A0A3Q0KJZ7_SCHMA Loading...

Putative cyclic nucleotide-gated ion channel

AlphaFold DB , UniProt , Accession A0A3Q0KJZ7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,225 aa.

						>A0A3Q0KJZ7_SCHMA|A0A3Q0KJZ7
MDDTHASTSDDSVITLDNSKQSNWFICKEDKTDENVTTYEKQNRIRQRLTSENYSNTQPNVPLLYNGPYSYSDPKEKHDIIQGVNKTSILGTPSSLENKSQKLRKSSWNSALFYFNPSGRIVHTWCGVISIVFMYHLWVIIYRFAFNEINQQTVIFWLTLDYFADLLYLIDMTISLKTGFLEDGVMQFDGMKMRSHYLNSSRFYIDCLSLLPLDFLYLSIGFKSILRIFRLCKVYKFWQFMDRAERHTNYPNLMRSTKLLLYYLTFLHWNACVFQLINSTADSLFMTSLTQSPTSRTTITEGSRTNISNLGATHTNYHTTNINNSHRNNSNQNTNHISNRSNVSDNGINNDSSLLLRSNHSLSNINNETSATSATITSANTDVGSLITMSPNLHSFNKIHLTPGHHDGYEYLHAFYWSMLSLFPVGGFPTPKCPIAYFYLICEGVIGMFLMATVLGHVSNIVTNVSAAQKEFQARLDSVKNYMSLRRVPASLQERVINWFDFLWYTNKITDEEKVLRNLPYKLKAEIAIHVHLNTLKQVEIFQDTEEGFLSELVLKLRVVLFAPGDYVCRKGEIGKQMYIVNRGKLHVLGDDGHTVLATLHAGSYFGELSILNLGNNGNRRTASVRSLGYSDLFCLSKSDLWKVLKEYPNARSKLEADAYRKINQYQNIPQQNIKDFPNKSIPFERKVMNSTDPMNYIGYSALALDSTHLRNNNPTINQNSHSQLDMNSNHECLVRVSNSDGSDGYGSDPSRCSAFLPTPQRSPTPSAIVVMNNPDKTHITSNHGPFIQPNPTIFNVAGQSQSVYENRSSSVPTTVNDSLGNFTAMCSNENEQVCNCLVAEPNKCSRLKPYQNDSIPFGKQRHLSMPTNLFSTDDSFYHPNSSQLKESNVKSTPIALHSGVMITDFHSNQWKEVENEKLFRKNCHFDCSMKGKQTITSNLDSSNHDGTVNGKRVIPIICFEKASTPSISEATISEDEQEYQAVYEHTSQPSSSPFINKTPAYSSSMLKSEPTHGKYCTHLKIPKHKTPNWTARRPPWPYKTCSHHYKPSGIFKTGHISNHSKEDNSMFNAIHSYKHNKTNHELIEHLSYLTYRINKLENENYFLQNNLFNQSNSMMTQQQQQQPPPPQQQQHQVQPSLSQQKWSPTVNLTRKYSLPIKSTNVFQQFQDYLKIPDNIQINDPRSNEYDHSKDLKFNISQSNLQKNEENLVDKPNITNNNCPVFTLE
					

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Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.4	Very low	32.3	Very low	226 Å²	226	142.8 Å²	142.8	100%	1.113	82%	0.819	S	S	*	*				0	57.4	0	-69	-179	170.9	0	0	108.3
2	D	30.5	Very low	31.8	Very low	140 Å²	140	139.4 Å²	139.4	75%	0.749	81%	0.81	S	S	*	*				64.3	105.4	119.6	-38	-5.9	0	0	0	115
3	D	29.6	Very low	31.6	Very low	147 Å²	147	139.3 Å²	139.3	79%	0.786	81%	0.812	S	S	*	*				68.2	133	80.8	-77.7	-17.4	0	0	0	111.7
4	T	32.3	Very low	31.3	Very low	115 Å²	115	139.6 Å²	139.6	71%	0.706	81%	0.806	S	S	*	*			cis	-164.9	167	22.8	23.6	0	0	0	0	111.9
5	H	32.4	Very low	31.1	Very low	184 Å²	184	138.9 Å²	138.9	85%	0.852	81%	0.806	S	S	*	*			trans	-3.5	141	156.9	-62.2	-91.5	0	0	0	122.6
6	A	34.8	Very low	30.9	Very low	110 Å²	110	139.9 Å²	139.9	91%	0.909	81%	0.806	S	S	*	*			trans	-157.2	153.2	132.7	0	0	0	0	0	112
7	S	29.3	Very low	30.7	Very low	106 Å²	106	139.5 Å²	139.5	74%	0.741	80%	0.8	S	S	*	*			trans	-129.5	147.7	-168.4	55.4	0	0	0	0	114
8	T	34.9	Very low	30.5	Very low	133 Å²	133	140.3 Å²	140.3	82%	0.816	80%	0.802	S	S	*	*			trans	178.3	123	150.7	33.8	0	0	0	0	108.5
9	S	31.8	Very low	30.4	Very low	87 Å²	87	137.3 Å²	137.3	61%	0.608	79%	0.79	S	S	*	*				54.7	128.9	72.7	72.6	0	0	0	0	114.1
10	D	31.8	Very low	30.2	Very low	150 Å²	150	140.9 Å²	140.9	80%	0.802	80%	0.796	S	S	*	*			cis	-157.7	153.6	-6.3	-86.2	-40.4	0	0	0	107.4
11	D	34.1	Very low	30	Very low	173 Å²	173	143.1 Å²	143.1	93%	0.925	80%	0.8	S	S	*	*			trans	-179.2	133.1	131.6	-105.2	-22.8	0	0	0	111.8
12	S	27	Very low	29.6	Very low	102 Å²	102	136.7 Å²	136.7	71%	0.713	78%	0.777	S	S	*	*			trans	-107.8	132.3	-162.6	60.7	0	0	0	0	114.2
13	V	29.5	Very low	29.4	Very low	138 Å²	138	135.5 Å²	135.5	84%	0.836	77%	0.771	S	S	*	*			trans	-127.7	108.7	154	178.5	0	0	0	0	108.2	T15	V13-T15 PolarHBondContact O-N 3.32Å
14	I	26.3	Very low	29.2	Very low	143 Å²	143	139.2 Å²	139.2	73%	0.733	77%	0.774	S	S	*	*			trans	-72.3	115.9	-172.7	-61.1	164.4	0	0	0	109.8
15	T	28.8	Very low	29	Very low	130 Å²	130	140.5 Å²	140.5	80%	0.798	77%	0.77	S	S	*	*			trans	-126.2	124	158.2	41.8	0	0	0	0	108.4	V13 D17	V13-T15 PolarHBondContact O-N 3.32Å; T15-D17 PolarHBondContact O-N 3.26Å
16	L	28.2	Very low	28.7	Very low	154 Å²	154	137.4 Å²	137.4	81%	0.806	76%	0.759	S	S	*	*			trans	-78.3	104.6	-172.8	-85.4	149.3	0	0	0	110.7	N18	L16-N18 PolarHBondContact O-N 2.81Å
17	D	27.5	Very low	28.4	Very low	133 Å²	133	136.7 Å²	136.7	71%	0.711	75%	0.746	S	S	*	*			trans	-79.8	103.8	171.4	-169.1	-16.7	0	0	0	110.2	T15 S19	T15-D17 PolarHBondContact O-N 3.26Å; D17-S19 PolarHBondContact O-N 3.35Å; D17-S19 VanDerWaalsContact OD1-CB 3.31Å; D17-S19 WeakPolarHBondContact OD1-CB 3.19Å; D17-S19 PolarHBondContact OD1-N 3.24Å; D17-S19 PolarHBondContact OD1-OG 3.13Å
18	N	26.9	Very low	28.3	Very low	154 Å²	154	140.2 Å²	140.2	82%	0.824	75%	0.748	S	S	*	*			trans	-99.5	65.8	177.7	-91.6	-17.6	0	0	0	110.9	L16	L16-N18 PolarHBondContact O-N 2.81Å
19	S	28	Very low	27.9	Very low	84 Å²	84	142.4 Å²	142.4	59%	0.587	75%	0.749	S	S	*	*			trans	-109.1	28.3	176.8	51	0	0	0	0	113.7	D17	D17-S19 PolarHBondContact O-N 3.35Å; D17-S19 VanDerWaalsContact OD1-CB 3.31Å; D17-S19 WeakPolarHBondContact OD1-CB 3.19Å; D17-S19 PolarHBondContact OD1-N 3.24Å; D17-S19 PolarHBondContact OD1-OG 3.13Å
20	K	27.5	Very low	27.8	Very low	208 Å²	208	144.7 Å²	144.7	90%	0.904	75%	0.754	S	S	*	*			trans	-100.2	68.2	173.6	-74.7	-173	176.5	178.4	0	113.1
21	Q	25.5	Very low	27.6	Very low	188 Å²	188	147.1 Å²	147.1	88%	0.879	76%	0.758	S	S	*	*			trans	-157.6	73	160.1	-120.2	171.8	13.8	0	0	111.9
22	S	25.5	Very low	27.3	Very low	91 Å²	91	144.6 Å²	144.6	64%	0.636	75%	0.749	S	S	*	*			trans	-150.7	148.7	161.9	54.5	0	0	0	0	108.2
23	N	26.2	Very low	27.6	Very low	115 Å²	115	146.7 Å²	146.7	62%	0.615	75%	0.752	S	S	*	*			trans	109.9	73.1	179.3	-60.1	-9.8	0	0	0	115.9
24	W	24.7	Very low	27.6	Very low	226 Å²	226	148.2 Å²	148.2	86%	0.856	75%	0.75	S	S	*	*	S	Bend	trans	-126.9	13.4	154.5	-83.1	97.4	0	0	0	113.9
25	F	28	Very low	27.8	Very low	142 Å²	142	148.5 Å²	148.5	62%	0.623	75%	0.753	S	S	*	*	S	Bend	trans	-121.8	55.2	170.8	-93.6	-73.5	0	0	0	112	R202	F25-R202 VanDerWaalsContact CZ-NH2 3.35Å
26	I	26.7	Very low	28.3	Very low	118 Å²	118	146.2 Å²	146.2	61%	0.605	74%	0.739	S	S	*	*			trans	-132	111.7	162.5	-61.7	179.6	0	0	0	106.5
27	C	28	Very low	28.9	Very low	95 Å²	95	143.1 Å²	143.1	64%	0.642	73%	0.726	S	S	*	*			trans	-64.3	139.3	164.3	-83	0	0	0	0	108.2	E29	C27-E29 PolarHBondContact O-N 3.49Å
28	K	26.5	Very low	29.5	Very low	181 Å²	181	142.1 Å²	142.1	79%	0.787	73%	0.725	S	S	*	*			trans	-38.9	125.9	-179.3	-73.6	176	169.1	-177.3	0	112.6	D30	K28-D30 VanDerWaalsContact C-N 3.34Å; K28-D30 PolarHBondContact O-N 2.96Å
29	E	26.9	Very low	29.9	Very low	179 Å²	179	142.1 Å²	142.1	84%	0.836	72%	0.715	S	S	*	*			trans	-66.1	98.2	151	-70.8	178.4	128.5	0	0	107.8	C27 K31	C27-E29 PolarHBondContact O-N 3.49Å; E29-K31 PolarHBondContact O-N 2.96Å
30	D	31.1	Very low	30.6	Very low	134 Å²	134	142.5 Å²	142.5	72%	0.717	71%	0.707	S	S	*	*			trans	-69.3	115.6	164.6	-83.9	-27.2	0	0	0	108.3	K28 T32	K28-D30 VanDerWaalsContact C-N 3.34Å; K28-D30 PolarHBondContact O-N 2.96Å; D30-T32 PolarHBondContact O-N 3.4Å; D30-T32 VanDerWaalsContact O-N 3.1Å
31	K	27.1	Very low	31.2	Very low	202 Å²	202	139.5 Å²	139.5	88%	0.878	69%	0.694	S	S	*	*			trans	-72.7	94.7	-178.6	-65.2	176.1	177.5	179.8	0	111.2	E29	E29-K31 PolarHBondContact O-N 2.96Å
32	T	28.4	Very low	32.2	Very low	120 Å²	120	134.2 Å²	134.2	74%	0.736	67%	0.669	S	S	*	*			trans	-164.1	143.9	153.6	32	0	0	0	0	111	D30	D30-T32 PolarHBondContact O-N 3.4Å; D30-T32 VanDerWaalsContact O-N 3.1Å
33	D	31.7	Very low	32.9	Very low	146 Å²	146	133.7 Å²	133.7	78%	0.781	66%	0.659	S	S	*	*			trans	76.7	77.6	158.5	-52.4	-11.2	0	0	0	119.6
34	E	30.8	Very low	33.5	Very low	170 Å²	170	135.5 Å²	135.5	79%	0.794	66%	0.657	S	S	*	*				37.8	122.9	126.5	-60.8	-166.2	154.3	0	0	122.2
35	N	30.2	Very low	34.5	Very low	148 Å²	148	129.8 Å²	129.8	79%	0.791	64%	0.643	S	S	*	*			trans	63.9	50.1	132.3	-58.2	-27.6	0	0	0	120.2
36	V	38.5	Very low	35	Very low	83 Å²	83	128.3 Å²	128.3	50%	0.503	63%	0.633	S	S	.	*			trans	-140.4	119.3	149.9	-175	0	0	0	0	110.1	E40	V36-E40 HydrophobicContact CG1-CB 4.06Å
37	T	41.6	Very low	35.6	Very low	89 Å²	89	129.4 Å²	129.4	55%	0.546	64%	0.635	S	S	.	*			trans	-73.4	145.4	175.7	61.9	0	0	0	0	111	Y39 E40	T37-Y39 PolarHBondContact O-N 2.96Å; T37-E40 PolarHBondContact N-OE2 3.02Å; T37-E40 PolarHBondContact O-N 3.27Å; T37-E40 PolarHBondContact OG1-OE2 3.37Å
38	T	40.3	Very low	36	Very low	111 Å²	111	134.7 Å²	134.7	68%	0.681	64%	0.642	S	S	*	*	H	α-helix	trans	-54.8	-29.4	-178.5	-37	0	0	0	0	112.7	E40 K41 Q42	T38-E40 VanDerWaalsContact C-N 3.35Å; T38-E40 PolarHBondContact O-N 2.69Å; T38-K41 PolarHBondContact O-N 3.34Å; T38-Q42 PolarHBondContact O-N 2.97Å
