A0A5K4FEJ0_SCHMA Loading...

Serine/threonine-protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FEJ0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 915 aa.

						>A0A5K4FEJ0_SCHMA|A0A5K4FEJ0
MEQDLSPTHSCTPPEPPVRSSSTMHRHPLKVAPKKPLPDLPKKAGRSRIRLFRLPKLTSDPKISSPLCVSHELHVVYDENTGEFRGMPEEWLEWLHAADISFQEREQNPELVIEVLQCYDTAKHRARRQKFIMTEEHCWENFENTTSCVCHQFINNEVSANHTCRKFQYNSADSTSSNAISGDSPCSDLSSPSNSCQFSCTSTTKNIPPSAPRRPPPVPPHYFVTHRQDGDKNLEGDKNNNEVLTIERTKSDSHLEQKSLSGNDICFVDANVDSEHESISFQILNLHHRFKASNECIDCESIRSYSNIFYSSLPLDGTKQTEKLDRNESAFQTIDHFNDNDENSDKKSTCETDLCTGQTLNNTLLGSSLNETNRFIIEEEPYGVEEIDVYESEKLFDTIATNRTCQPVTEMEISSQNHLSLISSTNWQIFCCISEAAFTSNIIDSSSTGLRICLAQPELDEDTHLTESIEADQNGSHTSEATQKPIFPDNGSNASQSTSSVELKSISEMLSNGEDITTTSELPSESVGPQRGRTVTRCNVVQTRTKRSAVHSGRQSAVSLKNSPKLLAISRNLGPSITPSDTSFPGDGNGFQSPNPPVCLVSRHSPSCRSRIRMRDEQIIARLRTIVSHGKPSEKYETLGRIGHGASGVVYIGRELQSGCRVAIKQMSLRQQPRKELILNEILVMRTYRNPNVVNYLDSYLLGDELWVVMEYLDGGSLTDVITETCMNESHIATVCRETLQALKFLHSKHVIHRDIKSDNILLGLDGSVKLTDFGFCAQLSAKNDDFKRTTMVGTPYWMAPEVVSRKQYGHKIDIWSLGIMTLEMLEGEPPYLSENPLKALYLIATNGKPDFRKDNLSPELLNFLDRCLEVDAQSRANASELIEHPFIQQNARPVITLIPLILLAREQAQSVTET
					

Structure Viewer

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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	39.8	Very low	41.4	Very low	241 Å²	241	147.2 Å²	147.2	100%	1.187	81%	0.814	S	S	*	*				0	160.4	0	-70	164.9	178.1	0	0	107.3
2	E	39.1	Very low	42.3	Very low	165 Å²	165	144.6 Å²	144.6	77%	0.771	81%	0.805	S	S	*	*			trans	-11.4	144.2	167.6	-66.4	172.8	109.6	0	0	118.2
3	Q	39.8	Very low	43.5	Very low	143 Å²	143	141.1 Å²	141.1	67%	0.668	79%	0.793	S	S	*	*			cis	-156.5	165.6	13.5	-119	155.2	32.1	0	0	111.3
4	D	41.4	Very low	45.1	Very low	136 Å²	136	139.9 Å²	139.9	73%	0.727	79%	0.794	S	S	*	*			trans	42.6	113.2	154.7	-55.4	-13.6	0	0	0	121.6
5	L	43.7	Very low	46.1	Very low	177 Å²	177	142.3 Å²	142.3	93%	0.927	80%	0.796	S	S	*	*				-169.8	155	101.6	-97.8	168.2	0	0	0	111.9
6	S	42.8	Very low	46.5	Very low	105 Å²	105	139.7 Å²	139.7	73%	0.734	79%	0.787	S	S	*	*			trans	-150.3	173.1	-171.1	71.4	0	0	0	0	110.7
7	P	43.4	Very low	47.5	Very low	99 Å²	99	138.8 Å²	138.8	64%	0.643	79%	0.788	S	S	*	*			cis	-130.4	-169.8	-20.6	35.6	-16.8	0	0	0	113.2
8	T	36.3	Very low	47.6	Very low	129 Å²	129	137.6 Å²	137.6	79%	0.791	78%	0.784	S	S	*	*			trans	-32.3	137.1	164.6	52.9	0	0	0	0	117.3
9	H	45.8	Very low	47.3	Very low	183 Å²	183	143.2 Å²	143.2	85%	0.847	79%	0.791	S	S	*	*			trans	-130.8	119.5	156.3	-90.8	-89.7	0	0	0	111.1
10	S	40.6	Very low	46.8	Very low	109 Å²	109	141.7 Å²	141.7	76%	0.762	79%	0.791	S	S	*	*			trans	-82	121.4	167.4	52.5	0	0	0	0	109.8
11	C	42.1	Very low	46.3	Very low	132 Å²	132	140 Å²	140	89%	0.892	79%	0.789	S	S	*	*			trans	-96.8	98.4	177.7	-162.8	0	0	0	0	110.7
12	T	52.4	Low	46.1	Very low	116 Å²	116	134.2 Å²	134.2	71%	0.712	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-79.9	140	166	48.7	0	0	0	0	110.2
13	P	58.8	Low	46.1	Very low	99 Å²	99	133.2 Å²	133.2	64%	0.643	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-63.4	155.3	175.1	26.9	-34.1	0	0	0	111.9
14	P	65.7	Low	45.9	Very low	125 Å²	125	133.8 Å²	133.8	81%	0.812	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-71	141.7	-177.6	29.2	-34.9	0	0	0	112.6
15	E	59.1	Low	45.8	Very low	176 Å²	176	136.7 Å²	136.7	82%	0.822	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-67	132.2	179.9	-169	175.9	-155.6	0	0	111.7
16	P	53.7	Low	45.5	Very low	100 Å²	100	137.5 Å²	137.5	65%	0.649	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-68.8	147.9	-175.8	26.5	-34.7	0	0	0	112.7	V18	P16-V18 PolarHBondContact O-N 3.48Å; P16-V18 VanDerWaalsContact O-N 3.14Å
17	P	62.5	Low	45.6	Very low	125 Å²	125	139.6 Å²	139.6	81%	0.812	78%	0.779	S	S	*	*			trans	-66.5	114.2	-169.8	24.9	-34.4	0	0	0	113.2	R19	P17-R19 PolarHBondContact O-N 3.16Å
18	V	50.5	Low	45.4	Very low	117 Å²	117	139.7 Å²	139.7	71%	0.709	78%	0.78	S	S	*	*			trans	-63	100.6	-177.7	-176.8	0	0	0	0	111.8	P16 S20	P16-V18 PolarHBondContact O-N 3.48Å; P16-V18 VanDerWaalsContact O-N 3.14Å; V18-S20 VanDerWaalsContact C-N 3.26Å; V18-S20 PolarHBondContact O-N 3.21Å
19	R	41.4	Very low	45.5	Very low	244 Å²	244	140 Å²	140	92%	0.921	78%	0.776	S	S	*	*			trans	-77.4	70.9	-178.1	-155.4	173.5	-164.3	159.7	5.6	112.1	P17 S21	P17-R19 PolarHBondContact O-N 3.16Å; R19-S21 PolarHBondContact O-N 3.4Å
20	S	37.1	Very low	45.4	Very low	113 Å²	113	140.1 Å²	140.1	79%	0.79	77%	0.774	S	S	*	*			trans	-57.2	117.9	-176	-65.4	0	0	0	0	113	V18	V18-S20 VanDerWaalsContact C-N 3.26Å; V18-S20 PolarHBondContact O-N 3.21Å
21	S	36.8	Very low	45.5	Very low	107 Å²	107	141.6 Å²	141.6	75%	0.748	78%	0.778	S	S	*	*			trans	-115.3	127.7	172.7	60.2	0	0	0	0	112	R19	R19-S21 PolarHBondContact O-N 3.4Å
22	S	35.2	Very low	45.6	Very low	118 Å²	118	139.1 Å²	139.1	83%	0.825	77%	0.767	S	S	*	*			trans	43.5	101.3	155.2	-60.4	0	0	0	0	119.5
23	T	39	Very low	45.4	Very low	144 Å²	144	140 Å²	140	88%	0.883	78%	0.775	S	S	*	*			trans	-150.2	145.3	130.2	-71.3	0	0	0	0	109.8
24	M	36.6	Very low	44.4	Very low	155 Å²	155	145 Å²	145	76%	0.764	79%	0.787	S	S	*	*			trans	-68.6	154.6	-179.3	-50.5	-176.3	77.8	0	0	112.6
25	H	38.3	Very low	43.5	Very low	198 Å²	198	148.4 Å²	148.4	92%	0.917	79%	0.789	S	S	*	*			trans	-148.8	170.8	132	-106.7	75.9	0	0	0	109.8
26	R	38.1	Very low	43	Very low	193 Å²	193	146.2 Å²	146.2	73%	0.728	79%	0.79	S	S	*	*			trans	-128.4	133.6	-143.9	-138.2	-173	167.6	165.3	-0.2	114.4
27	H	43.2	Very low	42.3	Very low	149 Å²	149	149.3 Å²	149.3	69%	0.69	80%	0.8	S	S	*	*			trans	66.7	169.4	147.4	-75.4	-26.2	0	0	0	119.2
28	P	39.9	Very low	41.7	Very low	101 Å²	101	148.8 Å²	148.8	66%	0.656	80%	0.796	S	S	*	*			cis	-137.5	163.5	-29	28.9	-9.1	0	0	0	115.3
29	L	39.2	Very low	41.7	Very low	135 Å²	135	150.2 Å²	150.2	71%	0.707	80%	0.8	S	S	*	*				153.8	124.2	112.7	-81.6	178.7	0	0	0	114.3
30	K	42.8	Very low	42	Very low	186 Å²	186	145.9 Å²	145.9	81%	0.809	79%	0.794	S	S	*	*			trans	60.2	141.6	145.2	-62.3	167.3	177.9	171	0	117.7
31	V	42.9	Very low	42.4	Very low	140 Å²	140	146.5 Å²	146.5	85%	0.848	80%	0.796	S	S	*	*			cis	-130.3	150.7	15.6	177	0	0	0	0	110
32	A	45	Very low	42.5	Very low	80 Å²	80	150 Å²	150	66%	0.661	80%	0.797	S	S	*	*			trans	-131	144.3	169.5	0	0	0	0	0	110.6
33	P	48	Very low	42.7	Very low	135 Å²	135	153.9 Å²	153.9	88%	0.877	80%	0.8	S	S	*	*			trans	-74.2	146.8	-178.1	30.4	-34.9	0	0	0	112.4
34	K	38	Very low	42.8	Very low	205 Å²	205	151.8 Å²	151.8	89%	0.891	80%	0.797	S	S	*	*			trans	-106.3	102.5	-178.9	-66.3	179.7	179.9	178.8	0	112.2
35	K	45.6	Very low	42.8	Very low	196 Å²	196	147.5 Å²	147.5	85%	0.852	79%	0.792	S	S	*	*			trans	-143.6	126.1	150.1	-74	-169.3	179.6	177.6	0	108.6
36	P	49.2	Very low	43	Very low	130 Å²	130	150 Å²	150	84%	0.844	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-76.8	139.7	172.8	31.5	-32.6	0	0	0	110.6
37	L	40.2	Very low	43	Very low	165 Å²	165	146.4 Å²	146.4	86%	0.864	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-91.6	159.5	164.7	-75.7	166.4	0	0	0	110
38	P	49	Very low	43	Very low	114 Å²	114	148.9 Å²	148.9	74%	0.74	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-80.4	155.9	-157.5	-15.8	32.3	0	0	0	115.7
39	D	51	Low	43.4	Very low	147 Å²	147	152 Å²	152	79%	0.786	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-64	132.3	168	-91.8	-14.5	0	0	0	111.4
40	L	47.7	Very low	43.5	Very low	152 Å²	152	154.4 Å²	154.4	80%	0.796	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-72.6	150.6	169.3	-83.8	98.7	0	0	0	112.1
41	P	45.4	Very low	43.5	Very low	127 Å²	127	152.3 Å²	152.3	83%	0.825	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-74.5	140.7	-159.7	27.5	-35.9	0	0	0	115.2
42	K	38.7	Very low	43.6	Very low	179 Å²	179	154.2 Å²	154.2	78%	0.778	80%	0.804	S	S	*	*			trans	-105.7	113	174.8	-64.5	169	-175.1	157.9	0	111.5
43	K	39.9	Very low	43.3	Very low	201 Å²	201	161.8 Å²	161.8	87%	0.874	82%	0.816	S	S	*	*			trans	-167.3	124.5	157.6	-100.1	146.6	-174.6	-179.6	0	107.1
44	A	40.4	Very low	43.5	Very low	100 Å²	100	162.6 Å²	162.6	83%	0.826	81%	0.812	S	S	*	*				66	131.1	83.5	0	0	0	0	0	113.2
45	G	37.3	Very low	44	Very low	64 Å²	64	158.6 Å²	158.6	66%	0.66	81%	0.807	S	S	*	*			cis	153.5	144.9	-3.3	0	0	0	0	0	112.1
46	R	41.7	Very low	44.2	Very low	251 Å²	251	158.4 Å²	158.4	95%	0.947	81%	0.806	S	S	*	*			trans	74.2	155.9	-161.1	-53.9	172.8	165.5	163.1	-6.3	111.6
47	S	39.1	Very low	43.9	Very low	118 Å²	118	160 Å²	160	83%	0.825	81%	0.806	S	S	*	*			cis	-124.9	159.3	8.7	-67.4	0	0	0	0	112.4
48	R	42.1	Very low	44.1	Very low	201 Å²	201	158.5 Å²	158.5	76%	0.758	81%	0.805	S	S	*	*			trans	-92.3	133.7	173.2	-52.1	177.7	-166.6	123.7	0.2	110
49	I	48.1	Very low	44.5	Very low	167 Å²	167	157.3 Å²	157.3	86%	0.856	80%	0.799	S	S	*	*			trans	-98.9	141.6	144.4	-61.8	178.2	0	0	0	106.4
50	R	42.2	Very low	44.7	Very low	184 Å²	184	157.3 Å²	157.3	69%	0.694	80%	0.799	S	S	*	*			trans	-128.5	102.9	-179.6	-79.5	-179.9	170.3	174.5	-3.4	109.1
51	L	42	Very low	45.3	Very low	142 Å²	142	155.7 Å²	155.7	74%	0.743	80%	0.798	S	S	*	*			trans	-110.6	146.3	155.6	-106.3	69	0	0	0	109.6
52	F	45.7	Very low	46.1	Very low	181 Å²	181	159.4 Å²	159.4	79%	0.794	80%	0.801	S	S	*	*			trans	14.7	110.9	172.8	-51.6	-69	0	0	0	119.5	L54	F52-L54 PolarHBondContact O-N 3.46Å
53	R	38.4	Very low	47.3	Very low	238 Å²	238	158.5 Å²	158.5	90%	0.898	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-75.1	116.8	163.1	-75	173.3	166.7	168.4	-9	110.2
54	L	51.8	Low	49.1	Very low	152 Å²	152	153 Å²	153	80%	0.796	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-74.2	155.9	145.8	-81.3	88.8	0	0	0	109.9	F52	F52-L54 PolarHBondContact O-N 3.46Å
55	P	47.9	Very low	50.7	Low	121 Å²	121	152.6 Å²	152.6	79%	0.786	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-63.9	141.1	173.2	-18.8	32.3	0	0	0	111.4	L57	P55-L57 PolarHBondContact O-N 3.22Å; P55-L57 VanDerWaalsContact O-N 3.16Å
56	K	49.6	Very low	52.3	Low	192 Å²	192	154.6 Å²	154.6	84%	0.835	78%	0.782	S	S	*	*			trans	-69.2	110.2	169.3	-78.8	-166.1	170.3	-162.4	0	109.9	T58	K56-T58 HydrophobicContact CB-CG2 4.41Å; K56-T58 PolarHBondContact O-N 3.36Å
57	L	43.5	Very low	53.6	Low	163 Å²	163	149.7 Å²	149.7	85%	0.853	77%	0.774	S	S	*	*			trans	-63.3	112	158.7	-93.3	150.6	0	0	0	108.2	P55 S59	P55-L57 PolarHBondContact O-N 3.22Å; P55-L57 VanDerWaalsContact O-N 3.16Å; L57-S59 VanDerWaalsContact C-N 3.32Å; L57-S59 PolarHBondContact O-N 2.63Å
58	T	44.2	Very low	54.5	Low	135 Å²	135	150.2 Å²	150.2	83%	0.828	78%	0.776	S	S	*	*			trans	-93.2	59.7	-173.5	40.5	0	0	0	0	111.6	K56	K56-T58 HydrophobicContact CB-CG2 4.41Å; K56-T58 PolarHBondContact O-N 3.36Å
59	S	57.5	Low	54.9	Low	88 Å²	88	145.1 Å²	145.1	62%	0.615	77%	0.767	S	S	*	*			trans	-159.6	100.4	171.2	56.6	0	0	0	0	111.1	L57	L57-S59 VanDerWaalsContact C-N 3.32Å; L57-S59 PolarHBondContact O-N 2.63Å
60	D	55	Low	54.7	Low	148 Å²	148	140.3 Å²	140.3	79%	0.791	75%	0.748	S	S	*	*			trans	-60.3	132.5	158.5	-54.5	-57.7	0	0	0	107.7	K62	D60-K62 PolarHBondContact O-N 3.02Å
61	P	60.9	Low	55.2	Low	118 Å²	118	139.1 Å²	139.1	77%	0.766	75%	0.75	S	S	*	*			trans	-69.4	93.3	-175.6	27	-33.9	0	0	0	110.7	I63	P61-I63 VanDerWaalsContact C-N 3.26Å; P61-I63 PolarHBondContact O-N 3.28Å
62	K	62.2	Low	55.8	Low	205 Å²	205	140.6 Å²	140.6	89%	0.891	75%	0.753	S	S	*	*			trans	-69.8	85.1	167.9	-72.8	-172.8	177.1	-177.8	0	109.6	D60 S64	D60-K62 PolarHBondContact O-N 3.02Å; K62-S64 PolarHBondContact O-N 3.33Å
63	I	63.8	Low	56.6	Low	160 Å²	160	136 Å²	136	82%	0.821	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-55.4	122.3	167.5	-57.3	173.8	0	0	0	107.5	P61	P61-I63 VanDerWaalsContact C-N 3.26Å; P61-I63 PolarHBondContact O-N 3.28Å
64	S	77.8	Confident	58.1	Low	86 Å²	86	131.1 Å²	131.1	60%	0.601	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-68.9	152.1	173.9	51.7	0	0	0	0	110.5	K62	K62-S64 PolarHBondContact O-N 3.33Å
65	S	73.6	Confident	59.4	Low	90 Å²	90	125 Å²	125	63%	0.629	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-49.8	137.5	161.7	49.3	0	0	0	0	109.9	L67	S65-L67 PolarHBondContact O-N 2.83Å
66	P	71.5	Confident	60.8	Low	106 Å²	106	122.3 Å²	122.3	69%	0.688	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-61.1	130.4	-177	26.6	-35.1	0	0	0	110.2	V69	P66-V69 HydrophobicContact CB-CG2 3.67Å; P66-V69 HydrophobicContact CG-CG2 3.74Å
67	L	68	Low	62.4	Low	149 Å²	149	114.9 Å²	114.9	78%	0.78	64%	0.64	S	S	*	*	S	Bend	trans	-101.5	142.4	176.4	-60.2	176	0	0	0	108.1	S65	S65-L67 PolarHBondContact O-N 2.83Å
68	C	58.2	Low	64.3	Low	128 Å²	128	107.9 Å²	107.9	87%	0.865	60%	0.604	S	S	*	*	S	Bend	trans	60.3	50.7	-175.7	-159.7	0	0	0	0	113.9	S70	C68-S70 PolarHBondContact O-N 3.13Å
69	V	50.6	Low	66.1	Low	95 Å²	95	109.1 Å²	109.1	58%	0.576	60%	0.601	S	S	*	*			trans	-74.1	103.4	167.4	-179.4	0	0	0	0	109.1	P66	P66-V69 HydrophobicContact CB-CG2 3.67Å; P66-V69 HydrophobicContact CG-CG2 3.74Å
70	S	44.6	Very low	67.2	Low	65 Å²	65	112 Å²	112	46%	0.455	61%	0.609	S	S	.	*			trans	-84.5	132.1	164.8	40.9	0	0	0	0	110	C68 E72	C68-S70 PolarHBondContact O-N 3.13Å; S70-E72 VanDerWaalsContact CB-CG 3.49Å; S70-E72 WeakPolarHBondContact CB-OE1 3.41Å; S70-E72 WeakPolarHBondContact OG-CG 3.13Å; S70-E72 PolarHBondContact OG-OE1 3.33Å
71	H	52.4	Low	68.5	Low	160 Å²	160	107.8 Å²	107.8	74%	0.741	59%	0.589	S	S	*	*			trans	-92.3	95.6	155.3	-75.1	94.2	0	0	0	105.9	L73	H71-L73 PolarHBondContact O-N 3.43Å
72	E	54.4	Low	69.2	Low	173 Å²	173	102.5 Å²	102.5	81%	0.808	56%	0.556	S	S	*	*			trans	-77.7	-10.6	-169.7	-62.7	180	170.7	0	0	113.1	S70	S70-E72 VanDerWaalsContact CB-CG 3.49Å; S70-E72 WeakPolarHBondContact CB-OE1 3.41Å; S70-E72 WeakPolarHBondContact OG-CG 3.13Å; S70-E72 PolarHBondContact OG-OE1 3.33Å
73	L	61.8	Low	70.1	Confident	85 Å²	85	98.7 Å²	98.7	45%	0.445	54%	0.541	S	S	.	.			trans	-137.1	113.3	177.9	-169.4	156.1	0	0	0	108.1	H71 V75 P88 W91	H71-L73 PolarHBondContact O-N 3.43Å; L73-V75 HydrophobicContact CD2-CG2 3.78Å; L73-V75 HydrophobicContact CG-CG2 4.39Å; L73-P88 HydrophobicContact CD1-CG 3.54Å; L73-P88 HydrophobicContact CG-CG 4.08Å; L73-W91 HydrophobicContact CD1-CH2 4.13Å; L73-W91 HydrophobicContact CD1-CZ2 4.02Å; L73-W91 HydrophobicContact CD2-CH2 3.88Å; L73-W91 HydrophobicContact CD2-CZ3 4.2Å
74	H	71.1	Confident	71	Confident	134 Å²	134	92 Å²	92	62%	0.62	51%	0.506	S	S	*	.			trans	-143	74.8	-179.5	-175	-75.8	0	0	0	108.8	V76	H74-V76 WeakPolarHBondContact CE1-CG2 3.19Å; H74-V76 VanDerWaalsContact ND1-CG2 3.25Å; H74-V76 WeakPolarHBondContact ND1-CG2 3.39Å
75	V	78.3	Confident	71.2	Confident	23 Å²	23	95.3 Å²	95.3	14%	0.139	51%	0.505	C	S	.	.			trans	-71.1	131.7	178.3	-168.7	0	0	0	0	109.4	L73 F84 R85 M87 W91 I113	L73-V75 HydrophobicContact CD2-CG2 3.78Å; L73-V75 HydrophobicContact CG-CG2 4.39Å; V75-F84 HydrophobicContact CG1-CB 3.93Å; V75-F84 HydrophobicContact CG1-CD1 3.99Å; V75-F84 HydrophobicContact CG1-CG 4.29Å; V75-R85 WeakPolarHBondContact CA-O 3.41Å; V75-M87 HydrophobicContact CG1-CB 4.14Å; V75-M87 HydrophobicContact CG1-CE 3.76Å; V75-W91 HydrophobicContact CG2-CE3 4.11Å; V75-W91 HydrophobicContact CG2-CZ3 3.77Å; V75-I113 HydrophobicContact CB-CD1 4.49Å; V75-I113 HydrophobicContact CG1-CD1 4.15Å; V75-I113 HydrophobicContact CG1-CG1 4.24Å
76	V	77.7	Confident	71.6	Confident	65 Å²	65	93.6 Å²	93.6	39%	0.394	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	132.1	176.9	-171.2	0	0	0	0	108.7	H74 F84 R85	H74-V76 WeakPolarHBondContact CE1-CG2 3.19Å; H74-V76 VanDerWaalsContact ND1-CG2 3.25Å; H74-V76 WeakPolarHBondContact ND1-CG2 3.39Å; V76-F84 CarbonylContact O-C 3.29Å; V76-F84 WeakPolarHBondContact O-CA 3.43Å; V76-R85 PolarHBondContact N-O 3.39Å; V76-R85 PolarHBondContact O-N 3.34Å
77	Y	83.3	Confident	72	Confident	36 Å²	36	89.5 Å²	89.5	14%	0.141	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	126	168.3	-172.2	-105.2	0	0	0	110.1	G82 F84 E106 P109	Y77-G82 WeakPolarHBondContact CE2-O 3.4Å; Y77-G82 VanDerWaalsContact OH-CA 3.23Å; Y77-G82 WeakPolarHBondContact OH-CA 3.45Å; Y77-F84 AromaticContact CD2-CD1 3.89Å; Y77-F84 HydrophobicContact CD2-CD1 3.89Å; Y77-F84 AromaticContact CD2-CE1 3.63Å; Y77-F84 HydrophobicContact CD2-CE1 3.63Å; Y77-F84 HydrophobicContact CD2-CE2 4.42Å; Y77-F84 HydrophobicContact CD2-CG 4.39Å; Y77-F84 AromaticContact CD2-CZ 3.91Å; Y77-F84 HydrophobicContact CD2-CZ 3.91Å; Y77-F84 HydrophobicContact CG-CD1 4.48Å; Y77-F84 HydrophobicContact CG-CE1 4.24Å; Y77-E106 WeakPolarHBondContact OH-CA 3.46Å; Y77-E106 WeakPolarHBondContact OH-CB 3.42Å; Y77-P109 HydrophobicContact CD1-CB 3.84Å; Y77-P109 HydrophobicContact CD1-CG 3.87Å; Y77-P109 HydrophobicContact CD2-CB 3.56Å; Y77-P109 HydrophobicContact CD2-CG 4.45Å; Y77-P109 HydrophobicContact CE1-CB 4.32Å; Y77-P109 HydrophobicContact CE1-CG 4.21Å; Y77-P109 HydrophobicContact CE2-CB 4.06Å; Y77-P109 HydrophobicContact CG-CB 3.43Å; Y77-P109 VanDerWaalsContact CG-CB 3.43Å; Y77-P109 HydrophobicContact CG-CG 3.99Å
78	D	83.2	Confident	72.8	Confident	17 Å²	17	84.3 Å²	84.3	9%	0.091	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	104	175	-178.5	6	0	0	0	110.6	N80 T81 G82 E83 R85	D78-N80 PolarHBondContact O-N 2.69Å; D78-N80 WeakPolarHBondContact OD1-CB 3.39Å; D78-N80 PolarHBondContact OD1-N 2.61Å; D78-N80 PolarHBondContact OD1-ND2 2.94Å; D78-T81 PolarHBondContact O-N 2.89Å; D78-T81 VanDerWaalsContact O-N 3.09Å; D78-G82 WeakPolarHBondContact O-CA 3.34Å; D78-G82 PolarHBondContact O-N 3.24Å; D78-E83 PolarHBondContact N-O 2.76Å; D78-R85 HydrophobicContact CB-CG 4.14Å; D78-R85 IonicContact OD2-CZ 2.57Å; D78-R85 IonicContact OD2-NE 2.86Å; D78-R85 PolarHBondContact OD2-NE 3.18Å; D78-R85 IonicContact OD2-NH2 2.75Å; D78-R85 PolarHBondContact OD2-NH2 2.96Å
79	E	83.1	Confident	74	Confident	161 Å²	161	85.7 Å²	85.7	75%	0.752	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-21	176.2	-60.6	177.8	174.7	0	0	113.9
80	N	79.6	Confident	75.7	Confident	148 Å²	148	85.8 Å²	85.8	79%	0.791	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-21.8	-177.1	-53.4	-92.2	0	0	0	113.7	D78	D78-N80 PolarHBondContact O-N 2.69Å; D78-N80 WeakPolarHBondContact OD1-CB 3.39Å; D78-N80 PolarHBondContact OD1-N 2.61Å; D78-N80 PolarHBondContact OD1-ND2 2.94Å
81	T	82	Confident	77.8	Confident	60 Å²	60	83.1 Å²	83.1	37%	0.368	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	-18.1	176.3	66.1	0	0	0	0	112.9	D78 E83	D78-T81 PolarHBondContact O-N 2.89Å; D78-T81 VanDerWaalsContact O-N 3.09Å; T81-E83 PolarHBondContact O-N 2.95Å; T81-E83 WeakPolarHBondContact OG1-CB 3.38Å; T81-E83 PolarHBondContact OG1-N 3.46Å
82	G	76.8	Confident	79.4	Confident	7 Å²	7	79.6 Å²	79.6	7%	0.072	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.4	15.9	-169.2	0	0	0	0	0	114.1	Y77 D78 F102	Y77-G82 WeakPolarHBondContact CE2-O 3.4Å; Y77-G82 VanDerWaalsContact OH-CA 3.23Å; Y77-G82 WeakPolarHBondContact OH-CA 3.45Å; D78-G82 WeakPolarHBondContact O-CA 3.34Å; D78-G82 PolarHBondContact O-N 3.24Å; G82-F102 WeakPolarHBondContact O-CE2 3.32Å
83	E	81	Confident	81	Confident	124 Å²	124	76.8 Å²	76.8	58%	0.579	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.5	153.9	-178.2	-58.3	177.8	133.2	0	0	112.2	D78 T81 R85	D78-E83 PolarHBondContact N-O 2.76Å; T81-E83 PolarHBondContact O-N 2.95Å; T81-E83 WeakPolarHBondContact OG1-CB 3.38Å; T81-E83 PolarHBondContact OG1-N 3.46Å; E83-R85 PolarHBondContact O-N 2.85Å
84	F	82.7	Confident	82.2	Confident	21 Å²	21	73.6 Å²	73.6	9%	0.092	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	108	172.5	-65.5	-75.6	0	0	0	111.3	V75 V76 Y77 M87 L95 R105 P109 V112 I113	V75-F84 HydrophobicContact CG1-CB 3.93Å; V75-F84 HydrophobicContact CG1-CD1 3.99Å; V75-F84 HydrophobicContact CG1-CG 4.29Å; V76-F84 CarbonylContact O-C 3.29Å; V76-F84 WeakPolarHBondContact O-CA 3.43Å; Y77-F84 AromaticContact CD2-CD1 3.89Å; Y77-F84 HydrophobicContact CD2-CD1 3.89Å; Y77-F84 AromaticContact CD2-CE1 3.63Å; Y77-F84 HydrophobicContact CD2-CE1 3.63Å; Y77-F84 HydrophobicContact CD2-CE2 4.42Å; Y77-F84 HydrophobicContact CD2-CG 4.39Å; Y77-F84 AromaticContact CD2-CZ 3.91Å; Y77-F84 HydrophobicContact CD2-CZ 3.91Å; Y77-F84 HydrophobicContact CG-CD1 4.48Å; Y77-F84 HydrophobicContact CG-CE1 4.24Å; F84-M87 HydrophobicContact CB-CB 4.14Å; F84-M87 HydrophobicContact CB-CE 3.54Å; F84-M87 HydrophobicContact CB-SD 4.23Å; F84-M87 HydrophobicContact CD1-CE 4.05Å; F84-M87 HydrophobicContact CD2-CE 3.54Å; F84-M87 HydrophobicContact CD2-SD 4.39Å; F84-M87 HydrophobicContact CE2-CE 4.22Å; F84-M87 HydrophobicContact CG-CE 3.45Å; F84-M87 VanDerWaalsContact CG-CE 3.45Å; F84-L95 HydrophobicContact CD2-CD1 4.25Å; F84-L95 HydrophobicContact CE2-CD1 4.24Å; F84-R105 HydrophobicContact CE2-CB 4.02Å; F84-R105 HydrophobicContact CE2-CG 4.11Å; F84-R105 HydrophobicContact CZ-CB 4.42Å; F84-P109 HydrophobicContact CE1-CB 3.98Å; F84-P109 HydrophobicContact CZ-CB 4.1Å; F84-V112 HydrophobicContact CE2-CG1 3.96Å; F84-V112 HydrophobicContact CZ-CB 4.01Å; F84-V112 HydrophobicContact CZ-CG1 3.9Å; F84-I113 HydrophobicContact CD1-CD1 4.03Å; F84-I113 HydrophobicContact CD1-CG1 4.16Å; F84-I113 HydrophobicContact CE1-CD1 3.78Å; F84-I113 HydrophobicContact CE1-CG1 3.75Å
85	R	82.5	Confident	83	Confident	154 Å²	154	67.2 Å²	67.2	58%	0.581	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	138.4	170.9	-64.3	-177.8	179.4	-121.8	5.3	110.2	V75 V76 D78 E83 M87	V75-R85 WeakPolarHBondContact CA-O 3.41Å; V76-R85 PolarHBondContact N-O 3.39Å; V76-R85 PolarHBondContact O-N 3.34Å; D78-R85 HydrophobicContact CB-CG 4.14Å; D78-R85 IonicContact OD2-CZ 2.57Å; D78-R85 IonicContact OD2-NE 2.86Å; D78-R85 PolarHBondContact OD2-NE 3.18Å; D78-R85 IonicContact OD2-NH2 2.75Å; D78-R85 PolarHBondContact OD2-NH2 2.96Å; E83-R85 PolarHBondContact O-N 2.85Å; R85-M87 VanDerWaalsContact C-N 3.31Å; R85-M87 PolarHBondContact O-N 3.28Å
86	G	80.9	Confident	83.3	Confident	55 Å²	55	73.1 Å²	73.1	57%	0.567	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	14.1	176.2	0	0	0	0	0	115.2
87	M	81	Confident	83.8	Confident	20 Å²	20	72.1 Å²	72.1	10%	0.099	37%	0.367	C	S	.	.			trans	-70.9	136.9	172	-170.9	165.3	-77.1	0	0	111	V75 F84 R85 W91 L92 L95 L116	V75-M87 HydrophobicContact CG1-CB 4.14Å; V75-M87 HydrophobicContact CG1-CE 3.76Å; F84-M87 HydrophobicContact CB-CB 4.14Å; F84-M87 HydrophobicContact CB-CE 3.54Å; F84-M87 HydrophobicContact CB-SD 4.23Å; F84-M87 HydrophobicContact CD1-CE 4.05Å; F84-M87 HydrophobicContact CD2-CE 3.54Å; F84-M87 HydrophobicContact CD2-SD 4.39Å; F84-M87 HydrophobicContact CE2-CE 4.22Å; F84-M87 HydrophobicContact CG-CE 3.45Å; F84-M87 VanDerWaalsContact CG-CE 3.45Å; R85-M87 VanDerWaalsContact C-N 3.31Å; R85-M87 PolarHBondContact O-N 3.28Å; M87-W91 HydrophobicContact CE-CE3 4.48Å; M87-W91 HydrophobicContact CG-CB 3.57Å; M87-W91 HydrophobicContact CG-CE3 4.29Å; M87-W91 HydrophobicContact SD-CB 3.98Å; M87-L92 HydrophobicContact CB-CD2 4.29Å; M87-L92 HydrophobicContact CB-CG 4.24Å; M87-L92 HydrophobicContact CG-CD2 4.14Å; M87-L92 HydrophobicContact CG-CG 3.97Å; M87-L92 HydrophobicContact SD-CD2 3.62Å; M87-L92 HydrophobicContact SD-CG 3.97Å; M87-L95 HydrophobicContact CE-CD1 4.03Å; M87-L95 HydrophobicContact SD-CD1 3.74Å; M87-L95 HydrophobicContact SD-CG 4.5Å; M87-L116 HydrophobicContact CE-CD1 3.33Å; M87-L116 HydrophobicContact SD-CD1 3.97Å
88	P	83.6	Confident	84.1	Confident	39 Å²	39	70.5 Å²	70.5	25%	0.253	36%	0.361	S	S	.	.			trans	-60.9	151.1	170.2	-22.7	33.1	0	0	0	112.6	L73 E90 W91 L92	L73-P88 HydrophobicContact CD1-CG 3.54Å; L73-P88 HydrophobicContact CG-CG 4.08Å; P88-E90 PolarHBondContact O-N 2.7Å; P88-W91 HydrophobicContact CB-CB 4.33Å; P88-W91 HydrophobicContact CB-CG 4.2Å; P88-W91 HydrophobicContact CG-CB 4.49Å; P88-W91 HydrophobicContact CG-CD2 4.06Å; P88-W91 HydrophobicContact CG-CE3 4.48Å; P88-W91 HydrophobicContact CG-CG 4.05Å; P88-W91 WeakPolarHBondContact O-CB 3.34Å; P88-W91 PolarHBondContact O-N 2.86Å; P88-L92 PolarHBondContact O-N 3.38Å; P88-L92 VanDerWaalsContact O-N 3.13Å
89	E	84.4	Confident	84.3	Confident	158 Å²	158	75.8 Å²	75.8	74%	0.738	39%	0.389	S	S	*	.	H	α-helix	trans	-58.1	-46.6	176.1	-163.9	161	-149	0	0	111.2	W91 L92 E93	E89-W91 PolarHBondContact O-N 3.07Å; E89-W91 VanDerWaalsContact O-N 3.14Å; E89-L92 WeakPolarHBondContact O-CB 3.38Å; E89-L92 PolarHBondContact O-N 3.41Å; E89-E93 WeakPolarHBondContact O-CG 3.33Å; E89-E93 PolarHBondContact O-N 3.19Å
90	E	86.2	Confident	84.5	Confident	96 Å²	96	68.2 Å²	68.2	45%	0.449	35%	0.354	S	S	.	.	H	α-helix	trans	-53.8	-34.9	173.5	-63.8	-172.2	-138.2	0	0	113.1	P88 W94	P88-E90 PolarHBondContact O-N 2.7Å; E90-W94 HydrophobicContact CB-CZ2 3.86Å; E90-W94 VanDerWaalsContact O-CD2 3.24Å; E90-W94 VanDerWaalsContact O-CE2 3.29Å; E90-W94 PolarHBondContact O-N 3.03Å; E90-W94 VanDerWaalsContact O-N 3.09Å; E90-W94 PolarHBondContact O-NE1 2.98Å; E90-W94 VanDerWaalsContact O-NE1 3.11Å
91	W	88	Confident	84.9	Confident	10 Å²	10	63.5 Å²	63.5	4%	0.038	33%	0.333	C	S	.	.	H	α-helix	trans	-78.2	-32.9	-179.8	-75.4	19.6	0	0	0	112.1	L73 V75 M87 P88 E89 W94 L95 L116 Q117 D120	L73-W91 HydrophobicContact CD1-CH2 4.13Å; L73-W91 HydrophobicContact CD1-CZ2 4.02Å; L73-W91 HydrophobicContact CD2-CH2 3.88Å; L73-W91 HydrophobicContact CD2-CZ3 4.2Å; V75-W91 HydrophobicContact CG2-CE3 4.11Å; V75-W91 HydrophobicContact CG2-CZ3 3.77Å; M87-W91 HydrophobicContact CE-CE3 4.48Å; M87-W91 HydrophobicContact CG-CB 3.57Å; M87-W91 HydrophobicContact CG-CE3 4.29Å; M87-W91 HydrophobicContact SD-CB 3.98Å; P88-W91 HydrophobicContact CB-CB 4.33Å; P88-W91 HydrophobicContact CB-CG 4.2Å; P88-W91 HydrophobicContact CG-CB 4.49Å; P88-W91 HydrophobicContact CG-CD2 4.06Å; P88-W91 HydrophobicContact CG-CE3 4.48Å; P88-W91 HydrophobicContact CG-CG 4.05Å; P88-W91 WeakPolarHBondContact O-CB 3.34Å; P88-W91 PolarHBondContact O-N 2.86Å; E89-W91 PolarHBondContact O-N 3.07Å; E89-W91 VanDerWaalsContact O-N 3.14Å; W91-W94 AromaticContact CD1-CE3 3.77Å; W91-W94 AromaticContact CD1-CH2 3.8Å; W91-W94 AromaticContact CD1-CZ3 3.37Å; W91-W94 HydrophobicContact CG-CE3 4.49Å; W91-W94 HydrophobicContact CG-CZ3 4.39Å; W91-W94 AromaticContact NE1-CH2 3.92Å; W91-W94 AromaticContact NE1-CZ3 3.51Å; W91-W94 PolarHBondContact O-N 3.29Å; W91-L95 WeakPolarHBondContact O-CG 2.83Å; W91-L95 PolarHBondContact O-N 2.88Å; W91-L116 HydrophobicContact CB-CD1 4.45Å; W91-L116 HydrophobicContact CB-CD2 3.89Å; W91-L116 HydrophobicContact CD2-CB 4.15Å; W91-L116 HydrophobicContact CD2-CD2 4.24Å; W91-L116 HydrophobicContact CE3-CB 3.84Å; W91-L116 HydrophobicContact CE3-CD1 3.95Å; W91-L116 HydrophobicContact CE3-CD2 4.47Å; W91-L116 HydrophobicContact CE3-CG 4.34Å; W91-L116 HydrophobicContact CG-CD2 4Å; W91-L116 HydrophobicContact CZ3-CB 4.09Å; W91-Q117 HydrophobicContact CH2-CB 4.45Å; W91-Q117 HydrophobicContact CH2-CG 3.6Å; W91-Q117 HydrophobicContact CZ2-CG 4.37Å; W91-Q117 HydrophobicContact CZ3-CG 4.3Å; W91-D120 HydrophobicContact CZ2-CB 4.14Å
92	L	85.8	Confident	85	Confident	85 Å²	85	65.6 Å²	65.6	45%	0.445	34%	0.337	S	S	.	.	H	α-helix	trans	-67	-40.5	172.2	-68.9	168.1	0	0	0	111	M87 P88 E89 L95 H96	M87-L92 HydrophobicContact CB-CD2 4.29Å; M87-L92 HydrophobicContact CB-CG 4.24Å; M87-L92 HydrophobicContact CG-CD2 4.14Å; M87-L92 HydrophobicContact CG-CG 3.97Å; M87-L92 HydrophobicContact SD-CD2 3.62Å; M87-L92 HydrophobicContact SD-CG 3.97Å; P88-L92 PolarHBondContact O-N 3.38Å; P88-L92 VanDerWaalsContact O-N 3.13Å; E89-L92 WeakPolarHBondContact O-CB 3.38Å; E89-L92 PolarHBondContact O-N 3.41Å; L92-L95 PolarHBondContact O-N 3.47Å; L92-H96 PolarHBondContact O-N 2.86Å; L92-H96 VanDerWaalsContact O-N 3.08Å
93	E	87.4	Confident	85.5	Confident	114 Å²	114	71.5 Å²	71.5	53%	0.533	36%	0.363	S	S	.	.	H	α-helix	trans	-57.8	-49.6	171.5	-68.8	175.6	158.1	0	0	111.2	E89 L95 H96 A97	E89-E93 WeakPolarHBondContact O-CG 3.33Å; E89-E93 PolarHBondContact O-N 3.19Å; E93-L95 VanDerWaalsContact C-N 3.35Å; E93-L95 PolarHBondContact O-N 2.89Å; E93-H96 WeakPolarHBondContact O-CB 3.43Å; E93-H96 PolarHBondContact O-N 3.32Å; E93-H96 VanDerWaalsContact O-N 3.08Å; E93-A97 WeakPolarHBondContact O-CB 3.35Å; E93-A97 PolarHBondContact O-N 2.98Å
94	W	88.2	Confident	85.8	Confident	18 Å²	18	67.3 Å²	67.3	7%	0.068	34%	0.343	C	S	.	.	H	α-helix	trans	-68.1	-31.9	-179.3	-50.5	-16.8	0	0	0	112.9	E90 W91 H96 A98 L116 Y119 D120 K123 L838	E90-W94 HydrophobicContact CB-CZ2 3.86Å; E90-W94 VanDerWaalsContact O-CD2 3.24Å; E90-W94 VanDerWaalsContact O-CE2 3.29Å; E90-W94 PolarHBondContact O-N 3.03Å; E90-W94 VanDerWaalsContact O-N 3.09Å; E90-W94 PolarHBondContact O-NE1 2.98Å; E90-W94 VanDerWaalsContact O-NE1 3.11Å; W91-W94 AromaticContact CD1-CE3 3.77Å; W91-W94 AromaticContact CD1-CH2 3.8Å; W91-W94 AromaticContact CD1-CZ3 3.37Å; W91-W94 HydrophobicContact CG-CE3 4.49Å; W91-W94 HydrophobicContact CG-CZ3 4.39Å; W91-W94 AromaticContact NE1-CH2 3.92Å; W91-W94 AromaticContact NE1-CZ3 3.51Å; W91-W94 PolarHBondContact O-N 3.29Å; W94-H96 VanDerWaalsContact C-N 3.28Å; W94-H96 PolarHBondContact O-N 3.33Å; W94-A98 WeakPolarHBondContact O-CB 3.46Å; W94-A98 PolarHBondContact O-N 3.18Å; W94-A98 VanDerWaalsContact O-N 3.11Å; W94-L116 HydrophobicContact CE3-CD2 4.32Å; W94-Y119 HydrophobicContact CB-CE1 4.36Å; W94-Y119 HydrophobicContact CD2-CD1 4.01Å; W94-Y119 AromaticContact CD2-CE1 3.97Å; W94-Y119 HydrophobicContact CD2-CE1 3.97Å; W94-Y119 AromaticContact CE3-CD1 3.6Å; W94-Y119 HydrophobicContact CE3-CD1 3.6Å; W94-Y119 HydrophobicContact CE3-CE1 4.05Å; W94-Y119 HydrophobicContact CG-CD1 4.4Å; W94-Y119 HydrophobicContact CG-CE1 4.09Å; W94-Y119 HydrophobicContact CZ3-CD1 4.18Å; W94-D120 HydrophobicContact CH2-CB 4.43Å; W94-D120 HydrophobicContact CZ3-CB 3.97Å; W94-K123 HydrophobicContact CH2-CD 4.28Å; W94-K123 HydrophobicContact CZ2-CD 3.91Å; W94-K123 VanDerWaalsContact NE1-NZ 3.17Å; W94-L838 HydrophobicContact CB-CD1 4.03Å
95	L	87.5	Confident	86	Confident	1 Å²	1	69 Å²	69	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-67.3	-27.4	171.3	-76.7	-171	0	0	0	113.2	F84 M87 W91 L92 E93 I100 R105 V112 L116 L838	F84-L95 HydrophobicContact CD2-CD1 4.25Å; F84-L95 HydrophobicContact CE2-CD1 4.24Å; M87-L95 HydrophobicContact CE-CD1 4.03Å; M87-L95 HydrophobicContact SD-CD1 3.74Å; M87-L95 HydrophobicContact SD-CG 4.5Å; W91-L95 WeakPolarHBondContact O-CG 2.83Å; W91-L95 PolarHBondContact O-N 2.88Å; L92-L95 PolarHBondContact O-N 3.47Å; E93-L95 VanDerWaalsContact C-N 3.35Å; E93-L95 PolarHBondContact O-N 2.89Å; L95-I100 HydrophobicContact CD2-CD1 4.21Å; L95-R105 PolarHBondContact O-NH2 3.45Å; L95-R105 VanDerWaalsContact O-NH2 3.16Å; L95-V112 HydrophobicContact CD1-CG1 4.23Å; L95-V112 HydrophobicContact CD2-CG1 3.7Å; L95-L116 HydrophobicContact CD1-CD1 3.97Å; L95-L116 HydrophobicContact CD2-CD1 3.93Å; L95-L116 HydrophobicContact CD2-CD2 4.16Å; L95-L116 HydrophobicContact CD2-CG 4.04Å; L95-L116 HydrophobicContact CG-CD1 3.9Å; L95-L116 HydrophobicContact CG-CD2 4.16Å; L95-L116 HydrophobicContact CG-CG 4.34Å; L95-L838 HydrophobicContact CD2-CD2 4.21Å
96	H	85.1	Confident	86.2	Confident	147 Å²	147	67 Å²	67	68%	0.681	35%	0.346	S	S	*	.	H	α-helix	trans	-79.5	-46.3	173.8	-170.3	-57	0	0	0	111	L92 E93 W94 A98 D99	L92-H96 PolarHBondContact O-N 2.86Å; L92-H96 VanDerWaalsContact O-N 3.08Å; E93-H96 WeakPolarHBondContact O-CB 3.43Å; E93-H96 PolarHBondContact O-N 3.32Å; E93-H96 VanDerWaalsContact O-N 3.08Å; W94-H96 VanDerWaalsContact C-N 3.28Å; W94-H96 PolarHBondContact O-N 3.33Å; H96-A98 PolarHBondContact O-N 2.88Å; H96-D99 PolarHBondContact O-N 3.15Å
97	A	88.1	Confident	86.6	Confident	44 Å²	44	70.7 Å²	70.7	36%	0.364	35%	0.349	S	S	.	.	H	α-helix	trans	-69	-12.2	-179.8	0	0	0	0	0	114.2	E93 N836	E93-A97 WeakPolarHBondContact O-CB 3.35Å; E93-A97 PolarHBondContact O-N 2.98Å; A97-N836 PolarHBondContact O-ND2 3.11Å
98	A	88.3	Confident	86.9	Confident	2 Å²	2	73 Å²	73	2%	0.017	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	6.7	177.8	0	0	0	0	0	114.2	W94 H96 I100 N836 L838 K839	W94-A98 WeakPolarHBondContact O-CB 3.46Å; W94-A98 PolarHBondContact O-N 3.18Å; W94-A98 VanDerWaalsContact O-N 3.11Å; H96-A98 PolarHBondContact O-N 2.88Å; A98-I100 HydrophobicContact CB-CG1 4.47Å; A98-I100 PolarHBondContact O-N 3.42Å; A98-N836 HydrophobicContact CB-CB 4.03Å; A98-L838 HydrophobicContact CB-CB 4.07Å; A98-L838 HydrophobicContact CB-CD2 3.45Å; A98-L838 VanDerWaalsContact CB-CD2 3.45Å; A98-L838 HydrophobicContact CB-CG 4.35Å; A98-K839 HydrophobicContact CB-CB 4.26Å; A98-K839 WeakPolarHBondContact O-CB 3.49Å; A98-K839 WeakPolarHBondContact O-CD 3.31Å
99	D	88.8	Confident	87.1	Confident	128 Å²	128	72.5 Å²	72.5	68%	0.684	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.7	39.6	178.3	-73.6	-45.8	0	0	0	114.6	H96 S101 K839	H96-D99 PolarHBondContact O-N 3.15Å; D99-S101 PolarHBondContact O-N 3.5Å; D99-K839 PolarHBondContact O-NZ 3.42Å
100	I	86.6	Confident	87.3	Confident	1 Å²	1	71.3 Å²	71.3	1%	0.005	35%	0.352	C	S	.	.			trans	-80.6	107.5	167.4	-60	-173.9	0	0	0	107.2	L95 A98 E104 R105 V112 L838 K839 Y842	L95-I100 HydrophobicContact CD2-CD1 4.21Å; A98-I100 HydrophobicContact CB-CG1 4.47Å; A98-I100 PolarHBondContact O-N 3.42Å; I100-E104 HydrophobicContact CG2-CB 3.74Å; I100-R105 HydrophobicContact CG2-CG 3.95Å; I100-R105 PolarHBondContact O-NE 3.13Å; I100-R105 PolarHBondContact O-NH2 3.39Å; I100-V112 HydrophobicContact CG2-CG2 4.46Å; I100-L838 HydrophobicContact CD1-CD2 3.45Å; I100-L838 VanDerWaalsContact CD1-CD2 3.45Å; I100-L838 HydrophobicContact CG1-CD2 4.25Å; I100-K839 HydrophobicContact CG1-CD 3.83Å; I100-Y842 HydrophobicContact CD1-CD1 4.42Å; I100-Y842 HydrophobicContact CD1-CD2 4.21Å; I100-Y842 HydrophobicContact CD1-CG 3.9Å
101	S	87.1	Confident	87.3	Confident	50 Å²	50	67.9 Å²	67.9	35%	0.35	34%	0.337	S	S	.	.			trans	-64.2	161.8	-177.3	67.4	0	0	0	0	113	D99 Q103 E104 R105	D99-S101 PolarHBondContact O-N 3.5Å; S101-Q103 PolarHBondContact O-N 3.44Å; S101-E104 VanDerWaalsContact CB-OE2 3.26Å; S101-E104 WeakPolarHBondContact CB-OE2 3.15Å; S101-E104 PolarHBondContact N-OE2 3.42Å; S101-E104 PolarHBondContact O-N 2.85Å; S101-E104 WeakPolarHBondContact OG-CG 3.23Å; S101-E104 PolarHBondContact OG-N 2.64Å; S101-E104 PolarHBondContact OG-OE2 2.97Å; S101-R105 WeakPolarHBondContact O-CG 3.37Å; S101-R105 PolarHBondContact O-N 2.99Å; S101-R105 VanDerWaalsContact O-N 3.13Å
102	F	85.5	Confident	87.4	Confident	103 Å²	103	67.4 Å²	67.4	45%	0.452	34%	0.335	S	S	.	.	H	α-helix	trans	-56.8	-39.3	174.8	-175.2	-85.1	0	0	0	112.2	G82 E104 R105 E106	G82-F102 WeakPolarHBondContact O-CE2 3.32Å; F102-E104 PolarHBondContact O-N 3.11Å; F102-R105 WeakPolarHBondContact O-CB 3.32Å; F102-R105 PolarHBondContact O-N 3.05Å; F102-E106 WeakPolarHBondContact O-CB 3.2Å; F102-E106 PolarHBondContact O-N 2.89Å
103	Q	86.2	Confident	87.5	Confident	132 Å²	132	64 Å²	64	62%	0.617	32%	0.317	S	S	*	.	H	α-helix	trans	-67.2	-36.1	179.7	-67.3	178.8	-11.5	0	0	112.5	S101 E106 Q107	S101-Q103 PolarHBondContact O-N 3.44Å; Q103-E106 PolarHBondContact O-N 2.85Å; Q103-Q107 WeakPolarHBondContact O-CB 3.33Å; Q103-Q107 WeakPolarHBondContact O-CG 3.15Å; Q103-Q107 PolarHBondContact O-N 3.09Å; Q103-Q107 PolarHBondContact O-NE2 3.2Å
104	E	88.4	Confident	87.4	Confident	35 Å²	35	61.5 Å²	61.5	16%	0.164	31%	0.305	C	S	.	.	H	α-helix	trans	-65.5	-39.9	172.3	-76.6	165.1	106.8	0	0	111.7	I100 S101 F102 Q107 N108 K839 Y842	I100-E104 HydrophobicContact CG2-CB 3.74Å; S101-E104 VanDerWaalsContact CB-OE2 3.26Å; S101-E104 WeakPolarHBondContact CB-OE2 3.15Å; S101-E104 PolarHBondContact N-OE2 3.42Å; S101-E104 PolarHBondContact O-N 2.85Å; S101-E104 WeakPolarHBondContact OG-CG 3.23Å; S101-E104 PolarHBondContact OG-N 2.64Å; S101-E104 PolarHBondContact OG-OE2 2.97Å; F102-E104 PolarHBondContact O-N 3.11Å; E104-Q107 PolarHBondContact O-N 2.99Å; E104-N108 PolarHBondContact O-N 2.82Å; E104-K839 VanDerWaalsContact CD-NZ 3.34Å; E104-K839 IonicContact OE1-NZ 2.71Å; E104-K839 PolarHBondContact OE1-NZ 2.78Å; E104-K839 IonicContact OE2-NZ 3.18Å; E104-K839 PolarHBondContact OE2-NZ 3.09Å; E104-Y842 HydrophobicContact CB-CE1 4.09Å; E104-Y842 WeakPolarHBondContact CB-OH 3.44Å; E104-Y842 HydrophobicContact CG-CE1 4.02Å; E104-Y842 PolarHBondContact O-OH 3.26Å; E104-Y842 WeakPolarHBondContact OE1-CE1 3.48Å
105	R	87.1	Confident	87.4	Confident	56 Å²	56	60.7 Å²	60.7	21%	0.211	30%	0.303	C	S	.	.	H	α-helix	trans	-64.8	-41.1	175.3	-60	167.8	-157.8	-163.5	1.6	112.1	F84 L95 I100 S101 F102 P109	F84-R105 HydrophobicContact CE2-CB 4.02Å; F84-R105 HydrophobicContact CE2-CG 4.11Å; F84-R105 HydrophobicContact CZ-CB 4.42Å; L95-R105 PolarHBondContact O-NH2 3.45Å; L95-R105 VanDerWaalsContact O-NH2 3.16Å; I100-R105 HydrophobicContact CG2-CG 3.95Å; I100-R105 PolarHBondContact O-NE 3.13Å; I100-R105 PolarHBondContact O-NH2 3.39Å; S101-R105 WeakPolarHBondContact O-CG 3.37Å; S101-R105 PolarHBondContact O-N 2.99Å; S101-R105 VanDerWaalsContact O-N 3.13Å; F102-R105 WeakPolarHBondContact O-CB 3.32Å; F102-R105 PolarHBondContact O-N 3.05Å; R105-P109 VanDerWaalsContact O-CA 3.23Å; R105-P109 WeakPolarHBondContact O-CA 3.48Å; R105-P109 WeakPolarHBondContact O-CB 3.35Å; R105-P109 WeakPolarHBondContact O-CD 3.12Å; R105-P109 VanDerWaalsContact O-N 3.16Å
106	E	86.8	Confident	87.5	Confident	113 Å²	113	60.6 Å²	60.6	53%	0.528	30%	0.302	S	S	.	.	H	α-helix	trans	-68.3	-36.8	177.6	-178.5	178.3	-163.1	0	0	112.7	Y77 F102 Q103	Y77-E106 WeakPolarHBondContact OH-CA 3.46Å; Y77-E106 WeakPolarHBondContact OH-CB 3.42Å; F102-E106 WeakPolarHBondContact O-CB 3.2Å; F102-E106 PolarHBondContact O-N 2.89Å; Q103-E106 PolarHBondContact O-N 2.85Å
107	Q	88.6	Confident	87.5	Confident	133 Å²	133	56.7 Å²	56.7	62%	0.621	28%	0.284	S	S	*	.	H	α-helix	trans	-67.4	-40.3	178.7	-76.3	167.1	39.9	0	0	113.2	Q103 E104	Q103-Q107 WeakPolarHBondContact O-CB 3.33Å; Q103-Q107 WeakPolarHBondContact O-CG 3.15Å; Q103-Q107 PolarHBondContact O-N 3.09Å; Q103-Q107 PolarHBondContact O-NE2 3.2Å; E104-Q107 PolarHBondContact O-N 2.99Å
108	N	86.4	Confident	87.2	Confident	69 Å²	69	54.6 Å²	54.6	37%	0.369	27%	0.267	S	S	.	.			trans	-141.6	64.3	-175.6	-62.1	-78.6	0	0	0	112.8	E104 E110 L111 V112	E104-N108 PolarHBondContact O-N 2.82Å; N108-E110 PolarHBondContact O-N 3.43Å; N108-L111 HydrophobicContact CB-CB 3.86Å; N108-L111 HydrophobicContact CB-CD2 4.34Å; N108-L111 WeakPolarHBondContact O-CB 3.47Å; N108-L111 PolarHBondContact O-N 3.11Å; N108-L111 VanDerWaalsContact O-N 3.08Å; N108-V112 PolarHBondContact O-N 2.83Å
109	P	88.6	Confident	87	Confident	27 Å²	27	55.2 Å²	55.2	18%	0.175	27%	0.269	C	S	.	.	H	α-helix	trans	-63.9	-39.8	-171.4	22.5	-33	0	0	0	113.7	Y77 F84 R105 L111 V112 I113	Y77-P109 HydrophobicContact CD1-CB 3.84Å; Y77-P109 HydrophobicContact CD1-CG 3.87Å; Y77-P109 HydrophobicContact CD2-CB 3.56Å; Y77-P109 HydrophobicContact CD2-CG 4.45Å; Y77-P109 HydrophobicContact CE1-CB 4.32Å; Y77-P109 HydrophobicContact CE1-CG 4.21Å; Y77-P109 HydrophobicContact CE2-CB 4.06Å; Y77-P109 HydrophobicContact CG-CB 3.43Å; Y77-P109 VanDerWaalsContact CG-CB 3.43Å; Y77-P109 HydrophobicContact CG-CG 3.99Å; F84-P109 HydrophobicContact CE1-CB 3.98Å; F84-P109 HydrophobicContact CZ-CB 4.1Å; R105-P109 VanDerWaalsContact O-CA 3.23Å; R105-P109 WeakPolarHBondContact O-CA 3.48Å; R105-P109 WeakPolarHBondContact O-CB 3.35Å; R105-P109 WeakPolarHBondContact O-CD 3.12Å; R105-P109 VanDerWaalsContact O-N 3.16Å; P109-L111 VanDerWaalsContact C-N 3.31Å; P109-L111 PolarHBondContact O-N 2.99Å; P109-V112 PolarHBondContact O-N 3.04Å; P109-I113 WeakPolarHBondContact O-CG1 3.37Å; P109-I113 PolarHBondContact O-N 3.1Å; P109-I113 VanDerWaalsContact O-N 3.08Å
110	E	88	Confident	86.8	Confident	134 Å²	134	50.7 Å²	50.7	63%	0.626	25%	0.245	S	C	*	.	H	α-helix	trans	-62.2	-37.6	174.2	-67.4	-64	148.6	0	0	111.7	N108 I113 E114	N108-E110 PolarHBondContact O-N 3.43Å; E110-I113 WeakPolarHBondContact O-CB 3.34Å; E110-I113 PolarHBondContact O-N 3.16Å; E110-E114 PolarHBondContact O-N 3.11Å
111	L	87.9	Confident	86.2	Confident	23 Å²	23	53 Å²	53	12%	0.12	26%	0.259	C	S	.	.	H	α-helix	trans	-69.1	-39.4	177.4	-179.6	61.5	0	0	0	111.5	N108 P109 I113 E114 V115 Y842 A845 T846	N108-L111 HydrophobicContact CB-CB 3.86Å; N108-L111 HydrophobicContact CB-CD2 4.34Å; N108-L111 WeakPolarHBondContact O-CB 3.47Å; N108-L111 PolarHBondContact O-N 3.11Å; N108-L111 VanDerWaalsContact O-N 3.08Å; P109-L111 VanDerWaalsContact C-N 3.31Å; P109-L111 PolarHBondContact O-N 2.99Å; L111-I113 PolarHBondContact O-N 3.07Å; L111-E114 HydrophobicContact CD1-CB 4.47Å; L111-E114 PolarHBondContact O-N 2.71Å; L111-E114 VanDerWaalsContact O-N 3.16Å; L111-V115 HydrophobicContact CD1-CG2 4.05Å; L111-V115 HydrophobicContact CG-CG2 4.18Å; L111-V115 WeakPolarHBondContact O-CB 3.43Å; L111-V115 VanDerWaalsContact O-CG2 3.23Å; L111-V115 WeakPolarHBondContact O-CG2 3.43Å; L111-V115 PolarHBondContact O-N 3.31Å; L111-Y842 HydrophobicContact CD2-CE2 4.47Å; L111-A845 HydrophobicContact CD1-CB 3.63Å; L111-A845 HydrophobicContact CD2-CB 3.99Å; L111-A845 HydrophobicContact CG-CB 4.29Å; L111-T846 HydrophobicContact CD2-CG2 3.6Å
112	V	90	Very high	85.4	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.006	25%	0.252	C	S	.	.	H	α-helix	trans	-60.8	-36	173.3	174.1	0	0	0	0	110.8	F84 L95 I100 N108 P109 L116 Y842	F84-V112 HydrophobicContact CE2-CG1 3.96Å; F84-V112 HydrophobicContact CZ-CB 4.01Å; F84-V112 HydrophobicContact CZ-CG1 3.9Å; L95-V112 HydrophobicContact CD1-CG1 4.23Å; L95-V112 HydrophobicContact CD2-CG1 3.7Å; I100-V112 HydrophobicContact CG2-CG2 4.46Å; N108-V112 PolarHBondContact O-N 2.83Å; P109-V112 PolarHBondContact O-N 3.04Å; V112-L116 HydrophobicContact CG1-CD1 4.12Å; V112-L116 VanDerWaalsContact O-CB 3.31Å; V112-L116 WeakPolarHBondContact O-CB 3.45Å; V112-L116 WeakPolarHBondContact O-CG 3.25Å; V112-L116 PolarHBondContact O-N 3.14Å; V112-Y842 HydrophobicContact CG2-CD2 3.99Å; V112-Y842 HydrophobicContact CG2-CE2 3.71Å
