O-CG 3.37Å; L1132-L1136 PolarHBondContact O-N 3.34Å
1133	V	74.7	Confident	73.2	Confident	13 Å²	13	47.9 Å²	47.9	8%	0.079	24%	0.24	C	C	.	.	H	α-helix	trans	-59.9	-50.2	178.3	165.7	0	0	0	0	111.2	W1128 I1135 L1136 F1137 P1189 I1191	W1128-V1133 HydrophobicContact CD2-CG2 4.13Å; W1128-V1133 HydrophobicContact CG-CG2 4.24Å; W1128-V1133 HydrophobicContact CZ2-CG2 4.19Å; W1128-V1133 VanDerWaalsContact O-CB 3.3Å; W1128-V1133 WeakPolarHBondContact O-CB 3.21Å; W1128-V1133 VanDerWaalsContact O-CG2 3.31Å; W1128-V1133 WeakPolarHBondContact O-CG2 3.25Å; W1128-V1133 PolarHBondContact O-N 2.82Å; V1133-I1135 PolarHBondContact O-N 3.38Å; V1133-L1136 PolarHBondContact O-N 2.98Å; V1133-F1137 HydrophobicContact CG1-CD2 3.83Å; V1133-F1137 HydrophobicContact CG1-CE2 4.09Å; V1133-F1137 WeakPolarHBondContact O-CD2 3.35Å; V1133-F1137 PolarHBondContact O-N 2.97Å; V1133-P1189 HydrophobicContact CG1-CB 4.1Å; V1133-P1189 HydrophobicContact CG2-CB 4.44Å; V1133-I1191 HydrophobicContact CG1-CD1 4.27Å; V1133-I1191 HydrophobicContact CG1-CG1 4.47Å
1134	P	74.1	Confident	71.4	Confident	62 Å²	62	49.1 Å²	49.1	40%	0.403	25%	0.251	S	S	.	.	H	α-helix	trans	-56	-42.6	175.5	-30.7	38	0	0	0	114.6	N1129 K1138	N1129-P1134 VanDerWaalsContact O-CD 3.27Å; N1129-P1134 WeakPolarHBondContact O-CD 3.5Å; P1134-K1138 WeakPolarHBondContact O-CB 3.37Å; P1134-K1138 PolarHBondContact O-N 2.98Å
1135	I	70.1	Confident	69.8	Low	59 Å²	59	53.6 Å²	53.6	30%	0.303	28%	0.279	S	S	.	.	H	α-helix	trans	-65.9	-53.4	178.1	-67.5	167.7	0	0	0	110.5	F1105 M1131 L1132 V1133 F1137 K1138 D1139	F1105-I1135 HydrophobicContact CE1-CB 4.08Å; F1105-I1135 HydrophobicContact CE1-CD1 4.18Å; F1105-I1135 HydrophobicContact CE1-CG2 3.72Å; F1105-I1135 HydrophobicContact CZ-CB 4.49Å; F1105-I1135 HydrophobicContact CZ-CG2 3.9Å; M1131-I1135 HydrophobicContact CG-CD1 3.82Å; M1131-I1135 WeakPolarHBondContact O-CD1 2.99Å; M1131-I1135 VanDerWaalsContact O-CG1 3.25Å; M1131-I1135 WeakPolarHBondContact O-CG1 3.28Å; M1131-I1135 PolarHBondContact O-N 2.97Å; M1131-I1135 VanDerWaalsContact O-N 3.14Å; L1132-I1135 PolarHBondContact O-N 2.82Å; V1133-I1135 PolarHBondContact O-N 3.38Å; I1135-F1137 VanDerWaalsContact C-N 3.31Å; I1135-F1137 PolarHBondContact O-N 3.23Å; I1135-K1138 WeakPolarHBondContact O-CB 3.38Å; I1135-K1138 PolarHBondContact O-N 3.02Å; I1135-K1138 VanDerWaalsContact O-N 3.08Å; I1135-D1139 PolarHBondContact O-N 3.3Å
1136	L	70.9	Confident	68.3	Low	20 Å²	20	57.2 Å²	57.2	11%	0.105	31%	0.307	C	S	.	.	H	α-helix	trans	-55.9	-44.6	-179.3	-70.5	169.1	0	0	0	111.6	L1089 I1092 F1105 L1132 V1133 D1139 I1140 L1162	L1089-L1136 HydrophobicContact CD2-CD1 4.4Å; I1092-L1136 HydrophobicContact CD1-CD2 4.16Å; F1105-L1136 HydrophobicContact CE2-CD2 3.93Å; F1105-L1136 HydrophobicContact CZ-CD2 3.7Å; F1105-L1136 HydrophobicContact CZ-CG 3.92Å; L1132-L1136 WeakPolarHBondContact O-CB 3.39Å; L1132-L1136 VanDerWaalsContact O-CG 3.26Å; L1132-L1136 WeakPolarHBondContact O-CG 3.37Å; L1132-L1136 PolarHBondContact O-N 3.34Å; V1133-L1136 PolarHBondContact O-N 2.98Å; L1136-D1139 PolarHBondContact O-N 3.38Å; L1136-I1140 WeakPolarHBondContact O-CD1 3.25Å; L1136-I1140 WeakPolarHBondContact O-CG1 3.28Å; L1136-I1140 PolarHBondContact O-N 2.97Å; L1136-L1162 HydrophobicContact CD1-CD2 4.12Å; L1136-L1162 HydrophobicContact CD2-CD2 4.43Å
1137	F	67.7	Low	66.4	Low	82 Å²	82	56 Å²	56	36%	0.36	30%	0.303	S	S	.	.	H	α-helix	trans	-74.2	-28.7	178.1	-80.8	-89.5	0	0	0	114	V1133 I1135 I1140 K1141 I1191	V1133-F1137 HydrophobicContact CG1-CD2 3.83Å; V1133-F1137 HydrophobicContact CG1-CE2 4.09Å; V1133-F1137 WeakPolarHBondContact O-CD2 3.35Å; V1133-F1137 PolarHBondContact O-N 2.97Å; I1135-F1137 VanDerWaalsContact C-N 3.31Å; I1135-F1137 PolarHBondContact O-N 3.23Å; F1137-I1140 HydrophobicContact CD1-CD1 4.28Å; F1137-I1140 HydrophobicContact CG-CD1 4.45Å; F1137-K1141 WeakPolarHBondContact O-CB 3.3Å; F1137-K1141 PolarHBondContact O-N 2.8Å; F1137-I1191 HydrophobicContact CD1-CD1 4.13Å; F1137-I1191 HydrophobicContact CD2-CD1 3.91Å; F1137-I1191 HydrophobicContact CE1-CD1 3.87Å; F1137-I1191 HydrophobicContact CE2-CD1 3.64Å; F1137-I1191 HydrophobicContact CG-CD1 4.14Å; F1137-I1191 HydrophobicContact CZ-CD1 3.62Å
1138	K	65.9	Low	64	Low	104 Å²	104	62.8 Å²	62.8	45%	0.452	34%	0.336	S	S	.	.	H	α-helix	trans	-64	-44.1	171.4	-173.1	173.9	-176.7	175.4	0	110.7	L493 P1134 I1135 K1141 N1142	L493-K1138 PolarHBondContact O-NZ 3.46Å; P1134-K1138 WeakPolarHBondContact O-CB 3.37Å; P1134-K1138 PolarHBondContact O-N 2.98Å; I1135-K1138 WeakPolarHBondContact O-CB 3.38Å; I1135-K1138 PolarHBondContact O-N 3.02Å; I1135-K1138 VanDerWaalsContact O-N 3.08Å; K1138-K1141 WeakPolarHBondContact O-CB 3.35Å; K1138-K1141 PolarHBondContact O-N 2.88Å; K1138-N1142 PolarHBondContact O-N 3.5Å; K1138-N1142 PolarHBondContact O-ND2 2.94Å
1139	D	61.2	Low	62.1	Low	37 Å²	37	68.2 Å²	68.2	20%	0.198	37%	0.372	C	S	.	.	H	α-helix	trans	-72.5	-39.5	-179.5	-67.8	-24.6	0	0	0	112.8	I1135 L1136 K1141 N1142 I1143	I1135-D1139 PolarHBondContact O-N 3.3Å; L1136-D1139 PolarHBondContact O-N 3.38Å; D1139-K1141 VanDerWaalsContact C-N 3.29Å; D1139-K1141 PolarHBondContact O-N 2.82Å; D1139-N1142 PolarHBondContact O-N 2.8Å; D1139-I1143 WeakPolarHBondContact O-CG1 3.36Å; D1139-I1143 PolarHBondContact O-N 3.23Å
1140	I	61.3	Low	60.5	Low	17 Å²	17	72.2 Å²	72.2	9%	0.087	40%	0.398	C	S	.	.	H	α-helix	trans	-54.7	-47.6	168.7	-66.7	161.3	0	0	0	110.3	L1136 F1137 N1142 I1143 T1144 I1158 F1159 L1162	L1136-I1140 WeakPolarHBondContact O-CD1 3.25Å; L1136-I1140 WeakPolarHBondContact O-CG1 3.28Å; L1136-I1140 PolarHBondContact O-N 2.97Å; F1137-I1140 HydrophobicContact CD1-CD1 4.28Å; F1137-I1140 HydrophobicContact CG-CD1 4.45Å; I1140-N1142 PolarHBondContact O-N 2.91Å; I1140-I1143 PolarHBondContact O-N 3.47Å; I1140-T1144 WeakPolarHBondContact O-CG2 3.49Å; I1140-T1144 PolarHBondContact O-N 3.12Å; I1140-I1158 HydrophobicContact CD1-CG2 4.12Å; I1140-I1158 HydrophobicContact CG1-CG2 3.76Å; I1140-F1159 HydrophobicContact CG2-CZ 4.49Å; I1140-L1162 HydrophobicContact CD1-CD1 3.49Å; I1140-L1162 VanDerWaalsContact CD1-CD1 3.49Å; I1140-L1162 HydrophobicContact CG1-CD1 4.44Å
1141	K	57	Low	58.7	Low	121 Å²	121	73.7 Å²	73.7	53%	0.526	40%	0.399	S	S	.	.	H	α-helix	trans	-61.4	-46.1	179.8	-171.7	179.1	178.7	-176	0	111.1	F1137 K1138 D1139 I1143 T1144 T1145	F1137-K1141 WeakPolarHBondContact O-CB 3.3Å; F1137-K1141 PolarHBondContact O-N 2.8Å; K1138-K1141 WeakPolarHBondContact O-CB 3.35Å; K1138-K1141 PolarHBondContact O-N 2.88Å; D1139-K1141 VanDerWaalsContact C-N 3.29Å; D1139-K1141 PolarHBondContact O-N 2.82Å; K1141-I1143 VanDerWaalsContact C-N 3.3Å; K1141-I1143 PolarHBondContact O-N 3.42Å; K1141-T1144 WeakPolarHBondContact CA-OG1 3.16Å; K1141-T1144 PolarHBondContact O-N 2.64Å; K1141-T1144 PolarHBondContact O-OG1 3.12Å; K1141-T1145 PolarHBondContact O-N 3.41Å; K1141-T1145 PolarHBondContact O-OG1 3.01Å
1142	N	55.7	Low	56.9	Low	79 Å²	79	79.5 Å²	79.5	42%	0.422	42%	0.423	S	S	.	.	H	α-helix	trans	-58.5	-40.4	176.9	-68	-22.9	0	0	0	112.2	K1138 D1139 I1140 T1145 S1146	K1138-N1142 PolarHBondContact O-N 3.5Å; K1138-N1142 PolarHBondContact O-ND2 2.94Å; D1139-N1142 PolarHBondContact O-N 2.8Å; I1140-N1142 PolarHBondContact O-N 2.91Å; N1142-T1145 PolarHBondContact O-N 3.46Å; N1142-T1145 PolarHBondContact O-OG1 3.22Å; N1142-S1146 WeakPolarHBondContact O-CB 3.24Å; N1142-S1146 PolarHBondContact O-N 2.81Å
1143	I	54.7	Low	55.1	Low	31 Å²	31	86.4 Å²	86.4	16%	0.159	46%	0.455	C	S	.	.	H	α-helix	trans	-63.9	-42	174.4	-66.6	165.8	0	0	0	111	D1139 I1140 K1141 T1145 T1147 L1155 I1158	D1139-I1143 WeakPolarHBondContact O-CG1 3.36Å; D1139-I1143 PolarHBondContact O-N 3.23Å; I1140-I1143 PolarHBondContact O-N 3.47Å; K1141-I1143 VanDerWaalsContact C-N 3.3Å; K1141-I1143 PolarHBondContact O-N 3.42Å; I1143-T1145 VanDerWaalsContact C-N 3.31Å; I1143-T1145 PolarHBondContact O-N 2.84Å; I1143-T1147 PolarHBondContact O-N 2.81Å; I1143-T1147 PolarHBondContact O-OG1 3.01Å; I1143-L1155 HydrophobicContact CG2-CD2 4.2Å; I1143-I1158 HydrophobicContact CD1-CD1 3.93Å; I1143-I1158 HydrophobicContact CG2-CD1 4.26Å
1144	T	51.4	Low	54.3	Low	65 Å²	65	87.7 Å²	87.7	40%	0.399	46%	0.464	S	S	.	.	H	α-helix	trans	-66.2	-26.6	177.3	63.4	0	0	0	0	114.6	I1140 K1141 L1155	I1140-T1144 WeakPolarHBondContact O-CG2 3.49Å; I1140-T1144 PolarHBondContact O-N 3.12Å; K1141-T1144 WeakPolarHBondContact CA-OG1 3.16Å; K1141-T1144 PolarHBondContact O-N 2.64Å; K1141-T1144 PolarHBondContact O-OG1 3.12Å; T1144-L1155 HydrophobicContact CG2-CD1 3.85Å; T1144-L1155 HydrophobicContact CG2-CD2 3.49Å; T1144-L1155 VanDerWaalsContact CG2-CD2 3.49Å; T1144-L1155 HydrophobicContact CG2-CG 4.33Å
1145	T	52.9	Low	53.3	Low	95 Å²	95	86.9 Å²	86.9	58%	0.583	46%	0.456	S	S	*	.	H	α-helix	trans	-100	-26.5	-177	54.1	0	0	0	0	114	K1141 N1142 I1143	K1141-T1145 PolarHBondContact O-N 3.41Å; K1141-T1145 PolarHBondContact O-OG1 3.01Å; N1142-T1145 PolarHBondContact O-N 3.46Å; N1142-T1145 PolarHBondContact O-OG1 3.22Å; I1143-T1145 VanDerWaalsContact C-N 3.31Å; I1143-T1145 PolarHBondContact O-N 2.84Å