39	Y	34.4	Very low	36.6	Very low	155 Å²	155	132.9 Å²	132.9	61%	0.608	64%	0.64	S	S	*	*	H	α-helix	trans	-59.5	-36.8	174.1	-127	-95.6	0	0	0	113.7	T37 N43	T37-Y39 PolarHBondContact O-N 2.96Å; Y39-N43 PolarHBondContact O-N 3.05Å
40	E	42.4	Very low	37.1	Very low	92 Å²	92	129.8 Å²	129.8	43%	0.43	63%	0.633	S	S	.	*	H	α-helix	trans	-77.8	-30	-179.7	-69.1	176.6	107.9	0	0	112.6	V36 T37 T38 R44	V36-E40 HydrophobicContact CG1-CB 4.06Å; T37-E40 PolarHBondContact N-OE2 3.02Å; T37-E40 PolarHBondContact O-N 3.27Å; T37-E40 PolarHBondContact OG1-OE2 3.37Å; T38-E40 VanDerWaalsContact C-N 3.35Å; T38-E40 PolarHBondContact O-N 2.69Å; E40-R44 WeakPolarHBondContact O-CG 3.31Å; E40-R44 PolarHBondContact O-N 3.35Å; E40-R44 VanDerWaalsContact O-N 3.07Å
41	K	40.2	Very low	37	Very low	145 Å²	145	127.4 Å²	127.4	63%	0.63	63%	0.627	S	S	*	*	H	α-helix	trans	-64.1	-45.1	172.8	-101	177.1	177.7	170.3	0	111.4	T38 R44 I45	T38-K41 PolarHBondContact O-N 3.34Å; K41-R44 PolarHBondContact O-N 3.33Å; K41-I45 WeakPolarHBondContact O-CG1 3.42Å; K41-I45 PolarHBondContact O-N 3.01Å
42	Q	46.8	Very low	37.3	Very low	76 Å²	76	126.5 Å²	126.5	36%	0.355	63%	0.626	S	S	.	*	H	α-helix	trans	-65.4	-39.9	177.6	-72.8	-174.7	-20.2	0	0	112.3	T38 I45 R46	T38-Q42 PolarHBondContact O-N 2.97Å; Q42-I45 PolarHBondContact O-N 3.42Å; Q42-R46 PolarHBondContact O-N 3.08Å; Q42-R46 VanDerWaalsContact O-N 3.09Å
43	N	39.6	Very low	37.3	Very low	80 Å²	80	128 Å²	128	43%	0.428	63%	0.63	S	S	.	*	H	α-helix	trans	-65	-38.2	175.6	-88.6	-22.4	0	0	0	113.3	Y39 I45 R46 Q47	Y39-N43 PolarHBondContact O-N 3.05Å; N43-I45 VanDerWaalsContact C-N 3.33Å; N43-I45 PolarHBondContact O-N 3.44Å; N43-R46 PolarHBondContact O-N 3.07Å; N43-Q47 WeakPolarHBondContact O-CG 3.48Å; N43-Q47 PolarHBondContact O-N 3.17Å
44	R	39.9	Very low	37.1	Very low	153 Å²	153	132.4 Å²	132.4	58%	0.577	64%	0.637	S	S	*	*	H	α-helix	trans	-66.4	-31.1	175.8	-74.2	-177	-171.9	-173.2	6.4	113.4	E40 K41 R48	E40-R44 WeakPolarHBondContact O-CG 3.31Å; E40-R44 PolarHBondContact O-N 3.35Å; E40-R44 VanDerWaalsContact O-N 3.07Å; K41-R44 PolarHBondContact O-N 3.33Å; R44-R48 WeakPolarHBondContact O-CG 3.28Å
45	I	45.2	Very low	37	Very low	107 Å²	107	129.1 Å²	129.1	55%	0.549	63%	0.633	S	S	.	*	H	α-helix	trans	-71.6	-43.5	174.3	-66.6	168	0	0	0	109.9	K41 Q42 N43 Q47 R48 L49	K41-I45 WeakPolarHBondContact O-CG1 3.42Å; K41-I45 PolarHBondContact O-N 3.01Å; Q42-I45 PolarHBondContact O-N 3.42Å; N43-I45 VanDerWaalsContact C-N 3.33Å; N43-I45 PolarHBondContact O-N 3.44Å; I45-Q47 VanDerWaalsContact C-N 3.33Å; I45-Q47 PolarHBondContact O-N 3.35Å; I45-R48 PolarHBondContact O-N 3.26Å; I45-R48 VanDerWaalsContact O-N 3.14Å; I45-L49 HydrophobicContact CG2-CD1 4.23Å
46	R	38.8	Very low	36.9	Very low	110 Å²	110	129.4 Å²	129.4	42%	0.415	63%	0.634	S	S	.	*	H	α-helix	trans	-63.4	-35.7	179.2	-167	167.3	-70.9	166.4	-6.6	113.2	Q42 N43 R48 L49 A982	Q42-R46 PolarHBondContact O-N 3.08Å; Q42-R46 VanDerWaalsContact O-N 3.09Å; N43-R46 PolarHBondContact O-N 3.07Å; R46-R48 VanDerWaalsContact C-N 3.33Å; R46-R48 PolarHBondContact O-N 2.99Å; R46-L49 PolarHBondContact O-N 3.44Å; R46-A982 PolarHBondContact NH1-O 3.46Å; R46-A982 PolarHBondContact NH2-O 3.35Å
47	Q	39.9	Very low	36.6	Very low	141 Å²	141	132.6 Å²	132.6	66%	0.659	65%	0.654	S	S	*	*	H	α-helix	trans	-70.8	-21.3	174.9	-74.6	178.5	-17.9	0	0	114.5	N43 I45 T50	N43-Q47 WeakPolarHBondContact O-CG 3.48Å; N43-Q47 PolarHBondContact O-N 3.17Å; I45-Q47 VanDerWaalsContact C-N 3.33Å; I45-Q47 PolarHBondContact O-N 3.35Å; Q47-T50 PolarHBondContact O-OG1 3.36Å
48	R	36.9	Very low	35.9	Very low	207 Å²	207	137.3 Å²	137.3	78%	0.781	67%	0.67	S	S	*	*	H	α-helix	trans	-83.3	-15.6	176.5	-73.1	180	-176.2	-171.5	0.9	114	R44 I45 R46	R44-R48 WeakPolarHBondContact O-CG 3.28Å; I45-R48 PolarHBondContact O-N 3.26Å; I45-R48 VanDerWaalsContact O-N 3.14Å; R46-R48 VanDerWaalsContact C-N 3.33Å; R46-R48 PolarHBondContact O-N 2.99Å
49	L	38.7	Very low	35.4	Very low	142 Å²	142	137 Å²	137	74%	0.743	67%	0.67	S	S	*	*	S	Bend	trans	-96.5	-0.9	-178.5	-81.2	156.5	0	0	0	113.5	I45 R46	I45-L49 HydrophobicContact CG2-CD1 4.23Å; R46-L49 PolarHBondContact O-N 3.44Å
50	T	36.2	Very low	35.1	Very low	114 Å²	114	137.1 Å²	137.1	70%	0.699	68%	0.681	S	S	*	*	S	Bend	trans	-114.9	17.2	-175.2	55.4	0	0	0	0	113.8	Q47	Q47-T50 PolarHBondContact O-OG1 3.36Å
51	S	30.3	Very low	34.4	Very low	84 Å²	84	139.1 Å²	139.1	59%	0.587	70%	0.7	S	S	*	*			trans	-120.6	10	-171.5	62.4	0	0	0	0	115.7
52	E	33.6	Very low	33.7	Very low	184 Å²	184	137.4 Å²	137.4	86%	0.86	70%	0.703	S	S	*	*			trans	-103.9	114.9	176.9	-68.3	-165.5	154.5	0	0	111.9
53	N	27.8	Very low	32.7	Very low	150 Å²	150	142 Å²	142	80%	0.802	73%	0.729	S	S	*	*			trans	-56.3	127.9	-175	-55.3	-65.9	0	0	0	113.3
54	Y	27.7	Very low	32	Very low	239 Å²	239	145 Å²	145	94%	0.937	74%	0.744	S	S	*	*			trans	-140	108.3	148.4	-98	-76.9	0	0	0	111.7
55	S	28.5	Very low	31.4	Very low	101 Å²	101	148 Å²	148	71%	0.706	76%	0.757	S	S	*	*			trans	-86.8	140.2	174	44.6	0	0	0	0	111.5
56	N	27.4	Very low	30.6	Very low	154 Å²	154	149.9 Å²	149.9	82%	0.824	77%	0.768	S	S	*	*			trans	34.7	97.3	152.2	-61	-13.7	0	0	0	118.9
57	T	32.6	Very low	30.1	Very low	150 Å²	150	147.9 Å²	147.9	92%	0.92	78%	0.782	S	S	*	*				-173.8	126.1	118.9	20.3	0	0	0	0	111.8
58	Q	27.3	Very low	29.5	Very low	189 Å²	189	146.6 Å²	146.6	88%	0.883	79%	0.786	S	S	*	*			trans	-86.3	155.2	162.4	-100.1	-177.2	-6.7	0	0	108.7
59	P	29.7	Very low	29	Very low	105 Å²	105	148.4 Å²	148.4	68%	0.682	80%	0.795	S	S	*	*				-150.3	165.3	62.7	38.8	-17.9	0	0	0	119.1
60	N	26.6	Very low	28.3	Very low	156 Å²	156	145.9 Å²	145.9	83%	0.834	79%	0.789	S	S	*	*			trans	53	87.6	151.3	-60.9	-11.3	0	0	0	120.2
61	V	28.6	Very low	28	Very low	135 Å²	135	147 Å²	147	82%	0.818	78%	0.781	S	S	*	*			trans	-137.3	137.8	150.9	-175.5	0	0	0	0	108.7
62	P	25.5	Very low	27.8	Very low	109 Å²	109	146.7 Å²	146.7	71%	0.708	78%	0.779	S	S	*	*			trans	-68.7	147	-175.3	-18.5	31.9	0	0	0	113.7	L64	P62-L64 VanDerWaalsContact C-N 3.27Å; P62-L64 PolarHBondContact O-N 3.37Å
63	L	26.2	Very low	27.5	Very low	172 Å²	172	142 Å²	142	90%	0.901	76%	0.76	S	S	*	*			trans	-70.7	78.5	171.1	-91.6	160.4	0	0	0	111.4	Y65	L63-Y65 PolarHBondContact O-N 2.92Å
64	L	25.7	Very low	27.9	Very low	142 Å²	142	140 Å²	140	74%	0.743	76%	0.756	S	S	*	*			trans	-83.9	82.1	172.7	-117.9	161.4	0	0	0	109.8	P62	P62-L64 VanDerWaalsContact C-N 3.27Å; P62-L64 PolarHBondContact O-N 3.37Å
65	Y	26.3	Very low	28.2	Very low	217 Å²	217	137.4 Å²	137.4	85%	0.851	75%	0.749	S	S	*	*			trans	-119	41	174.2	-134.9	-83.8	0	0	0	112.9	L63	L63-Y65 PolarHBondContact O-N 2.92Å
66	N	28.8	Very low	28.6	Very low	146 Å²	146	138.4 Å²	138.4	78%	0.781	74%	0.743	S	S	*	*			trans	-93.7	113.7	158.6	-60.2	-18.3	0	0	0	104.9
67	G	27.5	Very low	28.9	Very low	69 Å²	69	138.9 Å²	138.9	71%	0.711	74%	0.737	S	S	*	*				93.9	145.8	57.7	0	0	0	0	0	109.1
68	P	27.8	Very low	29.2	Very low	113 Å²	113	138.5 Å²	138.5	73%	0.734	73%	0.725	S	S	*	*			cis	-121.9	-178.4	-5.8	40.3	-25.7	0	0	0	113.2	S70	P68-S70 VanDerWaalsContact C-N 3.25Å; P68-S70 PolarHBondContact O-N 3.03Å
69	Y	26.4	Very low	29.7	Very low	246 Å²	246	135.5 Å²	135.5	97%	0.965	72%	0.715	S	S	*	*			trans	-71.4	79.1	164.6	-78.4	-98.7	0	0	0	110.5
70	S	24.4	Very low	30.3	Very low	89 Å²	89	135.8 Å²	135.8	62%	0.622	71%	0.709	S	S	*	*			trans	-93.1	129.4	165.6	-167.8	0	0	0	0	109.8	P68 S72	P68-S70 VanDerWaalsContact C-N 3.25Å; P68-S70 PolarHBondContact O-N 3.03Å; S70-S72 PolarHBondContact O-N 3.2Å
71	Y	29.1	Very low	30.9	Very low	137 Å²	137	133.9 Å²	133.9	54%	0.537	70%	0.698	S	S	.	*			trans	-78.3	72.4	178.5	-161.2	-87	0	0	0	109.6	N116 G119	Y71-N116 PolarHBondContact OH-ND2 2.74Å; Y71-G119 VanDerWaalsContact OH-CA 3.3Å; Y71-G119 WeakPolarHBondContact OH-CA 3.1Å
72	S	26.1	Very low	31.4	Very low	78 Å²	78	135.4 Å²	135.4	55%	0.545	70%	0.696	S	S	.	*			trans	-76.5	135.8	173.8	39.7	0	0	0	0	110.9	S70	S70-S72 PolarHBondContact O-N 3.2Å