113	I	87.1	Confident	84.7	Confident	13 Å²	13	48.3 Å²	48.3	7%	0.067	24%	0.237	C	C	.	.	H	α-helix	trans	-68	-43.9	172.2	-67.6	168.7	0	0	0	111.5	V75 F84 P109 E110 L111 V115 L116 Q117	V75-I113 HydrophobicContact CB-CD1 4.49Å; V75-I113 HydrophobicContact CG1-CD1 4.15Å; V75-I113 HydrophobicContact CG1-CG1 4.24Å; F84-I113 HydrophobicContact CD1-CD1 4.03Å; F84-I113 HydrophobicContact CD1-CG1 4.16Å; F84-I113 HydrophobicContact CE1-CD1 3.78Å; F84-I113 HydrophobicContact CE1-CG1 3.75Å; P109-I113 WeakPolarHBondContact O-CG1 3.37Å; P109-I113 PolarHBondContact O-N 3.1Å; P109-I113 VanDerWaalsContact O-N 3.08Å; E110-I113 WeakPolarHBondContact O-CB 3.34Å; E110-I113 PolarHBondContact O-N 3.16Å; L111-I113 PolarHBondContact O-N 3.07Å; I113-V115 VanDerWaalsContact C-N 3.33Å; I113-V115 PolarHBondContact O-N 2.66Å; I113-L116 PolarHBondContact O-N 2.67Å; I113-Q117 HydrophobicContact CG2-CG 4.49Å; I113-Q117 VanDerWaalsContact CG2-NE2 3.28Å; I113-Q117 WeakPolarHBondContact O-CB 3.42Å; I113-Q117 VanDerWaalsContact O-CG 3.23Å; I113-Q117 WeakPolarHBondContact O-CG 3.49Å; I113-Q117 PolarHBondContact O-N 2.77Å
114	E	86.2	Confident	83.7	Confident	61 Å²	61	45.9 Å²	45.9	29%	0.285	23%	0.225	S	C	.	.	H	α-helix	trans	-60.2	-41.7	174.8	-74	-175.1	163.7	0	0	111.9	E110 L111 C118 S805	E110-E114 PolarHBondContact O-N 3.11Å; L111-E114 HydrophobicContact CD1-CB 4.47Å; L111-E114 PolarHBondContact O-N 2.71Å; L111-E114 VanDerWaalsContact O-N 3.16Å; E114-C118 WeakPolarHBondContact O-CB 3.43Å; E114-C118 PolarHBondContact O-N 2.85Å; E114-S805 WeakPolarHBondContact OE2-CA 3.47Å; E114-S805 WeakPolarHBondContact OE2-CB 3.34Å
115	V	87.6	Confident	82.1	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-70.5	-40.5	178.5	169.8	0	0	0	0	112	L111 I113 C118 Y119 V804 L838 L841	L111-V115 HydrophobicContact CD1-CG2 4.05Å; L111-V115 HydrophobicContact CG-CG2 4.18Å; L111-V115 WeakPolarHBondContact O-CB 3.43Å; L111-V115 VanDerWaalsContact O-CG2 3.23Å; L111-V115 WeakPolarHBondContact O-CG2 3.43Å; L111-V115 PolarHBondContact O-N 3.31Å; I113-V115 VanDerWaalsContact C-N 3.33Å; I113-V115 PolarHBondContact O-N 2.66Å; V115-C118 WeakPolarHBondContact O-CA 3.21Å; V115-C118 VanDerWaalsContact O-CB 3.25Å; V115-C118 WeakPolarHBondContact O-CB 3.42Å; V115-C118 PolarHBondContact O-N 3.35Å; V115-C118 VanDerWaalsContact O-N 3.17Å; V115-Y119 WeakPolarHBondContact O-CB 3.5Å; V115-Y119 PolarHBondContact O-N 3.29Å; V115-V804 HydrophobicContact CG2-CG1 3.88Å; V115-L838 HydrophobicContact CG1-CG 4.15Å; V115-L838 WeakPolarHBondContact CG1-O 3.37Å; V115-L841 HydrophobicContact CG1-CB 3.94Å
116	L	88.7	Confident	80.4	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.1	-49.3	173.1	-87.9	165.8	0	0	0	111.4	M87 W91 W94 L95 V112 I113 C118 Y119 D120 L838	M87-L116 HydrophobicContact CE-CD1 3.33Å; M87-L116 HydrophobicContact SD-CD1 3.97Å; W91-L116 HydrophobicContact CB-CD1 4.45Å; W91-L116 HydrophobicContact CB-CD2 3.89Å; W91-L116 HydrophobicContact CD2-CB 4.15Å; W91-L116 HydrophobicContact CD2-CD2 4.24Å; W91-L116 HydrophobicContact CE3-CB 3.84Å; W91-L116 HydrophobicContact CE3-CD1 3.95Å; W91-L116 HydrophobicContact CE3-CD2 4.47Å; W91-L116 HydrophobicContact CE3-CG 4.34Å; W91-L116 HydrophobicContact CG-CD2 4Å; W91-L116 HydrophobicContact CZ3-CB 4.09Å; W94-L116 HydrophobicContact CE3-CD2 4.32Å; L95-L116 HydrophobicContact CD1-CD1 3.97Å; L95-L116 HydrophobicContact CD2-CD1 3.93Å; L95-L116 HydrophobicContact CD2-CD2 4.16Å; L95-L116 HydrophobicContact CD2-CG 4.04Å; L95-L116 HydrophobicContact CG-CD1 3.9Å; L95-L116 HydrophobicContact CG-CD2 4.16Å; L95-L116 HydrophobicContact CG-CG 4.34Å; V112-L116 HydrophobicContact CG1-CD1 4.12Å; V112-L116 VanDerWaalsContact O-CB 3.31Å; V112-L116 WeakPolarHBondContact O-CB 3.45Å; V112-L116 WeakPolarHBondContact O-CG 3.25Å; V112-L116 PolarHBondContact O-N 3.14Å; I113-L116 PolarHBondContact O-N 2.67Å; L116-C118 PolarHBondContact O-N 3.3Å; L116-Y119 PolarHBondContact O-N 2.95Å; L116-D120 VanDerWaalsContact O-CB 3.23Å; L116-D120 WeakPolarHBondContact O-CB 3.46Å; L116-D120 PolarHBondContact O-N 2.58Å; L116-L838 HydrophobicContact CD2-CD1 3.68Å; L116-L838 HydrophobicContact CG-CD1 4.34Å
117	Q	85.9	Confident	78.6	Confident	64 Å²	64	45.3 Å²	45.3	30%	0.299	22%	0.221	S	C	.	.	H	α-helix	trans	-60.7	-34.1	173	-66.2	174.2	28.8	0	0	111.3	W91 I113 T121 R806	W91-Q117 HydrophobicContact CH2-CB 4.45Å; W91-Q117 HydrophobicContact CH2-CG 3.6Å; W91-Q117 HydrophobicContact CZ2-CG 4.37Å; W91-Q117 HydrophobicContact CZ3-CG 4.3Å; I113-Q117 HydrophobicContact CG2-CG 4.49Å; I113-Q117 VanDerWaalsContact CG2-NE2 3.28Å; I113-Q117 WeakPolarHBondContact O-CB 3.42Å; I113-Q117 VanDerWaalsContact O-CG 3.23Å; I113-Q117 WeakPolarHBondContact O-CG 3.49Å; I113-Q117 PolarHBondContact O-N 2.77Å; Q117-T121 WeakPolarHBondContact O-CB 3.36Å; Q117-T121 PolarHBondContact O-N 3.23Å; Q117-T121 PolarHBondContact O-OG1 3.47Å; Q117-R806 VanDerWaalsContact C-NH2 3.26Å; Q117-R806 PolarHBondContact O-NH2 3.36Å
118	C	80.8	Confident	76.4	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.4	-57.4	176.7	173.5	0	0	0	0	110.6	E114 V115 L116 D120 T121 A122 M792 V804	E114-C118 WeakPolarHBondContact O-CB 3.43Å; E114-C118 PolarHBondContact O-N 2.85Å; V115-C118 WeakPolarHBondContact O-CA 3.21Å; V115-C118 VanDerWaalsContact O-CB 3.25Å; V115-C118 WeakPolarHBondContact O-CB 3.42Å; V115-C118 PolarHBondContact O-N 3.35Å; V115-C118 VanDerWaalsContact O-N 3.17Å; L116-C118 PolarHBondContact O-N 3.3Å; C118-D120 PolarHBondContact O-N 3.05Å; C118-T121 PolarHBondContact O-N 2.78Å; C118-A122 PolarHBondContact O-N 2.83Å; C118-M792 WeakPolarHBondContact CA-SD 3.44Å; C118-M792 HydrophobicContact CB-CE 3.53Å; C118-M792 HydrophobicContact CB-SD 3.67Å; C118-M792 WeakPolarHBondContact SG-CE 3.08Å; C118-M792 PolarHBondContact SG-SD 3.13Å; C118-V804 HydrophobicContact CB-CG1 4.48Å
119	Y	85	Confident	74.2	Confident	16 Å²	16	43.8 Å²	43.8	6%	0.063	21%	0.205	C	C	.	.	H	α-helix	trans	-62	-40.5	178.7	-173.2	-119	0	0	0	112.6	W94 V115 L116 T121 A122 K123 W139 P837 L838 L841	W94-Y119 HydrophobicContact CB-CE1 4.36Å; W94-Y119 HydrophobicContact CD2-CD1 4.01Å; W94-Y119 AromaticContact CD2-CE1 3.97Å; W94-Y119 HydrophobicContact CD2-CE1 3.97Å; W94-Y119 AromaticContact CE3-CD1 3.6Å; W94-Y119 HydrophobicContact CE3-CD1 3.6Å; W94-Y119 HydrophobicContact CE3-CE1 4.05Å; W94-Y119 HydrophobicContact CG-CD1 4.4Å; W94-Y119 HydrophobicContact CG-CE1 4.09Å; W94-Y119 HydrophobicContact CZ3-CD1 4.18Å; V115-Y119 WeakPolarHBondContact O-CB 3.5Å; V115-Y119 PolarHBondContact O-N 3.29Å; L116-Y119 PolarHBondContact O-N 2.95Å; Y119-T121 PolarHBondContact O-N 3.2Å; Y119-A122 CarbonylContact O-C 3.58Å; Y119-A122 PolarHBondContact O-N 2.91Å; Y119-A122 VanDerWaalsContact O-N 3.16Å; Y119-K123 HydrophobicContact CE1-CD 4.01Å; Y119-K123 VanDerWaalsContact O-CB 3.28Å; Y119-K123 WeakPolarHBondContact O-CB 3.46Å; Y119-K123 PolarHBondContact O-N 3.24Å; Y119-W139 HydrophobicContact CE2-CE3 4.5Å; Y119-W139 HydrophobicContact CE2-CZ3 4.32Å; Y119-P837 HydrophobicContact CE2-CB 3.99Å; Y119-L838 HydrophobicContact CD1-CB 3.95Å; Y119-L838 HydrophobicContact CD1-CD1 3.53Å; Y119-L838 HydrophobicContact CD1-CG 4.29Å; Y119-L838 HydrophobicContact CD2-CB 4.19Å; Y119-L838 HydrophobicContact CE1-CB 4.22Å; Y119-L838 HydrophobicContact CE1-CD1 4.29Å; Y119-L838 HydrophobicContact CE2-CB 4.49Å; Y119-L838 HydrophobicContact CG-CB 3.9Å; Y119-L838 HydrophobicContact CG-CD1 3.89Å; Y119-L838 HydrophobicContact CG-CG 4.31Å; Y119-L841 HydrophobicContact CD2-CD1 4.2Å
120	D	84.4	Confident	71.6	Confident	32 Å²	32	50.1 Å²	50.1	17%	0.171	23%	0.23	C	C	.	.	H	α-helix	trans	-52.7	-52.1	171	174	80.1	0	0	0	111.8	W91 W94 L116 C118 A122 K123 H124	W91-D120 HydrophobicContact CZ2-CB 4.14Å; W94-D120 HydrophobicContact CH2-CB 4.43Å; W94-D120 HydrophobicContact CZ3-CB 3.97Å; L116-D120 VanDerWaalsContact O-CB 3.23Å; L116-D120 WeakPolarHBondContact O-CB 3.46Å; L116-D120 PolarHBondContact O-N 2.58Å; C118-D120 PolarHBondContact O-N 3.05Å; D120-A122 VanDerWaalsContact C-N 3.28Å; D120-A122 PolarHBondContact O-N 2.8Å; D120-K123 PolarHBondContact O-N 2.8Å; D120-H124 VanDerWaalsContact O-CB 3.31Å; D120-H124 WeakPolarHBondContact O-CB 3.27Å; D120-H124 PolarHBondContact O-N 3.33Å; D120-H124 IonicContact OD1-CD2 3.69Å; D120-H124 PolarHBondContact OD1-CD2 3.33Å; D120-H124 IonicContact OD1-NE2 2.62Å; D120-H124 IonicContact OD2-CD2 2.82Å
121	T	73.4	Confident	69	Low	51 Å²	51	46.8 Å²	46.8	31%	0.313	21%	0.213	S	C	.	.	H	α-helix	trans	-66.6	-29.9	-179.9	-63.2	0	0	0	0	112.1	Q117 C118 Y119 R125 M792 R806	Q117-T121 WeakPolarHBondContact O-CB 3.36Å; Q117-T121 PolarHBondContact O-N 3.23Å; Q117-T121 PolarHBondContact O-OG1 3.47Å; C118-T121 PolarHBondContact O-N 2.78Å; Y119-T121 PolarHBondContact O-N 3.2Å; T121-R125 WeakPolarHBondContact O-CB 3.11Å; T121-R125 PolarHBondContact O-N 3.48Å; T121-M792 HydrophobicContact CG2-CB 3.93Å; T121-M792 HydrophobicContact CG2-SD 4.42Å; T121-R806 PolarHBondContact OG1-NH2 2.98Å
122	A	70.5	Confident	66.3	Low	23 Å²	23	49.7 Å²	49.7	19%	0.19	23%	0.228	C	C	.	.	H	α-helix	trans	-74.3	-43.9	172.4	0	0	0	0	0	112.5	C118 Y119 D120 R125 A126	C118-A122 PolarHBondContact O-N 2.83Å; Y119-A122 CarbonylContact O-C 3.58Å; Y119-A122 PolarHBondContact O-N 2.91Å; Y119-A122 VanDerWaalsContact O-N 3.16Å; D120-A122 VanDerWaalsContact C-N 3.28Å; D120-A122 PolarHBondContact O-N 2.8Å; A122-R125 CarbonylContact O-C 3.53Å; A122-R125 WeakPolarHBondContact O-CA 3.35Å; A122-R125 VanDerWaalsContact O-CB 3.3Å; A122-R125 WeakPolarHBondContact O-CB 3.46Å; A122-R125 PolarHBondContact O-N 2.92Å; A122-A126 PolarHBondContact O-N 2.84Å
123	K	71	Confident	63.3	Low	31 Å²	31	54.7 Å²	54.7	14%	0.135	25%	0.253	C	S	.	.	H	α-helix	trans	-70.1	-43.6	-178.7	-170	168.2	-178.5	171.3	0	111.7	W94 Y119 D120 R125 A126 R127	W94-K123 HydrophobicContact CH2-CD 4.28Å; W94-K123 HydrophobicContact CZ2-CD 3.91Å; W94-K123 VanDerWaalsContact NE1-NZ 3.17Å; Y119-K123 HydrophobicContact CE1-CD 4.01Å; Y119-K123 VanDerWaalsContact O-CB 3.28Å; Y119-K123 WeakPolarHBondContact O-CB 3.46Å; Y119-K123 PolarHBondContact O-N 3.24Å; D120-K123 PolarHBondContact O-N 2.8Å; K123-R125 PolarHBondContact O-N 2.99Å; K123-A126 PolarHBondContact O-N 2.85Å; K123-R127 WeakPolarHBondContact O-CB 3.48Å; K123-R127 WeakPolarHBondContact O-CG 3.28Å; K123-R127 PolarHBondContact O-N 3.39Å
124	H	64.9	Low	60.6	Low	81 Å²	81	60 Å²	60	38%	0.375	29%	0.286	S	S	.	.	H	α-helix	trans	-64.9	-12.5	168.7	-83.3	-36.5	0	0	0	114.2	D120 R128	D120-H124 VanDerWaalsContact O-CB 3.31Å; D120-H124 WeakPolarHBondContact O-CB 3.27Å; D120-H124 PolarHBondContact O-N 3.33Å; D120-H124 IonicContact OD1-CD2 3.69Å; D120-H124 PolarHBondContact OD1-CD2 3.33Å; D120-H124 IonicContact OD1-NE2 2.62Å; D120-H124 IonicContact OD2-CD2 2.82Å; H124-R128 WeakPolarHBondContact O-CD 3.48Å; H124-R128 WeakPolarHBondContact O-CG 3.46Å; H124-R128 PolarHBondContact O-NH1 2.88Å; H124-R128 VanDerWaalsContact O-NH1 3.1Å
125	R	56.1	Low	57.9	Low	35 Å²	35	65.5 Å²	65.5	13%	0.132	31%	0.312	C	S	.	.	H	α-helix	trans	-93.7	-46.3	172.6	-177.9	174.8	-169.5	157.2	4.5	111.8	T121 A122 K123 R128 Q129 M792	T121-R125 WeakPolarHBondContact O-CB 3.11Å; T121-R125 PolarHBondContact O-N 3.48Å; A122-R125 CarbonylContact O-C 3.53Å; A122-R125 WeakPolarHBondContact O-CA 3.35Å; A122-R125 VanDerWaalsContact O-CB 3.3Å; A122-R125 WeakPolarHBondContact O-CB 3.46Å; A122-R125 PolarHBondContact O-N 2.92Å; K123-R125 PolarHBondContact O-N 2.99Å; R125-R128 CarbonylContact O-C 3.43Å; R125-R128 VanDerWaalsContact O-C 3.24Å; R125-R128 VanDerWaalsContact O-CA 3.31Å; R125-R128 WeakPolarHBondContact O-CA 3.29Å; R125-R128 WeakPolarHBondContact O-CB 3.21Å; R125-R128 PolarHBondContact O-N 2.9Å; R125-Q129 HydrophobicContact CG-CG 4.46Å; R125-Q129 WeakPolarHBondContact O-CB 3.09Å; R125-Q129 PolarHBondContact O-N 3.12Å; R125-M792 PolarHBondContact NH1-O 2.91Å
126	A	51.7	Low	55.1	Low	21 Å²	21	73.3 Å²	73.3	17%	0.174	35%	0.348	C	S	.	.	H	α-helix	trans	-62	-41.7	176	0	0	0	0	0	112.3	A122 K123 R128 Q129	A122-A126 PolarHBondContact O-N 2.84Å; K123-A126 PolarHBondContact O-N 2.85Å; A126-R128 PolarHBondContact O-N 3.12Å; A126-Q129 CarbonylContact O-C 3.55Å; A126-Q129 PolarHBondContact O-N 3.18Å; A126-Q129 VanDerWaalsContact O-O 3.09Å
127	R	47.6	Very low	52.4	Low	136 Å²	136	78.5 Å²	78.5	51%	0.513	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-9.7	169.3	-74.5	179.8	167.5	173.8	-5.4	114	K123 E140	K123-R127 WeakPolarHBondContact O-CB 3.48Å; K123-R127 WeakPolarHBondContact O-CG 3.28Å; K123-R127 PolarHBondContact O-N 3.39Å; R127-E140 IonicContact CZ-OE1 2.66Å; R127-E140 IonicContact NE-OE1 3.92Å; R127-E140 PolarHBondContact NE-OE1 2.75Å; R127-E140 IonicContact NH2-OE1 3.11Å; R127-E140 PolarHBondContact NH2-OE1 3.3Å
128	R	43.4	Very low	49.7	Very low	155 Å²	155	78.7 Å²	78.7	59%	0.585	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.1	3.2	173.2	-57	179.7	174.3	125.4	-6.6	113.2	H124 R125 A126 P673	H124-R128 WeakPolarHBondContact O-CD 3.48Å; H124-R128 WeakPolarHBondContact O-CG 3.46Å; H124-R128 PolarHBondContact O-NH1 2.88Å; H124-R128 VanDerWaalsContact O-NH1 3.1Å; R125-R128 CarbonylContact O-C 3.43Å; R125-R128 VanDerWaalsContact O-C 3.24Å; R125-R128 VanDerWaalsContact O-CA 3.31Å; R125-R128 WeakPolarHBondContact O-CA 3.29Å; R125-R128 WeakPolarHBondContact O-CB 3.21Å; R125-R128 PolarHBondContact O-N 2.9Å; A126-R128 PolarHBondContact O-N 3.12Å; R128-P673 HydrophobicContact CB-CB 4.09Å; R128-P673 HydrophobicContact CB-CG 3.91Å; R128-P673 WeakPolarHBondContact O-CD 3.35Å; R128-P673 WeakPolarHBondContact O-CG 3.25Å
129	Q	39.2	Very low	47.8	Very low	14 Å²	14	83 Å²	83	7%	0.065	40%	0.396	C	S	.	.	S	Bend	trans	-153.4	84.4	-175.6	-66.9	-157.5	-90.7	0	0	108.9	R125 A126 F131 A646 P673	R125-Q129 HydrophobicContact CG-CG 4.46Å; R125-Q129 WeakPolarHBondContact O-CB 3.09Å; R125-Q129 PolarHBondContact O-N 3.12Å; A126-Q129 CarbonylContact O-C 3.55Å; A126-Q129 PolarHBondContact O-N 3.18Å; A126-Q129 VanDerWaalsContact O-O 3.09Å; Q129-F131 WeakPolarHBondContact O-CD2 3.2Å; Q129-F131 WeakPolarHBondContact O-CE2 3.4Å; Q129-F131 PolarHBondContact O-N 3.19Å; Q129-F131 VanDerWaalsContact O-N 3.14Å; Q129-A646 VanDerWaalsContact C-CB 3.49Å; Q129-A646 HydrophobicContact CB-CB 3.82Å; Q129-P673 HydrophobicContact CG-CG 4.47Å
130	K	34.2	Very low	45.4	Very low	161 Å²	161	87 Å²	87	70%	0.7	42%	0.416	S	S	*	.			trans	-75.5	89.5	-177.8	-62.2	-177.2	177.4	-171	0	112	G645 A646	K130-G645 CarbonylContact O-C 3.56Å; K130-G645 WeakPolarHBondContact O-CA 3.46Å; K130-A646 WeakPolarHBondContact O-CA 3.47Å; K130-A646 PolarHBondContact O-N 3.36Å
131	F	34.4	Very low	43	Very low	63 Å²	63	89.4 Å²	89.4	28%	0.276	43%	0.428	S	S	.	.			trans	-52.5	156.5	-173.9	-70.5	-100.7	0	0	0	115	Q129 M133 F776	Q129-F131 WeakPolarHBondContact O-CD2 3.2Å; Q129-F131 WeakPolarHBondContact O-CE2 3.4Å; Q129-F131 PolarHBondContact O-N 3.19Å; Q129-F131 VanDerWaalsContact O-N 3.14Å; F131-M133 PolarHBondContact O-N 3.27Å; F131-F776 HydrophobicContact CD1-CE2 4.47Å; F131-F776 HydrophobicContact CD1-CZ 4.43Å; F131-F776 HydrophobicContact CE1-CE1 4.5Å; F131-F776 AromaticContact CE1-CE2 3.56Å; F131-F776 HydrophobicContact CE1-CE2 3.56Å; F131-F776 AromaticContact CE1-CZ 3.38Å; F131-F776 HydrophobicContact CE1-CZ 3.38Å; F131-F776 HydrophobicContact CZ-CE1 4.29Å; F131-F776 HydrophobicContact CZ-CE2 4.16Å; F131-F776 AromaticContact CZ-CZ 3.52Å; F131-F776 HydrophobicContact CZ-CZ 3.52Å
132	I	29.3	Very low	41.2	Very low	84 Å²	84	93.4 Å²	93.4	43%	0.431	44%	0.441	S	S	.	.			trans	-64.4	129.7	164	-80.1	173.9	0	0	0	107.4	H644 V650	I132-H644 VanDerWaalsContact CG1-C 3.42Å; I132-H644 VanDerWaalsContact CG1-O 3.3Å; I132-H644 WeakPolarHBondContact CG1-O 3.13Å; I132-V650 HydrophobicContact CD1-CG2 4.31Å
133	M	27.5	Very low	39.6	Very low	107 Å²	107	98.9 Å²	98.9	53%	0.527	46%	0.463	S	S	.	.			trans	-140.1	141.4	146.2	-66.9	-168.5	69.9	0	0	107.2	F131 H137	F131-M133 PolarHBondContact O-N 3.27Å; M133-H137 HydrophobicContact CE-CB 3.51Å; M133-H137 HydrophobicContact SD-CB 3.44Å; M133-H137 WeakPolarHBondContact SD-CB 2.83Å
134	T	31.7	Very low	37.8	Very low	125 Å²	125	104.2 Å²	104.2	77%	0.767	49%	0.493	S	S	*	.	S	Bend	trans	-63.1	135.5	154	31.1	0	0	0	0	107.7
135	E	29.3	Very low	36.1	Very low	176 Å²	176	104.4 Å²	104.4	82%	0.822	50%	0.5	S	S	*	.	S	Bend	trans	16.9	129.9	-177.7	-48	-156	135.7	0	0	121.4	H137	E135-H137 PolarHBondContact O-N 2.74Å
136	E	28	Very low	35	Very low	164 Å²	164	108.5 Å²	108.5	77%	0.766	53%	0.529	S	S	*	.	S	Bend	trans	69.1	13	155.9	-65.8	-101.4	110.1	0	0	121.1
137	H	32.3	Very low	34	Very low	109 Å²	109	112.2 Å²	112.2	51%	0.505	55%	0.554	S	S	.	*			trans	-112.7	71.3	168.6	-75.7	90.7	0	0	0	114.5	M133 E135	M133-H137 HydrophobicContact CE-CB 3.51Å; M133-H137 HydrophobicContact SD-CB 3.44Å; M133-H137 WeakPolarHBondContact SD-CB 2.83Å; E135-H137 PolarHBondContact O-N 2.74Å
138	C	28.9	Very low	33	Very low	69 Å²	69	109.4 Å²	109.4	47%	0.466	55%	0.554	S	S	.	*			trans	-89.2	137.1	166.7	-167.8	0	0	0	0	111.3	E140 N141	C138-E140 PolarHBondContact O-N 2.81Å; C138-N141 PolarHBondContact O-N 3.06Å; C138-N141 VanDerWaalsContact O-N 3.07Å
139	W	40.1	Very low	32.3	Very low	91 Å²	91	108.8 Å²	108.8	35%	0.345	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.5	2.8	-179	-68.7	69.8	0	0	0	115.7	Y119 P796 P837	Y119-W139 HydrophobicContact CE2-CE3 4.5Å; Y119-W139 HydrophobicContact CE2-CZ3 4.32Å; W139-P796 HydrophobicContact CH2-CB 4.43Å; W139-P796 HydrophobicContact CH2-CG 3.63Å; W139-P796 HydrophobicContact CZ3-CG 4.16Å; W139-P837 HydrophobicContact CE3-CB 4.36Å; W139-P837 HydrophobicContact CE3-CG 4.03Å; W139-P837 HydrophobicContact CH2-CB 3.97Å; W139-P837 HydrophobicContact CH2-CG 4.03Å; W139-P837 HydrophobicContact CZ3-CB 3.43Å; W139-P837 VanDerWaalsContact CZ3-CB 3.43Å; W139-P837 HydrophobicContact CZ3-CG 3.46Å; W139-P837 VanDerWaalsContact CZ3-CG 3.46Å
140	E	35.8	Very low	31.8	Very low	100 Å²	100	112.5 Å²	112.5	47%	0.467	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-128.2	1.9	-176.6	-55.6	-171.3	127.8	0	0	112.7	R127 C138	R127-E140 IonicContact CZ-OE1 2.66Å; R127-E140 IonicContact NE-OE1 3.92Å; R127-E140 PolarHBondContact NE-OE1 2.75Å; R127-E140 IonicContact NH2-OE1 3.11Å; R127-E140 PolarHBondContact NH2-OE1 3.3Å; C138-E140 PolarHBondContact O-N 2.81Å
141	N	34	Very low	31.6	Very low	82 Å²	82	113.3 Å²	113.3	44%	0.439	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.5	-20.2	-178.9	-77.9	17.2	0	0	0	114.6	C138 E143 N144	C138-N141 PolarHBondContact O-N 3.06Å; C138-N141 VanDerWaalsContact O-N 3.07Å; N141-E143 PolarHBondContact O-N 2.93Å; N141-E143 VanDerWaalsContact O-N 3.11Å; N141-N144 PolarHBondContact O-N 3.13Å
142	F	34.7	Very low	31.4	Very low	134 Å²	134	117.7 Å²	117.7	59%	0.588	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-64.7	-20.9	-168.5	-142	-98.3	0	0	0	114.4	N144	F142-N144 PolarHBondContact O-N 3.27Å
143	E	37	Very low	31.4	Very low	139 Å²	139	123.6 Å²	123.6	65%	0.65	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-72.1	-8.9	-177.9	-66.1	176.2	173.2	0	0	114.2	N141	N141-E143 PolarHBondContact O-N 2.93Å; N141-E143 VanDerWaalsContact O-N 3.11Å
144	N	34.2	Very low	31.6	Very low	143 Å²	143	125.4 Å²	125.4	77%	0.765	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-115.4	-7.1	179.6	-72.1	-71.5	0	0	0	115.2	N141 F142	N141-N144 PolarHBondContact O-N 3.13Å; F142-N144 PolarHBondContact O-N 3.27Å
145	T	29.6	Very low	31.5	Very low	84 Å²	84	126.8 Å²	126.8	52%	0.515	66%	0.657	S	S	.	*			trans	-99	-0.3	-170.3	-41.2	0	0	0	0	113.7	S147	T145-S147 PolarHBondContact O-N 3.4Å
146	T	31.9	Very low	31.6	Very low	122 Å²	122	126.4 Å²	126.4	75%	0.748	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	9.4	-177.4	49.7	0	0	0	0	115.4
147	S	30.5	Very low	32	Very low	99 Å²	99	127.1 Å²	127.1	69%	0.692	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.3	14.3	-179.9	84.4	0	0	0	0	116.4	T145	T145-S147 PolarHBondContact O-N 3.4Å
148	C	26.7	Very low	32	Very low	77 Å²	77	127.8 Å²	127.8	52%	0.52	68%	0.675	S	S	.	*	S	Bend	trans	-137.1	30.6	-167.4	-153.2	0	0	0	0	118.2
149	V	29.6	Very low	32.1	Very low	142 Å²	142	129.6 Å²	129.6	86%	0.861	69%	0.689	S	S	*	*	S	Bend	trans	-127.9	30.9	162.9	-154.5	0	0	0	0	112.5
150	C	28.1	Very low	31.8	Very low	92 Å²	92	128.9 Å²	128.9	62%	0.622	70%	0.703	S	S	*	*	S	Bend	trans	-150.6	142.6	163.9	61.6	0	0	0	0	110.7
151	H	30.1	Very low	31.6	Very low	178 Å²	178	130.7 Å²	130.7	82%	0.824	72%	0.715	S	S	*	*	S	Bend	trans	73.6	55.2	-177.5	-51.4	94	0	0	0	118.6
152	Q	30.1	Very low	31.6	Very low	155 Å²	155	134.7 Å²	134.7	72%	0.724	73%	0.731	S	S	*	*			trans	-131.6	20.7	162.1	-71.4	-158.8	16.9	0	0	116.3
153	F	28.6	Very low	31.4	Very low	207 Å²	207	134.8 Å²	134.8	91%	0.908	74%	0.743	S	S	*	*	S	Bend	trans	-133.5	47	175	-71.5	-67.6	0	0	0	114.4
154	I	32.4	Very low	30.9	Very low	145 Å²	145	134 Å²	134	74%	0.744	75%	0.751	S	S	*	*	S	Bend	trans	-135.5	138.3	167.3	-56.9	-178.8	0	0	0	108.5
155	N	30.3	Very low	30.5	Very low	155 Å²	155	137.8 Å²	137.8	83%	0.829	76%	0.755	S	S	*	*			trans	68	95.8	-177.4	-52.6	-35.1	0	0	0	115.7
156	N	29.8	Very low	30.7	Very low	168 Å²	168	143.2 Å²	143.2	90%	0.898	77%	0.771	S	S	*	*			trans	-140	62.1	156.7	-157.8	0.4	0	0	0	110.3
157	E	36.3	Very low	30.6	Very low	179 Å²	179	146.1 Å²	146.1	84%	0.836	77%	0.774	S	S	*	*			trans	-91.9	113.4	170.6	-77.4	-158.3	137.2	0	0	111.4
158	V	33.7	Very low	30.7	Very low	122 Å²	122	149.8 Å²	149.8	74%	0.739	78%	0.78	S	S	*	*			trans	64.3	133.3	131.9	-176	0	0	0	0	119.9
159	S	31.7	Very low	30.9	Very low	107 Å²	107	156.1 Å²	156.1	75%	0.748	79%	0.794	S	S	*	*			trans	79.5	90.6	159.4	-75.5	0	0	0	0	120.8
160	A	32.1	Very low	30.9	Very low	77 Å²	77	156.1 Å²	156.1	64%	0.636	79%	0.79	S	S	*	*				62.6	110.3	105.6	0	0	0	0	0	121.1
161	N	31.3	Very low	31.2	Very low	138 Å²	138	157.6 Å²	157.6	74%	0.738	80%	0.801	S	S	*	*			trans	78	154.3	135.1	-56.1	-16.1	0	0	0	120.7
162	H	34.9	Very low	31.3	Very low	165 Å²	165	153.4 Å²	153.4	76%	0.764	80%	0.797	S	S	*	*			trans	75.6	91	163.5	-54.7	-60.6	0	0	0	119.5
163	T	30.2	Very low	31.5	Very low	136 Å²	136	153.6 Å²	153.6	83%	0.834	80%	0.803	S	S	*	*				-9.2	125	128.8	53.1	0	0	0	0	117.3
164	C	26.5	Very low	32	Very low	123 Å²	123	148.3 Å²	148.3	83%	0.831	79%	0.792	S	S	*	*				-166.8	166.3	124.4	-146.5	0	0	0	0	114.7
165	R	26.7	Very low	32	Very low	223 Å²	223	147.4 Å²	147.4	84%	0.842	79%	0.794	S	S	*	*			trans	-64.3	155.7	-168.1	-63.6	160.5	168.7	153.7	-3.9	118.1
166	K	33.4	Very low	32.3	Very low	197 Å²	197	145.2 Å²	145.2	86%	0.857	79%	0.79	S	S	*	*			trans	-2.8	124.1	143.5	-79.7	-177.9	168.2	-178.2	0	117.8
167	F	30.3	Very low	32.6	Very low	183 Å²	183	141.4 Å²	141.4	80%	0.803	78%	0.777	S	S	*	*			trans	-166.9	150.8	146.8	-85.3	-65	0	0	0	107.2
168	Q	31.8	Very low	32.6	Very low	176 Å²	176	140.2 Å²	140.2	82%	0.822	78%	0.776	S	S	*	*			cis	-156.4	175.8	-18.4	-154.7	163.1	8.6	0	0	108.5
169	Y	30.2	Very low	32.5	Very low	210 Å²	210	138.2 Å²	138.2	82%	0.824	77%	0.773	S	S	*	*			trans	-101.2	174.1	179.9	-140.4	-96.4	0	0	0	112.2
170	N	30.1	Very low	32.7	Very low	142 Å²	142	140.6 Å²	140.6	76%	0.759	78%	0.775	S	S	*	*			trans	81.8	147.3	177.5	-48.5	-29.7	0	0	0	114.7
171	S	34.7	Very low	32.9	Very low	124 Å²	124	142.3 Å²	142.3	87%	0.867	78%	0.783	S	S	*	*			cis	-135.8	177.6	23.2	-71.9	0	0	0	0	114.7
172	A	32.7	Very low	32.9	Very low	89 Å²	89	139.4 Å²	139.4	74%	0.736	79%	0.785	S	S	*	*			trans	-101.7	-157.6	179.9	0	0	0	0	0	113.1
173	D	34.5	Very low	33	Very low	159 Å²	159	138.8 Å²	138.8	85%	0.85	79%	0.788	S	S	*	*			trans	76.4	140.8	177.7	-63.2	-25.9	0	0	0	116.6
174	S	37.5	Very low	33.5	Very low	97 Å²	97	137 Å²	137	68%	0.678	78%	0.781	S	S	*	*			cis	-159	141.7	-1.4	36.8	0	0	0	0	115.3
175	T	33.4	Very low	34.4	Very low	126 Å²	126	136.5 Å²	136.5	77%	0.773	78%	0.776	S	S	*	*			trans	36.8	143.5	144.3	60.9	0	0	0	0	125
176	S	36.2	Very low	34.9	Very low	108 Å²	108	131.1 Å²	131.1	76%	0.755	77%	0.771	S	S	*	*			trans	82.2	151.3	142.3	79.8	0	0	0	0	119.6
177	S	37.2	Very low	35.1	Very low	89 Å²	89	126.5 Å²	126.5	62%	0.622	76%	0.764	S	S	*	*			cis	-171.3	163	-24.1	54.6	0	0	0	0	111.3
178	N	35	Very low	35.5	Very low	153 Å²	153	124.3 Å²	124.3	82%	0.818	76%	0.761	S	S	*	*			trans	68.3	156.2	160.9	-56.4	-30.2	0	0	0	117.5
179	A	31.9	Very low	35.8	Very low	81 Å²	81	122.4 Å²	122.4	67%	0.669	76%	0.755	S	S	*	*			cis	-168.4	-152.1	-23.5	0	0	0	0	0	107.3
180	I	37	Very low	36.2	Very low	157 Å²	157	117.2 Å²	117.2	81%	0.805	75%	0.749	S	S	*	*			trans	77.5	98.9	177.2	-48.8	170.4	0	0	0	111.1
181	S	35.8	Very low	36.6	Very low	113 Å²	113	115.7 Å²	115.7	79%	0.79	75%	0.75	S	S	*	*			cis	65.7	94.7	30.2	-39.2	0	0	0	0	113.3
182	G	30.5	Very low	37.1	Very low	77 Å²	77	115.3 Å²	115.3	79%	0.794	75%	0.745	S	S	*	*			trans	-89.4	155.1	175.2	0	0	0	0	0	113.2
183	D	37.7	Very low	37.3	Very low	152 Å²	152	116.1 Å²	116.1	81%	0.813	75%	0.745	S	S	*	*			trans	-149.2	125.5	169	-128.2	-36.1	0	0	0	110.9
184	S	40.2	Very low	37.4	Very low	98 Å²	98	115.6 Å²	115.6	69%	0.685	74%	0.742	S	S	*	*			trans	27.2	156.9	135	-47.4	0	0	0	0	122.7
185	P	45.5	Very low	37.3	Very low	112 Å²	112	115.4 Å²	115.4	73%	0.727	74%	0.741	S	S	*	*			cis	-142.6	-145.3	-36.2	39.3	-17.9	0	0	0	112
186	C	36.9	Very low	37.2	Very low	110 Å²	110	114.7 Å²	114.7	74%	0.743	74%	0.739	S	S	*	*			trans	76.7	107.5	169.1	-62.3	0	0	0	0	116.1
187	S	39.1	Very low	37	Very low	101 Å²	101	116.7 Å²	116.7	71%	0.706	74%	0.737	S	S	*	*				100.6	140.7	76	69.1	0	0	0	0	110.8
188	D	38	Very low	36.8	Very low	137 Å²	137	121.1 Å²	121.1	73%	0.733	75%	0.745	S	S	*	*			cis	-160.9	168.7	19.3	-137.3	-17.1	0	0	0	113.6
189	L	37.9	Very low	36.7	Very low	136 Å²	136	119.1 Å²	119.1	71%	0.712	74%	0.743	S	S	*	*			trans	52.5	106.6	153.6	-64	169.1	0	0	0	120.2
190	S	38.6	Very low	36.5	Very low	100 Å²	100	120.7 Å²	120.7	70%	0.699	75%	0.748	S	S	*	*				93.2	146.7	86.8	78.7	0	0	0	0	114.5
191	S	39.3	Very low	36.3	Very low	110 Å²	110	119.8 Å²	119.8	77%	0.769	75%	0.75	S	S	*	*			cis	-159.1	161	-12.2	-99.9	0	0	0	0	110.1
192	P	43.9	Very low	36.1	Very low	117 Å²	117	119.6 Å²	119.6	76%	0.76	75%	0.749	S	S	*	*			trans	-99.1	-166.8	-167.6	40.3	-38.4	0	0	0	114.9
193	S	37.5	Very low	36.3	Very low	106 Å²	106	122.6 Å²	122.6	74%	0.741	75%	0.752	S	S	*	*			trans	108	148.5	167.6	80.4	0	0	0	0	115.8
194	N	36.1	Very low	36	Very low	148 Å²	148	121 Å²	121	79%	0.791	75%	0.748	S	S	*	*			cis	-162.8	168.5	-28.2	-120	-15.9	0	0	0	111.9
195	S	35.5	Very low	35.9	Very low	92 Å²	92	126.2 Å²	126.2	64%	0.643	76%	0.758	S	S	*	*			trans	56.9	123.7	144.3	65.5	0	0	0	0	122.7
196	C	31.5	Very low	35.4	Very low	111 Å²	111	128.2 Å²	128.2	75%	0.75	76%	0.763	S	S	*	*				70.5	153.5	127.5	-66	0	0	0	0	120
197	Q	31.9	Very low	35.5	Very low	150 Å²	150	131 Å²	131	70%	0.701	77%	0.769	S	S	*	*			cis	-164.4	162.1	-14.9	-119.8	177.5	11.1	0	0	110.3
198	F	33.4	Very low	35.6	Very low	182 Å²	182	131.5 Å²	131.5	80%	0.798	77%	0.77	S	S	*	*			trans	62	153.5	153.5	-84.1	-67.4	0	0	0	122.2
199	S	33.1	Very low	35.4	Very low	111 Å²	111	131.2 Å²	131.2	78%	0.776	78%	0.775	S	S	*	*			trans	98.8	106	155.4	-49.3	0	0	0	0	118.4
200	C	27.6	Very low	35.6	Very low	114 Å²	114	130.4 Å²	130.4	77%	0.77	78%	0.781	S	S	*	*			trans	-53.8	144.3	163	50.1	0	0	0	0	114.9
201	T	32.2	Very low	35.7	Very low	139 Å²	139	129.9 Å²	129.9	85%	0.853	78%	0.782	S	S	*	*				-171.2	162.3	112.3	20.3	0	0	0	0	112.4
202	S	31	Very low	35.8	Very low	108 Å²	108	130.7 Å²	130.7	76%	0.755	79%	0.785	S	S	*	*			trans	-65.3	143.3	-177	51	0	0	0	0	115.6
203	T	34.9	Very low	35.8	Very low	140 Å²	140	136.8 Å²	136.8	86%	0.859	79%	0.793	S	S	*	*			trans	-159.3	139.5	133.7	-75.9	0	0	0	0	110.4
204	T	31.7	Very low	36.1	Very low	120 Å²	120	143.2 Å²	143.2	74%	0.736	80%	0.801	S	S	*	*			trans	-67.3	147.6	-178.9	50.6	0	0	0	0	114.8
205	K	39	Very low	36.6	Very low	207 Å²	207	141.2 Å²	141.2	90%	0.9	80%	0.796	S	S	*	*			trans	-157.6	146.1	146.6	-111.7	158.4	-171.4	174.6	0	112
206	N	33.7	Very low	37.1	Very low	153 Å²	153	142.3 Å²	142.3	82%	0.818	80%	0.801	S	S	*	*			trans	-84.2	150	-166.8	-51.6	-31.7	0	0	0	113.2
207	I	40.9	Very low	37.9	Very low	169 Å²	169	142.8 Å²	142.8	87%	0.867	80%	0.803	S	S	*	*			trans	-157.7	149.9	158.4	-107.2	148.5	0	0	0	108.2
208	P	39.5	Very low	38.4	Very low	112 Å²	112	141.6 Å²	141.6	73%	0.727	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-87.1	167.2	-149.5	33	-38	0	0	0	116.4
209	P	34.5	Very low	39	Very low	131 Å²	131	137.8 Å²	137.8	85%	0.851	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-74.4	139.8	-172	29.8	-36.6	0	0	0	114.3
210	S	41.9	Very low	39.5	Very low	118 Å²	118	137.8 Å²	137.8	83%	0.825	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-90.7	134.6	170.9	54.7	0	0	0	0	111.7
211	A	41.8	Very low	39.9	Very low	89 Å²	89	140.7 Å²	140.7	74%	0.736	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-58.6	154.3	-170.5	0	0	0	0	0	115.9
212	P	41.6	Very low	40	Very low	127 Å²	127	144.7 Å²	144.7	83%	0.825	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-64.5	144.3	171.5	28.9	-35.7	0	0	0	111.4
213	R	42.8	Very low	40.1	Very low	246 Å²	246	148.5 Å²	148.5	93%	0.928	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-74	130.1	170.9	-63.2	179.2	-177.3	-122.1	1.8	108.4
214	R	43.8	Very low	40	Very low	240 Å²	240	148.5 Å²	148.5	91%	0.906	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-68.6	145.6	172.2	-72.5	-172.5	175.7	-149	-1.9	110.3
215	P	46.3	Very low	40.1	Very low	107 Å²	107	148.3 Å²	148.3	70%	0.695	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-63.3	158.9	159.9	30.1	-34.8	0	0	0	110.6
216	P	47.3	Very low	39.8	Very low	114 Å²	114	147.2 Å²	147.2	74%	0.74	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-64.4	155.9	173.9	28.8	-35.1	0	0	0	111.7
217	P	46.3	Very low	39.6	Very low	122 Å²	122	150.8 Å²	150.8	79%	0.792	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-72.6	139.4	177.3	30.8	-34.3	0	0	0	111.8
218	V	43.9	Very low	39.2	Very low	124 Å²	124	151.4 Å²	151.4	75%	0.752	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-64.4	137.4	170.3	-174.9	0	0	0	0	109.4
219	P	44.6	Very low	39	Very low	103 Å²	103	153.6 Å²	153.6	67%	0.669	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-59.5	147.5	173.5	-23.6	34.6	0	0	0	112.4	H221	P219-H221 PolarHBondContact O-N 2.93Å
220	P	43.5	Very low	39	Very low	111 Å²	111	150.4 Å²	150.4	72%	0.721	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-71.9	126.3	177	29.4	-33.4	0	0	0	110.9	Y222	P220-Y222 PolarHBondContact O-N 3.41Å
221	H	36.8	Very low	38.8	Very low	174 Å²	174	152.5 Å²	152.5	81%	0.806	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-57.5	126.6	167.1	-74.7	-97.5	0	0	0	109.7	P219 F223	P219-H221 PolarHBondContact O-N 2.93Å; H221-F223 PolarHBondContact O-N 3.33Å
222	Y	34.7	Very low	38.8	Very low	223 Å²	223	156.3 Å²	156.3	88%	0.875	80%	0.798	S	S	*	*			trans	-71.5	115.8	176.5	-102	-103.4	0	0	0	110.1	P220 V224	P220-Y222 PolarHBondContact O-N 3.41Å; Y222-V224 PolarHBondContact O-N 3.21Å; Y222-V224 VanDerWaalsContact O-N 3.14Å
223	F	32.9	Very low	38.5	Very low	189 Å²	189	157.6 Å²	157.6	83%	0.829	80%	0.798	S	S	*	*			trans	-66.3	110.5	164.5	-82.6	-90.8	0	0	0	109.2	H221 T225	H221-F223 PolarHBondContact O-N 3.33Å; F223-T225 PolarHBondContact O-N 2.89Å
224	V	32.3	Very low	38	Very low	139 Å²	139	154 Å²	154	84%	0.842	80%	0.796	S	S	*	*			trans	-66.9	99.9	169.3	178.9	0	0	0	0	108.3	Y222 H226	Y222-V224 PolarHBondContact O-N 3.21Å; Y222-V224 VanDerWaalsContact O-N 3.14Å; V224-H226 PolarHBondContact O-N 2.77Å
225	T	33.4	Very low	37.5	Very low	117 Å²	117	152 Å²	152	72%	0.718	80%	0.798	S	S	*	*			trans	-71.7	113.2	175.6	54.5	0	0	0	0	109.6	F223 R227	F223-T225 PolarHBondContact O-N 2.89Å; T225-R227 PolarHBondContact O-N 2.79Å
226	H	33.6	Very low	37	Very low	183 Å²	183	150.4 Å²	150.4	85%	0.847	80%	0.8	S	S	*	*			trans	-50	117	162.5	-95.7	-76.7	0	0	0	109.2	V224 Q228	V224-H226 PolarHBondContact O-N 2.77Å; H226-Q228 PolarHBondContact O-N 2.7Å
227	R	28.5	Very low	36.5	Very low	229 Å²	229	150.9 Å²	150.9	86%	0.864	80%	0.796	S	S	*	*			trans	-70.6	101.6	166.1	-77.7	-174.8	174.1	171.3	0.2	108	T225	T225-R227 PolarHBondContact O-N 2.79Å
228	Q	32.4	Very low	36.2	Very low	181 Å²	181	152.3 Å²	152.3	85%	0.846	79%	0.79	S	S	*	*			trans	-71.8	123.1	155.7	-69.5	-178.9	-24	0	0	107.5	H226 G230	H226-Q228 PolarHBondContact O-N 2.7Å; Q228-G230 PolarHBondContact O-N 3.02Å
229	D	36.2	Very low	35.9	Very low	159 Å²	159	152.5 Å²	152.5	85%	0.85	79%	0.787	S	S	*	*			trans	-68	96.1	170.3	-77.6	-50.9	0	0	0	109.4	D231	D229-D231 PolarHBondContact O-N 2.87Å
230	G	33.5	Very low	35.7	Very low	64 Å²	64	153.5 Å²	153.5	66%	0.66	79%	0.787	S	S	*	*			trans	-75.4	76.6	175.5	0	0	0	0	0	110.8	Q228	Q228-G230 PolarHBondContact O-N 3.02Å
231	D	38.5	Very low	35.5	Very low	162 Å²	162	154.3 Å²	154.3	87%	0.866	79%	0.785	S	S	*	*			trans	-60.1	141.5	-179.2	-160	2.7	0	0	0	111.8	D229	D229-D231 PolarHBondContact O-N 2.87Å
232	K	41.3	Very low	35.5	Very low	169 Å²	169	153.3 Å²	153.3	74%	0.735	78%	0.781	S	S	*	*			trans	-116.7	117.9	-162.7	-81.4	-176.4	-178.7	172	0	114.1
233	N	35.5	Very low	35.6	Very low	153 Å²	153	148.3 Å²	148.3	82%	0.818	77%	0.773	S	S	*	*			trans	70	124.2	154.2	-59.8	-19.1	0	0	0	117.3
234	L	32.5	Very low	35.8	Very low	170 Å²	170	146.3 Å²	146.3	89%	0.89	77%	0.77	S	S	*	*			trans	-63.8	138	162.7	-64.9	67.8	0	0	0	110.2
235	E	34.5	Very low	35.9	Very low	200 Å²	200	144.3 Å²	144.3	94%	0.935	76%	0.759	S	S	*	*				-166.9	144.1	118.2	-108.5	-177.1	-166	0	0	109.9
236	G	34.5	Very low	36.1	Very low	73 Å²	73	146 Å²	146	75%	0.753	76%	0.761	S	S	*	*			trans	121.8	76.3	168.6	0	0	0	0	0	117.9
237	D	37.3	Very low	36.2	Very low	123 Å²	123	142.6 Å²	142.6	66%	0.658	75%	0.746	S	S	*	*			trans	53.3	119.4	141.6	-100.7	12.9	0	0	0	123
238	K	38.8	Very low	36.4	Very low	153 Å²	153	141.4 Å²	141.4	67%	0.665	74%	0.741	S	S	*	*			trans	60.5	133.7	130.2	-60.8	178.9	-177.5	81.1	0	118.4
239	N	38.6	Very low	36.6	Very low	128 Å²	128	138.7 Å²	138.7	68%	0.684	74%	0.738	S	S	*	*			cis	-167.4	162.5	25.4	-126.9	7.9	0	0	0	112.9
240	N	39.5	Very low	36.5	Very low	123 Å²	123	140.1 Å²	140.1	66%	0.658	74%	0.736	S	S	*	*			trans	71.8	111.6	152.5	-58.8	-3.5	0	0	0	121.8
241	N	39.2	Very low	36.7	Very low	128 Å²	128	142 Å²	142	68%	0.684	74%	0.739	S	S	*	*				65.6	138.4	124.1	-63.1	39	0	0	0	120.7
242	E	36.8	Very low	36.7	Very low	153 Å²	153	141 Å²	141	72%	0.715	73%	0.734	S	S	*	*			cis	-169	167.9	-6.1	-122.8	174.7	142	0	0	110.6
243	V	36.8	Very low	36.5	Very low	118 Å²	118	138 Å²	138	72%	0.715	73%	0.734	S	S	*	*			trans	64.6	129	147.8	163.9	0	0	0	0	118.4
244	L	38.6	Very low	36.4	Very low	148 Å²	148	138.9 Å²	138.9	78%	0.775	73%	0.733	S	S	*	*			cis	-151.8	162.3	-7.7	-108.5	173.2	0	0	0	111.4
245	T	33.4	Very low	36.2	Very low	97 Å²	97	137.4 Å²	137.4	60%	0.595	73%	0.725	S	S	*	*			trans	-57.9	174.9	167.2	47.7	0	0	0	0	113.1
246	I	38.8	Very low	36	Very low	151 Å²	151	135.8 Å²	135.8	77%	0.774	72%	0.717	S	S	*	*				-154.9	111.9	62.4	-71	177	0	0	0	113.7
247	E	35.2	Very low	35.7	Very low	113 Å²	113	141.3 Å²	141.3	53%	0.528	72%	0.724	S	S	.	*				41.2	129.2	123.6	-50.9	-154.5	164.4	0	0	126
248	R	32.3	Very low	35.4	Very low	203 Å²	203	144 Å²	144	77%	0.766	73%	0.73	S	S	*	*				57.8	165.9	120.8	-54.5	174.8	-174.2	141.5	4.7	119.6
249	T	36.8	Very low	34.8	Very low	125 Å²	125	142.4 Å²	142.4	77%	0.767	74%	0.738	S	S	*	*			cis	-127	158.3	1	48.1	0	0	0	0	109
250	K	34.2	Very low	34.4	Very low	189 Å²	189	144.4 Å²	144.4	82%	0.822	75%	0.748	S	S	*	*			cis	82.1	99.2	27.5	-142.6	-164	-169.1	-157.9	0	116.5
251	S	37.7	Very low	33.9	Very low	103 Å²	103	144 Å²	144	72%	0.72	75%	0.754	S	S	*	*			trans	-169.3	107.2	144.8	43	0	0	0	0	113.3
252	D	37.6	Very low	33.4	Very low	142 Å²	142	141 Å²	141	76%	0.759	75%	0.754	S	S	*	*				45.5	130.8	127.1	-42.2	-39.4	0	0	0	120.4
253	S	37.6	Very low	33.1	Very low	104 Å²	104	141.2 Å²	141.2	73%	0.727	76%	0.76	S	S	*	*				-174.5	154.7	61.3	42.7	0	0	0	0	114.1
254	H	34.2	Very low	32.6	Very low	173 Å²	173	142.4 Å²	142.4	80%	0.801	76%	0.762	S	S	*	*			trans	28.6	151.6	147.9	-71.8	-100.9	0	0	0	123.2
255	L	28.6	Very low	32.3	Very low	139 Å²	139	142.7 Å²	142.7	73%	0.728	76%	0.763	S	S	*	*			cis	-180	118.5	-19.9	174.4	80.5	0	0	0	107.9
256	E	30.4	Very low	32	Very low	165 Å²	165	142.8 Å²	142.8	77%	0.771	77%	0.766	S	S	*	*			trans	-170.2	143.6	136.7	-116.5	-172.1	-174.9	0	0	110.9
257	Q	27.1	Very low	31.7	Very low	190 Å²	190	144.8 Å²	144.8	89%	0.888	77%	0.77	S	S	*	*			trans	-97.9	124.6	173.8	-66.1	174.1	-80.2	0	0	109.6
258	K	30	Very low	31.6	Very low	179 Å²	179	145.6 Å²	145.6	78%	0.778	78%	0.782	S	S	*	*			trans	-128.9	117	156.1	-77.4	-175.5	179.4	169.9	0	109.9	L260	K258-L260 PolarHBondContact O-N 3.16Å
259	S	26.5	Very low	31.4	Very low	119 Å²	119	143.1 Å²	143.1	83%	0.832	78%	0.784	S	S	*	*			trans	-61.6	124.4	163.4	50.7	0	0	0	0	109.4
260	L	31.7	Very low	31.3	Very low	171 Å²	171	142 Å²	142	90%	0.895	79%	0.788	S	S	*	*			trans	-119.5	110.1	164.8	-87.4	166	0	0	0	108.9	K258	K258-L260 PolarHBondContact O-N 3.16Å
261	S	28.8	Very low	31.1	Very low	113 Å²	113	140 Å²	140	79%	0.79	79%	0.786	S	S	*	*			trans	-89.6	137.6	171	51.9	0	0	0	0	110.1
262	G	28.8	Very low	31	Very low	67 Å²	67	140.9 Å²	140.9	69%	0.691	79%	0.787	S	S	*	*	S	Bend	trans	64.9	130.5	147	0	0	0	0	0	118.7
263	N	29.1	Very low	30.7	Very low	156 Å²	156	140.7 Å²	140.7	83%	0.834	79%	0.786	S	S	*	*			trans	58	108.9	157.3	-55.3	9.6	0	0	0	117.1
264	D	28	Very low	30.4	Very low	144 Å²	144	141.1 Å²	141.1	77%	0.77	79%	0.788	S	S	*	*				-178.4	111.6	125.8	-91.1	-17	0	0	0	109.3
265	I	31	Very low	30.4	Very low	154 Å²	154	141.9 Å²	141.9	79%	0.79	79%	0.793	S	S	*	*			trans	-117.2	81.2	159	-59.3	-178.1	0	0	0	106.3	F267	I265-F267 HydrophobicContact CG2-CD2 3.93Å; I265-F267 HydrophobicContact CG2-CE2 3.84Å; I265-F267 PolarHBondContact O-N 3.48Å
266	C	28.1	Very low	30.4	Very low	98 Å²	98	144.3 Å²	144.3	66%	0.662	80%	0.8	S	S	*	*			trans	-72.1	107.5	171.5	-57.7	0	0	0	0	109
267	F	32.4	Very low	30.5	Very low	193 Å²	193	145.5 Å²	145.5	85%	0.846	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-82.1	138.5	155.2	-89.7	-85.2	0	0	0	109.1	I265	I265-F267 HydrophobicContact CG2-CD2 3.93Å; I265-F267 HydrophobicContact CG2-CE2 3.84Å; I265-F267 PolarHBondContact O-N 3.48Å
268	V	33	Very low	30.6	Very low	130 Å²	130	142 Å²	142	79%	0.788	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-89.8	134.5	-158	-169.9	0	0	0	0	111.2	A270	V268-A270 PolarHBondContact O-N 2.91Å
269	D	27	Very low	30.7	Very low	152 Å²	152	140.1 Å²	140.1	81%	0.813	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-55.8	132.6	169.3	-79	-59.8	0	0	0	111.7
270	A	34.9	Very low	30.8	Very low	101 Å²	101	140 Å²	140	84%	0.835	80%	0.798	S	S	*	*			trans	-131.5	65.2	176.8	0	0	0	0	0	110.8	V268	V268-A270 PolarHBondContact O-N 2.91Å
271	N	29.3	Very low	31	Very low	148 Å²	148	140.7 Å²	140.7	79%	0.791	79%	0.794	S	S	*	*			trans	-101.2	163.7	165.3	-96.5	-39.4	0	0	0	110.2
272	V	37.4	Very low	31	Very low	121 Å²	121	143.1 Å²	143.1	73%	0.733	79%	0.793	S	S	*	*			trans	83.8	97.7	172.2	-169	0	0	0	0	116.5
273	D	31.5	Very low	31.1	Very low	138 Å²	138	147.6 Å²	147.6	74%	0.738	80%	0.799	S	S	*	*			trans	59.9	107.7	134.4	-52.6	-11.6	0	0	0	122.9
274	S	31.3	Very low	31.2	Very low	112 Å²	112	146.4 Å²	146.4	78%	0.783	79%	0.792	S	S	*	*				86.9	149.4	125.4	77.6	0	0	0	0	121.9
275	E	32.8	Very low	31.2	Very low	190 Å²	190	146.9 Å²	146.9	89%	0.888	80%	0.795	S	S	*	*			trans	69.3	148.9	166.8	-53.9	-154.5	159	0	0	119.8
276	H	30.1	Very low	31.3	Very low	189 Å²	189	147.9 Å²	147.9	88%	0.875	80%	0.801	S	S	*	*			trans	-72.8	128.9	-169	-71.5	-115.4	0	0	0	112.9
277	E	32.6	Very low	31.4	Very low	191 Å²	191	151.8 Å²	151.8	89%	0.893	81%	0.809	S	S	*	*			trans	-157.7	156.6	134.6	-121.3	172.3	-159.3	0	0	112.6
278	S	28.3	Very low	31.4	Very low	116 Å²	116	151.7 Å²	151.7	81%	0.811	81%	0.811	S	S	*	*			trans	-92.7	114.6	-172.3	59.1	0	0	0	0	112.5
279	I	32.8	Very low	31.3	Very low	140 Å²	140	157 Å²	157	72%	0.718	82%	0.817	S	S	*	*			trans	-121.9	107	175.6	-59	-178.1	0	0	0	110.6	F281	I279-F281 HydrophobicContact CG2-CD2 4.04Å; I279-F281 HydrophobicContact CG2-CE2 4.32Å; I279-F281 PolarHBondContact O-N 3.07Å
280	S	28.8	Very low	31.5	Very low	116 Å²	116	159.1 Å²	159.1	81%	0.811	82%	0.819	S	S	*	*			trans	-75.7	103.6	171.2	-58.7	0	0	0	0	110.5	Q282	S280-Q282 PolarHBondContact O-N 3.3Å
281	F	34.1	Very low	31.3	Very low	185 Å²	185	164.4 Å²	164.4	81%	0.811	82%	0.823	S	S	*	*			trans	-77.2	120.3	175.2	-117.7	-88.5	0	0	0	111.7	I279	I279-F281 HydrophobicContact CG2-CD2 4.04Å; I279-F281 HydrophobicContact CG2-CE2 4.32Å; I279-F281 PolarHBondContact O-N 3.07Å
282	Q	30.3	Very low	31.3	Very low	164 Å²	164	162.2 Å²	162.2	77%	0.766	83%	0.826	S	S	*	*			trans	-87.1	108.6	179.6	-66.3	176.6	-12.7	0	0	110.5	S280 L284	S280-Q282 PolarHBondContact O-N 3.3Å; Q282-L284 PolarHBondContact O-N 2.58Å
283	I	31.2	Very low	31.2	Very low	162 Å²	162	162 Å²	162	83%	0.831	83%	0.829	S	S	*	*			trans	-89.1	89.6	165.5	-57.5	-178.3	0	0	0	108.2
284	L	29.5	Very low	31	Very low	131 Å²	131	163.4 Å²	163.4	69%	0.686	84%	0.837	S	S	*	*			trans	-120.3	147	170.1	-87	165.6	0	0	0	109.1	Q282	Q282-L284 PolarHBondContact O-N 2.58Å
285	N	29.2	Very low	31.1	Very low	154 Å²	154	166.9 Å²	166.9	82%	0.824	84%	0.841	S	S	*	*			trans	77.1	61.4	177.8	-52	-54.5	0	0	0	117.8
286	L	32.4	Very low	30.9	Very low	174 Å²	174	164.1 Å²	164.1	91%	0.911	84%	0.841	S	S	*	*			trans	-124.4	54.3	153	-99.3	170.7	0	0	0	110.9