1146	S	52.7	Low	52.7	Low	103 Å²	103	89.8 Å²	89.8	72%	0.72	47%	0.472	S	S	*	.	H	α-helix	trans	-82.5	-33.2	179.7	-176.1	0	0	0	0	112.6	N1142	N1142-S1146 WeakPolarHBondContact O-CB 3.24Å; N1142-S1146 PolarHBondContact O-N 2.81Å
1147	T	42.1	Very low	52.2	Low	70 Å²	70	91.6 Å²	91.6	43%	0.429	49%	0.486	S	S	.	.	S	Bend	trans	-82.4	128.5	-179.3	57.4	0	0	0	0	112.1	I1143	I1143-T1147 PolarHBondContact O-N 2.81Å; I1143-T1147 PolarHBondContact O-OG1 3.01Å
1148	M	35.8	Very low	52	Low	153 Å²	153	87.9 Å²	87.9	75%	0.754	47%	0.47	S	S	*	.			trans	-54.2	144.9	170.8	-76.8	-72.7	156.9	0	0	110.5	T1150	M1148-T1150 PolarHBondContact O-N 2.9Å
1149	P	42.4	Very low	52	Low	119 Å²	119	87.2 Å²	87.2	77%	0.773	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	20	-160.4	29	-37.7	0	0	0	116
1150	T	44.3	Very low	52.4	Low	125 Å²	125	92.1 Å²	92.1	77%	0.767	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	-5	-170.7	53.6	0	0	0	0	114.7	M1148	M1148-T1150 PolarHBondContact O-N 2.9Å
1151	K	39.8	Very low	52.7	Low	142 Å²	142	93.2 Å²	93.2	62%	0.617	50%	0.495	S	S	*	.			trans	-127	103.4	171.1	-70.4	-166.9	176.3	-170.7	0	112.1	P1154	K1151-P1154 WeakPolarHBondContact O-CD 3.13Å
1152	K	39.6	Very low	53.3	Low	173 Å²	173	88.2 Å²	88.2	75%	0.752	47%	0.474	S	S	*	.			trans	-82.6	-13.2	171.9	-68.9	-175.6	176.7	-179.4	0	113.8
1153	E	43.3	Very low	54.2	Low	145 Å²	145	89.5 Å²	89.5	68%	0.678	48%	0.48	S	S	*	.	H	α-helix	trans	-59.9	-46	-175.1	-59.9	176.3	139.2	0	0	115.3	L1155 N1156 S1157	E1153-L1155 VanDerWaalsContact C-N 3.29Å; E1153-L1155 PolarHBondContact O-N 2.85Å; E1153-N1156 PolarHBondContact O-N 3.11Å; E1153-S1157 PolarHBondContact O-N 3.28Å
1154	P	56.5	Low	55.2	Low	40 Å²	40	92.6 Å²	92.6	26%	0.26	50%	0.497	S	S	.	.	H	α-helix	trans	-66.2	-30.5	-173.8	25.4	-34.4	0	0	0	113	K1151 S1157 I1158	K1151-P1154 WeakPolarHBondContact O-CD 3.13Å; P1154-S1157 WeakPolarHBondContact CA-OG 3.36Å; P1154-S1157 PolarHBondContact O-N 3.11Å; P1154-S1157 PolarHBondContact O-OG 2.85Å; P1154-I1158 VanDerWaalsContact O-CG1 3.23Å; P1154-I1158 WeakPolarHBondContact O-CG1 3.25Å; P1154-I1158 PolarHBondContact O-N 3.24Å
1155	L	53.6	Low	56.5	Low	44 Å²	44	90.1 Å²	90.1	23%	0.23	48%	0.482	C	S	.	.	H	α-helix	trans	-65.9	-41.4	178.6	-57.1	179.3	0	0	0	111.4	I1143 T1144 E1153 S1157 I1158 F1159	I1143-L1155 HydrophobicContact CG2-CD2 4.2Å; T1144-L1155 HydrophobicContact CG2-CD1 3.85Å; T1144-L1155 HydrophobicContact CG2-CD2 3.49Å; T1144-L1155 VanDerWaalsContact CG2-CD2 3.49Å; T1144-L1155 HydrophobicContact CG2-CG 4.33Å; E1153-L1155 VanDerWaalsContact C-N 3.29Å; E1153-L1155 PolarHBondContact O-N 2.85Å; L1155-S1157 VanDerWaalsContact C-N 3.33Å; L1155-S1157 PolarHBondContact O-N 2.93Å; L1155-I1158 HydrophobicContact CD2-CD1 4.26Å; L1155-I1158 PolarHBondContact O-N 2.91Å; L1155-F1159 VanDerWaalsContact O-CD2 3.3Å; L1155-F1159 WeakPolarHBondContact O-CD2 3.47Å; L1155-F1159 PolarHBondContact O-N 3.04Å
1156	N	58.1	Low	57.7	Low	121 Å²	121	87.8 Å²	87.8	65%	0.647	47%	0.465	S	S	*	.	H	α-helix	trans	-66.4	-33.5	176.5	-80.7	-6.9	0	0	0	112.2	E1153 K1160	E1153-N1156 PolarHBondContact O-N 3.11Å; N1156-K1160 WeakPolarHBondContact O-CB 3.5Å; N1156-K1160 PolarHBondContact O-N 3.27Å
1157	S	60.8	Low	58.8	Low	57 Å²	57	84 Å²	84	40%	0.399	44%	0.443	S	S	.	.	H	α-helix	trans	-68.7	-42	170.8	44.8	0	0	0	0	112.2	E1153 P1154 L1155 K1160 T1161	E1153-S1157 PolarHBondContact O-N 3.28Å; P1154-S1157 WeakPolarHBondContact CA-OG 3.36Å; P1154-S1157 PolarHBondContact O-N 3.11Å; P1154-S1157 PolarHBondContact O-OG 2.85Å; L1155-S1157 VanDerWaalsContact C-N 3.33Å; L1155-S1157 PolarHBondContact O-N 2.93Å; S1157-K1160 PolarHBondContact O-N 3.26Å; S1157-T1161 PolarHBondContact O-N 3.44Å; S1157-T1161 PolarHBondContact O-OG1 3.1Å; S1157-T1161 VanDerWaalsContact O-OG1 3.12Å
1158	I	62	Low	60.8	Low	4 Å²	4	83.5 Å²	83.5	2%	0.021	43%	0.433	C	S	.	.	H	α-helix	trans	-60.9	-52.3	177.7	-60.8	159.6	0	0	0	110.9	L1096 I1140 I1143 P1154 L1155 K1160 T1161 L1162	L1096-I1158 HydrophobicContact CD1-CD1 4.32Å; L1096-I1158 HydrophobicContact CD1-CG1 3.66Å; L1096-I1158 HydrophobicContact CD1-CG2 4.34Å; L1096-I1158 HydrophobicContact CD2-CD1 4.1Å; L1096-I1158 HydrophobicContact CD2-CG1 3.31Å; L1096-I1158 HydrophobicContact CG-CG1 4.09Å; I1140-I1158 HydrophobicContact CD1-CG2 4.12Å; I1140-I1158 HydrophobicContact CG1-CG2 3.76Å; I1143-I1158 HydrophobicContact CD1-CD1 3.93Å; I1143-I1158 HydrophobicContact CG2-CD1 4.26Å; P1154-I1158 VanDerWaalsContact O-CG1 3.23Å; P1154-I1158 WeakPolarHBondContact O-CG1 3.25Å; P1154-I1158 PolarHBondContact O-N 3.24Å; L1155-I1158 HydrophobicContact CD2-CD1 4.26Å; L1155-I1158 PolarHBondContact O-N 2.91Å; I1158-K1160 PolarHBondContact O-N 2.96Å; I1158-T1161 PolarHBondContact O-N 2.97Å; I1158-L1162 HydrophobicContact CG2-CD1 3.65Å; I1158-L1162 HydrophobicContact CG2-CG 4.35Å; I1158-L1162 WeakPolarHBondContact O-CB 3.32Å; I1158-L1162 WeakPolarHBondContact O-CG 3.42Å; I1158-L1162 PolarHBondContact O-N 3.33Å
1159	F	66.9	Low	63.1	Low	90 Å²	90	76.2 Å²	76.2	40%	0.395	40%	0.397	S	S	.	.	H	α-helix	trans	-62.1	-33	177.7	-80.2	-68	0	0	0	112.1	I1140 L1155 N1163	I1140-F1159 HydrophobicContact CG2-CZ 4.49Å; L1155-F1159 VanDerWaalsContact O-CD2 3.3Å; L1155-F1159 WeakPolarHBondContact O-CD2 3.47Å; L1155-F1159 PolarHBondContact O-N 3.04Å; F1159-N1163 WeakPolarHBondContact O-CB 3.1Å; F1159-N1163 PolarHBondContact O-N 2.91Å; F1159-N1163 PolarHBondContact O-ND2 2.68Å
1160	K	68.5	Low	64.7	Low	140 Å²	140	73.5 Å²	73.5	61%	0.609	38%	0.378	S	S	*	.	H	α-helix	trans	-68	-45.5	173.4	-171.3	179.9	-179.9	-171.9	0	112.1	N1156 S1157 I1158 N1163 N1164	N1156-K1160 WeakPolarHBondContact O-CB 3.5Å; N1156-K1160 PolarHBondContact O-N 3.27Å; S1157-K1160 PolarHBondContact O-N 3.26Å; I1158-K1160 PolarHBondContact O-N 2.96Å; K1160-N1163 PolarHBondContact O-N 2.61Å; K1160-N1164 WeakPolarHBondContact O-CB 3.21Å; K1160-N1164 PolarHBondContact O-N 3.02Å; K1160-N1164 PolarHBondContact O-OD1 3.37Å
1161	T	68.5	Low	66.4	Low	41 Å²	41	74.4 Å²	74.4	25%	0.252	38%	0.377	S	S	.	.	H	α-helix	trans	-65.7	-39.6	178.3	-55.3	0	0	0	0	111.5	I1092 S1157 I1158 N1164 I1165	I1092-T1161 HydrophobicContact CB-CG2 4.46Å; I1092-T1161 HydrophobicContact CG1-CG2 4.35Å; I1092-T1161 HydrophobicContact CG2-CG2 3.85Å; S1157-T1161 PolarHBondContact O-N 3.44Å; S1157-T1161 PolarHBondContact O-OG1 3.1Å; S1157-T1161 VanDerWaalsContact O-OG1 3.12Å; I1158-T1161 PolarHBondContact O-N 2.97Å; T1161-N1164 WeakPolarHBondContact O-CB 3.36Å; T1161-N1164 PolarHBondContact O-N 3.1Å; T1161-I1165 HydrophobicContact CG2-CD1 4.21Å; T1161-I1165 WeakPolarHBondContact O-CG1 3.4Å; T1161-I1165 PolarHBondContact O-N 2.99Å
1162	L	70.6	Confident	68.4	Low	16 Å²	16	69.7 Å²	69.7	8%	0.084	36%	0.36	C	S	.	.	H	α-helix	trans	-64.9	-45.1	173.1	-71.6	165.7	0	0	0	111.9	I1092 L1136 I1140 I1158 N1164 I1165 L1166	I1092-L1162 HydrophobicContact CD1-CD2 3.89Å; L1136-L1162 HydrophobicContact CD1-CD2 4.12Å; L1136-L1162 HydrophobicContact CD2-CD2 4.43Å; I1140-L1162 HydrophobicContact CD1-CD1 3.49Å; I1140-L1162 VanDerWaalsContact CD1-CD1 3.49Å; I1140-L1162 HydrophobicContact CG1-CD1 4.44Å; I1158-L1162 HydrophobicContact CG2-CD1 3.65Å; I1158-L1162 HydrophobicContact CG2-CG 4.35Å; I1158-L1162 WeakPolarHBondContact O-CB 3.32Å; I1158-L1162 WeakPolarHBondContact O-CG 3.42Å; I1158-L1162 PolarHBondContact O-N 3.33Å; L1162-N1164 VanDerWaalsContact C-N 3.3Å; L1162-N1164 PolarHBondContact O-N 3.11Å; L1162-I1165 PolarHBondContact O-N 2.88Å; L1162-I1165 VanDerWaalsContact O-N 3.14Å; L1162-L1166 WeakPolarHBondContact O-CD1 3.45Å; L1162-L1166 PolarHBondContact O-N 2.74Å
1163	N	73.3	Confident	70.3	Confident	105 Å²	105	62.6 Å²	62.6	56%	0.561	33%	0.329	S	S	*	.	H	α-helix	trans	-64.8	-33.1	175.2	-74.3	-32.2	0	0	0	112.5	F1159 K1160 G1167	F1159-N1163 WeakPolarHBondContact O-CB 3.1Å; F1159-N1163 PolarHBondContact O-N 2.91Å; F1159-N1163 PolarHBondContact O-ND2 2.68Å; K1160-N1163 PolarHBondContact O-N 2.61Å; N1163-G1167 PolarHBondContact O-N 2.76Å
1164	N	75.7	Confident	72.1	Confident	97 Å²	97	55.9 Å²	55.9	52%	0.519	30%	0.298	S	S	.	.	H	α-helix	trans	-63.9	-42.3	171.3	-71.9	-4.2	0	0	0	111.1	K1160 T1161 L1162 G1167 W1168	K1160-N1164 WeakPolarHBondContact O-CB 3.21Å; K1160-N1164 PolarHBondContact O-N 3.02Å; K1160-N1164 PolarHBondContact O-OD1 3.37Å; T1161-N1164 WeakPolarHBondContact O-CB 3.36Å; T1161-N1164 PolarHBondContact O-N 3.1Å; L1162-N1164 VanDerWaalsContact C-N 3.3Å; L1162-N1164 PolarHBondContact O-N 3.11Å; N1164-G1167 PolarHBondContact O-N 3Å; N1164-W1168 WeakPolarHBondContact O-CB 3.13Å; N1164-W1168 PolarHBondContact O-N 3.07Å
1165	I	79	Confident	73.2	Confident	13 Å²	13	54.5 Å²	54.5	7%	0.067	29%	0.287	C	S	.	.	H	α-helix	trans	-73	-43.1	180	-75.1	169.9	0	0	0	111.6	Q1088 I1092 T1161 L1162 G1167 W1168 I1169	Q1088-I1165 HydrophobicContact CB-CD1 4.32Å; I1092-I1165 HydrophobicContact CD1-CD1 3.47Å; I1092-I1165 VanDerWaalsContact CD1-CD1 3.47Å; I1092-I1165 HydrophobicContact CG1-CD1 3.46Å; I1092-I1165 VanDerWaalsContact CG1-CD1 3.46Å; T1161-I1165 HydrophobicContact CG2-CD1 4.21Å; T1161-I1165 WeakPolarHBondContact O-CG1 3.4Å; T1161-I1165 PolarHBondContact O-N 2.99Å; L1162-I1165 PolarHBondContact O-N 2.88Å; L1162-I1165 VanDerWaalsContact O-N 3.14Å; I1165-G1167 VanDerWaalsContact C-N 3.26Å; I1165-G1167 PolarHBondContact O-N 2.81Å; I1165-W1168 PolarHBondContact O-N 2.87Å; I1165-I1169 HydrophobicContact CG2-CD1 3.88Å; I1165-I1169 HydrophobicContact CG2-CG1 4.4Å; I1165-I1169 WeakPolarHBondContact O-CB 3.45Å; I1165-I1169 WeakPolarHBondContact O-CG1 3.34Å; I1165-I1169 PolarHBondContact O-N 3.07Å