73	D	28.5	Very low	31.9	Very low	84 Å²	84	133 Å²	133	45%	0.449	69%	0.692	S	S	.	*			trans	-59.6	143.6	-178.8	-79.8	-61.3	0	0	0	110.7	K75 E76 R120	D73-K75 PolarHBondContact O-N 3.45Å; D73-E76 PolarHBondContact O-N 3.41Å; D73-R120 IonicContact OD1-NH2 3.93Å; D73-R120 PolarHBondContact OD1-NH2 2.76Å; D73-R120 IonicContact OD2-NH2 2.72Å; D73-R120 PolarHBondContact OD2-NH2 3.4Å
74	P	35.5	Very low	32.7	Very low	110 Å²	110	130.1 Å²	130.1	71%	0.714	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	12.4	-170.3	27.5	-36.3	0	0	0	115.6
75	K	34.4	Very low	33.1	Very low	183 Å²	183	130.6 Å²	130.6	80%	0.796	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-29.1	176	-69	-173.6	174.3	-176.8	0	113.2	D73	D73-K75 PolarHBondContact O-N 3.45Å
76	E	36.2	Very low	33.6	Very low	123 Å²	123	129.3 Å²	129.3	58%	0.575	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-80.5	-22.7	-173.8	-161.6	167.6	-149.1	0	0	113.3	D73 H78 I80	D73-E76 PolarHBondContact O-N 3.41Å; E76-H78 VanDerWaalsContact C-N 3.25Å; E76-H78 PolarHBondContact O-N 3.5Å; E76-I80 HydrophobicContact CG-CD1 4.34Å
77	K	34.4	Very low	34	Very low	163 Å²	163	128.5 Å²	128.5	71%	0.709	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-74.4	-10.9	-177.2	-143.1	174.7	-172.3	176.3	0	114.4	I81	K77-I81 WeakPolarHBondContact O-CD1 3.4Å
78	H	38.2	Very low	34.3	Very low	142 Å²	142	130.2 Å²	130.2	66%	0.657	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-86.1	-28.4	178.8	-98.6	-71.2	0	0	0	113.8	E76	E76-H78 VanDerWaalsContact C-N 3.25Å; E76-H78 PolarHBondContact O-N 3.5Å
79	D	36.8	Very low	34.9	Very low	126 Å²	126	133.2 Å²	133.2	67%	0.674	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-36.4	-176.6	-65.1	-24.4	0	0	0	112.1	I81 Q82	D79-I81 VanDerWaalsContact C-N 3.26Å; D79-I81 PolarHBondContact O-N 3.43Å; D79-Q82 PolarHBondContact O-N 2.95Å
80	I	42.3	Very low	35.1	Very low	112 Å²	112	130.1 Å²	130.1	57%	0.574	69%	0.692	S	S	*	*	H	α-helix	trans	-64.8	-29.3	-179.6	-62.2	173.8	0	0	0	112	E76	E76-I80 HydrophobicContact CG-CD1 4.34Å
81	I	41.1	Very low	35.6	Very low	116 Å²	116	128.9 Å²	128.9	60%	0.595	69%	0.693	S	S	*	*	H	α-helix	trans	-79.2	-15.9	-179.1	-63.8	177.9	0	0	0	112.5	K77 D79	K77-I81 WeakPolarHBondContact O-CD1 3.4Å; D79-I81 VanDerWaalsContact C-N 3.26Å; D79-I81 PolarHBondContact O-N 3.43Å
82	Q	38.2	Very low	36.1	Very low	166 Å²	166	128.6 Å²	128.6	78%	0.776	71%	0.706	S	S	*	*	H	α-helix	trans	-92.2	-15	174.3	-65.2	-162.6	6.7	0	0	114.1	D79	D79-Q82 PolarHBondContact O-N 2.95Å
83	G	36.8	Very low	36.3	Very low	60 Å²	60	131.1 Å²	131.1	62%	0.619	72%	0.72	S	S	*	*	H	α-helix	trans	-80.1	-24.2	-178.9	0	0	0	0	0	116
84	V	41.2	Very low	36.7	Very low	111 Å²	111	132.6 Å²	132.6	67%	0.673	74%	0.737	S	S	*	*	S	Bend	trans	-92.3	-13.4	-163.2	-178.5	0	0	0	0	114.3	K86	V84-K86 PolarHBondContact O-N 3.26Å
85	N	35.1	Very low	36.9	Very low	151 Å²	151	132.5 Å²	132.5	81%	0.807	74%	0.739	S	S	*	*	S	Bend	trans	-95.5	31	-174.5	-80.1	-23.3	0	0	0	115
86	K	36.3	Very low	36.9	Very low	191 Å²	191	130.5 Å²	130.5	83%	0.83	74%	0.737	S	S	*	*			trans	-135	34.5	-173.3	-104.8	-169.9	-178.4	-178.9	0	117.4	V84	V84-K86 PolarHBondContact O-N 3.26Å
87	T	37.8	Very low	37	Very low	129 Å²	129	133.4 Å²	133.4	79%	0.791	75%	0.75	S	S	*	*			trans	-166.9	140.3	159.7	39.1	0	0	0	0	107.9
88	S	33.8	Very low	37.2	Very low	104 Å²	104	133.3 Å²	133.3	73%	0.727	76%	0.757	S	S	*	*			cis	-172.1	108.9	-9.6	46	0	0	0	0	108.1
89	I	39.4	Very low	37.3	Very low	176 Å²	176	134.2 Å²	134.2	90%	0.903	76%	0.759	S	S	*	*			trans	-132.3	128.6	162.4	-61.2	-175.4	0	0	0	109
90	L	31.6	Very low	37.5	Very low	181 Å²	181	132.6 Å²	132.6	95%	0.948	76%	0.758	S	S	*	*			trans	-74.7	125	-172.9	-168.5	71.9	0	0	0	110.7
91	G	35.8	Very low	37.4	Very low	64 Å²	64	135.9 Å²	135.9	66%	0.66	77%	0.771	S	S	*	*			trans	-172.7	97.1	179.8	0	0	0	0	0	114.9
92	T	37.8	Very low	37.3	Very low	130 Å²	130	139.8 Å²	139.8	80%	0.798	78%	0.783	S	S	*	*			trans	36.8	107.7	159.5	52.7	0	0	0	0	119.6
93	P	31.8	Very low	37.4	Very low	131 Å²	131	139.1 Å²	139.1	85%	0.851	78%	0.784	S	S	*	*			trans	-91.8	110.8	176.3	34.2	-30.3	0	0	0	113
94	S	36.6	Very low	37.3	Very low	116 Å²	116	147.6 Å²	147.6	81%	0.811	80%	0.798	S	S	*	*	S	Bend	trans	-156.7	6.8	170.3	60.5	0	0	0	0	117.4
95	S	38.7	Very low	37.1	Very low	107 Å²	107	152.3 Å²	152.3	75%	0.748	81%	0.809	S	S	*	*	S	Bend	trans	-136.1	8.1	-172.3	65.3	0	0	0	0	116.8
96	L	36.1	Very low	37.3	Very low	142 Å²	142	150.5 Å²	150.5	74%	0.743	81%	0.808	S	S	*	*			trans	-89.4	-5.2	-169.1	-95.9	158.6	0	0	0	116.1	N98	L96-N98 VanDerWaalsContact C-N 3.3Å; L96-N98 PolarHBondContact O-N 3.32Å
97	E	38.4	Very low	37.1	Very low	183 Å²	183	146.3 Å²	146.3	86%	0.855	80%	0.803	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-12.2	-169.3	-146.4	165	-161.7	0	0	114.7
98	N	38.1	Very low	37.3	Very low	161 Å²	161	151.5 Å²	151.5	86%	0.861	81%	0.808	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	8.2	-174.6	-105.7	-32.7	0	0	0	116	L96	L96-N98 VanDerWaalsContact C-N 3.3Å; L96-N98 PolarHBondContact O-N 3.32Å
99	K	40.2	Very low	37.3	Very low	162 Å²	162	153.6 Å²	153.6	70%	0.704	81%	0.812	S	S	*	*	S	Bend	trans	-107.4	-11.2	179.1	-82.3	-177.6	176.4	175.4	0	115.6
100	S	39.8	Very low	37.4	Very low	91 Å²	91	149.9 Å²	149.9	64%	0.636	80%	0.801	S	S	*	*	S	Bend	trans	-73.2	-27	-174	58.6	0	0	0	0	114.8
101	Q	41.2	Very low	38	Very low	181 Å²	181	146.1 Å²	146.1	85%	0.846	80%	0.796	S	S	*	*	S	Bend	trans	-91.6	-13.6	-174.6	-67.7	-172.2	-7.9	0	0	115.2
102	K	39.2	Very low	38.8	Very low	198 Å²	198	148.1 Å²	148.1	86%	0.861	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-6.6	-176.4	-127.3	174.1	-174.3	175.7	0	115
103	L	39.7	Very low	40.4	Very low	153 Å²	153	148.8 Å²	148.8	80%	0.801	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	2.3	-177.8	-83	161.9	0	0	0	114.7
104	R	34.6	Very low	42.7	Very low	238 Å²	238	145.4 Å²	145.4	90%	0.898	75%	0.754	S	S	*	*	S	Bend	trans	-104.9	29.3	-170.7	-151	175.3	176.1	-172.5	-2.8	114.8
105	K	38.1	Very low	44.9	Very low	210 Å²	210	141.2 Å²	141.2	91%	0.913	72%	0.721	S	S	*	*	S	Bend	trans	-132.9	16.4	-177	-114.1	-179.4	-178.6	-178.9	0	115.9
106	S	37.7	Very low	47	Very low	113 Å²	113	138.2 Å²	138.2	79%	0.79	70%	0.697	S	S	*	*			trans	-125.9	107.6	175.1	-176.2	0	0	0	0	109.6
107	S	33.5	Very low	49.2	Very low	103 Å²	103	133.3 Å²	133.3	72%	0.72	67%	0.673	S	S	*	*	S	Bend	trans	-154.5	-9.9	-174.7	-172.2	0	0	0	0	117.2
108	W	40.1	Very low	51.1	Low	237 Å²	237	128.1 Å²	128.1	90%	0.898	66%	0.657	S	S	*	*	S	Bend	trans	-136.2	-3.3	-173.9	-77	89.6	0	0	0	116
109	N	34.8	Very low	53.1	Low	149 Å²	149	120.8 Å²	120.8	80%	0.797	62%	0.62	S	S	*	*	S	Bend	trans	-106.6	125.8	176.9	-68.7	-12.5	0	0	0	110.1
110	S	42.5	Very low	55.3	Low	98 Å²	98	120.5 Å²	120.5	69%	0.685	61%	0.614	S	S	*	*			trans	76.8	42	167	-49	0	0	0	0	118.4	L112	S110-L112 PolarHBondContact O-N 3.4Å
111	A	42.6	Very low	57.6	Low	102 Å²	102	121.6 Å²	121.6	84%	0.843	61%	0.612	S	S	*	*			trans	-65.9	92.3	146.9	0	0	0	0	0	108.1	F113	A111-F113 VanDerWaalsContact C-N 3.33Å; A111-F113 PolarHBondContact O-N 3.38Å
112	L	53.8	Low	59.9	Low	106 Å²	106	113.8 Å²	113.8	56%	0.555	58%	0.577	S	S	*	*			trans	-70.2	82.7	-170.6	-80.7	152.1	0	0	0	111.5	S110 Y114	S110-L112 PolarHBondContact O-N 3.4Å; L112-Y114 HydrophobicContact CB-CD2 4.03Å; L112-Y114 HydrophobicContact CB-CE2 3.75Å; L112-Y114 HydrophobicContact CD2-CE2 3.72Å; L112-Y114 WeakPolarHBondContact CD2-OH 3.01Å; L112-Y114 HydrophobicContact CG-CE2 4.23Å; L112-Y114 PolarHBondContact O-N 3.27Å
113	F	70.5	Confident	62.2	Low	143 Å²	143	106.2 Å²	106.2	63%	0.627	54%	0.544	S	S	*	.			trans	-70.9	100.3	176.5	-151.5	-113.8	0	0	0	109.9	A111 F115	A111-F113 VanDerWaalsContact C-N 3.33Å; A111-F113 PolarHBondContact O-N 3.38Å; F113-F115 HydrophobicContact CD1-CE1 4.11Å; F113-F115 HydrophobicContact CD1-CE2 4.07Å; F113-F115 AromaticContact CD1-CZ 3.68Å; F113-F115 HydrophobicContact CD1-CZ 3.68Å; F113-F115 HydrophobicContact CE1-CD1 4.39Å; F113-F115 AromaticContact CE1-CE1 3.46Å; F113-F115 HydrophobicContact CE1-CE1 3.46Å; F113-F115 VanDerWaalsContact CE1-CE1 3.46Å; F113-F115 HydrophobicContact CE1-CE2 4.2Å; F113-F115 AromaticContact CE1-CZ 3.36Å; F113-F115 HydrophobicContact CE1-CZ 3.36Å; F113-F115 HydrophobicContact CZ-CE1 4.22Å; F113-F115 HydrophobicContact CZ-CZ 4.5Å