287	H	30.5	Very low	31.2	Very low	180 Å²	180	161.3 Å²	161.3	83%	0.833	83%	0.831	S	S	*	*			trans	-135.5	24.5	-172.7	-148.4	-63.1	0	0	0	114.5
288	H	31.5	Very low	31.2	Very low	192 Å²	192	157.8 Å²	157.8	89%	0.889	82%	0.818	S	S	*	*	S	Bend	trans	-138.4	40.1	-170.5	-117.4	-71.3	0	0	0	114.7
289	R	31.5	Very low	31.4	Very low	242 Å²	242	155.5 Å²	155.5	91%	0.913	80%	0.802	S	S	*	*	S	Bend	trans	-145.4	7.3	175.9	-128.4	178	-166.3	167.5	4.6	120
290	F	31.1	Very low	31.5	Very low	196 Å²	196	153.9 Å²	153.9	86%	0.86	79%	0.791	S	S	*	*			trans	-114	106	173.7	-81.3	-83.9	0	0	0	111.7
291	K	30.3	Very low	31.9	Very low	211 Å²	211	151.6 Å²	151.6	92%	0.917	78%	0.776	S	S	*	*			trans	-165.8	54.6	173.7	-153.5	180	-175.2	180	0	114.7
292	A	30.4	Very low	31.9	Very low	103 Å²	103	148.4 Å²	148.4	85%	0.851	77%	0.765	S	S	*	*			trans	-166	61	170.3	0	0	0	0	0	116.4
293	S	34.1	Very low	31.9	Very low	115 Å²	115	147.9 Å²	147.9	80%	0.804	76%	0.756	S	S	*	*			trans	-163.2	143.7	153.9	46.6	0	0	0	0	109.4
294	N	27.2	Very low	32	Very low	169 Å²	169	144.8 Å²	144.8	90%	0.904	75%	0.749	S	S	*	*			trans	-119.2	81.1	-177.4	-80.8	2.7	0	0	0	110.2
295	E	34.8	Very low	32.1	Very low	184 Å²	184	146.9 Å²	146.9	86%	0.86	75%	0.749	S	S	*	*			trans	-128.1	155	157	-68.3	-159.6	147.5	0	0	109.6	I297	E295-I297 PolarHBondContact O-N 3.16Å
296	C	29.2	Very low	32.1	Very low	133 Å²	133	143.6 Å²	143.6	90%	0.899	74%	0.738	S	S	*	*			trans	-89.7	96.9	-153.8	-163.8	0	0	0	0	113.3
297	I	34.3	Very low	32	Very low	129 Å²	129	142.1 Å²	142.1	66%	0.662	73%	0.731	S	S	*	*			trans	-94.7	113.3	168.5	-53.2	-179.9	0	0	0	109.5	E295 C299	E295-I297 PolarHBondContact O-N 3.16Å; I297-C299 PolarHBondContact O-N 3.18Å; I297-C299 PolarHBondContact O-SG 3.32Å
298	D	34.3	Very low	31.9	Very low	117 Å²	117	140.9 Å²	140.9	63%	0.626	73%	0.729	S	S	*	*			trans	-74.9	94.5	175.6	-177	14.9	0	0	0	111.7	E300	D298-E300 PolarHBondContact O-N 3.37Å; D298-E300 WeakPolarHBondContact OD1-CG 3.43Å
299	C	30.8	Very low	31.8	Very low	69 Å²	69	140.9 Å²	140.9	47%	0.466	73%	0.727	S	S	.	*			trans	-87.5	17.8	-171.5	-72.3	0	0	0	0	115.1	I297 S301 I302	I297-C299 PolarHBondContact O-N 3.18Å; I297-C299 PolarHBondContact O-SG 3.32Å; C299-S301 VanDerWaalsContact C-N 3.25Å; C299-S301 PolarHBondContact O-N 3.13Å; C299-S301 VanDerWaalsContact O-N 3.11Å; C299-I302 HydrophobicContact CB-CD1 4.13Å; C299-I302 WeakPolarHBondContact O-CB 3.48Å; C299-I302 PolarHBondContact O-N 3.36Å; C299-I302 VanDerWaalsContact O-N 3.08Å
300	E	35.9	Very low	31.6	Very low	105 Å²	105	139.2 Å²	139.2	49%	0.491	72%	0.722	S	S	.	*	G	3₁₀ helix	trans	-56.4	-30	-173.2	-76.1	-97.4	92.7	0	0	114.8	D298 I302 R303	D298-E300 PolarHBondContact O-N 3.37Å; D298-E300 WeakPolarHBondContact OD1-CG 3.43Å; E300-I302 VanDerWaalsContact C-N 3.25Å; E300-I302 PolarHBondContact O-N 2.91Å; E300-R303 PolarHBondContact O-N 3.18Å; E300-R303 IonicContact OE1-CZ 2.66Å; E300-R303 IonicContact OE1-NH1 3.7Å; E300-R303 PolarHBondContact OE1-NH1 2.65Å
301	S	36.9	Very low	31.6	Very low	69 Å²	69	135.4 Å²	135.4	48%	0.483	72%	0.72	S	S	.	*	G	3₁₀ helix	trans	-65	-25.7	178.6	-163.2	0	0	0	0	113.8	C299 R303	C299-S301 VanDerWaalsContact C-N 3.25Å; C299-S301 PolarHBondContact O-N 3.13Å; C299-S301 VanDerWaalsContact O-N 3.11Å; S301-R303 PolarHBondContact O-N 3.37Å
302	I	33.3	Very low	31.7	Very low	117 Å²	117	130.4 Å²	130.4	60%	0.6	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-68.4	-19.5	-176.3	-63	179.6	0	0	0	111.8	C299 E300 S304 Y305	C299-I302 HydrophobicContact CB-CD1 4.13Å; C299-I302 WeakPolarHBondContact O-CB 3.48Å; C299-I302 PolarHBondContact O-N 3.36Å; C299-I302 VanDerWaalsContact O-N 3.08Å; E300-I302 VanDerWaalsContact C-N 3.25Å; E300-I302 PolarHBondContact O-N 2.91Å; I302-S304 PolarHBondContact O-N 3.14Å; I302-S304 VanDerWaalsContact O-N 3.16Å; I302-Y305 PolarHBondContact O-N 3.22Å
303	R	30.8	Very low	31.7	Very low	153 Å²	153	133.4 Å²	133.4	58%	0.577	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-67.6	-14.1	-176.6	-73.1	-179.7	167.2	149.6	0.2	115.1	E300 S301 S306	E300-R303 PolarHBondContact O-N 3.18Å; E300-R303 IonicContact OE1-CZ 2.66Å; E300-R303 IonicContact OE1-NH1 3.7Å; E300-R303 PolarHBondContact OE1-NH1 2.65Å; S301-R303 PolarHBondContact O-N 3.37Å; R303-S306 PolarHBondContact O-OG 3.1Å
304	S	32.8	Very low	31.6	Very low	97 Å²	97	134 Å²	134	68%	0.678	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-83.8	-16.6	175	-63.4	0	0	0	0	114.5	I302 S306	I302-S304 PolarHBondContact O-N 3.14Å; I302-S304 VanDerWaalsContact O-N 3.16Å; S304-S306 PolarHBondContact O-N 3.42Å
305	Y	31.9	Very low	31.9	Very low	176 Å²	176	134.2 Å²	134.2	69%	0.69	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	51.7	-173	-76.6	-82.6	0	0	0	113.5	I302	I302-Y305 PolarHBondContact O-N 3.22Å
306	S	30.1	Very low	32	Very low	84 Å²	84	133.2 Å²	133.2	59%	0.587	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.6	4	-171.7	57.6	0	0	0	0	116.5	R303 S304	R303-S306 PolarHBondContact O-OG 3.1Å; S304-S306 PolarHBondContact O-N 3.42Å
307	N	29.3	Very low	32	Very low	143 Å²	143	129.8 Å²	129.8	77%	0.765	70%	0.701	S	S	*	*			trans	-138.7	11.2	-173.1	-83.6	-62.6	0	0	0	116.9	F309	N307-F309 PolarHBondContact O-N 2.98Å
308	I	29.6	Very low	32.1	Very low	155 Å²	155	130.1 Å²	130.1	80%	0.795	71%	0.71	S	S	*	*			trans	-103.2	57.5	-178.6	-44.1	-175.3	0	0	0	112.1
309	F	29.4	Very low	32.2	Very low	191 Å²	191	133.1 Å²	133.1	84%	0.838	72%	0.717	S	S	*	*	S	Bend	trans	-150.4	142	159	-96.1	-80.6	0	0	0	109	N307	N307-F309 PolarHBondContact O-N 2.98Å
310	Y	28.1	Very low	32.4	Very low	207 Å²	207	137.8 Å²	137.8	81%	0.812	73%	0.732	S	S	*	*			trans	66.3	95	-179.2	-69.7	-85.3	0	0	0	119
311	S	30.5	Very low	32.2	Very low	117 Å²	117	138.7 Å²	138.7	82%	0.818	75%	0.745	S	S	*	*				-168.7	106.3	118.7	22.3	0	0	0	0	108.8
312	S	31.4	Very low	32	Very low	105 Å²	105	144.3 Å²	144.3	73%	0.734	76%	0.763	S	S	*	*				81	117.2	70.2	-67.1	0	0	0	0	113
313	L	30.1	Very low	32	Very low	166 Å²	166	147.2 Å²	147.2	87%	0.869	77%	0.772	S	S	*	*			trans	-59.7	145.5	174.8	-70.2	161	0	0	0	111.4	L315	L313-L315 PolarHBondContact O-N 3.45Å
314	P	33.3	Very low	32.1	Very low	127 Å²	127	147 Å²	147	83%	0.825	78%	0.781	S	S	*	*			trans	-73.7	120.9	178.8	29.7	-33.7	0	0	0	111.4
315	L	33.5	Very low	32.1	Very low	174 Å²	174	147.5 Å²	147.5	91%	0.911	78%	0.776	S	S	*	*			trans	-106.6	124.3	157.6	-89.7	167.1	0	0	0	108	L313	L313-L315 PolarHBondContact O-N 3.45Å
316	D	35.8	Very low	32.1	Very low	163 Å²	163	148.8 Å²	148.8	87%	0.872	78%	0.78	S	S	*	*			trans	-73.8	145.5	-170.1	-154.4	-12.4	0	0	0	112.2
317	G	30	Very low	32.2	Very low	61 Å²	61	151 Å²	151	63%	0.629	79%	0.785	S	S	*	*			trans	-133.2	82.2	-157.5	0	0	0	0	0	115
318	T	37.3	Very low	32.2	Very low	137 Å²	137	152 Å²	152	84%	0.84	79%	0.785	S	S	*	*			trans	-106.4	80.6	177	39.5	0	0	0	0	113.7
319	K	36.3	Very low	32.3	Very low	180 Å²	180	150.2 Å²	150.2	78%	0.783	79%	0.787	S	S	*	*			trans	38.1	140.4	139	-70.6	-179.8	179.9	173.5	0	122.2
320	Q	34.5	Very low	32.5	Very low	166 Å²	166	145.1 Å²	145.1	78%	0.776	78%	0.78	S	S	*	*			trans	78.3	97.3	144.1	-75.6	169.3	-30.2	0	0	119.3
321	T	30.9	Very low	32.6	Very low	124 Å²	124	143.9 Å²	143.9	76%	0.761	78%	0.779	S	S	*	*				27	113.2	117.5	56.9	0	0	0	0	117.9
322	E	33.8	Very low	32.7	Very low	187 Å²	187	146.1 Å²	146.1	87%	0.874	78%	0.776	S	S	*	*				-162.9	-171.5	92.8	-104.1	-160.2	146.3	0	0	113.1
323	K	32.8	Very low	32.7	Very low	179 Å²	179	146.1 Å²	146.1	78%	0.778	77%	0.772	S	S	*	*			trans	-88	159.1	-160.5	-68.7	170	176.4	163.9	0	115.2
324	L	31.9	Very low	32.9	Very low	148 Å²	148	144.9 Å²	144.9	78%	0.775	77%	0.765	S	S	*	*			trans	81.8	130.4	142	-81.1	157.3	0	0	0	120.8
325	D	33.2	Very low	33	Very low	107 Å²	107	143.9 Å²	143.9	57%	0.572	75%	0.753	S	S	*	*			trans	65	107.3	146.1	-80.7	16	0	0	0	123.1
326	R	33.2	Very low	33.3	Very low	204 Å²	204	143.1 Å²	143.1	77%	0.77	74%	0.744	S	S	*	*				75.3	109.2	123.1	-68.8	174.3	165.8	138.6	-9.9	120.8
327	N	31.6	Very low	33.3	Very low	129 Å²	129	143.3 Å²	143.3	69%	0.69	74%	0.737	S	S	*	*				47.6	122.4	127.5	-70.8	50.2	0	0	0	121.6
328	E	29.8	Very low	33.7	Very low	165 Å²	165	146.1 Å²	146.1	77%	0.771	74%	0.738	S	S	*	*			trans	59.8	111.1	132.2	-59.6	173.8	109.1	0	0	119.2
329	S	31.5	Very low	33.7	Very low	118 Å²	118	145 Å²	145	83%	0.825	73%	0.727	S	S	*	*				174.5	168.1	95.7	47.8	0	0	0	0	114.1
330	A	33.7	Very low	33.8	Very low	84 Å²	84	142.3 Å²	142.3	69%	0.694	72%	0.721	S	S	*	*			trans	69.7	100.9	151.8	0	0	0	0	0	121.8
331	F	30.5	Very low	34	Very low	180 Å²	180	140.8 Å²	140.8	79%	0.789	72%	0.719	S	S	*	*				58.8	124.4	112.5	-93.2	-108.9	0	0	0	122.7
332	Q	32.7	Very low	34.3	Very low	164 Å²	164	142.4 Å²	142.4	77%	0.766	72%	0.717	S	S	*	*			trans	65.4	146.2	131.7	-88.3	-173.3	-9.6	0	0	120.6
333	T	30.4	Very low	34.4	Very low	105 Å²	105	139.1 Å²	139.1	64%	0.644	71%	0.706	S	S	*	*			cis	-163.2	-174.6	-12.2	-23.5	0	0	0	0	108.4
334	I	33.8	Very low	34.4	Very low	141 Å²	141	135.2 Å²	135.2	72%	0.723	70%	0.701	S	S	*	*			trans	73.4	142.8	150.5	-74.8	156.1	0	0	0	116.5
335	D	35.9	Very low	34.8	Very low	105 Å²	105	134.3 Å²	134.3	56%	0.561	70%	0.697	S	S	*	*			cis	-157.2	179.7	-25.3	-90.5	-17.7	0	0	0	105.2
336	H	39.3	Very low	35	Very low	159 Å²	159	137 Å²	137	74%	0.736	70%	0.704	S	S	*	*			cis	-139.8	177.2	22.4	-81.4	-78.5	0	0	0	109.1
337	F	36.7	Very low	35.1	Very low	166 Å²	166	136.4 Å²	136.4	73%	0.728	71%	0.707	S	S	*	*			cis	64	138.4	42.9	-50.1	-69.2	0	0	0	114.2
338	N	37.3	Very low	35.1	Very low	120 Å²	120	134.3 Å²	134.3	64%	0.642	70%	0.702	S	S	*	*			cis	-153.8	-172.3	-0.2	-123.1	23.6	0	0	0	108.1
339	D	38.5	Very low	35.3	Very low	114 Å²	114	132.2 Å²	132.2	61%	0.61	70%	0.701	S	S	*	*			cis	-158.3	144.2	10.2	-123.3	-53.8	0	0	0	109.6
340	N	37.6	Very low	35.2	Very low	124 Å²	124	131.3 Å²	131.3	66%	0.663	69%	0.693	S	S	*	*				15.1	158.6	127.5	-54.6	-20.1	0	0	0	121.4
341	D	38.3	Very low	35.1	Very low	134 Å²	134	134.7 Å²	134.7	72%	0.717	70%	0.695	S	S	*	*			cis	-164.7	169.3	-10.5	-116.7	-35.7	0	0	0	113.9
342	E	37.3	Very low	35.2	Very low	158 Å²	158	131.8 Å²	131.8	74%	0.738	69%	0.692	S	S	*	*			trans	17.8	148.3	152	-67.2	-148	139.5	0	0	126.7
343	N	37.3	Very low	35.1	Very low	117 Å²	117	130.2 Å²	130.2	63%	0.626	69%	0.689	S	S	*	*			trans	79.4	99.3	136	-89.1	-50.7	0	0	0	123.7
344	S	32.7	Very low	35.2	Very low	98 Å²	98	131.6 Å²	131.6	69%	0.685	69%	0.691	S	S	*	*				28.6	121.4	124.9	68.6	0	0	0	0	120.8
345	D	39.1	Very low	35	Very low	128 Å²	128	130.1 Å²	130.1	68%	0.684	69%	0.693	S	S	*	*				-151.4	171.5	112.3	-141.6	0.6	0	0	0	116
346	K	37.6	Very low	34.9	Very low	165 Å²	165	132.4 Å²	132.4	72%	0.717	71%	0.711	S	S	*	*			trans	-54.5	151.2	-168.9	-48.2	129.3	-173.7	86.9	0	116.4
347	K	34.6	Very low	34.7	Very low	190 Å²	190	128.2 Å²	128.2	83%	0.826	71%	0.711	S	S	*	*				113.1	136.8	119.5	-138.1	-178.1	-173.7	-177.7	0	119.2
348	S	33.1	Very low	34.7	Very low	85 Å²	85	129 Å²	129	59%	0.594	72%	0.716	S	S	*	*			trans	69.8	115.1	144.5	47	0	0	0	0	121.9
349	T	32.6	Very low	34.5	Very low	122 Å²	122	128.5 Å²	128.5	75%	0.748	72%	0.718	S	S	*	*			trans	69.9	136.3	130.2	57.6	0	0	0	0	120.7
350	C	29.6	Very low	34.3	Very low	99 Å²	99	130.7 Å²	130.7	67%	0.669	73%	0.729	S	S	*	*			trans	45.7	140.9	130.9	-58.2	0	0	0	0	119.8
351	E	31.8	Very low	34.1	Very low	154 Å²	154	130.9 Å²	130.9	72%	0.72	73%	0.73	S	S	*	*			cis	-175.9	163.3	1.7	-116.8	165.3	152.4	0	0	105.7
352	T	32	Very low	34	Very low	120 Å²	120	131.8 Å²	131.8	74%	0.736	74%	0.735	S	S	*	*			trans	61.9	163.5	156.3	56.8	0	0	0	0	116.9
353	D	32.2	Very low	33.7	Very low	130 Å²	130	130.3 Å²	130.3	70%	0.695	74%	0.737	S	S	*	*			cis	-154.6	169.8	-20.2	-115.5	-20	0	0	0	111.1
354	L	32.3	Very low	33.4	Very low	134 Å²	134	132 Å²	132	70%	0.702	74%	0.744	S	S	*	*			trans	40.2	117.4	152.2	-83.2	67.7	0	0	0	119.3
355	C	30	Very low	33.3	Very low	111 Å²	111	135.2 Å²	135.2	75%	0.75	75%	0.753	S	S	*	*				63.5	117.4	72.2	-64.4	0	0	0	0	116.7
356	T	33.6	Very low	32.9	Very low	153 Å²	153	131.9 Å²	131.9	94%	0.939	75%	0.75	S	S	*	*				-174.3	116.8	128.2	16.2	0	0	0	0	108.7
357	G	35.5	Very low	32.7	Very low	71 Å²	71	130.3 Å²	130.3	73%	0.732	76%	0.759	S	S	*	*				119.3	163.2	89.8	0	0	0	0	0	108.9
358	Q	35.9	Very low	32.5	Very low	182 Å²	182	126 Å²	126	85%	0.85	75%	0.753	S	S	*	*			cis	-147.8	129.3	0.2	-76.2	-178.6	-17.4	0	0	107.3
359	T	32.1	Very low	32.5	Very low	110 Å²	110	129.7 Å²	129.7	68%	0.675	77%	0.765	S	S	*	*				91.2	149.6	89.2	-54.6	0	0	0	0	114.9
360	L	35.9	Very low	32.4	Very low	160 Å²	160	131.3 Å²	131.3	84%	0.838	77%	0.769	S	S	*	*			trans	103.7	91.4	176.9	-59.6	174	0	0	0	113.3
361	N	33.6	Very low	32.6	Very low	128 Å²	128	135 Å²	135	68%	0.684	78%	0.777	S	S	*	*			cis	91.9	131.3	42.6	-67.4	5.3	0	0	0	115.1
362	N	34.8	Very low	32.6	Very low	153 Å²	153	134.8 Å²	134.8	82%	0.818	79%	0.786	S	S	*	*			trans	115.4	89.6	168.8	-62.8	-11.9	0	0	0	112.2
363	T	30.7	Very low	32.6	Very low	127 Å²	127	135.2 Å²	135.2	78%	0.779	78%	0.784	S	S	*	*			cis	81.5	93.5	43.6	-48.2	0	0	0	0	114.5
364	L	31.2	Very low	32.4	Very low	151 Å²	151	140.6 Å²	140.6	79%	0.791	79%	0.794	S	S	*	*			trans	-162	148	133.9	-140.6	68.6	0	0	0	112.8
365	L	32.1	Very low	32.3	Very low	166 Å²	166	143 Å²	143	87%	0.869	80%	0.8	S	S	*	*			trans	10	131.7	160	-66	159.3	0	0	0	119.9
366	G	30.8	Very low	32.3	Very low	59 Å²	59	144.9 Å²	144.9	61%	0.608	80%	0.801	S	S	*	*			cis	156.4	156.3	-5.2	0	0	0	0	0	113.4
367	S	32.3	Very low	32.2	Very low	131 Å²	131	145.4 Å²	145.4	92%	0.916	80%	0.796	S	S	*	*			trans	62	146	174.9	48.9	0	0	0	0	118.3
368	S	30.8	Very low	32	Very low	100 Å²	100	150 Å²	150	70%	0.699	80%	0.799	S	S	*	*			cis	-166	146.6	-16	-177.7	0	0	0	0	111.5
369	L	31.9	Very low	31.8	Very low	163 Å²	163	149.8 Å²	149.8	85%	0.853	80%	0.797	S	S	*	*			trans	68.1	123.7	165.7	-71.3	160.8	0	0	0	119.7
370	N	31.7	Very low	31.7	Very low	156 Å²	156	151.1 Å²	151.1	83%	0.834	80%	0.796	S	S	*	*			trans	-103.7	-172.3	163.3	-81.6	-16.2	0	0	0	109.9
371	E	33	Very low	31.6	Very low	176 Å²	176	148.7 Å²	148.7	82%	0.822	79%	0.79	S	S	*	*			trans	83.8	90.9	162.2	-55.5	-170	157.5	0	0	117.9
372	T	32.9	Very low	31.6	Very low	150 Å²	150	150.7 Å²	150.7	92%	0.92	79%	0.789	S	S	*	*			trans	-114.5	129	140.6	36.8	0	0	0	0	109.1
373	N	32.4	Very low	31.3	Very low	129 Å²	129	146.7 Å²	146.7	69%	0.69	78%	0.783	S	S	*	*			trans	-83.9	162.9	-171.6	-95.2	-64.6	0	0	0	113.2	F375	N373-F375 PolarHBondContact O-N 2.83Å
374	R	27.2	Very low	31.4	Very low	242 Å²	242	145.2 Å²	145.2	91%	0.913	77%	0.774	S	S	*	*			trans	-48.5	131.2	157.6	-71.7	175	170.1	174.6	-4.3	109.5
375	F	30.5	Very low	31.4	Very low	186 Å²	186	146.5 Å²	146.5	82%	0.816	78%	0.776	S	S	*	*			trans	-127.7	132.9	157.8	-97.5	-87.7	0	0	0	110.2	N373	N373-F375 PolarHBondContact O-N 2.83Å
376	I	28.8	Very low	31.2	Very low	150 Å²	150	145.5 Å²	145.5	77%	0.769	77%	0.767	S	S	*	*			trans	-75.2	134.5	170.1	-65.1	167	0	0	0	106.7	E378	I376-E378 HydrophobicContact CG2-CG 4.39Å; I376-E378 PolarHBondContact O-N 2.89Å; I376-E378 VanDerWaalsContact O-N 3.13Å
377	I	33	Very low	31.3	Very low	163 Å²	163	149.7 Å²	149.7	84%	0.836	77%	0.774	S	S	*	*			trans	-81.6	91.6	175.2	-56.7	177.1	0	0	0	107.9
378	E	30.9	Very low	31	Very low	169 Å²	169	150.9 Å²	150.9	79%	0.79	77%	0.77	S	S	*	*			trans	-77.8	143.6	163.6	-65.1	-169.6	134.2	0	0	110.1	I376 E380	I376-E378 HydrophobicContact CG2-CG 4.39Å; I376-E378 PolarHBondContact O-N 2.89Å; I376-E378 VanDerWaalsContact O-N 3.13Å; E378-E380 PolarHBondContact O-N 3.3Å
379	E	31.5	Very low	31	Very low	176 Å²	176	152.2 Å²	152.2	82%	0.822	77%	0.774	S	S	*	*			trans	-81.4	103.4	-176.7	-63.4	-172.2	133.2	0	0	111.9	P381	E379-P381 WeakPolarHBondContact O-CD 3.49Å
380	E	30.8	Very low	30.9	Very low	138 Å²	138	155 Å²	155	65%	0.645	78%	0.775	S	S	*	*			trans	-87.3	117.7	171.3	-77.6	-141.2	107.7	0	0	113.2	E378 Y382	E378-E380 PolarHBondContact O-N 3.3Å; E380-Y382 HydrophobicContact CB-CD2 3.97Å; E380-Y382 HydrophobicContact CB-CE2 3.58Å; E380-Y382 HydrophobicContact CG-CE2 4.28Å; E380-Y382 PolarHBondContact O-N 2.94Å; E380-Y382 WeakPolarHBondContact OE2-CE2 3.3Å; E380-Y382 VanDerWaalsContact OE2-CZ 3.26Å; E380-Y382 PolarHBondContact OE2-OH 2.96Å
381	P	32.8	Very low	30.7	Very low	109 Å²	109	156.9 Å²	156.9	71%	0.708	78%	0.778	S	S	*	*			trans	-89.9	80.5	-175.3	35.5	-35.4	0	0	0	112.9	E379 G383	E379-P381 WeakPolarHBondContact O-CD 3.49Å; P381-G383 PolarHBondContact O-N 3.29Å
382	Y	33	Very low	30.6	Very low	171 Å²	171	154 Å²	154	67%	0.671	78%	0.777	S	S	*	*			trans	-69.2	93.4	-177.3	-83.4	-81.6	0	0	0	115.2	E380	E380-Y382 HydrophobicContact CB-CD2 3.97Å; E380-Y382 HydrophobicContact CB-CE2 3.58Å; E380-Y382 HydrophobicContact CG-CE2 4.28Å; E380-Y382 PolarHBondContact O-N 2.94Å; E380-Y382 WeakPolarHBondContact OE2-CE2 3.3Å; E380-Y382 VanDerWaalsContact OE2-CZ 3.26Å; E380-Y382 PolarHBondContact OE2-OH 2.96Å
383	G	28.8	Very low	30.5	Very low	68 Å²	68	154.1 Å²	154.1	70%	0.701	77%	0.768	S	S	*	*			trans	-85.7	110.7	148.1	0	0	0	0	0	109.5	P381 E385	P381-G383 PolarHBondContact O-N 3.29Å; G383-E385 PolarHBondContact O-N 3.12Å
384	V	32.3	Very low	30.4	Very low	96 Å²	96	156.2 Å²	156.2	58%	0.582	77%	0.77	S	S	*	*			trans	-82.1	113	-175.3	-177.7	0	0	0	0	111.1
385	E	31	Very low	30.5	Very low	179 Å²	179	152.8 Å²	152.8	84%	0.836	77%	0.769	S	S	*	*			trans	-80.1	147.3	160	-63.8	-166.2	141.2	0	0	110	G383	G383-E385 PolarHBondContact O-N 3.12Å
386	E	29.7	Very low	30.3	Very low	144 Å²	144	152.5 Å²	152.5	67%	0.673	77%	0.768	S	S	*	*			trans	-75.9	127.6	179.7	-69.5	179.9	125.7	0	0	111.3
387	I	31.7	Very low	30.3	Very low	148 Å²	148	151.8 Å²	151.8	76%	0.759	77%	0.766	S	S	*	*			trans	-122.5	108.5	165.6	-60.4	-179.7	0	0	0	107.8	V389	I387-V389 HydrophobicContact CG2-CG2 4.21Å; I387-V389 PolarHBondContact O-N 2.82Å
388	D	26.6	Very low	30.1	Very low	156 Å²	156	150.1 Å²	150.1	83%	0.834	76%	0.763	S	S	*	*			trans	-67.3	125.2	171.2	-73.9	-50.5	0	0	0	110.5
389	V	31	Very low	30.1	Very low	127 Å²	127	149.3 Å²	149.3	77%	0.77	76%	0.763	S	S	*	*			trans	-125.6	118.4	167	-176.4	0	0	0	0	108.6	I387	I387-V389 HydrophobicContact CG2-CG2 4.21Å; I387-V389 PolarHBondContact O-N 2.82Å
390	Y	29.6	Very low	30	Very low	223 Å²	223	145 Å²	145	88%	0.875	76%	0.757	S	S	*	*			trans	-73.4	136.6	175.1	-98.3	-101.1	0	0	0	111
391	E	27.4	Very low	30.2	Very low	195 Å²	195	144.1 Å²	144.1	91%	0.911	76%	0.761	S	S	*	*			trans	-71	140.8	166.3	-64.2	-179.3	131.6	0	0	111.5
392	S	31.4	Very low	30.2	Very low	115 Å²	115	144.6 Å²	144.6	80%	0.804	76%	0.758	S	S	*	*			trans	-152.5	121	154.8	65.4	0	0	0	0	110
393	E	30	Very low	30.2	Very low	153 Å²	153	146.9 Å²	146.9	72%	0.715	77%	0.765	S	S	*	*			trans	-66.2	167.2	179.1	-47.5	176.9	124.4	0	0	113.6
394	K	30.7	Very low	30.4	Very low	172 Å²	172	150 Å²	150	75%	0.748	77%	0.771	S	S	*	*			trans	73.8	111.8	160.3	-59.4	151.4	176.9	134.8	0	116.8
395	L	29.4	Very low	30.1	Very low	171 Å²	171	151.3 Å²	151.3	90%	0.895	78%	0.783	S	S	*	*				-156.8	161.8	89.3	-127.5	88	0	0	0	111.7
396	F	26.5	Very low	30.1	Very low	180 Å²	180	152 Å²	152	79%	0.789	79%	0.786	S	S	*	*			trans	-85.5	160.8	169.6	-105.7	-107.7	0	0	0	111.3
397	D	27.4	Very low	30.2	Very low	134 Å²	134	150.7 Å²	150.7	72%	0.717	79%	0.791	S	S	*	*			trans	46.1	129.8	156.8	-56	-29.5	0	0	0	120.7
398	T	28.7	Very low	30.3	Very low	128 Å²	128	150.7 Å²	150.7	79%	0.785	80%	0.797	S	S	*	*				163	163.3	96.5	-50	0	0	0	0	109.9
399	I	31.4	Very low	30.6	Very low	153 Å²	153	149.7 Å²	149.7	79%	0.785	80%	0.797	S	S	*	*			trans	82.1	95.9	164.5	-48.3	-176.2	0	0	0	115.9
400	A	30.1	Very low	30.4	Very low	84 Å²	84	152.4 Å²	152.4	69%	0.694	80%	0.801	S	S	*	*			trans	-81.1	-175.9	156	0	0	0	0	0	111.7
401	T	33.8	Very low	30.5	Very low	120 Å²	120	150.2 Å²	150.2	74%	0.736	80%	0.801	S	S	*	*			trans	82	100.2	174.9	75.3	0	0	0	0	116.9
402	N	33.7	Very low	30.5	Very low	120 Å²	120	149.8 Å²	149.8	64%	0.642	80%	0.799	S	S	*	*				-179.9	128.7	97	-90.6	-70.2	0	0	0	109.2
403	R	33.3	Very low	30.6	Very low	218 Å²	218	152.1 Å²	152.1	82%	0.823	80%	0.801	S	S	*	*				58.2	131.9	100	-60.1	-174.7	-173	-171.4	0.8	114.4
404	T	32.1	Very low	30.4	Very low	135 Å²	135	150 Å²	150	83%	0.828	80%	0.803	S	S	*	*			cis	-160.8	164	3.2	5.1	0	0	0	0	110.5
405	C	26.9	Very low	30.6	Very low	122 Å²	122	147.3 Å²	147.3	82%	0.824	81%	0.805	S	S	*	*			trans	-79.4	155.8	-175.2	-45.7	0	0	0	0	114.9
406	Q	30.3	Very low	30.6	Very low	193 Å²	193	147.5 Å²	147.5	90%	0.902	80%	0.802	S	S	*	*			trans	-163.1	125.8	143.7	-120.4	177.8	-0.5	0	0	111.8
407	P	31.4	Very low	31	Very low	118 Å²	118	146.6 Å²	146.6	77%	0.766	81%	0.805	S	S	*	*			trans	-104.8	162.2	171.6	38.2	-31.8	0	0	0	112.9
408	V	34.1	Very low	31.3	Very low	147 Å²	147	148.2 Å²	148.2	89%	0.891	81%	0.808	S	S	*	*			trans	-140	153.5	170.2	-178.3	0	0	0	0	109.3
409	T	33.9	Very low	31.2	Very low	135 Å²	135	148.9 Å²	148.9	83%	0.828	81%	0.806	S	S	*	*			trans	-90	170.6	-158.6	49.6	0	0	0	0	116.8
410	E	27.4	Very low	31.2	Very low	184 Å²	184	147.4 Å²	147.4	86%	0.86	81%	0.81	S	S	*	*			trans	-70.1	172.7	-179.3	-58.7	158.3	123.9	0	0	114.8
411	M	31.3	Very low	31	Very low	178 Å²	178	150.7 Å²	150.7	88%	0.877	82%	0.815	S	S	*	*			trans	-153.1	110.5	160.4	-164.5	178.8	-58.3	0	0	110.5
412	E	26.5	Very low	30.9	Very low	185 Å²	185	152.9 Å²	152.9	86%	0.864	82%	0.82	S	S	*	*			trans	-81.7	151.2	171.7	-67.1	-170.5	120.5	0	0	112.1
413	I	33.5	Very low	30.9	Very low	164 Å²	164	152.4 Å²	152.4	84%	0.841	83%	0.826	S	S	*	*			trans	-136.8	130.9	156.1	-60.9	-177.2	0	0	0	108.4
414	S	26.6	Very low	30.7	Very low	110 Å²	110	147.7 Å²	147.7	77%	0.769	83%	0.827	S	S	*	*			trans	-122.7	139.1	-179.2	173.3	0	0	0	0	111.1
415	S	35.1	Very low	30.8	Very low	114 Å²	114	148.3 Å²	148.3	80%	0.797	83%	0.83	S	S	*	*			trans	-160	114.2	158.4	62	0	0	0	0	113.3
416	Q	29.3	Very low	30.9	Very low	175 Å²	175	148.2 Å²	148.2	82%	0.818	82%	0.822	S	S	*	*			trans	-41.9	152.1	174.4	-60.8	153.3	-29	0	0	117.9
417	N	34.8	Very low	30.8	Very low	162 Å²	162	151.1 Å²	151.1	87%	0.866	82%	0.824	S	S	*	*			trans	-175.6	147.5	141.3	-91.4	-43.7	0	0	0	109.2
418	H	33.4	Very low	30.6	Very low	168 Å²	168	152.9 Å²	152.9	78%	0.778	82%	0.822	S	S	*	*			cis	-158.3	152.4	-35.6	-163.6	-81.8	0	0	0	106.9
419	L	26.8	Very low	30.3	Very low	142 Å²	142	152.7 Å²	152.7	74%	0.743	82%	0.815	S	S	*	*			trans	-68.3	150.7	-168.6	-64.9	112.9	0	0	0	116.4	L421	L419-L421 HydrophobicContact CD2-CD1 4.28Å
420	S	31	Very low	30	Very low	122 Å²	122	155.3 Å²	155.3	85%	0.853	82%	0.815	S	S	*	*			trans	-142.7	130.1	138.7	60.8	0	0	0	0	110.3
421	L	26.2	Very low	29.9	Very low	153 Å²	153	152.1 Å²	152.1	80%	0.801	81%	0.812	S	S	*	*			trans	-103.9	-164.7	-173	-139.9	78.6	0	0	0	111.9	L419	L419-L421 HydrophobicContact CD2-CD1 4.28Å
422	I	32.6	Very low	29.8	Very low	165 Å²	165	149.6 Å²	149.6	85%	0.846	81%	0.811	S	S	*	*			trans	88.8	122.1	176.9	-51.9	164.7	0	0	0	112.5
423	S	32.3	Very low	29.9	Very low	110 Å²	110	148.6 Å²	148.6	77%	0.769	81%	0.809	S	S	*	*			cis	-148.1	152	-5.5	47	0	0	0	0	111.3
424	S	29.7	Very low	29.8	Very low	120 Å²	120	145.5 Å²	145.5	84%	0.839	80%	0.802	S	S	*	*			trans	-111.1	139.4	-174.8	-48.3	0	0	0	0	112.9
425	T	34.5	Very low	29.8	Very low	147 Å²	147	149.8 Å²	149.8	90%	0.902	81%	0.81	S	S	*	*			trans	-131.9	114.8	155.9	42.6	0	0	0	0	110.9
426	N	27.9	Very low	29.6	Very low	120 Å²	120	149 Å²	149	64%	0.642	81%	0.811	S	S	*	*			trans	-50.7	141.5	179.8	-151.3	-3.1	0	0	0	114.7
427	W	29.6	Very low	29.5	Very low	254 Å²	254	145.4 Å²	145.4	96%	0.962	81%	0.811	S	S	*	*				-155.2	131.3	122.1	-102.2	-60.4	0	0	0	111.3
428	Q	27.1	Very low	29.4	Very low	155 Å²	155	147.5 Å²	147.5	72%	0.724	81%	0.813	S	S	*	*			trans	-97.9	178	167.6	-66	176.8	-33.2	0	0	109.5
429	I	27	Very low	29.3	Very low	143 Å²	143	145.1 Å²	145.1	73%	0.733	81%	0.81	S	S	*	*			trans	79.3	86.8	173	-45.1	164.4	0	0	0	114.1
430	F	26.8	Very low	29.4	Very low	190 Å²	190	142.7 Å²	142.7	83%	0.833	81%	0.805	S	S	*	*				-165.1	132.3	103.3	-105.4	-72.7	0	0	0	110.3
431	C	26.1	Very low	29.4	Very low	118 Å²	118	143.8 Å²	143.8	80%	0.797	80%	0.801	S	S	*	*			trans	-152.5	165.6	175	-84.9	0	0	0	0	108.7
432	C	28.4	Very low	29.7	Very low	125 Å²	125	143.5 Å²	143.5	85%	0.845	80%	0.799	S	S	*	*			trans	67.8	143.9	-160.6	-50.7	0	0	0	0	110.9
433	I	28.7	Very low	29.8	Very low	163 Å²	163	142.3 Å²	142.3	84%	0.836	79%	0.793	S	S	*	*			cis	-136.9	150.1	25.6	-67.1	167.6	0	0	0	107.3
434	S	33	Very low	29.6	Very low	99 Å²	99	144 Å²	144	69%	0.692	79%	0.793	S	S	*	*			cis	-147.7	140.7	7.7	27.4	0	0	0	0	112.5
435	E	26.1	Very low	29.8	Very low	200 Å²	200	143.5 Å²	143.5	94%	0.935	79%	0.79	S	S	*	*			trans	-95.3	141.6	139.7	-73.6	-173.3	122.9	0	0	108.2
436	A	31.3	Very low	29.8	Very low	98 Å²	98	141.3 Å²	141.3	81%	0.81	78%	0.781	S	S	*	*			trans	-155	41.7	176.8	0	0	0	0	0	113.6
437	A	27.4	Very low	30	Very low	100 Å²	100	141 Å²	141	83%	0.826	79%	0.788	S	S	*	*			trans	-97.1	87.6	174.5	0	0	0	0	0	111.3
438	F	31.1	Very low	30.3	Very low	206 Å²	206	135.6 Å²	135.6	90%	0.904	78%	0.783	S	S	*	*			trans	-147.9	136.4	166.1	-133.1	-87.3	0	0	0	112.4
439	T	32.1	Very low	30.4	Very low	118 Å²	118	131.7 Å²	131.7	72%	0.724	79%	0.785	S	S	*	*			trans	-103.2	134.2	-170.3	50.5	0	0	0	0	113.7
440	S	29	Very low	30.6	Very low	91 Å²	91	133.3 Å²	133.3	64%	0.636	79%	0.794	S	S	*	*			trans	48.6	111.8	146.8	63.7	0	0	0	0	119.8
441	N	30	Very low	30.6	Very low	144 Å²	144	135.3 Å²	135.3	77%	0.77	80%	0.796	S	S	*	*				158.5	160.5	107.8	-84.9	-41.8	0	0	0	114
442	I	32.5	Very low	30.8	Very low	148 Å²	148	137.4 Å²	137.4	76%	0.759	80%	0.798	S	S	*	*			trans	69.5	94.2	168.3	-61.9	154.1	0	0	0	113.3
443	I	34.9	Very low	30.8	Very low	140 Å²	140	136.9 Å²	136.9	72%	0.718	79%	0.794	S	S	*	*				93.2	120.2	64.5	-72.6	163.3	0	0	0	112.6
444	D	29.5	Very low	30.9	Very low	144 Å²	144	136.2 Å²	136.2	77%	0.77	79%	0.791	S	S	*	*			trans	40.8	116.9	157.9	-55	-15.5	0	0	0	120.9
445	S	33.2	Very low	30.7	Very low	111 Å²	111	135.3 Å²	135.3	78%	0.776	79%	0.79	S	S	*	*				-176.4	128.6	94.2	-77.9	0	0	0	0	115.6
446	S	33.9	Very low	31	Very low	101 Å²	101	134.4 Å²	134.4	71%	0.706	79%	0.786	S	S	*	*			trans	43.4	111.6	146.5	64.3	0	0	0	0	123.4
447	S	32.9	Very low	31.3	Very low	112 Å²	112	135.8 Å²	135.8	78%	0.783	79%	0.786	S	S	*	*			trans	58.8	143.1	132.3	76.3	0	0	0	0	120.4
448	T	36.2	Very low	31.7	Very low	141 Å²	141	139.9 Å²	139.9	87%	0.865	79%	0.788	S	S	*	*			cis	-139.4	165.1	4	49	0	0	0	0	107.8
449	G	29.2	Very low	32.3	Very low	74 Å²	74	138.1 Å²	138.1	76%	0.763	79%	0.787	S	S	*	*			cis	144.4	98.6	4.2	0	0	0	0	0	110.1
450	L	29.8	Very low	32.5	Very low	176 Å²	176	140.4 Å²	140.4	92%	0.921	80%	0.795	S	S	*	*			trans	-147.5	128.5	170.7	-116.3	167.2	0	0	0	108.1
451	R	27.1	Very low	32.9	Very low	233 Å²	233	145 Å²	145	88%	0.879	81%	0.807	S	S	*	*			trans	-101.1	132	-178.5	-73.1	178.4	173.3	166.7	-4.6	110.3
452	I	31.1	Very low	33.5	Very low	162 Å²	162	146.2 Å²	146.2	83%	0.831	81%	0.813	S	S	*	*			trans	-122.7	124.7	153.3	-62	179.3	0	0	0	105.6
453	C	27.7	Very low	33.7	Very low	114 Å²	114	143.9 Å²	143.9	77%	0.77	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-85.2	123.1	-177.6	-58.4	0	0	0	0	109.8
454	L	30.6	Very low	33.8	Very low	148 Å²	148	145 Å²	145	78%	0.775	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-88.7	136.5	158.9	-65.5	174.3	0	0	0	107.9
455	A	28.8	Very low	34	Very low	81 Å²	81	144.5 Å²	144.5	67%	0.669	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-75.5	143.8	174.5	0	0	0	0	0	109.9
456	Q	33.4	Very low	34.1	Very low	180 Å²	180	144.3 Å²	144.3	84%	0.841	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-93.8	147.3	166.7	-62	-173.7	-102.1	0	0	108.9
457	P	37.5	Very low	34.2	Very low	127 Å²	127	148 Å²	148	83%	0.825	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-67	140.7	164.7	30	-33.4	0	0	0	109.7
458	E	36.1	Very low	34.3	Very low	186 Å²	186	147.2 Å²	147.2	87%	0.869	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-80.4	150.3	177	-64.4	176.1	135.9	0	0	110.2
459	L	42	Very low	34.3	Very low	169 Å²	169	147.4 Å²	147.4	89%	0.885	79%	0.794	S	S	*	*			trans	-119.8	115.3	171.5	-80.8	172.1	0	0	0	108.1	E461	L459-E461 PolarHBondContact O-N 3.49Å
460	D	38	Very low	34.6	Very low	166 Å²	166	152.1 Å²	152.1	89%	0.888	80%	0.796	S	S	*	*			trans	-75.9	116.8	173.6	-66	-51.8	0	0	0	110.3
461	E	37.2	Very low	35	Very low	189 Å²	189	148.2 Å²	148.2	88%	0.883	79%	0.789	S	S	*	*			trans	-120.5	106.7	161.3	-78.9	-142.8	157.2	0	0	110.1	L459 T463	L459-E461 PolarHBondContact O-N 3.49Å; E461-T463 PolarHBondContact O-N 3.05Å
462	D	43	Very low	35.5	Very low	168 Å²	168	143.9 Å²	143.9	90%	0.898	78%	0.783	S	S	*	*			trans	-81	107	176.8	-117.8	-31.9	0	0	0	111.2
463	T	35.4	Very low	35.9	Very low	99 Å²	99	143 Å²	143	61%	0.607	78%	0.776	S	S	*	*			trans	-26.4	147.8	172.6	-9.6	0	0	0	0	117.9	E461	E461-T463 PolarHBondContact O-N 3.05Å
464	H	36.4	Very low	36.2	Very low	164 Å²	164	144.7 Å²	144.7	76%	0.759	78%	0.777	S	S	*	*				-173.6	119.3	109.6	-95.1	-63.4	0	0	0	114.4
465	L	34.7	Very low	36.4	Very low	134 Å²	134	141.5 Å²	141.5	70%	0.702	78%	0.78	S	S	*	*			trans	42	139.6	132.3	-49.3	176.5	0	0	0	120.5
466	T	35.2	Very low	36.7	Very low	107 Å²	107	142.5 Å²	142.5	66%	0.656	78%	0.782	S	S	*	*			cis	-170.8	155.6	1.7	15.5	0	0	0	0	109.6
467	E	35.2	Very low	37	Very low	177 Å²	177	141.9 Å²	141.9	83%	0.827	78%	0.779	S	S	*	*			trans	41.1	147.3	141.4	-60.5	-172.5	145.2	0	0	122.5
468	S	35	Very low	36.8	Very low	97 Å²	97	141.2 Å²	141.2	68%	0.678	77%	0.773	S	S	*	*			cis	-175.8	179	-12	-94.8	0	0	0	0	110
469	I	37.8	Very low	36.7	Very low	144 Å²	144	137.5 Å²	137.5	74%	0.738	77%	0.767	S	S	*	*			trans	100.6	113.5	154.6	-53.3	-171.7	0	0	0	118.7
470	E	35.6	Very low	36.4	Very low	173 Å²	173	138.3 Å²	138.3	81%	0.808	77%	0.767	S	S	*	*			trans	30.5	123.4	141	-57.4	161.5	-174.2	0	0	119.6
471	A	36.9	Very low	36.3	Very low	94 Å²	94	134.3 Å²	134.3	78%	0.777	76%	0.757	S	S	*	*			cis	76.8	110.1	47.5	0	0	0	0	0	115.5
472	D	37.8	Very low	36.1	Very low	143 Å²	143	131.4 Å²	131.4	77%	0.765	75%	0.752	S	S	*	*				-161.2	155.6	120.6	-133.6	-10.8	0	0	0	117
473	Q	39.3	Very low	35.8	Very low	144 Å²	144	132.7 Å²	132.7	67%	0.673	75%	0.752	S	S	*	*			trans	-27.8	148.5	176.3	-78.1	166.5	83.5	0	0	125.9
474	N	35.3	Very low	35.8	Very low	148 Å²	148	136.7 Å²	136.7	79%	0.791	76%	0.761	S	S	*	*			trans	68.4	133.3	131.6	-63	-27.5	0	0	0	123.1
475	G	34.8	Very low	35.9	Very low	82 Å²	82	134.5 Å²	134.5	85%	0.845	76%	0.762	S	S	*	*			trans	167.5	108.6	162.4	0	0	0	0	0	113.6
476	S	34.2	Very low	36.1	Very low	101 Å²	101	133.8 Å²	133.8	71%	0.706	76%	0.757	S	S	*	*			trans	-117.5	161.7	-171.7	57.4	0	0	0	0	115.1
477	H	38.8	Very low	36.3	Very low	167 Å²	167	138 Å²	138	77%	0.773	77%	0.767	S	S	*	*			trans	93.6	124.9	156.4	-67.9	-64.1	0	0	0	122.8
478	T	34.9	Very low	36.6	Very low	114 Å²	114	134.7 Å²	134.7	70%	0.699	76%	0.761	S	S	*	*			trans	72.6	104.7	134.7	55.2	0	0	0	0	123.5
479	S	33.9	Very low	36.7	Very low	107 Å²	107	136.9 Å²	136.9	75%	0.748	77%	0.765	S	S	*	*				82.6	150.5	109.3	-54	0	0	0	0	123.5
480	E	35	Very low	36.5	Very low	187 Å²	187	137.6 Å²	137.6	87%	0.874	77%	0.77	S	S	*	*			trans	89.8	110.6	156.1	-55.8	-145.8	115.8	0	0	122.6
481	A	36.7	Very low	36.4	Very low	82 Å²	82	133 Å²	133	68%	0.678	77%	0.77	S	S	*	*				68.9	98.1	123.7	0	0	0	0	0	123.4
482	T	31.5	Very low	36.2	Very low	128 Å²	128	133.5 Å²	133.5	79%	0.785	77%	0.767	S	S	*	*				48.7	112.3	115.1	-41.9	0	0	0	0	121.6
483	Q	37	Very low	36	Very low	194 Å²	194	133.9 Å²	133.9	91%	0.907	77%	0.77	S	S	*	*				-175.2	165	122.3	-102.4	165.5	60.4	0	0	114.2
484	K	35.1	Very low	35.5	Very low	183 Å²	183	131.9 Å²	131.9	80%	0.796	78%	0.778	S	S	*	*			trans	-105.7	159.3	177	-69	-176.1	176.2	-178.6	0	111.5
485	P	40.2	Very low	35.4	Very low	119 Å²	119	130.2 Å²	130.2	77%	0.773	78%	0.778	S	S	*	*				-138	134.6	103.2	35.3	-22.8	0	0	0	112.8
486	I	37.1	Very low	35.5	Very low	118 Å²	118	135.9 Å²	135.9	61%	0.605	78%	0.782	S	S	*	*				56.3	105.5	74.8	-40.9	169.6	0	0	0	116
487	F	40.8	Very low	35.5	Very low	196 Å²	196	136 Å²	136	86%	0.86	78%	0.783	S	S	*	*				163.9	166.5	120.6	-88.8	-53.4	0	0	0	111.6
488	P	40.2	Very low	35.2	Very low	108 Å²	108	134.2 Å²	134.2	70%	0.701	78%	0.784	S	S	*	*			trans	-133.7	-178.6	-144.1	43.6	-24.4	0	0	0	115.3
489	D	37.7	Very low	35.3	Very low	143 Å²	143	134.2 Å²	134.2	77%	0.765	79%	0.788	S	S	*	*				-167.8	-175.7	107.2	-142.5	-40.2	0	0	0	110.3
490	N	32.7	Very low	35.4	Very low	158 Å²	158	134 Å²	134	85%	0.845	79%	0.787	S	S	*	*			trans	-79.8	138.2	-167.9	-70.4	-93.9	0	0	0	114.2
491	G	34	Very low	35.6	Very low	77 Å²	77	130 Å²	130	79%	0.794	78%	0.775	S	S	*	*			trans	-150.5	133.3	168.7	0	0	0	0	0	110.3
492	S	33.4	Very low	35.6	Very low	105 Å²	105	134.1 Å²	134.1	73%	0.734	78%	0.78	S	S	*	*			trans	-92	160.2	-167.3	51.1	0	0	0	0	115
493	N	32.7	Very low	35.9	Very low	151 Å²	151	135.4 Å²	135.4	81%	0.807	78%	0.781	S	S	*	*			trans	95.3	120.5	158.3	-58.2	-27.1	0	0	0	120
494	A	30.2	Very low	35.8	Very low	102 Å²	102	135.4 Å²	135.4	84%	0.843	78%	0.779	S	S	*	*			trans	51	108.2	133.2	0	0	0	0	0	120.1
495	S	32.7	Very low	35.7	Very low	113 Å²	113	131.2 Å²	131.2	79%	0.79	77%	0.772	S	S	*	*			trans	-146.2	116.6	148.4	46	0	0	0	0	111.1
496	Q	35.6	Very low	35.6	Very low	201 Å²	201	133 Å²	133	94%	0.939	77%	0.774	S	S	*	*				-179.1	106.1	128.4	-99.1	178.5	14.4	0	0	108.7
497	S	34.6	Very low	35.5	Very low	103 Å²	103	131.5 Å²	131.5	72%	0.72	77%	0.774	S	S	*	*			trans	-102	149.7	-176.6	-44.7	0	0	0	0	110.1
498	T	34	Very low	35.1	Very low	129 Å²	129	130.2 Å²	130.2	79%	0.791	77%	0.77	S	S	*	*			trans	38.6	141.7	131.3	61.4	0	0	0	0	120.4
499	S	35.1	Very low	34.6	Very low	114 Å²	114	132.7 Å²	132.7	80%	0.797	77%	0.774	S	S	*	*			cis	-166.5	-152.8	-0.6	41.2	0	0	0	0	106.5
500	S	37.9	Very low	34.5	Very low	102 Å²	102	133.2 Å²	133.2	71%	0.713	78%	0.776	S	S	*	*			cis	-163.1	-179.8	8.3	66.8	0	0	0	0	108
501	V	37.9	Very low	34.4	Very low	105 Å²	105	129.9 Å²	129.9	64%	0.636	77%	0.765	S	S	*	*			cis	-152.1	134.5	-0.4	87.6	0	0	0	0	109.2
502	E	37.2	Very low	34.3	Very low	168 Å²	168	134.2 Å²	134.2	79%	0.785	77%	0.77	S	S	*	*			trans	56.3	164	142.3	-70.2	173.1	-179.6	0	0	121.7
503	L	37.7	Very low	34.3	Very low	154 Å²	154	132.7 Å²	132.7	81%	0.806	77%	0.771	S	S	*	*			cis	-124.7	157.5	13.7	-84.3	168.5	0	0	0	114.8
504	K	34	Very low	34.5	Very low	195 Å²	195	134.3 Å²	134.3	85%	0.848	77%	0.774	S	S	*	*			trans	-106	-171.9	159.5	-60.1	176.7	-179.6	173.4	0	107.4
505	S	34.7	Very low	34.7	Very low	94 Å²	94	136.6 Å²	136.6	66%	0.657	77%	0.772	S	S	*	*			cis	-170.5	-166.1	21.5	-156.9	0	0	0	0	110.5
506	I	37.7	Very low	34.9	Very low	158 Å²	158	139.2 Å²	139.2	81%	0.81	78%	0.775	S	S	*	*			trans	123.7	102.8	165.3	-67.3	158.8	0	0	0	108.6
507	S	34.6	Very low	34.8	Very low	86 Å²	86	135 Å²	135	60%	0.601	76%	0.764	S	S	*	*			cis	72	146	46.1	-67.7	0	0	0	0	114.9
508	E	32.1	Very low	34.8	Very low	168 Å²	168	135.2 Å²	135.2	79%	0.785	76%	0.761	S	S	*	*			cis	-175.4	175.7	-21.7	-166.1	158.8	-168.6	0	0	108.9
509	M	30.9	Very low	34.9	Very low	161 Å²	161	135.1 Å²	135.1	79%	0.793	76%	0.76	S	S	*	*			trans	81.6	162	159.5	-53.4	-169.1	71	0	0	121.6
510	L	35.5	Very low	35	Very low	153 Å²	153	134 Å²	134	80%	0.801	75%	0.752	S	S	*	*			trans	73.8	107.9	172.7	-49.4	-177.6	0	0	0	116.4
511	S	29.8	Very low	35	Very low	88 Å²	88	136.3 Å²	136.3	62%	0.615	75%	0.752	S	S	*	*			cis	93.1	115.1	13.1	94.2	0	0	0	0	118.7
512	N	31.2	Very low	35.2	Very low	169 Å²	169	138.6 Å²	138.6	90%	0.904	76%	0.759	S	S	*	*			trans	76.7	138.9	157.8	-50.9	-11.8	0	0	0	118.7
513	G	34.4	Very low	35.3	Very low	73 Å²	73	135.3 Å²	135.3	75%	0.753	75%	0.753	S	S	*	*			trans	151	77.7	172.2	0	0	0	0	0	116.2
514	E	36.6	Very low	35.3	Very low	184 Å²	184	132.6 Å²	132.6	86%	0.86	75%	0.747	S	S	*	*			trans	15.1	120.9	144.8	-65.4	161.7	161.7	0	0	119.1
515	D	33.8	Very low	35.5	Very low	150 Å²	150	131.4 Å²	131.4	80%	0.802	74%	0.744	S	S	*	*				83.6	122.9	69.9	-97.6	-34.4	0	0	0	115.9
516	I	37.9	Very low	35.5	Very low	168 Å²	168	131.8 Å²	131.8	86%	0.862	75%	0.747	S	S	*	*				-174.9	151.4	128.1	-96.8	161.3	0	0	0	111.1
517	T	33.9	Very low	35.6	Very low	114 Å²	114	130.7 Å²	130.7	70%	0.699	75%	0.747	S	S	*	*			trans	-81.3	-177.8	-167.1	53.5	0	0	0	0	113
518	T	34.1	Very low	35.5	Very low	107 Å²	107	129.4 Å²	129.4	66%	0.656	75%	0.748	S	S	*	*			cis	-171.9	131.2	47.7	-32.8	0	0	0	0	114.3
519	T	35.3	Very low	35.8	Very low	126 Å²	126	127.2 Å²	127.2	77%	0.773	75%	0.748	S	S	*	*			trans	55.2	140.2	151.1	50.6	0	0	0	0	120.7
520	S	37.8	Very low	35.9	Very low	90 Å²	90	128.3 Å²	128.3	63%	0.629	75%	0.751	S	S	*	*			cis	-167.8	-166.5	-0.8	48.8	0	0	0	0	108.4
521	E	37.4	Very low	35.6	Very low	152 Å²	152	132.8 Å²	132.8	71%	0.71	76%	0.757	S	S	*	*			cis	-159.4	121.3	10.9	-151.7	147.5	-66.1	0	0	113.7
522	L	42	Very low	35.6	Very low	152 Å²	152	131.9 Å²	131.9	80%	0.796	76%	0.762	S	S	*	*			trans	53.3	157	140	-58.8	177.4	0	0	0	123.1
523	P	39.7	Very low	35.7	Very low	99 Å²	99	135.3 Å²	135.3	64%	0.643	76%	0.762	S	S	*	*			cis	-144.4	172.9	-44.8	40.1	-23.2	0	0	0	116.5
524	S	37.6	Very low	35.5	Very low	98 Å²	98	137.7 Å²	137.7	69%	0.685	76%	0.762	S	S	*	*			trans	65.3	142.8	142.1	62.2	0	0	0	0	121.8
525	E	38.3	Very low	35.1	Very low	170 Å²	170	135 Å²	135	79%	0.794	76%	0.758	S	S	*	*			cis	-160	138.5	-6.5	-122.5	171.2	-151.4	0	0	113.9
526	S	34.9	Very low	35	Very low	101 Å²	101	134.5 Å²	134.5	71%	0.706	76%	0.76	S	S	*	*			trans	50.4	159.4	133.8	82.9	0	0	0	0	122.1
527	V	39.2	Very low	34.6	Very low	136 Å²	136	137.4 Å²	137.4	82%	0.824	76%	0.761	S	S	*	*			cis	-141.7	152	10.5	176.4	0	0	0	0	109.9
528	G	34.1	Very low	34.3	Very low	59 Å²	59	137.8 Å²	137.8	61%	0.608	77%	0.767	S	S	*	*			trans	-129.8	-164.7	158.7	0	0	0	0	0	110.8
529	P	37.4	Very low	34.2	Very low	121 Å²	121	140.1 Å²	140.1	79%	0.786	78%	0.775	S	S	*	*			cis	-145.6	-153.4	8.7	34.2	-8	0	0	0	114.2
530	Q	33.9	Very low	34.1	Very low	184 Å²	184	140.7 Å²	140.7	86%	0.86	78%	0.778	S	S	*	*			trans	99.9	155.6	152.6	-59.9	-124.7	5.6	0	0	121.7
531	R	28.3	Very low	33.8	Very low	247 Å²	247	141.9 Å²	141.9	93%	0.932	78%	0.781	S	S	*	*			trans	-85.1	155.7	-165.9	-62.2	165	161.5	175.4	-7.4	113.9
532	G	29.2	Very low	33.7	Very low	69 Å²	69	142.5 Å²	142.5	71%	0.711	78%	0.784	S	S	*	*				137.7	140.8	127.9	0	0	0	0	0	119.2
533	R	34.4	Very low	33.1	Very low	241 Å²	241	141.2 Å²	141.2	91%	0.909	78%	0.783	S	S	*	*			trans	64	120.6	164.1	-73.3	176.1	174	153.5	-1.7	117
534	T	29.1	Very low	32.9	Very low	123 Å²	123	147.9 Å²	147.9	76%	0.755	80%	0.795	S	S	*	*				91.7	103.5	61.6	-63.6	0	0	0	0	112.6
535	V	28.8	Very low	32.7	Very low	128 Å²	128	148.5 Å²	148.5	78%	0.776	80%	0.795	S	S	*	*			trans	54	120.3	150.7	-179.9	0	0	0	0	119.1
536	T	32.4	Very low	32.6	Very low	139 Å²	139	148.4 Å²	148.4	85%	0.853	79%	0.792	S	S	*	*				-163	150	119.1	-78	0	0	0	0	110.7
537	R	28	Very low	32.6	Very low	229 Å²	229	154.4 Å²	154.4	86%	0.864	80%	0.799	S	S	*	*			trans	-114.8	131.2	-173.6	172	-163.4	-165.1	-179.9	7.1	109.2
538	C	28.9	Very low	32.4	Very low	123 Å²	123	153.1 Å²	153.1	83%	0.831	80%	0.796	S	S	*	*			trans	-177.2	165.9	139.6	-105.4	0	0	0	0	114.7
539	N	31.6	Very low	32.6	Very low	156 Å²	156	154.5 Å²	154.5	83%	0.834	80%	0.802	S	S	*	*			trans	-90.5	-168	-176.2	-64.1	-37.4	0	0	0	112.8
540	V	33.3	Very low	32.5	Very low	137 Å²	137	154.4 Å²	154.4	83%	0.83	80%	0.799	S	S	*	*			trans	100.3	125	166.9	-177.8	0	0	0	0	113
541	V	30.4	Very low	32.9	Very low	115 Å²	115	154.9 Å²	154.9	70%	0.697	80%	0.8	S	S	*	*			cis	163.6	165.8	-19.2	135.9	0	0	0	0	105.6
542	Q	35.4	Very low	33.2	Very low	165 Å²	165	148.7 Å²	148.7	77%	0.771	80%	0.795	S	S	*	*			trans	79	104.7	164.5	-86.7	164.8	42.4	0	0	120.7
543	T	31.1	Very low	33.5	Very low	125 Å²	125	149.1 Å²	149.1	77%	0.767	80%	0.8	S	S	*	*			trans	63.4	144.8	132.4	65.7	0	0	0	0	119.6
544	R	34.3	Very low	33.7	Very low	240 Å²	240	148 Å²	148	91%	0.906	80%	0.795	S	S	*	*			cis	-164.5	159.3	45	-157.8	172.4	-174.3	177.4	1.5	112.9
545	T	33.5	Very low	34.2	Very low	111 Å²	111	149.6 Å²	149.6	68%	0.681	80%	0.795	S	S	*	*			trans	-74	149.4	-177.6	56.8	0	0	0	0	116
546	K	36.8	Very low	34.5	Very low	168 Å²	168	149.1 Å²	149.1	73%	0.73	80%	0.797	S	S	*	*				162.2	142.3	110	-96	167.3	-176.6	174.1	0	116.3
547	R	34.1	Very low	34.5	Very low	226 Å²	226	146.9 Å²	146.9	85%	0.853	79%	0.792	S	S	*	*			trans	69	159.8	145.8	-71.7	173.6	175.2	-174.6	-4.4	118
548	S	35.4	Very low	35	Very low	110 Å²	110	142.3 Å²	142.3	77%	0.769	79%	0.789	S	S	*	*			cis	-174.5	173.7	-23.9	-173.1	0	0	0	0	110
549	A	38.3	Very low	35.2	Very low	87 Å²	87	141.6 Å²	141.6	72%	0.719	79%	0.786	S	S	*	*			trans	81.7	125.3	179.8	0	0	0	0	0	114.3
550	V	35.8	Very low	35.5	Very low	120 Å²	120	142.3 Å²	142.3	73%	0.727	79%	0.789	S	S	*	*			cis	85.8	102.5	29.6	-175.5	0	0	0	0	114.2
551	H	40.8	Very low	35.5	Very low	193 Å²	193	144.8 Å²	144.8	89%	0.894	79%	0.788	S	S	*	*			trans	-128.9	157.8	152.2	-81	5.1	0	0	0	108.5
552	S	36	Very low	35.8	Very low	118 Å²	118	146.9 Å²	146.9	83%	0.825	80%	0.796	S	S	*	*			trans	-154	141.5	-173.5	-62.1	0	0	0	0	113.3
553	G	35.9	Very low	35.8	Very low	78 Å²	78	144.5 Å²	144.5	80%	0.804	80%	0.797	S	S	*	*			trans	158.3	151	175.4	0	0	0	0	0	110.9
554	R	37.1	Very low	36.3	Very low	216 Å²	216	144.1 Å²	144.1	82%	0.815	80%	0.797	S	S	*	*			cis	-164	130.7	-1.4	-178	174.1	-179.4	-174.5	0.2	110.6
555	Q	39.9	Very low	36.4	Very low	158 Å²	158	142 Å²	142	74%	0.738	79%	0.794	S	S	*	*			trans	31.6	146.9	144.4	-59.1	156.8	-14.2	0	0	120.5
556	S	36	Very low	36.4	Very low	118 Å²	118	144 Å²	144	83%	0.825	80%	0.8	S	S	*	*			cis	-170.4	-178.6	-2	44.6	0	0	0	0	109.8
557	A	33	Very low	36.3	Very low	91 Å²	91	143.9 Å²	143.9	75%	0.752	81%	0.807	S	S	*	*			trans	-111	173.8	-178	0	0	0	0	0	114
558	V	36.7	Very low	36.3	Very low	133 Å²	133	137.2 Å²	137.2	81%	0.806	80%	0.8	S	S	*	*			trans	147.7	138.2	139.6	163.1	0	0	0	0	114.5