1166	L	78.3	Confident	73.8	Confident	45 Å²	45	55.2 Å²	55.2	24%	0.236	29%	0.291	C	S	.	.	H	α-helix	trans	-60.1	-39.5	170.5	-87.7	76.2	0	0	0	110.9	W1128 L1162 I1169 T1170	W1128-L1166 HydrophobicContact CH2-CD1 3.96Å; W1128-L1166 HydrophobicContact CZ2-CD1 3.98Å; W1128-L1166 HydrophobicContact CZ2-CG 4.27Å; L1162-L1166 WeakPolarHBondContact O-CD1 3.45Å; L1162-L1166 PolarHBondContact O-N 2.74Å; L1166-I1169 PolarHBondContact O-N 2.92Å; L1166-T1170 WeakPolarHBondContact O-CG2 3.41Å; L1166-T1170 PolarHBondContact O-N 3.27Å; L1166-T1170 PolarHBondContact O-OG1 3.47Å
1167	G	76.4	Confident	73.7	Confident	24 Å²	24	53.8 Å²	53.8	25%	0.247	29%	0.288	C	S	.	.	H	α-helix	trans	-59.1	-49.7	171.8	0	0	0	0	0	112.4	N1163 N1164 I1165 T1170 I1171	N1163-G1167 PolarHBondContact O-N 2.76Å; N1164-G1167 PolarHBondContact O-N 3Å; I1165-G1167 VanDerWaalsContact C-N 3.26Å; I1165-G1167 PolarHBondContact O-N 2.81Å; G1167-T1170 WeakPolarHBondContact CA-OG1 3.25Å; G1167-T1170 PolarHBondContact O-N 2.84Å; G1167-T1170 PolarHBondContact O-OG1 3.18Å; G1167-I1171 WeakPolarHBondContact O-CD1 3.24Å; G1167-I1171 VanDerWaalsContact O-CG1 3.28Å; G1167-I1171 WeakPolarHBondContact O-CG1 3.35Å; G1167-I1171 PolarHBondContact O-N 2.68Å; G1167-I1171 VanDerWaalsContact O-N 3.14Å
1168	W	83.9	Confident	73.3	Confident	59 Å²	59	56.8 Å²	56.8	22%	0.223	31%	0.305	C	S	.	.	H	α-helix	trans	-58.2	-50.3	175.8	-177.4	91.5	0	0	0	111.2	W1081 E1084 F1085 Q1088 N1164 I1165 T1170 I1171 T1172	W1081-W1168 AromaticContact CD1-CH2 3.53Å; W1081-W1168 HydrophobicContact CD2-CH2 4.29Å; W1081-W1168 HydrophobicContact CD2-CZ3 4.39Å; W1081-W1168 AromaticContact CE2-CH2 3.79Å; W1081-W1168 AromaticContact CE2-CZ3 3.55Å; W1081-W1168 HydrophobicContact CG-CH2 4.15Å; W1081-W1168 HydrophobicContact CZ2-CH2 4.47Å; W1081-W1168 AromaticContact CZ2-CZ3 3.79Å; W1081-W1168 HydrophobicContact CZ2-CZ3 3.79Å; W1081-W1168 AromaticContact NE1-CH2 3.27Å; W1081-W1168 VanDerWaalsContact NE1-CH2 3.27Å; W1081-W1168 AromaticContact NE1-CZ3 3.32Å; W1081-W1168 VanDerWaalsContact NE1-CZ3 3.32Å; E1084-W1168 HydrophobicContact CB-CH2 4.01Å; E1084-W1168 HydrophobicContact CB-CZ2 3.99Å; F1085-W1168 HydrophobicContact CB-CH2 4.25Å; F1085-W1168 HydrophobicContact CB-CZ3 3.99Å; F1085-W1168 HydrophobicContact CD2-CZ3 4.27Å; Q1088-W1168 VanDerWaalsContact NE2-CZ2 3.34Å; Q1088-W1168 VanDerWaalsContact OE1-CD2 3.28Å; N1164-W1168 WeakPolarHBondContact O-CB 3.13Å; N1164-W1168 PolarHBondContact O-N 3.07Å; I1165-W1168 PolarHBondContact O-N 2.87Å; W1168-T1170 VanDerWaalsContact C-N 3.26Å; W1168-T1170 PolarHBondContact O-N 2.89Å; W1168-I1171 CarbonylContact O-C 3.38Å; W1168-I1171 WeakPolarHBondContact O-CA 3.4Å; W1168-I1171 PolarHBondContact O-N 3.07Å; W1168-T1172 HydrophobicContact CD2-CG2 4.11Å; W1168-T1172 VanDerWaalsContact CD2-OG1 3.29Å; W1168-T1172 HydrophobicContact CG-CG2 4.24Å; W1168-T1172 HydrophobicContact CZ2-CG2 4.1Å; W1168-T1172 WeakPolarHBondContact CZ2-OG1 3.34Å; W1168-T1172 WeakPolarHBondContact CZ3-OG1 3.26Å; W1168-T1172 PolarHBondContact O-N 2.97Å; W1168-T1172 PolarHBondContact O-OG1 3.16Å
1169	I	83.1	Confident	72.8	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-54.8	-40	175.6	-65.3	163.7	0	0	0	111.5	W1081 F1085 W1128 I1165 L1166 I1171 W1173 F1182 I1186	W1081-I1169 HydrophobicContact CZ2-CB 4.49Å; W1081-I1169 HydrophobicContact CZ2-CG1 4.18Å; W1081-I1169 HydrophobicContact CZ2-CG2 4.22Å; F1085-I1169 HydrophobicContact CD2-CD1 4.25Å; F1085-I1169 HydrophobicContact CD2-CG1 4.22Å; F1085-I1169 HydrophobicContact CE2-CD1 3.71Å; F1085-I1169 HydrophobicContact CE2-CG1 4.18Å; W1128-I1169 HydrophobicContact CH2-CD1 3.72Å; W1128-I1169 HydrophobicContact CZ2-CD1 4.48Å; W1128-I1169 HydrophobicContact CZ3-CD1 3.83Å; I1165-I1169 HydrophobicContact CG2-CD1 3.88Å; I1165-I1169 HydrophobicContact CG2-CG1 4.4Å; I1165-I1169 WeakPolarHBondContact O-CB 3.45Å; I1165-I1169 WeakPolarHBondContact O-CG1 3.34Å; I1165-I1169 PolarHBondContact O-N 3.07Å; L1166-I1169 PolarHBondContact O-N 2.92Å; I1169-I1171 VanDerWaalsContact C-N 3.28Å; I1169-I1171 PolarHBondContact O-N 2.96Å; I1169-W1173 HydrophobicContact CG2-CE3 3.8Å; I1169-W1173 HydrophobicContact CG2-CZ3 3.86Å; I1169-W1173 WeakPolarHBondContact O-CB 3.45Å; I1169-W1173 PolarHBondContact O-N 3.16Å; I1169-F1182 HydrophobicContact CG2-CE2 4.14Å; I1169-F1182 HydrophobicContact CG2-CZ 4.19Å; I1169-I1186 HydrophobicContact CG2-CG2 4.43Å
1170	T	77.1	Confident	72.3	Confident	62 Å²	62	58.5 Å²	58.5	38%	0.38	32%	0.317	S	S	.	.	H	α-helix	trans	-72.8	-15.5	176.4	56	0	0	0	0	114.8	L1166 G1167 W1168 F1182	L1166-T1170 WeakPolarHBondContact O-CG2 3.41Å; L1166-T1170 PolarHBondContact O-N 3.27Å; L1166-T1170 PolarHBondContact O-OG1 3.47Å; G1167-T1170 WeakPolarHBondContact CA-OG1 3.25Å; G1167-T1170 PolarHBondContact O-N 2.84Å; G1167-T1170 PolarHBondContact O-OG1 3.18Å; W1168-T1170 VanDerWaalsContact C-N 3.26Å; W1168-T1170 PolarHBondContact O-N 2.89Å; T1170-F1182 HydrophobicContact CG2-CE1 3.81Å; T1170-F1182 HydrophobicContact CG2-CE2 3.83Å; T1170-F1182 HydrophobicContact CG2-CZ 3.41Å; T1170-F1182 VanDerWaalsContact CG2-CZ 3.41Å
1171	I	80.3	Confident	71.8	Confident	144 Å²	144	58.8 Å²	58.8	74%	0.738	33%	0.326	S	S	*	.	H	α-helix	trans	-100.9	-36.9	-178.9	-68.4	165.4	0	0	0	111.4	G1167 W1168 I1169	G1167-I1171 WeakPolarHBondContact O-CD1 3.24Å; G1167-I1171 VanDerWaalsContact O-CG1 3.28Å; G1167-I1171 WeakPolarHBondContact O-CG1 3.35Å; G1167-I1171 PolarHBondContact O-N 2.68Å; G1167-I1171 VanDerWaalsContact O-N 3.14Å; W1168-I1171 CarbonylContact O-C 3.38Å; W1168-I1171 WeakPolarHBondContact O-CA 3.4Å; W1168-I1171 PolarHBondContact O-N 3.07Å; I1169-I1171 VanDerWaalsContact C-N 3.28Å; I1169-I1171 PolarHBondContact O-N 2.96Å
1172	T	81.1	Confident	71.4	Confident	42 Å²	42	58.7 Å²	58.7	26%	0.258	32%	0.322	S	S	.	.	H	α-helix	trans	-102.6	7.9	-173.7	61.5	0	0	0	0	114	W1081 W1168 P1174	W1081-T1172 PolarHBondContact NE1-O 3.01Å; W1081-T1172 VanDerWaalsContact NE1-O 3.15Å; W1081-T1172 PolarHBondContact NE1-OG1 2.94Å; W1168-T1172 HydrophobicContact CD2-CG2 4.11Å; W1168-T1172 VanDerWaalsContact CD2-OG1 3.29Å; W1168-T1172 HydrophobicContact CG-CG2 4.24Å; W1168-T1172 HydrophobicContact CZ2-CG2 4.1Å; W1168-T1172 WeakPolarHBondContact CZ2-OG1 3.34Å; W1168-T1172 WeakPolarHBondContact CZ3-OG1 3.26Å; W1168-T1172 PolarHBondContact O-N 2.97Å; W1168-T1172 PolarHBondContact O-OG1 3.16Å; T1172-P1174 VanDerWaalsContact O-N 3.16Å
1173	W	80.7	Confident	71	Confident	24 Å²	24	58.9 Å²	58.9	9%	0.091	32%	0.324	C	S	.	.			trans	-43.1	113.8	-176.6	-167.7	-111.8	0	0	0	112.7	L1121 F1124 I1169 W1175 F1182 P1183 I1186	L1121-W1173 HydrophobicContact CD1-CH2 4.23Å; L1121-W1173 HydrophobicContact CD1-CZ2 3.67Å; F1124-W1173 HydrophobicContact CD1-CH2 4.3Å; F1124-W1173 HydrophobicContact CD1-CZ3 4.46Å; F1124-W1173 HydrophobicContact CE1-CH2 4.34Å; F1124-W1173 HydrophobicContact CE1-CZ3 4.1Å; I1169-W1173 HydrophobicContact CG2-CE3 3.8Å; I1169-W1173 HydrophobicContact CG2-CZ3 3.86Å; I1169-W1173 WeakPolarHBondContact O-CB 3.45Å; I1169-W1173 PolarHBondContact O-N 3.16Å; W1173-W1175 AromaticContact CD2-CE3 3.85Å; W1173-W1175 HydrophobicContact CD2-CE3 3.85Å; W1173-W1175 HydrophobicContact CD2-CZ3 4.32Å; W1173-W1175 AromaticContact CE2-CE3 3.56Å; W1173-W1175 AromaticContact CE3-CE3 4Å; W1173-W1175 HydrophobicContact CE3-CE3 4Å; W1173-W1175 AromaticContact CE3-CZ3 3.99Å; W1173-W1175 HydrophobicContact CE3-CZ3 3.99Å; W1173-W1175 AromaticContact CH2-CE3 3.59Å; W1173-W1175 HydrophobicContact CH2-CE3 3.59Å; W1173-W1175 AromaticContact CH2-CZ3 3.52Å; W1173-W1175 HydrophobicContact CH2-CZ3 3.52Å; W1173-W1175 HydrophobicContact CZ2-CD2 4.28Å; W1173-W1175 AromaticContact CZ2-CE3 3.44Å; W1173-W1175 HydrophobicContact CZ2-CE3 3.44Å; W1173-W1175 VanDerWaalsContact CZ2-CE3 3.44Å; W1173-W1175 AromaticContact CZ2-CZ3 3.9Å; W1173-W1175 HydrophobicContact CZ2-CZ3 3.9Å; W1173-W1175 AromaticContact CZ3-CE3 3.88Å; W1173-W1175 HydrophobicContact CZ3-CE3 3.88Å; W1173-W1175 AromaticContact CZ3-CZ3 3.57Å; W1173-W1175 HydrophobicContact CZ3-CZ3 3.57Å; W1173-F1182 HydrophobicContact CB-CD2 4.47Å; W1173-F1182 AromaticContact CD2-CD2 3.67Å; W1173-F1182 HydrophobicContact CD2-CD2 3.67Å; W1173-F1182 AromaticContact CD2-CE2 3.74Å; W1173-F1182 HydrophobicContact CD2-CE2 3.74Å; W1173-F1182 AromaticContact CE2-CD2 3.97Å; W1173-F1182 AromaticContact CE3-CD2 3.98Å; W1173-F1182 HydrophobicContact CE3-CD2 3.98Å; W1173-F1182 AromaticContact CE3-CE2 3.53Å; W1173-F1182 HydrophobicContact CE3-CE2 3.53Å; W1173-F1182 AromaticContact CG-CD2 3.91Å; W1173-F1182 HydrophobicContact CG-CD2 3.91Å; W1173-F1182 HydrophobicContact CG-CE2 4.25Å; W1173-F1182 AromaticContact CZ3-CE2 3.99Å; W1173-F1182 HydrophobicContact CZ3-CE2 3.99Å; W1173-P1183 HydrophobicContact CZ2-CG 4.22Å; W1173-I1186 HydrophobicContact CH2-CD1 3.37Å; W1173-I1186 HydrophobicContact CZ2-CD1 4.34Å; W1173-I1186 HydrophobicContact CZ3-CD1 3.61Å