114	Y	79.7	Confident	64.6	Low	61 Å²	61	103.5 Å²	103.5	24%	0.239	53%	0.534	C	S	.	.			trans	-116.1	144.1	172.6	-65.7	-61.5	0	0	0	109.7	L112 K177 F188 G190 M193	L112-Y114 HydrophobicContact CB-CD2 4.03Å; L112-Y114 HydrophobicContact CB-CE2 3.75Å; L112-Y114 HydrophobicContact CD2-CE2 3.72Å; L112-Y114 WeakPolarHBondContact CD2-OH 3.01Å; L112-Y114 HydrophobicContact CG-CE2 4.23Å; L112-Y114 PolarHBondContact O-N 3.27Å; Y114-K177 HydrophobicContact CD1-CD 4.08Å; Y114-K177 HydrophobicContact CE1-CD 4.16Å; Y114-F188 HydrophobicContact CD2-CB 4.21Å; Y114-F188 WeakPolarHBondContact CE2-O 3.39Å; Y114-F188 HydrophobicContact CG-CD1 4.29Å; Y114-F188 PolarHBondContact OH-O 3.38Å; Y114-G190 VanDerWaalsContact OH-CA 3.32Å; Y114-G190 WeakPolarHBondContact OH-CA 3.25Å; Y114-G190 PolarHBondContact OH-N 3.3Å; Y114-G190 VanDerWaalsContact OH-N 3.13Å; Y114-M193 HydrophobicContact CD1-CE 3.56Å; Y114-M193 HydrophobicContact CD1-SD 3.8Å; Y114-M193 HydrophobicContact CE1-CE 3.93Å; Y114-M193 HydrophobicContact CE1-SD 3.72Å; Y114-M193 HydrophobicContact CG-CE 4.45Å
115	F	83.6	Confident	67.4	Low	28 Å²	28	94.6 Å²	94.6	12%	0.123	50%	0.5	C	S	.	.	B	Isolated β-bridge	trans	-100.1	126.4	178.7	-61.4	-83.2	0	0	0	110.6	F113 I121 V122 I174 K177 T178 G179	F113-F115 HydrophobicContact CD1-CE1 4.11Å; F113-F115 HydrophobicContact CD1-CE2 4.07Å; F113-F115 AromaticContact CD1-CZ 3.68Å; F113-F115 HydrophobicContact CD1-CZ 3.68Å; F113-F115 HydrophobicContact CE1-CD1 4.39Å; F113-F115 AromaticContact CE1-CE1 3.46Å; F113-F115 HydrophobicContact CE1-CE1 3.46Å; F113-F115 VanDerWaalsContact CE1-CE1 3.46Å; F113-F115 HydrophobicContact CE1-CE2 4.2Å; F113-F115 AromaticContact CE1-CZ 3.36Å; F113-F115 HydrophobicContact CE1-CZ 3.36Å; F113-F115 HydrophobicContact CZ-CE1 4.22Å; F113-F115 HydrophobicContact CZ-CZ 4.5Å; F115-I121 HydrophobicContact CD1-CG2 4.19Å; F115-I121 HydrophobicContact CE1-CG2 4.08Å; F115-V122 HydrophobicContact CB-CG2 3.68Å; F115-V122 HydrophobicContact CD1-CG2 4.43Å; F115-V122 HydrophobicContact CG-CG2 4.38Å; F115-I174 HydrophobicContact CD2-CG2 3.92Å; F115-I174 HydrophobicContact CE2-CB 4.22Å; F115-I174 HydrophobicContact CE2-CG1 3.83Å; F115-I174 HydrophobicContact CE2-CG2 4Å; F115-I174 HydrophobicContact CG-CG2 4.34Å; F115-I174 HydrophobicContact CZ-CG1 4.03Å; F115-I174 HydrophobicContact CZ-CG2 4.46Å; F115-K177 HydrophobicContact CD2-CB 3.89Å; F115-K177 HydrophobicContact CE2-CB 4.16Å; F115-K177 PolarHBondContact N-O 3.4Å; F115-T178 WeakPolarHBondContact O-CA 3.3Å; F115-G179 PolarHBondContact O-N 3.45Å
116	N	82.7	Confident	70	Confident	44 Å²	44	85 Å²	85	24%	0.235	46%	0.46	C	S	.	.			trans	-73.1	121.6	168.1	-179	-30.9	0	0	0	108.6	Y71 S118 G119 V122 M186 F188	Y71-N116 PolarHBondContact OH-ND2 2.74Å; N116-S118 PolarHBondContact O-N 3.07Å; N116-S118 WeakPolarHBondContact OD1-CA 3.43Å; N116-S118 WeakPolarHBondContact OD1-CB 3.3Å; N116-S118 PolarHBondContact OD1-N 3.37Å; N116-G119 PolarHBondContact O-N 2.7Å; N116-V122 VanDerWaalsContact O-CG2 3.27Å; N116-V122 WeakPolarHBondContact O-CG2 3.28Å; N116-M186 HydrophobicContact CB-SD 4.28Å; N116-M186 WeakPolarHBondContact OD1-CE 3.25Å; N116-M186 PolarHBondContact OD1-SD 2.88Å; N116-M186 VanDerWaalsContact OD1-SD 3.37Å; N116-F188 HydrophobicContact CB-CZ 4.16Å
117	P	82.6	Confident	72.6	Confident	38 Å²	38	80 Å²	80	25%	0.247	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-30.2	179.9	26.2	-37.2	0	0	0	113	G119 T178 G179 M186 R243	P117-G119 VanDerWaalsContact C-N 3.3Å; P117-T178 HydrophobicContact CB-CG2 3.84Å; P117-G179 WeakPolarHBondContact CD-O 3.23Å; P117-G179 VanDerWaalsContact CG-O 3.29Å; P117-G179 WeakPolarHBondContact CG-O 3.47Å; P117-M186 HydrophobicContact CG-CE 3.71Å; P117-M186 HydrophobicContact CG-SD 4.32Å; P117-R243 PolarHBondContact O-NH1 3.33Å
118	S	78.3	Confident	75.6	Confident	74 Å²	74	77.7 Å²	77.7	52%	0.517	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-10	175.9	-57.1	0	0	0	0	112.9	N116 R243	N116-S118 PolarHBondContact O-N 3.07Å; N116-S118 WeakPolarHBondContact OD1-CA 3.43Å; N116-S118 WeakPolarHBondContact OD1-CB 3.3Å; N116-S118 PolarHBondContact OD1-N 3.37Å; S118-R243 PolarHBondContact O-NH2 2.84Å
119	G	80.2	Confident	78.2	Confident	8 Å²	8	66.4 Å²	66.4	8%	0.082	37%	0.365	C	S	.	.	S	Bend	trans	-67.8	153	-177.8	0	0	0	0	0	114.8	Y71 N116 P117 I121 V122 H123	Y71-G119 VanDerWaalsContact OH-CA 3.3Å; Y71-G119 WeakPolarHBondContact OH-CA 3.1Å; N116-G119 PolarHBondContact O-N 2.7Å; P117-G119 VanDerWaalsContact C-N 3.3Å; G119-I121 VanDerWaalsContact C-N 3.29Å; G119-I121 PolarHBondContact O-N 3.39Å; G119-V122 PolarHBondContact O-N 3.06Å; G119-H123 PolarHBondContact O-N 3.36Å
120	R	87	Confident	81.1	Confident	156 Å²	156	59.6 Å²	59.6	59%	0.589	33%	0.329	S	S	*	.	H	α-helix	trans	-56.7	-41.9	175.5	-67.4	-178.5	-70.7	-163.1	-1.5	112	D73 V122 H123 T124	D73-R120 IonicContact OD1-NH2 3.93Å; D73-R120 PolarHBondContact OD1-NH2 2.76Å; D73-R120 IonicContact OD2-NH2 2.72Å; D73-R120 PolarHBondContact OD2-NH2 3.4Å; R120-V122 PolarHBondContact O-N 2.71Å; R120-H123 WeakPolarHBondContact O-CB 3.43Å; R120-H123 PolarHBondContact O-N 2.88Å; R120-H123 VanDerWaalsContact O-N 3.11Å; R120-T124 PolarHBondContact O-N 3.3Å; R120-T124 PolarHBondContact O-OG1 3.27Å
121	I	87.7	Confident	83.5	Confident	114 Å²	114	60.9 Å²	60.9	59%	0.585	33%	0.327	S	S	*	.	H	α-helix	trans	-57.4	-48.1	-178.4	-61.6	165.3	0	0	0	111.5	F115 G119 H123 T124 W125	F115-I121 HydrophobicContact CD1-CG2 4.19Å; F115-I121 HydrophobicContact CE1-CG2 4.08Å; G119-I121 VanDerWaalsContact C-N 3.29Å; G119-I121 PolarHBondContact O-N 3.39Å; I121-H123 VanDerWaalsContact C-N 3.33Å; I121-H123 PolarHBondContact O-N 3.18Å; I121-T124 PolarHBondContact O-N 3.16Å; I121-W125 WeakPolarHBondContact O-CB 3.36Å; I121-W125 PolarHBondContact O-N 3.18Å
122	V	88.1	Confident	86.1	Confident	17 Å²	17	56.6 Å²	56.6	10%	0.103	29%	0.291	C	S	.	.	H	α-helix	trans	-65	-39.1	177.8	178.9	0	0	0	0	110.8	F115 N116 G119 R120 W125 C126	F115-V122 HydrophobicContact CB-CG2 3.68Å; F115-V122 HydrophobicContact CD1-CG2 4.43Å; F115-V122 HydrophobicContact CG-CG2 4.38Å; N116-V122 VanDerWaalsContact O-CG2 3.27Å; N116-V122 WeakPolarHBondContact O-CG2 3.28Å; G119-V122 PolarHBondContact O-N 3.06Å; R120-V122 PolarHBondContact O-N 2.71Å; V122-W125 PolarHBondContact O-N 3.44Å; V122-C126 PolarHBondContact O-N 2.79Å; V122-C126 PolarHBondContact O-SG 2.74Å
123	H	87.7	Confident	88.1	Confident	38 Å²	38	52 Å²	52	18%	0.176	27%	0.266	C	S	.	.	H	α-helix	trans	-63.8	-47	177.5	-173.9	26.5	0	0	0	112.7	G119 R120 I121 W125 C126 G127 F240	G119-H123 PolarHBondContact O-N 3.36Å; R120-H123 WeakPolarHBondContact O-CB 3.43Å; R120-H123 PolarHBondContact O-N 2.88Å; R120-H123 VanDerWaalsContact O-N 3.11Å; I121-H123 VanDerWaalsContact C-N 3.33Å; I121-H123 PolarHBondContact O-N 3.18Å; H123-W125 VanDerWaalsContact C-N 3.32Å; H123-W125 PolarHBondContact O-N 2.96Å; H123-C126 PolarHBondContact O-N 3.12Å; H123-G127 PolarHBondContact O-N 2.87Å; H123-G127 VanDerWaalsContact O-N 3.1Å; H123-F240 AromaticContact CE1-CD2 3.72Å; H123-F240 AromaticContact CE1-CE2 3.7Å; H123-F240 AromaticContact ND1-CD2 3.86Å
124	T	90.6	Very high	89.2	Confident	97 Å²	97	46.8 Å²	46.8	60%	0.595	24%	0.244	S	C	*	.	H	α-helix	trans	-61.7	-41	175.4	-55.9	0	0	0	0	111.1	R120 I121 G127 V128	R120-T124 PolarHBondContact O-N 3.3Å; R120-T124 PolarHBondContact O-OG1 3.27Å; I121-T124 PolarHBondContact O-N 3.16Å; T124-G127 WeakPolarHBondContact O-CA 3.11Å; T124-G127 PolarHBondContact O-N 2.73Å; T124-G127 VanDerWaalsContact O-N 3.07Å; T124-V128 PolarHBondContact O-N 3.44Å
125	W	93.4	Very high	89.9	Confident	50 Å²	50	46.3 Å²	46.3	19%	0.189	24%	0.242	C	C	.	.	H	α-helix	trans	-62.4	-44.7	175.6	-176.1	-98.9	0	0	0	112.7	I121 V122 H123 G127 V128 I129 L167 I170 D171 I174	I121-W125 WeakPolarHBondContact O-CB 3.36Å; I121-W125 PolarHBondContact O-N 3.18Å; V122-W125 PolarHBondContact O-N 3.44Å; H123-W125 VanDerWaalsContact C-N 3.32Å; H123-W125 PolarHBondContact O-N 2.96Å; W125-G127 PolarHBondContact O-N 3.39Å; W125-V128 WeakPolarHBondContact O-CB 3.1Å; W125-V128 PolarHBondContact O-N 3.28Å; W125-I129 HydrophobicContact CZ2-CD1 3.84Å; W125-I129 HydrophobicContact CZ2-CG1 4.3Å; W125-I129 PolarHBondContact O-N 2.9Å; W125-L167 HydrophobicContact CH2-CD2 3.89Å; W125-I170 HydrophobicContact CH2-CB 4.09Å; W125-I170 HydrophobicContact CH2-CG2 3.53Å; W125-I170 HydrophobicContact CZ2-CB 3.99Å; W125-I170 HydrophobicContact CZ2-CG2 3.56Å; W125-I170 HydrophobicContact CZ3-CG2 4.49Å; W125-D171 HydrophobicContact CZ2-CB 4.33Å; W125-D171 PolarHBondContact NE1-OD1 2.85Å; W125-D171 VanDerWaalsContact NE1-OD1 3.09Å; W125-I174 HydrophobicContact CD2-CD1 3.66Å; W125-I174 HydrophobicContact CE3-CD1 4.22Å; W125-I174 HydrophobicContact CG-CD1 4.05Å; W125-I174 HydrophobicContact CH2-CD1 4.3Å; W125-I174 HydrophobicContact CZ2-CD1 3.76Å