559	S	33.1	Very low	36.3	Very low	109 Å²	109	139.2 Å²	139.2	76%	0.762	80%	0.8	S	S	*	*			trans	69.6	153.2	166.7	-73.7	0	0	0	0	117.7
560	L	38.3	Very low	36	Very low	170 Å²	170	139.9 Å²	139.9	89%	0.89	80%	0.8	S	S	*	*			cis	-126.5	-177.7	24	-75	162.2	0	0	0	115
561	K	34.5	Very low	36.1	Very low	189 Å²	189	144.8 Å²	144.8	82%	0.822	81%	0.805	S	S	*	*			trans	-132.4	176.4	179.8	-73.2	-176.7	175.4	179.6	0	112
562	N	35.5	Very low	36	Very low	160 Å²	160	141.6 Å²	141.6	86%	0.856	79%	0.794	S	S	*	*			trans	91.3	147.3	171.6	-45.8	-23.4	0	0	0	113.7
563	S	35.4	Very low	36.2	Very low	115 Å²	115	143.9 Å²	143.9	80%	0.804	80%	0.797	S	S	*	*			cis	-156.1	156.8	2.9	-164.4	0	0	0	0	111.7
564	P	42.3	Very low	36.1	Very low	117 Å²	117	143.4 Å²	143.4	76%	0.76	79%	0.792	S	S	*	*			trans	-113.7	171.8	-173.6	41.8	-34.9	0	0	0	117.4
565	K	36.5	Very low	36.5	Very low	195 Å²	195	139.5 Å²	139.5	85%	0.848	79%	0.794	S	S	*	*			trans	-164.5	134.2	158.1	-96.1	156.2	-175.9	179.7	0	107.6
566	L	32.2	Very low	36.4	Very low	153 Å²	153	137.4 Å²	137.4	80%	0.801	80%	0.797	S	S	*	*				70.1	136.4	56.3	-70	174.5	0	0	0	113.6
567	L	35.7	Very low	36.6	Very low	166 Å²	166	139.1 Å²	139.1	87%	0.869	80%	0.796	S	S	*	*			cis	-120.4	-126	32.5	-71.2	162.6	0	0	0	117
568	A	33.4	Very low	37.1	Very low	86 Å²	86	140.4 Å²	140.4	71%	0.711	79%	0.794	S	S	*	*			trans	-165.3	-158	-157.5	0	0	0	0	0	114.3
569	I	35.6	Very low	37.5	Very low	151 Å²	151	140.1 Å²	140.1	77%	0.774	80%	0.795	S	S	*	*			trans	89.3	118.9	178.1	-49.7	164.4	0	0	0	114.1
570	S	33.1	Very low	37.9	Very low	101 Å²	101	141 Å²	141	71%	0.706	80%	0.801	S	S	*	*			cis	105.2	139.7	3.2	-52.4	0	0	0	0	118.9
571	R	36.7	Very low	37.8	Very low	224 Å²	224	139.8 Å²	139.8	85%	0.845	80%	0.796	S	S	*	*			trans	93	147.2	171.5	-57.9	171.4	-178	146.8	0.1	116.2
572	N	38.3	Very low	38.1	Very low	125 Å²	125	137.3 Å²	137.3	67%	0.668	80%	0.797	S	S	*	*			cis	-169.6	151.1	-13.3	-107.3	-1.4	0	0	0	112.5
573	L	40.1	Very low	38.1	Very low	166 Å²	166	134 Å²	134	87%	0.869	79%	0.786	S	S	*	*			trans	54.2	148.7	144.7	-56.5	164.8	0	0	0	120.7
574	G	35.1	Very low	38.4	Very low	69 Å²	69	138.6 Å²	138.6	71%	0.711	79%	0.792	S	S	*	*			cis	179.8	166	-5.1	0	0	0	0	0	112.3
575	P	45.7	Very low	38.4	Very low	133 Å²	133	139.2 Å²	139.2	86%	0.864	80%	0.796	S	S	*	*			trans	-124.3	178.6	-163.4	43	-31.3	0	0	0	117.6
576	S	38	Very low	38.8	Very low	114 Å²	114	133.5 Å²	133.5	80%	0.797	79%	0.792	S	S	*	*			trans	-171.1	158.3	176.3	-86.2	0	0	0	0	111
577	I	40.2	Very low	39.1	Very low	155 Å²	155	134.9 Å²	134.9	80%	0.795	80%	0.8	S	S	*	*			cis	-139.5	-116.4	-3.2	-139.5	164.6	0	0	0	115
578	T	42.6	Very low	39.1	Very low	118 Å²	118	130.7 Å²	130.7	72%	0.724	80%	0.798	S	S	*	*			trans	-146.1	164.3	-157.2	49.4	0	0	0	0	117.1
579	P	46.1	Very low	39.3	Very low	127 Å²	127	135.4 Å²	135.4	83%	0.825	81%	0.811	S	S	*	*			trans	-112.1	-163.5	179.7	44.6	-36	0	0	0	115.1
580	S	40.7	Very low	39.3	Very low	126 Å²	126	131.6 Å²	131.6	88%	0.881	81%	0.809	S	S	*	*			trans	-147.5	-177.5	172.1	60.6	0	0	0	0	113.3
581	D	35.7	Very low	39.3	Very low	145 Å²	145	137 Å²	137	78%	0.775	82%	0.82	S	S	*	*			trans	-155.2	158.6	-165	178.4	32.8	0	0	0	113.4
582	T	40.4	Very low	39.3	Very low	138 Å²	138	135.5 Å²	135.5	85%	0.847	82%	0.823	S	S	*	*			trans	-168	154.5	161.5	3	0	0	0	0	114.7
583	S	36.1	Very low	39	Very low	90 Å²	90	134.9 Å²	134.9	63%	0.629	83%	0.829	S	S	*	*			trans	-158.7	160.4	-173.1	59.4	0	0	0	0	113.2
584	F	42.7	Very low	39	Very low	211 Å²	211	132.5 Å²	132.5	93%	0.925	82%	0.823	S	S	*	*			trans	-171.5	148.4	151.3	-87.6	-55.9	0	0	0	113.8
585	P	42.2	Very low	38.9	Very low	131 Å²	131	136.3 Å²	136.3	85%	0.851	83%	0.827	S	S	*	*			trans	-123.8	-178.1	179.2	43.5	-32.2	0	0	0	116
586	G	44.5	Very low	38.5	Very low	75 Å²	75	135.2 Å²	135.2	77%	0.773	82%	0.82	S	S	*	*			trans	-162.1	158	171	0	0	0	0	0	114.6
587	D	37.9	Very low	38.4	Very low	181 Å²	181	135.7 Å²	135.7	97%	0.968	82%	0.82	S	S	*	*			trans	-93.4	158.6	-166.4	-70.8	-61.8	0	0	0	116.9
588	G	36.9	Very low	38	Very low	79 Å²	79	134.9 Å²	134.9	81%	0.814	82%	0.822	S	S	*	*			trans	-177.6	125.3	165.5	0	0	0	0	0	114.2
589	N	36.5	Very low	37.5	Very low	184 Å²	184	134.5 Å²	134.5	98%	0.984	82%	0.823	S	S	*	*			trans	-83.2	141.8	-176.4	-95.4	-27.7	0	0	0	113.9
590	G	35.1	Very low	36.7	Very low	72 Å²	72	137 Å²	137	74%	0.742	83%	0.829	S	S	*	*			trans	-165.7	138.7	167	0	0	0	0	0	112.5
591	F	34.7	Very low	36.4	Very low	214 Å²	214	136.6 Å²	136.6	94%	0.939	82%	0.82	S	S	*	*			trans	-78.7	124.4	-179.9	-93.7	-112	0	0	0	112
592	Q	36.1	Very low	36	Very low	193 Å²	193	134 Å²	134	90%	0.902	81%	0.814	S	S	*	*			trans	-165.5	160.6	143.4	-110.1	160.6	65.5	0	0	111	P594	Q592-P594 WeakPolarHBondContact O-CD 3.38Å
593	S	31.6	Very low	35.7	Very low	112 Å²	112	138 Å²	138	78%	0.783	81%	0.813	S	S	*	*			trans	-103	114.4	-167.6	179.3	0	0	0	0	112.9
594	P	40.5	Very low	35.6	Very low	115 Å²	115	142.5 Å²	142.5	75%	0.747	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-93.6	130.1	168.5	33.3	-27.9	0	0	0	111.4	Q592	Q592-P594 WeakPolarHBondContact O-CD 3.38Å
595	N	32.8	Very low	35.2	Very low	150 Å²	150	135.6 Å²	135.6	80%	0.802	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-63.3	143	171.4	-74.2	-40.3	0	0	0	110.9
596	P	36.2	Very low	35	Very low	110 Å²	110	135.1 Å²	135.1	71%	0.714	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-68.6	139.7	-177.6	28.2	-34.7	0	0	0	111.6	V598	P596-V598 PolarHBondContact O-N 2.9Å
597	P	36.3	Very low	34.8	Very low	123 Å²	123	136.5 Å²	136.5	80%	0.799	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-70.2	126.7	-178.3	28.2	-34.4	0	0	0	111.4	C599	P597-C599 PolarHBondContact O-N 3.39Å
598	V	33	Very low	34.8	Very low	139 Å²	139	133 Å²	133	84%	0.842	79%	0.785	S	S	*	*			trans	-76	110.6	174.8	179.5	0	0	0	0	109.3	P596 L600	P596-V598 PolarHBondContact O-N 2.9Å; V598-L600 PolarHBondContact O-N 3.02Å
599	C	30.5	Very low	34.7	Very low	110 Å²	110	139.8 Å²	139.8	74%	0.743	79%	0.786	S	S	*	*			trans	-58.8	126.1	179.7	-75.2	0	0	0	0	112.7	P597 V601	P597-C599 PolarHBondContact O-N 3.39Å; C599-V601 PolarHBondContact O-N 2.9Å
600	L	29.7	Very low	34.6	Very low	180 Å²	180	135.7 Å²	135.7	94%	0.942	77%	0.772	S	S	*	*			trans	-68.3	97.3	172.8	-67.2	169.9	0	0	0	110.9	V598 S602	V598-L600 PolarHBondContact O-N 3.02Å; L600-S602 PolarHBondContact O-N 2.84Å
601	V	34.6	Very low	35.3	Very low	116 Å²	116	141.2 Å²	141.2	70%	0.703	77%	0.77	S	S	*	*			trans	-83.3	106.1	170	-178.4	0	0	0	0	109.1	C599 R603	C599-V601 PolarHBondContact O-N 2.9Å; V601-R603 PolarHBondContact O-N 2.89Å
602	S	28.2	Very low	35.9	Very low	91 Å²	91	137 Å²	137	64%	0.636	76%	0.757	S	S	*	*			trans	-56.2	127.2	174.8	179.7	0	0	0	0	111.3	L600 H604	L600-S602 PolarHBondContact O-N 2.84Å; S602-H604 PolarHBondContact OG-CD2 2.86Å; S602-H604 VanDerWaalsContact OG-CD2 3.28Å
603	R	33.9	Very low	37	Very low	222 Å²	222	138 Å²	138	84%	0.838	75%	0.752	S	S	*	*			trans	-118.6	59.4	178	-62.2	-164.2	-167.7	-173.1	8.3	112.2	V601 S605	V601-R603 PolarHBondContact O-N 2.89Å; R603-S605 PolarHBondContact O-N 2.79Å
604	H	33.2	Very low	38.7	Very low	184 Å²	184	136.3 Å²	136.3	85%	0.852	73%	0.733	S	S	*	*			trans	-70.3	80.1	160.9	-68.7	-69	0	0	0	110.3	S602	S602-H604 PolarHBondContact OG-CD2 2.86Å; S602-H604 VanDerWaalsContact OG-CD2 3.28Å
605	S	34.8	Very low	40.6	Very low	66 Å²	66	138.4 Å²	138.4	46%	0.462	73%	0.726	S	S	.	*			trans	-128.6	115.4	168.7	-179.4	0	0	0	0	109.6	R603 S607	R603-S605 PolarHBondContact O-N 2.79Å; S605-S607 PolarHBondContact O-N 2.87Å; S605-S607 VanDerWaalsContact O-N 3.1Å
606	P	38.2	Very low	43	Very low	122 Å²	122	135 Å²	135	79%	0.792	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-61	-17.8	177.8	-25.4	35.3	0	0	0	114.4	C608	P606-C608 PolarHBondContact O-N 3.09Å; P606-C608 VanDerWaalsContact O-N 3.14Å
607	S	40.4	Very low	45.4	Very low	104 Å²	104	136 Å²	136	73%	0.727	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-69.2	-9.1	-171.1	-165.8	0	0	0	0	115.4	S605	S605-S607 PolarHBondContact O-N 2.87Å; S605-S607 VanDerWaalsContact O-N 3.1Å
608	C	36.9	Very low	47.8	Very low	107 Å²	107	132.6 Å²	132.6	72%	0.723	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-97.5	9.8	-174.9	-63.4	0	0	0	0	114.6	P606 S610	P606-C608 PolarHBondContact O-N 3.09Å; P606-C608 VanDerWaalsContact O-N 3.14Å; C608-S610 VanDerWaalsContact C-N 3.31Å; C608-S610 PolarHBondContact O-N 2.95Å
609	R	35.6	Very low	50.2	Low	221 Å²	221	126 Å²	126	83%	0.834	64%	0.636	S	S	*	*			trans	-79.6	-2.7	-179.8	-82.3	-169.5	171.8	-163.6	-3.5	115.6	R611	R609-R611 PolarHBondContact O-N 3.13Å; R609-R611 VanDerWaalsContact O-N 3.11Å
610	S	34.9	Very low	52.9	Low	98 Å²	98	121.8 Å²	121.8	69%	0.685	61%	0.606	S	S	*	*			trans	-75.8	93.8	165.1	-168.9	0	0	0	0	109.5	C608 I612	C608-S610 VanDerWaalsContact C-N 3.31Å; C608-S610 PolarHBondContact O-N 2.95Å; S610-I612 PolarHBondContact O-N 2.81Å; S610-I612 VanDerWaalsContact O-N 3.16Å
611	R	48.9	Very low	55.8	Low	188 Å²	188	115.6 Å²	115.6	71%	0.709	58%	0.581	S	S	*	*			trans	-61.2	115	156.2	-76.2	-171.5	-178.5	-173.3	0.4	106	R609 R613	R609-R611 PolarHBondContact O-N 3.13Å; R609-R611 VanDerWaalsContact O-N 3.11Å; R611-R613 PolarHBondContact O-N 2.87Å
612	I	47.2	Very low	58.3	Low	127 Å²	127	115.8 Å²	115.8	65%	0.651	57%	0.569	S	S	*	*			trans	-54.8	117.7	-179.4	-61.8	171.8	0	0	0	107.6	S610 M614	S610-I612 PolarHBondContact O-N 2.81Å; S610-I612 VanDerWaalsContact O-N 3.16Å; I612-M614 PolarHBondContact O-N 2.66Å; I612-M614 VanDerWaalsContact O-N 3.11Å
613	R	60.5	Low	61.2	Low	213 Å²	213	111.5 Å²	111.5	80%	0.804	54%	0.539	S	S	*	.			trans	-62.9	115.7	169.5	-76	-173.9	177	178.9	-0.4	106.6	R611 R615	R611-R613 PolarHBondContact O-N 2.87Å; R613-R615 PolarHBondContact O-N 2.91Å
614	M	66.4	Low	64	Low	77 Å²	77	108 Å²	108	38%	0.379	53%	0.525	S	S	.	.			trans	-56.7	136.2	171.6	-61.8	-176	74.7	0	0	108.2	I612 Q618 I619 R622	I612-M614 PolarHBondContact O-N 2.66Å; I612-M614 VanDerWaalsContact O-N 3.11Å; M614-Q618 HydrophobicContact CB-CB 4.43Å; M614-Q618 HydrophobicContact CE-CB 4.13Å; M614-I619 HydrophobicContact CB-CD1 4.1Å; M614-I619 HydrophobicContact CB-CG1 3.65Å; M614-I619 WeakPolarHBondContact O-CD1 3.2Å; M614-R622 HydrophobicContact CE-CG 4.07Å
615	R	81.1	Confident	66.7	Low	159 Å²	159	104.3 Å²	104.3	60%	0.6	52%	0.516	S	S	*	.			trans	-71.1	154.5	175.3	-66.3	174.9	-76.8	162.3	-6.2	110	R613 E617 Q618 I619	R613-R615 PolarHBondContact O-N 2.91Å; R615-E617 WeakPolarHBondContact CB-OE2 3.45Å; R615-E617 PolarHBondContact O-N 2.85Å; R615-E617 VanDerWaalsContact O-N 3.15Å; R615-Q618 HydrophobicContact CB-CG 4.42Å; R615-Q618 WeakPolarHBondContact O-CA 3.3Å; R615-Q618 WeakPolarHBondContact O-CB 3.48Å; R615-Q618 PolarHBondContact O-N 2.9Å; R615-I619 PolarHBondContact O-N 2.88Å
616	D	82.8	Confident	69.3	Low	78 Å²	78	102.2 Å²	102.2	42%	0.417	50%	0.5	S	S	.	.	H	α-helix	trans	-53	-38.2	-178.8	-75.8	14.3	0	0	0	112.5	Q618 I619 I620 K675	D616-Q618 PolarHBondContact O-N 2.82Å; D616-I619 PolarHBondContact O-N 2.73Å; D616-I620 WeakPolarHBondContact O-CB 3.35Å; D616-I620 VanDerWaalsContact O-CG1 3.25Å; D616-I620 WeakPolarHBondContact O-CG1 3.4Å; D616-I620 PolarHBondContact O-N 2.79Å; D616-K675 HydrophobicContact CB-CD 4.27Å; D616-K675 WeakPolarHBondContact OD2-CE 3.23Å; D616-K675 IonicContact OD2-NZ 2.67Å; D616-K675 PolarHBondContact OD2-NZ 2.89Å
617	E	86.1	Confident	71.9	Confident	131 Å²	131	97 Å²	97	61%	0.612	47%	0.466	S	S	*	.	H	α-helix	trans	-66.3	-37.2	176.7	-52.9	82	-178.6	0	0	112	R615 A621	R615-E617 WeakPolarHBondContact CB-OE2 3.45Å; R615-E617 PolarHBondContact O-N 2.85Å; R615-E617 VanDerWaalsContact O-N 3.15Å; E617-A621 WeakPolarHBondContact O-CB 3.35Å; E617-A621 PolarHBondContact O-N 2.97Å
618	Q	87.5	Confident	74.5	Confident	51 Å²	51	94.2 Å²	94.2	24%	0.238	45%	0.446	C	S	.	.	H	α-helix	trans	-69.8	-36.6	176.2	-63.3	173.4	-67.2	0	0	111.1	M614 R615 D616 R622	M614-Q618 HydrophobicContact CB-CB 4.43Å; M614-Q618 HydrophobicContact CE-CB 4.13Å; R615-Q618 HydrophobicContact CB-CG 4.42Å; R615-Q618 WeakPolarHBondContact O-CA 3.3Å; R615-Q618 WeakPolarHBondContact O-CB 3.48Å; R615-Q618 PolarHBondContact O-N 2.9Å; D616-Q618 PolarHBondContact O-N 2.82Å; Q618-R622 WeakPolarHBondContact O-CG 3.42Å; Q618-R622 PolarHBondContact O-N 2.84Å
619	I	84	Confident	77.1	Confident	2 Å²	2	97.1 Å²	97.1	1%	0.01	45%	0.449	C	S	.	.	H	α-helix	trans	-70.4	-45.9	176.9	-60.2	165.4	0	0	0	110.3	M614 R615 D616 A621 R622 L623 K675 E676 L679	M614-I619 HydrophobicContact CB-CD1 4.1Å; M614-I619 HydrophobicContact CB-CG1 3.65Å; M614-I619 WeakPolarHBondContact O-CD1 3.2Å; R615-I619 PolarHBondContact O-N 2.88Å; D616-I619 PolarHBondContact O-N 2.73Å; I619-A621 VanDerWaalsContact C-N 3.34Å; I619-A621 PolarHBondContact O-N 2.92Å; I619-R622 PolarHBondContact O-N 3.25Å; I619-L623 HydrophobicContact CG2-CD1 4.27Å; I619-L623 WeakPolarHBondContact O-CG 3.36Å; I619-L623 PolarHBondContact O-N 3.21Å; I619-K675 HydrophobicContact CB-CB 4.42Å; I619-K675 HydrophobicContact CD1-CB 3.97Å; I619-K675 HydrophobicContact CG2-CB 3.77Å; I619-E676 HydrophobicContact CD1-CB 4.05Å; I619-L679 HydrophobicContact CG2-CB 4.28Å; I619-L679 HydrophobicContact CG2-CD2 4.29Å
620	I	86.8	Confident	79.7	Confident	20 Å²	20	89 Å²	89	10%	0.103	43%	0.434	C	S	.	.	H	α-helix	trans	-63.3	-40	176.6	-70.1	165.8	0	0	0	110.8	D616 L623 R624 L669 L701	D616-I620 WeakPolarHBondContact O-CB 3.35Å; D616-I620 VanDerWaalsContact O-CG1 3.25Å; D616-I620 WeakPolarHBondContact O-CG1 3.4Å; D616-I620 PolarHBondContact O-N 2.79Å; I620-L623 PolarHBondContact O-N 3.46Å; I620-R624 WeakPolarHBondContact O-CG 3.38Å; I620-R624 PolarHBondContact O-N 3.19Å; I620-L669 HydrophobicContact CG1-CD1 4.26Å; I620-L701 HydrophobicContact CG2-CD2 4.31Å
621	A	89.6	Confident	82.5	Confident	51 Å²	51	89.8 Å²	89.8	42%	0.421	43%	0.425	S	S	.	.	H	α-helix	trans	-61.7	-42.4	173	0	0	0	0	0	112.2	E617 I619 R624 T625	E617-A621 WeakPolarHBondContact O-CB 3.35Å; E617-A621 PolarHBondContact O-N 2.97Å; I619-A621 VanDerWaalsContact C-N 3.34Å; I619-A621 PolarHBondContact O-N 2.92Å; A621-R624 PolarHBondContact O-N 2.82Å; A621-T625 PolarHBondContact O-N 3Å
622	R	88.3	Confident	84.6	Confident	120 Å²	120	81 Å²	81	45%	0.453	39%	0.392	S	S	.	.	H	α-helix	trans	-65.8	-41.8	175	-73.7	-70.4	-177.4	165	-0.4	112.5	M614 Q618 I619 R624 T625 I626 L679	M614-R622 HydrophobicContact CE-CG 4.07Å; Q618-R622 WeakPolarHBondContact O-CG 3.42Å; Q618-R622 PolarHBondContact O-N 2.84Å; I619-R622 PolarHBondContact O-N 3.25Å; R622-R624 VanDerWaalsContact C-N 3.31Å; R622-R624 PolarHBondContact O-N 2.85Å; R622-T625 PolarHBondContact O-N 2.67Å; R622-T625 VanDerWaalsContact O-N 3.07Å; R622-T625 PolarHBondContact O-OG1 3.1Å; R622-I626 WeakPolarHBondContact O-CD1 3.44Å; R622-I626 WeakPolarHBondContact O-CG1 3.46Å; R622-I626 PolarHBondContact O-N 3.06Å; R622-L679 HydrophobicContact CB-CD1 4.14Å; R622-L679 HydrophobicContact CB-CD2 3.92Å
623	L	88.9	Confident	86.8	Confident	1 Å²	1	78.7 Å²	78.7	1%	0.005	39%	0.387	C	S	.	.	H	α-helix	trans	-57.3	-44.4	173.2	-72.6	169.4	0	0	0	111	I619 I620 T625 I626 V627 L669 L679 I682 L701 L706	I619-L623 HydrophobicContact CG2-CD1 4.27Å; I619-L623 WeakPolarHBondContact O-CG 3.36Å; I619-L623 PolarHBondContact O-N 3.21Å; I620-L623 PolarHBondContact O-N 3.46Å; L623-T625 PolarHBondContact O-N 3.41Å; L623-I626 PolarHBondContact O-N 3.28Å; L623-V627 WeakPolarHBondContact O-CG1 3.18Å; L623-V627 WeakPolarHBondContact O-CG2 3.33Å; L623-V627 PolarHBondContact O-N 3.43Å; L623-L669 HydrophobicContact CD1-CD1 3.84Å; L623-L669 HydrophobicContact CD1-CD2 4.26Å; L623-L679 HydrophobicContact CD2-CB 4.39Å; L623-L679 HydrophobicContact CD2-CD1 3.91Å; L623-L679 HydrophobicContact CG-CD1 4.25Å; L623-I682 HydrophobicContact CD2-CD1 4.07Å; L623-L701 HydrophobicContact CB-CD2 4.34Å; L623-L706 HydrophobicContact CD1-CD2 4.36Å; L623-L706 HydrophobicContact CD2-CD2 4.29Å
624	R	91.4	Very high	88.4	Confident	147 Å²	147	74.2 Å²	74.2	56%	0.555	38%	0.376	S	S	*	.	H	α-helix	trans	-60.7	-22	175.6	-72.3	175.2	-174	167.2	4.5	114.9	I620 A621 R622 L701	I620-R624 WeakPolarHBondContact O-CG 3.38Å; I620-R624 PolarHBondContact O-N 3.19Å; A621-R624 PolarHBondContact O-N 2.82Å; R622-R624 VanDerWaalsContact C-N 3.31Å; R622-R624 PolarHBondContact O-N 2.85Å; R624-L701 HydrophobicContact CG-CD2 3.7Å
625	T	90.9	Very high	89.7	Confident	107 Å²	107	73.1 Å²	73.1	66%	0.656	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-4.3	173.5	57.7	0	0	0	0	114.2	A621 R622 L623	A621-T625 PolarHBondContact O-N 3Å; R622-T625 PolarHBondContact O-N 2.67Å; R622-T625 VanDerWaalsContact O-N 3.07Å; R622-T625 PolarHBondContact O-OG1 3.1Å; L623-T625 PolarHBondContact O-N 3.41Å
626	I	89.4	Confident	90.5	Very high	23 Å²	23	65.8 Å²	65.8	12%	0.118	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-44.8	-176.2	-62.2	161	0	0	0	110.7	R622 L623 L679 I682 L683 R686	R622-I626 WeakPolarHBondContact O-CD1 3.44Å; R622-I626 WeakPolarHBondContact O-CG1 3.46Å; R622-I626 PolarHBondContact O-N 3.06Å; L623-I626 PolarHBondContact O-N 3.28Å; I626-L679 HydrophobicContact CD1-CD1 3.45Å; I626-L679 VanDerWaalsContact CD1-CD1 3.45Å; I626-I682 HydrophobicContact CG2-CG2 3.85Å; I626-L683 HydrophobicContact CD1-CD1 4.4Å; I626-L683 HydrophobicContact CD1-CD2 3.74Å; I626-L683 HydrophobicContact CD1-CG 4.07Å; I626-L683 HydrophobicContact CG1-CD2 4.43Å; I626-R686 PolarHBondContact O-NH1 3.22Å
627	V	92.7	Very high	91.1	Very high	13 Å²	13	66 Å²	66	8%	0.079	34%	0.34	C	S	.	.	S	Bend	trans	-64.5	149.5	179.2	-60	0	0	0	0	112.5	L623 S699 L701 L706	L623-V627 WeakPolarHBondContact O-CG1 3.18Å; L623-V627 WeakPolarHBondContact O-CG2 3.33Å; L623-V627 PolarHBondContact O-N 3.43Å; V627-S699 CarbonylContact C-O 3.46Å; V627-S699 WeakPolarHBondContact CA-O 3.03Å; V627-S699 WeakPolarHBondContact CB-O 3.43Å; V627-L701 HydrophobicContact CG1-CB 4.28Å; V627-L701 HydrophobicContact CG2-CB 3.88Å; V627-L706 HydrophobicContact CG1-CD1 3.82Å
628	S	94.7	Very high	91.5	Very high	45 Å²	45	62.7 Å²	62.7	32%	0.315	33%	0.329	S	S	.	.	B	Isolated β-bridge	trans	-62.9	151.3	168.6	-65.3	0	0	0	0	111.6	D698 S699	S628-D698 WeakPolarHBondContact CB-OD1 3.44Å; S628-D698 PolarHBondContact OG-OD1 3.16Å; S628-S699 WeakPolarHBondContact CB-O 3.21Å; S628-S699 PolarHBondContact N-O 3.33Å
629	H	92	Very high	91.8	Very high	167 Å²	167	64.6 Å²	64.6	77%	0.773	34%	0.34	S	S	*	.	S	Bend	trans	-88	164.9	173.9	-58.6	-28.2	0	0	0	111.3
630	G	90.7	Very high	92.2	Very high	52 Å²	52	65.9 Å²	65.9	54%	0.536	35%	0.353	S	S	.	.	S	Bend	trans	88.8	-164.1	-174.7	0	0	0	0	0	112.7
631	K	91.9	Very high	92.4	Very high	114 Å²	114	72.6 Å²	72.6	50%	0.496	38%	0.378	S	S	.	.			trans	-111.2	142.5	174.4	-57	174	-167.7	155.6	0	110.5	S633 E634	K631-S633 WeakPolarHBondContact CB-OG 3.47Å; K631-S633 PolarHBondContact O-N 2.62Å; K631-E634 HydrophobicContact CB-CG 4.16Å; K631-E634 WeakPolarHBondContact CD-OE1 3.27Å; K631-E634 WeakPolarHBondContact CG-OE1 3.25Å; K631-E634 PolarHBondContact N-OE2 3.2Å; K631-E634 WeakPolarHBondContact O-CB 3.43Å; K631-E634 PolarHBondContact O-N 2.86Å
632	P	93.6	Very high	92.4	Very high	2 Å²	2	74.1 Å²	74.1	1%	0.013	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-60.1	-30.4	174.5	23.4	-32.1	0	0	0	111.8	E634 K635 Y636 Y700 L702 W707	P632-E634 PolarHBondContact O-N 3.13Å; P632-E634 VanDerWaalsContact O-N 3.09Å; P632-K635 CarbonylContact O-C 3.46Å; P632-K635 PolarHBondContact O-N 3.26Å; P632-Y636 HydrophobicContact CB-CD2 4.28Å; P632-Y636 PolarHBondContact O-N 2.82Å; P632-Y700 HydrophobicContact CB-CD2 3.86Å; P632-Y700 HydrophobicContact CB-CE2 4.2Å; P632-Y700 HydrophobicContact CB-CG 4.07Å; P632-Y700 HydrophobicContact CG-CD2 4.48Å; P632-Y700 HydrophobicContact CG-CG 4.29Å; P632-L702 HydrophobicContact CG-CD1 4Å; P632-W707 HydrophobicContact CB-CD2 4.22Å; P632-W707 HydrophobicContact CB-CE3 3.5Å; P632-W707 VanDerWaalsContact CB-CE3 3.5Å; P632-W707 HydrophobicContact CB-CZ3 3.76Å; P632-W707 HydrophobicContact CG-CD2 3.55Å; P632-W707 HydrophobicContact CG-CE3 3.28Å; P632-W707 HydrophobicContact CG-CG 4.2Å; P632-W707 HydrophobicContact CG-CH2 4.04Å; P632-W707 HydrophobicContact CG-CZ2 4.27Å; P632-W707 HydrophobicContact CG-CZ3 3.55Å
633	S	92.6	Very high	91.9	Very high	79 Å²	79	69.1 Å²	69.1	55%	0.552	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-62.9	-11.2	174.2	61.9	0	0	0	0	115	K631	K631-S633 WeakPolarHBondContact CB-OG 3.47Å; K631-S633 PolarHBondContact O-N 2.62Å
634	E	94.1	Very high	91.4	Very high	120 Å²	120	73.1 Å²	73.1	56%	0.561	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-87.7	-9.3	175.1	-65.2	152	-171.7	0	0	111.7	K631 P632	K631-E634 HydrophobicContact CB-CG 4.16Å; K631-E634 WeakPolarHBondContact CD-OE1 3.27Å; K631-E634 WeakPolarHBondContact CG-OE1 3.25Å; K631-E634 PolarHBondContact N-OE2 3.2Å; K631-E634 WeakPolarHBondContact O-CB 3.43Å; K631-E634 PolarHBondContact O-N 2.86Å; P632-E634 PolarHBondContact O-N 3.13Å; P632-E634 VanDerWaalsContact O-N 3.09Å
635	K	95.6	Very high	90	Very high	53 Å²	53	66.4 Å²	66.4	23%	0.23	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131	-25.9	-178.1	-176.2	176.8	168.7	-168.9	0	113.9	P632 E655 L656 D698	P632-K635 CarbonylContact O-C 3.46Å; P632-K635 PolarHBondContact O-N 3.26Å; K635-E655 WeakPolarHBondContact CE-OE1 3.22Å; K635-E655 HydrophobicContact CG-CG 4.37Å; K635-E655 IonicContact NZ-OE1 3.44Å; K635-E655 PolarHBondContact NZ-OE1 2.96Å; K635-L656 WeakPolarHBondContact O-CB 3.29Å; K635-L656 WeakPolarHBondContact O-CG 3.47Å; K635-L656 PolarHBondContact O-N 3.27Å; K635-D698 IonicContact NZ-OD2 2.85Å; K635-D698 PolarHBondContact NZ-OD2 3.23Å
636	Y	96.7	Very high	88.4	Confident	5 Å²	5	62.3 Å²	62.3	2%	0.02	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	131.8	-174.4	-52.7	-81.3	0	0	0	112.3	P632 R654 E655 V662 D698 Y700 V709	P632-Y636 HydrophobicContact CB-CD2 4.28Å; P632-Y636 PolarHBondContact O-N 2.82Å; Y636-R654 CarbonylContact C-O 3.6Å; Y636-R654 VanDerWaalsContact CA-O 3.27Å; Y636-R654 WeakPolarHBondContact CA-O 3.42Å; Y636-E655 HydrophobicContact CD1-CB 3.88Å; Y636-E655 HydrophobicContact CD1-CG 4.25Å; Y636-E655 HydrophobicContact CE1-CB 3.88Å; Y636-E655 HydrophobicContact CE1-CG 3.99Å; Y636-V662 HydrophobicContact CD1-CG2 3.81Å; Y636-V662 HydrophobicContact CE1-CG1 4.29Å; Y636-V662 HydrophobicContact CE1-CG2 4.26Å; Y636-D698 HydrophobicContact CE2-CB 4.48Å; Y636-D698 WeakPolarHBondContact OH-CB 3.3Å; Y636-D698 PolarHBondContact OH-OD2 2.67Å; Y636-Y700 HydrophobicContact CD2-CE2 4.43Å; Y636-Y700 AromaticContact CE2-CE2 3.82Å; Y636-Y700 HydrophobicContact CE2-CE2 3.82Å; Y636-V709 HydrophobicContact CD1-CG1 4.34Å; Y636-V709 HydrophobicContact CD2-CG2 4.41Å; Y636-V709 HydrophobicContact CE1-CG1 3.84Å; Y636-V709 HydrophobicContact CE2-CG1 4.39Å; Y636-V709 HydrophobicContact CE2-CG2 4.07Å
637	E	96	Very high	87.3	Confident	83 Å²	83	61.8 Å²	61.8	39%	0.388	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	145	164.6	174.5	172.6	-125.1	0	0	109.5	L639 G653 R654 L656	E637-L639 HydrophobicContact CG-CD2 3.91Å; E637-G653 CarbonylContact O-C 3.24Å; E637-G653 WeakPolarHBondContact O-CA 3.48Å; E637-R654 HydrophobicContact CB-CB 4.32Å; E637-R654 PolarHBondContact N-O 3.46Å; E637-R654 PolarHBondContact O-N 2.85Å; E637-R654 IonicContact OE2-NH1 2.77Å; E637-L656 HydrophobicContact CB-CD2 3.9Å
638	T	94.4	Very high	86.5	Confident	62 Å²	62	62 Å²	62	38%	0.38	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	112.4	175.9	-56.3	0	0	0	0	108.5	Y651	T638-Y651 HydrophobicContact CG2-CD1 3.57Å; T638-Y651 HydrophobicContact CG2-CE1 4.36Å; T638-Y651 HydrophobicContact CG2-CG 3.75Å
639	L	93.8	Very high	86.1	Confident	91 Å²	91	61.3 Å²	61.3	48%	0.476	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-37.7	-171.3	-62.3	176.4	0	0	0	112.5	E637 I652 R654	E637-L639 HydrophobicContact CG-CD2 3.91Å; L639-I652 HydrophobicContact CB-CG2 4.24Å; L639-I652 PolarHBondContact N-O 3.48Å; L639-R654 HydrophobicContact CD1-CB 4.08Å; L639-R654 HydrophobicContact CG-CB 4.3Å
640	G	92.3	Very high	86.1	Confident	28 Å²	28	54.5 Å²	54.5	29%	0.289	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.7	166.5	-177.4	0	0	0	0	0	113.4	Y651 I652	G640-Y651 CarbonylContact O-C 3.5Å; G640-Y651 WeakPolarHBondContact O-CA 3.49Å; G640-Y651 VanDerWaalsContact O-CB 3.27Å; G640-Y651 WeakPolarHBondContact O-CB 3.41Å; G640-Y651 WeakPolarHBondContact O-CD1 3.26Å; G640-I652 PolarHBondContact N-O 2.97Å; G640-I652 PolarHBondContact O-N 3.34Å
641	R	91.7	Very high	86.3	Confident	162 Å²	162	54.9 Å²	54.9	61%	0.611	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	127.7	174.1	173.6	177.8	160.4	-156.2	-13.2	109.2	H644 V649 Y651	R641-H644 VanDerWaalsContact NH2-CB 3.34Å; R641-V649 HydrophobicContact CG-CG1 3.8Å; R641-Y651 HydrophobicContact CB-CD1 3.98Å; R641-Y651 HydrophobicContact CB-CE1 4.01Å
642	I	88.1	Confident	86.4	Confident	82 Å²	82	50.5 Å²	50.5	42%	0.421	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-14.7	177.9	58.7	173.8	0	0	0	113.4	V650 I652 Y712	I642-V650 HydrophobicContact CD1-CG1 3.92Å; I642-V650 HydrophobicContact CG1-CB 4.2Å; I642-V650 HydrophobicContact CG1-CG1 3.84Å; I642-V650 WeakPolarHBondContact CG1-O 3.42Å; I642-V650 PolarHBondContact N-O 3.11Å; I642-I652 HydrophobicContact CD1-CB 4.38Å; I642-I652 HydrophobicContact CG2-CB 3.75Å; I642-I652 HydrophobicContact CG2-CG2 3.66Å; I642-Y712 HydrophobicContact CD1-CD2 4.08Å; I642-Y712 HydrophobicContact CD1-CE2 3.62Å
643	G	79.3	Confident	86.6	Confident	15 Å²	15	50.4 Å²	50.4	16%	0.155	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.5	165.8	178.4	0	0	0	0	0	113.4	V649 V650	G643-V649 WeakPolarHBondContact O-CG1 3.31Å; G643-V650 PolarHBondContact N-O 3.4Å; G643-V650 PolarHBondContact O-N 2.64Å
644	H	76.9	Confident	86.8	Confident	85 Å²	85	52 Å²	52	39%	0.394	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	128.7	170.7	171.6	50.7	0	0	0	110.5	I132 R641 G648	I132-H644 VanDerWaalsContact CG1-C 3.42Å; I132-H644 VanDerWaalsContact CG1-O 3.3Å; I132-H644 WeakPolarHBondContact CG1-O 3.13Å; R641-H644 VanDerWaalsContact NH2-CB 3.34Å; H644-G648 PolarHBondContact ND1-O 2.82Å
645	G	62.6	Low	86.9	Confident	7 Å²	7	48.3 Å²	48.3	7%	0.072	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.1	-144.5	175.2	0	0	0	0	0	113.5	K130 S647 G648	K130-G645 CarbonylContact O-C 3.56Å; K130-G645 WeakPolarHBondContact O-CA 3.46Å; G645-S647 VanDerWaalsContact C-N 3.32Å; G645-S647 PolarHBondContact O-N 3.47Å; G645-G648 PolarHBondContact N-O 3.16Å; G645-G648 PolarHBondContact O-N 3.45Å
646	A	57.2	Low	86.9	Confident	20 Å²	20	50.3 Å²	50.3	17%	0.165	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-37.1	-151.1	0	0	0	0	0	113.3	Q129 K130 Q672	Q129-A646 VanDerWaalsContact C-CB 3.49Å; Q129-A646 HydrophobicContact CB-CB 3.82Å; K130-A646 WeakPolarHBondContact O-CA 3.47Å; K130-A646 PolarHBondContact O-N 3.36Å; A646-Q672 PolarHBondContact O-NE2 3.43Å
647	S	65.8	Low	86.7	Confident	13 Å²	13	58.2 Å²	58.2	9%	0.091	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-28.2	178.5	-49.7	0	0	0	0	112.1	G645 M667 Q672	G645-S647 VanDerWaalsContact C-N 3.32Å; G645-S647 PolarHBondContact O-N 3.47Å; S647-M667 VanDerWaalsContact CB-SD 3.55Å; S647-M667 VanDerWaalsContact O-CA 3.31Å; S647-M667 WeakPolarHBondContact O-CA 3.41Å; S647-M667 WeakPolarHBondContact O-CB 3.19Å; S647-M667 VanDerWaalsContact O-CG 3.27Å; S647-M667 WeakPolarHBondContact O-CG 3.39Å; S647-Q672 VanDerWaalsContact CA-NE2 3.31Å; S647-Q672 PolarHBondContact O-NE2 2.86Å
648	G	75.6	Confident	86.6	Confident	16 Å²	16	57.1 Å²	57.1	17%	0.165	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.1	-141.7	178.9	0	0	0	0	0	114.2	H644 G645 Q666	H644-G648 PolarHBondContact ND1-O 2.82Å; G645-G648 PolarHBondContact N-O 3.16Å; G645-G648 PolarHBondContact O-N 3.45Å; G648-Q666 CarbonylContact C-O 3.55Å; G648-Q666 VanDerWaalsContact CA-O 3.26Å; G648-Q666 WeakPolarHBondContact CA-O 3.18Å
649	V	88	Confident	86.6	Confident	32 Å²	32	55.7 Å²	55.7	19%	0.194	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	138.3	-179	-172.9	0	0	0	0	109.7	R641 G643 Y651 Q666	R641-V649 HydrophobicContact CG-CG1 3.8Å; G643-V649 WeakPolarHBondContact O-CG1 3.31Å; V649-Y651 HydrophobicContact CB-CD2 4.32Å; V649-Y651 HydrophobicContact CB-CE2 3.62Å; V649-Y651 HydrophobicContact CG1-CD2 3.92Å; V649-Y651 HydrophobicContact CG1-CE1 4.23Å; V649-Y651 HydrophobicContact CG1-CE2 3.34Å; V649-Q666 PolarHBondContact N-O 3.32Å; V649-Q666 PolarHBondContact O-N 3.47Å
650	V	91.4	Very high	86.6	Confident	24 Å²	24	54.8 Å²	54.8	15%	0.145	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	126.7	174.6	-168.3	0	0	0	0	109.1	I132 I642 G643 I664 K665	I132-V650 HydrophobicContact CD1-CG2 4.31Å; I642-V650 HydrophobicContact CD1-CG1 3.92Å; I642-V650 HydrophobicContact CG1-CB 4.2Å; I642-V650 HydrophobicContact CG1-CG1 3.84Å; I642-V650 WeakPolarHBondContact CG1-O 3.42Å; I642-V650 PolarHBondContact N-O 3.11Å; G643-V650 PolarHBondContact N-O 3.4Å; G643-V650 PolarHBondContact O-N 2.64Å; V650-I664 WeakPolarHBondContact CA-O 3.39Å; V650-K665 HydrophobicContact CG2-CG 4.29Å
651	Y	94.6	Very high	86.8	Confident	60 Å²	60	58.3 Å²	58.3	24%	0.235	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	147.4	177.3	-62.4	-96.6	0	0	0	110.8	T638 G640 R641 V649 I664 Q666	T638-Y651 HydrophobicContact CG2-CD1 3.57Å; T638-Y651 HydrophobicContact CG2-CE1 4.36Å; T638-Y651 HydrophobicContact CG2-CG 3.75Å; G640-Y651 CarbonylContact O-C 3.5Å; G640-Y651 WeakPolarHBondContact O-CA 3.49Å; G640-Y651 VanDerWaalsContact O-CB 3.27Å; G640-Y651 WeakPolarHBondContact O-CB 3.41Å; G640-Y651 WeakPolarHBondContact O-CD1 3.26Å; R641-Y651 HydrophobicContact CB-CD1 3.98Å; R641-Y651 HydrophobicContact CB-CE1 4.01Å; V649-Y651 HydrophobicContact CB-CD2 4.32Å; V649-Y651 HydrophobicContact CB-CE2 3.62Å; V649-Y651 HydrophobicContact CG1-CD2 3.92Å; V649-Y651 HydrophobicContact CG1-CE1 4.23Å; V649-Y651 HydrophobicContact CG1-CE2 3.34Å; Y651-I664 PolarHBondContact N-O 2.89Å; Y651-I664 PolarHBondContact O-N 3.21Å; Y651-Q666 HydrophobicContact CD2-CG 3.92Å; Y651-Q666 HydrophobicContact CE2-CB 4.32Å; Y651-Q666 HydrophobicContact CE2-CG 3.94Å
652	I	95.2	Very high	87	Confident	22 Å²	22	50.8 Å²	50.8	11%	0.113	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	134.2	157.7	-174.3	175.3	0	0	0	108.1	L639 G640 I642 Y712	L639-I652 HydrophobicContact CB-CG2 4.24Å; L639-I652 PolarHBondContact N-O 3.48Å; G640-I652 PolarHBondContact N-O 2.97Å; G640-I652 PolarHBondContact O-N 3.34Å; I642-I652 HydrophobicContact CD1-CB 4.38Å; I642-I652 HydrophobicContact CG2-CB 3.75Å; I642-I652 HydrophobicContact CG2-CG2 3.66Å; I652-Y712 HydrophobicContact CD1-CD1 3.9Å; I652-Y712 HydrophobicContact CD1-CE1 3.55Å; I652-Y712 HydrophobicContact CD1-CE2 4.38Å; I652-Y712 HydrophobicContact CD1-CG 4.42Å; I652-Y712 HydrophobicContact CG1-CD1 4.38Å; I652-Y712 HydrophobicContact CG1-CE1 4.38Å; I652-Y712 HydrophobicContact CG1-CG 4.44Å
653	G	96.1	Very high	87.4	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	-178.5	176.5	0	0	0	0	0	111.9	E637 R661 V662	E637-G653 CarbonylContact O-C 3.24Å; E637-G653 WeakPolarHBondContact O-CA 3.48Å; G653-R661 WeakPolarHBondContact O-CA 3.25Å; G653-V662 PolarHBondContact N-O 3.46Å; G653-V662 PolarHBondContact O-N 3.17Å
654	R	96.7	Very high	88.1	Confident	113 Å²	113	46.6 Å²	46.6	43%	0.426	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	130	-177.5	-171.1	-172.7	-172.1	-164.7	5	109.8	Y636 E637 L639 L656 G659 C660	Y636-R654 CarbonylContact C-O 3.6Å; Y636-R654 VanDerWaalsContact CA-O 3.27Å; Y636-R654 WeakPolarHBondContact CA-O 3.42Å; E637-R654 HydrophobicContact CB-CB 4.32Å; E637-R654 PolarHBondContact N-O 3.46Å; E637-R654 PolarHBondContact O-N 2.85Å; E637-R654 IonicContact OE2-NH1 2.77Å; L639-R654 HydrophobicContact CD1-CB 4.08Å; L639-R654 HydrophobicContact CG-CB 4.3Å; R654-L656 PolarHBondContact O-N 3.12Å; R654-G659 WeakPolarHBondContact CG-O 3.38Å; R654-C660 CarbonylContact C-O 3.55Å; R654-C660 WeakPolarHBondContact CA-O 3.45Å
655	E	96.3	Very high	88.7	Confident	41 Å²	41	42.9 Å²	42.9	19%	0.192	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	123.3	171.3	-177.2	177	-118.7	0	0	109.9	K635 Y636 Q657 S658 G659 C660	K635-E655 WeakPolarHBondContact CE-OE1 3.22Å; K635-E655 HydrophobicContact CG-CG 4.37Å; K635-E655 IonicContact NZ-OE1 3.44Å; K635-E655 PolarHBondContact NZ-OE1 2.96Å; Y636-E655 HydrophobicContact CD1-CB 3.88Å; Y636-E655 HydrophobicContact CD1-CG 4.25Å; Y636-E655 HydrophobicContact CE1-CB 3.88Å; Y636-E655 HydrophobicContact CE1-CG 3.99Å; E655-Q657 PolarHBondContact O-N 2.98Å; E655-S658 WeakPolarHBondContact CB-OG 3.36Å; E655-S658 WeakPolarHBondContact OE2-CB 3.13Å; E655-S658 PolarHBondContact OE2-OG 2.83Å; E655-G659 VanDerWaalsContact O-CA 3.3Å; E655-G659 WeakPolarHBondContact O-CA 3.4Å; E655-G659 PolarHBondContact O-N 2.78Å; E655-C660 PolarHBondContact N-O 3.25Å
656	L	95.6	Very high	90.1	Very high	95 Å²	95	44.3 Å²	44.3	50%	0.497	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-23.2	-171.4	-67.2	172.9	0	0	0	113.8	K635 E637 R654	K635-L656 WeakPolarHBondContact O-CB 3.29Å; K635-L656 WeakPolarHBondContact O-CG 3.47Å; K635-L656 PolarHBondContact O-N 3.27Å; E637-L656 HydrophobicContact CB-CD2 3.9Å; R654-L656 PolarHBondContact O-N 3.12Å
657	Q	93.6	Very high	91.5	Very high	172 Å²	172	43.4 Å²	43.4	80%	0.804	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90	-38.8	-176.9	-64.7	-175.6	-1.4	0	0	113.2	E655	E655-Q657 PolarHBondContact O-N 2.98Å
658	S	94.2	Very high	92.5	Very high	60 Å²	60	43.5 Å²	43.5	42%	0.42	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101	-19.6	-176.3	61.3	0	0	0	0	113.3	E655 C660	E655-S658 WeakPolarHBondContact CB-OG 3.36Å; E655-S658 WeakPolarHBondContact OE2-CB 3.13Å; E655-S658 PolarHBondContact OE2-OG 2.83Å; S658-C660 PolarHBondContact O-N 2.79Å; S658-C660 WeakPolarHBondContact OG-CB 3.45Å; S658-C660 PolarHBondContact OG-N 3.33Å
659	G	93.7	Very high	93	Very high	32 Å²	32	42.8 Å²	42.8	33%	0.33	22%	0.221	S	C	.	.			trans	73.9	0	-169.8	0	0	0	0	0	114.2	R654 E655	R654-G659 WeakPolarHBondContact CG-O 3.38Å; E655-G659 VanDerWaalsContact O-CA 3.3Å; E655-G659 WeakPolarHBondContact O-CA 3.4Å; E655-G659 PolarHBondContact O-N 2.78Å
660	C	93.8	Very high	92.8	Very high	72 Å²	72	50.4 Å²	50.4	49%	0.486	25%	0.246	S	C	.	.			trans	-68.7	143	-175.7	-66.9	0	0	0	0	112.7	R654 E655 S658	R654-C660 CarbonylContact C-O 3.55Å; R654-C660 WeakPolarHBondContact CA-O 3.45Å; E655-C660 PolarHBondContact N-O 3.25Å; S658-C660 PolarHBondContact O-N 2.79Å; S658-C660 WeakPolarHBondContact OG-CB 3.45Å; S658-C660 PolarHBondContact OG-N 3.33Å
661	R	96	Very high	92.2	Very high	102 Å²	102	56.4 Å²	56.4	39%	0.385	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	138.6	173.9	-69.4	177.2	173.2	-174.2	-2.6	110.7	G653 Y712 D714	G653-R661 WeakPolarHBondContact O-CA 3.25Å; R661-Y712 HydrophobicContact CB-CD1 3.95Å; R661-Y712 HydrophobicContact CB-CG 4.37Å; R661-D714 WeakPolarHBondContact CD-OD1 3.44Å; R661-D714 IonicContact CZ-OD1 3.17Å; R661-D714 IonicContact NE-OD1 2.7Å; R661-D714 IonicContact NH1-OD1 3.5Å; R661-D714 PolarHBondContact NH1-OD1 2.9Å
662	V	96.4	Very high	91.2	Very high	3 Å²	3	54.5 Å²	54.5	2%	0.018	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	149.7	179.7	-65	0	0	0	0	111.4	Y636 G653 I664 L697 V709 M710	Y636-V662 HydrophobicContact CD1-CG2 3.81Å; Y636-V662 HydrophobicContact CE1-CG1 4.29Å; Y636-V662 HydrophobicContact CE1-CG2 4.26Å; G653-V662 PolarHBondContact N-O 3.46Å; G653-V662 PolarHBondContact O-N 3.17Å; V662-I664 HydrophobicContact CG2-CD1 4.15Å; V662-I664 HydrophobicContact CG2-CG1 4Å; V662-L697 HydrophobicContact CB-CD1 4.48Å; V662-L697 HydrophobicContact CG1-CD1 3.65Å; V662-V709 HydrophobicContact CB-CG1 3.86Å; V662-V709 HydrophobicContact CG1-CG1 4.24Å; V662-V709 HydrophobicContact CG2-CG1 4.03Å; V662-M710 WeakPolarHBondContact CA-O 3.22Å; V662-M710 WeakPolarHBondContact CB-O 3.27Å
663	A	95.5	Very high	90	Very high	10 Å²	10	56.4 Å²	56.4	8%	0.083	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	126.5	170.9	0	0	0	0	0	109.9	V709 M710 Y712	A663-V709 WeakPolarHBondContact O-CA 3.45Å; A663-M710 HydrophobicContact CB-CB 4.38Å; A663-M710 HydrophobicContact CB-CE 4.15Å; A663-M710 PolarHBondContact N-O 3.45Å; A663-M710 PolarHBondContact O-N 2.92Å; A663-Y712 HydrophobicContact CB-CD2 4.37Å
664	I	94.3	Very high	88.7	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	103.2	-175.7	-54.8	179.2	0	0	0	109.3	V650 Y651 V662 Q666 W707 V709	V650-I664 WeakPolarHBondContact CA-O 3.39Å; Y651-I664 PolarHBondContact N-O 2.89Å; Y651-I664 PolarHBondContact O-N 3.21Å; V662-I664 HydrophobicContact CG2-CD1 4.15Å; V662-I664 HydrophobicContact CG2-CG1 4Å; I664-Q666 HydrophobicContact CG2-CG 4.03Å; I664-W707 HydrophobicContact CG2-CD2 4.15Å; I664-W707 HydrophobicContact CG2-CE3 3.4Å; I664-W707 VanDerWaalsContact CG2-CE3 3.4Å; I664-W707 HydrophobicContact CG2-CZ3 3.87Å; I664-V709 HydrophobicContact CG1-CG1 4.39Å
665	K	90.9	Very high	87.9	Confident	6 Å²	6	56 Å²	56	3%	0.026	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	100.7	178.6	-170.2	173.6	-172.4	177.9	0	108.9	V650 M667 E681 V708 M710 D773	V650-K665 HydrophobicContact CG2-CG 4.29Å; K665-M667 HydrophobicContact CD-SD 4.26Å; K665-M667 HydrophobicContact CG-CG 4.07Å; K665-M667 HydrophobicContact CG-SD 4.07Å; K665-E681 IonicContact NZ-OE1 2.73Å; K665-E681 PolarHBondContact NZ-OE1 2.9Å; K665-V708 HydrophobicContact CB-CB 4.47Å; K665-V708 PolarHBondContact N-O 3.04Å; K665-V708 PolarHBondContact O-N 2.86Å; K665-M710 HydrophobicContact CB-CE 3.89Å; K665-M710 HydrophobicContact CD-CE 4.27Å; K665-D773 IonicContact NZ-OD1 3.16Å; K665-D773 PolarHBondContact NZ-OD1 3.29Å; K665-D773 IonicContact NZ-OD2 2.71Å; K665-D773 PolarHBondContact NZ-OD2 2.86Å
666	Q	91.4	Very high	87	Confident	38 Å²	38	56.9 Å²	56.9	18%	0.178	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	123.8	179.5	-58.9	-174	17.6	0	0	110.3	G648 V649 Y651 I664 W707	G648-Q666 CarbonylContact C-O 3.55Å; G648-Q666 VanDerWaalsContact CA-O 3.26Å; G648-Q666 WeakPolarHBondContact CA-O 3.18Å; V649-Q666 PolarHBondContact N-O 3.32Å; V649-Q666 PolarHBondContact O-N 3.47Å; Y651-Q666 HydrophobicContact CD2-CG 3.92Å; Y651-Q666 HydrophobicContact CE2-CB 4.32Å; Y651-Q666 HydrophobicContact CE2-CG 3.94Å; I664-Q666 HydrophobicContact CG2-CG 4.03Å; Q666-W707 VanDerWaalsContact CD-CZ2 3.46Å; Q666-W707 HydrophobicContact CG-CD2 3.8Å; Q666-W707 HydrophobicContact CG-CE3 4.28Å; Q666-W707 HydrophobicContact CG-CG 4.07Å; Q666-W707 HydrophobicContact CG-CZ2 4.19Å; Q666-W707 VanDerWaalsContact NE2-CH2 3.26Å; Q666-W707 VanDerWaalsContact NE2-CZ2 3.29Å
667	M	86.7	Confident	86	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	112.5	-166.5	-57.9	-174.7	-81.2	0	0	112.1	S647 K665 L669 I678 L706 V708	S647-M667 VanDerWaalsContact CB-SD 3.55Å; S647-M667 VanDerWaalsContact O-CA 3.31Å; S647-M667 WeakPolarHBondContact O-CA 3.41Å; S647-M667 WeakPolarHBondContact O-CB 3.19Å; S647-M667 VanDerWaalsContact O-CG 3.27Å; S647-M667 WeakPolarHBondContact O-CG 3.39Å; K665-M667 HydrophobicContact CD-SD 4.26Å; K665-M667 HydrophobicContact CG-CG 4.07Å; K665-M667 HydrophobicContact CG-SD 4.07Å; M667-L669 PolarHBondContact O-N 3.03Å; M667-L669 VanDerWaalsContact O-N 3.16Å; M667-I678 HydrophobicContact CE-CG2 4.09Å; M667-I678 HydrophobicContact SD-CG2 4.45Å; M667-L706 HydrophobicContact CB-CB 4.49Å; M667-L706 HydrophobicContact CE-CD2 3.92Å; M667-L706 HydrophobicContact CE-CG 4.1Å; M667-L706 PolarHBondContact N-O 2.85Å; M667-L706 PolarHBondContact O-N 2.61Å; M667-V708 HydrophobicContact CE-CB 4.06Å; M667-V708 HydrophobicContact CE-CG2 3.39Å
668	S	87.1	Confident	85.3	Confident	16 Å²	16	45.4 Å²	45.4	11%	0.112	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	102.1	178.6	-169.6	0	0	0	0	111.1	R670 Q671 Q672 E705	S668-R670 PolarHBondContact O-N 2.99Å; S668-R670 VanDerWaalsContact O-N 3.07Å; S668-Q671 PolarHBondContact O-N 2.84Å; S668-Q672 WeakPolarHBondContact O-CG 3.41Å; S668-Q672 PolarHBondContact O-N 2.9Å; S668-E705 WeakPolarHBondContact CA-OE1 3.45Å; S668-E705 WeakPolarHBondContact CA-OE2 3.39Å; S668-E705 WeakPolarHBondContact CB-OE1 3.34Å; S668-E705 WeakPolarHBondContact CB-OE2 3.4Å; S668-E705 PolarHBondContact N-OE2 2.7Å; S668-E705 PolarHBondContact OG-OE1 3.24Å
669	L	85.9	Confident	84.7	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-58	-29.1	-175.3	-65.6	-179.5	0	0	0	112.3	I620 L623 M667 Q671 Q672 K675 I678 L701 D704 L706	I620-L669 HydrophobicContact CG1-CD1 4.26Å; L623-L669 HydrophobicContact CD1-CD1 3.84Å; L623-L669 HydrophobicContact CD1-CD2 4.26Å; M667-L669 PolarHBondContact O-N 3.03Å; M667-L669 VanDerWaalsContact O-N 3.16Å; L669-Q671 PolarHBondContact O-N 3.17Å; L669-Q672 PolarHBondContact O-N 2.87Å; L669-K675 WeakPolarHBondContact O-CE 3.35Å; L669-I678 HydrophobicContact CD2-CD1 4.21Å; L669-L701 HydrophobicContact CD1-CD1 3.62Å; L669-D704 WeakPolarHBondContact CB-O 3.4Å; L669-D704 VanDerWaalsContact CG-O 3.29Å; L669-D704 WeakPolarHBondContact CG-O 3.49Å; L669-D704 PolarHBondContact N-O 3.21Å; L669-L706 HydrophobicContact CD1-CB 4.36Å; L669-L706 HydrophobicContact CD2-CB 4.02Å; L669-L706 HydrophobicContact CD2-CD2 3.87Å; L669-L706 HydrophobicContact CG-CB 4.04Å
670	R	84.2	Confident	83.9	Confident	192 Å²	192	43.5 Å²	43.5	73%	0.725	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-60.7	-31.6	175.1	-68.5	-176.7	-175.8	-178.1	6.6	113.5	S668 D704	S668-R670 PolarHBondContact O-N 2.99Å; S668-R670 VanDerWaalsContact O-N 3.07Å; R670-D704 HydrophobicContact CG-CB 3.96Å; R670-D704 IonicContact CZ-OD2 3.52Å; R670-D704 IonicContact NE-OD2 2.7Å; R670-D704 PolarHBondContact NE-OD2 2.9Å; R670-D704 IonicContact NH2-OD2 2.71Å; R670-D704 PolarHBondContact NH2-OD2 3.05Å