1174	P	79.4	Confident	70.4	Confident	5 Å²	5	62.6 Å²	62.6	3%	0.032	34%	0.335	C	S	.	.			trans	-83.8	-20.5	-167.6	33.1	-38	0	0	0	113.5	Q1077 L1078 W1081 T1172	Q1077-P1174 HydrophobicContact CG-CB 4.45Å; L1078-P1174 HydrophobicContact CD1-CG 4.42Å; W1081-P1174 HydrophobicContact CB-CB 3.93Å; W1081-P1174 HydrophobicContact CB-CG 4.04Å; W1081-P1174 HydrophobicContact CD2-CB 4.38Å; W1081-P1174 HydrophobicContact CD2-CG 3.58Å; W1081-P1174 HydrophobicContact CE3-CG 3.77Å; W1081-P1174 HydrophobicContact CG-CB 3.95Å; W1081-P1174 HydrophobicContact CG-CG 3.69Å; W1081-P1174 HydrophobicContact CZ3-CG 4.42Å; T1172-P1174 VanDerWaalsContact O-N 3.16Å
1175	W	80.3	Confident	69.6	Low	11 Å²	11	59.4 Å²	59.4	4%	0.042	32%	0.321	C	S	.	.	S	Bend	trans	-77.6	127.3	173.7	-59.9	-86.8	0	0	0	109.5	L1078 W1081 S1117 S1120 L1121 F1124 W1173 P1177 V1180	L1078-W1175 HydrophobicContact CD1-CD2 4.25Å; L1078-W1175 VanDerWaalsContact CD1-CE2 3.42Å; L1078-W1175 HydrophobicContact CD1-CH2 4.42Å; L1078-W1175 HydrophobicContact CD1-CZ2 3.54Å; L1078-W1175 VanDerWaalsContact CD1-NE1 3.33Å; W1081-W1175 HydrophobicContact CH2-CZ3 4.23Å; W1081-W1175 HydrophobicContact CZ3-CH2 4.02Å; W1081-W1175 HydrophobicContact CZ3-CZ3 4.06Å; S1117-W1175 VanDerWaalsContact O-CD1 3.24Å; S1117-W1175 PolarHBondContact O-NE1 2.71Å; S1117-W1175 VanDerWaalsContact O-NE1 3.09Å; S1120-W1175 PolarHBondContact OG-NE1 2.77Å; L1121-W1175 HydrophobicContact CB-CD2 4.41Å; L1121-W1175 HydrophobicContact CB-CG 4.37Å; L1121-W1175 HydrophobicContact CD1-CD2 3.98Å; L1121-W1175 HydrophobicContact CD1-CE3 4.27Å; L1121-W1175 HydrophobicContact CD1-CG 4.15Å; F1124-W1175 HydrophobicContact CB-CH2 3.65Å; F1124-W1175 HydrophobicContact CB-CZ2 3.94Å; F1124-W1175 AromaticContact CD1-CH2 3.87Å; F1124-W1175 HydrophobicContact CD1-CH2 3.87Å; F1124-W1175 HydrophobicContact CD1-CZ3 4.17Å; F1124-W1175 HydrophobicContact CD2-CH2 4.01Å; F1124-W1175 AromaticContact CG-CH2 3.55Å; F1124-W1175 HydrophobicContact CG-CH2 3.55Å; F1124-W1175 HydrophobicContact CG-CZ2 4.34Å; F1124-W1175 HydrophobicContact CG-CZ3 4.29Å; W1173-W1175 AromaticContact CD2-CE3 3.85Å; W1173-W1175 HydrophobicContact CD2-CE3 3.85Å; W1173-W1175 HydrophobicContact CD2-CZ3 4.32Å; W1173-W1175 AromaticContact CE2-CE3 3.56Å; W1173-W1175 AromaticContact CE3-CE3 4Å; W1173-W1175 HydrophobicContact CE3-CE3 4Å; W1173-W1175 AromaticContact CE3-CZ3 3.99Å; W1173-W1175 HydrophobicContact CE3-CZ3 3.99Å; W1173-W1175 AromaticContact CH2-CE3 3.59Å; W1173-W1175 HydrophobicContact CH2-CE3 3.59Å; W1173-W1175 AromaticContact CH2-CZ3 3.52Å; W1173-W1175 HydrophobicContact CH2-CZ3 3.52Å; W1173-W1175 HydrophobicContact CZ2-CD2 4.28Å; W1173-W1175 AromaticContact CZ2-CE3 3.44Å; W1173-W1175 HydrophobicContact CZ2-CE3 3.44Å; W1173-W1175 VanDerWaalsContact CZ2-CE3 3.44Å; W1173-W1175 AromaticContact CZ2-CZ3 3.9Å; W1173-W1175 HydrophobicContact CZ2-CZ3 3.9Å; W1173-W1175 AromaticContact CZ3-CE3 3.88Å; W1173-W1175 HydrophobicContact CZ3-CE3 3.88Å; W1173-W1175 AromaticContact CZ3-CZ3 3.57Å; W1173-W1175 HydrophobicContact CZ3-CZ3 3.57Å; W1175-P1177 WeakPolarHBondContact O-CD 3.47Å; W1175-P1177 VanDerWaalsContact O-N 3.15Å; W1175-V1180 HydrophobicContact CB-CB 4.49Å
1176	N	65.2	Low	68.8	Low	59 Å²	59	59 Å²	59	32%	0.316	32%	0.318	S	S	.	.			trans	-55.2	118.2	-173.3	-176.4	-7.4	0	0	0	111.8	T1178 I1179 V1180	N1176-T1178 PolarHBondContact ND2-OG1 2.96Å; N1176-T1178 PolarHBondContact O-N 2.85Å; N1176-T1178 VanDerWaalsContact O-N 3.14Å; N1176-T1178 PolarHBondContact OD1-N 2.6Å; N1176-T1178 VanDerWaalsContact OD1-N 3.14Å; N1176-T1178 PolarHBondContact OD1-OG1 3.44Å; N1176-T1178 VanDerWaalsContact OD1-OG1 3.06Å; N1176-I1179 HydrophobicContact CB-CD1 4.22Å; N1176-I1179 HydrophobicContact CB-CG1 4.3Å; N1176-I1179 PolarHBondContact O-N 2.9Å; N1176-V1180 PolarHBondContact O-N 3.43Å
1177	P	56.9	Low	67.7	Low	90 Å²	90	65.1 Å²	65.1	58%	0.584	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-15.1	-174.8	26.7	-35.9	0	0	0	114.5	W1175	W1175-P1177 WeakPolarHBondContact O-CD 3.47Å; W1175-P1177 VanDerWaalsContact O-N 3.15Å
1178	T	51.7	Low	66.4	Low	121 Å²	121	71.4 Å²	71.4	74%	0.742	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-27	172.7	65.7	0	0	0	0	112.7	N1176	N1176-T1178 PolarHBondContact ND2-OG1 2.96Å; N1176-T1178 PolarHBondContact O-N 2.85Å; N1176-T1178 VanDerWaalsContact O-N 3.14Å; N1176-T1178 PolarHBondContact OD1-N 2.6Å; N1176-T1178 VanDerWaalsContact OD1-N 3.14Å; N1176-T1178 PolarHBondContact OD1-OG1 3.44Å; N1176-T1178 VanDerWaalsContact OD1-OG1 3.06Å
1179	I	52.5	Low	64.7	Low	109 Å²	109	70.2 Å²	70.2	56%	0.559	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-37.6	179.9	-52.4	178.2	0	0	0	110.1	N1176	N1176-I1179 HydrophobicContact CB-CD1 4.22Å; N1176-I1179 HydrophobicContact CB-CG1 4.3Å; N1176-I1179 PolarHBondContact O-N 2.9Å
1180	V	57	Low	62.4	Low	20 Å²	20	79.2 Å²	79.2	12%	0.121	40%	0.4	C	S	.	.	S	Bend	trans	-127.4	103.4	-174.6	-179.1	0	0	0	0	110.8	L1121 W1175 N1176 F1182	L1121-V1180 HydrophobicContact CD1-CG1 3.91Å; L1121-V1180 HydrophobicContact CD2-CB 4.41Å; L1121-V1180 HydrophobicContact CD2-CG1 3.46Å; L1121-V1180 VanDerWaalsContact CD2-CG1 3.46Å; L1121-V1180 HydrophobicContact CD2-CG2 4.01Å; L1121-V1180 HydrophobicContact CG-CG1 4.33Å; W1175-V1180 HydrophobicContact CB-CB 4.49Å; N1176-V1180 PolarHBondContact O-N 3.43Å; V1180-F1182 PolarHBondContact O-N 3.26Å
1181	N	57	Low	60.5	Low	147 Å²	147	79.7 Å²	79.7	79%	0.786	40%	0.4	S	S	*	.			trans	-56.4	130.6	168.3	-86.8	-69	0	0	0	111	P1183	N1181-P1183 VanDerWaalsContact O-CD 3.27Å; N1181-P1183 WeakPolarHBondContact O-CD 3.2Å; N1181-P1183 VanDerWaalsContact O-N 3.09Å
1182	F	59.6	Low	57.9	Low	39 Å²	39	79 Å²	79	17%	0.171	40%	0.402	C	S	.	.			trans	-51.5	115.4	-180	-172.3	-86.5	0	0	0	111.3	I1169 T1170 W1173 V1180 K1184 I1186 R1187	I1169-F1182 HydrophobicContact CG2-CE2 4.14Å; I1169-F1182 HydrophobicContact CG2-CZ 4.19Å; T1170-F1182 HydrophobicContact CG2-CE1 3.81Å; T1170-F1182 HydrophobicContact CG2-CE2 3.83Å; T1170-F1182 HydrophobicContact CG2-CZ 3.41Å; T1170-F1182 VanDerWaalsContact CG2-CZ 3.41Å; W1173-F1182 HydrophobicContact CB-CD2 4.47Å; W1173-F1182 AromaticContact CD2-CD2 3.67Å; W1173-F1182 HydrophobicContact CD2-CD2 3.67Å; W1173-F1182 AromaticContact CD2-CE2 3.74Å; W1173-F1182 HydrophobicContact CD2-CE2 3.74Å; W1173-F1182 AromaticContact CE2-CD2 3.97Å; W1173-F1182 AromaticContact CE3-CD2 3.98Å; W1173-F1182 HydrophobicContact CE3-CD2 3.98Å; W1173-F1182 AromaticContact CE3-CE2 3.53Å; W1173-F1182 HydrophobicContact CE3-CE2 3.53Å; W1173-F1182 AromaticContact CG-CD2 3.91Å; W1173-F1182 HydrophobicContact CG-CD2 3.91Å; W1173-F1182 HydrophobicContact CG-CE2 4.25Å; W1173-F1182 AromaticContact CZ3-CE2 3.99Å; W1173-F1182 HydrophobicContact CZ3-CE2 3.99Å; V1180-F1182 PolarHBondContact O-N 3.26Å; F1182-K1184 PolarHBondContact O-N 3.4Å; F1182-I1186 HydrophobicContact CE1-CB 3.74Å; F1182-I1186 HydrophobicContact CE1-CG2 3.95Å; F1182-I1186 HydrophobicContact CZ-CB 3.89Å; F1182-I1186 HydrophobicContact CZ-CD1 4.21Å; F1182-I1186 HydrophobicContact CZ-CG2 3.65Å; F1182-R1187 HydrophobicContact CD1-CG 4.09Å; F1182-R1187 HydrophobicContact CE1-CG 3.75Å
1183	P	62.3	Low	55.5	Low	20 Å²	20	83 Å²	83	13%	0.13	42%	0.421	C	S	.	.			trans	-61	125.7	-169.3	-29.6	38.2	0	0	0	113.2	L1121 L1125 W1173 N1181 S1185 I1186	L1121-P1183 HydrophobicContact CD1-CG 4.41Å; L1125-P1183 HydrophobicContact CD1-CB 4.28Å; L1125-P1183 HydrophobicContact CD1-CG 3.97Å; L1125-P1183 HydrophobicContact CD2-CB 3.72Å; L1125-P1183 HydrophobicContact CD2-CG 3.91Å; L1125-P1183 HydrophobicContact CG-CG 4.44Å; W1173-P1183 HydrophobicContact CZ2-CG 4.22Å; N1181-P1183 VanDerWaalsContact O-CD 3.27Å; N1181-P1183 WeakPolarHBondContact O-CD 3.2Å; N1181-P1183 VanDerWaalsContact O-N 3.09Å; P1183-S1185 PolarHBondContact O-N 3.07Å; P1183-S1185 VanDerWaalsContact O-N 3.1Å; P1183-I1186 HydrophobicContact CB-CD1 4.38Å; P1183-I1186 HydrophobicContact CB-CG1 4.44Å; P1183-I1186 HydrophobicContact CG-CD1 4.47Å; P1183-I1186 PolarHBondContact O-N 3.33Å
1184	K	60.9	Low	53.1	Low	182 Å²	182	86.3 Å²	86.3	79%	0.791	45%	0.445	S	S	*	.	H	α-helix	trans	-56	-30.5	-179.6	-68.5	-177	-179.8	177.3	0	112.6	F1182 I1186 R1187 E1188	F1182-K1184 PolarHBondContact O-N 3.4Å; K1184-I1186 PolarHBondContact O-N 3.11Å; K1184-R1187 PolarHBondContact O-N 2.68Å; K1184-R1187 VanDerWaalsContact O-N 3.1Å; K1184-E1188 PolarHBondContact O-N 3.37Å
1185	S	59.9	Low	50.8	Low	31 Å²	31	94.2 Å²	94.2	22%	0.217	48%	0.481	C	S	.	.	H	α-helix	trans	-58.5	-20.9	174.5	43.9	0	0	0	0	115	P1183 E1188 P1189	P1183-S1185 PolarHBondContact O-N 3.07Å; P1183-S1185 VanDerWaalsContact O-N 3.1Å; S1185-E1188 CarbonylContact O-C 3.5Å; S1185-P1189 VanDerWaalsContact O-CA 3.22Å; S1185-P1189 WeakPolarHBondContact O-CA 3.38Å