126	C	92.6	Very high	90.5	Very high	8 Å²	8	45.1 Å²	45.1	5%	0.054	24%	0.237	C	C	.	.	H	α-helix	trans	-59.2	-31.5	172.3	-68.2	0	0	0	0	112.1	V122 H123 S130 F240	V122-C126 PolarHBondContact O-N 2.79Å; V122-C126 PolarHBondContact O-SG 2.74Å; H123-C126 PolarHBondContact O-N 3.12Å; C126-S130 WeakPolarHBondContact O-CB 3.35Å; C126-S130 PolarHBondContact O-N 3.29Å; C126-S130 PolarHBondContact O-OG 3.39Å; C126-F240 HydrophobicContact CB-CB 4.23Å; C126-F240 HydrophobicContact CB-CD2 4.42Å
127	G	93.1	Very high	91	Very high	10 Å²	10	44.3 Å²	44.3	10%	0.103	23%	0.233	C	C	.	.	H	α-helix	trans	-63.9	-46.4	171.1	0	0	0	0	0	113	H123 T124 W125 I129 S130 I131 F240	H123-G127 PolarHBondContact O-N 2.87Å; H123-G127 VanDerWaalsContact O-N 3.1Å; T124-G127 WeakPolarHBondContact O-CA 3.11Å; T124-G127 PolarHBondContact O-N 2.73Å; T124-G127 VanDerWaalsContact O-N 3.07Å; W125-G127 PolarHBondContact O-N 3.39Å; G127-I129 PolarHBondContact O-N 2.82Å; G127-S130 WeakPolarHBondContact O-CB 3.19Å; G127-S130 PolarHBondContact O-N 3.06Å; G127-I131 WeakPolarHBondContact O-CG1 3.21Å; G127-I131 PolarHBondContact O-N 3.26Å; G127-I131 VanDerWaalsContact O-N 3.11Å; G127-F240 VanDerWaalsContact CA-CD2 3.43Å; G127-F240 VanDerWaalsContact CA-CE2 3.4Å
128	V	95.7	Very high	91.6	Very high	54 Å²	54	46.8 Å²	46.8	33%	0.327	24%	0.237	S	C	.	.	H	α-helix	trans	-58.4	-48.7	174.6	177.2	0	0	0	0	110.8	T124 W125 S130 I131 V132 L167	T124-V128 PolarHBondContact O-N 3.44Å; W125-V128 WeakPolarHBondContact O-CB 3.1Å; W125-V128 PolarHBondContact O-N 3.28Å; V128-S130 VanDerWaalsContact C-N 3.26Å; V128-S130 PolarHBondContact O-N 2.82Å; V128-I131 WeakPolarHBondContact O-CB 3.36Å; V128-I131 PolarHBondContact O-N 3.46Å; V128-I131 VanDerWaalsContact O-N 3.12Å; V128-V132 WeakPolarHBondContact O-CG2 3.43Å; V128-V132 PolarHBondContact O-N 2.6Å; V128-V132 VanDerWaalsContact O-N 3.11Å; V128-L167 HydrophobicContact CG1-CD1 4.49Å
129	I	95.4	Very high	92.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.4	-31.1	178.2	-60.9	-57.8	0	0	0	112.2	W125 G127 V132 F133 L167 Y168 D171 K236	W125-I129 HydrophobicContact CZ2-CD1 3.84Å; W125-I129 HydrophobicContact CZ2-CG1 4.3Å; W125-I129 PolarHBondContact O-N 2.9Å; G127-I129 PolarHBondContact O-N 2.82Å; I129-V132 PolarHBondContact O-N 3.07Å; I129-F133 WeakPolarHBondContact O-CB 3.46Å; I129-F133 PolarHBondContact O-N 2.82Å; I129-L167 HydrophobicContact CD1-CB 4.2Å; I129-L167 WeakPolarHBondContact CD1-O 3.43Å; I129-Y168 HydrophobicContact CG2-CE1 4.24Å; I129-D171 HydrophobicContact CD1-CB 3.78Å; I129-D171 HydrophobicContact CG1-CB 3.98Å; I129-K236 HydrophobicContact CG2-CB 4.09Å; I129-K236 HydrophobicContact CG2-CG 4.31Å
130	S	94.4	Very high	92.9	Very high	6 Å²	6	44.3 Å²	44.3	4%	0.042	22%	0.217	C	C	.	.	H	α-helix	trans	-66.9	-34.5	174.2	-61.6	0	0	0	0	112.8	C126 G127 V128 M134 F240	C126-S130 WeakPolarHBondContact O-CB 3.35Å; C126-S130 PolarHBondContact O-N 3.29Å; C126-S130 PolarHBondContact O-OG 3.39Å; G127-S130 WeakPolarHBondContact O-CB 3.19Å; G127-S130 PolarHBondContact O-N 3.06Å; V128-S130 VanDerWaalsContact C-N 3.26Å; V128-S130 PolarHBondContact O-N 2.82Å; S130-M134 PolarHBondContact O-N 2.64Å; S130-F240 WeakPolarHBondContact OG-CB 3.09Å; S130-F240 WeakPolarHBondContact OG-CG 3.41Å
131	I	94.7	Very high	93.1	Very high	124 Å²	124	37.8 Å²	37.8	64%	0.636	19%	0.193	S	C	*	.	H	α-helix	trans	-68.8	-42.6	173.4	-64.4	164.6	0	0	0	110.2	G127 V128 F133 M134 Y135	G127-I131 WeakPolarHBondContact O-CG1 3.21Å; G127-I131 PolarHBondContact O-N 3.26Å; G127-I131 VanDerWaalsContact O-N 3.11Å; V128-I131 WeakPolarHBondContact O-CB 3.36Å; V128-I131 PolarHBondContact O-N 3.46Å; V128-I131 VanDerWaalsContact O-N 3.12Å; I131-F133 VanDerWaalsContact C-N 3.35Å; I131-F133 PolarHBondContact O-N 2.66Å; I131-M134 WeakPolarHBondContact O-CB 3.49Å; I131-M134 PolarHBondContact O-N 3.46Å; I131-M134 VanDerWaalsContact O-N 3.16Å; I131-Y135 PolarHBondContact O-N 3.02Å
132	V	96.1	Very high	93.3	Very high	13 Å²	13	34.6 Å²	34.6	8%	0.079	17%	0.174	C	C	.	.	H	α-helix	trans	-62.7	-41.1	175.7	-179	0	0	0	0	111.6	V128 I129 M134 Y135 H136 A164 L167 Y168	V128-V132 WeakPolarHBondContact O-CG2 3.43Å; V128-V132 PolarHBondContact O-N 2.6Å; V128-V132 VanDerWaalsContact O-N 3.11Å; I129-V132 PolarHBondContact O-N 3.07Å; V132-M134 VanDerWaalsContact C-N 3.34Å; V132-M134 PolarHBondContact O-N 3.1Å; V132-Y135 WeakPolarHBondContact O-CB 3.28Å; V132-Y135 PolarHBondContact O-N 3.21Å; V132-H136 PolarHBondContact O-N 3.22Å; V132-H136 VanDerWaalsContact O-N 3.11Å; V132-H136 PolarHBondContact O-ND1 2.8Å; V132-A164 HydrophobicContact CG1-CB 3.65Å; V132-L167 HydrophobicContact CG2-CB 4.23Å; V132-L167 HydrophobicContact CG2-CD1 3.5Å; V132-L167 VanDerWaalsContact CG2-CD1 3.5Å; V132-Y168 HydrophobicContact CB-CE1 4.04Å; V132-Y168 HydrophobicContact CG1-CD1 3.92Å; V132-Y168 HydrophobicContact CG1-CE1 3.51Å
133	F	95.7	Very high	93.4	Very high	9 Å²	9	33.9 Å²	33.9	4%	0.039	17%	0.17	C	C	.	.	H	α-helix	trans	-60.4	-42.9	172.4	170.5	-100.2	0	0	0	111.7	I129 I131 H136 L137 L231 V234 F237	I129-F133 WeakPolarHBondContact O-CB 3.46Å; I129-F133 PolarHBondContact O-N 2.82Å; I131-F133 VanDerWaalsContact C-N 3.35Å; I131-F133 PolarHBondContact O-N 2.66Å; F133-H136 PolarHBondContact O-N 3.37Å; F133-L137 HydrophobicContact CE1-CD2 3.82Å; F133-L137 HydrophobicContact CZ-CD1 4.32Å; F133-L137 HydrophobicContact CZ-CD2 4.1Å; F133-L137 VanDerWaalsContact O-CB 3.31Å; F133-L137 WeakPolarHBondContact O-CB 3.45Å; F133-L137 PolarHBondContact O-N 2.99Å; F133-L231 HydrophobicContact CE2-CD2 4.46Å; F133-V234 HydrophobicContact CE1-CG2 4.17Å; F133-V234 HydrophobicContact CE2-CB 3.71Å; F133-V234 HydrophobicContact CE2-CG2 4.19Å; F133-V234 HydrophobicContact CZ-CB 3.67Å; F133-V234 HydrophobicContact CZ-CG2 3.6Å; F133-F237 HydrophobicContact CD1-CB 3.54Å; F133-F237 HydrophobicContact CD1-CD1 4.49Å; F133-F237 AromaticContact CD1-CD2 3.77Å; F133-F237 HydrophobicContact CD1-CD2 3.77Å; F133-F237 AromaticContact CD1-CG 3.68Å; F133-F237 HydrophobicContact CD1-CG 3.68Å; F133-F237 HydrophobicContact CE1-CB 3.93Å; F133-F237 HydrophobicContact CE1-CD1 4.23Å; F133-F237 HydrophobicContact CE1-CD2 4.22Å; F133-F237 AromaticContact CE1-CG 3.86Å; F133-F237 HydrophobicContact CE1-CG 3.86Å; F133-F237 HydrophobicContact CG-CB 4.16Å
134	M	94	Very high	93.4	Very high	34 Å²	34	35.1 Å²	35.1	17%	0.167	18%	0.175	C	C	.	.	H	α-helix	trans	-63.6	-40.9	177.5	-165.8	58.5	49.5	0	0	112.6	S130 I131 V132 L137 W138 F237 L261	S130-M134 PolarHBondContact O-N 2.64Å; I131-M134 WeakPolarHBondContact O-CB 3.49Å; I131-M134 PolarHBondContact O-N 3.46Å; I131-M134 VanDerWaalsContact O-N 3.16Å; V132-M134 VanDerWaalsContact C-N 3.34Å; V132-M134 PolarHBondContact O-N 3.1Å; M134-L137 HydrophobicContact CE-CD2 4.13Å; M134-L137 PolarHBondContact O-N 2.89Å; M134-L137 HydrophobicContact SD-CD2 3.99Å; M134-W138 PolarHBondContact O-N 2.72Å; M134-F237 HydrophobicContact CE-CD2 4.11Å; M134-F237 HydrophobicContact CE-CE2 3.45Å; M134-F237 VanDerWaalsContact CE-CE2 3.45Å; M134-F237 HydrophobicContact CE-CZ 3.96Å; M134-L261 HydrophobicContact CE-CD1 3.97Å; M134-L261 HydrophobicContact CE-CD2 3.77Å; M134-L261 HydrophobicContact CE-CG 3.95Å; M134-L261 HydrophobicContact SD-CD1 3.83Å; M134-L261 HydrophobicContact SD-CG 4.42Å