671	Q	78.4	Confident	83.1	Confident	151 Å²	151	40.4 Å²	40.4	71%	0.706	18%	0.184	S	C	*	.	G	3₁₀ helix	trans	-86.4	-14.3	-179.1	-55.6	-177	39.8	0	0	111.8	S668 L669 P673	S668-Q671 PolarHBondContact O-N 2.84Å; L669-Q671 PolarHBondContact O-N 3.17Å; Q671-P673 WeakPolarHBondContact O-CD 3.18Å
672	Q	72.7	Confident	82.4	Confident	19 Å²	19	35.6 Å²	35.6	9%	0.089	17%	0.165	C	C	.	.			trans	-86.1	113.3	-172.2	-67.8	-59.4	-33.5	0	0	111.7	A646 S647 S668 L669 R674 K675 I678	A646-Q672 PolarHBondContact O-NE2 3.43Å; S647-Q672 VanDerWaalsContact CA-NE2 3.31Å; S647-Q672 PolarHBondContact O-NE2 2.86Å; S668-Q672 WeakPolarHBondContact O-CG 3.41Å; S668-Q672 PolarHBondContact O-N 2.9Å; L669-Q672 PolarHBondContact O-N 2.87Å; Q672-R674 PolarHBondContact O-N 2.61Å; Q672-R674 VanDerWaalsContact O-N 3.16Å; Q672-K675 HydrophobicContact CB-CG 4.47Å; Q672-I678 HydrophobicContact CB-CD1 3.62Å; Q672-I678 HydrophobicContact CG-CD1 3.45Å; Q672-I678 VanDerWaalsContact CG-CD1 3.45Å
673	P	69.5	Low	81.8	Confident	62 Å²	62	39 Å²	39	40%	0.403	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-12.8	-170.7	34	-41.9	0	0	0	113.5	R128 Q129 Q671	R128-P673 HydrophobicContact CB-CB 4.09Å; R128-P673 HydrophobicContact CB-CG 3.91Å; R128-P673 WeakPolarHBondContact O-CD 3.35Å; R128-P673 WeakPolarHBondContact O-CG 3.25Å; Q129-P673 HydrophobicContact CG-CG 4.47Å; Q671-P673 WeakPolarHBondContact O-CD 3.18Å
674	R	70.7	Confident	81	Confident	86 Å²	86	38.8 Å²	38.8	33%	0.325	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-147.7	65.1	-169.3	-65.9	-163.6	66.8	179.4	-2.5	110.7	Q672 E676 L677	Q672-R674 PolarHBondContact O-N 2.61Å; Q672-R674 VanDerWaalsContact O-N 3.16Å; R674-E676 WeakPolarHBondContact CA-OE2 3.47Å; R674-E676 WeakPolarHBondContact CB-OE2 3.27Å; R674-E676 IonicContact CZ-OE1 3.7Å; R674-E676 IonicContact NE-OE1 3.44Å; R674-E676 PolarHBondContact NE-OE1 3.33Å; R674-E676 IonicContact NH2-OE1 3.72Å; R674-E676 PolarHBondContact NH2-OE1 2.86Å; R674-E676 PolarHBondContact O-N 2.98Å; R674-L677 HydrophobicContact CB-CD1 3.84Å; R674-L677 HydrophobicContact CB-CG 3.97Å; R674-L677 WeakPolarHBondContact O-CB 3.15Å; R674-L677 PolarHBondContact O-N 2.96Å
675	K	79.1	Confident	80.4	Confident	19 Å²	19	39.1 Å²	39.1	8%	0.083	18%	0.182	C	C	.	.	H	α-helix	trans	-54.1	-23.7	-179.3	-63.7	168.6	177.3	171.7	0	112.9	D616 I619 L669 Q672 L677 I678 L679	D616-K675 HydrophobicContact CB-CD 4.27Å; D616-K675 WeakPolarHBondContact OD2-CE 3.23Å; D616-K675 IonicContact OD2-NZ 2.67Å; D616-K675 PolarHBondContact OD2-NZ 2.89Å; I619-K675 HydrophobicContact CB-CB 4.42Å; I619-K675 HydrophobicContact CD1-CB 3.97Å; I619-K675 HydrophobicContact CG2-CB 3.77Å; L669-K675 WeakPolarHBondContact O-CE 3.35Å; Q672-K675 HydrophobicContact CB-CG 4.47Å; K675-L677 VanDerWaalsContact C-N 3.27Å; K675-L677 PolarHBondContact O-N 3.18Å; K675-I678 PolarHBondContact O-N 2.71Å; K675-L679 PolarHBondContact O-N 2.9Å
676	E	77.1	Confident	80.1	Confident	60 Å²	60	44.7 Å²	44.7	28%	0.28	20%	0.203	S	C	.	.	H	α-helix	trans	-68.8	-23.4	176.5	83.3	-74.2	-174.9	0	0	113.4	I619 R674 N680	I619-E676 HydrophobicContact CD1-CB 4.05Å; R674-E676 WeakPolarHBondContact CA-OE2 3.47Å; R674-E676 WeakPolarHBondContact CB-OE2 3.27Å; R674-E676 IonicContact CZ-OE1 3.7Å; R674-E676 IonicContact NE-OE1 3.44Å; R674-E676 PolarHBondContact NE-OE1 3.33Å; R674-E676 IonicContact NH2-OE1 3.72Å; R674-E676 PolarHBondContact NH2-OE1 2.86Å; R674-E676 PolarHBondContact O-N 2.98Å; E676-N680 PolarHBondContact O-N 2.91Å
677	L	75	Confident	79.7	Confident	20 Å²	20	47.1 Å²	47.1	11%	0.105	22%	0.221	C	C	.	.	H	α-helix	trans	-73.4	-37.8	173.6	-62.8	-179.4	0	0	0	111.6	R674 K675 N680 E681	R674-L677 HydrophobicContact CB-CD1 3.84Å; R674-L677 HydrophobicContact CB-CG 3.97Å; R674-L677 WeakPolarHBondContact O-CB 3.15Å; R674-L677 PolarHBondContact O-N 2.96Å; K675-L677 VanDerWaalsContact C-N 3.27Å; K675-L677 PolarHBondContact O-N 3.18Å; L677-N680 CarbonylContact O-C 3.14Å; L677-N680 WeakPolarHBondContact O-CA 3.49Å; L677-N680 WeakPolarHBondContact O-CB 3.45Å; L677-N680 PolarHBondContact O-N 3.17Å; L677-N680 VanDerWaalsContact O-N 3.13Å; L677-E681 PolarHBondContact O-N 3.42Å
678	I	79.5	Confident	79.5	Confident	5 Å²	5	49.1 Å²	49.1	3%	0.026	23%	0.229	C	C	.	.	H	α-helix	trans	-70.7	-38.7	-179.8	-59.3	171.1	0	0	0	110.9	M667 L669 Q672 K675 N680 E681 I682 L706	M667-I678 HydrophobicContact CE-CG2 4.09Å; M667-I678 HydrophobicContact SD-CG2 4.45Å; L669-I678 HydrophobicContact CD2-CD1 4.21Å; Q672-I678 HydrophobicContact CB-CD1 3.62Å; Q672-I678 HydrophobicContact CG-CD1 3.45Å; Q672-I678 VanDerWaalsContact CG-CD1 3.45Å; K675-I678 PolarHBondContact O-N 2.71Å; I678-N680 PolarHBondContact O-N 3.07Å; I678-E681 PolarHBondContact O-N 3.1Å; I678-I682 PolarHBondContact O-N 2.96Å; I678-L706 HydrophobicContact CG2-CD2 3.37Å
679	L	81.6	Confident	79.6	Confident	15 Å²	15	55.7 Å²	55.7	8%	0.079	25%	0.251	C	S	.	.	H	α-helix	trans	-59	-38.9	169.5	179.6	61.9	0	0	0	111.2	I619 R622 L623 I626 K675 L683	I619-L679 HydrophobicContact CG2-CB 4.28Å; I619-L679 HydrophobicContact CG2-CD2 4.29Å; R622-L679 HydrophobicContact CB-CD1 4.14Å; R622-L679 HydrophobicContact CB-CD2 3.92Å; L623-L679 HydrophobicContact CD2-CB 4.39Å; L623-L679 HydrophobicContact CD2-CD1 3.91Å; L623-L679 HydrophobicContact CG-CD1 4.25Å; I626-L679 HydrophobicContact CD1-CD1 3.45Å; I626-L679 VanDerWaalsContact CD1-CD1 3.45Å; K675-L679 PolarHBondContact O-N 2.9Å; L679-L683 HydrophobicContact CD1-CD1 4.09Å; L679-L683 HydrophobicContact CD1-CG 4.47Å; L679-L683 HydrophobicContact CG-CD1 4.07Å; L679-L683 WeakPolarHBondContact O-CB 3.37Å; L679-L683 WeakPolarHBondContact O-CD1 3.34Å; L679-L683 WeakPolarHBondContact O-CG 3.11Å; L679-L683 PolarHBondContact O-N 2.97Å; L679-L683 VanDerWaalsContact O-N 3.13Å
680	N	76.3	Confident	79.9	Confident	37 Å²	37	57.3 Å²	57.3	20%	0.198	26%	0.259	C	S	.	.	H	α-helix	trans	-70.4	-41	175.2	-178.5	107.7	0	0	0	112.5	E676 L677 I678 L683 V684	E676-N680 PolarHBondContact O-N 2.91Å; L677-N680 CarbonylContact O-C 3.14Å; L677-N680 WeakPolarHBondContact O-CA 3.49Å; L677-N680 WeakPolarHBondContact O-CB 3.45Å; L677-N680 PolarHBondContact O-N 3.17Å; L677-N680 VanDerWaalsContact O-N 3.13Å; I678-N680 PolarHBondContact O-N 3.07Å; N680-L683 PolarHBondContact O-N 3.14Å; N680-V684 WeakPolarHBondContact O-CB 3.38Å; N680-V684 VanDerWaalsContact O-CG2 3.28Å; N680-V684 WeakPolarHBondContact O-CG2 3.33Å; N680-V684 PolarHBondContact O-N 3.21Å
681	E	76.2	Confident	80.4	Confident	8 Å²	8	52.9 Å²	52.9	4%	0.037	26%	0.256	C	S	.	.	H	α-helix	trans	-56.1	-54.3	175.9	177.2	174.6	-173.1	0	0	110.7	K665 L677 I678 L683 V684 M685 F774 G775	K665-E681 IonicContact NZ-OE1 2.73Å; K665-E681 PolarHBondContact NZ-OE1 2.9Å; L677-E681 PolarHBondContact O-N 3.42Å; I678-E681 PolarHBondContact O-N 3.1Å; E681-L683 PolarHBondContact O-N 3.37Å; E681-V684 PolarHBondContact O-N 3.41Å; E681-M685 HydrophobicContact CG-SD 4.26Å; E681-M685 WeakPolarHBondContact O-CG 3.44Å; E681-M685 PolarHBondContact O-N 2.82Å; E681-F774 HydrophobicContact CG-CB 4.16Å; E681-G775 VanDerWaalsContact CD-CA 3.44Å; E681-G775 VanDerWaalsContact OE2-CA 3.25Å; E681-G775 WeakPolarHBondContact OE2-CA 3.3Å
682	I	81.9	Confident	81.3	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-61.3	-45.1	177.3	-66.7	174	0	0	0	111.5	L623 I626 I678 V684 R686 Y696 L706 V708	L623-I682 HydrophobicContact CD2-CD1 4.07Å; I626-I682 HydrophobicContact CG2-CG2 3.85Å; I678-I682 PolarHBondContact O-N 2.96Å; I682-V684 PolarHBondContact O-N 3.43Å; I682-R686 WeakPolarHBondContact O-CB 3.36Å; I682-R686 PolarHBondContact O-N 2.9Å; I682-Y696 HydrophobicContact CG2-CE2 4.2Å; I682-L706 HydrophobicContact CD1-CD1 4.03Å; I682-L706 HydrophobicContact CD1-CD2 3.84Å; I682-L706 HydrophobicContact CD1-CG 4.33Å; I682-V708 HydrophobicContact CD1-CG2 3.65Å; I682-V708 HydrophobicContact CG1-CG2 3.78Å
683	L	83.5	Confident	82.3	Confident	75 Å²	75	45.5 Å²	45.5	39%	0.393	22%	0.222	S	C	.	.	H	α-helix	trans	-63.9	-39.9	-179.8	-77	171	0	0	0	112.2	I626 L679 N680 E681 T687	I626-L683 HydrophobicContact CD1-CD1 4.4Å; I626-L683 HydrophobicContact CD1-CD2 3.74Å; I626-L683 HydrophobicContact CD1-CG 4.07Å; I626-L683 HydrophobicContact CG1-CD2 4.43Å; L679-L683 HydrophobicContact CD1-CD1 4.09Å; L679-L683 HydrophobicContact CD1-CG 4.47Å; L679-L683 HydrophobicContact CG-CD1 4.07Å; L679-L683 WeakPolarHBondContact O-CB 3.37Å; L679-L683 WeakPolarHBondContact O-CD1 3.34Å; L679-L683 WeakPolarHBondContact O-CG 3.11Å; L679-L683 PolarHBondContact O-N 2.97Å; L679-L683 VanDerWaalsContact O-N 3.13Å; N680-L683 PolarHBondContact O-N 3.14Å; E681-L683 PolarHBondContact O-N 3.37Å; L683-T687 VanDerWaalsContact O-CB 3.23Å; L683-T687 WeakPolarHBondContact O-CB 3.11Å; L683-T687 PolarHBondContact O-N 2.83Å; L683-T687 VanDerWaalsContact O-N 3.11Å; L683-T687 PolarHBondContact O-OG1 3.08Å
684	V	79.8	Confident	83.4	Confident	5 Å²	5	42.7 Å²	42.7	3%	0.03	20%	0.204	C	C	.	.	H	α-helix	trans	-64.4	-54.4	176	165.6	0	0	0	0	110.4	N680 E681 I682 R686 T687 Y688 V751 F774	N680-V684 WeakPolarHBondContact O-CB 3.38Å; N680-V684 VanDerWaalsContact O-CG2 3.28Å; N680-V684 WeakPolarHBondContact O-CG2 3.33Å; N680-V684 PolarHBondContact O-N 3.21Å; E681-V684 PolarHBondContact O-N 3.41Å; I682-V684 PolarHBondContact O-N 3.43Å; V684-R686 VanDerWaalsContact C-N 3.35Å; V684-R686 PolarHBondContact O-N 3.04Å; V684-T687 PolarHBondContact O-N 3.39Å; V684-Y688 HydrophobicContact CG1-CD2 4.24Å; V684-Y688 WeakPolarHBondContact O-CB 3.38Å; V684-Y688 PolarHBondContact O-N 3.28Å; V684-V751 HydrophobicContact CG1-CG1 4.27Å; V684-V751 HydrophobicContact CG2-CG2 4.45Å; V684-F774 HydrophobicContact CG1-CD1 3.61Å; V684-F774 HydrophobicContact CG1-CE1 4.28Å; V684-F774 HydrophobicContact CG1-CG 4.34Å
685	M	80.4	Confident	84.4	Confident	6 Å²	6	40.9 Å²	40.9	3%	0.03	20%	0.2	C	C	.	.	H	α-helix	trans	-65.9	-35	-176.1	-62.4	178.9	73.6	0	0	113.1	E681 V694 M710 F774	E681-M685 HydrophobicContact CG-SD 4.26Å; E681-M685 WeakPolarHBondContact O-CG 3.44Å; E681-M685 PolarHBondContact O-N 2.82Å; M685-V694 WeakPolarHBondContact CE-O 3.48Å; M685-M710 HydrophobicContact CE-CG 4.27Å; M685-M710 HydrophobicContact CE-SD 3.82Å; M685-F774 HydrophobicContact CE-CD2 4.03Å; M685-F774 HydrophobicContact CE-CE2 4.47Å; M685-F774 HydrophobicContact CG-CB 3.86Å; M685-F774 HydrophobicContact CG-CD1 4.46Å; M685-F774 HydrophobicContact CG-CD2 3.54Å; M685-F774 HydrophobicContact CG-CE2 4.31Å; M685-F774 HydrophobicContact CG-CG 3.67Å; M685-F774 HydrophobicContact SD-CB 4.11Å; M685-F774 HydrophobicContact SD-CD2 3.73Å; M685-F774 HydrophobicContact SD-CG 4.2Å
686	R	85	Confident	85	Confident	124 Å²	124	40.5 Å²	40.5	47%	0.468	20%	0.198	S	C	.	.	H	α-helix	trans	-71.7	-34.1	176.1	179.8	173.6	172.8	155.4	-7.6	113.2	I626 I682 V684 Y696	I626-R686 PolarHBondContact O-NH1 3.22Å; I682-R686 WeakPolarHBondContact O-CB 3.36Å; I682-R686 PolarHBondContact O-N 2.9Å; V684-R686 VanDerWaalsContact C-N 3.35Å; V684-R686 PolarHBondContact O-N 3.04Å; R686-Y696 HydrophobicContact CB-CD1 3.83Å; R686-Y696 HydrophobicContact CB-CE1 3.8Å; R686-Y696 HydrophobicContact CB-CG 4.41Å; R686-Y696 HydrophobicContact CG-CD1 4.12Å; R686-Y696 HydrophobicContact CG-CE1 3.79Å
687	T	84.1	Confident	85.7	Confident	88 Å²	88	40.5 Å²	40.5	54%	0.54	20%	0.2	S	C	.	.	H	α-helix	trans	-83.6	-33.3	-177.6	-51.5	0	0	0	0	111.9	L683 V684	L683-T687 VanDerWaalsContact O-CB 3.23Å; L683-T687 WeakPolarHBondContact O-CB 3.11Å; L683-T687 PolarHBondContact O-N 2.83Å; L683-T687 VanDerWaalsContact O-N 3.11Å; L683-T687 PolarHBondContact O-OG1 3.08Å; V684-T687 PolarHBondContact O-N 3.39Å
688	Y	82.3	Confident	86.6	Confident	43 Å²	43	40 Å²	40	17%	0.169	20%	0.198	C	C	.	.			trans	-120.7	77	-166.5	-58.4	-50.8	0	0	0	112.5	V684 F745 K749 V751	V684-Y688 HydrophobicContact CG1-CD2 4.24Å; V684-Y688 WeakPolarHBondContact O-CB 3.38Å; V684-Y688 PolarHBondContact O-N 3.28Å; Y688-F745 HydrophobicContact CD1-CZ 4.44Å; Y688-F745 HydrophobicContact CG-CZ 4.49Å; Y688-K749 HydrophobicContact CD1-CB 4.36Å; Y688-K749 HydrophobicContact CD1-CD 4.48Å; Y688-K749 HydrophobicContact CD1-CG 3.95Å; Y688-K749 HydrophobicContact CE1-CB 3.92Å; Y688-K749 HydrophobicContact CE1-CD 3.92Å; Y688-K749 HydrophobicContact CE1-CG 3.71Å; Y688-K749 HydrophobicContact CE2-CB 4.2Å; Y688-V751 HydrophobicContact CD2-CG2 4.35Å; Y688-V751 HydrophobicContact CE2-CG2 4.02Å
689	R	87.5	Confident	87.3	Confident	153 Å²	153	39.8 Å²	39.8	58%	0.577	20%	0.196	S	C	*	.			trans	-74.8	137.6	168.5	-73.8	179.9	164.7	159.6	-0.4	111.3	N695 Y696 F745	R689-N695 PolarHBondContact NE-OD1 3.02Å; R689-Y696 PolarHBondContact NH2-O 2.87Å; R689-F745 WeakPolarHBondContact O-CZ 3.48Å
690	N	92.4	Very high	87.9	Confident	34 Å²	34	39.7 Å²	39.7	18%	0.182	20%	0.195	C	C	.	.			trans	-153.4	147.5	176.7	171.2	-82.1	0	0	0	108.9	N692 V693 F745	N690-N692 PolarHBondContact O-N 3.17Å; N690-N692 WeakPolarHBondContact OD1-CA 3.31Å; N690-N692 WeakPolarHBondContact OD1-CB 3.3Å; N690-N692 PolarHBondContact OD1-N 2.89Å; N690-V693 HydrophobicContact CB-CB 4.14Å; N690-V693 HydrophobicContact CB-CG2 4.02Å; N690-V693 PolarHBondContact O-N 2.75Å; N690-V693 VanDerWaalsContact O-N 3.1Å; N690-V693 VanDerWaalsContact O-O 3.14Å; N690-F745 HydrophobicContact CB-CD1 3.47Å; N690-F745 VanDerWaalsContact CB-CD1 3.47Å; N690-F745 HydrophobicContact CB-CE1 3.48Å; N690-F745 VanDerWaalsContact CB-CE1 3.48Å; N690-F745 HydrophobicContact CB-CG 4Å; N690-F745 HydrophobicContact CB-CZ 4.04Å
691	P	95.2	Very high	88.8	Confident	100 Å²	100	39.5 Å²	39.5	65%	0.649	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-30.8	-177	-26.7	36.3	0	0	0	114.8	K770	P691-K770 WeakPolarHBondContact O-CD 3.18Å; P691-K770 VanDerWaalsContact O-CE 3.25Å; P691-K770 WeakPolarHBondContact O-CE 3.4Å
692	N	96.6	Very high	89.5	Confident	11 Å²	11	42.3 Å²	42.3	6%	0.059	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	19.7	-177.7	-49.4	97.6	0	0	0	112.2	N690 E738 Q741 A742 V769 K770 L771	N690-N692 PolarHBondContact O-N 3.17Å; N690-N692 WeakPolarHBondContact OD1-CA 3.31Å; N690-N692 WeakPolarHBondContact OD1-CB 3.3Å; N690-N692 PolarHBondContact OD1-N 2.89Å; N692-E738 WeakPolarHBondContact CB-O 3.41Å; N692-E738 WeakPolarHBondContact ND2-CB 3.43Å; N692-E738 PolarHBondContact ND2-OE2 2.74Å; N692-Q741 PolarHBondContact ND2-OE1 3.19Å; N692-Q741 WeakPolarHBondContact OD1-CB 3.3Å; N692-Q741 PolarHBondContact OD1-OE1 2.98Å; N692-Q741 VanDerWaalsContact OD1-OE1 3.06Å; N692-A742 HydrophobicContact CB-CB 3.91Å; N692-A742 WeakPolarHBondContact O-CB 3.18Å; N692-V769 PolarHBondContact ND2-O 2.95Å; N692-K770 WeakPolarHBondContact O-CA 3.43Å; N692-L771 PolarHBondContact O-N 3.11Å
693	V	93.8	Very high	89.8	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.024	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-127.4	132.8	175.8	167.2	0	0	0	0	108.3	N690 N695 A742 F774	N690-V693 HydrophobicContact CB-CB 4.14Å; N690-V693 HydrophobicContact CB-CG2 4.02Å; N690-V693 PolarHBondContact O-N 2.75Å; N690-V693 VanDerWaalsContact O-N 3.1Å; N690-V693 VanDerWaalsContact O-O 3.14Å; V693-N695 PolarHBondContact O-N 3.03Å; V693-N695 VanDerWaalsContact O-N 3.12Å; V693-A742 HydrophobicContact CG2-CB 4.09Å; V693-F774 HydrophobicContact CB-CZ 4.33Å; V693-F774 HydrophobicContact CG1-CE1 4.39Å; V693-F774 HydrophobicContact CG1-CE2 3.69Å; V693-F774 HydrophobicContact CG1-CZ 3.43Å; V693-F774 VanDerWaalsContact CG1-CZ 3.43Å; V693-F774 HydrophobicContact CG2-CZ 4.05Å
694	V	93.3	Very high	90	Very high	3 Å²	3	43 Å²	43	2%	0.018	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-59.3	117.7	179.5	174.4	0	0	0	0	110.4	M685 Y696 M710 E711 L713 L762 K770 L771	M685-V694 WeakPolarHBondContact CE-O 3.48Å; V694-Y696 PolarHBondContact O-N 3.2Å; V694-M710 HydrophobicContact CG1-CB 4.04Å; V694-E711 HydrophobicContact CG1-CG 3.98Å; V694-L713 HydrophobicContact CG2-CD1 3.83Å; V694-L762 HydrophobicContact CG2-CD1 4.32Å; V694-K770 HydrophobicContact CG2-CB 3.85Å; V694-L771 PolarHBondContact N-O 2.86Å
695	N	91.9	Very high	90.5	Very high	47 Å²	47	46.1 Å²	46.1	25%	0.251	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-69.2	119.6	-171.9	-175.9	23.9	0	0	0	112.1	R689 V693 L697 M710 E711	R689-N695 PolarHBondContact NE-OD1 3.02Å; V693-N695 PolarHBondContact O-N 3.03Å; V693-N695 VanDerWaalsContact O-N 3.12Å; N695-L697 PolarHBondContact O-N 3.21Å; N695-M710 WeakPolarHBondContact O-CA 3.45Å; N695-E711 HydrophobicContact CB-CB 4.46Å; N695-E711 HydrophobicContact CB-CG 4.04Å; N695-E711 WeakPolarHBondContact CB-OE1 3.5Å; N695-E711 PolarHBondContact N-OE1 3.12Å; N695-E711 PolarHBondContact O-N 3.47Å
696	Y	91.9	Very high	91	Very high	11 Å²	11	45.9 Å²	45.9	4%	0.043	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	126.5	166.3	167.4	-88.6	0	0	0	110.5	I682 R686 R689 V694 D698 S699 V708	I682-Y696 HydrophobicContact CG2-CE2 4.2Å; R686-Y696 HydrophobicContact CB-CD1 3.83Å; R686-Y696 HydrophobicContact CB-CE1 3.8Å; R686-Y696 HydrophobicContact CB-CG 4.41Å; R686-Y696 HydrophobicContact CG-CD1 4.12Å; R686-Y696 HydrophobicContact CG-CE1 3.79Å; R689-Y696 PolarHBondContact NH2-O 2.87Å; V694-Y696 PolarHBondContact O-N 3.2Å; Y696-D698 WeakPolarHBondContact CE2-O 3.41Å; Y696-S699 PolarHBondContact OH-N 2.96Å; Y696-S699 PolarHBondContact OH-OG 3.39Å; Y696-V708 HydrophobicContact CD2-CG1 4.05Å; Y696-V708 HydrophobicContact CE2-CG1 4.26Å
697	L	92.4	Very high	91.4	Very high	61 Å²	61	41.7 Å²	41.7	32%	0.319	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-48.7	177.9	-56.7	-179	0	0	0	111.4	V662 N695 V709	V662-L697 HydrophobicContact CB-CD1 4.48Å; V662-L697 HydrophobicContact CG1-CD1 3.65Å; N695-L697 PolarHBondContact O-N 3.21Å; L697-V709 HydrophobicContact CB-CG1 4.43Å; L697-V709 HydrophobicContact CD1-CG1 4.46Å; L697-V709 PolarHBondContact N-O 3.07Å
698	D	93.4	Very high	91.8	Very high	10 Å²	10	37.8 Å²	37.8	5%	0.053	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	167.3	-166.4	-138.3	-34.9	0	0	0	112.4	S628 K635 Y636 Y696 Y700 V709	S628-D698 WeakPolarHBondContact CB-OD1 3.44Å; S628-D698 PolarHBondContact OG-OD1 3.16Å; K635-D698 IonicContact NZ-OD2 2.85Å; K635-D698 PolarHBondContact NZ-OD2 3.23Å; Y636-D698 HydrophobicContact CE2-CB 4.48Å; Y636-D698 WeakPolarHBondContact OH-CB 3.3Å; Y636-D698 PolarHBondContact OH-OD2 2.67Å; Y696-D698 WeakPolarHBondContact CE2-O 3.41Å; D698-Y700 HydrophobicContact CB-CE2 4.02Å; D698-Y700 PolarHBondContact OD2-OH 3.08Å; D698-Y700 VanDerWaalsContact OD2-OH 3.09Å; D698-V709 HydrophobicContact CB-CB 3.9Å; D698-V709 HydrophobicContact CB-CG2 4.18Å; D698-V709 PolarHBondContact N-O 3.02Å; D698-V709 VanDerWaalsContact N-O 3.12Å; D698-V709 PolarHBondContact O-N 2.84Å
699	S	94	Very high	92.3	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	149.8	165.6	53.8	0	0	0	0	113	V627 S628 Y696 W707	V627-S699 CarbonylContact C-O 3.46Å; V627-S699 WeakPolarHBondContact CA-O 3.03Å; V627-S699 WeakPolarHBondContact CB-O 3.43Å; S628-S699 WeakPolarHBondContact CB-O 3.21Å; S628-S699 PolarHBondContact N-O 3.33Å; Y696-S699 PolarHBondContact OH-N 2.96Å; Y696-S699 PolarHBondContact OH-OG 3.39Å; S699-W707 CarbonylContact C-O 3.58Å; S699-W707 WeakPolarHBondContact CA-O 3.43Å; S699-W707 WeakPolarHBondContact CB-O 3.46Å
700	Y	94.9	Very high	92.6	Very high	13 Å²	13	29 Å²	29	5%	0.051	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	149.6	-174.7	-62.5	-98.5	0	0	0	110.9	P632 Y636 D698 W707	P632-Y700 HydrophobicContact CB-CD2 3.86Å; P632-Y700 HydrophobicContact CB-CE2 4.2Å; P632-Y700 HydrophobicContact CB-CG 4.07Å; P632-Y700 HydrophobicContact CG-CD2 4.48Å; P632-Y700 HydrophobicContact CG-CG 4.29Å; Y636-Y700 HydrophobicContact CD2-CE2 4.43Å; Y636-Y700 AromaticContact CE2-CE2 3.82Å; Y636-Y700 HydrophobicContact CE2-CE2 3.82Å; D698-Y700 HydrophobicContact CB-CE2 4.02Å; D698-Y700 PolarHBondContact OD2-OH 3.08Å; D698-Y700 VanDerWaalsContact OD2-OH 3.09Å; Y700-W707 PolarHBondContact N-O 2.84Å; Y700-W707 PolarHBondContact O-N 2.9Å
701	L	93.5	Very high	92.7	Very high	33 Å²	33	29.2 Å²	29.2	17%	0.173	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	110.6	176.9	-178.5	64.8	0	0	0	111.9	I620 L623 R624 V627 L669 L706	I620-L701 HydrophobicContact CG2-CD2 4.31Å; L623-L701 HydrophobicContact CB-CD2 4.34Å; R624-L701 HydrophobicContact CG-CD2 3.7Å; V627-L701 HydrophobicContact CG1-CB 4.28Å; V627-L701 HydrophobicContact CG2-CB 3.88Å; L669-L701 HydrophobicContact CD1-CD1 3.62Å; L701-L706 HydrophobicContact CD1-CB 4.06Å; L701-L706 HydrophobicContact CD1-CD1 4.46Å
702	L	91.2	Very high	92.7	Very high	66 Å²	66	27 Å²	27	35%	0.346	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	87.3	-177	-68.4	86.9	0	0	0	109.5	P632 D704 E705 W707	P632-L702 HydrophobicContact CG-CD1 4Å; L702-D704 PolarHBondContact O-N 3.39Å; L702-E705 PolarHBondContact N-O 2.98Å; L702-E705 PolarHBondContact O-N 2.85Å; L702-W707 HydrophobicContact CD1-CG 4.49Å
703	G	88.6	Confident	92.7	Very high	51 Å²	51	27.1 Å²	27.1	53%	0.526	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	-96.2	-174.8	0	0	0	0	0	111.2
704	D	87.2	Confident	92.6	Very high	41 Å²	41	28.4 Å²	28.4	22%	0.219	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.8	-4.3	174.9	-70.9	-66.2	0	0	0	113.2	L669 R670 L702	L669-D704 WeakPolarHBondContact CB-O 3.4Å; L669-D704 VanDerWaalsContact CG-O 3.29Å; L669-D704 WeakPolarHBondContact CG-O 3.49Å; L669-D704 PolarHBondContact N-O 3.21Å; R670-D704 HydrophobicContact CG-CB 3.96Å; R670-D704 IonicContact CZ-OD2 3.52Å; R670-D704 IonicContact NE-OD2 2.7Å; R670-D704 PolarHBondContact NE-OD2 2.9Å; R670-D704 IonicContact NH2-OD2 2.71Å; R670-D704 PolarHBondContact NH2-OD2 3.05Å; L702-D704 PolarHBondContact O-N 3.39Å
705	E	90.5	Very high	92.6	Very high	70 Å²	70	28.4 Å²	28.4	33%	0.327	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	117.7	177.5	-61	-54.2	128.2	0	0	110.3	S668 L702	S668-E705 WeakPolarHBondContact CA-OE1 3.45Å; S668-E705 WeakPolarHBondContact CA-OE2 3.39Å; S668-E705 WeakPolarHBondContact CB-OE1 3.34Å; S668-E705 WeakPolarHBondContact CB-OE2 3.4Å; S668-E705 PolarHBondContact N-OE2 2.7Å; S668-E705 PolarHBondContact OG-OE1 3.24Å; L702-E705 PolarHBondContact N-O 2.98Å; L702-E705 PolarHBondContact O-N 2.85Å
706	L	91.5	Very high	92.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	123.4	179	173.5	66.8	0	0	0	109.6	L623 V627 M667 L669 I678 I682 L701	L623-L706 HydrophobicContact CD1-CD2 4.36Å; L623-L706 HydrophobicContact CD2-CD2 4.29Å; V627-L706 HydrophobicContact CG1-CD1 3.82Å; M667-L706 HydrophobicContact CB-CB 4.49Å; M667-L706 HydrophobicContact CE-CD2 3.92Å; M667-L706 HydrophobicContact CE-CG 4.1Å; M667-L706 PolarHBondContact N-O 2.85Å; M667-L706 PolarHBondContact O-N 2.61Å; L669-L706 HydrophobicContact CD1-CB 4.36Å; L669-L706 HydrophobicContact CD2-CB 4.02Å; L669-L706 HydrophobicContact CD2-CD2 3.87Å; L669-L706 HydrophobicContact CG-CB 4.04Å; I678-L706 HydrophobicContact CG2-CD2 3.37Å; I682-L706 HydrophobicContact CD1-CD1 4.03Å; I682-L706 HydrophobicContact CD1-CD2 3.84Å; I682-L706 HydrophobicContact CD1-CG 4.33Å; L701-L706 HydrophobicContact CD1-CB 4.06Å; L701-L706 HydrophobicContact CD1-CD1 4.46Å
707	W	93.1	Very high	92.8	Very high	37 Å²	37	27.3 Å²	27.3	14%	0.14	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	131.3	175.2	-68.7	38.3	0	0	0	108.7	P632 I664 Q666 S699 Y700 L702	P632-W707 HydrophobicContact CB-CD2 4.22Å; P632-W707 HydrophobicContact CB-CE3 3.5Å; P632-W707 VanDerWaalsContact CB-CE3 3.5Å; P632-W707 HydrophobicContact CB-CZ3 3.76Å; P632-W707 HydrophobicContact CG-CD2 3.55Å; P632-W707 HydrophobicContact CG-CE3 3.28Å; P632-W707 HydrophobicContact CG-CG 4.2Å; P632-W707 HydrophobicContact CG-CH2 4.04Å; P632-W707 HydrophobicContact CG-CZ2 4.27Å; P632-W707 HydrophobicContact CG-CZ3 3.55Å; I664-W707 HydrophobicContact CG2-CD2 4.15Å; I664-W707 HydrophobicContact CG2-CE3 3.4Å; I664-W707 VanDerWaalsContact CG2-CE3 3.4Å; I664-W707 HydrophobicContact CG2-CZ3 3.87Å; Q666-W707 VanDerWaalsContact CD-CZ2 3.46Å; Q666-W707 HydrophobicContact CG-CD2 3.8Å; Q666-W707 HydrophobicContact CG-CE3 4.28Å; Q666-W707 HydrophobicContact CG-CG 4.07Å; Q666-W707 HydrophobicContact CG-CZ2 4.19Å; Q666-W707 VanDerWaalsContact NE2-CH2 3.26Å; Q666-W707 VanDerWaalsContact NE2-CZ2 3.29Å; S699-W707 CarbonylContact C-O 3.58Å; S699-W707 WeakPolarHBondContact CA-O 3.43Å; S699-W707 WeakPolarHBondContact CB-O 3.46Å; Y700-W707 PolarHBondContact N-O 2.84Å; Y700-W707 PolarHBondContact O-N 2.9Å; L702-W707 HydrophobicContact CD1-CG 4.49Å
708	V	92	Very high	93.1	Very high	6 Å²	6	24.4 Å²	24.4	4%	0.036	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	127.8	169.3	174.4	0	0	0	0	108.4	K665 M667 I682 Y696 M710	K665-V708 HydrophobicContact CB-CB 4.47Å; K665-V708 PolarHBondContact N-O 3.04Å; K665-V708 PolarHBondContact O-N 2.86Å; M667-V708 HydrophobicContact CE-CB 4.06Å; M667-V708 HydrophobicContact CE-CG2 3.39Å; I682-V708 HydrophobicContact CD1-CG2 3.65Å; I682-V708 HydrophobicContact CG1-CG2 3.78Å; Y696-V708 HydrophobicContact CD2-CG1 4.05Å; Y696-V708 HydrophobicContact CE2-CG1 4.26Å; V708-M710 HydrophobicContact CG1-CG 4.08Å; V708-M710 HydrophobicContact CG1-SD 4.34Å
709	V	94.3	Very high	93.1	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	129.9	-177.5	-169.9	0	0	0	0	109.1	Y636 V662 A663 I664 L697 D698	Y636-V709 HydrophobicContact CD1-CG1 4.34Å; Y636-V709 HydrophobicContact CD2-CG2 4.41Å; Y636-V709 HydrophobicContact CE1-CG1 3.84Å; Y636-V709 HydrophobicContact CE2-CG1 4.39Å; Y636-V709 HydrophobicContact CE2-CG2 4.07Å; V662-V709 HydrophobicContact CB-CG1 3.86Å; V662-V709 HydrophobicContact CG1-CG1 4.24Å; V662-V709 HydrophobicContact CG2-CG1 4.03Å; A663-V709 WeakPolarHBondContact O-CA 3.45Å; I664-V709 HydrophobicContact CG1-CG1 4.39Å; L697-V709 HydrophobicContact CB-CG1 4.43Å; L697-V709 HydrophobicContact CD1-CG1 4.46Å; L697-V709 PolarHBondContact N-O 3.07Å; D698-V709 HydrophobicContact CB-CB 3.9Å; D698-V709 HydrophobicContact CB-CG2 4.18Å; D698-V709 PolarHBondContact N-O 3.02Å; D698-V709 VanDerWaalsContact N-O 3.12Å; D698-V709 PolarHBondContact O-N 2.84Å
710	M	93.8	Very high	93.1	Very high	10 Å²	10	28.2 Å²	28.2	5%	0.049	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	164.7	-173.4	-58.2	168.8	-62.7	0	0	109.3	V662 A663 K665 M685 V694 N695 V708	V662-M710 WeakPolarHBondContact CA-O 3.22Å; V662-M710 WeakPolarHBondContact CB-O 3.27Å; A663-M710 HydrophobicContact CB-CB 4.38Å; A663-M710 HydrophobicContact CB-CE 4.15Å; A663-M710 PolarHBondContact N-O 3.45Å; A663-M710 PolarHBondContact O-N 2.92Å; K665-M710 HydrophobicContact CB-CE 3.89Å; K665-M710 HydrophobicContact CD-CE 4.27Å; M685-M710 HydrophobicContact CE-CG 4.27Å; M685-M710 HydrophobicContact CE-SD 3.82Å; V694-M710 HydrophobicContact CG1-CB 4.04Å; N695-M710 WeakPolarHBondContact O-CA 3.45Å; V708-M710 HydrophobicContact CG1-CG 4.08Å; V708-M710 HydrophobicContact CG1-SD 4.34Å
711	E	94.4	Very high	93.1	Very high	39 Å²	39	27.8 Å²	27.8	18%	0.182	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58	147.4	165.8	66.4	-179.9	138.2	0	0	111	V694 N695 K770	V694-E711 HydrophobicContact CG1-CG 3.98Å; N695-E711 HydrophobicContact CB-CB 4.46Å; N695-E711 HydrophobicContact CB-CG 4.04Å; N695-E711 WeakPolarHBondContact CB-OE1 3.5Å; N695-E711 PolarHBondContact N-OE1 3.12Å; N695-E711 PolarHBondContact O-N 3.47Å; E711-K770 WeakPolarHBondContact OE1-CD 3.28Å; E711-K770 IonicContact OE1-NZ 2.79Å; E711-K770 PolarHBondContact OE1-NZ 3.04Å; E711-K770 IonicContact OE2-NZ 3.46Å; E711-K770 PolarHBondContact OE2-NZ 3.21Å
712	Y	95.3	Very high	93.3	Very high	53 Å²	53	27 Å²	27	21%	0.208	15%	0.153	C	C	.	.			trans	-94.2	145.4	168.6	-175.4	-117.9	0	0	0	109.9	I642 I652 R661 A663 D714	I642-Y712 HydrophobicContact CD1-CD2 4.08Å; I642-Y712 HydrophobicContact CD1-CE2 3.62Å; I652-Y712 HydrophobicContact CD1-CD1 3.9Å; I652-Y712 HydrophobicContact CD1-CE1 3.55Å; I652-Y712 HydrophobicContact CD1-CE2 4.38Å; I652-Y712 HydrophobicContact CD1-CG 4.42Å; I652-Y712 HydrophobicContact CG1-CD1 4.38Å; I652-Y712 HydrophobicContact CG1-CE1 4.38Å; I652-Y712 HydrophobicContact CG1-CG 4.44Å; R661-Y712 HydrophobicContact CB-CD1 3.95Å; R661-Y712 HydrophobicContact CB-CG 4.37Å; A663-Y712 HydrophobicContact CB-CD2 4.37Å; Y712-D714 HydrophobicContact CD1-CB 4.49Å; Y712-D714 HydrophobicContact CE1-CB 4.16Å; Y712-D714 VanDerWaalsContact CE1-OD1 3.25Å; Y712-D714 WeakPolarHBondContact CE1-OD1 3.3Å
713	L	95.2	Very high	93.3	Very high	15 Å²	15	28 Å²	28	8%	0.079	16%	0.162	C	C	.	.			trans	-120.8	99.7	178.8	-75.5	167.1	0	0	0	108.3	V694 G715 L762 L763 K770	V694-L713 HydrophobicContact CG2-CD1 3.83Å; L713-G715 PolarHBondContact O-N 3.3Å; L713-L762 HydrophobicContact CB-CB 4.3Å; L713-L762 HydrophobicContact CD1-CB 3.45Å; L713-L762 VanDerWaalsContact CD1-CB 3.45Å; L713-L762 HydrophobicContact CD1-CD1 4.3Å; L713-L763 WeakPolarHBondContact CB-O 3.23Å; L713-K770 HydrophobicContact CD1-CB 4Å; L713-K770 HydrophobicContact CD1-CD 4.13Å; L713-K770 HydrophobicContact CD1-CG 4.25Å; L713-K770 HydrophobicContact CD2-CD 4.26Å
714	D	92.5	Very high	93.5	Very high	31 Å²	31	28.6 Å²	28.6	17%	0.166	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-2.1	-173.3	-66.7	-96.1	0	0	0	114.9	R661 Y712 L765 R906	R661-D714 WeakPolarHBondContact CD-OD1 3.44Å; R661-D714 IonicContact CZ-OD1 3.17Å; R661-D714 IonicContact NE-OD1 2.7Å; R661-D714 IonicContact NH1-OD1 3.5Å; R661-D714 PolarHBondContact NH1-OD1 2.9Å; Y712-D714 HydrophobicContact CD1-CB 4.49Å; Y712-D714 HydrophobicContact CE1-CB 4.16Å; Y712-D714 VanDerWaalsContact CE1-OD1 3.25Å; Y712-D714 WeakPolarHBondContact CE1-OD1 3.3Å; D714-L765 HydrophobicContact CB-CD1 3.58Å; D714-L765 HydrophobicContact CB-CG 3.79Å; D714-R906 PolarHBondContact O-NE 3.49Å; D714-R906 PolarHBondContact O-NH1 2.89Å
715	G	93.7	Very high	93.8	Very high	3 Å²	3	27.5 Å²	27.5	3%	0.031	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-26.2	179.5	0	0	0	0	0	114.6	L713 L763 R906	L713-G715 PolarHBondContact O-N 3.3Å; G715-L763 CarbonylContact C-O 3.59Å; G715-L763 WeakPolarHBondContact CA-O 3.49Å; G715-L763 PolarHBondContact N-O 2.63Å; G715-R906 WeakPolarHBondContact O-CD 3.18Å
716	G	93.1	Very high	93.9	Very high	19 Å²	19	30.1 Å²	30.1	20%	0.196	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	104.6	-156.1	-175.6	0	0	0	0	0	113	L762 L763	G716-L762 WeakPolarHBondContact O-CA 3.5Å; G716-L763 PolarHBondContact N-O 2.76Å; G716-L763 PolarHBondContact O-N 3.21Å
717	S	94.8	Very high	94.1	Very high	16 Å²	16	31.2 Å²	31.2	11%	0.112	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	168.6	173.6	71.7	0	0	0	0	111.8	T719 D720 I761	S717-T719 VanDerWaalsContact C-N 3.28Å; S717-T719 WeakPolarHBondContact OG-CB 3.41Å; S717-T719 PolarHBondContact OG-N 3.19Å; S717-D720 WeakPolarHBondContact CA-OD2 3.39Å; S717-D720 WeakPolarHBondContact CB-OD2 3.37Å; S717-D720 PolarHBondContact N-OD2 3.09Å; S717-D720 PolarHBondContact OG-N 2.84Å; S717-D720 PolarHBondContact OG-OD2 2.94Å; S717-I761 CarbonylContact C-O 3.44Å; S717-I761 WeakPolarHBondContact CA-O 3.43Å
718	L	97.3	Very high	94.2	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-69.3	-29.3	168	-176.9	66.1	0	0	0	111.6	D720 V721 I722 M727 V735 I761 L763 M821 M825	L718-D720 VanDerWaalsContact C-N 3.33Å; L718-D720 PolarHBondContact O-N 3.07Å; L718-V721 PolarHBondContact O-N 3.14Å; L718-V721 VanDerWaalsContact O-N 3.08Å; L718-I722 HydrophobicContact CD2-CD1 4.23Å; L718-I722 HydrophobicContact CG-CD1 3.87Å; L718-I722 HydrophobicContact CG-CG1 4.25Å; L718-I722 WeakPolarHBondContact O-CG1 3.42Å; L718-I722 PolarHBondContact O-N 2.8Å; L718-M727 HydrophobicContact CD1-CE 4.44Å; L718-M727 HydrophobicContact CD1-SD 4.21Å; L718-V735 HydrophobicContact CD1-CG1 4.09Å; L718-V735 HydrophobicContact CD1-CG2 4.2Å; L718-V735 HydrophobicContact CD2-CG1 3.71Å; L718-I761 HydrophobicContact CB-CB 3.87Å; L718-I761 HydrophobicContact CB-CG2 4.03Å; L718-I761 HydrophobicContact CD2-CB 4.22Å; L718-I761 HydrophobicContact CD2-CG1 4.39Å; L718-I761 HydrophobicContact CD2-CG2 4.28Å; L718-I761 PolarHBondContact N-O 3.28Å; L718-L763 HydrophobicContact CD1-CD1 4.37Å; L718-M821 HydrophobicContact CD2-CE 3.88Å; L718-M821 HydrophobicContact CD2-CG 4.29Å; L718-M821 HydrophobicContact CD2-SD 4.09Å; L718-M825 HydrophobicContact CD1-SD 4.31Å; L718-M825 HydrophobicContact CD2-CG 4.35Å; L718-M825 HydrophobicContact CD2-SD 4.04Å
719	T	94.5	Very high	94.5	Very high	30 Å²	30	34.5 Å²	34.5	18%	0.184	20%	0.195	C	C	.	.	H	α-helix	trans	-56.8	-48.2	176.6	-40.6	0	0	0	0	110.7	S717 V721 I722 T723 S758 D759	S717-T719 VanDerWaalsContact C-N 3.28Å; S717-T719 WeakPolarHBondContact OG-CB 3.41Å; S717-T719 PolarHBondContact OG-N 3.19Å; T719-V721 PolarHBondContact O-N 2.67Å; T719-I722 PolarHBondContact O-N 3.43Å; T719-T723 PolarHBondContact O-N 2.71Å; T719-T723 PolarHBondContact O-OG1 2.85Å; T719-S758 VanDerWaalsContact OG1-C 3.3Å; T719-S758 VanDerWaalsContact OG1-CB 3.28Å; T719-S758 WeakPolarHBondContact OG1-CB 3.38Å; T719-S758 PolarHBondContact OG1-OG 3.31Å; T719-D759 VanDerWaalsContact OG1-CA 3.3Å; T719-D759 WeakPolarHBondContact OG1-CA 3.01Å; T719-D759 PolarHBondContact OG1-N 3.04Å; T719-D759 PolarHBondContact OG1-OD1 2.88Å
720	D	93.5	Very high	94.6	Very high	59 Å²	59	36 Å²	36	32%	0.316	21%	0.206	S	C	.	.	H	α-helix	trans	-57.9	-31.8	177.7	-50.1	-55	0	0	0	112.2	S717 L718 E724 A905	S717-D720 WeakPolarHBondContact CA-OD2 3.39Å; S717-D720 WeakPolarHBondContact CB-OD2 3.37Å; S717-D720 PolarHBondContact N-OD2 3.09Å; S717-D720 PolarHBondContact OG-N 2.84Å; S717-D720 PolarHBondContact OG-OD2 2.94Å; L718-D720 VanDerWaalsContact C-N 3.33Å; L718-D720 PolarHBondContact O-N 3.07Å; D720-E724 WeakPolarHBondContact O-CB 3.22Å; D720-E724 VanDerWaalsContact O-CG 3.3Å; D720-E724 WeakPolarHBondContact O-CG 3.31Å; D720-E724 PolarHBondContact O-N 3.44Å; D720-A905 VanDerWaalsContact O-CB 3.31Å; D720-A905 WeakPolarHBondContact O-CB 3.46Å
721	V	96.3	Very high	94.8	Very high	5 Å²	5	36.9 Å²	36.9	3%	0.03	21%	0.21	C	C	.	.	H	α-helix	trans	-81.3	-29.3	177.9	173.8	0	0	0	0	112.3	L718 T719 T725 M727 L763 L901 I902 A905	L718-V721 PolarHBondContact O-N 3.14Å; L718-V721 VanDerWaalsContact O-N 3.08Å; T719-V721 PolarHBondContact O-N 2.67Å; V721-T725 WeakPolarHBondContact O-CB 3.22Å; V721-T725 PolarHBondContact O-N 3.35Å; V721-T725 PolarHBondContact O-OG1 2.92Å; V721-M727 HydrophobicContact CG1-CG 4.49Å; V721-M727 HydrophobicContact CG1-SD 4.26Å; V721-L763 HydrophobicContact CB-CD1 4.26Å; V721-L763 HydrophobicContact CG2-CD1 3.56Å; V721-L901 HydrophobicContact CG1-CB 3.9Å; V721-L901 HydrophobicContact CG1-CD1 4.26Å; V721-I902 HydrophobicContact CG2-CG1 4.14Å; V721-A905 HydrophobicContact CG2-CB 4Å
722	I	95.7	Very high	95	Very high	15 Å²	15	35 Å²	35	8%	0.077	20%	0.201	C	C	.	.	H	α-helix	trans	-77.1	-37.9	178.3	-67.2	171.8	0	0	0	111.6	L718 T719 M727 E824 M825	L718-I722 HydrophobicContact CD2-CD1 4.23Å; L718-I722 HydrophobicContact CG-CD1 3.87Å; L718-I722 HydrophobicContact CG-CG1 4.25Å; L718-I722 WeakPolarHBondContact O-CG1 3.42Å; L718-I722 PolarHBondContact O-N 2.8Å; T719-I722 PolarHBondContact O-N 3.43Å; I722-M727 HydrophobicContact CG1-SD 4.23Å; I722-E824 HydrophobicContact CD1-CG 4.01Å; I722-E824 WeakPolarHBondContact CG2-O 3.49Å; I722-M825 HydrophobicContact CD1-CB 4.37Å; I722-M825 HydrophobicContact CD1-CG 3.51Å; I722-M825 HydrophobicContact CG1-CG 3.91Å
723	T	91.9	Very high	95.2	Very high	87 Å²	87	32.5 Å²	32.5	53%	0.534	19%	0.191	S	C	.	.	H	α-helix	trans	-73.1	-43.2	179.1	60.3	0	0	0	0	112	T719	T719-T723 PolarHBondContact O-N 2.71Å; T719-T723 PolarHBondContact O-OG1 2.85Å
724	E	92	Very high	95.3	Very high	65 Å²	65	31.8 Å²	31.8	30%	0.304	19%	0.188	S	C	.	.	H	α-helix	trans	-91.4	-9.8	-172.2	-53.1	-43.4	109.6	0	0	114	D720 A905 Q908	D720-E724 WeakPolarHBondContact O-CB 3.22Å; D720-E724 VanDerWaalsContact O-CG 3.3Å; D720-E724 WeakPolarHBondContact O-CG 3.31Å; D720-E724 PolarHBondContact O-N 3.44Å; E724-A905 HydrophobicContact CB-CB 4.04Å; E724-A905 HydrophobicContact CG-CB 4.4Å; E724-Q908 HydrophobicContact CB-CB 4.29Å; E724-Q908 HydrophobicContact CG-CB 4.17Å; E724-Q908 PolarHBondContact O-NE2 2.94Å
725	T	93.6	Very high	95.6	Very high	17 Å²	17	30.4 Å²	30.4	10%	0.104	18%	0.18	C	C	.	.	S	Bend	trans	-144.5	153.8	-174.8	89.1	0	0	0	0	114.3	V721 L901 L904 A905	V721-T725 WeakPolarHBondContact O-CB 3.22Å; V721-T725 PolarHBondContact O-N 3.35Å; V721-T725 PolarHBondContact O-OG1 2.92Å; T725-L901 HydrophobicContact CG2-CB 4.3Å; T725-L901 HydrophobicContact CG2-CD2 4.4Å; T725-L904 HydrophobicContact CG2-CB 4.32Å; T725-L904 HydrophobicContact CG2-CD2 4.03Å; T725-L904 HydrophobicContact CG2-CG 4.13Å; T725-A905 HydrophobicContact CG2-CB 4.23Å
726	C	93.1	Very high	95.9	Very high	126 Å²	126	30.2 Å²	30.2	85%	0.851	18%	0.179	S	C	*	.	P	Polyproline II helix	trans	-93	119.8	171.4	-67.4	0	0	0	0	111.1
727	M	95.7	Very high	96.1	Very high	22 Å²	22	31.7 Å²	31.7	11%	0.108	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-87.1	133.2	177	-59	-169.7	71.3	0	0	111.5	L718 V721 I722 H731 I732 V735 M825 L898 L901	L718-M727 HydrophobicContact CD1-CE 4.44Å; L718-M727 HydrophobicContact CD1-SD 4.21Å; V721-M727 HydrophobicContact CG1-CG 4.49Å; V721-M727 HydrophobicContact CG1-SD 4.26Å; I722-M727 HydrophobicContact CG1-SD 4.23Å; M727-H731 HydrophobicContact CB-CB 4.41Å; M727-H731 HydrophobicContact CE-CB 3.79Å; M727-I732 HydrophobicContact CB-CD1 4.25Å; M727-I732 HydrophobicContact CB-CG1 3.82Å; M727-V735 HydrophobicContact CE-CG2 3.94Å; M727-M825 HydrophobicContact CE-SD 3.98Å; M727-M825 HydrophobicContact SD-CB 4.16Å; M727-M825 HydrophobicContact SD-CG 3.74Å; M727-M825 HydrophobicContact SD-SD 3.8Å; M727-L898 HydrophobicContact CE-CD2 4.43Å; M727-L901 HydrophobicContact CG-CD1 4.01Å
728	N	95.5	Very high	96.3	Very high	75 Å²	75	32 Å²	32	40%	0.401	18%	0.178	S	C	.	.	P	Polyproline II helix	trans	-87.4	165	169.6	69.8	46.6	0	0	0	111	S730 H731 I732	N728-S730 PolarHBondContact O-N 3.44Å; N728-S730 VanDerWaalsContact O-N 3.08Å; N728-S730 WeakPolarHBondContact OD1-CA 3.39Å; N728-S730 VanDerWaalsContact OD1-CB 3.3Å; N728-S730 WeakPolarHBondContact OD1-CB 3.3Å; N728-S730 PolarHBondContact OD1-N 2.78Å; N728-H731 PolarHBondContact ND2-CE1 3.14Å; N728-H731 PolarHBondContact ND2-NE2 3.26Å; N728-H731 WeakPolarHBondContact O-CB 3.3Å; N728-H731 PolarHBondContact O-N 2.85Å; N728-H731 PolarHBondContact OD1-CD2 2.97Å; N728-H731 PolarHBondContact OD1-N 2.83Å; N728-I732 WeakPolarHBondContact O-CG1 3.45Å; N728-I732 PolarHBondContact O-N 3.14Å
729	E	97.4	Very high	96.3	Very high	37 Å²	37	32.1 Å²	32.1	17%	0.173	18%	0.179	C	C	.	.	H	α-helix	trans	-54.1	-32.2	-179.4	-70.7	-157.1	-171.6	0	0	114.7	A733 S858 L861 F887 N891	E729-A733 WeakPolarHBondContact O-CB 3.41Å; E729-A733 PolarHBondContact O-N 3.3Å; E729-S858 VanDerWaalsContact CD-OG 3.27Å; E729-S858 WeakPolarHBondContact OE1-CB 3.49Å; E729-S858 PolarHBondContact OE1-N 3.48Å; E729-S858 PolarHBondContact OE1-OG 3.09Å; E729-S858 VanDerWaalsContact OE2-CB 3.25Å; E729-S858 WeakPolarHBondContact OE2-CB 3.23Å; E729-S858 PolarHBondContact OE2-OG 3.45Å; E729-L861 HydrophobicContact CG-CD2 3.88Å; E729-L861 WeakPolarHBondContact OE1-CD2 3.23Å; E729-F887 HydrophobicContact CB-CE2 4.19Å; E729-N891 PolarHBondContact OE2-ND2 3.08Å; E729-N891 VanDerWaalsContact OE2-ND2 3.11Å
730	S	97.7	Very high	96.5	Very high	31 Å²	31	30.7 Å²	30.7	22%	0.217	17%	0.17	C	C	.	.	H	α-helix	trans	-71.3	-35.3	178.2	-65.2	0	0	0	0	111.9	N728 T734 N891	N728-S730 PolarHBondContact O-N 3.44Å; N728-S730 VanDerWaalsContact O-N 3.08Å; N728-S730 WeakPolarHBondContact OD1-CA 3.39Å; N728-S730 VanDerWaalsContact OD1-CB 3.3Å; N728-S730 WeakPolarHBondContact OD1-CB 3.3Å; N728-S730 PolarHBondContact OD1-N 2.78Å; S730-T734 WeakPolarHBondContact O-CB 3.11Å; S730-T734 PolarHBondContact O-N 2.9Å; S730-T734 VanDerWaalsContact O-N 3.15Å; S730-T734 PolarHBondContact O-OG1 3.31Å; S730-N891 VanDerWaalsContact CA-O 3.27Å; S730-N891 WeakPolarHBondContact CA-O 3.45Å; S730-N891 WeakPolarHBondContact CB-O 3.36Å; S730-N891 PolarHBondContact OG-O 2.85Å
731	H	98	Very high	96.7	Very high	30 Å²	30	30.7 Å²	30.7	14%	0.139	17%	0.168	C	C	.	.	H	α-helix	trans	-70.3	-43.8	173.9	-57.5	171.1	0	0	0	110.6	M727 N728 T734 V735 L898 L901	M727-H731 HydrophobicContact CB-CB 4.41Å; M727-H731 HydrophobicContact CE-CB 3.79Å; N728-H731 PolarHBondContact ND2-CE1 3.14Å; N728-H731 PolarHBondContact ND2-NE2 3.26Å; N728-H731 WeakPolarHBondContact O-CB 3.3Å; N728-H731 PolarHBondContact O-N 2.85Å; N728-H731 PolarHBondContact OD1-CD2 2.97Å; N728-H731 PolarHBondContact OD1-N 2.83Å; H731-T734 WeakPolarHBondContact O-CB 3.43Å; H731-T734 PolarHBondContact O-N 2.76Å; H731-V735 PolarHBondContact O-N 2.8Å; H731-L898 HydrophobicContact CB-CD2 3.78Å; H731-L901 HydrophobicContact CB-CD1 4.47Å; H731-L901 VanDerWaalsContact ND1-CD1 3.28Å; H731-L901 WeakPolarHBondContact ND1-CD1 3.32Å