1186	I	60.7	Low	48.4	Very low	3 Å²	3	100.2 Å²	100.2	2%	0.015	51%	0.514	C	S	.	.	H	α-helix	trans	-85.4	-32.3	175.9	-57.5	173.9	0	0	0	110.9	F1124 L1125 W1128 I1169 W1173 F1182 P1183 K1184	F1124-I1186 HydrophobicContact CE1-CD1 4.29Å; L1125-I1186 HydrophobicContact CD2-CD1 3.85Å; L1125-I1186 HydrophobicContact CD2-CG1 3.9Å; W1128-I1186 HydrophobicContact CZ2-CG2 4.38Å; I1169-I1186 HydrophobicContact CG2-CG2 4.43Å; W1173-I1186 HydrophobicContact CH2-CD1 3.37Å; W1173-I1186 HydrophobicContact CZ2-CD1 4.34Å; W1173-I1186 HydrophobicContact CZ3-CD1 3.61Å; F1182-I1186 HydrophobicContact CE1-CB 3.74Å; F1182-I1186 HydrophobicContact CE1-CG2 3.95Å; F1182-I1186 HydrophobicContact CZ-CB 3.89Å; F1182-I1186 HydrophobicContact CZ-CD1 4.21Å; F1182-I1186 HydrophobicContact CZ-CG2 3.65Å; P1183-I1186 HydrophobicContact CB-CD1 4.38Å; P1183-I1186 HydrophobicContact CB-CG1 4.44Å; P1183-I1186 HydrophobicContact CG-CD1 4.47Å; P1183-I1186 PolarHBondContact O-N 3.33Å; K1184-I1186 PolarHBondContact O-N 3.11Å
1187	R	55.1	Low	47.1	Very low	175 Å²	175	99.6 Å²	99.6	66%	0.66	51%	0.514	S	S	*	.	H	α-helix	trans	-77.2	-39.7	174.2	-60.6	-167.8	-179.7	-177.1	0.4	112.2	F1182 K1184	F1182-R1187 HydrophobicContact CD1-CG 4.09Å; F1182-R1187 HydrophobicContact CE1-CG 3.75Å; K1184-R1187 PolarHBondContact O-N 2.68Å; K1184-R1187 VanDerWaalsContact O-N 3.1Å
1188	E	50.2	Low	46	Very low	156 Å²	156	101.3 Å²	101.3	73%	0.729	52%	0.517	S	S	*	.	S	Bend	trans	-121.2	81.9	175	-68.9	178.6	-172.7	0	0	108	K1184 S1185 K1190	K1184-E1188 PolarHBondContact O-N 3.37Å; S1185-E1188 CarbonylContact O-C 3.5Å; E1188-K1190 PolarHBondContact O-N 2.89Å
1189	P	48	Very low	45.1	Very low	34 Å²	34	100.6 Å²	100.6	22%	0.221	52%	0.517	C	S	.	.			trans	-55.8	137.6	167.3	25.6	-34.1	0	0	0	108.2	V1133 S1185 I1191	V1133-P1189 HydrophobicContact CG1-CB 4.1Å; V1133-P1189 HydrophobicContact CG2-CB 4.44Å; S1185-P1189 VanDerWaalsContact O-CA 3.22Å; S1185-P1189 WeakPolarHBondContact O-CA 3.38Å; P1189-I1191 HydrophobicContact CB-CD1 4.31Å; P1189-I1191 HydrophobicContact CB-CG1 4.14Å; P1189-I1191 HydrophobicContact CG-CD1 4.01Å; P1189-I1191 HydrophobicContact CG-CG1 4.26Å; P1189-I1191 PolarHBondContact O-N 2.74Å
1190	K	34.9	Very low	43.9	Very low	189 Å²	189	103.6 Å²	103.6	82%	0.822	53%	0.531	S	S	*	.			trans	-72.5	51.5	-173.2	-71.5	-175.8	176.9	176.4	0	113.3	E1188 T1192	E1188-K1190 PolarHBondContact O-N 2.89Å; K1190-T1192 PolarHBondContact O-N 3.45Å
1191	I	37.2	Very low	42.6	Very low	73 Å²	73	108.8 Å²	108.8	37%	0.374	56%	0.556	S	S	.	*			trans	-78.2	88.6	176.5	-53.7	177.7	0	0	0	107.7	V1133 F1137 P1189 L1193	V1133-I1191 HydrophobicContact CG1-CD1 4.27Å; V1133-I1191 HydrophobicContact CG1-CG1 4.47Å; F1137-I1191 HydrophobicContact CD1-CD1 4.13Å; F1137-I1191 HydrophobicContact CD2-CD1 3.91Å; F1137-I1191 HydrophobicContact CE1-CD1 3.87Å; F1137-I1191 HydrophobicContact CE2-CD1 3.64Å; F1137-I1191 HydrophobicContact CG-CD1 4.14Å; F1137-I1191 HydrophobicContact CZ-CD1 3.62Å; P1189-I1191 HydrophobicContact CB-CD1 4.31Å; P1189-I1191 HydrophobicContact CB-CG1 4.14Å; P1189-I1191 HydrophobicContact CG-CD1 4.01Å; P1189-I1191 HydrophobicContact CG-CG1 4.26Å; P1189-I1191 PolarHBondContact O-N 2.74Å; I1191-L1193 HydrophobicContact CG2-CB 4.4Å; I1191-L1193 HydrophobicContact CG2-CD1 3.73Å; I1191-L1193 HydrophobicContact CG2-CG 3.75Å; I1191-L1193 PolarHBondContact O-N 3Å
1192	T	26.5	Very low	41.4	Very low	128 Å²	128	111.2 Å²	111.2	79%	0.785	56%	0.559	S	S	*	*			trans	-73.2	64.5	170.7	30.3	0	0	0	0	110.7	K1190 T1194	K1190-T1192 PolarHBondContact O-N 3.45Å; T1192-T1194 PolarHBondContact O-N 3.4Å
1193	L	30.2	Very low	40	Very low	126 Å²	126	116.2 Å²	116.2	66%	0.66	59%	0.587	S	S	*	*			trans	-64.4	84.2	162.6	-89.5	162.1	0	0	0	108.7	I1191 Q1195	I1191-L1193 HydrophobicContact CG2-CB 4.4Å; I1191-L1193 HydrophobicContact CG2-CD1 3.73Å; I1191-L1193 HydrophobicContact CG2-CG 3.75Å; I1191-L1193 PolarHBondContact O-N 3Å; L1193-Q1195 PolarHBondContact O-N 3.09Å
1194	T	29.3	Very low	38.4	Very low	95 Å²	95	125 Å²	125	58%	0.583	62%	0.62	S	S	*	*			trans	-59.1	126.9	172.9	54.2	0	0	0	0	108.6	T1192 N1196 S1197	T1192-T1194 PolarHBondContact O-N 3.4Å; T1194-N1196 PolarHBondContact O-N 3.31Å; T1194-S1197 WeakPolarHBondContact O-CB 3.37Å; T1194-S1197 PolarHBondContact O-N 2.89Å; T1194-S1197 PolarHBondContact O-OG 2.93Å
1195	Q	30.8	Very low	36.9	Very low	171 Å²	171	124.7 Å²	124.7	80%	0.799	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-61.7	-18.3	-167.1	-65.4	179.6	-88.7	0	0	113.8	L1193 S1197 I1198	L1193-Q1195 PolarHBondContact O-N 3.09Å; Q1195-S1197 VanDerWaalsContact C-N 3.25Å; Q1195-S1197 PolarHBondContact O-N 3.04Å; Q1195-I1198 PolarHBondContact O-N 3.16Å
1196	N	30.8	Very low	35.3	Very low	136 Å²	136	130.6 Å²	130.6	73%	0.727	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-66	-22.2	173.8	-64.5	0.2	0	0	0	113.4	T1194 I1198 S1199	T1194-N1196 PolarHBondContact O-N 3.31Å; N1196-I1198 PolarHBondContact O-N 2.89Å; N1196-I1198 VanDerWaalsContact O-N 3.13Å; N1196-S1199 PolarHBondContact O-N 3.11Å
1197	S	37.4	Very low	33.8	Very low	46 Å²	46	135.5 Å²	135.5	32%	0.322	68%	0.679	S	S	.	*	G	3₁₀ helix	trans	-67	-11.8	179.8	72.9	0	0	0	0	113.7	T1194 Q1195 M1201	T1194-S1197 WeakPolarHBondContact O-CB 3.37Å; T1194-S1197 PolarHBondContact O-N 2.89Å; T1194-S1197 PolarHBondContact O-OG 2.93Å; Q1195-S1197 VanDerWaalsContact C-N 3.25Å; Q1195-S1197 PolarHBondContact O-N 3.04Å; S1197-M1201 VanDerWaalsContact O-CE 3.27Å; S1197-M1201 WeakPolarHBondContact O-CE 3.13Å
1198	I	34.8	Very low	32.4	Very low	127 Å²	127	134.1 Å²	134.1	65%	0.651	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-84.3	-24.1	-177.7	-60.6	175.6	0	0	0	111.6	Q1195 N1196	Q1195-I1198 PolarHBondContact O-N 3.16Å; N1196-I1198 PolarHBondContact O-N 2.89Å; N1196-I1198 VanDerWaalsContact O-N 3.13Å
1199	S	31.9	Very low	31.3	Very low	105 Å²	105	131.6 Å²	131.6	73%	0.734	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-19	-170.7	-59.1	0	0	0	0	115.5	N1196	N1196-S1199 PolarHBondContact O-N 3.11Å
1200	M	27.8	Very low	30.3	Very low	173 Å²	173	133.7 Å²	133.7	85%	0.852	70%	0.696	S	S	*	*	S	Bend	trans	-88.1	-13.5	-176.6	-72.9	-172.9	167.3	0	0	114.9	K1202	M1200-K1202 PolarHBondContact O-N 2.97Å
1201	M	29.6	Very low	29.9	Very low	129 Å²	129	129 Å²	129	64%	0.635	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	58.9	-175.3	-82.2	-175.2	-83.2	0	0	113.9	S1197	S1197-M1201 VanDerWaalsContact O-CE 3.27Å; S1197-M1201 WeakPolarHBondContact O-CE 3.13Å
1202	K	31.2	Very low	29.5	Very low	197 Å²	197	126.5 Å²	126.5	86%	0.857	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.8	-19.9	171.8	-85.4	-166	173.7	-177.5	0	117.9	M1200	M1200-K1202 PolarHBondContact O-N 2.97Å
1203	N	30.6	Very low	29.5	Very low	144 Å²	144	126.3 Å²	126.3	77%	0.77	66%	0.663	S	S	*	*	S	Bend	trans	-127.8	-3.6	-164.3	-94.2	11.8	0	0	0	118.2
1204	Y	28.9	Very low	29.4	Very low	206 Å²	206	121.8 Å²	121.8	81%	0.808	64%	0.642	S	S	*	*			trans	-116.3	90.6	-174.3	-81.3	-80.5	0	0	0	114.9
1205	Q	29.4	Very low	29.2	Very low	175 Å²	175	118.9 Å²	118.9	82%	0.818	62%	0.622	S	S	*	*			trans	-76.8	154.6	142.7	-157.1	169.1	6.8	0	0	107.6
1206	L	26.7	Very low	29.3	Very low	154 Å²	154	113.4 Å²	113.4	81%	0.806	60%	0.6	S	S	*	*	S	Bend	trans	67.9	71.2	-168.5	-62.8	85.6	0	0	0	116.2
1207	T	29	Very low	29.3	Very low	106 Å²	106	111 Å²	111	65%	0.65	59%	0.585	S	S	*	*			trans	-168	83.9	131.4	33.8	0	0	0	0	107.8
1208	L	25.1	Very low	28.8	Very low	147 Å²	147	112.9 Å²	112.9	77%	0.77	60%	0.595	S	S	*	*			trans	-128.6	28.3	-175.9	-109.5	172.3	0	0	0	111.4
1209	S	26.7	Very low	28.5	Very low	103 Å²	103	111.7 Å²	111.7	72%	0.72	60%	0.597	S	S	*	*	S	Bend	trans	-144.4	10.6	-158.5	60.3	0	0	0	0	114.9
1210	T	28.1	Very low	28.4	Very low	78 Å²	78	111.3 Å²	111.3	48%	0.479	58%	0.583	S	S	.	*	S	Bend	trans	-141.9	-12.9	-175.7	46.5	0	0	0	0	114.5	Q491 C1212	Q491-T1210 PolarHBondContact NE2-O 2.92Å; T1210-C1212 VanDerWaalsContact C-N 3.29Å; T1210-C1212 PolarHBondContact O-N 3.39Å
1211	L	26	Very low	28.4	Very low	89 Å²	89	110 Å²	110	47%	0.466	57%	0.574	S	S	.	*	S	Bend	trans	-88.1	25.3	-168.8	-107.1	160.8	0	0	0	113.1	Q491 D492 L493	Q491-L1211 VanDerWaalsContact C-C 3.5Å; Q491-L1211 CarbonylContact O-C 2.86Å; Q491-L1211 WeakPolarHBondContact O-CA 3.44Å; D492-L1211 CarbonylContact C-O 3.41Å; D492-L1211 VanDerWaalsContact CA-O 3.24Å; D492-L1211 WeakPolarHBondContact CA-O 3.37Å; D492-L1211 PolarHBondContact N-O 2.89Å; L493-L1211 PolarHBondContact N-O 2.91Å
1212	C	28.5	Very low	28.3	Very low	22 Å²	22	113.2 Å²	113.2	15%	0.149	58%	0.58	C	S	.	*			trans	-134.1	14.8	-145.2	-64.1	0	0	0	0	125.1	Q491 D492 L493 Q494 T1210	Q491-C1212 PolarHBondContact O-N 3.2Å; D492-C1212 VanDerWaalsContact CA-N 3.33Å; D492-C1212 PolarHBondContact OD1-N 3.37Å; L493-C1212 CarbonylContact C-O 3.59Å; L493-C1212 WeakPolarHBondContact CA-O 3.43Å; L493-C1212 VanDerWaalsContact N-CA 3.27Å; Q494-C1212 HydrophobicContact CB-CB 3.78Å; Q494-C1212 WeakPolarHBondContact CB-SG 3.3Å; Q494-C1212 HydrophobicContact CG-CB 4.29Å; Q494-C1212 WeakPolarHBondContact CG-SG 3.49Å; Q494-C1212 PolarHBondContact N-O 3.44Å; Q494-C1212 PolarHBondContact OE1-SG 2.88Å; Q494-C1212 VanDerWaalsContact OE1-SG 3.32Å; T1210-C1212 VanDerWaalsContact C-N 3.29Å; T1210-C1212 PolarHBondContact O-N 3.39Å