135	Y	95	Very high	93.3	Very high	51 Å²	51	30.8 Å²	30.8	20%	0.2	15%	0.149	C	C	.	.	H	α-helix	trans	-55	-52.8	171.9	165.9	-96.4	0	0	0	110.9	I131 V132 L137 W138 V139 W157 L160 D161 A164	I131-Y135 PolarHBondContact O-N 3.02Å; V132-Y135 WeakPolarHBondContact O-CB 3.28Å; V132-Y135 PolarHBondContact O-N 3.21Å; Y135-L137 VanDerWaalsContact C-N 3.32Å; Y135-L137 PolarHBondContact O-N 2.72Å; Y135-W138 PolarHBondContact O-N 2.8Å; Y135-V139 HydrophobicContact CD2-CB 4.26Å; Y135-V139 HydrophobicContact CD2-CG2 3.74Å; Y135-V139 HydrophobicContact CE2-CB 4Å; Y135-V139 HydrophobicContact CE2-CG1 3.93Å; Y135-V139 HydrophobicContact CE2-CG2 3.71Å; Y135-V139 HydrophobicContact CG-CG2 4.5Å; Y135-V139 VanDerWaalsContact O-CB 3.23Å; Y135-V139 WeakPolarHBondContact O-CB 3.46Å; Y135-V139 WeakPolarHBondContact O-CG2 3.47Å; Y135-V139 PolarHBondContact O-N 3.17Å; Y135-W157 HydrophobicContact CE2-CZ3 4.39Å; Y135-L160 HydrophobicContact CE2-CB 4.45Å; Y135-L160 HydrophobicContact CE2-CD1 4.36Å; Y135-D161 WeakPolarHBondContact CE1-OD1 3.45Å; Y135-D161 PolarHBondContact OH-OD1 3.08Å; Y135-A164 HydrophobicContact CD1-CB 4.28Å; Y135-A164 HydrophobicContact CE1-CB 4.31Å
136	H	94.7	Very high	92.9	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.009	14%	0.144	C	C	.	.	H	α-helix	trans	-60.5	-40.4	177.2	-70.9	141.9	0	0	0	112.8	V132 F133 W138 I140 A164 Y168 L231	V132-H136 PolarHBondContact O-N 3.22Å; V132-H136 VanDerWaalsContact O-N 3.11Å; V132-H136 PolarHBondContact O-ND1 2.8Å; F133-H136 PolarHBondContact O-N 3.37Å; H136-W138 VanDerWaalsContact C-N 3.3Å; H136-W138 PolarHBondContact O-N 3.02Å; H136-I140 HydrophobicContact CB-CD1 3.84Å; H136-I140 HydrophobicContact CB-CG1 4.49Å; H136-I140 VanDerWaalsContact O-CB 3.3Å; H136-I140 WeakPolarHBondContact O-CB 3.43Å; H136-I140 WeakPolarHBondContact O-CD1 3.35Å; H136-I140 WeakPolarHBondContact O-CG1 3.36Å; H136-I140 PolarHBondContact O-N 3.3Å; H136-A164 WeakPolarHBondContact NE2-CB 3.43Å; H136-Y168 AromaticContact ND1-CZ 3.68Å; H136-Y168 PolarHBondContact ND1-OH 3.34Å; H136-L231 HydrophobicContact CB-CD2 4.04Å
137	L	94.9	Very high	92.3	Very high	28 Å²	28	34.6 Å²	34.6	15%	0.147	17%	0.171	C	C	.	.	H	α-helix	trans	-62.5	-32.9	-177.5	-173.4	62.5	0	0	0	113.3	F133 M134 Y135 L231 T265 W269	F133-L137 HydrophobicContact CE1-CD2 3.82Å; F133-L137 HydrophobicContact CZ-CD1 4.32Å; F133-L137 HydrophobicContact CZ-CD2 4.1Å; F133-L137 VanDerWaalsContact O-CB 3.31Å; F133-L137 WeakPolarHBondContact O-CB 3.45Å; F133-L137 PolarHBondContact O-N 2.99Å; M134-L137 HydrophobicContact CE-CD2 4.13Å; M134-L137 PolarHBondContact O-N 2.89Å; M134-L137 HydrophobicContact SD-CD2 3.99Å; Y135-L137 VanDerWaalsContact C-N 3.32Å; Y135-L137 PolarHBondContact O-N 2.72Å; L137-L231 HydrophobicContact CB-CD2 4.28Å; L137-L231 HydrophobicContact CD1-CD2 4.21Å; L137-T265 HydrophobicContact CD1-CG2 4.26Å; L137-T265 HydrophobicContact CD2-CG2 3.69Å; L137-T265 HydrophobicContact CG-CG2 3.73Å; L137-W269 HydrophobicContact CD1-CZ2 4.07Å; L137-W269 PolarHBondContact O-NE1 2.87Å
138	W	94	Very high	91.2	Very high	90 Å²	90	37.9 Å²	37.9	34%	0.341	18%	0.184	S	C	.	.	H	α-helix	trans	-96	-49.8	177.7	-68	17.1	0	0	0	111.3	M134 Y135 H136 I140 I141 Y142 L261 L264 T265 H268	M134-W138 PolarHBondContact O-N 2.72Å; Y135-W138 PolarHBondContact O-N 2.8Å; H136-W138 VanDerWaalsContact C-N 3.3Å; H136-W138 PolarHBondContact O-N 3.02Å; W138-I140 PolarHBondContact O-N 3.35Å; W138-I141 WeakPolarHBondContact O-CG2 3.16Å; W138-I141 PolarHBondContact O-N 3.1Å; W138-Y142 WeakPolarHBondContact O-CB 3.48Å; W138-Y142 PolarHBondContact O-N 3.3Å; W138-L261 HydrophobicContact CZ2-CD1 4.36Å; W138-L264 HydrophobicContact CZ2-CB 4.3Å; W138-T265 PolarHBondContact NE1-OG1 3.36Å; W138-H268 PolarHBondContact O-NE2 2.91Å
139	V	93.1	Very high	90	Very high	24 Å²	24	37 Å²	37	15%	0.145	18%	0.178	C	C	.	.	H	α-helix	trans	-73.1	-23.2	-168.4	175.2	0	0	0	0	113.7	Y135 R143 W157	Y135-V139 HydrophobicContact CD2-CB 4.26Å; Y135-V139 HydrophobicContact CD2-CG2 3.74Å; Y135-V139 HydrophobicContact CE2-CB 4Å; Y135-V139 HydrophobicContact CE2-CG1 3.93Å; Y135-V139 HydrophobicContact CE2-CG2 3.71Å; Y135-V139 HydrophobicContact CG-CG2 4.5Å; Y135-V139 VanDerWaalsContact O-CB 3.23Å; Y135-V139 WeakPolarHBondContact O-CB 3.46Å; Y135-V139 WeakPolarHBondContact O-CG2 3.47Å; Y135-V139 PolarHBondContact O-N 3.17Å; V139-R143 HydrophobicContact CG1-CG 4.24Å; V139-R143 VanDerWaalsContact CG1-NE 3.32Å; V139-R143 WeakPolarHBondContact O-CB 3.37Å; V139-R143 VanDerWaalsContact O-CG 3.31Å; V139-R143 WeakPolarHBondContact O-CG 3.34Å; V139-R143 PolarHBondContact O-N 3.18Å; V139-R143 PolarHBondContact O-NE 3.1Å; V139-R143 VanDerWaalsContact O-NE 3.15Å; V139-W157 HydrophobicContact CG1-CE3 4.07Å; V139-W157 HydrophobicContact CG1-CH2 4.12Å; V139-W157 HydrophobicContact CG1-CZ3 3.51Å
140	I	92.1	Very high	88.8	Confident	5 Å²	5	42.3 Å²	42.3	3%	0.026	21%	0.206	C	C	.	.	H	α-helix	trans	-70.6	-47.4	176.7	-66.4	172.6	0	0	0	111.4	H136 W138 F144 R227 R230 L231	H136-I140 HydrophobicContact CB-CD1 3.84Å; H136-I140 HydrophobicContact CB-CG1 4.49Å; H136-I140 VanDerWaalsContact O-CB 3.3Å; H136-I140 WeakPolarHBondContact O-CB 3.43Å; H136-I140 WeakPolarHBondContact O-CD1 3.35Å; H136-I140 WeakPolarHBondContact O-CG1 3.36Å; H136-I140 PolarHBondContact O-N 3.3Å; W138-I140 PolarHBondContact O-N 3.35Å; I140-F144 WeakPolarHBondContact O-CB 3.36Å; I140-F144 PolarHBondContact O-N 3.31Å; I140-R227 HydrophobicContact CD1-CB 4.18Å; I140-R227 WeakPolarHBondContact CD1-O 3.29Å; I140-R230 HydrophobicContact CD1-CB 4.5Å; I140-L231 HydrophobicContact CD1-CD2 4.37Å
141	I	92.3	Very high	87.7	Confident	19 Å²	19	50.9 Å²	50.9	10%	0.097	25%	0.245	C	C	.	.	H	α-helix	trans	-73.4	-39.3	-176.9	-169.7	62.4	0	0	0	111.4	W138 F144 A145 W269 C272	W138-I141 WeakPolarHBondContact O-CG2 3.16Å; W138-I141 PolarHBondContact O-N 3.1Å; I141-F144 HydrophobicContact CD1-CD1 4.3Å; I141-F144 WeakPolarHBondContact O-CB 3.25Å; I141-F144 PolarHBondContact O-N 3.32Å; I141-F144 VanDerWaalsContact O-N 3.11Å; I141-A145 PolarHBondContact O-N 3.37Å; I141-A145 VanDerWaalsContact O-N 3.07Å; I141-W269 HydrophobicContact CB-CD2 4.32Å; I141-W269 HydrophobicContact CB-CZ2 4.26Å; I141-W269 HydrophobicContact CD1-CE3 4.47Å; I141-W269 HydrophobicContact CD1-CZ3 4.47Å; I141-W269 HydrophobicContact CG1-CD2 4.2Å; I141-W269 HydrophobicContact CG1-CE3 4.22Å; I141-W269 HydrophobicContact CG2-CD2 4.1Å; I141-W269 HydrophobicContact CG2-CG 4.12Å; I141-W269 HydrophobicContact CG2-CZ2 4.34Å; I141-C272 HydrophobicContact CG1-CB 3.69Å
142	Y	91.5	Very high	87	Confident	47 Å²	47	53.8 Å²	53.8	18%	0.184	26%	0.256	C	S	.	.	H	α-helix	trans	-54.2	-55.6	173.4	178.3	-102.1	0	0	0	112.4	W138 F144 A145 F146 E148 Y411	W138-Y142 WeakPolarHBondContact O-CB 3.48Å; W138-Y142 PolarHBondContact O-N 3.3Å; Y142-F144 PolarHBondContact O-N 3.1Å; Y142-F144 VanDerWaalsContact O-N 3.14Å; Y142-A145 PolarHBondContact O-N 3.31Å; Y142-A145 VanDerWaalsContact O-N 3.12Å; Y142-F146 AromaticContact CD2-CD2 3.85Å; Y142-F146 HydrophobicContact CD2-CD2 3.85Å; Y142-F146 HydrophobicContact CD2-CE2 4.3Å; Y142-F146 HydrophobicContact CE2-CD2 4.03Å; Y142-F146 HydrophobicContact CE2-CG 4.46Å; Y142-F146 PolarHBondContact O-N 3.26Å; Y142-E148 WeakPolarHBondContact CE1-OE2 3.46Å; Y142-E148 VanDerWaalsContact CZ-OE2 3.24Å; Y142-E148 PolarHBondContact OH-OE1 3.36Å; Y142-E148 PolarHBondContact OH-OE2 3.47Å; Y142-Y411 AromaticContact CD2-CD2 3.84Å; Y142-Y411 HydrophobicContact CD2-CD2 3.84Å; Y142-Y411 HydrophobicContact CD2-CE2 4Å; Y142-Y411 AromaticContact CE2-CD2 3.62Å; Y142-Y411 HydrophobicContact CE2-CD2 3.62Å; Y142-Y411 HydrophobicContact CE2-CE2 4.12Å; Y142-Y411 AromaticContact CE2-CG 3.95Å; Y142-Y411 HydrophobicContact CE2-CG 3.95Å
143	R	90	Very high	86.4	Confident	3 Å²	3	55.4 Å²	55.4	1%	0.011	27%	0.266	C	S	.	.	H	α-helix	trans	-69.6	-8.2	179.4	-67.5	-174.6	-59.6	-178.3	-6.7	113.9	V139 I149 D161 S224	V139-R143 HydrophobicContact CG1-CG 4.24Å; V139-R143 VanDerWaalsContact CG1-NE 3.32Å; V139-R143 WeakPolarHBondContact O-CB 3.37Å; V139-R143 VanDerWaalsContact O-CG 3.31Å; V139-R143 WeakPolarHBondContact O-CG 3.34Å; V139-R143 PolarHBondContact O-N 3.18Å; V139-R143 PolarHBondContact O-NE 3.1Å; V139-R143 VanDerWaalsContact O-NE 3.15Å; R143-I149 HydrophobicContact CB-CD1 4.29Å; R143-D161 IonicContact CZ-OD1 2.82Å; R143-D161 IonicContact CZ-OD2 2.76Å; R143-D161 IonicContact NH1-OD1 3.52Å; R143-D161 PolarHBondContact NH1-OD1 2.8Å; R143-D161 IonicContact NH1-OD2 3.97Å; R143-D161 PolarHBondContact NH1-OD2 2.86Å; R143-D161 IonicContact NH2-OD1 3.67Å; R143-D161 PolarHBondContact NH2-OD1 2.81Å; R143-D161 IonicContact NH2-OD2 3.36Å; R143-D161 PolarHBondContact NH2-OD2 3.48Å; R143-S224 VanDerWaalsContact C-OG 3.31Å; R143-S224 WeakPolarHBondContact CB-OG 3.47Å; R143-S224 PolarHBondContact O-OG 2.78Å