732	I	98.3	Very high	96.7	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.3	-52	176.5	-63	175.8	0	0	0	110.5	M727 N728 T734 V735 C736 T822 M825 L826 F887	M727-I732 HydrophobicContact CB-CD1 4.25Å; M727-I732 HydrophobicContact CB-CG1 3.82Å; N728-I732 WeakPolarHBondContact O-CG1 3.45Å; N728-I732 PolarHBondContact O-N 3.14Å; I732-T734 PolarHBondContact O-N 2.99Å; I732-V735 PolarHBondContact O-N 3.05Å; I732-C736 WeakPolarHBondContact O-CB 3.34Å; I732-C736 PolarHBondContact O-N 2.95Å; I732-C736 PolarHBondContact O-SG 3.19Å; I732-T822 HydrophobicContact CG2-CG2 3.89Å; I732-M825 HydrophobicContact CD1-CB 4.08Å; I732-M825 HydrophobicContact CG1-CB 3.94Å; I732-M825 HydrophobicContact CG1-SD 4.35Å; I732-M825 HydrophobicContact CG2-CE 4.06Å; I732-M825 HydrophobicContact CG2-SD 4.42Å; I732-L826 HydrophobicContact CD1-CD2 3.41Å; I732-L826 VanDerWaalsContact CD1-CD2 3.41Å; I732-L826 HydrophobicContact CD1-CG 3.86Å; I732-F887 HydrophobicContact CB-CZ 4.37Å; I732-F887 HydrophobicContact CG2-CE1 4.37Å; I732-F887 HydrophobicContact CG2-CZ 4.01Å
733	A	98.6	Very high	96.8	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-57.8	-33.2	176.4	0	0	0	0	0	112.6	E729 R737 F887 N891 A892	E729-A733 WeakPolarHBondContact O-CB 3.41Å; E729-A733 PolarHBondContact O-N 3.3Å; A733-R737 VanDerWaalsContact O-CB 3.3Å; A733-R737 WeakPolarHBondContact O-CB 3.37Å; A733-R737 PolarHBondContact O-N 3.44Å; A733-F887 HydrophobicContact CB-CD1 4.16Å; A733-F887 HydrophobicContact CB-CD2 4.43Å; A733-F887 HydrophobicContact CB-CE1 3.71Å; A733-F887 HydrophobicContact CB-CE2 3.99Å; A733-F887 HydrophobicContact CB-CG 4.5Å; A733-F887 HydrophobicContact CB-CZ 3.6Å; A733-N891 HydrophobicContact CB-CB 3.83Å; A733-A892 HydrophobicContact CB-CB 3.91Å
734	T	98.6	Very high	97	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-67.5	-51.7	175.6	-58.3	0	0	0	0	111.4	S730 H731 I732 C736 R737 E738 R893 V895 L898	S730-T734 WeakPolarHBondContact O-CB 3.11Å; S730-T734 PolarHBondContact O-N 2.9Å; S730-T734 VanDerWaalsContact O-N 3.15Å; S730-T734 PolarHBondContact O-OG1 3.31Å; H731-T734 WeakPolarHBondContact O-CB 3.43Å; H731-T734 PolarHBondContact O-N 2.76Å; I732-T734 PolarHBondContact O-N 2.99Å; T734-C736 PolarHBondContact O-N 3.16Å; T734-R737 WeakPolarHBondContact O-CB 3.49Å; T734-R737 PolarHBondContact O-N 2.86Å; T734-E738 WeakPolarHBondContact O-CG 3.41Å; T734-E738 PolarHBondContact O-N 2.78Å; T734-R893 WeakPolarHBondContact CG2-O 3.39Å; T734-R893 PolarHBondContact OG1-N 3.08Å; T734-R893 PolarHBondContact OG1-O 3.17Å; T734-V895 HydrophobicContact CG2-CG1 4.14Å; T734-L898 HydrophobicContact CG2-CD1 4.03Å; T734-L898 HydrophobicContact CG2-CG 4.27Å
735	V	98.6	Very high	97.1	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.006	15%	0.146	C	C	.	.	H	α-helix	trans	-63.1	-41.4	177.3	172.4	0	0	0	0	111.7	L718 M727 H731 I732 R737 T739 V769 M821 M825 L898	L718-V735 HydrophobicContact CD1-CG1 4.09Å; L718-V735 HydrophobicContact CD1-CG2 4.2Å; L718-V735 HydrophobicContact CD2-CG1 3.71Å; M727-V735 HydrophobicContact CE-CG2 3.94Å; H731-V735 PolarHBondContact O-N 2.8Å; I732-V735 PolarHBondContact O-N 3.05Å; V735-R737 VanDerWaalsContact C-N 3.33Å; V735-R737 PolarHBondContact O-N 3.27Å; V735-T739 WeakPolarHBondContact O-CB 3.28Å; V735-T739 PolarHBondContact O-N 3.46Å; V735-T739 PolarHBondContact O-OG1 3.35Å; V735-V769 HydrophobicContact CG1-CG1 4.26Å; V735-V769 HydrophobicContact CG2-CG2 4.4Å; V735-M821 HydrophobicContact CG1-CE 4.15Å; V735-M825 HydrophobicContact CB-CE 4.46Å; V735-M825 HydrophobicContact CB-SD 4.02Å; V735-M825 HydrophobicContact CG1-CE 4.14Å; V735-M825 HydrophobicContact CG1-SD 3.9Å; V735-L898 HydrophobicContact CG2-CD1 3.77Å; V735-L898 HydrophobicContact CG2-CD2 4.21Å
736	C	98.7	Very high	97.1	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-61.2	-39.1	174.1	-68.2	0	0	0	0	112	I732 T734 L740 F864 I888	I732-C736 WeakPolarHBondContact O-CB 3.34Å; I732-C736 PolarHBondContact O-N 2.95Å; I732-C736 PolarHBondContact O-SG 3.19Å; T734-C736 PolarHBondContact O-N 3.16Å; C736-L740 VanDerWaalsContact O-CB 3.27Å; C736-L740 WeakPolarHBondContact O-CB 3.5Å; C736-L740 WeakPolarHBondContact O-CD1 3.13Å; C736-L740 VanDerWaalsContact O-CG 3.22Å; C736-L740 WeakPolarHBondContact O-CG 3.3Å; C736-L740 PolarHBondContact O-N 2.8Å; C736-F864 HydrophobicContact CB-CE1 4.34Å; C736-F864 HydrophobicContact CB-CZ 4.06Å; C736-I888 HydrophobicContact CB-CD1 3.64Å
737	R	98.7	Very high	97.1	Very high	50 Å²	50	21.9 Å²	21.9	19%	0.189	11%	0.105	C	C	.	.	H	α-helix	trans	-61.5	-52.6	178.1	-173.7	-173.4	67.1	-135.7	-8.7	111.9	A733 T734 V735 T739 L740 Q741 I888 A892 R893	A733-R737 VanDerWaalsContact O-CB 3.3Å; A733-R737 WeakPolarHBondContact O-CB 3.37Å; A733-R737 PolarHBondContact O-N 3.44Å; T734-R737 WeakPolarHBondContact O-CB 3.49Å; T734-R737 PolarHBondContact O-N 2.86Å; V735-R737 VanDerWaalsContact C-N 3.33Å; V735-R737 PolarHBondContact O-N 3.27Å; R737-T739 VanDerWaalsContact C-N 3.33Å; R737-T739 PolarHBondContact O-N 2.73Å; R737-L740 PolarHBondContact O-N 3.16Å; R737-Q741 WeakPolarHBondContact O-CG 3.5Å; R737-Q741 PolarHBondContact O-N 3.17Å; R737-I888 HydrophobicContact CB-CG2 3.84Å; R737-I888 HydrophobicContact CG-CG2 3.76Å; R737-A892 HydrophobicContact CB-CB 4.43Å; R737-R893 PolarHBondContact NH1-O 3.45Å; R737-R893 PolarHBondContact NH2-O 3.36Å
738	E	98.4	Very high	97	Very high	22 Å²	22	24.4 Å²	24.4	10%	0.103	13%	0.125	C	C	.	.	H	α-helix	trans	-63.6	-40.3	-179.6	-57.3	-51.7	112.7	0	0	111	N692 T734 L740 Q741 A742 V769 V895	N692-E738 WeakPolarHBondContact CB-O 3.41Å; N692-E738 WeakPolarHBondContact ND2-CB 3.43Å; N692-E738 PolarHBondContact ND2-OE2 2.74Å; T734-E738 WeakPolarHBondContact O-CG 3.41Å; T734-E738 PolarHBondContact O-N 2.78Å; E738-L740 PolarHBondContact O-N 2.95Å; E738-Q741 WeakPolarHBondContact O-CB 3.33Å; E738-Q741 PolarHBondContact O-N 3.27Å; E738-Q741 PolarHBondContact OE2-OE1 2.92Å; E738-A742 PolarHBondContact O-N 3.16Å; E738-A742 VanDerWaalsContact O-N 3.16Å; E738-V769 HydrophobicContact CB-CB 3.69Å; E738-V769 HydrophobicContact CB-CG1 4.07Å; E738-V769 HydrophobicContact CB-CG2 4.32Å; E738-V769 HydrophobicContact CG-CB 3.93Å; E738-V769 HydrophobicContact CG-CG2 4.08Å; E738-V895 HydrophobicContact CG-CG1 4Å
739	T	98.5	Very high	96.7	Very high	3 Å²	3	24.6 Å²	24.6	2%	0.018	12%	0.122	C	C	.	.	H	α-helix	trans	-63.8	-39.5	174.6	-52.2	0	0	0	0	111.9	V735 R737 A742 L743 I761 L818 M821	V735-T739 WeakPolarHBondContact O-CB 3.28Å; V735-T739 PolarHBondContact O-N 3.46Å; V735-T739 PolarHBondContact O-OG1 3.35Å; R737-T739 VanDerWaalsContact C-N 3.33Å; R737-T739 PolarHBondContact O-N 2.73Å; T739-A742 PolarHBondContact O-N 2.89Å; T739-L743 HydrophobicContact CG2-CD1 4.35Å; T739-L743 WeakPolarHBondContact O-CG 2.97Å; T739-L743 PolarHBondContact O-N 2.8Å; T739-I761 HydrophobicContact CG2-CD1 3.97Å; T739-L818 HydrophobicContact CG2-CD1 3.94Å; T739-M821 HydrophobicContact CG2-CE 4.36Å
740	L	98.5	Very high	96.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-67.4	-31.9	174.8	-79.4	165.5	0	0	0	113	C736 R737 E738 L743 K744 I815 L818 F864 A879 L882 I883 I888	C736-L740 VanDerWaalsContact O-CB 3.27Å; C736-L740 WeakPolarHBondContact O-CB 3.5Å; C736-L740 WeakPolarHBondContact O-CD1 3.13Å; C736-L740 VanDerWaalsContact O-CG 3.22Å; C736-L740 WeakPolarHBondContact O-CG 3.3Å; C736-L740 PolarHBondContact O-N 2.8Å; R737-L740 PolarHBondContact O-N 3.16Å; E738-L740 PolarHBondContact O-N 2.95Å; L740-L743 PolarHBondContact O-N 3.03Å; L740-K744 WeakPolarHBondContact O-CB 3.48Å; L740-K744 PolarHBondContact O-N 2.94Å; L740-I815 HydrophobicContact CD2-CD1 4.36Å; L740-L818 HydrophobicContact CD1-CD2 4.33Å; L740-L818 HydrophobicContact CD2-CD2 3.53Å; L740-L818 HydrophobicContact CG-CD2 3.71Å; L740-F864 HydrophobicContact CD1-CE2 3.94Å; L740-F864 HydrophobicContact CD1-CZ 4.03Å; L740-A879 HydrophobicContact CD2-CB 4.24Å; L740-L882 HydrophobicContact CD1-CB 3.85Å; L740-L882 HydrophobicContact CD2-CB 3.66Å; L740-L882 HydrophobicContact CD2-CD1 4.2Å; L740-L882 HydrophobicContact CG-CB 4.44Å; L740-I883 HydrophobicContact CB-CB 4.36Å; L740-I888 HydrophobicContact CD1-CD1 4.08Å; L740-I888 HydrophobicContact CD1-CG1 4Å
741	Q	97.8	Very high	95.7	Very high	58 Å²	58	24.2 Å²	24.2	27%	0.271	12%	0.117	S	C	.	.	H	α-helix	trans	-64.7	-44.4	173	-70.5	163.7	-3.7	0	0	111.1	N692 R737 E738 F745 I883	N692-Q741 PolarHBondContact ND2-OE1 3.19Å; N692-Q741 WeakPolarHBondContact OD1-CB 3.3Å; N692-Q741 PolarHBondContact OD1-OE1 2.98Å; N692-Q741 VanDerWaalsContact OD1-OE1 3.06Å; R737-Q741 WeakPolarHBondContact O-CG 3.5Å; R737-Q741 PolarHBondContact O-N 3.17Å; E738-Q741 WeakPolarHBondContact O-CB 3.33Å; E738-Q741 PolarHBondContact O-N 3.27Å; E738-Q741 PolarHBondContact OE2-OE1 2.92Å; Q741-F745 WeakPolarHBondContact O-CB 3.44Å; Q741-F745 PolarHBondContact O-N 3.46Å; Q741-F745 VanDerWaalsContact O-N 3.13Å; Q741-I883 HydrophobicContact CG-CD1 3.62Å
742	A	96.4	Very high	95.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-60.2	-49.4	172.8	0	0	0	0	0	111.9	N692 V693 E738 T739 F745 L746 L771	N692-A742 HydrophobicContact CB-CB 3.91Å; N692-A742 WeakPolarHBondContact O-CB 3.18Å; V693-A742 HydrophobicContact CG2-CB 4.09Å; E738-A742 PolarHBondContact O-N 3.16Å; E738-A742 VanDerWaalsContact O-N 3.16Å; T739-A742 PolarHBondContact O-N 2.89Å; A742-F745 PolarHBondContact O-N 3.15Å; A742-L746 VanDerWaalsContact O-CG 3.3Å; A742-L746 WeakPolarHBondContact O-CG 3.31Å; A742-L746 PolarHBondContact O-N 3.19Å; A742-L771 HydrophobicContact CB-CB 4.18Å; A742-L771 HydrophobicContact CB-CD2 4.2Å
743	L	96.9	Very high	94.8	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-64.9	-43.4	-179.8	-69.9	177.9	0	0	0	112.7	T739 L740 F745 L746 H747 I756 L771 D814 I815 L818 A879	T739-L743 HydrophobicContact CG2-CD1 4.35Å; T739-L743 WeakPolarHBondContact O-CG 2.97Å; T739-L743 PolarHBondContact O-N 2.8Å; L740-L743 PolarHBondContact O-N 3.03Å; L743-F745 VanDerWaalsContact C-N 3.29Å; L743-F745 PolarHBondContact O-N 3.17Å; L743-L746 PolarHBondContact O-N 3.28Å; L743-H747 VanDerWaalsContact O-CB 3.23Å; L743-H747 WeakPolarHBondContact O-CB 3.48Å; L743-H747 PolarHBondContact O-CD2 2.65Å; L743-H747 PolarHBondContact O-N 3.05Å; L743-I756 HydrophobicContact CD2-CD1 3.87Å; L743-I756 HydrophobicContact CD2-CG1 4.18Å; L743-L771 HydrophobicContact CD2-CD2 4.5Å; L743-D814 HydrophobicContact CD1-CB 4.23Å; L743-D814 HydrophobicContact CD2-CB 3.75Å; L743-I815 HydrophobicContact CD1-CD1 4.21Å; L743-L818 HydrophobicContact CD1-CD2 4.35Å; L743-A879 HydrophobicContact CB-CB 4.06Å
744	K	96.5	Very high	94.3	Very high	65 Å²	65	23.2 Å²	23.2	28%	0.283	11%	0.112	S	C	.	.	H	α-helix	trans	-57	-43.6	175.7	-179.5	165.6	-176.3	176.3	0	111	L740 S748 A879 S880 I883 E884	L740-K744 WeakPolarHBondContact O-CB 3.48Å; L740-K744 PolarHBondContact O-N 2.94Å; K744-S748 WeakPolarHBondContact O-CB 3.3Å; K744-S748 PolarHBondContact O-N 2.95Å; K744-S748 VanDerWaalsContact O-N 3.14Å; K744-A879 HydrophobicContact CB-CB 3.97Å; K744-S880 WeakPolarHBondContact CE-OG 3.36Å; K744-I883 HydrophobicContact CD-CD1 4.19Å; K744-I883 HydrophobicContact CD-CG2 3.78Å; K744-I883 VanDerWaalsContact NZ-CG2 3.27Å; K744-E884 IonicContact NZ-OE1 3.66Å; K744-E884 PolarHBondContact NZ-OE1 3Å; K744-E884 VanDerWaalsContact NZ-OE1 3.1Å
745	F	94.6	Very high	93.8	Very high	46 Å²	46	23.4 Å²	23.4	20%	0.202	11%	0.113	C	C	.	.	H	α-helix	trans	-64.2	-53.5	174.8	171	-107.1	0	0	0	112.5	Y688 R689 N690 Q741 A742 L743 H747 S748 K749	Y688-F745 HydrophobicContact CD1-CZ 4.44Å; Y688-F745 HydrophobicContact CG-CZ 4.49Å; R689-F745 WeakPolarHBondContact O-CZ 3.48Å; N690-F745 HydrophobicContact CB-CD1 3.47Å; N690-F745 VanDerWaalsContact CB-CD1 3.47Å; N690-F745 HydrophobicContact CB-CE1 3.48Å; N690-F745 VanDerWaalsContact CB-CE1 3.48Å; N690-F745 HydrophobicContact CB-CG 4Å; N690-F745 HydrophobicContact CB-CZ 4.04Å; Q741-F745 WeakPolarHBondContact O-CB 3.44Å; Q741-F745 PolarHBondContact O-N 3.46Å; Q741-F745 VanDerWaalsContact O-N 3.13Å; A742-F745 PolarHBondContact O-N 3.15Å; L743-F745 VanDerWaalsContact C-N 3.29Å; L743-F745 PolarHBondContact O-N 3.17Å; F745-H747 PolarHBondContact O-N 3.49Å; F745-S748 PolarHBondContact O-N 3.47Å; F745-S748 PolarHBondContact O-OG 2.76Å; F745-K749 PolarHBondContact O-N 3.19Å
746	L	92.7	Very high	93.6	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-62.5	-43.1	-178	-68.4	169	0	0	0	112.4	A742 L743 S748 K749 H750 V751 L771 F774	A742-L746 VanDerWaalsContact O-CG 3.3Å; A742-L746 WeakPolarHBondContact O-CG 3.31Å; A742-L746 PolarHBondContact O-N 3.19Å; L743-L746 PolarHBondContact O-N 3.28Å; L746-S748 VanDerWaalsContact C-N 3.31Å; L746-S748 PolarHBondContact O-N 2.85Å; L746-K749 CarbonylContact O-C 3.47Å; L746-K749 WeakPolarHBondContact O-CA 3.25Å; L746-K749 PolarHBondContact O-N 3Å; L746-H750 PolarHBondContact O-N 3.28Å; L746-V751 CarbonylContact C-O 2.9Å; L746-V751 HydrophobicContact CB-CB 4.32Å; L746-V751 HydrophobicContact CD2-CB 4.4Å; L746-V751 HydrophobicContact CD2-CG1 4.38Å; L746-V751 PolarHBondContact O-N 2.95Å; L746-L771 HydrophobicContact CD1-CD2 3.75Å; L746-F774 HydrophobicContact CD1-CE1 3.74Å; L746-F774 HydrophobicContact CD1-CZ 4.25Å; L746-F774 HydrophobicContact CD2-CE1 3.8Å; L746-F774 HydrophobicContact CG-CE1 4.44Å
747	H	94	Very high	93.4	Very high	18 Å²	18	23.9 Å²	23.9	8%	0.083	12%	0.115	C	C	.	.	H	α-helix	trans	-64.4	-36.3	178.1	-66.7	-172.2	0	0	0	111.2	L743 F745 K749 H750 V751 H811 D814	L743-H747 VanDerWaalsContact O-CB 3.23Å; L743-H747 WeakPolarHBondContact O-CB 3.48Å; L743-H747 PolarHBondContact O-CD2 2.65Å; L743-H747 PolarHBondContact O-N 3.05Å; F745-H747 PolarHBondContact O-N 3.49Å; H747-K749 PolarHBondContact O-N 3.44Å; H747-H750 WeakPolarHBondContact O-CA 3.39Å; H747-H750 PolarHBondContact O-N 3.27Å; H747-V751 PolarHBondContact CD2-O 3.31Å; H747-H811 HydrophobicContact CB-CB 4.46Å; H747-H811 AromaticContact CE1-CD2 3.95Å; H747-H811 PolarHBondContact CE1-O 3.17Å; H747-H811 VanDerWaalsContact CE1-O 3.27Å; H747-H811 AromaticContact ND1-CD2 3.4Å; H747-H811 PolarHBondContact ND1-CD2 3.44Å; H747-H811 AromaticContact ND1-CG 3.76Å; H747-D814 IonicContact CD2-OD2 2.81Å; H747-D814 IonicContact CE1-OD2 3.93Å; H747-D814 IonicContact NE2-OD2 2.65Å; H747-D814 PolarHBondContact NE2-OD2 3.17Å
748	S	92.8	Very high	93.2	Very high	76 Å²	76	21.6 Å²	21.6	53%	0.531	11%	0.106	S	C	.	.	H	α-helix	trans	-65	-22.5	173.3	81.8	0	0	0	0	114	K744 F745 L746 H750	K744-S748 WeakPolarHBondContact O-CB 3.3Å; K744-S748 PolarHBondContact O-N 2.95Å; K744-S748 VanDerWaalsContact O-N 3.14Å; F745-S748 PolarHBondContact O-N 3.47Å; F745-S748 PolarHBondContact O-OG 2.76Å; L746-S748 VanDerWaalsContact C-N 3.31Å; L746-S748 PolarHBondContact O-N 2.85Å; S748-H750 VanDerWaalsContact C-N 3.34Å
749	K	88.7	Confident	92.9	Very high	79 Å²	79	23.1 Å²	23.1	34%	0.343	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	16.9	172.5	-59.8	-57.6	-176.4	-179.4	0	112.6	Y688 F745 L746 H747 V751	Y688-K749 HydrophobicContact CD1-CB 4.36Å; Y688-K749 HydrophobicContact CD1-CD 4.48Å; Y688-K749 HydrophobicContact CD1-CG 3.95Å; Y688-K749 HydrophobicContact CE1-CB 3.92Å; Y688-K749 HydrophobicContact CE1-CD 3.92Å; Y688-K749 HydrophobicContact CE1-CG 3.71Å; Y688-K749 HydrophobicContact CE2-CB 4.2Å; F745-K749 PolarHBondContact O-N 3.19Å; L746-K749 CarbonylContact O-C 3.47Å; L746-K749 WeakPolarHBondContact O-CA 3.25Å; L746-K749 PolarHBondContact O-N 3Å; H747-K749 PolarHBondContact O-N 3.44Å; K749-V751 PolarHBondContact O-N 3.4Å
750	H	86.4	Confident	92.7	Very high	60 Å²	60	23.7 Å²	23.7	28%	0.278	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	27.4	-177.2	-56.7	-86.9	0	0	0	114.3	L746 H747 S748 Q779 L780 A782 D785	L746-H750 PolarHBondContact O-N 3.28Å; H747-H750 WeakPolarHBondContact O-CA 3.39Å; H747-H750 PolarHBondContact O-N 3.27Å; S748-H750 VanDerWaalsContact C-N 3.34Å; H750-Q779 CarbonylContact O-C 3.53Å; H750-Q779 WeakPolarHBondContact O-CA 3.06Å; H750-L780 HydrophobicContact CB-CB 4.18Å; H750-L780 PolarHBondContact O-N 2.96Å; H750-A782 WeakPolarHBondContact NE2-CB 3.38Å; H750-D785 IonicContact CE1-OD1 2.88Å
751	V	87.1	Confident	92.6	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	121.4	174.8	-178.1	0	0	0	0	109.5	V684 Y688 L746 H747 K749 C777	V684-V751 HydrophobicContact CG1-CG1 4.27Å; V684-V751 HydrophobicContact CG2-CG2 4.45Å; Y688-V751 HydrophobicContact CD2-CG2 4.35Å; Y688-V751 HydrophobicContact CE2-CG2 4.02Å; L746-V751 CarbonylContact C-O 2.9Å; L746-V751 HydrophobicContact CB-CB 4.32Å; L746-V751 HydrophobicContact CD2-CB 4.4Å; L746-V751 HydrophobicContact CD2-CG1 4.38Å; L746-V751 PolarHBondContact O-N 2.95Å; H747-V751 PolarHBondContact CD2-O 3.31Å; K749-V751 PolarHBondContact O-N 3.4Å; V751-C777 HydrophobicContact CG1-CB 3.99Å
752	I	89.3	Confident	92.5	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	139.4	166.2	-37.1	173.3	0	0	0	108.6	R754 C777 A778 L780 Y809 H811 I813 D814	I752-R754 HydrophobicContact CB-CG 3.89Å; I752-R754 HydrophobicContact CG2-CG 3.64Å; I752-C777 CarbonylContact O-C 3.5Å; I752-C777 WeakPolarHBondContact O-CA 3.13Å; I752-A778 HydrophobicContact CB-CB 3.94Å; I752-A778 HydrophobicContact CD1-CB 4.45Å; I752-A778 HydrophobicContact CG1-CB 4.27Å; I752-A778 PolarHBondContact N-O 2.7Å; I752-A778 PolarHBondContact O-N 2.97Å; I752-L780 HydrophobicContact CD1-CD1 4.16Å; I752-L780 HydrophobicContact CD1-CD2 3.87Å; I752-L780 HydrophobicContact CD1-CG 4.24Å; I752-L780 HydrophobicContact CG1-CD1 4.4Å; I752-L780 HydrophobicContact CG1-CD2 4.34Å; I752-L780 HydrophobicContact CG1-CG 4.31Å; I752-Y809 HydrophobicContact CD1-CD2 4.37Å; I752-Y809 HydrophobicContact CD1-CE2 4.23Å; I752-H811 HydrophobicContact CG1-CB 4.02Å; I752-I813 HydrophobicContact CG2-CD1 4.35Å; I752-I813 HydrophobicContact CG2-CG1 3.92Å; I752-D814 WeakPolarHBondContact CG2-OD1 3.22Å; I752-D814 WeakPolarHBondContact CG2-OD2 3.49Å
753	H	89.1	Confident	92.6	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.117	C	C	.	.			trans	-75	-54.2	177.5	-160.3	-104.9	0	0	0	112.2	D755 I756 T772 F776 C777 D814	H753-D755 VanDerWaalsContact C-N 3.3Å; H753-D755 PolarHBondContact CE1-O 3.24Å; H753-D755 VanDerWaalsContact CE1-O 3.32Å; H753-D755 PolarHBondContact ND1-O 3.37Å; H753-D755 PolarHBondContact O-N 2.93Å; H753-I756 HydrophobicContact CB-CD1 3.73Å; H753-I756 HydrophobicContact CB-CG1 3.99Å; H753-I756 WeakPolarHBondContact ND1-CD1 3.48Å; H753-T772 PolarHBondContact CE1-O 3.08Å; H753-T772 PolarHBondContact NE2-O 3.09Å; H753-T772 VanDerWaalsContact NE2-O 3.17Å; H753-F776 CarbonylContact O-C 3.53Å; H753-F776 VanDerWaalsContact O-C 3.29Å; H753-C777 PolarHBondContact CD2-SG 2.89Å; H753-D814 PolarHBondContact N-OD1 3.43Å; H753-D814 PolarHBondContact N-OD2 3.24Å
754	R	87.6	Confident	92.6	Very high	9 Å²	9	23.4 Å²	23.4	3%	0.034	12%	0.119	C	C	.	.	S	Bend	trans	69.3	11.1	178.8	-41.1	-171	-69.6	-176.2	-6.4	117	I752 F776 C777 A778 R789 V793 G794 Y809 I813 D814	I752-R754 HydrophobicContact CB-CG 3.89Å; I752-R754 HydrophobicContact CG2-CG 3.64Å; R754-F776 PolarHBondContact NE-O 3.24Å; R754-F776 PolarHBondContact NH2-O 3.46Å; R754-C777 PolarHBondContact NH2-O 3.16Å; R754-C777 VanDerWaalsContact NH2-O 3.09Å; R754-A778 HydrophobicContact CG-CB 4.15Å; R754-R789 VanDerWaalsContact NH1-NH1 3.16Å; R754-V793 HydrophobicContact CB-CB 4.07Å; R754-V793 HydrophobicContact CB-CG1 4.17Å; R754-G794 WeakPolarHBondContact O-CA 3.4Å; R754-G794 PolarHBondContact O-N 2.8Å; R754-Y809 WeakPolarHBondContact CD-OH 3.32Å; R754-Y809 PolarHBondContact NH1-OH 3.08Å; R754-I813 HydrophobicContact CB-CD1 4.21Å; R754-I813 HydrophobicContact CG-CD1 3.99Å; R754-D814 PolarHBondContact N-OD1 2.91Å
755	D	88.7	Confident	92.5	Very high	4 Å²	4	23.5 Å²	23.5	2%	0.021	12%	0.122	C	C	.	.			trans	-152.6	67.6	168.5	-160.5	47.5	0	0	0	108.1	H753 K757 N760 F776 T795	H753-D755 VanDerWaalsContact C-N 3.3Å; H753-D755 PolarHBondContact CE1-O 3.24Å; H753-D755 VanDerWaalsContact CE1-O 3.32Å; H753-D755 PolarHBondContact ND1-O 3.37Å; H753-D755 PolarHBondContact O-N 2.93Å; D755-K757 WeakPolarHBondContact OD2-CE 3.36Å; D755-N760 PolarHBondContact O-ND2 2.92Å; D755-N760 PolarHBondContact OD2-ND2 3.38Å; D755-F776 HydrophobicContact CB-CB 4.09Å; D755-F776 HydrophobicContact CB-CD2 3.62Å; D755-F776 HydrophobicContact CB-CE2 4.44Å; D755-F776 HydrophobicContact CB-CG 4.08Å; D755-T795 PolarHBondContact OD1-N 3.05Å; D755-T795 PolarHBondContact OD1-OG1 3.45Å
756	I	94.7	Very high	92.5	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.133	C	C	.	.			trans	-90.3	125.4	172.6	-63.4	-65.5	0	0	0	107.7	L743 H753 L771 D814 S817 M821	L743-I756 HydrophobicContact CD2-CD1 3.87Å; L743-I756 HydrophobicContact CD2-CG1 4.18Å; H753-I756 HydrophobicContact CB-CD1 3.73Å; H753-I756 HydrophobicContact CB-CG1 3.99Å; H753-I756 WeakPolarHBondContact ND1-CD1 3.48Å; I756-L771 HydrophobicContact CD1-CD1 3.51Å; I756-L771 HydrophobicContact CD1-CD2 3.79Å; I756-L771 HydrophobicContact CD1-CG 4.33Å; I756-D814 HydrophobicContact CG1-CB 3.99Å; I756-S817 WeakPolarHBondContact O-CB 3.27Å; I756-M821 HydrophobicContact CG2-SD 4.27Å
757	K	94.2	Very high	92.7	Very high	11 Å²	11	25.1 Å²	25.1	5%	0.048	13%	0.133	C	C	.	.	S	Bend	trans	-169.6	164.4	-179.5	53.6	173.6	-176	155.6	0	108.9	D755 D759 N760 W798	D755-K757 WeakPolarHBondContact OD2-CE 3.36Å; K757-D759 VanDerWaalsContact C-N 3.33Å; K757-D759 HydrophobicContact CD-CB 4.25Å; K757-D759 WeakPolarHBondContact CD-OD2 3.37Å; K757-D759 VanDerWaalsContact CE-OD2 3.28Å; K757-D759 WeakPolarHBondContact CE-OD2 3.24Å; K757-D759 HydrophobicContact CG-CB 4.39Å; K757-D759 IonicContact NZ-OD2 2.69Å; K757-D759 PolarHBondContact NZ-OD2 3.17Å; K757-D759 PolarHBondContact O-N 3.04Å; K757-N760 HydrophobicContact CG-CB 4.33Å; K757-N760 PolarHBondContact O-N 2.89Å; K757-N760 VanDerWaalsContact O-N 3.09Å; K757-W798 HydrophobicContact CB-CD2 3.76Å; K757-W798 VanDerWaalsContact CB-CE2 3.48Å; K757-W798 HydrophobicContact CB-CE3 4.41Å; K757-W798 HydrophobicContact CB-CG 3.98Å; K757-W798 HydrophobicContact CB-CZ2 3.89Å; K757-W798 HydrophobicContact CD-CE3 4.48Å; K757-W798 HydrophobicContact CD-CH2 4.46Å; K757-W798 HydrophobicContact CD-CZ3 4.42Å
758	S	95.1	Very high	92.9	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.007	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-42.6	-51.7	174.1	50	0	0	0	0	114.3	T719 N760 I761 E824	T719-S758 VanDerWaalsContact OG1-C 3.3Å; T719-S758 VanDerWaalsContact OG1-CB 3.28Å; T719-S758 WeakPolarHBondContact OG1-CB 3.38Å; T719-S758 PolarHBondContact OG1-OG 3.31Å; S758-N760 PolarHBondContact O-N 2.53Å; S758-I761 PolarHBondContact O-N 2.73Å; S758-E824 WeakPolarHBondContact CB-OE1 3.37Å; S758-E824 PolarHBondContact OG-OE1 3.06Å
759	D	91.3	Very high	93.1	Very high	55 Å²	55	21.7 Å²	21.7	29%	0.294	11%	0.111	S	C	.	.	G	3₁₀ helix	trans	-56.7	-30.6	-177.1	-52.6	-41.1	0	0	0	113.6	T719 K757	T719-D759 VanDerWaalsContact OG1-CA 3.3Å; T719-D759 WeakPolarHBondContact OG1-CA 3.01Å; T719-D759 PolarHBondContact OG1-N 3.04Å; T719-D759 PolarHBondContact OG1-OD1 2.88Å; K757-D759 VanDerWaalsContact C-N 3.33Å; K757-D759 HydrophobicContact CD-CB 4.25Å; K757-D759 WeakPolarHBondContact CD-OD2 3.37Å; K757-D759 VanDerWaalsContact CE-OD2 3.28Å; K757-D759 WeakPolarHBondContact CE-OD2 3.24Å; K757-D759 HydrophobicContact CG-CB 4.39Å; K757-D759 IonicContact NZ-OD2 2.69Å; K757-D759 PolarHBondContact NZ-OD2 3.17Å; K757-D759 PolarHBondContact O-N 3.04Å
760	N	93.9	Very high	93.5	Very high	14 Å²	14	19.3 Å²	19.3	8%	0.075	10%	0.1	C	C	.	.	G	3₁₀ helix	trans	-94.9	4.4	-176.3	-64.5	-17.7	0	0	0	112.2	D755 K757 S758 T772	D755-N760 PolarHBondContact O-ND2 2.92Å; D755-N760 PolarHBondContact OD2-ND2 3.38Å; K757-N760 HydrophobicContact CG-CB 4.33Å; K757-N760 PolarHBondContact O-N 2.89Å; K757-N760 VanDerWaalsContact O-N 3.09Å; S758-N760 PolarHBondContact O-N 2.53Å; N760-T772 PolarHBondContact O-N 3.47Å
761	I	96.7	Very high	94	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	114.6	168.2	-57	-57.7	0	0	0	108.1	S717 L718 T739 S758 L763 V769 L771 M821	S717-I761 CarbonylContact C-O 3.44Å; S717-I761 WeakPolarHBondContact CA-O 3.43Å; L718-I761 HydrophobicContact CB-CB 3.87Å; L718-I761 HydrophobicContact CB-CG2 4.03Å; L718-I761 HydrophobicContact CD2-CB 4.22Å; L718-I761 HydrophobicContact CD2-CG1 4.39Å; L718-I761 HydrophobicContact CD2-CG2 4.28Å; L718-I761 PolarHBondContact N-O 3.28Å; T739-I761 HydrophobicContact CG2-CD1 3.97Å; S758-I761 PolarHBondContact O-N 2.73Å; I761-L763 HydrophobicContact CG2-CD2 4.41Å; I761-V769 HydrophobicContact CG2-CG1 3.47Å; I761-V769 VanDerWaalsContact CG2-CG1 3.47Å; I761-L771 HydrophobicContact CD1-CB 4.36Å; I761-L771 HydrophobicContact CD1-CD1 3.94Å; I761-M821 HydrophobicContact CD1-SD 4.44Å; I761-M821 HydrophobicContact CG1-CE 4.08Å; I761-M821 HydrophobicContact CG1-SD 3.65Å
762	L	96.7	Very high	94.1	Very high	46 Å²	46	17 Å²	17	24%	0.241	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	148.6	177.2	-61.6	-173.8	0	0	0	111.3	V694 L713 G716 K770 T772	V694-L762 HydrophobicContact CG2-CD1 4.32Å; L713-L762 HydrophobicContact CB-CB 4.3Å; L713-L762 HydrophobicContact CD1-CB 3.45Å; L713-L762 VanDerWaalsContact CD1-CB 3.45Å; L713-L762 HydrophobicContact CD1-CD1 4.3Å; G716-L762 WeakPolarHBondContact O-CA 3.5Å; L762-K770 PolarHBondContact N-O 2.98Å; L762-K770 PolarHBondContact O-N 3.12Å; L762-T772 HydrophobicContact CD1-CG2 3.95Å; L762-T772 HydrophobicContact CG-CG2 3.87Å
763	L	97.8	Very high	93.7	Very high	3 Å²	3	19 Å²	19	2%	0.016	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	137.8	-172	-58.1	179.3	0	0	0	111.2	L713 G715 G716 L718 V721 I761 S768 V769 I902	L713-L763 WeakPolarHBondContact CB-O 3.23Å; G715-L763 CarbonylContact C-O 3.59Å; G715-L763 WeakPolarHBondContact CA-O 3.49Å; G715-L763 PolarHBondContact N-O 2.63Å; G716-L763 PolarHBondContact N-O 2.76Å; G716-L763 PolarHBondContact O-N 3.21Å; L718-L763 HydrophobicContact CD1-CD1 4.37Å; V721-L763 HydrophobicContact CB-CD1 4.26Å; V721-L763 HydrophobicContact CG2-CD1 3.56Å; I761-L763 HydrophobicContact CG2-CD2 4.41Å; L763-S768 CarbonylContact C-O 3.35Å; L763-S768 VanDerWaalsContact CA-O 3.3Å; L763-S768 WeakPolarHBondContact CA-O 3.42Å; L763-V769 HydrophobicContact CD2-CB 4.2Å; L763-V769 HydrophobicContact CD2-CG1 4.03Å; L763-V769 HydrophobicContact CD2-CG2 3.83Å; L763-I902 HydrophobicContact CB-CD1 4.03Å; L763-I902 HydrophobicContact CB-CG1 4.32Å; L763-I902 HydrophobicContact CD1-CD1 4.2Å; L763-I902 HydrophobicContact CD1-CG1 3.89Å
764	G	96.3	Very high	92.8	Very high	3 Å²	3	19 Å²	19	3%	0.031	10%	0.101	C	C	.	.			trans	-93.8	156.6	170.9	0	0	0	0	0	112.5	D766 G767 S768	G764-D766 WeakPolarHBondContact CA-OD1 3.39Å; G764-D766 PolarHBondContact O-N 3.19Å; G764-G767 WeakPolarHBondContact O-CA 3.4Å; G764-G767 PolarHBondContact O-N 3.07Å; G764-S768 PolarHBondContact N-O 2.83Å
765	L	95.2	Very high	91.4	Very high	68 Å²	68	19 Å²	19	36%	0.356	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-9.7	173.5	-66.7	177	0	0	0	113.5	D714 G767 I899 I902 L903	D714-L765 HydrophobicContact CB-CD1 3.58Å; D714-L765 HydrophobicContact CB-CG 3.79Å; L765-G767 VanDerWaalsContact C-N 3.28Å; L765-I899 WeakPolarHBondContact O-CD1 3.36Å; L765-I902 HydrophobicContact CD2-CG2 4.01Å; L765-L903 HydrophobicContact CD2-CD2 4.11Å
766	D	95	Very high	89.9	Confident	81 Å²	81	19.5 Å²	19.5	43%	0.433	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-2.1	167	66.9	-24.6	0	0	0	113.1	G764 S768	G764-D766 WeakPolarHBondContact CA-OD1 3.39Å; G764-D766 PolarHBondContact O-N 3.19Å; D766-S768 VanDerWaalsContact OD1-CB 3.23Å; D766-S768 WeakPolarHBondContact OD1-CB 3.31Å; D766-S768 PolarHBondContact OD1-N 2.66Å; D766-S768 PolarHBondContact OD1-OG 2.65Å; D766-S768 WeakPolarHBondContact OD2-CB 3.19Å; D766-S768 PolarHBondContact OD2-OG 3.25Å
767	G	96.2	Very high	88.2	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.107	C	C	.	.			trans	85.9	-1.2	-173.5	0	0	0	0	0	114.3	G764 L765 V895	G764-G767 WeakPolarHBondContact O-CA 3.4Å; G764-G767 PolarHBondContact O-N 3.07Å; L765-G767 VanDerWaalsContact C-N 3.28Å; G767-V895 WeakPolarHBondContact O-CB 3.16Å
768	S	97.5	Very high	86.4	Confident	19 Å²	19	19.1 Å²	19.1	13%	0.133	10%	0.104	C	C	.	.			trans	-60.5	143.6	-178.5	60.8	0	0	0	0	112.1	L763 G764 D766	L763-S768 CarbonylContact C-O 3.35Å; L763-S768 VanDerWaalsContact CA-O 3.3Å; L763-S768 WeakPolarHBondContact CA-O 3.42Å; G764-S768 PolarHBondContact N-O 2.83Å; D766-S768 VanDerWaalsContact OD1-CB 3.23Å; D766-S768 WeakPolarHBondContact OD1-CB 3.31Å; D766-S768 PolarHBondContact OD1-N 2.66Å; D766-S768 PolarHBondContact OD1-OG 2.65Å; D766-S768 WeakPolarHBondContact OD2-CB 3.19Å; D766-S768 PolarHBondContact OD2-OG 3.25Å
769	V	98.3	Very high	84.6	Confident	2 Å²	2	23.4 Å²	23.4	1%	0.012	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	119.7	-174.8	-174.9	0	0	0	0	108.8	N692 V735 E738 I761 L763 L898	N692-V769 PolarHBondContact ND2-O 2.95Å; V735-V769 HydrophobicContact CG1-CG1 4.26Å; V735-V769 HydrophobicContact CG2-CG2 4.4Å; E738-V769 HydrophobicContact CB-CB 3.69Å; E738-V769 HydrophobicContact CB-CG1 4.07Å; E738-V769 HydrophobicContact CB-CG2 4.32Å; E738-V769 HydrophobicContact CG-CB 3.93Å; E738-V769 HydrophobicContact CG-CG2 4.08Å; I761-V769 HydrophobicContact CG2-CG1 3.47Å; I761-V769 VanDerWaalsContact CG2-CG1 3.47Å; L763-V769 HydrophobicContact CD2-CB 4.2Å; L763-V769 HydrophobicContact CD2-CG1 4.03Å; L763-V769 HydrophobicContact CD2-CG2 3.83Å; V769-L898 HydrophobicContact CG2-CD1 3.62Å
770	K	97.4	Very high	83.1	Confident	30 Å²	30	22 Å²	22	13%	0.13	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	135.4	-172.8	-53.3	-166.7	-174.6	178.6	0	113.6	P691 N692 V694 E711 L713 L762	P691-K770 WeakPolarHBondContact O-CD 3.18Å; P691-K770 VanDerWaalsContact O-CE 3.25Å; P691-K770 WeakPolarHBondContact O-CE 3.4Å; N692-K770 WeakPolarHBondContact O-CA 3.43Å; V694-K770 HydrophobicContact CG2-CB 3.85Å; E711-K770 WeakPolarHBondContact OE1-CD 3.28Å; E711-K770 IonicContact OE1-NZ 2.79Å; E711-K770 PolarHBondContact OE1-NZ 3.04Å; E711-K770 IonicContact OE2-NZ 3.46Å; E711-K770 PolarHBondContact OE2-NZ 3.21Å; L713-K770 HydrophobicContact CD1-CB 4Å; L713-K770 HydrophobicContact CD1-CD 4.13Å; L713-K770 HydrophobicContact CD1-CG 4.25Å; L713-K770 HydrophobicContact CD2-CD 4.26Å; L762-K770 PolarHBondContact N-O 2.98Å; L762-K770 PolarHBondContact O-N 3.12Å
771	L	95.3	Very high	80.8	Confident	1 Å²	1	23.7 Å²	23.7	1%	0.005	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	136.5	175.6	177.2	61.4	0	0	0	111.8	N692 V694 A742 L743 L746 I756 I761 F774	N692-L771 PolarHBondContact O-N 3.11Å; V694-L771 PolarHBondContact N-O 2.86Å; A742-L771 HydrophobicContact CB-CB 4.18Å; A742-L771 HydrophobicContact CB-CD2 4.2Å; L743-L771 HydrophobicContact CD2-CD2 4.5Å; L746-L771 HydrophobicContact CD1-CD2 3.75Å; I756-L771 HydrophobicContact CD1-CD1 3.51Å; I756-L771 HydrophobicContact CD1-CD2 3.79Å; I756-L771 HydrophobicContact CD1-CG 4.33Å; I761-L771 HydrophobicContact CD1-CB 4.36Å; I761-L771 HydrophobicContact CD1-CD1 3.94Å; L771-F774 HydrophobicContact CD2-CZ 4.48Å; L771-F774 HydrophobicContact CG-CZ 4.31Å
772	T	90.6	Very high	78.6	Confident	11 Å²	11	26.9 Å²	26.9	7%	0.067	16%	0.156	C	C	.	.			trans	-129.7	178.7	179.7	-159.4	0	0	0	0	113.8	H753 N760 L762	H753-T772 PolarHBondContact CE1-O 3.08Å; H753-T772 PolarHBondContact NE2-O 3.09Å; H753-T772 VanDerWaalsContact NE2-O 3.17Å; N760-T772 PolarHBondContact O-N 3.47Å; L762-T772 HydrophobicContact CD1-CG2 3.95Å; L762-T772 HydrophobicContact CG-CG2 3.87Å
773	D	79.3	Confident	76.4	Confident	41 Å²	41	33.1 Å²	33.1	22%	0.219	18%	0.181	C	C	.	.			trans	62.4	55.2	173.4	-96.5	39.1	0	0	0	117.6	K665 G775	K665-D773 IonicContact NZ-OD1 3.16Å; K665-D773 PolarHBondContact NZ-OD1 3.29Å; K665-D773 IonicContact NZ-OD2 2.71Å; K665-D773 PolarHBondContact NZ-OD2 2.86Å; D773-G775 PolarHBondContact O-N 2.86Å
774	F	71.7	Confident	73.6	Confident	1 Å²	1	36.6 Å²	36.6	0%	0.004	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-60.1	3.2	172.5	-63.2	-97.3	0	0	0	115.6	E681 V684 M685 V693 L746 L771 F776 C777	E681-F774 HydrophobicContact CG-CB 4.16Å; V684-F774 HydrophobicContact CG1-CD1 3.61Å; V684-F774 HydrophobicContact CG1-CE1 4.28Å; V684-F774 HydrophobicContact CG1-CG 4.34Å; M685-F774 HydrophobicContact CE-CD2 4.03Å; M685-F774 HydrophobicContact CE-CE2 4.47Å; M685-F774 HydrophobicContact CG-CB 3.86Å; M685-F774 HydrophobicContact CG-CD1 4.46Å; M685-F774 HydrophobicContact CG-CD2 3.54Å; M685-F774 HydrophobicContact CG-CE2 4.31Å; M685-F774 HydrophobicContact CG-CG 3.67Å; M685-F774 HydrophobicContact SD-CB 4.11Å; M685-F774 HydrophobicContact SD-CD2 3.73Å; M685-F774 HydrophobicContact SD-CG 4.2Å; V693-F774 HydrophobicContact CB-CZ 4.33Å; V693-F774 HydrophobicContact CG1-CE1 4.39Å; V693-F774 HydrophobicContact CG1-CE2 3.69Å; V693-F774 HydrophobicContact CG1-CZ 3.43Å; V693-F774 VanDerWaalsContact CG1-CZ 3.43Å; V693-F774 HydrophobicContact CG2-CZ 4.05Å; L746-F774 HydrophobicContact CD1-CE1 3.74Å; L746-F774 HydrophobicContact CD1-CZ 4.25Å; L746-F774 HydrophobicContact CD2-CE1 3.8Å; L746-F774 HydrophobicContact CG-CE1 4.44Å; L771-F774 HydrophobicContact CD2-CZ 4.48Å; L771-F774 HydrophobicContact CG-CZ 4.31Å; F774-F776 PolarHBondContact O-N 3.44Å; F774-F776 VanDerWaalsContact O-N 3.13Å; F774-C777 HydrophobicContact CB-CB 4.37Å; F774-C777 WeakPolarHBondContact CD1-SG 3.14Å; F774-C777 WeakPolarHBondContact O-CB 3.46Å; F774-C777 PolarHBondContact O-N 2.8Å
775	G	57.9	Low	71.1	Confident	9 Å²	9	42.8 Å²	42.8	9%	0.093	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-60.2	-19	174.6	0	0	0	0	0	114.3	E681 D773	E681-G775 VanDerWaalsContact CD-CA 3.44Å; E681-G775 VanDerWaalsContact OE2-CA 3.25Å; E681-G775 WeakPolarHBondContact OE2-CA 3.3Å; D773-G775 PolarHBondContact O-N 2.86Å
776	F	56.9	Low	68.7	Low	13 Å²	13	45.7 Å²	45.7	6%	0.057	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-95.8	-3.3	173	-64.7	-59.3	0	0	0	114.8	F131 H753 R754 D755 F774 V793	F131-F776 HydrophobicContact CD1-CE2 4.47Å; F131-F776 HydrophobicContact CD1-CZ 4.43Å; F131-F776 HydrophobicContact CE1-CE1 4.5Å; F131-F776 AromaticContact CE1-CE2 3.56Å; F131-F776 HydrophobicContact CE1-CE2 3.56Å; F131-F776 AromaticContact CE1-CZ 3.38Å; F131-F776 HydrophobicContact CE1-CZ 3.38Å; F131-F776 HydrophobicContact CZ-CE1 4.29Å; F131-F776 HydrophobicContact CZ-CE2 4.16Å; F131-F776 AromaticContact CZ-CZ 3.52Å; F131-F776 HydrophobicContact CZ-CZ 3.52Å; H753-F776 CarbonylContact O-C 3.53Å; H753-F776 VanDerWaalsContact O-C 3.29Å; R754-F776 PolarHBondContact NE-O 3.24Å; R754-F776 PolarHBondContact NH2-O 3.46Å; D755-F776 HydrophobicContact CB-CB 4.09Å; D755-F776 HydrophobicContact CB-CD2 3.62Å; D755-F776 HydrophobicContact CB-CE2 4.44Å; D755-F776 HydrophobicContact CB-CG 4.08Å; F774-F776 PolarHBondContact O-N 3.44Å; F774-F776 VanDerWaalsContact O-N 3.13Å; F776-V793 HydrophobicContact CB-CG1 3.71Å; F776-V793 HydrophobicContact CD1-CG1 3.36Å; F776-V793 HydrophobicContact CE1-CG1 4.28Å; F776-V793 HydrophobicContact CG-CG1 3.79Å
777	C	59.4	Low	66.4	Low	3 Å²	3	45.9 Å²	45.9	2%	0.02	25%	0.245	C	C	.	.			trans	-63.9	166	-169.6	-85.8	0	0	0	0	116.2	V751 I752 H753 R754 F774	V751-C777 HydrophobicContact CG1-CB 3.99Å; I752-C777 CarbonylContact O-C 3.5Å; I752-C777 WeakPolarHBondContact O-CA 3.13Å; H753-C777 PolarHBondContact CD2-SG 2.89Å; R754-C777 PolarHBondContact NH2-O 3.16Å; R754-C777 VanDerWaalsContact NH2-O 3.09Å; F774-C777 HydrophobicContact CB-CB 4.37Å; F774-C777 WeakPolarHBondContact CD1-SG 3.14Å; F774-C777 WeakPolarHBondContact O-CB 3.46Å; F774-C777 PolarHBondContact O-N 2.8Å
778	A	55.4	Low	64.3	Low	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	87	-165.8	0	0	0	0	0	113.5	I752 R754 L780	I752-A778 HydrophobicContact CB-CB 3.94Å; I752-A778 HydrophobicContact CD1-CB 4.45Å; I752-A778 HydrophobicContact CG1-CB 4.27Å; I752-A778 PolarHBondContact N-O 2.7Å; I752-A778 PolarHBondContact O-N 2.97Å; R754-A778 HydrophobicContact CG-CB 4.15Å; A778-L780 PolarHBondContact O-N 3.37Å
779	Q	58.7	Low	62	Low	92 Å²	92	51.2 Å²	51.2	43%	0.43	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	120	166.7	-159.1	179.1	23.4	0	0	110.5	H750 R789	H750-Q779 CarbonylContact O-C 3.53Å; H750-Q779 WeakPolarHBondContact O-CA 3.06Å; Q779-R789 PolarHBondContact O-NH2 3.46Å
780	L	58	Low	59.4	Low	26 Å²	26	55.2 Å²	55.2	14%	0.136	29%	0.289	C	S	.	.			trans	-82.6	163.2	167.2	-48.7	-174.3	0	0	0	109.4	H750 I752 A778 R789	H750-L780 HydrophobicContact CB-CB 4.18Å; H750-L780 PolarHBondContact O-N 2.96Å; I752-L780 HydrophobicContact CD1-CD1 4.16Å; I752-L780 HydrophobicContact CD1-CD2 3.87Å; I752-L780 HydrophobicContact CD1-CG 4.24Å; I752-L780 HydrophobicContact CG1-CD1 4.4Å; I752-L780 HydrophobicContact CG1-CD2 4.34Å; I752-L780 HydrophobicContact CG1-CG 4.31Å; A778-L780 PolarHBondContact O-N 3.37Å; L780-R789 HydrophobicContact CD2-CG 3.98Å
781	S	46.3	Very low	57.5	Low	49 Å²	49	56.9 Å²	56.9	34%	0.343	30%	0.302	S	S	.	.			trans	-90.7	108.8	177.3	-176.2	0	0	0	0	109.4	K783 N784	S781-K783 PolarHBondContact O-N 3.08Å; S781-N784 PolarHBondContact O-N 2.86Å
782	A	51.6	Low	55.3	Low	66 Å²	66	57.4 Å²	57.4	55%	0.545	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-12.9	-177.8	0	0	0	0	0	115.4	H750	H750-A782 WeakPolarHBondContact NE2-CB 3.38Å
783	K	48.8	Very low	53.7	Low	177 Å²	177	57.2 Å²	57.2	77%	0.77	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-15.2	176.6	-72.2	-176	175.1	174.6	0	114.7	S781	S781-K783 PolarHBondContact O-N 3.08Å
784	N	39	Very low	52.6	Low	76 Å²	76	56.2 Å²	56.2	41%	0.406	30%	0.302	S	S	.	.			trans	-143.8	118.4	165.5	-42.8	36.3	0	0	0	110.4	S781 D786 F787	S781-N784 PolarHBondContact O-N 2.86Å; N784-D786 HydrophobicContact CB-CB 4.31Å; N784-D786 PolarHBondContact O-N 3.37Å; N784-F787 HydrophobicContact CB-CD2 3.59Å; N784-F787 HydrophobicContact CB-CE2 3.76Å; N784-F787 HydrophobicContact CB-CG 4.47Å; N784-F787 WeakPolarHBondContact O-CD2 3.43Å; N784-F787 PolarHBondContact O-N 2.84Å; N784-F787 WeakPolarHBondContact OD1-CE2 3.46Å
785	D	44.5	Very low	52.6	Low	133 Å²	133	56.9 Å²	56.9	71%	0.711	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-18.1	168.4	-74.2	-51.2	0	0	0	112.8	H750 F787	H750-D785 IonicContact CE1-OD1 2.88Å; D785-F787 PolarHBondContact O-N 3.11Å; D785-F787 VanDerWaalsContact O-N 3.12Å
786	D	45.6	Very low	53.7	Low	129 Å²	129	56.8 Å²	56.8	69%	0.69	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-7	172.1	-64.6	-49.8	0	0	0	114.7	N784 K788	N784-D786 HydrophobicContact CB-CB 4.31Å; N784-D786 PolarHBondContact O-N 3.37Å; D786-K788 PolarHBondContact O-N 2.84Å
787	F	46.1	Very low	55.4	Low	86 Å²	86	57.3 Å²	57.3	38%	0.377	31%	0.306	S	S	.	.			trans	-76.1	54.4	-178.3	-83.8	-57.7	0	0	0	114.4	N784 D785	N784-F787 HydrophobicContact CB-CD2 3.59Å; N784-F787 HydrophobicContact CB-CE2 3.76Å; N784-F787 HydrophobicContact CB-CG 4.47Å; N784-F787 WeakPolarHBondContact O-CD2 3.43Å; N784-F787 PolarHBondContact O-N 2.84Å; N784-F787 WeakPolarHBondContact OD1-CE2 3.46Å; D785-F787 PolarHBondContact O-N 3.11Å; D785-F787 VanDerWaalsContact O-N 3.12Å
788	K	53.1	Low	57	Low	77 Å²	77	58 Å²	58	34%	0.335	31%	0.308	S	S	.	.			trans	-59.9	141.6	166.4	-62.7	-180	178.7	-170.7	0	110.7	D786 Q808 Y809	D786-K788 PolarHBondContact O-N 2.84Å; K788-Q808 HydrophobicContact CB-CB 3.52Å; K788-Q808 HydrophobicContact CB-CG 3.83Å; K788-Q808 HydrophobicContact CD-CB 4.04Å; K788-Q808 WeakPolarHBondContact CD-O 3.47Å; K788-Q808 HydrophobicContact CG-CB 4.4Å; K788-Y809 CarbonylContact C-O 3.53Å; K788-Y809 WeakPolarHBondContact CA-O 3.4Å; K788-Y809 WeakPolarHBondContact CB-O 3.49Å
789	R	48.5	Very low	58.7	Low	54 Å²	54	58.2 Å²	58.2	20%	0.204	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-99.1	159	-176.9	-71.2	-176.7	172.2	-144.6	0.1	111.7	R754 Q779 L780 Q808 Y809	R754-R789 VanDerWaalsContact NH1-NH1 3.16Å; Q779-R789 PolarHBondContact O-NH2 3.46Å; L780-R789 HydrophobicContact CD2-CG 3.98Å; R789-Q808 CarbonylContact O-C 3.5Å; R789-Q808 WeakPolarHBondContact O-CA 3.39Å; R789-Y809 HydrophobicContact CB-CD1 4.47Å; R789-Y809 HydrophobicContact CB-CD2 4.22Å; R789-Y809 HydrophobicContact CB-CE1 3.97Å; R789-Y809 HydrophobicContact CB-CE2 3.66Å; R789-Y809 PolarHBondContact N-O 3.31Å; R789-Y809 WeakPolarHBondContact O-CD1 3.33Å; R789-Y809 PolarHBondContact O-N 3.42Å
790	T	43.1	Very low	60.3	Low	86 Å²	86	53.9 Å²	53.9	53%	0.528	29%	0.289	S	S	.	.			trans	-126.8	-0.4	173.2	58	0	0	0	0	113.1	M792 Q808	T790-M792 PolarHBondContact O-N 2.8Å; T790-Q808 HydrophobicContact CG2-CG 3.82Å
791	T	56.8	Low	62	Low	65 Å²	65	53 Å²	53	40%	0.399	29%	0.285	S	S	.	.			trans	-74.7	118.2	178.7	-50.1	0	0	0	0	109.8	V793 Y809	T791-V793 HydrophobicContact CG2-CG2 4.41Å; T791-V793 WeakPolarHBondContact O-CG2 3.41Å; T791-V793 PolarHBondContact O-N 2.69Å; T791-Y809 WeakPolarHBondContact O-CE1 3.49Å; T791-Y809 PolarHBondContact O-OH 3.37Å
792	M	51	Low	64.1	Low	12 Å²	12	51.4 Å²	51.4	6%	0.059	27%	0.272	C	S	.	.			trans	-68.5	123.3	-179.4	-166.9	159.1	-85.8	0	0	112.9	C118 T121 R125 T790 M799 V803 R806	C118-M792 WeakPolarHBondContact CA-SD 3.44Å; C118-M792 HydrophobicContact CB-CE 3.53Å; C118-M792 HydrophobicContact CB-SD 3.67Å; C118-M792 WeakPolarHBondContact SG-CE 3.08Å; C118-M792 PolarHBondContact SG-SD 3.13Å; T121-M792 HydrophobicContact CG2-CB 3.93Å; T121-M792 HydrophobicContact CG2-SD 4.42Å; R125-M792 PolarHBondContact NH1-O 2.91Å; T790-M792 PolarHBondContact O-N 2.8Å; M792-M799 HydrophobicContact CE-CE 4.44Å; M792-M799 HydrophobicContact CG-CE 3.89Å; M792-M799 HydrophobicContact SD-CE 4.44Å; M792-V803 WeakPolarHBondContact CE-O 3.23Å; M792-R806 HydrophobicContact CE-CG 3.88Å