1213	N	25.8	Very low	28.1	Very low	124 Å²	124	107.3 Å²	107.3	66%	0.663	56%	0.56	S	S	*	*	S	Bend	trans	-104.4	-38.2	-174.9	-60.5	-90.6	0	0	0	120.7	D492	D492-N1213 VanDerWaalsContact CA-N 3.33Å; D492-N1213 HydrophobicContact CB-CB 4.15Å; D492-N1213 VanDerWaalsContact CB-N 3.26Å; D492-N1213 VanDerWaalsContact OD1-CB 3.3Å; D492-N1213 WeakPolarHBondContact OD1-CB 3.25Å; D492-N1213 PolarHBondContact OD1-N 3.03Å; D492-N1213 PolarHBondContact OD1-ND2 3.27Å
1214	S	28.1	Very low	27.8	Very low	31 Å²	31	105.1 Å²	105.1	22%	0.217	56%	0.556	C	S	.	*			trans	-162.2	-15.7	-136.4	49.5	0	0	0	0	119.7	D492 V1216 E1217	D492-S1214 VanDerWaalsContact CB-N 3.33Å; D492-S1214 WeakPolarHBondContact CB-OG 3.13Å; D492-S1214 CarbonylContact O-C 3.56Å; D492-S1214 PolarHBondContact O-N 2.92Å; S1214-V1216 PolarHBondContact O-N 3.17Å; S1214-E1217 VanDerWaalsContact CB-OE1 3.28Å; S1214-E1217 WeakPolarHBondContact CB-OE1 3.41Å; S1214-E1217 VanDerWaalsContact CB-OE2 3.27Å; S1214-E1217 WeakPolarHBondContact CB-OE2 3.41Å; S1214-E1217 WeakPolarHBondContact O-CB 2.92Å; S1214-E1217 WeakPolarHBondContact O-CG 3.39Å; S1214-E1217 PolarHBondContact O-N 3.28Å
1215	D	26.9	Very low	27.8	Very low	33 Å²	33	99.9 Å²	99.9	18%	0.176	54%	0.54	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	29.2	175.2	-155.4	17.2	0	0	0	113.8	M489 Y490 D492	M489-D1215 VanDerWaalsContact C-OD2 3.23Å; M489-D1215 WeakPolarHBondContact O-CB 3.38Å; Y490-D1215 VanDerWaalsContact CA-OD2 3.27Å; Y490-D1215 WeakPolarHBondContact CA-OD2 3.38Å; Y490-D1215 WeakPolarHBondContact CD1-OD2 3.09Å; Y490-D1215 WeakPolarHBondContact CE1-OD2 3.47Å; Y490-D1215 VanDerWaalsContact CG-OD2 3.24Å; Y490-D1215 PolarHBondContact N-OD2 3.48Å; D492-D1215 PolarHBondContact O-N 3.44Å
1216	V	32.5	Very low	27.8	Very low	56 Å²	56	93.7 Å²	93.7	34%	0.339	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.6	-0.6	164.9	-178.7	0	0	0	0	110.1	L493 S1214 T1218 C1219 Q1220	L493-V1216 HydrophobicContact CB-CG2 4.21Å; L493-V1216 HydrophobicContact CD2-CB 3.98Å; L493-V1216 HydrophobicContact CD2-CG1 4.48Å; L493-V1216 HydrophobicContact CD2-CG2 3.58Å; L493-V1216 HydrophobicContact CG-CG2 4.33Å; S1214-V1216 PolarHBondContact O-N 3.17Å; V1216-T1218 VanDerWaalsContact C-N 3.29Å; V1216-T1218 PolarHBondContact O-N 2.97Å; V1216-C1219 PolarHBondContact O-N 3.27Å; V1216-Q1220 HydrophobicContact CG1-CG 4.24Å; V1216-Q1220 WeakPolarHBondContact O-CG 3.16Å; V1216-Q1220 PolarHBondContact O-N 2.83Å
1217	E	29.6	Very low	27.8	Very low	86 Å²	86	88.8 Å²	88.8	40%	0.402	49%	0.491	S	S	.	.	H	α-helix	trans	-61.7	-30.9	178.4	-77.7	173.1	170.2	0	0	113.1	S1214 C1219 Q1220 H1221	S1214-E1217 VanDerWaalsContact CB-OE1 3.28Å; S1214-E1217 WeakPolarHBondContact CB-OE1 3.41Å; S1214-E1217 VanDerWaalsContact CB-OE2 3.27Å; S1214-E1217 WeakPolarHBondContact CB-OE2 3.41Å; S1214-E1217 WeakPolarHBondContact O-CB 2.92Å; S1214-E1217 WeakPolarHBondContact O-CG 3.39Å; S1214-E1217 PolarHBondContact O-N 3.28Å; E1217-C1219 PolarHBondContact O-N 3.46Å; E1217-Q1220 CarbonylContact O-C 3.47Å; E1217-Q1220 PolarHBondContact O-N 3.45Å; E1217-H1221 WeakPolarHBondContact O-CB 3.21Å; E1217-H1221 PolarHBondContact O-CD2 3.39Å; E1217-H1221 VanDerWaalsContact O-CG 3.27Å; E1217-H1221 PolarHBondContact O-N 3.14Å
1218	T	27.8	Very low	27.8	Very low	86 Å²	86	84.7 Å²	84.7	53%	0.528	47%	0.47	S	S	.	.	H	α-helix	trans	-62.9	-23.6	174.1	48.8	0	0	0	0	113.1	M489 V1216	M489-T1218 HydrophobicContact CE-CG2 4.32Å; V1216-T1218 VanDerWaalsContact C-N 3.29Å; V1216-T1218 PolarHBondContact O-N 2.97Å
1219	C	28.8	Very low	28	Very low	102 Å²	102	79.3 Å²	79.3	69%	0.689	44%	0.442	S	S	*	.	H	α-helix	trans	-94.2	-27.5	167.2	-67.1	0	0	0	0	113.2	V1216 E1217	V1216-C1219 PolarHBondContact O-N 3.27Å; E1217-C1219 PolarHBondContact O-N 3.46Å
1220	Q	30	Very low	28.4	Very low	96 Å²	96	78.2 Å²	78.2	45%	0.449	43%	0.427	S	S	.	.	H	α-helix	trans	-81.3	-19.1	179.1	-62.9	179.9	14	0	0	113.9	V1216 E1217 R1222 T1223	V1216-Q1220 HydrophobicContact CG1-CG 4.24Å; V1216-Q1220 WeakPolarHBondContact O-CG 3.16Å; V1216-Q1220 PolarHBondContact O-N 2.83Å; E1217-Q1220 CarbonylContact O-C 3.47Å; E1217-Q1220 PolarHBondContact O-N 3.45Å; Q1220-R1222 CarbonylContact O-C 3.58Å; Q1220-R1222 PolarHBondContact O-N 2.6Å; Q1220-T1223 VanDerWaalsContact O-CB 3.31Å; Q1220-T1223 WeakPolarHBondContact O-CB 3.19Å; Q1220-T1223 WeakPolarHBondContact O-CG2 3.4Å; Q1220-T1223 PolarHBondContact O-N 3.25Å; Q1220-T1223 PolarHBondContact O-OG1 2.72Å
1221	H	27.1	Very low	28.7	Very low	145 Å²	145	78.5 Å²	78.5	67%	0.671	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	4.4	176.6	-76.4	-42.2	0	0	0	115.5	E1217 T1223	E1217-H1221 WeakPolarHBondContact O-CB 3.21Å; E1217-H1221 PolarHBondContact O-CD2 3.39Å; E1217-H1221 VanDerWaalsContact O-CG 3.27Å; E1217-H1221 PolarHBondContact O-N 3.14Å; H1221-T1223 VanDerWaalsContact C-N 3.26Å
1222	R	27.5	Very low	29.4	Very low	198 Å²	198	75 Å²	75	75%	0.747	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	11	157.8	-66.9	-169.3	174.3	-156.9	-1.8	113.7	Q1220 S1224	Q1220-R1222 CarbonylContact O-C 3.58Å; Q1220-R1222 PolarHBondContact O-N 2.6Å; R1222-S1224 PolarHBondContact O-N 2.83Å; R1222-S1224 VanDerWaalsContact O-N 3.1Å
1223	T	26.1	Very low	29.7	Very low	73 Å²	73	74.5 Å²	74.5	45%	0.448	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	74.7	175.6	52.8	0	0	0	0	113.5	Q1220 H1221	Q1220-T1223 VanDerWaalsContact O-CB 3.31Å; Q1220-T1223 WeakPolarHBondContact O-CB 3.19Å; Q1220-T1223 WeakPolarHBondContact O-CG2 3.4Å; Q1220-T1223 PolarHBondContact O-N 3.25Å; Q1220-T1223 PolarHBondContact O-OG1 2.72Å; H1221-T1223 VanDerWaalsContact C-N 3.26Å
1224	S	24.8	Very low	30.3	Very low	97 Å²	97	69.1 Å²	69.1	68%	0.678	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.7	-24.6	153.4	65.4	0	0	0	0	112.3	R1222 D1226	R1222-S1224 PolarHBondContact O-N 2.83Å; R1222-S1224 VanDerWaalsContact O-N 3.1Å; S1224-D1226 VanDerWaalsContact C-N 3.26Å; S1224-D1226 PolarHBondContact O-N 3.21Å
1225	M	29	Very low	30.4	Very low	97 Å²	97	69 Å²	69	48%	0.478	37%	0.374	S	S	.	.			trans	-77.8	61.9	178.5	-72.8	-85.9	95.2	0	0	113.4	S1227 G1228	M1225-S1227 PolarHBondContact O-N 2.68Å; M1225-G1228 PolarHBondContact O-N 3.08Å
1226	D	29.9	Very low	30.7	Very low	44 Å²	44	69.1 Å²	69.1	24%	0.235	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	35.8	167.6	-111.8	-37	0	0	0	113.1	R937 H940 N973 S1224	R937-D1226 PolarHBondContact NH2-O 2.92Å; H940-D1226 IonicContact NE2-OD2 2.85Å; N973-D1226 PolarHBondContact ND2-OD1 3.33Å; N973-D1226 PolarHBondContact ND2-OD2 3.1Å; S1224-D1226 VanDerWaalsContact C-N 3.26Å; S1224-D1226 PolarHBondContact O-N 3.21Å
1227	S	26.4	Very low	30.7	Very low	51 Å²	51	71.1 Å²	71.1	36%	0.357	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-149.5	-5.1	-179.2	45.6	0	0	0	0	110.6	M1225 I1229	M1225-S1227 PolarHBondContact O-N 2.68Å; S1227-I1229 PolarHBondContact O-N 3.12Å
1228	G	29.1	Very low	30.6	Very low	21 Å²	21	69 Å²	69	22%	0.216	38%	0.383	C	S	.	.			trans	-96.5	87.8	-169.6	0	0	0	0	0	114.1	M1225	M1225-G1228 PolarHBondContact O-N 3.08Å
1229	I	30.2	Very low	30.6	Very low	33 Å²	33	71.5 Å²	71.5	17%	0.169	39%	0.394	C	S	.	.	S	Bend		-61.4	137.8	122.1	-58.2	161.9	0	0	0	104.6	Y1032 S1227 L1231	Y1032-I1229 WeakPolarHBondContact OH-CD1 3.38Å; S1227-I1229 PolarHBondContact O-N 3.12Å; I1229-L1231 PolarHBondContact O-N 3.42Å
1230	I	34.2	Very low	30.5	Very low	81 Å²	81	71.9 Å²	71.9	42%	0.415	39%	0.389	S	S	.	.			trans	-49.4	135.1	176.2	-80.1	165.5	0	0	0	109	T1112 D1232	T1112-I1230 HydrophobicContact CG2-CD1 3.81Å; I1230-D1232 VanDerWaalsContact C-N 3.3Å; I1230-D1232 PolarHBondContact O-N 3.14Å; I1230-D1232 VanDerWaalsContact O-OD1 3.12Å
1231	L	34	Very low	30.3	Very low	83 Å²	83	70.1 Å²	70.1	44%	0.435	38%	0.382	S	S	.	.			trans	-71.1	89.7	-174.2	-77.3	162.4	0	0	0	109	C716 R718 I1229 G1233	C716-L1231 HydrophobicContact CB-CD1 4.31Å; R718-L1231 HydrophobicContact CG-CD2 4.19Å; I1229-L1231 PolarHBondContact O-N 3.42Å; L1231-G1233 PolarHBondContact O-N 2.87Å
1232	D	40.6	Very low	30.4	Very low	16 Å²	16	71.5 Å²	71.5	9%	0.086	39%	0.386	C	S	.	.			trans	-66.1	1	170.3	-50.3	-26.3	0	0	0	112	F720 R1039 K1040 Q1043 I1230	F720-D1232 HydrophobicContact CD1-CB 4.34Å; F720-D1232 VanDerWaalsContact CD1-O 3.26Å; F720-D1232 WeakPolarHBondContact CD1-O 3.25Å; F720-D1232 HydrophobicContact CE1-CB 3.82Å; R1039-D1232 IonicContact CZ-OD2 2.61Å; R1039-D1232 VanDerWaalsContact CZ-OD2 3.3Å; R1039-D1232 IonicContact NE-OD2 2.64Å; R1039-D1232 PolarHBondContact NE-OD2 3.18Å; R1039-D1232 IonicContact NH2-OD2 2.68Å; R1039-D1232 PolarHBondContact NH2-OD2 3.38Å; K1040-D1232 WeakPolarHBondContact CE-OD1 3.35Å; K1040-D1232 VanDerWaalsContact CG-OD1 3.31Å; K1040-D1232 WeakPolarHBondContact CG-OD1 3.48Å; K1040-D1232 IonicContact NZ-OD1 3.47Å; Q1043-D1232 WeakPolarHBondContact CG-O 3.47Å; I1230-D1232 VanDerWaalsContact C-N 3.3Å; I1230-D1232 PolarHBondContact O-N 3.14Å; I1230-D1232 VanDerWaalsContact O-OD1 3.12Å