144	F	88.9	Confident	85.9	Confident	64 Å²	64	57 Å²	57	28%	0.281	28%	0.276	S	S	.	.	H	α-helix	trans	-90.4	-31.8	172	-179.4	-117.5	0	0	0	112	I140 I141 Y142 I225 L276	I140-F144 WeakPolarHBondContact O-CB 3.36Å; I140-F144 PolarHBondContact O-N 3.31Å; I141-F144 HydrophobicContact CD1-CD1 4.3Å; I141-F144 WeakPolarHBondContact O-CB 3.25Å; I141-F144 PolarHBondContact O-N 3.32Å; I141-F144 VanDerWaalsContact O-N 3.11Å; Y142-F144 PolarHBondContact O-N 3.1Å; Y142-F144 VanDerWaalsContact O-N 3.14Å; F144-I225 HydrophobicContact CD1-CD1 4.5Å; F144-I225 HydrophobicContact CD2-CB 3.86Å; F144-I225 HydrophobicContact CD2-CG2 4.46Å; F144-I225 HydrophobicContact CE2-CB 3.88Å; F144-I225 HydrophobicContact CE2-CG1 4.44Å; F144-I225 HydrophobicContact CE2-CG2 4.18Å; F144-I225 HydrophobicContact CG-CB 4.43Å; F144-I225 HydrophobicContact CZ-CB 4.47Å; F144-L276 HydrophobicContact CD1-CD2 4.32Å; F144-L276 HydrophobicContact CE1-CD1 4.16Å; F144-L276 HydrophobicContact CE1-CD2 3.69Å; F144-L276 HydrophobicContact CZ-CD1 4.5Å
145	A	87.8	Confident	85.6	Confident	6 Å²	6	61.3 Å²	61.3	5%	0.05	30%	0.299	C	S	.	.	H	α-helix	trans	-86.1	-41.7	-179.4	0	0	0	0	0	113.8	I141 Y142 C272 Q275	I141-A145 PolarHBondContact O-N 3.37Å; I141-A145 VanDerWaalsContact O-N 3.07Å; Y142-A145 PolarHBondContact O-N 3.31Å; Y142-A145 VanDerWaalsContact O-N 3.12Å; A145-C272 HydrophobicContact CB-CB 3.77Å; A145-C272 VanDerWaalsContact CB-O 3.25Å; A145-C272 WeakPolarHBondContact CB-O 3.49Å; A145-Q275 HydrophobicContact CB-CB 4.42Å
146	F	85.6	Confident	85.3	Confident	19 Å²	19	64.7 Å²	64.7	8%	0.083	32%	0.315	C	S	.	.	S	Bend	trans	-99.6	-11.1	-171.5	-66.9	-87	0	0	0	114.7	Y142 E148 Q275 E410 Y411 A414	Y142-F146 AromaticContact CD2-CD2 3.85Å; Y142-F146 HydrophobicContact CD2-CD2 3.85Å; Y142-F146 HydrophobicContact CD2-CE2 4.3Å; Y142-F146 HydrophobicContact CE2-CD2 4.03Å; Y142-F146 HydrophobicContact CE2-CG 4.46Å; Y142-F146 PolarHBondContact O-N 3.26Å; F146-E148 HydrophobicContact CB-CG 3.86Å; F146-E148 PolarHBondContact O-N 2.99Å; F146-Q275 HydrophobicContact CD1-CG 3.87Å; F146-Q275 HydrophobicContact CE1-CB 3.96Å; F146-Q275 HydrophobicContact CE1-CG 3.49Å; F146-Q275 VanDerWaalsContact CE1-CG 3.49Å; F146-Q275 HydrophobicContact CE2-CB 4.18Å; F146-Q275 HydrophobicContact CE2-CG 4.32Å; F146-Q275 HydrophobicContact CG-CG 4.44Å; F146-Q275 HydrophobicContact CZ-CB 3.65Å; F146-Q275 HydrophobicContact CZ-CG 3.72Å; F146-E410 HydrophobicContact CD1-CB 4.18Å; F146-E410 HydrophobicContact CE1-CB 3.94Å; F146-Y411 HydrophobicContact CD2-CD2 4.37Å; F146-Y411 AromaticContact CE2-CD2 3.68Å; F146-Y411 HydrophobicContact CE2-CD2 3.68Å; F146-Y411 HydrophobicContact CE2-CE2 4.48Å; F146-Y411 AromaticContact CZ-CD2 3.8Å; F146-Y411 HydrophobicContact CZ-CD2 3.8Å; F146-Y411 HydrophobicContact CZ-CG 4.44Å; F146-A414 HydrophobicContact CZ-CB 3.95Å
147	N	78.3	Confident	85.1	Confident	118 Å²	118	66.8 Å²	66.8	63%	0.631	32%	0.322	S	S	*	.			trans	48.4	31.8	175.9	-69.6	-39.2	0	0	0	116	I149	N147-I149 PolarHBondContact O-N 2.93Å
148	E	71.4	Confident	84.8	Confident	80 Å²	80	67.4 Å²	67.4	37%	0.374	33%	0.326	S	S	.	.			trans	-68	22.3	-176.2	-54.4	-172.8	154.5	0	0	115.7	Y142 F146 N150 T153	Y142-E148 WeakPolarHBondContact CE1-OE2 3.46Å; Y142-E148 VanDerWaalsContact CZ-OE2 3.24Å; Y142-E148 PolarHBondContact OH-OE1 3.36Å; Y142-E148 PolarHBondContact OH-OE2 3.47Å; F146-E148 HydrophobicContact CB-CG 3.86Å; F146-E148 PolarHBondContact O-N 2.99Å; E148-N150 VanDerWaalsContact C-N 3.34Å; E148-N150 PolarHBondContact O-N 3.06Å; E148-N150 VanDerWaalsContact O-N 3.08Å; E148-T153 PolarHBondContact O-OG1 3.09Å
149	I	70.5	Confident	84.7	Confident	36 Å²	36	67 Å²	67	19%	0.185	33%	0.333	C	S	.	.			trans	-92.9	74.6	-169.8	-59.9	-175.9	0	0	0	108.8	R143 N147 V154 F222	R143-I149 HydrophobicContact CB-CD1 4.29Å; N147-I149 PolarHBondContact O-N 2.93Å; I149-V154 HydrophobicContact CG2-CB 4.49Å; I149-V154 HydrophobicContact CG2-CG2 3.4Å; I149-F222 HydrophobicContact CD1-CD1 3.57Å; I149-F222 HydrophobicContact CD1-CE1 3.1Å; I149-F222 HydrophobicContact CD1-CZ 3.78Å; I149-F222 HydrophobicContact CG2-CD1 4.38Å
150	N	70	Confident	84.7	Confident	110 Å²	110	68.7 Å²	68.7	59%	0.588	34%	0.341	S	S	*	.			trans	-72.4	150.7	169.9	-70.4	-28.2	0	0	0	110.4	E148 Q152 T153 V154	E148-N150 VanDerWaalsContact C-N 3.34Å; E148-N150 PolarHBondContact O-N 3.06Å; E148-N150 VanDerWaalsContact O-N 3.08Å; N150-Q152 PolarHBondContact O-N 3.22Å; N150-T153 PolarHBondContact N-OG1 2.75Å; N150-T153 PolarHBondContact O-N 2.87Å; N150-T153 PolarHBondContact O-OG1 3.22Å; N150-T153 VanDerWaalsContact O-OG1 3.12Å; N150-V154 WeakPolarHBondContact O-CG2 3.42Å; N150-V154 PolarHBondContact O-N 2.69Å; N150-V154 VanDerWaalsContact O-N 3.13Å
151	Q	71.8	Confident	84.7	Confident	186 Å²	186	68.5 Å²	68.5	87%	0.869	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-26.5	-179.3	-68.8	-176.2	-13.1	0	0	113.7
152	Q	78.9	Confident	84.7	Confident	185 Å²	185	73 Å²	73	86%	0.864	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-34.3	175	-62.8	179.1	-2	0	0	113.6	N150	N150-Q152 PolarHBondContact O-N 3.22Å
153	T	84.4	Confident	84.8	Confident	48 Å²	48	76.5 Å²	76.5	29%	0.294	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-18.8	-175	59.6	0	0	0	0	113.4	E148 N150 I155 F156 W157	E148-T153 PolarHBondContact O-OG1 3.09Å; N150-T153 PolarHBondContact N-OG1 2.75Å; N150-T153 PolarHBondContact O-N 2.87Å; N150-T153 PolarHBondContact O-OG1 3.22Å; N150-T153 VanDerWaalsContact O-OG1 3.12Å; T153-I155 VanDerWaalsContact C-N 3.31Å; T153-I155 PolarHBondContact O-N 3.05Å; T153-F156 PolarHBondContact O-N 3.29Å; T153-W157 VanDerWaalsContact O-CD1 3.27Å; T153-W157 PolarHBondContact O-N 3.25Å; T153-W157 VanDerWaalsContact O-N 3.08Å
154	V	84.9	Confident	85.1	Confident	42 Å²	42	76.6 Å²	76.6	26%	0.255	38%	0.375	S	S	.	.	H	α-helix	trans	-47.5	-49.5	177.3	168.8	0	0	0	0	112.4	I149 N150 F156 W157 L158	I149-V154 HydrophobicContact CG2-CB 4.49Å; I149-V154 HydrophobicContact CG2-CG2 3.4Å; N150-V154 WeakPolarHBondContact O-CG2 3.42Å; N150-V154 PolarHBondContact O-N 2.69Å; N150-V154 VanDerWaalsContact O-N 3.13Å; V154-F156 PolarHBondContact O-N 3.18Å; V154-W157 PolarHBondContact O-N 3.28Å; V154-L158 HydrophobicContact CG1-CD1 3.71Å; V154-L158 HydrophobicContact CG1-CG 4.31Å; V154-L158 WeakPolarHBondContact O-CB 3.4Å; V154-L158 VanDerWaalsContact O-CG 3.31Å; V154-L158 WeakPolarHBondContact O-CG 3.47Å; V154-L158 PolarHBondContact O-N 3.27Å
155	I	87.4	Confident	85.3	Confident	125 Å²	125	74.3 Å²	74.3	64%	0.641	37%	0.365	S	S	*	.	H	α-helix	trans	-62.8	-47.7	-175.5	-60.5	174.4	0	0	0	110.5	T153 W157 L158 T159	T153-I155 VanDerWaalsContact C-N 3.31Å; T153-I155 PolarHBondContact O-N 3.05Å; I155-W157 PolarHBondContact O-N 3.2Å; I155-L158 PolarHBondContact O-N 3.04Å; I155-T159 WeakPolarHBondContact O-CG2 3.39Å; I155-T159 PolarHBondContact O-N 3.18Å
156	F	89.9	Confident	85.6	Confident	122 Å²	122	78.1 Å²	78.1	54%	0.535	38%	0.384	S	S	.	.	H	α-helix	trans	-58.4	-50.8	179	174.1	-101.4	0	0	0	111.5	T153 V154 L158 T159 L160	T153-F156 PolarHBondContact O-N 3.29Å; V154-F156 PolarHBondContact O-N 3.18Å; F156-L158 PolarHBondContact O-N 2.83Å; F156-T159 PolarHBondContact O-N 3.49Å; F156-T159 PolarHBondContact O-OG1 3.2Å; F156-L160 HydrophobicContact CD1-CD1 4.31Å; F156-L160 HydrophobicContact CE1-CD1 3.62Å; F156-L160 HydrophobicContact CE2-CD1 4.33Å; F156-L160 HydrophobicContact CZ-CD1 3.64Å; F156-L160 HydrophobicContact CZ-CG 4.34Å; F156-L160 PolarHBondContact O-N 3.15Å