793	V	55	Low	65.8	Low	6 Å²	6	48.4 Å²	48.4	4%	0.036	25%	0.247	C	C	.	.			trans	-150.5	147.5	-177.6	-161.1	0	0	0	0	108.3	R754 F776 T791	R754-V793 HydrophobicContact CB-CB 4.07Å; R754-V793 HydrophobicContact CB-CG1 4.17Å; F776-V793 HydrophobicContact CB-CG1 3.71Å; F776-V793 HydrophobicContact CD1-CG1 3.36Å; F776-V793 HydrophobicContact CE1-CG1 4.28Å; F776-V793 HydrophobicContact CG-CG1 3.79Å; T791-V793 HydrophobicContact CG2-CG2 4.41Å; T791-V793 WeakPolarHBondContact O-CG2 3.41Å; T791-V793 PolarHBondContact O-N 2.69Å
794	G	56.9	Low	67.5	Low	20 Å²	20	40 Å²	40	21%	0.206	21%	0.211	C	C	.	.	S	Bend	trans	121.6	155.4	178.3	0	0	0	0	0	111.9	R754	R754-G794 WeakPolarHBondContact O-CA 3.4Å; R754-G794 PolarHBondContact O-N 2.8Å
795	T	71.8	Confident	69.6	Low	15 Å²	15	36.7 Å²	36.7	9%	0.092	19%	0.194	C	C	.	.			trans	-75.7	123.7	170.9	-52.6	0	0	0	0	109.1	D755 Y797 W798	D755-T795 PolarHBondContact OD1-N 3.05Å; D755-T795 PolarHBondContact OD1-OG1 3.45Å; T795-Y797 PolarHBondContact O-N 3.14Å; T795-Y797 VanDerWaalsContact O-N 3.11Å; T795-W798 HydrophobicContact CG2-CE3 3.69Å; T795-W798 HydrophobicContact CG2-CZ3 3.45Å; T795-W798 VanDerWaalsContact CG2-CZ3 3.45Å; T795-W798 PolarHBondContact O-N 3.29Å; T795-W798 VanDerWaalsContact O-N 3.07Å
796	P	82.2	Confident	71	Confident	7 Å²	7	34 Å²	34	5%	0.045	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-46.2	-45.6	-163.9	-39	40.9	0	0	0	118.4	W139 W798 M799 L841 I844	W139-P796 HydrophobicContact CH2-CB 4.43Å; W139-P796 HydrophobicContact CH2-CG 3.63Å; W139-P796 HydrophobicContact CZ3-CG 4.16Å; P796-W798 PolarHBondContact O-N 3.44Å; P796-M799 HydrophobicContact CG-SD 4.44Å; P796-M799 WeakPolarHBondContact O-CB 3.47Å; P796-M799 PolarHBondContact O-N 3Å; P796-L841 HydrophobicContact CB-CD1 4.48Å; P796-L841 HydrophobicContact CB-CD2 4.02Å; P796-L841 HydrophobicContact CB-CG 4.12Å; P796-I844 WeakPolarHBondContact O-CD1 3.17Å
797	Y	91	Very high	72.4	Confident	24 Å²	24	33.7 Å²	33.7	9%	0.094	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-64.4	-26.8	-175.8	-49.8	-79.9	0	0	0	113.5	T795 Y832 L833 E835 P837 A840	T795-Y797 PolarHBondContact O-N 3.14Å; T795-Y797 VanDerWaalsContact O-N 3.11Å; Y797-Y832 WeakPolarHBondContact CE1-O 3.48Å; Y797-L833 HydrophobicContact CD2-CD1 4.09Å; Y797-L833 HydrophobicContact CE2-CD1 3.9Å; Y797-E835 PolarHBondContact OH-O 3.45Å; Y797-P837 WeakPolarHBondContact OH-CG 3.29Å; Y797-A840 HydrophobicContact CD1-CB 3.83Å; Y797-A840 HydrophobicContact CE1-CB 3.6Å
798	W	93.3	Very high	73.9	Confident	17 Å²	17	34.8 Å²	34.8	6%	0.064	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-94.4	2.4	176	-59.5	-104.7	0	0	0	113.2	K757 T795 P796 S817 I820 E824 P830	K757-W798 HydrophobicContact CB-CD2 3.76Å; K757-W798 VanDerWaalsContact CB-CE2 3.48Å; K757-W798 HydrophobicContact CB-CE3 4.41Å; K757-W798 HydrophobicContact CB-CG 3.98Å; K757-W798 HydrophobicContact CB-CZ2 3.89Å; K757-W798 HydrophobicContact CD-CE3 4.48Å; K757-W798 HydrophobicContact CD-CH2 4.46Å; K757-W798 HydrophobicContact CD-CZ3 4.42Å; T795-W798 HydrophobicContact CG2-CE3 3.69Å; T795-W798 HydrophobicContact CG2-CZ3 3.45Å; T795-W798 VanDerWaalsContact CG2-CZ3 3.45Å; T795-W798 PolarHBondContact O-N 3.29Å; T795-W798 VanDerWaalsContact O-N 3.07Å; P796-W798 PolarHBondContact O-N 3.44Å; W798-S817 WeakPolarHBondContact O-CB 3.3Å; W798-S817 PolarHBondContact O-OG 3.02Å; W798-I820 HydrophobicContact CB-CB 4.48Å; W798-I820 HydrophobicContact CB-CG2 4.35Å; W798-I820 VanDerWaalsContact CD1-CG2 3.47Å; W798-I820 HydrophobicContact CD2-CG2 4.48Å; W798-I820 HydrophobicContact CG-CB 4.3Å; W798-I820 HydrophobicContact CG-CG2 3.84Å; W798-E824 WeakPolarHBondContact CZ2-OE1 3.21Å; W798-E824 PolarHBondContact NE1-OE2 3.07Å; W798-P830 HydrophobicContact CD2-CB 4.48Å; W798-P830 HydrophobicContact CH2-CG 3.78Å; W798-P830 HydrophobicContact CZ2-CB 4.07Å; W798-P830 HydrophobicContact CZ2-CG 3.69Å; W798-P830 HydrophobicContact CZ3-CG 4.29Å
799	M	90.5	Very high	75.2	Confident	6 Å²	6	31.3 Å²	31.3	3%	0.03	16%	0.157	C	C	.	.			trans	-75.1	138.3	-178	-71.6	177.6	54.5	0	0	112.4	M792 P796 V803 V804 W816 L841 I844	M792-M799 HydrophobicContact CE-CE 4.44Å; M792-M799 HydrophobicContact CG-CE 3.89Å; M792-M799 HydrophobicContact SD-CE 4.44Å; P796-M799 HydrophobicContact CG-SD 4.44Å; P796-M799 WeakPolarHBondContact O-CB 3.47Å; P796-M799 PolarHBondContact O-N 3Å; M799-V803 HydrophobicContact CE-CB 4.08Å; M799-V803 HydrophobicContact CE-CG1 3.65Å; M799-V804 HydrophobicContact CB-CG2 4.27Å; M799-V804 HydrophobicContact CE-CG2 4.24Å; M799-W816 PolarHBondContact O-NE1 3.34Å; M799-L841 HydrophobicContact CE-CD2 4.29Å; M799-L841 HydrophobicContact SD-CD2 4.14Å; M799-I844 WeakPolarHBondContact O-CG2 3.14Å
800	A	93.4	Very high	77.1	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.159	C	C	.	.			trans	-76.1	147.9	175.9	0	0	0	0	0	112.2	E802 V803 V804 I813 W816	A800-E802 VanDerWaalsContact CB-OE2 3.3Å; A800-E802 WeakPolarHBondContact CB-OE2 3.31Å; A800-E802 PolarHBondContact O-N 2.76Å; A800-E802 VanDerWaalsContact O-N 3.12Å; A800-V803 HydrophobicContact CB-CG2 4.22Å; A800-V803 WeakPolarHBondContact O-CA 3.34Å; A800-V803 WeakPolarHBondContact O-CB 3.25Å; A800-V803 PolarHBondContact O-N 3.23Å; A800-V804 PolarHBondContact O-N 2.98Å; A800-I813 HydrophobicContact CB-CB 4.22Å; A800-I813 HydrophobicContact CB-CG2 4.02Å; A800-W816 VanDerWaalsContact CA-CD1 3.47Å; A800-W816 HydrophobicContact CB-CB 3.65Å; A800-W816 HydrophobicContact CB-CD2 4.07Å; A800-W816 HydrophobicContact CB-CG 3.55Å
801	P	92.7	Very high	79.4	Confident	9 Å²	9	28.9 Å²	28.9	6%	0.058	15%	0.148	C	C	.	.	H	α-helix	trans	-57.3	-31.3	-176.8	-26.6	34.5	0	0	0	114	V803 V804 S805 W816 I844	P801-V803 VanDerWaalsContact C-N 3.28Å; P801-V803 PolarHBondContact O-N 2.97Å; P801-V804 PolarHBondContact O-N 3.08Å; P801-S805 WeakPolarHBondContact O-CB 3.23Å; P801-S805 PolarHBondContact O-N 3.24Å; P801-S805 PolarHBondContact O-OG 2.93Å; P801-W816 HydrophobicContact CG-CH2 3.66Å; P801-W816 HydrophobicContact CG-CZ2 3.77Å; P801-W816 HydrophobicContact CG-CZ3 4.15Å; P801-I844 HydrophobicContact CG-CG2 4.12Å
802	E	91.6	Very high	81.3	Confident	14 Å²	14	27.7 Å²	27.7	7%	0.065	14%	0.137	C	C	.	.	H	α-helix	trans	-69.6	-22.2	174.9	72	-91.4	-151.4	0	0	113.9	A800 K807 I813 A873 R876	A800-E802 VanDerWaalsContact CB-OE2 3.3Å; A800-E802 WeakPolarHBondContact CB-OE2 3.31Å; A800-E802 PolarHBondContact O-N 2.76Å; A800-E802 VanDerWaalsContact O-N 3.12Å; E802-K807 HydrophobicContact CB-CB 4.22Å; E802-K807 WeakPolarHBondContact O-CB 3.48Å; E802-K807 PolarHBondContact O-N 3.24Å; E802-I813 HydrophobicContact CG-CG2 4.19Å; E802-I813 WeakPolarHBondContact OE1-CG2 3.41Å; E802-A873 HydrophobicContact CG-CB 4.22Å; E802-A873 VanDerWaalsContact OE1-CB 3.3Å; E802-A873 WeakPolarHBondContact OE1-CB 3.48Å; E802-R876 IonicContact OE1-CZ 3.75Å; E802-R876 IonicContact OE1-NH1 3.1Å; E802-R876 PolarHBondContact OE1-NH1 3.34Å; E802-R876 IonicContact OE1-NH2 3.14Å; E802-R876 PolarHBondContact OE1-NH2 3.45Å; E802-R876 IonicContact OE2-CZ 2.79Å; E802-R876 IonicContact OE2-NH1 2.91Å; E802-R876 IonicContact OE2-NH2 2.66Å; E802-R876 PolarHBondContact OE2-NH2 3.11Å
803	V	87.3	Confident	83.4	Confident	4 Å²	4	27.3 Å²	27.3	2%	0.024	14%	0.136	C	C	.	.	H	α-helix	trans	-79.3	-43.5	174.1	-167.7	0	0	0	0	110	M792 M799 A800 P801 R806 Y809 I813	M792-V803 WeakPolarHBondContact CE-O 3.23Å; M799-V803 HydrophobicContact CE-CB 4.08Å; M799-V803 HydrophobicContact CE-CG1 3.65Å; A800-V803 HydrophobicContact CB-CG2 4.22Å; A800-V803 WeakPolarHBondContact O-CA 3.34Å; A800-V803 WeakPolarHBondContact O-CB 3.25Å; A800-V803 PolarHBondContact O-N 3.23Å; P801-V803 VanDerWaalsContact C-N 3.28Å; P801-V803 PolarHBondContact O-N 2.97Å; V803-R806 PolarHBondContact O-N 2.85Å; V803-R806 VanDerWaalsContact O-N 3.14Å; V803-Y809 HydrophobicContact CG1-CD1 4.28Å; V803-Y809 HydrophobicContact CG1-CE1 4.23Å; V803-Y809 HydrophobicContact CG2-CD1 4.13Å; V803-Y809 HydrophobicContact CG2-CG 4.22Å; V803-I813 HydrophobicContact CG2-CB 4.18Å; V803-I813 HydrophobicContact CG2-CD1 3.99Å; V803-I813 HydrophobicContact CG2-CG2 3.59Å
804	V	85.2	Confident	85.3	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61	-51.1	177.4	-174.8	0	0	0	0	110.6	V115 C118 M799 A800 P801 R806 L841 I844 A845	V115-V804 HydrophobicContact CG2-CG1 3.88Å; C118-V804 HydrophobicContact CB-CG1 4.48Å; M799-V804 HydrophobicContact CB-CG2 4.27Å; M799-V804 HydrophobicContact CE-CG2 4.24Å; A800-V804 PolarHBondContact O-N 2.98Å; P801-V804 PolarHBondContact O-N 3.08Å; V804-R806 PolarHBondContact O-N 3.23Å; V804-L841 HydrophobicContact CG1-CB 4.2Å; V804-L841 HydrophobicContact CG1-CD2 4.15Å; V804-L841 HydrophobicContact CG2-CD2 3.72Å; V804-I844 HydrophobicContact CG2-CG2 4.05Å; V804-A845 HydrophobicContact CB-CB 4.32Å; V804-A845 HydrophobicContact CG1-CB 3.99Å
805	S	82.2	Confident	87.3	Confident	7 Å²	7	26.1 Å²	26.1	5%	0.049	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	21.5	175.4	57	0	0	0	0	114.2	E114 P801 K807	E114-S805 WeakPolarHBondContact OE2-CA 3.47Å; E114-S805 WeakPolarHBondContact OE2-CB 3.34Å; P801-S805 WeakPolarHBondContact O-CB 3.23Å; P801-S805 PolarHBondContact O-N 3.24Å; P801-S805 PolarHBondContact O-OG 2.93Å; S805-K807 WeakPolarHBondContact O-CG 3.28Å; S805-K807 PolarHBondContact O-N 3.47Å; S805-K807 WeakPolarHBondContact OG-CD 3.46Å; S805-K807 WeakPolarHBondContact OG-CE 3.43Å; S805-K807 PolarHBondContact OG-NZ 2.91Å
806	R	73	Confident	88.5	Confident	77 Å²	77	25.4 Å²	25.4	29%	0.291	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	16.7	169.5	-67.2	171.3	159	-109.9	-28.4	115.7	Q117 T121 M792 V803 V804	Q117-R806 VanDerWaalsContact C-NH2 3.26Å; Q117-R806 PolarHBondContact O-NH2 3.36Å; T121-R806 PolarHBondContact OG1-NH2 2.98Å; M792-R806 HydrophobicContact CE-CG 3.88Å; V803-R806 PolarHBondContact O-N 2.85Å; V803-R806 VanDerWaalsContact O-N 3.14Å; V804-R806 PolarHBondContact O-N 3.23Å
807	K	76	Confident	89.3	Confident	121 Å²	121	25.5 Å²	25.5	53%	0.526	12%	0.12	S	C	.	.			trans	-70.6	164.2	-179.4	-73.8	156.8	-164.8	148	0	110	E802 S805 Y809	E802-K807 HydrophobicContact CB-CB 4.22Å; E802-K807 WeakPolarHBondContact O-CB 3.48Å; E802-K807 PolarHBondContact O-N 3.24Å; S805-K807 WeakPolarHBondContact O-CG 3.28Å; S805-K807 PolarHBondContact O-N 3.47Å; S805-K807 WeakPolarHBondContact OG-CD 3.46Å; S805-K807 WeakPolarHBondContact OG-CE 3.43Å; S805-K807 PolarHBondContact OG-NZ 2.91Å; K807-Y809 PolarHBondContact O-N 3.48Å
808	Q	76.8	Confident	89.6	Confident	110 Å²	110	24.3 Å²	24.3	51%	0.514	12%	0.116	S	C	.	.			trans	-70.1	108.2	174.5	-103	174.5	72	0	0	109.4	K788 R789 T790	K788-Q808 HydrophobicContact CB-CB 3.52Å; K788-Q808 HydrophobicContact CB-CG 3.83Å; K788-Q808 HydrophobicContact CD-CB 4.04Å; K788-Q808 WeakPolarHBondContact CD-O 3.47Å; K788-Q808 HydrophobicContact CG-CB 4.4Å; R789-Q808 CarbonylContact O-C 3.5Å; R789-Q808 WeakPolarHBondContact O-CA 3.39Å; T790-Q808 HydrophobicContact CG2-CG 3.82Å
809	Y	81.9	Confident	89.9	Confident	3 Å²	3	23.5 Å²	23.5	1%	0.012	11%	0.113	C	C	.	.	B	Isolated β-bridge	trans	-101.9	151.6	-177	69.4	-104.1	0	0	0	113.5	I752 R754 K788 R789 T791 V803 K807 I813	I752-Y809 HydrophobicContact CD1-CD2 4.37Å; I752-Y809 HydrophobicContact CD1-CE2 4.23Å; R754-Y809 WeakPolarHBondContact CD-OH 3.32Å; R754-Y809 PolarHBondContact NH1-OH 3.08Å; K788-Y809 CarbonylContact C-O 3.53Å; K788-Y809 WeakPolarHBondContact CA-O 3.4Å; K788-Y809 WeakPolarHBondContact CB-O 3.49Å; R789-Y809 HydrophobicContact CB-CD1 4.47Å; R789-Y809 HydrophobicContact CB-CD2 4.22Å; R789-Y809 HydrophobicContact CB-CE1 3.97Å; R789-Y809 HydrophobicContact CB-CE2 3.66Å; R789-Y809 PolarHBondContact N-O 3.31Å; R789-Y809 WeakPolarHBondContact O-CD1 3.33Å; R789-Y809 PolarHBondContact O-N 3.42Å; T791-Y809 WeakPolarHBondContact O-CE1 3.49Å; T791-Y809 PolarHBondContact O-OH 3.37Å; V803-Y809 HydrophobicContact CG1-CD1 4.28Å; V803-Y809 HydrophobicContact CG1-CE1 4.23Å; V803-Y809 HydrophobicContact CG2-CD1 4.13Å; V803-Y809 HydrophobicContact CG2-CG 4.22Å; K807-Y809 PolarHBondContact O-N 3.48Å; Y809-I813 HydrophobicContact CD2-CD1 3.54Å; Y809-I813 HydrophobicContact CD2-CG1 4.17Å; Y809-I813 HydrophobicContact CD2-CG2 4.19Å; Y809-I813 HydrophobicContact CE2-CD1 3.58Å; Y809-I813 HydrophobicContact CG-CD1 4.25Å; Y809-I813 HydrophobicContact CG-CG2 4.21Å
810	G	88.3	Confident	90.2	Very high	23 Å²	23	23.4 Å²	23.4	24%	0.237	11%	0.112	C	C	.	.			trans	-115.9	-163.2	175.7	0	0	0	0	0	112.5	K812 I813	G810-K812 PolarHBondContact O-N 2.9Å; G810-I813 PolarHBondContact O-N 3.06Å
811	H	91.5	Very high	90.4	Very high	67 Å²	67	23.4 Å²	23.4	31%	0.31	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-22.3	-177.8	61.1	-107.7	0	0	0	114.3	H747 I752 I813 D814	H747-H811 HydrophobicContact CB-CB 4.46Å; H747-H811 AromaticContact CE1-CD2 3.95Å; H747-H811 PolarHBondContact CE1-O 3.17Å; H747-H811 VanDerWaalsContact CE1-O 3.27Å; H747-H811 AromaticContact ND1-CD2 3.4Å; H747-H811 PolarHBondContact ND1-CD2 3.44Å; H747-H811 AromaticContact ND1-CG 3.76Å; I752-H811 HydrophobicContact CG1-CB 4.02Å; H811-I813 PolarHBondContact O-N 2.95Å; H811-D814 PolarHBondContact O-N 3.49Å; H811-D814 VanDerWaalsContact O-N 3.12Å
812	K	95.7	Very high	90.7	Very high	39 Å²	39	23 Å²	23	17%	0.17	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-1.1	178.6	-67.8	-176.1	173.5	-170.7	0	115.1	G810 W816 A873 Q874 R876	G810-K812 PolarHBondContact O-N 2.9Å; K812-W816 PolarHBondContact O-N 3.3Å; K812-A873 VanDerWaalsContact CD-O 3.31Å; K812-A873 WeakPolarHBondContact CD-O 3.34Å; K812-Q874 PolarHBondContact NZ-O 3.03Å; K812-R876 WeakPolarHBondContact CD-O 3.28Å; K812-R876 WeakPolarHBondContact CE-O 3.23Å; K812-R876 PolarHBondContact NZ-O 3.32Å; K812-R876 WeakPolarHBondContact O-CD 3.25Å; K812-R876 PolarHBondContact O-NH1 2.99Å
813	I	94.5	Very high	90.9	Very high	5 Å²	5	22.3 Å²	22.3	3%	0.026	11%	0.106	C	C	.	.	H	α-helix	trans	-72.3	-34.7	168.7	65.4	166.6	0	0	0	111.9	I752 R754 A800 E802 V803 Y809 G810 H811 I815 W816 S817	I752-I813 HydrophobicContact CG2-CD1 4.35Å; I752-I813 HydrophobicContact CG2-CG1 3.92Å; R754-I813 HydrophobicContact CB-CD1 4.21Å; R754-I813 HydrophobicContact CG-CD1 3.99Å; A800-I813 HydrophobicContact CB-CB 4.22Å; A800-I813 HydrophobicContact CB-CG2 4.02Å; E802-I813 HydrophobicContact CG-CG2 4.19Å; E802-I813 WeakPolarHBondContact OE1-CG2 3.41Å; V803-I813 HydrophobicContact CG2-CB 4.18Å; V803-I813 HydrophobicContact CG2-CD1 3.99Å; V803-I813 HydrophobicContact CG2-CG2 3.59Å; Y809-I813 HydrophobicContact CD2-CD1 3.54Å; Y809-I813 HydrophobicContact CD2-CG1 4.17Å; Y809-I813 HydrophobicContact CD2-CG2 4.19Å; Y809-I813 HydrophobicContact CE2-CD1 3.58Å; Y809-I813 HydrophobicContact CG-CD1 4.25Å; Y809-I813 HydrophobicContact CG-CG2 4.21Å; G810-I813 PolarHBondContact O-N 3.06Å; H811-I813 PolarHBondContact O-N 2.95Å; I813-I815 PolarHBondContact O-N 2.88Å; I813-W816 WeakPolarHBondContact O-CB 3.2Å; I813-W816 PolarHBondContact O-N 3.44Å; I813-W816 VanDerWaalsContact O-N 3.12Å; I813-S817 PolarHBondContact O-N 2.88Å; I813-S817 PolarHBondContact O-OG 3.26Å
814	D	96.4	Very high	91.4	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-63.3	-27.6	175.9	-62.9	-22.3	0	0	0	111.4	L743 H747 I752 H753 R754 I756 H811 L818	L743-D814 HydrophobicContact CD1-CB 4.23Å; L743-D814 HydrophobicContact CD2-CB 3.75Å; H747-D814 IonicContact CD2-OD2 2.81Å; H747-D814 IonicContact CE1-OD2 3.93Å; H747-D814 IonicContact NE2-OD2 2.65Å; H747-D814 PolarHBondContact NE2-OD2 3.17Å; I752-D814 WeakPolarHBondContact CG2-OD1 3.22Å; I752-D814 WeakPolarHBondContact CG2-OD2 3.49Å; H753-D814 PolarHBondContact N-OD1 3.43Å; H753-D814 PolarHBondContact N-OD2 3.24Å; R754-D814 PolarHBondContact N-OD1 2.91Å; I756-D814 HydrophobicContact CG1-CB 3.99Å; H811-D814 PolarHBondContact O-N 3.49Å; H811-D814 VanDerWaalsContact O-N 3.12Å; D814-L818 WeakPolarHBondContact O-CB 3.49Å; D814-L818 PolarHBondContact O-N 3.16Å
815	I	98.2	Very high	91.9	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-74.2	-36.2	176.9	-58.3	-54	0	0	0	112.1	L740 L743 I813 G819 C868 R876 A879 L882	L740-I815 HydrophobicContact CD2-CD1 4.36Å; L743-I815 HydrophobicContact CD1-CD1 4.21Å; I813-I815 PolarHBondContact O-N 2.88Å; I815-G819 PolarHBondContact O-N 2.98Å; I815-C868 HydrophobicContact CG2-CB 4.36Å; I815-R876 HydrophobicContact CG2-CG 4.25Å; I815-A879 HydrophobicContact CD1-CB 4.07Å; I815-L882 HydrophobicContact CD1-CD1 4.11Å; I815-L882 HydrophobicContact CG2-CD1 3.37Å
816	W	97.9	Very high	92.6	Very high	1 Å²	1	24.9 Å²	24.9	0%	0.004	12%	0.119	C	C	.	.	H	α-helix	trans	-63.7	-49.3	170.6	178.7	-83.4	0	0	0	110.4	M799 A800 P801 K812 I813 L818 G819 I820 G848 L869 V871	M799-W816 PolarHBondContact O-NE1 3.34Å; A800-W816 VanDerWaalsContact CA-CD1 3.47Å; A800-W816 HydrophobicContact CB-CB 3.65Å; A800-W816 HydrophobicContact CB-CD2 4.07Å; A800-W816 HydrophobicContact CB-CG 3.55Å; P801-W816 HydrophobicContact CG-CH2 3.66Å; P801-W816 HydrophobicContact CG-CZ2 3.77Å; P801-W816 HydrophobicContact CG-CZ3 4.15Å; K812-W816 PolarHBondContact O-N 3.3Å; I813-W816 WeakPolarHBondContact O-CB 3.2Å; I813-W816 PolarHBondContact O-N 3.44Å; I813-W816 VanDerWaalsContact O-N 3.12Å; W816-L818 VanDerWaalsContact C-N 3.3Å; W816-L818 PolarHBondContact O-N 3.18Å; W816-G819 CarbonylContact O-C 3.53Å; W816-G819 VanDerWaalsContact O-CA 3.31Å; W816-G819 WeakPolarHBondContact O-CA 3.33Å; W816-G819 PolarHBondContact O-N 3.23Å; W816-I820 PolarHBondContact O-N 2.87Å; W816-G848 VanDerWaalsContact CH2-O 3.25Å; W816-G848 WeakPolarHBondContact CH2-O 3.25Å; W816-G848 WeakPolarHBondContact CZ2-O 3.48Å; W816-L869 HydrophobicContact CD2-CD2 3.87Å; W816-L869 HydrophobicContact CE3-CB 4.47Å; W816-L869 HydrophobicContact CE3-CD2 4.1Å; W816-L869 HydrophobicContact CG-CD2 4.29Å; W816-L869 HydrophobicContact CH2-CD2 4.5Å; W816-L869 HydrophobicContact CZ2-CD2 4.28Å; W816-L869 HydrophobicContact CZ3-CB 4.24Å; W816-L869 HydrophobicContact CZ3-CD2 4.42Å; W816-L869 VanDerWaalsContact CZ3-O 3.3Å; W816-L869 WeakPolarHBondContact CZ3-O 3.44Å; W816-V871 HydrophobicContact CZ3-CG2 4.43Å
817	S	97.6	Very high	93.5	Very high	8 Å²	8	24 Å²	24	6%	0.056	12%	0.118	C	C	.	.	H	α-helix	trans	-61.2	-36.7	179	-55.2	0	0	0	0	112.5	I756 W798 I813 I820 M821	I756-S817 WeakPolarHBondContact O-CB 3.27Å; W798-S817 WeakPolarHBondContact O-CB 3.3Å; W798-S817 PolarHBondContact O-OG 3.02Å; I813-S817 PolarHBondContact O-N 2.88Å; I813-S817 PolarHBondContact O-OG 3.26Å; S817-I820 PolarHBondContact O-N 3.49Å; S817-M821 WeakPolarHBondContact O-CB 3.41Å; S817-M821 PolarHBondContact O-N 3.08Å
818	L	98.3	Very high	94.3	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60.8	-40.7	167.8	173.5	65.8	0	0	0	112.2	T739 L740 L743 D814 W816 M821 T822 F864	T739-L818 HydrophobicContact CG2-CD1 3.94Å; L740-L818 HydrophobicContact CD1-CD2 4.33Å; L740-L818 HydrophobicContact CD2-CD2 3.53Å; L740-L818 HydrophobicContact CG-CD2 3.71Å; L743-L818 HydrophobicContact CD1-CD2 4.35Å; D814-L818 WeakPolarHBondContact O-CB 3.49Å; D814-L818 PolarHBondContact O-N 3.16Å; W816-L818 VanDerWaalsContact C-N 3.3Å; W816-L818 PolarHBondContact O-N 3.18Å; L818-M821 HydrophobicContact CD1-CE 4.02Å; L818-M821 PolarHBondContact O-N 3.01Å; L818-T822 WeakPolarHBondContact O-CB 3.36Å; L818-T822 PolarHBondContact O-N 2.66Å; L818-T822 PolarHBondContact O-OG1 3.21Å; L818-F864 HydrophobicContact CD2-CZ 4.46Å
819	G	98.3	Very high	95	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-61.3	-42.6	173.7	0	0	0	0	0	112.7	I815 W816 T822 L823	I815-G819 PolarHBondContact O-N 2.98Å; W816-G819 CarbonylContact O-C 3.53Å; W816-G819 VanDerWaalsContact O-CA 3.31Å; W816-G819 WeakPolarHBondContact O-CA 3.33Å; W816-G819 PolarHBondContact O-N 3.23Å; G819-T822 WeakPolarHBondContact O-CB 3.4Å; G819-T822 PolarHBondContact O-N 3.22Å; G819-T822 VanDerWaalsContact O-N 3.15Å; G819-L823 PolarHBondContact O-N 3.06Å
820	I	98	Very high	95.6	Very high	3 Å²	3	19.5 Å²	19.5	2%	0.015	11%	0.11	C	C	.	.	H	α-helix	trans	-64.7	-44.6	174.3	-60.3	-59.7	0	0	0	111	W798 W816 S817 T822 L823 E824 P830 P831 P850 L869	W798-I820 HydrophobicContact CB-CB 4.48Å; W798-I820 HydrophobicContact CB-CG2 4.35Å; W798-I820 VanDerWaalsContact CD1-CG2 3.47Å; W798-I820 HydrophobicContact CD2-CG2 4.48Å; W798-I820 HydrophobicContact CG-CB 4.3Å; W798-I820 HydrophobicContact CG-CG2 3.84Å; W816-I820 PolarHBondContact O-N 2.87Å; S817-I820 PolarHBondContact O-N 3.49Å; I820-T822 PolarHBondContact O-N 3.39Å; I820-L823 WeakPolarHBondContact O-CB 3.39Å; I820-L823 PolarHBondContact O-N 3.06Å; I820-E824 WeakPolarHBondContact O-CB 3.42Å; I820-E824 PolarHBondContact O-N 3.18Å; I820-P830 HydrophobicContact CG2-CB 3.7Å; I820-P831 HydrophobicContact CD1-CG 4.49Å; I820-P850 HydrophobicContact CD1-CG 3.9Å; I820-L869 HydrophobicContact CD1-CD2 3.79Å; I820-L869 HydrophobicContact CG1-CD2 4.1Å
821	M	97.8	Very high	95.9	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-62.3	-23.2	173.5	-164.3	-172.1	90.2	0	0	112.9	L718 V735 T739 I756 I761 S817 L818 M825	L718-M821 HydrophobicContact CD2-CE 3.88Å; L718-M821 HydrophobicContact CD2-CG 4.29Å; L718-M821 HydrophobicContact CD2-SD 4.09Å; V735-M821 HydrophobicContact CG1-CE 4.15Å; T739-M821 HydrophobicContact CG2-CE 4.36Å; I756-M821 HydrophobicContact CG2-SD 4.27Å; I761-M821 HydrophobicContact CD1-SD 4.44Å; I761-M821 HydrophobicContact CG1-CE 4.08Å; I761-M821 HydrophobicContact CG1-SD 3.65Å; S817-M821 WeakPolarHBondContact O-CB 3.41Å; S817-M821 PolarHBondContact O-N 3.08Å; L818-M821 HydrophobicContact CD1-CE 4.02Å; L818-M821 PolarHBondContact O-N 3.01Å; M821-M825 HydrophobicContact CE-CE 3.99Å; M821-M825 WeakPolarHBondContact O-CE 3.36Å; M821-M825 WeakPolarHBondContact O-CG 3.47Å; M821-M825 PolarHBondContact O-N 3.21Å
822	T	98.3	Very high	96	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-78.4	-36	173.5	-51	0	0	0	0	111.4	I732 L818 G819 I820 L826 L861 F864 L865	I732-T822 HydrophobicContact CG2-CG2 3.89Å; L818-T822 WeakPolarHBondContact O-CB 3.36Å; L818-T822 PolarHBondContact O-N 2.66Å; L818-T822 PolarHBondContact O-OG1 3.21Å; G819-T822 WeakPolarHBondContact O-CB 3.4Å; G819-T822 PolarHBondContact O-N 3.22Å; G819-T822 VanDerWaalsContact O-N 3.15Å; I820-T822 PolarHBondContact O-N 3.39Å; T822-L826 WeakPolarHBondContact O-CD1 3.38Å; T822-L826 VanDerWaalsContact O-CG 3.29Å; T822-L826 WeakPolarHBondContact O-CG 3.5Å; T822-L826 PolarHBondContact O-N 2.93Å; T822-L861 HydrophobicContact CG2-CD1 4.04Å; T822-F864 HydrophobicContact CG2-CD1 4.33Å; T822-F864 HydrophobicContact CG2-CE1 4.23Å; T822-L865 HydrophobicContact CG2-CD2 3.74Å; T822-L865 HydrophobicContact CG2-CG 4.37Å
823	L	96.9	Very high	95.7	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-67.7	-38.2	169.6	-65.1	179.7	0	0	0	111.7	G819 I820 M825 L826 E827 P831 P850 F852 L865 L869	G819-L823 PolarHBondContact O-N 3.06Å; I820-L823 WeakPolarHBondContact O-CB 3.39Å; I820-L823 PolarHBondContact O-N 3.06Å; L823-M825 PolarHBondContact O-N 3.15Å; L823-L826 HydrophobicContact CD2-CD1 4.48Å; L823-L826 CarbonylContact O-C 3.59Å; L823-L826 WeakPolarHBondContact O-CA 3.4Å; L823-L826 WeakPolarHBondContact O-CB 3.29Å; L823-L826 PolarHBondContact O-N 2.87Å; L823-E827 PolarHBondContact O-N 3.46Å; L823-P831 HydrophobicContact CB-CG 4.43Å; L823-P831 HydrophobicContact CD1-CG 3.67Å; L823-P850 HydrophobicContact CD1-CB 4.24Å; L823-P850 HydrophobicContact CD1-CG 4.44Å; L823-F852 HydrophobicContact CD1-CD1 4.25Å; L823-F852 HydrophobicContact CD2-CB 4.03Å; L823-F852 HydrophobicContact CD2-CD1 3.7Å; L823-F852 HydrophobicContact CD2-CD2 3.7Å; L823-F852 HydrophobicContact CD2-CE1 4.01Å; L823-F852 HydrophobicContact CD2-CE2 4.01Å; L823-F852 HydrophobicContact CD2-CG 3.54Å; L823-F852 HydrophobicContact CD2-CZ 4.17Å; L823-L865 HydrophobicContact CD2-CD1 3.9Å; L823-L865 HydrophobicContact CD2-CD2 3.83Å; L823-L865 HydrophobicContact CD2-CG 4.5Å; L823-L865 HydrophobicContact CG-CD2 4.08Å; L823-L869 HydrophobicContact CD1-CD1 3.71Å; L823-L869 HydrophobicContact CG-CD1 4.18Å
824	E	96	Very high	95.5	Very high	9 Å²	9	23.9 Å²	23.9	4%	0.042	14%	0.137	C	C	.	.	H	α-helix	trans	-57.3	-46.2	175.4	-169.1	-179.8	-177.3	0	0	111.7	I722 S758 W798 I820 L826 G828	I722-E824 HydrophobicContact CD1-CG 4.01Å; I722-E824 WeakPolarHBondContact CG2-O 3.49Å; S758-E824 WeakPolarHBondContact CB-OE1 3.37Å; S758-E824 PolarHBondContact OG-OE1 3.06Å; W798-E824 WeakPolarHBondContact CZ2-OE1 3.21Å; W798-E824 PolarHBondContact NE1-OE2 3.07Å; I820-E824 WeakPolarHBondContact O-CB 3.42Å; I820-E824 PolarHBondContact O-N 3.18Å; E824-L826 PolarHBondContact O-N 3.21Å; E824-G828 CarbonylContact O-C 3.51Å; E824-G828 WeakPolarHBondContact O-CA 3.28Å; E824-G828 PolarHBondContact O-N 3.45Å
825	M	97.4	Very high	95.2	Very high	8 Å²	8	27.6 Å²	27.6	4%	0.039	15%	0.154	C	C	.	.	H	α-helix	trans	-66.9	-10.6	172.6	-71.6	-175.9	-80.2	0	0	114.9	L718 I722 M727 I732 V735 M821 L823	L718-M825 HydrophobicContact CD1-SD 4.31Å; L718-M825 HydrophobicContact CD2-CG 4.35Å; L718-M825 HydrophobicContact CD2-SD 4.04Å; I722-M825 HydrophobicContact CD1-CB 4.37Å; I722-M825 HydrophobicContact CD1-CG 3.51Å; I722-M825 HydrophobicContact CG1-CG 3.91Å; M727-M825 HydrophobicContact CE-SD 3.98Å; M727-M825 HydrophobicContact SD-CB 4.16Å; M727-M825 HydrophobicContact SD-CG 3.74Å; M727-M825 HydrophobicContact SD-SD 3.8Å; I732-M825 HydrophobicContact CD1-CB 4.08Å; I732-M825 HydrophobicContact CG1-CB 3.94Å; I732-M825 HydrophobicContact CG1-SD 4.35Å; I732-M825 HydrophobicContact CG2-CE 4.06Å; I732-M825 HydrophobicContact CG2-SD 4.42Å; V735-M825 HydrophobicContact CB-CE 4.46Å; V735-M825 HydrophobicContact CB-SD 4.02Å; V735-M825 HydrophobicContact CG1-CE 4.14Å; V735-M825 HydrophobicContact CG1-SD 3.9Å; M821-M825 HydrophobicContact CE-CE 3.99Å; M821-M825 WeakPolarHBondContact O-CE 3.36Å; M821-M825 WeakPolarHBondContact O-CG 3.47Å; M821-M825 PolarHBondContact O-N 3.21Å; L823-M825 PolarHBondContact O-N 3.15Å
826	L	95.2	Very high	94.8	Very high	49 Å²	49	29.7 Å²	29.7	26%	0.257	17%	0.165	S	C	.	.	H	α-helix	trans	-103.9	-36.2	180	-71.1	166.5	0	0	0	113.3	I732 T822 L823 E824 L857 L861 L865	I732-L826 HydrophobicContact CD1-CD2 3.41Å; I732-L826 VanDerWaalsContact CD1-CD2 3.41Å; I732-L826 HydrophobicContact CD1-CG 3.86Å; T822-L826 WeakPolarHBondContact O-CD1 3.38Å; T822-L826 VanDerWaalsContact O-CG 3.29Å; T822-L826 WeakPolarHBondContact O-CG 3.5Å; T822-L826 PolarHBondContact O-N 2.93Å; L823-L826 HydrophobicContact CD2-CD1 4.48Å; L823-L826 CarbonylContact O-C 3.59Å; L823-L826 WeakPolarHBondContact O-CA 3.4Å; L823-L826 WeakPolarHBondContact O-CB 3.29Å; L823-L826 PolarHBondContact O-N 2.87Å; E824-L826 PolarHBondContact O-N 3.21Å; L826-L857 HydrophobicContact CD1-CD1 4.34Å; L826-L857 HydrophobicContact CD2-CD2 3.99Å; L826-L861 HydrophobicContact CD1-CD1 4.36Å; L826-L861 HydrophobicContact CD1-CD2 3.98Å; L826-L861 HydrophobicContact CD2-CD2 3.87Å; L826-L865 HydrophobicContact CD1-CD1 3.95Å
827	E	92.8	Very high	94.3	Very high	57 Å²	57	30.7 Å²	30.7	27%	0.266	17%	0.172	S	C	.	.	H	α-helix	trans	-110.8	-11.8	-174.5	-58.3	-154.1	99.8	0	0	113.7	L823 F852 R853	L823-E827 PolarHBondContact O-N 3.46Å; E827-F852 WeakPolarHBondContact OE2-CB 3.3Å; E827-R853 IonicContact OE1-CZ 3.17Å; E827-R853 PolarHBondContact OE1-N 2.82Å; E827-R853 IonicContact OE1-NE 3.7Å; E827-R853 PolarHBondContact OE1-NE 3.42Å; E827-R853 IonicContact OE1-NH2 2.81Å; E827-R853 PolarHBondContact OE1-NH2 2.86Å
828	G	92.2	Very high	93.9	Very high	39 Å²	39	30.3 Å²	30.3	40%	0.402	17%	0.169	S	C	.	.	S	Bend	trans	96.2	-19	179.2	0	0	0	0	0	114.3	E824	E824-G828 CarbonylContact O-C 3.51Å; E824-G828 WeakPolarHBondContact O-CA 3.28Å; E824-G828 PolarHBondContact O-N 3.45Å
829	E	92.4	Very high	93.6	Very high	98 Å²	98	31.4 Å²	31.4	46%	0.458	17%	0.174	S	C	.	.	S	Bend	trans	-144.8	155	-179.2	57.1	176.3	-171.8	0	0	110.8	L833	E829-L833 HydrophobicContact CB-CB 4.34Å; E829-L833 HydrophobicContact CB-CD2 3.81Å
830	P	94.4	Very high	93.2	Very high	3 Å²	3	31.4 Å²	31.4	2%	0.019	17%	0.174	C	C	.	.			trans	-69.3	150.4	170.6	31.9	-37.5	0	0	0	110.9	W798 I820 Y832 L833	W798-P830 HydrophobicContact CD2-CB 4.48Å; W798-P830 HydrophobicContact CH2-CG 3.78Å; W798-P830 HydrophobicContact CZ2-CB 4.07Å; W798-P830 HydrophobicContact CZ2-CG 3.69Å; W798-P830 HydrophobicContact CZ3-CG 4.29Å; I820-P830 HydrophobicContact CG2-CB 3.7Å; P830-Y832 PolarHBondContact O-N 3.49Å; P830-L833 HydrophobicContact CG-CB 4.25Å; P830-L833 HydrophobicContact CG-CD1 4.3Å; P830-L833 WeakPolarHBondContact O-CB 3.33Å; P830-L833 PolarHBondContact O-N 3.46Å
831	P	94.3	Very high	92.9	Very high	17 Å²	17	31.3 Å²	31.3	11%	0.11	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	140.1	178.3	-27.1	36.7	0	0	0	113	I820 L823 L833 P850	I820-P831 HydrophobicContact CD1-CG 4.49Å; L823-P831 HydrophobicContact CB-CG 4.43Å; L823-P831 HydrophobicContact CD1-CG 3.67Å; P831-L833 VanDerWaalsContact C-N 3.3Å; P831-L833 PolarHBondContact O-N 2.99Å; P831-P850 HydrophobicContact CB-CB 3.81Å; P831-P850 HydrophobicContact CB-CG 4.06Å; P831-P850 HydrophobicContact CG-CB 3.75Å; P831-P850 HydrophobicContact CG-CG 3.96Å
832	Y	93.6	Very high	92.7	Very high	47 Å²	47	31.5 Å²	31.5	18%	0.184	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	15.4	-179.1	-38.7	-61.7	0	0	0	115.5	Y797 P830 S834 E835 L843 I844 N847 P850	Y797-Y832 WeakPolarHBondContact CE1-O 3.48Å; P830-Y832 PolarHBondContact O-N 3.49Å; Y832-S834 PolarHBondContact O-N 3.26Å; Y832-E835 WeakPolarHBondContact O-CB 3.37Å; Y832-E835 PolarHBondContact O-N 3.03Å; Y832-L843 HydrophobicContact CD1-CB 4.37Å; Y832-L843 HydrophobicContact CD1-CD1 3.81Å; Y832-L843 HydrophobicContact CD2-CB 4.36Å; Y832-L843 HydrophobicContact CE1-CB 4.26Å; Y832-L843 HydrophobicContact CE1-CD1 4.18Å; Y832-L843 HydrophobicContact CE2-CB 4.22Å; Y832-L843 HydrophobicContact CG-CB 4.43Å; Y832-L843 HydrophobicContact CG-CD1 4.26Å; Y832-I844 HydrophobicContact CD2-CG1 3.97Å; Y832-I844 HydrophobicContact CE2-CG1 4.08Å; Y832-N847 PolarHBondContact OH-ND2 3.04Å; Y832-P850 HydrophobicContact CE2-CG 4.44Å
833	L	90.5	Very high	92.4	Very high	72 Å²	72	32.8 Å²	32.8	38%	0.377	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-38.9	177.3	-174.8	64.9	0	0	0	112.8	Y797 E829 P830 P831 E835	Y797-L833 HydrophobicContact CD2-CD1 4.09Å; Y797-L833 HydrophobicContact CE2-CD1 3.9Å; E829-L833 HydrophobicContact CB-CB 4.34Å; E829-L833 HydrophobicContact CB-CD2 3.81Å; P830-L833 HydrophobicContact CG-CB 4.25Å; P830-L833 HydrophobicContact CG-CD1 4.3Å; P830-L833 WeakPolarHBondContact O-CB 3.33Å; P830-L833 PolarHBondContact O-N 3.46Å; P831-L833 VanDerWaalsContact C-N 3.3Å; P831-L833 PolarHBondContact O-N 2.99Å; L833-E835 PolarHBondContact O-N 3.42Å
834	S	89.6	Confident	92.2	Very high	91 Å²	91	33 Å²	33	64%	0.636	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-12.4	177	64.3	0	0	0	0	115.1	Y832	Y832-S834 PolarHBondContact O-N 3.26Å
835	E	90	Very high	92	Very high	77 Å²	77	33.7 Å²	33.7	36%	0.36	19%	0.189	S	C	.	.	S	Bend	trans	-87.7	151.7	-179.2	-63.6	-70.6	155.2	0	0	111.1	Y797 Y832 L833 K839 A840 L843	Y797-E835 PolarHBondContact OH-O 3.45Å; Y832-E835 WeakPolarHBondContact O-CB 3.37Å; Y832-E835 PolarHBondContact O-N 3.03Å; L833-E835 PolarHBondContact O-N 3.42Å; E835-K839 HydrophobicContact CB-CB 4.45Å; E835-K839 HydrophobicContact CB-CG 4.45Å; E835-K839 WeakPolarHBondContact OE2-CG 3.41Å; E835-A840 HydrophobicContact CB-CB 4.31Å; E835-L843 HydrophobicContact CG-CD1 4Å
836	N	88.6	Confident	91.8	Very high	44 Å²	44	35.7 Å²	35.7	24%	0.235	20%	0.202	C	C	.	.			trans	-52.4	133.1	168.3	-178.9	-57.6	0	0	0	109.1	A97 A98 L838 K839 A840	A97-N836 PolarHBondContact O-ND2 3.11Å; A98-N836 HydrophobicContact CB-CB 4.03Å; N836-L838 PolarHBondContact O-N 2.91Å; N836-L838 PolarHBondContact OD1-N 3.16Å; N836-K839 HydrophobicContact CB-CB 4.15Å; N836-K839 CarbonylContact O-C 3.54Å; N836-K839 WeakPolarHBondContact O-CA 3.37Å; N836-K839 VanDerWaalsContact O-CB 3.29Å; N836-K839 WeakPolarHBondContact O-CB 3.39Å; N836-K839 PolarHBondContact O-N 3.25Å; N836-A840 PolarHBondContact O-N 2.87Å
837	P	87.9	Confident	91.6	Very high	23 Å²	23	37.3 Å²	37.3	15%	0.149	21%	0.211	C	C	.	.	H	α-helix	trans	-57	-27.8	-174.5	-22.7	27.6	0	0	0	114.8	Y119 W139 Y797 L841	Y119-P837 HydrophobicContact CE2-CB 3.99Å; W139-P837 HydrophobicContact CE3-CB 4.36Å; W139-P837 HydrophobicContact CE3-CG 4.03Å; W139-P837 HydrophobicContact CH2-CB 3.97Å; W139-P837 HydrophobicContact CH2-CG 4.03Å; W139-P837 HydrophobicContact CZ3-CB 3.43Å; W139-P837 VanDerWaalsContact CZ3-CB 3.43Å; W139-P837 HydrophobicContact CZ3-CG 3.46Å; W139-P837 VanDerWaalsContact CZ3-CG 3.46Å; Y797-P837 WeakPolarHBondContact OH-CG 3.29Å; P837-L841 WeakPolarHBondContact O-CB 3.49Å; P837-L841 WeakPolarHBondContact O-CD1 3.42Å; P837-L841 WeakPolarHBondContact O-CG 3.26Å; P837-L841 PolarHBondContact O-N 3.31Å
838	L	89.8	Confident	91.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-72.5	-36.2	173.2	-179.3	146	0	0	0	112.1	W94 L95 A98 I100 V115 L116 Y119 N836 Y842	W94-L838 HydrophobicContact CB-CD1 4.03Å; L95-L838 HydrophobicContact CD2-CD2 4.21Å; A98-L838 HydrophobicContact CB-CB 4.07Å; A98-L838 HydrophobicContact CB-CD2 3.45Å; A98-L838 VanDerWaalsContact CB-CD2 3.45Å; A98-L838 HydrophobicContact CB-CG 4.35Å; I100-L838 HydrophobicContact CD1-CD2 3.45Å; I100-L838 VanDerWaalsContact CD1-CD2 3.45Å; I100-L838 HydrophobicContact CG1-CD2 4.25Å; V115-L838 HydrophobicContact CG1-CG 4.15Å; V115-L838 WeakPolarHBondContact CG1-O 3.37Å; L116-L838 HydrophobicContact CD2-CD1 3.68Å; L116-L838 HydrophobicContact CG-CD1 4.34Å; Y119-L838 HydrophobicContact CD1-CB 3.95Å; Y119-L838 HydrophobicContact CD1-CD1 3.53Å; Y119-L838 HydrophobicContact CD1-CG 4.29Å; Y119-L838 HydrophobicContact CD2-CB 4.19Å; Y119-L838 HydrophobicContact CE1-CB 4.22Å; Y119-L838 HydrophobicContact CE1-CD1 4.29Å; Y119-L838 HydrophobicContact CE2-CB 4.49Å; Y119-L838 HydrophobicContact CG-CB 3.9Å; Y119-L838 HydrophobicContact CG-CD1 3.89Å; Y119-L838 HydrophobicContact CG-CG 4.31Å; N836-L838 PolarHBondContact O-N 2.91Å; N836-L838 PolarHBondContact OD1-N 3.16Å; L838-Y842 PolarHBondContact O-N 3.26Å
839	K	91.2	Very high	91.7	Very high	23 Å²	23	36 Å²	36	10%	0.1	20%	0.195	C	C	.	.	H	α-helix	trans	-68.2	-43.2	171.8	-174.6	66.1	163.1	-161.1	0	111	A98 D99 I100 E104 E835 N836 L841 Y842 L843	A98-K839 HydrophobicContact CB-CB 4.26Å; A98-K839 WeakPolarHBondContact O-CB 3.49Å; A98-K839 WeakPolarHBondContact O-CD 3.31Å; D99-K839 PolarHBondContact O-NZ 3.42Å; I100-K839 HydrophobicContact CG1-CD 3.83Å; E104-K839 VanDerWaalsContact CD-NZ 3.34Å; E104-K839 IonicContact OE1-NZ 2.71Å; E104-K839 PolarHBondContact OE1-NZ 2.78Å; E104-K839 IonicContact OE2-NZ 3.18Å; E104-K839 PolarHBondContact OE2-NZ 3.09Å; E835-K839 HydrophobicContact CB-CB 4.45Å; E835-K839 HydrophobicContact CB-CG 4.45Å; E835-K839 WeakPolarHBondContact OE2-CG 3.41Å; N836-K839 HydrophobicContact CB-CB 4.15Å; N836-K839 CarbonylContact O-C 3.54Å; N836-K839 WeakPolarHBondContact O-CA 3.37Å; N836-K839 VanDerWaalsContact O-CB 3.29Å; N836-K839 WeakPolarHBondContact O-CB 3.39Å; N836-K839 PolarHBondContact O-N 3.25Å; K839-L841 PolarHBondContact O-N 3.05Å; K839-Y842 WeakPolarHBondContact O-CB 3.3Å; K839-Y842 PolarHBondContact O-N 2.87Å; K839-Y842 VanDerWaalsContact O-N 3.13Å; K839-L843 HydrophobicContact CG-CD1 4.06Å; K839-L843 HydrophobicContact CG-CG 4.44Å; K839-L843 VanDerWaalsContact O-CG 3.31Å; K839-L843 WeakPolarHBondContact O-CG 3.45Å; K839-L843 PolarHBondContact O-N 3.27Å
840	A	91.3	Very high	91.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-58.2	-45.7	173.8	0	0	0	0	0	111.7	Y797 E835 N836 Y842 L843 I844	Y797-A840 HydrophobicContact CD1-CB 3.83Å; Y797-A840 HydrophobicContact CE1-CB 3.6Å; E835-A840 HydrophobicContact CB-CB 4.31Å; N836-A840 PolarHBondContact O-N 2.87Å; A840-Y842 VanDerWaalsContact C-N 3.34Å; A840-Y842 PolarHBondContact O-N 3.46Å; A840-L843 PolarHBondContact O-N 3.28Å; A840-I844 WeakPolarHBondContact O-CB 3.38Å; A840-I844 WeakPolarHBondContact O-CD1 3.43Å; A840-I844 VanDerWaalsContact O-CG1 3.23Å; A840-I844 WeakPolarHBondContact O-CG1 3.3Å; A840-I844 PolarHBondContact O-N 3.43Å
841	L	90.9	Very high	91.6	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60	-40.8	173.5	-74.2	167.3	0	0	0	112.5	V115 Y119 P796 M799 V804 P837 K839 A845	V115-L841 HydrophobicContact CG1-CB 3.94Å; Y119-L841 HydrophobicContact CD2-CD1 4.2Å; P796-L841 HydrophobicContact CB-CD1 4.48Å; P796-L841 HydrophobicContact CB-CD2 4.02Å; P796-L841 HydrophobicContact CB-CG 4.12Å; M799-L841 HydrophobicContact CE-CD2 4.29Å; M799-L841 HydrophobicContact SD-CD2 4.14Å; V804-L841 HydrophobicContact CG1-CB 4.2Å; V804-L841 HydrophobicContact CG1-CD2 4.15Å; V804-L841 HydrophobicContact CG2-CD2 3.72Å; P837-L841 WeakPolarHBondContact O-CB 3.49Å; P837-L841 WeakPolarHBondContact O-CD1 3.42Å; P837-L841 WeakPolarHBondContact O-CG 3.26Å; P837-L841 PolarHBondContact O-N 3.31Å; K839-L841 PolarHBondContact O-N 3.05Å; L841-A845 PolarHBondContact O-N 3.06Å
842	Y	92.6	Very high	91.5	Very high	5 Å²	5	37.9 Å²	37.9	2%	0.02	21%	0.206	C	C	.	.	H	α-helix	trans	-61.4	-50.7	173.4	176.8	-99.2	0	0	0	111.6	I100 E104 L111 V112 L838 K839 A840 I844 A845 T846	I100-Y842 HydrophobicContact CD1-CD1 4.42Å; I100-Y842 HydrophobicContact CD1-CD2 4.21Å; I100-Y842 HydrophobicContact CD1-CG 3.9Å; E104-Y842 HydrophobicContact CB-CE1 4.09Å; E104-Y842 WeakPolarHBondContact CB-OH 3.44Å; E104-Y842 HydrophobicContact CG-CE1 4.02Å; E104-Y842 PolarHBondContact O-OH 3.26Å; E104-Y842 WeakPolarHBondContact OE1-CE1 3.48Å; L111-Y842 HydrophobicContact CD2-CE2 4.47Å; V112-Y842 HydrophobicContact CG2-CD2 3.99Å; V112-Y842 HydrophobicContact CG2-CE2 3.71Å; L838-Y842 PolarHBondContact O-N 3.26Å; K839-Y842 WeakPolarHBondContact O-CB 3.3Å; K839-Y842 PolarHBondContact O-N 2.87Å; K839-Y842 VanDerWaalsContact O-N 3.13Å; A840-Y842 VanDerWaalsContact C-N 3.34Å; A840-Y842 PolarHBondContact O-N 3.46Å; Y842-I844 PolarHBondContact O-N 3.13Å; Y842-A845 CarbonylContact O-C 3.58Å; Y842-A845 PolarHBondContact O-N 3.45Å; Y842-T846 HydrophobicContact CD1-CG2 4.23Å; Y842-T846 HydrophobicContact CD2-CG2 4.18Å; Y842-T846 HydrophobicContact CE1-CG2 3.77Å; Y842-T846 HydrophobicContact CE2-CG2 3.7Å; Y842-T846 HydrophobicContact CG-CG2 4.41Å; Y842-T846 VanDerWaalsContact CZ-CG2 3.46Å; Y842-T846 PolarHBondContact O-N 2.85Å; Y842-T846 PolarHBondContact O-OG1 3.3Å
843	L	93.1	Very high	91.3	Very high	27 Å²	27	43.4 Å²	43.4	14%	0.141	23%	0.227	C	C	.	.	H	α-helix	trans	-61.3	-42.6	-179.7	-68.7	169.9	0	0	0	112.7	Y832 E835 K839 A840 A845 T846 N847	Y832-L843 HydrophobicContact CD1-CB 4.37Å; Y832-L843 HydrophobicContact CD1-CD1 3.81Å; Y832-L843 HydrophobicContact CD2-CB 4.36Å; Y832-L843 HydrophobicContact CE1-CB 4.26Å; Y832-L843 HydrophobicContact CE1-CD1 4.18Å; Y832-L843 HydrophobicContact CE2-CB 4.22Å; Y832-L843 HydrophobicContact CG-CB 4.43Å; Y832-L843 HydrophobicContact CG-CD1 4.26Å; E835-L843 HydrophobicContact CG-CD1 4Å; K839-L843 HydrophobicContact CG-CD1 4.06Å; K839-L843 HydrophobicContact CG-CG 4.44Å; K839-L843 VanDerWaalsContact O-CG 3.31Å; K839-L843 WeakPolarHBondContact O-CG 3.45Å; K839-L843 PolarHBondContact O-N 3.27Å; A840-L843 PolarHBondContact O-N 3.28Å; L843-A845 PolarHBondContact O-N 3.01Å; L843-T846 PolarHBondContact O-N 3.38Å; L843-T846 PolarHBondContact O-OG1 2.84Å; L843-N847 WeakPolarHBondContact O-CB 3.38Å; L843-N847 PolarHBondContact O-N 3.38Å; L843-N847 PolarHBondContact O-ND2 3.31Å
844	I	92.9	Very high	91.3	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-57.1	-38.3	173.6	-72.7	165.4	0	0	0	110.9	P796 M799 P801 V804 Y832 A840 Y842 G848	P796-I844 WeakPolarHBondContact O-CD1 3.17Å; M799-I844 WeakPolarHBondContact O-CG2 3.14Å; P801-I844 HydrophobicContact CG-CG2 4.12Å; V804-I844 HydrophobicContact CG2-CG2 4.05Å; Y832-I844 HydrophobicContact CD2-CG1 3.97Å; Y832-I844 HydrophobicContact CE2-CG1 4.08Å; A840-I844 WeakPolarHBondContact O-CB 3.38Å; A840-I844 WeakPolarHBondContact O-CD1 3.43Å; A840-I844 VanDerWaalsContact O-CG1 3.23Å; A840-I844 WeakPolarHBondContact O-CG1 3.3Å; A840-I844 PolarHBondContact O-N 3.43Å; Y842-I844 PolarHBondContact O-N 3.13Å; I844-G848 VanDerWaalsContact O-CA 3.3Å; I844-G848 WeakPolarHBondContact O-CA 3.49Å; I844-G848 PolarHBondContact O-N 2.96Å; I844-G848 VanDerWaalsContact O-N 3.16Å
845	A	91.6	Very high	91.2	Very high	24 Å²	24	46.3 Å²	46.3	20%	0.198	23%	0.231	C	C	.	.	H	α-helix	trans	-87.2	-25.8	-177.2	0	0	0	0	0	114.7	L111 V804 L841 Y842 L843	L111-A845 HydrophobicContact CD1-CB 3.63Å; L111-A845 HydrophobicContact CD2-CB 3.99Å; L111-A845 HydrophobicContact CG-CB 4.29Å; V804-A845 HydrophobicContact CB-CB 4.32Å; V804-A845 HydrophobicContact CG1-CB 3.99Å; L841-A845 PolarHBondContact O-N 3.06Å; Y842-A845 CarbonylContact O-C 3.58Å; Y842-A845 PolarHBondContact O-N 3.45Å; L843-A845 PolarHBondContact O-N 3.01Å
846	T	92.3	Very high	91	Very high	49 Å²	49	50.7 Å²	50.7	30%	0.301	26%	0.257	S	S	.	.	H	α-helix	trans	-82.6	-44.7	173.2	53.8	0	0	0	0	112.9	L111 Y842 L843	L111-T846 HydrophobicContact CD2-CG2 3.6Å; Y842-T846 HydrophobicContact CD1-CG2 4.23Å; Y842-T846 HydrophobicContact CD2-CG2 4.18Å; Y842-T846 HydrophobicContact CE1-CG2 3.77Å; Y842-T846 HydrophobicContact CE2-CG2 3.7Å; Y842-T846 HydrophobicContact CG-CG2 4.41Å; Y842-T846 VanDerWaalsContact CZ-CG2 3.46Å; Y842-T846 PolarHBondContact O-N 2.85Å; Y842-T846 PolarHBondContact O-OG1 3.3Å; L843-T846 PolarHBondContact O-N 3.38Å; L843-T846 PolarHBondContact O-OG1 2.84Å