1233	G	34.5	Very low	30.2	Very low	12 Å²	12	65.9 Å²	65.9	12%	0.124	37%	0.371	C	S	.	.			trans	-92.8	126.9	-176.3	0	0	0	0	0	111.9	S719 L1231	S719-G1233 CarbonylContact O-C 3.58Å; S719-G1233 VanDerWaalsContact O-CA 3.29Å; S719-G1233 WeakPolarHBondContact O-CA 3.36Å; L1231-G1233 PolarHBondContact O-N 2.87Å
1234	I	39.5	Very low	30.3	Very low	10 Å²	10	66.7 Å²	66.7	5%	0.051	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-83	132.8	175.1	-51.9	176.1	0	0	0	107.8	F679 I717 S719 K721 F1047 P1236 L1241	F679-I1234 HydrophobicContact CE1-CB 4.26Å; F679-I1234 HydrophobicContact CE1-CD1 3.9Å; F679-I1234 HydrophobicContact CE1-CG2 4.17Å; I717-I1234 CarbonylContact O-C 3.55Å; S719-I1234 PolarHBondContact N-O 2.94Å; S719-I1234 PolarHBondContact O-N 3.43Å; S719-I1234 PolarHBondContact OG-O 2.86Å; K721-I1234 HydrophobicContact CB-CD1 3.76Å; F1047-I1234 HydrophobicContact CD2-CD1 4.16Å; F1047-I1234 HydrophobicContact CE1-CD1 3.99Å; F1047-I1234 HydrophobicContact CE1-CG1 4.42Å; F1047-I1234 HydrophobicContact CE1-CG2 4.27Å; F1047-I1234 HydrophobicContact CE2-CD1 3.47Å; F1047-I1234 VanDerWaalsContact CE2-CD1 3.47Å; F1047-I1234 HydrophobicContact CE2-CG1 3.57Å; F1047-I1234 HydrophobicContact CZ-CB 4.18Å; F1047-I1234 HydrophobicContact CZ-CD1 3.38Å; F1047-I1234 HydrophobicContact CZ-CG1 3.44Å; F1047-I1234 VanDerWaalsContact CZ-CG1 3.44Å; F1047-I1234 HydrophobicContact CZ-CG2 3.78Å; I1234-P1236 WeakPolarHBondContact O-CD 3.3Å; I1234-L1241 HydrophobicContact CG2-CD1 4.05Å
1235	N	30.6	Very low	30.5	Very low	29 Å²	29	70 Å²	70	16%	0.155	38%	0.382	C	S	.	.			trans	-89.1	107.3	163.1	176.3	48	0	0	0	108.7	T1237 S1238	N1235-T1237 PolarHBondContact ND2-OG1 3.42Å; N1235-T1237 VanDerWaalsContact ND2-OG1 3.12Å; N1235-T1237 PolarHBondContact O-N 3.26Å; N1235-T1237 PolarHBondContact OD1-OG1 3.24Å; N1235-S1238 WeakPolarHBondContact CB-OG 3.47Å; N1235-S1238 VanDerWaalsContact ND2-CB 3.35Å; N1235-S1238 WeakPolarHBondContact ND2-CB 3.46Å; N1235-S1238 PolarHBondContact ND2-OG 3.47Å; N1235-S1238 PolarHBondContact O-N 3.26Å; N1235-S1238 VanDerWaalsContact O-N 3.16Å; N1235-S1238 PolarHBondContact O-OG 3.18Å
1236	P	33.1	Very low	30.4	Very low	35 Å²	35	72 Å²	72	23%	0.227	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-5.5	-168.9	29.5	-36.5	0	0	0	114.1	I1234	I1234-P1236 WeakPolarHBondContact O-CD 3.3Å
1237	T	31.1	Very low	30.2	Very low	99 Å²	99	75.9 Å²	75.9	61%	0.607	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	2.1	177.4	57.2	0	0	0	0	114	N1235	N1235-T1237 PolarHBondContact ND2-OG1 3.42Å; N1235-T1237 VanDerWaalsContact ND2-OG1 3.12Å; N1235-T1237 PolarHBondContact O-N 3.26Å; N1235-T1237 PolarHBondContact OD1-OG1 3.24Å
1238	S	27.6	Very low	30.1	Very low	41 Å²	41	79.9 Å²	79.9	29%	0.287	43%	0.428	S	S	.	.			trans	-124.8	96.3	-179.4	60.7	0	0	0	0	113	N1235 N1240	N1235-S1238 WeakPolarHBondContact CB-OG 3.47Å; N1235-S1238 VanDerWaalsContact ND2-CB 3.35Å; N1235-S1238 WeakPolarHBondContact ND2-CB 3.46Å; N1235-S1238 PolarHBondContact ND2-OG 3.47Å; N1235-S1238 PolarHBondContact O-N 3.26Å; N1235-S1238 VanDerWaalsContact O-N 3.16Å; N1235-S1238 PolarHBondContact O-OG 3.18Å; S1238-N1240 PolarHBondContact O-N 2.86Å
1239	N	28.7	Very low	29.9	Very low	139 Å²	139	83.2 Å²	83.2	74%	0.743	45%	0.447	S	S	*	.	S	Bend	trans	-65.7	1.2	172.3	-65.7	-7.5	0	0	0	113.9	L1241	N1239-L1241 PolarHBondContact O-N 3.27Å
1240	N	25.9	Very low	29.6	Very low	109 Å²	109	89 Å²	89	58%	0.583	48%	0.479	S	S	*	.			trans	-96.3	27.4	-174.2	-63.5	-12.3	0	0	0	113.4	S1238 F1242 N1243	S1238-N1240 PolarHBondContact O-N 2.86Å; N1240-F1242 PolarHBondContact O-N 3.03Å; N1240-F1242 VanDerWaalsContact O-N 3.13Å; N1240-N1243 PolarHBondContact O-N 3.42Å
1241	L	26.9	Very low	29.4	Very low	59 Å²	59	91.9 Å²	91.9	31%	0.309	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-18.9	-169.1	-103.6	163.8	0	0	0	115	F1047 I1234 N1239	F1047-L1241 HydrophobicContact CE1-CD1 4.43Å; F1047-L1241 HydrophobicContact CZ-CD1 3.86Å; I1234-L1241 HydrophobicContact CG2-CD1 4.05Å; N1239-L1241 PolarHBondContact O-N 3.27Å
1242	F	28.7	Very low	28.8	Very low	174 Å²	174	95.1 Å²	95.1	76%	0.763	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-40	169.7	-86.3	-90.5	0	0	0	112.9	N1240 C1244 F1245	N1240-F1242 PolarHBondContact O-N 3.03Å; N1240-F1242 VanDerWaalsContact O-N 3.13Å; F1242-C1244 PolarHBondContact O-N 2.87Å; F1242-C1244 VanDerWaalsContact O-N 3.11Å; F1242-F1245 PolarHBondContact O-N 3.11Å
1243	N	24.6	Very low	28.2	Very low	81 Å²	81	105.7 Å²	105.7	43%	0.433	55%	0.549	S	S	.	.	H	α-helix	trans	-66.3	-20.4	-174.2	-62.8	17.2	0	0	0	113.1	N1240 F1245 N1247	N1240-N1243 PolarHBondContact O-N 3.42Å; N1243-F1245 VanDerWaalsContact C-N 3.34Å; N1243-N1247 PolarHBondContact O-ND2 3.22Å
1244	C	26.7	Very low	27.8	Very low	89 Å²	89	107.6 Å²	107.6	60%	0.601	57%	0.569	S	S	*	*	H	α-helix	trans	-76.4	-18	174.9	-69.6	0	0	0	0	113.5	F1242	F1242-C1244 PolarHBondContact O-N 2.87Å; F1242-C1244 VanDerWaalsContact O-N 3.11Å
1245	F	28.9	Very low	27.1	Very low	168 Å²	168	112.6 Å²	112.6	74%	0.737	60%	0.596	S	S	*	*	H	α-helix	trans	-86.2	-30.4	172	-82.5	-86.4	0	0	0	112.7	F1242 N1243	F1242-F1245 PolarHBondContact O-N 3.11Å; N1243-F1245 VanDerWaalsContact C-N 3.34Å
1246	E	26.3	Very low	26.8	Very low	138 Å²	138	114.5 Å²	114.5	65%	0.645	61%	0.606	S	S	*	*	H	α-helix	trans	-78.1	-24.5	-175.2	-62.3	-170.4	137	0	0	114.5	N1248	E1246-N1248 VanDerWaalsContact C-N 3.29Å; E1246-N1248 PolarHBondContact O-N 3.35Å
1247	N	25.6	Very low	26.6	Very low	126 Å²	126	120.9 Å²	120.9	67%	0.674	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	6.6	-170.6	-83.6	-70.9	0	0	0	116.1	N1243 S1249	N1243-N1247 PolarHBondContact O-ND2 3.22Å; N1247-S1249 VanDerWaalsContact C-N 3.35Å; N1247-S1249 PolarHBondContact O-N 3.23Å
1248	N	26	Very low	26.4	Very low	134 Å²	134	123 Å²	123	72%	0.717	62%	0.624	S	S	*	*	S	Bend	trans	-94.1	65.8	165	-81	-61.2	0	0	0	110.6	E1246 N1250	E1246-N1248 VanDerWaalsContact C-N 3.29Å; E1246-N1248 PolarHBondContact O-N 3.35Å; N1248-N1250 PolarHBondContact O-N 3.35Å
1249	S	24.8	Very low	26.4	Very low	91 Å²	91	125.7 Å²	125.7	64%	0.636	64%	0.643	S	S	*	*			trans	-77	117.3	-178.7	40.6	0	0	0	0	112	N1247	N1247-S1249 VanDerWaalsContact C-N 3.35Å; N1247-S1249 PolarHBondContact O-N 3.23Å
1250	N	24.1	Very low	26.2	Very low	154 Å²	154	127.6 Å²	127.6	82%	0.824	65%	0.647	S	S	*	*			trans	167.6	40.1	143.5	-85.3	-21.4	0	0	0	115.1	N1248	N1248-N1250 PolarHBondContact O-N 3.35Å
1251	I	28.3	Very low	26.3	Very low	142 Å²	142	127.8 Å²	127.8	73%	0.728	64%	0.641	S	S	*	*			trans	-131.7	117.9	152.5	-59.3	-177.8	0	0	0	107.7
1252	M	23.2	Very low	26.3	Very low	151 Å²	151	133.7 Å²	133.7	74%	0.744	67%	0.666	S	S	*	*			trans	-77.9	125.7	169.4	-81.3	-171.5	167.3	0	0	109.8
1253	Y	27.4	Very low	26.2	Very low	238 Å²	238	132.6 Å²	132.6	93%	0.933	66%	0.658	S	S	*	*			trans	-171.4	138.5	134.7	-89.8	-60.3	0	0	0	109.3
1254	G	25.9	Very low	26.2	Very low	53 Å²	53	134.5 Å²	134.5	55%	0.546	68%	0.675	S	S	.	*			trans	96.7	24	151.4	0	0	0	0	0	120.8	N1256	G1254-N1256 PolarHBondContact O-N 3.23Å
1255	N	24.5	Very low	26.4	Very low	115 Å²	115	139 Å²	139	62%	0.615	68%	0.681	S	S	*	*			trans	-64.4	106.6	160.9	-86	7.3	0	0	0	109.5
1256	N	25	Very low	26.2	Very low	68 Å²	68	134.5 Å²	134.5	36%	0.364	68%	0.682	S	S	.	*			trans	175.1	48.1	161	-93.2	-14.3	0	0	0	113.9	G1254	G1254-N1256 PolarHBondContact O-N 3.23Å
1257	Y	28	Very low	26.4	Very low	169 Å²	169	135.3 Å²	135.3	66%	0.663	69%	0.688	S	S	*	*	S	Bend	trans	-140.3	5.6	-176.4	-86.1	-65.8	0	0	0	119.9	Y1261	Y1257-Y1261 WeakPolarHBondContact O-CE2 3.26Å
1258	Y	28	Very low	26.4	Very low	143 Å²	143	132 Å²	132	56%	0.561	69%	0.685	S	S	*	*	S	Bend	trans	-119.8	20.5	178.7	-88.6	-70.7	0	0	0	116.1	H1116 L1119	H1116-Y1258 PolarHBondContact CD2-OH 2.81Å; H1116-Y1258 AromaticContact NE2-CZ 3.93Å; H1116-Y1258 PolarHBondContact NE2-OH 2.9Å; L1119-Y1258 HydrophobicContact CD1-CE2 4.24Å; L1119-Y1258 WeakPolarHBondContact CD1-OH 3.41Å; L1119-Y1258 HydrophobicContact CD2-CE2 4.23Å; L1119-Y1258 WeakPolarHBondContact CG-OH 3.4Å
1259	S	26	Very low	26.6	Very low	99 Å²	99	133.1 Å²	133.1	69%	0.692	69%	0.691	S	S	*	*	S	Bend	trans	-134.4	47.4	178.5	66.7	0	0	0	0	112.8
1260	H	26.1	Very low	26.8	Very low	179 Å²	179	134.9 Å²	134.9	83%	0.829	69%	0.693	S	S	*	*			trans	-174.3	85.9	161.9	-106.9	66.4	0	0	0	109.8
1261	Y	27.4	Very low	27.1	Very low	113 Å²	113	137.9 Å²	137.9	44%	0.443	69%	0.694	S	S	.	*			trans	-139.8	44.6	169	-79.2	-60	0	0	0	112.7	Y1257 Y1263	Y1257-Y1261 WeakPolarHBondContact O-CE2 3.26Å; Y1261-Y1263 HydrophobicContact CD1-CD2 4.15Å; Y1261-Y1263 AromaticContact CD1-CE2 3.71Å; Y1261-Y1263 HydrophobicContact CD1-CE2 3.71Å; Y1261-Y1263 AromaticContact CE1-CE2 3.91Å; Y1261-Y1263 HydrophobicContact CE1-CE2 3.91Å
1262	H	25.8	Very low	26.9	Very low	182 Å²	182	138.1 Å²	138.1	84%	0.843	70%	0.697	S	S	*	*			trans	-82.7	122	142.7	-91.4	-21.6	0	0	0	107.4	P1264	H1262-P1264 VanDerWaalsContact O-CD 3.25Å; H1262-P1264 WeakPolarHBondContact O-CD 3.42Å