847	N	92.8	Very high	91.3	Very high	84 Å²	84	50.4 Å²	50.4	45%	0.449	26%	0.255	S	S	.	.	H	α-helix	trans	-84.9	-29.1	-173.5	-51	-14.5	0	0	0	110.4	Y832 L843 K849	Y832-N847 PolarHBondContact OH-ND2 3.04Å; L843-N847 WeakPolarHBondContact O-CB 3.38Å; L843-N847 PolarHBondContact O-N 3.38Å; L843-N847 PolarHBondContact O-ND2 3.31Å; N847-K849 PolarHBondContact O-N 3.07Å; N847-K849 VanDerWaalsContact O-N 3.11Å
848	G	92.5	Very high	91.7	Very high	5 Å²	5	50.2 Å²	50.2	5%	0.052	25%	0.254	C	S	.	.			trans	69.6	-102.5	-172	0	0	0	0	0	109.9	W816 I844 P850	W816-G848 VanDerWaalsContact CH2-O 3.25Å; W816-G848 WeakPolarHBondContact CH2-O 3.25Å; W816-G848 WeakPolarHBondContact CZ2-O 3.48Å; I844-G848 VanDerWaalsContact O-CA 3.3Å; I844-G848 WeakPolarHBondContact O-CA 3.49Å; I844-G848 PolarHBondContact O-N 2.96Å; I844-G848 VanDerWaalsContact O-N 3.16Å; G848-P850 WeakPolarHBondContact O-CD 3.39Å
849	K	94.3	Very high	92	Very high	63 Å²	63	54.7 Å²	54.7	27%	0.274	28%	0.283	S	S	.	.	S	Bend	trans	-72.9	125.7	-178.8	-179.1	176.3	179.4	-168.8	0	110	N847 D866 L869 V871	N847-K849 PolarHBondContact O-N 3.07Å; N847-K849 VanDerWaalsContact O-N 3.11Å; K849-D866 IonicContact NZ-OD1 2.74Å; K849-D866 PolarHBondContact NZ-OD1 3.2Å; K849-L869 HydrophobicContact CD-CB 4.29Å; K849-L869 HydrophobicContact CG-CB 3.96Å; K849-V871 HydrophobicContact CB-CG2 4.12Å
850	P	93.7	Very high	92.3	Very high	4 Å²	4	56.9 Å²	56.9	3%	0.026	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-60.9	144.7	174.7	-24	34.5	0	0	0	112.6	I820 L823 P831 Y832 G848	I820-P850 HydrophobicContact CD1-CG 3.9Å; L823-P850 HydrophobicContact CD1-CB 4.24Å; L823-P850 HydrophobicContact CD1-CG 4.44Å; P831-P850 HydrophobicContact CB-CB 3.81Å; P831-P850 HydrophobicContact CB-CG 4.06Å; P831-P850 HydrophobicContact CG-CB 3.75Å; P831-P850 HydrophobicContact CG-CG 3.96Å; Y832-P850 HydrophobicContact CE2-CG 4.44Å; G848-P850 WeakPolarHBondContact O-CD 3.39Å
851	D	91	Very high	92.7	Very high	133 Å²	133	56.9 Å²	56.9	71%	0.711	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-87.7	138.9	161.8	-92	-46.5	0	0	0	110	K854	D851-K854 IonicContact OD1-NZ 3.74Å; D851-K854 PolarHBondContact OD1-NZ 3.01Å
852	F	91	Very high	93	Very high	20 Å²	20	59 Å²	59	9%	0.088	31%	0.305	C	S	.	.			trans	-146.2	165.5	-174.1	60.5	-85.2	0	0	0	109.3	L823 E827 K854 L857 L862 L865	L823-F852 HydrophobicContact CD1-CD1 4.25Å; L823-F852 HydrophobicContact CD2-CB 4.03Å; L823-F852 HydrophobicContact CD2-CD1 3.7Å; L823-F852 HydrophobicContact CD2-CD2 3.7Å; L823-F852 HydrophobicContact CD2-CE1 4.01Å; L823-F852 HydrophobicContact CD2-CE2 4.01Å; L823-F852 HydrophobicContact CD2-CG 3.54Å; L823-F852 HydrophobicContact CD2-CZ 4.17Å; E827-F852 WeakPolarHBondContact OE2-CB 3.3Å; F852-K854 HydrophobicContact CD2-CG 3.96Å; F852-K854 HydrophobicContact CE2-CG 3.61Å; F852-K854 HydrophobicContact CZ-CG 4Å; F852-K854 PolarHBondContact O-N 3.4Å; F852-L857 HydrophobicContact CD2-CD1 4.35Å; F852-L857 HydrophobicContact CE2-CD1 3.9Å; F852-L862 HydrophobicContact CE2-CD2 3.99Å; F852-L862 HydrophobicContact CZ-CD2 4.1Å; F852-L865 HydrophobicContact CE2-CD1 3.77Å; F852-L865 HydrophobicContact CZ-CB 4.37Å; F852-L865 HydrophobicContact CZ-CD1 3.71Å
853	R	89.7	Confident	93.2	Very high	164 Å²	164	61.7 Å²	61.7	62%	0.619	32%	0.32	S	S	*	.			trans	-71.2	122.9	177	-72.3	167.6	-69.2	152.1	-1	110.9	E827	E827-R853 IonicContact OE1-CZ 3.17Å; E827-R853 PolarHBondContact OE1-N 2.82Å; E827-R853 IonicContact OE1-NE 3.7Å; E827-R853 PolarHBondContact OE1-NE 3.42Å; E827-R853 IonicContact OE1-NH2 2.81Å; E827-R853 PolarHBondContact OE1-NH2 2.86Å
854	K	90.6	Very high	93.5	Very high	92 Å²	92	60.4 Å²	60.4	40%	0.4	31%	0.313	S	S	.	.			trans	-105.3	-0.1	-175.5	-65.9	155.9	-167.1	158.3	0	113	D851 F852 L862	D851-K854 IonicContact OD1-NZ 3.74Å; D851-K854 PolarHBondContact OD1-NZ 3.01Å; F852-K854 HydrophobicContact CD2-CG 3.96Å; F852-K854 HydrophobicContact CE2-CG 3.61Å; F852-K854 HydrophobicContact CZ-CG 4Å; F852-K854 PolarHBondContact O-N 3.4Å; K854-L862 HydrophobicContact CB-CD2 4.15Å; K854-L862 HydrophobicContact CG-CD2 3.88Å
855	D	87.1	Confident	93.7	Very high	132 Å²	132	60.2 Å²	60.2	71%	0.706	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	133.5	-179.5	-59.2	-50.4	0	0	0	110.6	L857	D855-L857 PolarHBondContact O-N 3.11Å
856	N	87.2	Confident	94	Very high	169 Å²	169	62.3 Å²	62.3	90%	0.904	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.9	10	-179.8	-47.7	-38.1	0	0	0	116.9
857	L	93.9	Very high	94.3	Very high	37 Å²	37	65.8 Å²	65.8	19%	0.194	33%	0.328	C	S	.	.			trans	-85.2	145.9	173.6	-55.2	-172.9	0	0	0	111.9	L826 F852 D855 L861 L862	L826-L857 HydrophobicContact CD1-CD1 4.34Å; L826-L857 HydrophobicContact CD2-CD2 3.99Å; F852-L857 HydrophobicContact CD2-CD1 4.35Å; F852-L857 HydrophobicContact CE2-CD1 3.9Å; D855-L857 PolarHBondContact O-N 3.11Å; L857-L861 HydrophobicContact CB-CD2 4.27Å; L857-L861 HydrophobicContact CD1-CD2 4.32Å; L857-L861 HydrophobicContact CD2-CD2 4.01Å; L857-L861 HydrophobicContact CG-CD2 4.43Å; L857-L862 HydrophobicContact CB-CD1 4.47Å; L857-L862 HydrophobicContact CB-CD2 4.17Å; L857-L862 HydrophobicContact CB-CG 4.1Å; L857-L862 HydrophobicContact CD1-CD2 4.05Å
858	S	96.4	Very high	94.5	Very high	20 Å²	20	61.8 Å²	61.8	14%	0.14	31%	0.306	C	S	.	.			trans	-68.8	148.7	177.9	68.8	0	0	0	0	112.7	E729 E860 L861 L862	E729-S858 VanDerWaalsContact CD-OG 3.27Å; E729-S858 WeakPolarHBondContact OE1-CB 3.49Å; E729-S858 PolarHBondContact OE1-N 3.48Å; E729-S858 PolarHBondContact OE1-OG 3.09Å; E729-S858 VanDerWaalsContact OE2-CB 3.25Å; E729-S858 WeakPolarHBondContact OE2-CB 3.23Å; E729-S858 PolarHBondContact OE2-OG 3.45Å; S858-E860 PolarHBondContact O-N 3.44Å; S858-L861 PolarHBondContact O-N 3.05Å; S858-L861 VanDerWaalsContact OG-CB 3.28Å; S858-L861 WeakPolarHBondContact OG-CB 3.42Å; S858-L861 PolarHBondContact OG-N 2.93Å; S858-L862 WeakPolarHBondContact O-CG 3.4Å; S858-L862 PolarHBondContact O-N 2.79Å
859	P	97	Very high	94.8	Very high	94 Å²	94	61.6 Å²	61.6	61%	0.61	30%	0.304	S	S	*	.	H	α-helix	trans	-53.7	-33.7	169.9	-25.5	34.6	0	0	0	113	N863	P859-N863 WeakPolarHBondContact O-CB 3.46Å; P859-N863 PolarHBondContact O-N 2.75Å
860	E	97.4	Very high	94.9	Very high	68 Å²	68	62.3 Å²	62.3	32%	0.318	31%	0.308	S	S	.	.	H	α-helix	trans	-69.5	-45.2	-179.9	-67.9	62.7	-138.5	0	0	111.7	S858 N863 F864 H885 P886 F887	S858-E860 PolarHBondContact O-N 3.44Å; E860-N863 PolarHBondContact O-N 3.32Å; E860-F864 WeakPolarHBondContact O-CB 3.48Å; E860-F864 PolarHBondContact O-N 2.59Å; E860-H885 PolarHBondContact O-CE1 3.29Å; E860-P886 HydrophobicContact CG-CB 4.15Å; E860-F887 HydrophobicContact CB-CB 4.11Å
861	L	97.8	Very high	95	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-65.3	-44.1	173.3	171.5	57	0	0	0	111.3	E729 T822 L826 L857 S858 N863 F864 L865 F887	E729-L861 HydrophobicContact CG-CD2 3.88Å; E729-L861 WeakPolarHBondContact OE1-CD2 3.23Å; T822-L861 HydrophobicContact CG2-CD1 4.04Å; L826-L861 HydrophobicContact CD1-CD1 4.36Å; L826-L861 HydrophobicContact CD1-CD2 3.98Å; L826-L861 HydrophobicContact CD2-CD2 3.87Å; L857-L861 HydrophobicContact CB-CD2 4.27Å; L857-L861 HydrophobicContact CD1-CD2 4.32Å; L857-L861 HydrophobicContact CD2-CD2 4.01Å; L857-L861 HydrophobicContact CG-CD2 4.43Å; S858-L861 PolarHBondContact O-N 3.05Å; S858-L861 VanDerWaalsContact OG-CB 3.28Å; S858-L861 WeakPolarHBondContact OG-CB 3.42Å; S858-L861 PolarHBondContact OG-N 2.93Å; L861-N863 VanDerWaalsContact C-N 3.32Å; L861-N863 PolarHBondContact O-N 3.21Å; L861-F864 WeakPolarHBondContact O-CB 3.35Å; L861-F864 PolarHBondContact O-N 3.17Å; L861-L865 HydrophobicContact CD1-CD1 3.97Å; L861-L865 HydrophobicContact CD1-CG 4.1Å; L861-L865 HydrophobicContact CG-CD1 4.14Å; L861-L865 WeakPolarHBondContact O-CG 3.16Å; L861-L865 PolarHBondContact O-N 2.98Å; L861-F887 HydrophobicContact CB-CD2 3.84Å; L861-F887 HydrophobicContact CB-CE2 3.71Å; L861-F887 HydrophobicContact CB-CZ 4.37Å; L861-F887 HydrophobicContact CD1-CD2 4.5Å; L861-F887 HydrophobicContact CD1-CE1 4.05Å; L861-F887 HydrophobicContact CD1-CE2 3.92Å; L861-F887 HydrophobicContact CD1-CZ 3.67Å; L861-F887 HydrophobicContact CG-CE2 4.24Å; L861-F887 HydrophobicContact CG-CZ 4.46Å
862	L	97.4	Very high	95.1	Very high	44 Å²	44	62.4 Å²	62.4	23%	0.23	31%	0.311	C	S	.	.	H	α-helix	trans	-59.5	-43.6	176.6	-70.3	172.3	0	0	0	111	F852 K854 L857 S858 F864 L865 D866	F852-L862 HydrophobicContact CE2-CD2 3.99Å; F852-L862 HydrophobicContact CZ-CD2 4.1Å; K854-L862 HydrophobicContact CB-CD2 4.15Å; K854-L862 HydrophobicContact CG-CD2 3.88Å; L857-L862 HydrophobicContact CB-CD1 4.47Å; L857-L862 HydrophobicContact CB-CD2 4.17Å; L857-L862 HydrophobicContact CB-CG 4.1Å; L857-L862 HydrophobicContact CD1-CD2 4.05Å; S858-L862 WeakPolarHBondContact O-CG 3.4Å; S858-L862 PolarHBondContact O-N 2.79Å; L862-F864 PolarHBondContact O-N 2.95Å; L862-L865 PolarHBondContact O-N 2.66Å; L862-D866 PolarHBondContact O-N 2.77Å
863	N	97.7	Very high	95.2	Very high	63 Å²	63	62.4 Å²	62.4	34%	0.337	32%	0.315	S	S	.	.	H	α-helix	trans	-71.4	-28.8	176.9	-159.3	-120.1	0	0	0	113.5	P859 E860 L861 D866 R867 H885	P859-N863 WeakPolarHBondContact O-CB 3.46Å; P859-N863 PolarHBondContact O-N 2.75Å; E860-N863 PolarHBondContact O-N 3.32Å; L861-N863 VanDerWaalsContact C-N 3.32Å; L861-N863 PolarHBondContact O-N 3.21Å; N863-D866 PolarHBondContact O-N 3.02Å; N863-R867 WeakPolarHBondContact O-CB 3.5Å; N863-R867 VanDerWaalsContact O-CG 3.24Å; N863-R867 WeakPolarHBondContact O-CG 3.23Å; N863-R867 PolarHBondContact O-N 3.21Å; N863-H885 PolarHBondContact OD1-NE2 3.26Å
864	F	98.5	Very high	95.4	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-64.8	-46.4	171.1	-178.4	-98.4	0	0	0	110.9	C736 L740 L818 T822 E860 L861 L862 R867 C868 L882 H885 F887 I888	C736-F864 HydrophobicContact CB-CE1 4.34Å; C736-F864 HydrophobicContact CB-CZ 4.06Å; L740-F864 HydrophobicContact CD1-CE2 3.94Å; L740-F864 HydrophobicContact CD1-CZ 4.03Å; L818-F864 HydrophobicContact CD2-CZ 4.46Å; T822-F864 HydrophobicContact CG2-CD1 4.33Å; T822-F864 HydrophobicContact CG2-CE1 4.23Å; E860-F864 WeakPolarHBondContact O-CB 3.48Å; E860-F864 PolarHBondContact O-N 2.59Å; L861-F864 WeakPolarHBondContact O-CB 3.35Å; L861-F864 PolarHBondContact O-N 3.17Å; L862-F864 PolarHBondContact O-N 2.95Å; F864-R867 PolarHBondContact O-N 2.94Å; F864-C868 PolarHBondContact O-N 3.32Å; F864-C868 PolarHBondContact O-SG 3.49Å; F864-L882 HydrophobicContact CD2-CD2 3.86Å; F864-L882 HydrophobicContact CE2-CB 4.24Å; F864-L882 HydrophobicContact CE2-CD2 3.81Å; F864-H885 HydrophobicContact CD2-CB 4.21Å; F864-H885 AromaticContact CD2-CG 3.98Å; F864-H885 AromaticContact CD2-ND1 3.78Å; F864-H885 PolarHBondContact N-CE1 2.83Å; F864-H885 VanDerWaalsContact N-CE1 3.31Å; F864-F887 HydrophobicContact CB-CB 4.06Å; F864-F887 HydrophobicContact CB-CD1 3.99Å; F864-F887 HydrophobicContact CB-CG 4.19Å; F864-F887 AromaticContact CD1-CD1 3.89Å; F864-F887 HydrophobicContact CD1-CD1 3.89Å; F864-F887 HydrophobicContact CD1-CE1 4.12Å; F864-F887 AromaticContact CD2-CD1 3.98Å; F864-F887 HydrophobicContact CD2-CD1 3.98Å; F864-F887 HydrophobicContact CE1-CD1 4.36Å; F864-F887 HydrophobicContact CE1-CE1 4.39Å; F864-F887 HydrophobicContact CE2-CD1 4.43Å; F864-F887 HydrophobicContact CG-CB 4.44Å; F864-F887 AromaticContact CG-CD1 3.68Å; F864-F887 HydrophobicContact CG-CD1 3.68Å; F864-F887 HydrophobicContact CG-CE1 4.37Å; F864-F887 HydrophobicContact CG-CG 4.36Å; F864-I888 HydrophobicContact CD2-CD1 4.47Å; F864-I888 HydrophobicContact CD2-CG1 4.18Å; F864-I888 HydrophobicContact CE2-CD1 3.81Å; F864-I888 HydrophobicContact CE2-CG1 3.69Å; F864-I888 HydrophobicContact CZ-CD1 4.04Å; F864-I888 HydrophobicContact CZ-CG1 4.41Å
865	L	98.1	Very high	95.7	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63.4	-39.9	174.3	-73.2	167.9	0	0	0	112.1	T822 L823 L826 F852 L861 L862 R867 C868 L869	T822-L865 HydrophobicContact CG2-CD2 3.74Å; T822-L865 HydrophobicContact CG2-CG 4.37Å; L823-L865 HydrophobicContact CD2-CD1 3.9Å; L823-L865 HydrophobicContact CD2-CD2 3.83Å; L823-L865 HydrophobicContact CD2-CG 4.5Å; L823-L865 HydrophobicContact CG-CD2 4.08Å; L826-L865 HydrophobicContact CD1-CD1 3.95Å; F852-L865 HydrophobicContact CE2-CD1 3.77Å; F852-L865 HydrophobicContact CZ-CB 4.37Å; F852-L865 HydrophobicContact CZ-CD1 3.71Å; L861-L865 HydrophobicContact CD1-CD1 3.97Å; L861-L865 HydrophobicContact CD1-CG 4.1Å; L861-L865 HydrophobicContact CG-CD1 4.14Å; L861-L865 WeakPolarHBondContact O-CG 3.16Å; L861-L865 PolarHBondContact O-N 2.98Å; L862-L865 PolarHBondContact O-N 2.66Å; L865-R867 VanDerWaalsContact C-N 3.31Å; L865-R867 PolarHBondContact O-N 2.89Å; L865-C868 PolarHBondContact O-N 3.16Å; L865-L869 HydrophobicContact CD2-CD1 4.3Å; L865-L869 WeakPolarHBondContact O-CB 3.46Å; L865-L869 PolarHBondContact O-N 3.25Å
866	D	97.4	Very high	96.2	Very high	68 Å²	68	53.6 Å²	53.6	36%	0.364	29%	0.287	S	S	.	.	H	α-helix	trans	-57.1	-44.4	171.2	-65.8	-19.7	0	0	0	111.7	K849 L862 N863 E870	K849-D866 IonicContact NZ-OD1 2.74Å; K849-D866 PolarHBondContact NZ-OD1 3.2Å; L862-D866 PolarHBondContact O-N 2.77Å; N863-D866 PolarHBondContact O-N 3.02Å; D866-E870 PolarHBondContact O-N 2.57Å
867	R	98.2	Very high	96.7	Very high	122 Å²	122	45.7 Å²	45.7	46%	0.46	25%	0.245	S	C	.	.	H	α-helix	trans	-71.2	-31.4	-178.2	-78.3	-81.2	145.7	76.6	-7	113.6	N863 F864 L865 R876 A877 L882	N863-R867 WeakPolarHBondContact O-CB 3.5Å; N863-R867 VanDerWaalsContact O-CG 3.24Å; N863-R867 WeakPolarHBondContact O-CG 3.23Å; N863-R867 PolarHBondContact O-N 3.21Å; F864-R867 PolarHBondContact O-N 2.94Å; L865-R867 VanDerWaalsContact C-N 3.31Å; L865-R867 PolarHBondContact O-N 2.89Å; R867-R876 WeakPolarHBondContact O-CG 3.38Å; R867-A877 HydrophobicContact CB-CB 4.14Å; R867-A877 PolarHBondContact O-N 3.17Å; R867-A877 VanDerWaalsContact O-N 3.08Å; R867-L882 HydrophobicContact CB-CD2 3.79Å
868	C	98.3	Very high	96.9	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-81.3	-41.6	176.4	-67.6	0	0	0	0	112.9	I815 F864 L865 R876 L882	I815-C868 HydrophobicContact CG2-CB 4.36Å; F864-C868 PolarHBondContact O-N 3.32Å; F864-C868 PolarHBondContact O-SG 3.49Å; L865-C868 PolarHBondContact O-N 3.16Å; C868-R876 WeakPolarHBondContact O-CD 3.34Å; C868-R876 WeakPolarHBondContact O-CG 3.42Å; C868-L882 VanDerWaalsContact SG-CD1 3.56Å
869	L	97.8	Very high	96.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.239	C	C	.	.	S	Bend	trans	-101	25.2	-173.7	-58.5	172.1	0	0	0	113.4	W816 I820 L823 K849 L865	W816-L869 HydrophobicContact CD2-CD2 3.87Å; W816-L869 HydrophobicContact CE3-CB 4.47Å; W816-L869 HydrophobicContact CE3-CD2 4.1Å; W816-L869 HydrophobicContact CG-CD2 4.29Å; W816-L869 HydrophobicContact CH2-CD2 4.5Å; W816-L869 HydrophobicContact CZ2-CD2 4.28Å; W816-L869 HydrophobicContact CZ3-CB 4.24Å; W816-L869 HydrophobicContact CZ3-CD2 4.42Å; W816-L869 VanDerWaalsContact CZ3-O 3.3Å; W816-L869 WeakPolarHBondContact CZ3-O 3.44Å; I820-L869 HydrophobicContact CD1-CD2 3.79Å; I820-L869 HydrophobicContact CG1-CD2 4.1Å; L823-L869 HydrophobicContact CD1-CD1 3.71Å; L823-L869 HydrophobicContact CG-CD1 4.18Å; K849-L869 HydrophobicContact CD-CB 4.29Å; K849-L869 HydrophobicContact CG-CB 3.96Å; L865-L869 HydrophobicContact CD2-CD1 4.3Å; L865-L869 WeakPolarHBondContact O-CB 3.46Å; L865-L869 PolarHBondContact O-N 3.25Å
870	E	97.1	Very high	96.9	Very high	79 Å²	79	43 Å²	43	37%	0.369	23%	0.228	S	C	.	.			trans	-64.7	131.3	168.7	174.5	54	-102.6	0	0	110	D866 D872 R876	D866-E870 PolarHBondContact O-N 2.57Å; E870-D872 PolarHBondContact OE1-N 2.93Å; E870-D872 VanDerWaalsContact OE1-N 3.09Å; E870-R876 HydrophobicContact CB-CB 3.86Å; E870-R876 HydrophobicContact CB-CG 4.13Å; E870-R876 HydrophobicContact CG-CB 4.16Å; E870-R876 PolarHBondContact O-NE 3.45Å; E870-R876 PolarHBondContact O-NH2 3.07Å; E870-R876 VanDerWaalsContact O-NH2 3.08Å
871	V	95.1	Very high	97	Very high	69 Å²	69	44.7 Å²	44.7	42%	0.418	24%	0.236	S	C	.	.	S	Bend	trans	-78.8	-34.1	-172.1	-177.6	0	0	0	0	110.7	W816 K849 A873	W816-V871 HydrophobicContact CZ3-CG2 4.43Å; K849-V871 HydrophobicContact CB-CG2 4.12Å; V871-A873 PolarHBondContact O-N 2.72Å
872	D	94.3	Very high	97	Very high	70 Å²	70	44.7 Å²	44.7	37%	0.374	24%	0.236	S	C	.	.	S	Bend	trans	-74.1	108	168.4	171.9	35.2	0	0	0	111.3	E870 Q874 S875 R876	E870-D872 PolarHBondContact OE1-N 2.93Å; E870-D872 VanDerWaalsContact OE1-N 3.09Å; D872-Q874 PolarHBondContact O-N 3.03Å; D872-Q874 PolarHBondContact OD1-N 3.36Å; D872-S875 PolarHBondContact O-N 3.39Å; D872-S875 VanDerWaalsContact OD2-CB 3.22Å; D872-S875 WeakPolarHBondContact OD2-CB 3.49Å; D872-S875 PolarHBondContact OD2-N 2.84Å; D872-S875 PolarHBondContact OD2-OG 3.16Å; D872-R876 PolarHBondContact O-N 3.25Å
873	A	93.2	Very high	97	Very high	20 Å²	20	43.5 Å²	43.5	17%	0.165	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-7.2	175.6	0	0	0	0	0	114.9	E802 K812 V871	E802-A873 HydrophobicContact CG-CB 4.22Å; E802-A873 VanDerWaalsContact OE1-CB 3.3Å; E802-A873 WeakPolarHBondContact OE1-CB 3.48Å; K812-A873 VanDerWaalsContact CD-O 3.31Å; K812-A873 WeakPolarHBondContact CD-O 3.34Å; V871-A873 PolarHBondContact O-N 2.72Å
874	Q	92.8	Very high	97	Very high	119 Å²	119	45.8 Å²	45.8	56%	0.556	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-46.5	166	-55.1	-55.7	-110.5	0	0	111.6	K812 D872	K812-Q874 PolarHBondContact NZ-O 3.03Å; D872-Q874 PolarHBondContact O-N 3.03Å; D872-Q874 PolarHBondContact OD1-N 3.36Å
875	S	96.4	Very high	97	Very high	82 Å²	82	46.5 Å²	46.5	57%	0.573	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-26.4	179.7	-57.5	0	0	0	0	114.9	D872	D872-S875 PolarHBondContact O-N 3.39Å; D872-S875 VanDerWaalsContact OD2-CB 3.22Å; D872-S875 WeakPolarHBondContact OD2-CB 3.49Å; D872-S875 PolarHBondContact OD2-N 2.84Å; D872-S875 PolarHBondContact OD2-OG 3.16Å
876	R	97.7	Very high	97	Very high	1 Å²	1	49.3 Å²	49.3	0%	0.004	26%	0.26	C	S	.	.	S	Bend	trans	-53.6	141.3	173.5	-169.6	-172.6	-56.9	146	7.5	111.1	E802 K812 I815 R867 C868 E870 D872	E802-R876 IonicContact OE1-CZ 3.75Å; E802-R876 IonicContact OE1-NH1 3.1Å; E802-R876 PolarHBondContact OE1-NH1 3.34Å; E802-R876 IonicContact OE1-NH2 3.14Å; E802-R876 PolarHBondContact OE1-NH2 3.45Å; E802-R876 IonicContact OE2-CZ 2.79Å; E802-R876 IonicContact OE2-NH1 2.91Å; E802-R876 IonicContact OE2-NH2 2.66Å; E802-R876 PolarHBondContact OE2-NH2 3.11Å; K812-R876 WeakPolarHBondContact CD-O 3.28Å; K812-R876 WeakPolarHBondContact CE-O 3.23Å; K812-R876 PolarHBondContact NZ-O 3.32Å; K812-R876 WeakPolarHBondContact O-CD 3.25Å; K812-R876 PolarHBondContact O-NH1 2.99Å; I815-R876 HydrophobicContact CG2-CG 4.25Å; R867-R876 WeakPolarHBondContact O-CG 3.38Å; C868-R876 WeakPolarHBondContact O-CD 3.34Å; C868-R876 WeakPolarHBondContact O-CG 3.42Å; E870-R876 HydrophobicContact CB-CB 3.86Å; E870-R876 HydrophobicContact CB-CG 4.13Å; E870-R876 HydrophobicContact CG-CB 4.16Å; E870-R876 PolarHBondContact O-NE 3.45Å; E870-R876 PolarHBondContact O-NH2 3.07Å; E870-R876 VanDerWaalsContact O-NH2 3.08Å; D872-R876 PolarHBondContact O-N 3.25Å
877	A	97.9	Very high	97.1	Very high	3 Å²	3	46 Å²	46	3%	0.025	24%	0.243	C	C	.	.			trans	-66.5	163.3	-178	0	0	0	0	0	113	R867 E881 L882	R867-A877 HydrophobicContact CB-CB 4.14Å; R867-A877 PolarHBondContact O-N 3.17Å; R867-A877 VanDerWaalsContact O-N 3.08Å; A877-E881 WeakPolarHBondContact CA-OE2 3.21Å; A877-E881 HydrophobicContact CB-CB 4.32Å; A877-L882 HydrophobicContact CB-CD1 3.97Å; A877-L882 HydrophobicContact CB-CD2 3.93Å; A877-L882 HydrophobicContact CB-CG 3.65Å
878	N	97.7	Very high	97.1	Very high	38 Å²	38	40.4 Å²	40.4	20%	0.203	22%	0.221	C	C	.	.			trans	-108.1	165.8	169.1	83.3	79.4	0	0	0	111.7	S880 E881 L882	N878-S880 PolarHBondContact O-N 2.95Å; N878-S880 VanDerWaalsContact O-N 3.13Å; N878-S880 WeakPolarHBondContact OD1-CA 3.46Å; N878-S880 VanDerWaalsContact OD1-CB 3.29Å; N878-S880 WeakPolarHBondContact OD1-CB 3.43Å; N878-S880 PolarHBondContact OD1-N 2.88Å; N878-E881 PolarHBondContact N-OE2 3.31Å; N878-E881 WeakPolarHBondContact ND2-CG 3.46Å; N878-E881 PolarHBondContact ND2-OE1 3.44Å; N878-E881 PolarHBondContact ND2-OE2 2.81Å; N878-E881 PolarHBondContact O-N 3.21Å; N878-L882 PolarHBondContact O-N 3.01Å
879	A	97.9	Very high	97	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.008	25%	0.247	C	C	.	.	H	α-helix	trans	-58.5	-29	-175.6	0	0	0	0	0	114.2	L740 L743 K744 I815 I883	L740-A879 HydrophobicContact CD2-CB 4.24Å; L743-A879 HydrophobicContact CB-CB 4.06Å; K744-A879 HydrophobicContact CB-CB 3.97Å; I815-A879 HydrophobicContact CD1-CB 4.07Å; A879-I883 WeakPolarHBondContact O-CG2 3.17Å; A879-I883 PolarHBondContact O-N 3.35Å
880	S	97.3	Very high	97	Very high	55 Å²	55	51.3 Å²	51.3	39%	0.385	27%	0.273	S	S	.	.	H	α-helix	trans	-79.8	-18.2	176.2	-57.2	0	0	0	0	114	K744 N878 E884	K744-S880 WeakPolarHBondContact CE-OG 3.36Å; N878-S880 PolarHBondContact O-N 2.95Å; N878-S880 VanDerWaalsContact O-N 3.13Å; N878-S880 WeakPolarHBondContact OD1-CA 3.46Å; N878-S880 VanDerWaalsContact OD1-CB 3.29Å; N878-S880 WeakPolarHBondContact OD1-CB 3.43Å; N878-S880 PolarHBondContact OD1-N 2.88Å; S880-E884 WeakPolarHBondContact O-CG 3.33Å
881	E	97.9	Very high	97	Very high	104 Å²	104	48.8 Å²	48.8	49%	0.486	26%	0.262	S	S	.	.	H	α-helix	trans	-85.8	-39.5	171.7	-70.9	157.4	168.5	0	0	110.6	A877 N878 E884	A877-E881 WeakPolarHBondContact CA-OE2 3.21Å; A877-E881 HydrophobicContact CB-CB 4.32Å; N878-E881 PolarHBondContact N-OE2 3.31Å; N878-E881 WeakPolarHBondContact ND2-CG 3.46Å; N878-E881 PolarHBondContact ND2-OE1 3.44Å; N878-E881 PolarHBondContact ND2-OE2 2.81Å; N878-E881 PolarHBondContact O-N 3.21Å; E881-E884 PolarHBondContact O-N 3.32Å
882	L	98.5	Very high	97.1	Very high	1 Å²	1	46 Å²	46	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-74.1	-30.5	-176.3	-75.4	167.5	0	0	0	114.2	L740 I815 F864 R867 C868 A877 N878 E884 H885 I888	L740-L882 HydrophobicContact CD1-CB 3.85Å; L740-L882 HydrophobicContact CD2-CB 3.66Å; L740-L882 HydrophobicContact CD2-CD1 4.2Å; L740-L882 HydrophobicContact CG-CB 4.44Å; I815-L882 HydrophobicContact CD1-CD1 4.11Å; I815-L882 HydrophobicContact CG2-CD1 3.37Å; F864-L882 HydrophobicContact CD2-CD2 3.86Å; F864-L882 HydrophobicContact CE2-CB 4.24Å; F864-L882 HydrophobicContact CE2-CD2 3.81Å; R867-L882 HydrophobicContact CB-CD2 3.79Å; C868-L882 VanDerWaalsContact SG-CD1 3.56Å; A877-L882 HydrophobicContact CB-CD1 3.97Å; A877-L882 HydrophobicContact CB-CD2 3.93Å; A877-L882 HydrophobicContact CB-CG 3.65Å; N878-L882 PolarHBondContact O-N 3.01Å; L882-E884 PolarHBondContact O-N 3.46Å; L882-H885 WeakPolarHBondContact O-CB 3.39Å; L882-H885 PolarHBondContact O-N 3.25Å; L882-H885 VanDerWaalsContact O-N 3.16Å; L882-I888 WeakPolarHBondContact O-CG1 3.34Å
883	I	97.4	Very high	97.3	Very high	18 Å²	18	47.6 Å²	47.6	9%	0.092	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-25.7	175.9	-165.6	173.6	0	0	0	112.4	L740 Q741 K744 A879 H885 I888 Q889	L740-I883 HydrophobicContact CB-CB 4.36Å; Q741-I883 HydrophobicContact CG-CD1 3.62Å; K744-I883 HydrophobicContact CD-CD1 4.19Å; K744-I883 HydrophobicContact CD-CG2 3.78Å; K744-I883 VanDerWaalsContact NZ-CG2 3.27Å; A879-I883 WeakPolarHBondContact O-CG2 3.17Å; A879-I883 PolarHBondContact O-N 3.35Å; I883-H885 VanDerWaalsContact C-N 3.3Å; I883-I888 WeakPolarHBondContact O-CG2 3.48Å; I883-Q889 PolarHBondContact O-NE2 2.91Å
884	E	97.8	Very high	97.5	Very high	112 Å²	112	50.9 Å²	50.9	52%	0.523	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	5.9	175	-42.4	-58	155.9	0	0	111.9	K744 S880 E881 L882	K744-E884 IonicContact NZ-OE1 3.66Å; K744-E884 PolarHBondContact NZ-OE1 3Å; K744-E884 VanDerWaalsContact NZ-OE1 3.1Å; S880-E884 WeakPolarHBondContact O-CG 3.33Å; E881-E884 PolarHBondContact O-N 3.32Å; L882-E884 PolarHBondContact O-N 3.46Å
885	H	98.5	Very high	97.7	Very high	15 Å²	15	46.9 Å²	46.9	7%	0.069	25%	0.25	C	S	.	.	S	Bend	trans	-70	142	-176.9	-164.5	-95.5	0	0	0	111.7	E860 N863 F864 L882 I883 F887 I888 Q889	E860-H885 PolarHBondContact O-CE1 3.29Å; N863-H885 PolarHBondContact OD1-NE2 3.26Å; F864-H885 HydrophobicContact CD2-CB 4.21Å; F864-H885 AromaticContact CD2-CG 3.98Å; F864-H885 AromaticContact CD2-ND1 3.78Å; F864-H885 PolarHBondContact N-CE1 2.83Å; F864-H885 VanDerWaalsContact N-CE1 3.31Å; L882-H885 WeakPolarHBondContact O-CB 3.39Å; L882-H885 PolarHBondContact O-N 3.25Å; L882-H885 VanDerWaalsContact O-N 3.16Å; I883-H885 VanDerWaalsContact C-N 3.3Å; H885-F887 VanDerWaalsContact C-N 3.32Å; H885-F887 PolarHBondContact O-N 3.13Å; H885-I888 HydrophobicContact CB-CG1 4.44Å; H885-I888 PolarHBondContact O-N 3.22Å; H885-Q889 PolarHBondContact O-N 3.01Å
886	P	98	Very high	97.7	Very high	58 Å²	58	48.4 Å²	48.4	38%	0.377	25%	0.251	S	S	.	.	H	α-helix	trans	-48.5	-47.6	-179.6	-32.2	37.1	0	0	0	114.2	E860 I888 Q889 Q890	E860-P886 HydrophobicContact CG-CB 4.15Å; P886-I888 VanDerWaalsContact C-N 3.31Å; P886-I888 PolarHBondContact O-N 3.34Å; P886-Q889 PolarHBondContact O-N 3.11Å; P886-Q889 VanDerWaalsContact O-N 3.17Å; P886-Q890 VanDerWaalsContact O-CB 3.23Å; P886-Q890 WeakPolarHBondContact O-CB 3.37Å; P886-Q890 WeakPolarHBondContact O-CG 3.35Å; P886-Q890 PolarHBondContact O-N 2.85Å
887	F	98.4	Very high	97.7	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.263	C	S	.	.	I	π-helix	trans	-50	-46.3	174.2	-179.9	-114.9	0	0	0	113.6	E729 I732 A733 E860 L861 F864 H885 N891	E729-F887 HydrophobicContact CB-CE2 4.19Å; I732-F887 HydrophobicContact CB-CZ 4.37Å; I732-F887 HydrophobicContact CG2-CE1 4.37Å; I732-F887 HydrophobicContact CG2-CZ 4.01Å; A733-F887 HydrophobicContact CB-CD1 4.16Å; A733-F887 HydrophobicContact CB-CD2 4.43Å; A733-F887 HydrophobicContact CB-CE1 3.71Å; A733-F887 HydrophobicContact CB-CE2 3.99Å; A733-F887 HydrophobicContact CB-CG 4.5Å; A733-F887 HydrophobicContact CB-CZ 3.6Å; E860-F887 HydrophobicContact CB-CB 4.11Å; L861-F887 HydrophobicContact CB-CD2 3.84Å; L861-F887 HydrophobicContact CB-CE2 3.71Å; L861-F887 HydrophobicContact CB-CZ 4.37Å; L861-F887 HydrophobicContact CD1-CD2 4.5Å; L861-F887 HydrophobicContact CD1-CE1 4.05Å; L861-F887 HydrophobicContact CD1-CE2 3.92Å; L861-F887 HydrophobicContact CD1-CZ 3.67Å; L861-F887 HydrophobicContact CG-CE2 4.24Å; L861-F887 HydrophobicContact CG-CZ 4.46Å; F864-F887 HydrophobicContact CB-CB 4.06Å; F864-F887 HydrophobicContact CB-CD1 3.99Å; F864-F887 HydrophobicContact CB-CG 4.19Å; F864-F887 AromaticContact CD1-CD1 3.89Å; F864-F887 HydrophobicContact CD1-CD1 3.89Å; F864-F887 HydrophobicContact CD1-CE1 4.12Å; F864-F887 AromaticContact CD2-CD1 3.98Å; F864-F887 HydrophobicContact CD2-CD1 3.98Å; F864-F887 HydrophobicContact CE1-CD1 4.36Å; F864-F887 HydrophobicContact CE1-CE1 4.39Å; F864-F887 HydrophobicContact CE2-CD1 4.43Å; F864-F887 HydrophobicContact CG-CB 4.44Å; F864-F887 AromaticContact CG-CD1 3.68Å; F864-F887 HydrophobicContact CG-CD1 3.68Å; F864-F887 HydrophobicContact CG-CE1 4.37Å; F864-F887 HydrophobicContact CG-CG 4.36Å; H885-F887 VanDerWaalsContact C-N 3.32Å; H885-F887 PolarHBondContact O-N 3.13Å; F887-N891 HydrophobicContact CD2-CB 4.11Å; F887-N891 HydrophobicContact CE2-CB 4.24Å; F887-N891 WeakPolarHBondContact O-CA 3.29Å; F887-N891 WeakPolarHBondContact O-CB 3.44Å; F887-N891 PolarHBondContact O-N 3.21Å
888	I	98.4	Very high	97.7	Very high	3 Å²	3	50.5 Å²	50.5	2%	0.015	26%	0.263	C	S	.	.	I	π-helix	trans	-73.8	-40	-179.2	-60.8	-58.5	0	0	0	111.3	C736 R737 L740 F864 L882 I883 H885 P886 A892	C736-I888 HydrophobicContact CB-CD1 3.64Å; R737-I888 HydrophobicContact CB-CG2 3.84Å; R737-I888 HydrophobicContact CG-CG2 3.76Å; L740-I888 HydrophobicContact CD1-CD1 4.08Å; L740-I888 HydrophobicContact CD1-CG1 4Å; F864-I888 HydrophobicContact CD2-CD1 4.47Å; F864-I888 HydrophobicContact CD2-CG1 4.18Å; F864-I888 HydrophobicContact CE2-CD1 3.81Å; F864-I888 HydrophobicContact CE2-CG1 3.69Å; F864-I888 HydrophobicContact CZ-CD1 4.04Å; F864-I888 HydrophobicContact CZ-CG1 4.41Å; L882-I888 WeakPolarHBondContact O-CG1 3.34Å; I883-I888 WeakPolarHBondContact O-CG2 3.48Å; H885-I888 HydrophobicContact CB-CG1 4.44Å; H885-I888 PolarHBondContact O-N 3.22Å; P886-I888 VanDerWaalsContact C-N 3.31Å; P886-I888 PolarHBondContact O-N 3.34Å; I888-A892 WeakPolarHBondContact O-CB 3.31Å
889	Q	97.8	Very high	97.7	Very high	114 Å²	114	50.5 Å²	50.5	53%	0.533	26%	0.263	S	S	.	.	I	π-helix	trans	-77	-27.2	-177	-67.1	-69.2	-35.3	0	0	113.4	I883 H885 P886	I883-Q889 PolarHBondContact O-NE2 2.91Å; H885-Q889 PolarHBondContact O-N 3.01Å; P886-Q889 PolarHBondContact O-N 3.11Å; P886-Q889 VanDerWaalsContact O-N 3.17Å
890	Q	96.8	Very high	97.7	Very high	116 Å²	116	54.4 Å²	54.4	54%	0.542	29%	0.288	S	S	.	.	I	π-helix	trans	-109.1	-35.8	-172.6	-59.1	176.8	12.2	0	0	113.2	P886 R893	P886-Q890 VanDerWaalsContact O-CB 3.23Å; P886-Q890 WeakPolarHBondContact O-CB 3.37Å; P886-Q890 WeakPolarHBondContact O-CG 3.35Å; P886-Q890 PolarHBondContact O-N 2.85Å; Q890-R893 PolarHBondContact O-NH1 2.77Å; Q890-R893 PolarHBondContact O-NH2 3.16Å
891	N	97	Very high	97.6	Very high	26 Å²	26	52.8 Å²	52.8	14%	0.139	28%	0.275	C	S	.	.	I	π-helix	trans	-96	-27.9	-173.2	-53.4	27	0	0	0	111.8	E729 S730 A733 F887 R893	E729-N891 PolarHBondContact OE2-ND2 3.08Å; E729-N891 VanDerWaalsContact OE2-ND2 3.11Å; S730-N891 VanDerWaalsContact CA-O 3.27Å; S730-N891 WeakPolarHBondContact CA-O 3.45Å; S730-N891 WeakPolarHBondContact CB-O 3.36Å; S730-N891 PolarHBondContact OG-O 2.85Å; A733-N891 HydrophobicContact CB-CB 3.83Å; F887-N891 HydrophobicContact CD2-CB 4.11Å; F887-N891 HydrophobicContact CE2-CB 4.24Å; F887-N891 WeakPolarHBondContact O-CA 3.29Å; F887-N891 WeakPolarHBondContact O-CB 3.44Å; F887-N891 PolarHBondContact O-N 3.21Å; N891-R893 PolarHBondContact O-NE 2.95Å; N891-R893 PolarHBondContact O-NH1 2.98Å
892	A	97.5	Very high	97.6	Very high	11 Å²	11	47.9 Å²	47.9	9%	0.091	25%	0.252	C	S	.	.			trans	-66	152.7	-179.4	0	0	0	0	0	113	A733 R737 I888	A733-A892 HydrophobicContact CB-CB 3.91Å; R737-A892 HydrophobicContact CB-CB 4.43Å; I888-A892 WeakPolarHBondContact O-CB 3.31Å
893	R	97.6	Very high	97.5	Very high	102 Å²	102	52.4 Å²	52.4	39%	0.385	28%	0.275	S	S	.	.			trans	-130.3	171.2	-173.9	-58.5	-64.2	168.8	-113.5	3.4	110.9	T734 R737 Q890 N891 T897	T734-R893 WeakPolarHBondContact CG2-O 3.39Å; T734-R893 PolarHBondContact OG1-N 3.08Å; T734-R893 PolarHBondContact OG1-O 3.17Å; R737-R893 PolarHBondContact NH1-O 3.45Å; R737-R893 PolarHBondContact NH2-O 3.36Å; Q890-R893 PolarHBondContact O-NH1 2.77Å; Q890-R893 PolarHBondContact O-NH2 3.16Å; N891-R893 PolarHBondContact O-NE 2.95Å; N891-R893 PolarHBondContact O-NH1 2.98Å; R893-T897 HydrophobicContact CB-CG2 3.94Å
894	P	97.7	Very high	97.3	Very high	90 Å²	90	55 Å²	55	58%	0.584	29%	0.29	S	S	*	.			trans	-62.5	139.6	171.4	-19.9	33.4	0	0	0	110.1	I896 T897	P894-I896 HydrophobicContact CB-CG2 4.17Å; P894-I896 PolarHBondContact O-N 3.09Å; P894-T897 PolarHBondContact O-N 2.79Å; P894-T897 PolarHBondContact O-OG1 3.46Å
895	V	97.6	Very high	97.1	Very high	35 Å²	35	49.8 Å²	49.8	21%	0.212	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-57.2	-22	-169.7	-62	0	0	0	0	114.9	T734 E738 G767 T897 L898	T734-V895 HydrophobicContact CG2-CG1 4.14Å; E738-V895 HydrophobicContact CG-CG1 4Å; G767-V895 WeakPolarHBondContact O-CB 3.16Å; V895-T897 PolarHBondContact O-N 3.22Å; V895-L898 WeakPolarHBondContact O-CB 3.46Å; V895-L898 PolarHBondContact O-N 3.48Å
896	I	97.3	Very high	96.7	Very high	114 Å²	114	52.8 Å²	52.8	59%	0.585	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-52.5	-25.5	172.4	-157	177.3	0	0	0	113.7	P894 L898 I899	P894-I896 HydrophobicContact CB-CG2 4.17Å; P894-I896 PolarHBondContact O-N 3.09Å; I896-L898 PolarHBondContact O-N 3.24Å; I896-I899 HydrophobicContact CB-CD1 4.43Å; I896-I899 HydrophobicContact CG1-CD1 3.67Å; I896-I899 PolarHBondContact O-N 2.86Å
897	T	96.9	Very high	96.4	Very high	44 Å²	44	55.5 Å²	55.5	27%	0.27	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-69.3	-14.6	176.5	61.1	0	0	0	0	113.6	R893 P894 V895 P900	R893-T897 HydrophobicContact CB-CG2 3.94Å; P894-T897 PolarHBondContact O-N 2.79Å; P894-T897 PolarHBondContact O-OG1 3.46Å; V895-T897 PolarHBondContact O-N 3.22Å; T897-P900 WeakPolarHBondContact O-CD 3.33Å
898	L	97.5	Very high	95.8	Very high	4 Å²	4	58.7 Å²	58.7	2%	0.021	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-82.3	-23	176	-57.2	178.7	0	0	0	112.6	M727 H731 T734 V735 V769 V895 I896 P900 L901 I902	M727-L898 HydrophobicContact CE-CD2 4.43Å; H731-L898 HydrophobicContact CB-CD2 3.78Å; T734-L898 HydrophobicContact CG2-CD1 4.03Å; T734-L898 HydrophobicContact CG2-CG 4.27Å; V735-L898 HydrophobicContact CG2-CD1 3.77Å; V735-L898 HydrophobicContact CG2-CD2 4.21Å; V769-L898 HydrophobicContact CG2-CD1 3.62Å; V895-L898 WeakPolarHBondContact O-CB 3.46Å; V895-L898 PolarHBondContact O-N 3.48Å; I896-L898 PolarHBondContact O-N 3.24Å; L898-P900 VanDerWaalsContact C-CD 3.49Å; L898-L901 PolarHBondContact O-N 2.74Å; L898-I902 HydrophobicContact CB-CD1 3.93Å; L898-I902 WeakPolarHBondContact O-CG1 3.34Å; L898-I902 PolarHBondContact O-N 3.4Å
899	I	97.8	Very high	94.8	Very high	38 Å²	38	60.7 Å²	60.7	20%	0.195	32%	0.316	C	S	.	.	H	α-helix	trans	-53.7	-43.2	-175.3	-60.9	178	0	0	0	113.1	L765 I896 L901 I902 L903	L765-I899 WeakPolarHBondContact O-CD1 3.36Å; I896-I899 HydrophobicContact CB-CD1 4.43Å; I896-I899 HydrophobicContact CG1-CD1 3.67Å; I896-I899 PolarHBondContact O-N 2.86Å; I899-L901 VanDerWaalsContact C-N 3.29Å; I899-L901 PolarHBondContact O-N 3.4Å; I899-I902 PolarHBondContact O-N 3.33Å; I899-L903 HydrophobicContact CG2-CD1 3.76Å; I899-L903 HydrophobicContact CG2-CG 4.05Å; I899-L903 WeakPolarHBondContact O-CG 3.46Å; I899-L903 PolarHBondContact O-N 3.48Å
900	P	97	Very high	93.7	Very high	83 Å²	83	60.2 Å²	60.2	54%	0.539	31%	0.313	S	S	.	.	H	α-helix	trans	-60.9	-34.8	178.2	-24.6	35.8	0	0	0	113.8	T897 L898 L904	T897-P900 WeakPolarHBondContact O-CD 3.33Å; L898-P900 VanDerWaalsContact C-CD 3.49Å; P900-L904 VanDerWaalsContact O-CB 3.29Å; P900-L904 WeakPolarHBondContact O-CB 3.44Å; P900-L904 PolarHBondContact O-N 2.71Å; P900-L904 VanDerWaalsContact O-N 3.16Å
901	L	96.7	Very high	92.5	Very high	21 Å²	21	57.7 Å²	57.7	11%	0.11	31%	0.309	C	S	.	.	H	α-helix	trans	-73.6	-42.2	175.9	-59.9	-170.4	0	0	0	111.4	V721 T725 M727 H731 L898 I899 L903 L904 A905	V721-L901 HydrophobicContact CG1-CB 3.9Å; V721-L901 HydrophobicContact CG1-CD1 4.26Å; T725-L901 HydrophobicContact CG2-CB 4.3Å; T725-L901 HydrophobicContact CG2-CD2 4.4Å; M727-L901 HydrophobicContact CG-CD1 4.01Å; H731-L901 HydrophobicContact CB-CD1 4.47Å; H731-L901 VanDerWaalsContact ND1-CD1 3.28Å; H731-L901 WeakPolarHBondContact ND1-CD1 3.32Å; L898-L901 PolarHBondContact O-N 2.74Å; I899-L901 VanDerWaalsContact C-N 3.29Å; I899-L901 PolarHBondContact O-N 3.4Å; L901-L903 VanDerWaalsContact C-N 3.32Å; L901-L903 PolarHBondContact O-N 2.64Å; L901-L904 PolarHBondContact O-N 3.3Å; L901-A905 WeakPolarHBondContact O-CB 3.23Å; L901-A905 PolarHBondContact O-N 2.81Å
902	I	96.6	Very high	91	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-60.8	-42	177.9	-65.7	164.2	0	0	0	110.8	V721 L763 L765 L898 I899 R906	V721-I902 HydrophobicContact CG2-CG1 4.14Å; L763-I902 HydrophobicContact CB-CD1 4.03Å; L763-I902 HydrophobicContact CB-CG1 4.32Å; L763-I902 HydrophobicContact CD1-CD1 4.2Å; L763-I902 HydrophobicContact CD1-CG1 3.89Å; L765-I902 HydrophobicContact CD2-CG2 4.01Å; L898-I902 HydrophobicContact CB-CD1 3.93Å; L898-I902 WeakPolarHBondContact O-CG1 3.34Å; L898-I902 PolarHBondContact O-N 3.4Å; I899-I902 PolarHBondContact O-N 3.33Å; I902-R906 WeakPolarHBondContact O-CB 3.18Å; I902-R906 WeakPolarHBondContact O-CG 3.4Å; I902-R906 PolarHBondContact O-N 3.33Å
903	L	96.3	Very high	89.1	Confident	95 Å²	95	66.4 Å²	66.4	50%	0.497	36%	0.362	S	S	.	.	H	α-helix	trans	-67.6	-43.1	176.1	-67.6	175.4	0	0	0	112	L765 I899 L901 R906 E907	L765-L903 HydrophobicContact CD2-CD2 4.11Å; I899-L903 HydrophobicContact CG2-CD1 3.76Å; I899-L903 HydrophobicContact CG2-CG 4.05Å; I899-L903 WeakPolarHBondContact O-CG 3.46Å; I899-L903 PolarHBondContact O-N 3.48Å; L901-L903 VanDerWaalsContact C-N 3.32Å; L901-L903 PolarHBondContact O-N 2.64Å; L903-R906 PolarHBondContact O-N 3.18Å; L903-E907 PolarHBondContact O-N 2.79Å
904	L	94.9	Very high	86.8	Confident	74 Å²	74	69.4 Å²	69.4	39%	0.387	38%	0.38	S	S	.	.	H	α-helix	trans	-65.1	-39.8	179.4	177	60.9	0	0	0	113	T725 P900 L901 Q908	T725-L904 HydrophobicContact CG2-CB 4.32Å; T725-L904 HydrophobicContact CG2-CD2 4.03Å; T725-L904 HydrophobicContact CG2-CG 4.13Å; P900-L904 VanDerWaalsContact O-CB 3.29Å; P900-L904 WeakPolarHBondContact O-CB 3.44Å; P900-L904 PolarHBondContact O-N 2.71Å; P900-L904 VanDerWaalsContact O-N 3.16Å; L901-L904 PolarHBondContact O-N 3.3Å; L904-Q908 PolarHBondContact O-N 3.23Å; L904-Q908 VanDerWaalsContact O-N 3.16Å; L904-Q908 PolarHBondContact O-NE2 3.42Å
905	A	93.7	Very high	84.2	Confident	2 Å²	2	73.3 Å²	73.3	2%	0.017	40%	0.403	C	S	.	.	H	α-helix	trans	-63	-42.5	174.2	0	0	0	0	0	111.7	D720 V721 E724 T725 L901 Q908 A909	D720-A905 VanDerWaalsContact O-CB 3.31Å; D720-A905 WeakPolarHBondContact O-CB 3.46Å; V721-A905 HydrophobicContact CG2-CB 4Å; E724-A905 HydrophobicContact CB-CB 4.04Å; E724-A905 HydrophobicContact CG-CB 4.4Å; T725-A905 HydrophobicContact CG2-CB 4.23Å; L901-A905 WeakPolarHBondContact O-CB 3.23Å; L901-A905 PolarHBondContact O-N 2.81Å; A905-Q908 PolarHBondContact O-N 3.5Å; A905-A909 WeakPolarHBondContact O-CB 3.49Å; A905-A909 PolarHBondContact O-N 2.83Å
906	R	90	Very high	83.5	Confident	78 Å²	78	75.3 Å²	75.3	29%	0.294	41%	0.412	S	S	.	.	H	α-helix	trans	-68.1	-37	178.8	-70.5	178.2	64.3	68.3	8.2	113.3	D714 G715 I902 L903 Q910	D714-R906 PolarHBondContact O-NE 3.49Å; D714-R906 PolarHBondContact O-NH1 2.89Å; G715-R906 WeakPolarHBondContact O-CD 3.18Å; I902-R906 WeakPolarHBondContact O-CB 3.18Å; I902-R906 WeakPolarHBondContact O-CG 3.4Å; I902-R906 PolarHBondContact O-N 3.33Å; L903-R906 PolarHBondContact O-N 3.18Å; R906-Q910 WeakPolarHBondContact O-CB 3.41Å; R906-Q910 VanDerWaalsContact O-CG 3.26Å; R906-Q910 WeakPolarHBondContact O-CG 3.4Å; R906-Q910 PolarHBondContact O-N 3.01Å
907	E	90	Very high	82.8	Confident	115 Å²	115	73.2 Å²	73.2	54%	0.537	40%	0.403	S	S	.	.	H	α-helix	trans	-63.9	-43	174.5	-172.9	171.4	-162.8	0	0	111	L903 Q910 S911	L903-E907 PolarHBondContact O-N 2.79Å; E907-Q910 PolarHBondContact O-N 3.31Å; E907-S911 PolarHBondContact O-N 3.24Å; E907-S911 VanDerWaalsContact O-N 3.07Å
908	Q	86.4	Confident	82	Confident	67 Å²	67	74.8 Å²	74.8	31%	0.313	41%	0.41	S	S	.	.	H	α-helix	trans	-66.7	-48.7	176.6	-73.4	177	100.8	0	0	112.2	E724 L904 A905 Q910 S911 V912	E724-Q908 HydrophobicContact CB-CB 4.29Å; E724-Q908 HydrophobicContact CG-CB 4.17Å; E724-Q908 PolarHBondContact O-NE2 2.94Å; L904-Q908 PolarHBondContact O-N 3.23Å; L904-Q908 VanDerWaalsContact O-N 3.16Å; L904-Q908 PolarHBondContact O-NE2 3.42Å; A905-Q908 PolarHBondContact O-N 3.5Å; Q908-Q910 VanDerWaalsContact C-N 3.26Å; Q908-Q910 PolarHBondContact O-N 3.28Å; Q908-S911 PolarHBondContact O-N 3.14Å; Q908-S911 PolarHBondContact O-OG 2.93Å; Q908-V912 PolarHBondContact O-N 3.46Å; Q908-V912 VanDerWaalsContact O-N 3.16Å
909	A	76.7	Confident	81.1	Confident	45 Å²	45	79 Å²	79	37%	0.372	43%	0.433	S	S	.	.	H	α-helix	trans	-59.6	-33.7	177.3	0	0	0	0	0	113.5	A905 T913	A905-A909 WeakPolarHBondContact O-CB 3.49Å; A905-A909 PolarHBondContact O-N 2.83Å; A909-T913 PolarHBondContact O-OG1 3.29Å
910	Q	75.2	Confident	80	Confident	103 Å²	103	81.6 Å²	81.6	48%	0.481	45%	0.448	S	S	.	.	H	α-helix	trans	-67.5	-45.7	171.8	-76.1	177.2	-29.6	0	0	111.6	R906 E907 Q908 V912 T913 E914	R906-Q910 WeakPolarHBondContact O-CB 3.41Å; R906-Q910 VanDerWaalsContact O-CG 3.26Å; R906-Q910 WeakPolarHBondContact O-CG 3.4Å; R906-Q910 PolarHBondContact O-N 3.01Å; E907-Q910 PolarHBondContact O-N 3.31Å; Q908-Q910 VanDerWaalsContact C-N 3.26Å; Q908-Q910 PolarHBondContact O-N 3.28Å; Q910-V912 VanDerWaalsContact C-N 3.27Å; Q910-V912 PolarHBondContact O-N 2.98Å; Q910-T913 WeakPolarHBondContact O-CA 3.26Å; Q910-T913 WeakPolarHBondContact O-CB 3.38Å; Q910-T913 PolarHBondContact O-N 3.24Å; Q910-E914 PolarHBondContact O-N 3.05Å
911	S	72	Confident	78.9	Confident	64 Å²	64	81.5 Å²	81.5	45%	0.448	44%	0.442	S	S	.	.	H	α-helix	trans	-59.9	-33.5	-179.6	74.8	0	0	0	0	113.8	E907 Q908 T913 E914	E907-S911 PolarHBondContact O-N 3.24Å; E907-S911 VanDerWaalsContact O-N 3.07Å; Q908-S911 PolarHBondContact O-N 3.14Å; Q908-S911 PolarHBondContact O-OG 2.93Å; S911-T913 PolarHBondContact O-N 3.05Å; S911-E914 PolarHBondContact O-N 2.95Å
912	V	64.4	Low	77.6	Confident	98 Å²	98	85.8 Å²	85.8	59%	0.594	47%	0.466	S	S	*	.	H	α-helix	trans	-69.3	-21.6	175	176.3	0	0	0	0	112.4	Q908 Q910	Q908-V912 PolarHBondContact O-N 3.46Å; Q908-V912 VanDerWaalsContact O-N 3.16Å; Q910-V912 VanDerWaalsContact C-N 3.27Å; Q910-V912 PolarHBondContact O-N 2.98Å
913	T	58.5	Low	76.1	Confident	122 Å²	122	92.3 Å²	92.3	75%	0.748	50%	0.501	S	S	*	.	H	α-helix	trans	-86.5	-15.1	179.1	-48.6	0	0	0	0	112.5	A909 Q910 S911	A909-T913 PolarHBondContact O-OG1 3.29Å; Q910-T913 WeakPolarHBondContact O-CA 3.26Å; Q910-T913 WeakPolarHBondContact O-CB 3.38Å; Q910-T913 PolarHBondContact O-N 3.24Å; S911-T913 PolarHBondContact O-N 3.05Å
914	E	49	Very low	74.5	Confident	164 Å²	164	92.1 Å²	92.1	77%	0.766	50%	0.502	S	S	*	.			trans	-99	-1.3	-177.7	-67.2	-178	-176.1	0	0	114	Q910 S911	Q910-E914 PolarHBondContact O-N 3.05Å; S911-E914 PolarHBondContact O-N 2.95Å
915	T	42.8	Very low	72.6	Confident	173 Å²	173	93.7 Å²	93.7	100%	1.061	51%	0.512	S	S	*	.			trans	-111.9	0	-175.2	57.8	0	0	0	0	114.7

Retrieved 915 of 915 residues in 419.5 ms (Link to these results)

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