1263	Y	27	Very low	27.2	Very low	151 Å²	151	136.3 Å²	136.3	59%	0.592	69%	0.694	S	S	*	*			trans	-100.1	103.5	172	-98.4	-72.4	0	0	0	109.8	Y1261 Y1265	Y1261-Y1263 HydrophobicContact CD1-CD2 4.15Å; Y1261-Y1263 AromaticContact CD1-CE2 3.71Å; Y1261-Y1263 HydrophobicContact CD1-CE2 3.71Å; Y1261-Y1263 AromaticContact CE1-CE2 3.91Å; Y1261-Y1263 HydrophobicContact CE1-CE2 3.91Å; Y1263-Y1265 AromaticContact CD1-CD2 3.82Å; Y1263-Y1265 HydrophobicContact CD1-CD2 3.82Å; Y1263-Y1265 AromaticContact CD1-CE2 3.45Å; Y1263-Y1265 HydrophobicContact CD1-CE2 3.45Å; Y1263-Y1265 VanDerWaalsContact CD1-CE2 3.45Å; Y1263-Y1265 AromaticContact CE1-CE2 3.71Å; Y1263-Y1265 HydrophobicContact CE1-CE2 3.71Å; Y1263-Y1265 HydrophobicContact CG-CD2 4.33Å; Y1263-Y1265 HydrophobicContact CG-CE2 4.22Å; Y1263-Y1265 PolarHBondContact O-N 2.9Å
1264	P	25.9	Very low	27.3	Very low	121 Å²	121	132.4 Å²	132.4	79%	0.786	69%	0.685	S	S	*	*			trans	-84.7	88.7	165.5	33.2	-31.6	0	0	0	109.5	H1262 G1266	H1262-P1264 VanDerWaalsContact O-CD 3.25Å; H1262-P1264 WeakPolarHBondContact O-CD 3.42Å; P1264-G1266 PolarHBondContact O-N 2.89Å; P1264-G1266 VanDerWaalsContact O-N 3.11Å
1265	Y	31	Very low	27.4	Very low	185 Å²	185	136.6 Å²	136.6	73%	0.725	69%	0.69	S	S	*	*			trans	-81	86.2	169.6	-97.3	-74.8	0	0	0	110.5	Y1263	Y1263-Y1265 AromaticContact CD1-CD2 3.82Å; Y1263-Y1265 HydrophobicContact CD1-CD2 3.82Å; Y1263-Y1265 AromaticContact CD1-CE2 3.45Å; Y1263-Y1265 HydrophobicContact CD1-CE2 3.45Å; Y1263-Y1265 VanDerWaalsContact CD1-CE2 3.45Å; Y1263-Y1265 AromaticContact CE1-CE2 3.71Å; Y1263-Y1265 HydrophobicContact CE1-CE2 3.71Å; Y1263-Y1265 HydrophobicContact CG-CD2 4.33Å; Y1263-Y1265 HydrophobicContact CG-CE2 4.22Å; Y1263-Y1265 PolarHBondContact O-N 2.9Å
1266	G	23.4	Very low	27.6	Very low	73 Å²	73	139.4 Å²	139.4	75%	0.753	70%	0.699	S	S	*	*			trans	-95	117.7	169.6	0	0	0	0	0	111.8	P1264	P1264-G1266 PolarHBondContact O-N 2.89Å; P1264-G1266 VanDerWaalsContact O-N 3.11Å
1267	I	30.9	Very low	27.7	Very low	154 Å²	154	142.3 Å²	142.3	79%	0.79	72%	0.719	S	S	*	*			trans	-132.5	122.8	161.7	-58.1	177.6	0	0	0	103.1
1268	G	26.4	Very low	27.8	Very low	58 Å²	58	138.5 Å²	138.5	60%	0.598	72%	0.722	S	S	*	*				69.7	109.8	88.4	0	0	0	0	0	109.3
1269	D	29.2	Very low	27.9	Very low	157 Å²	157	138.4 Å²	138.4	84%	0.84	73%	0.732	S	S	*	*			cis	-147.2	169.4	26.7	-80.7	-49.8	0	0	0	115.7
1270	N	28.4	Very low	28	Very low	128 Å²	128	140.6 Å²	140.6	68%	0.684	73%	0.734	S	S	*	*			trans	-35.6	135.1	174.7	-50.8	-88.6	0	0	0	116.8
1271	Y	30.6	Very low	28.3	Very low	217 Å²	217	137.9 Å²	137.9	85%	0.851	73%	0.73	S	S	*	*				-145.5	117.1	128.8	-99.6	-76	0	0	0	110.9
1272	N	24.6	Very low	28.4	Very low	146 Å²	146	139 Å²	139	78%	0.781	74%	0.744	S	S	*	*			trans	-88.4	156.2	167.4	-100.5	-54.4	0	0	0	109.8
1273	V	29.9	Very low	28.4	Very low	114 Å²	114	135.1 Å²	135.1	69%	0.691	74%	0.736	S	S	*	*			trans	157.1	110.5	132.9	157.7	0	0	0	0	111.6
1274	Q	28.9	Very low	28.5	Very low	156 Å²	156	134.7 Å²	134.7	73%	0.729	74%	0.744	S	S	*	*			trans	57.3	152	136.7	-59.8	176.8	-16.9	0	0	119.9
1275	Q	28	Very low	28.6	Very low	141 Å²	141	136.7 Å²	136.7	66%	0.659	74%	0.743	S	S	*	*			cis	-161.6	-176.4	-2.7	-121.2	163.1	-2.5	0	0	110.2
1276	H	29.1	Very low	28.6	Very low	173 Å²	173	135.9 Å²	135.9	80%	0.801	75%	0.75	S	S	*	*			trans	82.8	96.5	-179.1	-60.9	-80.5	0	0	0	114.7
1277	V	27.3	Very low	28.9	Very low	130 Å²	130	137.4 Å²	137.4	79%	0.788	75%	0.745	S	S	*	*			cis	78.6	97.7	44.8	-173.6	0	0	0	0	113.6
1278	A	30.5	Very low	28.8	Very low	89 Å²	89	136.3 Å²	136.3	74%	0.736	75%	0.745	S	S	*	*			trans	-162.2	117.1	133.4	0	0	0	0	0	110.6
1279	N	29.2	Very low	29	Very low	141 Å²	141	140 Å²	140	75%	0.754	76%	0.757	S	S	*	*			trans	37.1	114.8	155.1	-52.4	-7.2	0	0	0	119.6
1280	I	27.9	Very low	29.2	Very low	144 Å²	144	138.4 Å²	138.4	74%	0.738	75%	0.753	S	S	*	*				76.5	103.7	51.4	-56	161.6	0	0	0	113.7
1281	T	32.6	Very low	29.3	Very low	123 Å²	123	134.8 Å²	134.8	76%	0.755	74%	0.738	S	S	*	*			trans	168.6	104.2	134.2	30.2	0	0	0	0	107.1
1282	D	29.9	Very low	29.4	Very low	137 Å²	137	129 Å²	129	73%	0.733	72%	0.718	S	S	*	*				70.2	104.8	94.3	-61.3	-40	0	0	0	112.7
1283	C	26.4	Very low	29.8	Very low	99 Å²	99	125.5 Å²	125.5	67%	0.669	70%	0.697	S	S	*	*			cis	87	123.2	19.6	-149.3	0	0	0	0	116
1284	N	27.7	Very low	29.9	Very low	143 Å²	143	125 Å²	125	77%	0.765	69%	0.688	S	S	*	*			trans	71.9	160.1	175.6	-39	-70.2	0	0	0	115.1
1285	Q	28.7	Very low	30.1	Very low	162 Å²	162	124.9 Å²	124.9	76%	0.757	69%	0.685	S	S	*	*			cis	-145.8	150.9	17.9	-59.5	174.2	9.5	0	0	113.4
1286	L	30	Very low	30.4	Very low	168 Å²	168	123.2 Å²	123.2	88%	0.88	68%	0.681	S	S	*	*			trans	-146.3	69.8	148.9	-94.4	173.7	0	0	0	106.8
1287	T	31.3	Very low	30.6	Very low	105 Å²	105	121.9 Å²	121.9	64%	0.644	68%	0.675	S	S	*	*				84.3	120.1	95.2	51.8	0	0	0	0	113.9
1288	T	28	Very low	31	Very low	131 Å²	131	121.4 Å²	121.4	80%	0.804	67%	0.668	S	S	*	*			trans	-116.4	168.3	-174.8	52.5	0	0	0	0	111.2
1289	T	31.1	Very low	31.1	Very low	137 Å²	137	122 Å²	122	84%	0.84	67%	0.666	S	S	*	*			trans	171.9	150.6	150.6	30.6	0	0	0	0	108.1
1290	T	32	Very low	31.4	Very low	123 Å²	123	120.7 Å²	120.7	76%	0.755	66%	0.663	S	S	*	*			cis	-153.5	164.7	34.6	45.1	0	0	0	0	113.9
1291	S	32.4	Very low	31.6	Very low	52 Å²	52	123.9 Å²	123.9	36%	0.364	67%	0.666	S	S	.	*			trans	83.6	163.4	151.2	85.7	0	0	0	0	121.6	K34 P35	K34-S1291 VanDerWaalsContact CE-O 3.26Å; K34-S1291 WeakPolarHBondContact CE-O 3.3Å; K34-S1291 WeakPolarHBondContact CE-OG 3.37Å; K34-S1291 WeakPolarHBondContact CG-O 3.42Å; K34-S1291 PolarHBondContact NZ-OG 3.3Å; P35-S1291 WeakPolarHBondContact CD-O 3.32Å
1292	H	32.5	Very low	31.7	Very low	94 Å²	94	122.4 Å²	122.4	44%	0.435	66%	0.661	S	S	.	*				-153	122.6	-81.5	-92.4	-57.2	0	0	0	110.5	K34 P35 N36	K34-H1292 VanDerWaalsContact CE-N 3.34Å; P35-H1292 CarbonylContact O-C 3.58Å; P35-H1292 WeakPolarHBondContact O-CA 3.32Å; P35-H1292 PolarHBondContact O-ND1 3.07Å; N36-H1292 WeakPolarHBondContact OD1-CB 3.45Å; N36-H1292 PolarHBondContact OD1-ND1 3.31Å
1293	Q	33	Very low	31.8	Very low	73 Å²	73	122.9 Å²	122.9	34%	0.341	66%	0.663	S	S	.	*			trans	6.5	-169.3	-176.4	-106.5	168.8	30	0	0	123.6	K34 P35	K34-Q1293 WeakPolarHBondContact O-CA 3.36Å; K34-Q1293 VanDerWaalsContact O-CG 3.24Å; K34-Q1293 WeakPolarHBondContact O-CG 3.45Å; P35-Q1293 VanDerWaalsContact C-CD 3.49Å; P35-Q1293 VanDerWaalsContact C-CG 3.41Å; P35-Q1293 WeakPolarHBondContact O-CB 3.01Å; P35-Q1293 WeakPolarHBondContact O-CG 3.39Å; P35-Q1293 PolarHBondContact O-N 3.18Å
1294	M	32.1	Very low	32.1	Very low	104 Å²	104	123.4 Å²	123.4	51%	0.512	67%	0.667	S	S	.	*			cis	-150.5	145	9.9	-112.4	-153.7	-174.3	0	0	113.5
1295	K	33.4	Very low	32.3	Very low	153 Å²	153	122 Å²	122	67%	0.665	66%	0.663	S	S	*	*			trans	64.2	158.8	137.1	-68.6	-170.5	-179.8	161.5	0	121.1
1296	N	33.6	Very low	32.6	Very low	106 Å²	106	123.3 Å²	123.3	57%	0.567	67%	0.667	S	S	*	*			cis	-161.5	154.2	-5.6	-122.5	8.7	0	0	0	113.1
1297	E	33.9	Very low	32.8	Very low	145 Å²	145	121.8 Å²	121.8	68%	0.678	66%	0.664	S	S	*	*			trans	60	151.9	139.5	-68.8	177.3	-148.2	0	0	121.7
1298	N	34.3	Very low	32.7	Very low	120 Å²	120	122.9 Å²	122.9	64%	0.642	67%	0.671	S	S	*	*			cis	-154.4	164.8	-3.6	-125.3	-32.4	0	0	0	114.3
1299	C	33.3	Very low	33.1	Very low	102 Å²	102	123.5 Å²	123.5	69%	0.689	68%	0.675	S	S	*	*			trans	3.9	157.7	158.5	-61.9	0	0	0	0	123.2
1300	T	35.8	Very low	33	Very low	113 Å²	113	121 Å²	121	69%	0.693	66%	0.663	S	S	*	*			cis	-169.1	-157.5	-22.4	40.6	0	0	0	0	105.9
1301	R	32	Very low	33.1	Very low	211 Å²	211	124 Å²	124	80%	0.796	67%	0.67	S	S	*	*			cis	-168	148.8	5.4	-148.6	176.1	-171.4	133.8	-0.8	111.4
1302	S	34.9	Very low	33.1	Very low	92 Å²	92	132.7 Å²	132.7	64%	0.643	70%	0.702	S	S	*	*			trans	59	155.6	149.2	54.7	0	0	0	0	120.9
1303	N	32.1	Very low	33.1	Very low	147 Å²	147	134.7 Å²	134.7	79%	0.786	72%	0.715	S	S	*	*			cis	-167.3	169.5	-17	-103.3	-2.7	0	0	0	109.4
1304	C	32.2	Very low	33.1	Very low	110 Å²	110	137.9 Å²	137.9	74%	0.743	74%	0.735	S	S	*	*			trans	71	154.1	156.5	-74.4	0	0	0	0	119
1305	T	31.5	Very low	33.2	Very low	113 Å²	113	139.8 Å²	139.8	69%	0.693	75%	0.747	S	S	*	*			cis	179.1	160.2	-45.5	29.9	0	0	0	0	108.5
1306	K	34.5	Very low	33.1	Very low	191 Å²	191	139 Å²	139	83%	0.83	75%	0.752	S	S	*	*			trans	78.9	146.3	174	-51.1	178.6	-177.9	179	0	114.3
1307	T	34.2	Very low	33.1	Very low	135 Å²	135	141.1 Å²	141.1	83%	0.828	76%	0.763	S	S	*	*			cis	-151.1	155	-6.5	3.9	0	0	0	0	110.3
1308	V	30.3	Very low	33.1	Very low	128 Å²	128	140.8 Å²	140.8	78%	0.776	77%	0.769	S	S	*	*			trans	-103	139.8	172.6	175.2	0	0	0	0	110
1309	T	35.3	Very low	33	Very low	145 Å²	145	142.3 Å²	142.3	89%	0.89	78%	0.778	S	S	*	*			trans	-148.4	127	152.9	32.4	0	0	0	0	108.8
1310	S	30.7	Very low	32.9	Very low	84 Å²	84	145.4 Å²	145.4	59%	0.587	79%	0.785	S	S	*	*			trans	-88.4	166.9	178.8	58.2	0	0	0	0	112.5
1311	M	33.1	Very low	32.7	Very low	185 Å²	185	148.1 Å²	148.1	91%	0.911	79%	0.793	S	S	*	*			trans	156	110.3	148	-89.2	-177.6	-170.3	0	0	107.9
1312	K	31.8	Very low	32.8	Very low	236 Å²	236	142.4 Å²	142.4	100%	1.026	79%	0.792	S	S	*	*			cis	-121.5	0	-5.2	-78.3	-175.2	170.7	-172.2	0	109.9

Retrieved 1,312 of 1,312 residues in 905.5 ms (Link to these results)

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