157	W	89.5	Confident	86.1	Confident	45 Å²	45	78.2 Å²	78.2	17%	0.17	39%	0.386	C	S	.	.	H	α-helix	trans	-57.9	-48.7	177.6	-77.3	122.5	0	0	0	112.4	Y135 V139 T153 V154 I155 T159 L160 D161	Y135-W157 HydrophobicContact CE2-CZ3 4.39Å; V139-W157 HydrophobicContact CG1-CE3 4.07Å; V139-W157 HydrophobicContact CG1-CH2 4.12Å; V139-W157 HydrophobicContact CG1-CZ3 3.51Å; T153-W157 VanDerWaalsContact O-CD1 3.27Å; T153-W157 PolarHBondContact O-N 3.25Å; T153-W157 VanDerWaalsContact O-N 3.08Å; V154-W157 PolarHBondContact O-N 3.28Å; I155-W157 PolarHBondContact O-N 3.2Å; W157-T159 VanDerWaalsContact C-N 3.3Å; W157-T159 PolarHBondContact O-N 3.3Å; W157-L160 HydrophobicContact CE3-CD1 4.36Å; W157-L160 HydrophobicContact CZ3-CD1 4.4Å; W157-L160 PolarHBondContact O-N 3.26Å; W157-L160 VanDerWaalsContact O-N 3.17Å; W157-D161 PolarHBondContact O-N 2.99Å
158	L	88.1	Confident	86.9	Confident	42 Å²	42	72.6 Å²	72.6	22%	0.22	36%	0.356	C	S	.	.	H	α-helix	trans	-58.7	-39.1	177.6	-72.6	175.4	0	0	0	112.5	V154 I155 F156 L160 D161 Y162 F222	V154-L158 HydrophobicContact CG1-CD1 3.71Å; V154-L158 HydrophobicContact CG1-CG 4.31Å; V154-L158 WeakPolarHBondContact O-CB 3.4Å; V154-L158 VanDerWaalsContact O-CG 3.31Å; V154-L158 WeakPolarHBondContact O-CG 3.47Å; V154-L158 PolarHBondContact O-N 3.27Å; I155-L158 PolarHBondContact O-N 3.04Å; F156-L158 PolarHBondContact O-N 2.83Å; L158-L160 PolarHBondContact O-N 3.19Å; L158-D161 PolarHBondContact O-N 3.41Å; L158-Y162 HydrophobicContact CB-CD2 4.26Å; L158-Y162 HydrophobicContact CB-CE2 4.1Å; L158-Y162 HydrophobicContact CD2-CE2 3.92Å; L158-Y162 HydrophobicContact CG-CE2 4.49Å; L158-Y162 WeakPolarHBondContact O-CD2 3.31Å; L158-Y162 PolarHBondContact O-N 2.93Å; L158-F222 HydrophobicContact CD2-CE2 4Å
159	T	91.9	Very high	88	Confident	81 Å²	81	72.7 Å²	72.7	50%	0.497	36%	0.358	S	S	.	.	H	α-helix	trans	-63.5	-40.4	176.9	58.6	0	0	0	0	112.9	I155 F156 W157 F163	I155-T159 WeakPolarHBondContact O-CG2 3.39Å; I155-T159 PolarHBondContact O-N 3.18Å; F156-T159 PolarHBondContact O-N 3.49Å; F156-T159 PolarHBondContact O-OG1 3.2Å; W157-T159 VanDerWaalsContact C-N 3.3Å; W157-T159 PolarHBondContact O-N 3.3Å; T159-F163 VanDerWaalsContact O-CB 3.25Å; T159-F163 WeakPolarHBondContact O-CB 3.35Å; T159-F163 PolarHBondContact O-N 2.81Å
160	L	92.6	Very high	89.1	Confident	59 Å²	59	74 Å²	74	31%	0.309	37%	0.365	S	S	.	.	H	α-helix	trans	-67.1	-42.5	176.4	-68	-179.5	0	0	0	112	Y135 F156 W157 L158 F163 A164	Y135-L160 HydrophobicContact CE2-CB 4.45Å; Y135-L160 HydrophobicContact CE2-CD1 4.36Å; F156-L160 HydrophobicContact CD1-CD1 4.31Å; F156-L160 HydrophobicContact CE1-CD1 3.62Å; F156-L160 HydrophobicContact CE2-CD1 4.33Å; F156-L160 HydrophobicContact CZ-CD1 3.64Å; F156-L160 HydrophobicContact CZ-CG 4.34Å; F156-L160 PolarHBondContact O-N 3.15Å; W157-L160 HydrophobicContact CE3-CD1 4.36Å; W157-L160 HydrophobicContact CZ3-CD1 4.4Å; W157-L160 PolarHBondContact O-N 3.26Å; W157-L160 VanDerWaalsContact O-N 3.17Å; L158-L160 PolarHBondContact O-N 3.19Å; L160-F163 PolarHBondContact O-N 2.87Å; L160-A164 WeakPolarHBondContact O-CB 3.09Å; L160-A164 PolarHBondContact O-N 3.4Å
161	D	92.4	Very high	90.2	Very high	1 Å²	1	68.8 Å²	68.8	1%	0.005	34%	0.337	C	S	.	.	H	α-helix	trans	-68	-43.6	-178.8	-59.5	-49.8	0	0	0	112.2	Y135 R143 W157 L158 F163 A164 D165 R227	Y135-D161 WeakPolarHBondContact CE1-OD1 3.45Å; Y135-D161 PolarHBondContact OH-OD1 3.08Å; R143-D161 IonicContact CZ-OD1 2.82Å; R143-D161 IonicContact CZ-OD2 2.76Å; R143-D161 IonicContact NH1-OD1 3.52Å; R143-D161 PolarHBondContact NH1-OD1 2.8Å; R143-D161 IonicContact NH1-OD2 3.97Å; R143-D161 PolarHBondContact NH1-OD2 2.86Å; R143-D161 IonicContact NH2-OD1 3.67Å; R143-D161 PolarHBondContact NH2-OD1 2.81Å; R143-D161 IonicContact NH2-OD2 3.36Å; R143-D161 PolarHBondContact NH2-OD2 3.48Å; W157-D161 PolarHBondContact O-N 2.99Å; L158-D161 PolarHBondContact O-N 3.41Å; D161-F163 VanDerWaalsContact C-N 3.31Å; D161-F163 PolarHBondContact O-N 2.96Å; D161-A164 WeakPolarHBondContact O-CB 3.34Å; D161-A164 PolarHBondContact O-N 3.46Å; D161-D165 PolarHBondContact O-N 3.29Å; D161-R227 VanDerWaalsContact CB-NH1 3.34Å; D161-R227 IonicContact OD1-NH1 2.75Å; D161-R227 IonicContact OD2-CZ 3.15Å; D161-R227 IonicContact OD2-NH1 2.71Å; D161-R227 PolarHBondContact OD2-NH1 2.88Å
162	Y	92.2	Very high	91.2	Very high	114 Å²	114	61.9 Å²	61.9	45%	0.447	31%	0.305	S	S	.	.	H	α-helix	trans	-70.6	-27.8	176.2	-68.1	-51.8	0	0	0	112.6	L158 L166 D214	L158-Y162 HydrophobicContact CB-CD2 4.26Å; L158-Y162 HydrophobicContact CB-CE2 4.1Å; L158-Y162 HydrophobicContact CD2-CE2 3.92Å; L158-Y162 HydrophobicContact CG-CE2 4.49Å; L158-Y162 WeakPolarHBondContact O-CD2 3.31Å; L158-Y162 PolarHBondContact O-N 2.93Å; Y162-L166 VanDerWaalsContact O-CB 3.32Å; Y162-L166 WeakPolarHBondContact O-CB 3.47Å; Y162-L166 PolarHBondContact O-N 3.3Å; Y162-D214 WeakPolarHBondContact CE1-OD2 3.48Å
163	F	95	Very high	91.7	Very high	120 Å²	120	56.7 Å²	56.7	53%	0.526	29%	0.286	S	S	.	.	H	α-helix	trans	-68.1	-39.3	169.4	-179.3	-105	0	0	0	111.9	T159 L160 D161 L166 L167	T159-F163 VanDerWaalsContact O-CB 3.25Å; T159-F163 WeakPolarHBondContact O-CB 3.35Å; T159-F163 PolarHBondContact O-N 2.81Å; L160-F163 PolarHBondContact O-N 2.87Å; D161-F163 VanDerWaalsContact C-N 3.31Å; D161-F163 PolarHBondContact O-N 2.96Å; F163-L166 WeakPolarHBondContact O-CB 3.33Å; F163-L166 PolarHBondContact O-N 2.97Å; F163-L167 HydrophobicContact CD1-CD1 4.16Å; F163-L167 HydrophobicContact CE1-CD1 3.68Å; F163-L167 HydrophobicContact CE1-CG 4.43Å; F163-L167 HydrophobicContact CZ-CD1 4.05Å; F163-L167 HydrophobicContact CZ-CG 4.45Å; F163-L167 WeakPolarHBondContact O-CG 3.43Å; F163-L167 PolarHBondContact O-N 3.24Å; F163-L167 VanDerWaalsContact O-N 3.08Å
164	A	94.7	Very high	92	Very high	5 Å²	5	55.2 Å²	55.2	4%	0.041	28%	0.277	C	S	.	.	H	α-helix	trans	-64.4	-45.2	174.2	0	0	0	0	0	112.4	V132 Y135 H136 L160 D161 L166 L167 Y168	V132-A164 HydrophobicContact CG1-CB 3.65Å; Y135-A164 HydrophobicContact CD1-CB 4.28Å; Y135-A164 HydrophobicContact CE1-CB 4.31Å; H136-A164 WeakPolarHBondContact NE2-CB 3.43Å; L160-A164 WeakPolarHBondContact O-CB 3.09Å; L160-A164 PolarHBondContact O-N 3.4Å; D161-A164 WeakPolarHBondContact O-CB 3.34Å; D161-A164 PolarHBondContact O-N 3.46Å; A164-L166 VanDerWaalsContact C-N 3.34Å; A164-L166 PolarHBondContact O-N 2.84Å; A164-L167 PolarHBondContact O-N 2.75Å; A164-Y168 PolarHBondContact O-N 3.41Å; A164-Y168 VanDerWaalsContact O-N 3.12Å
165	D	93.7	Very high	92.2	Very high	16 Å²	16	54 Å²	54	9%	0.086	27%	0.27	C	S	.	.	H	α-helix	trans	-64.1	-36.1	174	-78.3	-24.6	0	0	0	112	D161 L167 Y168 L169 R230	D161-D165 PolarHBondContact O-N 3.29Å; D165-L167 PolarHBondContact O-N 2.86Å; D165-Y168 WeakPolarHBondContact O-CB 3.35Å; D165-Y168 PolarHBondContact O-N 2.86Å; D165-L169 PolarHBondContact O-N 2.96Å; D165-R230 IonicContact OD1-CZ 3.64Å; D165-R230 IonicContact OD1-NE 2.65Å; D165-R230 PolarHBondContact OD1-NE 3.08Å; D165-R230 IonicContact OD1-NH2 3.48Å; D165-R230 IonicContact OD2-CZ 3.31Å; D165-R230 IonicContact OD2-NE 2.7Å; D165-R230 PolarHBondContact OD2-NE 3.24Å; D165-R230 IonicContact OD2-NH2 3.46Å; D165-R230 PolarHBondContact OD2-NH2 3.47Å
166	L	94.6	Very high	92.3	Very high	86 Å²	86	50.2 Å²	50.2	45%	0.45	25%	0.251	S	S	.	.	H	α-helix	trans	-60.6	-42	172.6	176.7	64.7	0	0	0	111.9	Y162 F163 A164 Y168 L169 I170	Y162-L166 VanDerWaalsContact O-CB 3.32Å; Y162-L166 WeakPolarHBondContact O-CB 3.47Å; Y162-L166 PolarHBondContact O-N 3.3Å; F163-L166 WeakPolarHBondContact O-CB 3.33Å; F163-L166 PolarHBondContact O-N 2.97Å; A164-L166 VanDerWaalsContact C-N 3.34Å; A164-L166 PolarHBondContact O-N 2.84Å; L166-Y168 VanDerWaalsContact C-N 3.32Å; L166-Y168 PolarHBondContact O-N 3.28Å; L166-L169 WeakPolarHBondContact O-CB 3.49Å; L166-L169 PolarHBondContact O-N 2.89Å; L166-I170 HydrophobicContact CD1-CD1 4.35Å; L166-I170 HydrophobicContact CG-CD1 4.11Å; L166-I170 WeakPolarHBondContact O-CG1 3.41Å; L166-I170 PolarHBondContact O-N 2.92Å
167	L	96.1	Very high	92.3	Very high	22 Å²	22	47.4 Å²	47.4	12%	0.115	24%	0.238	C	C	.	.	H	α-helix	trans	-65.5	-35.5	175.5	-69.8	172.6	0	0	0	112	W125 V128 I129 V132 F163 A164 D165 I170 D171	W125-L167 HydrophobicContact CH2-CD2 3.89Å; V128-L167 HydrophobicContact CG1-CD1 4.49Å; I129-L167 HydrophobicContact CD1-CB 4.2Å; I129-L167 WeakPolarHBondContact CD1-O 3.43Å; V132-L167 HydrophobicContact CG2-CB 4.23Å; V132-L167 HydrophobicContact CG2-CD1 3.5Å; V132-L167 VanDerWaalsContact CG2-CD1 3.5Å; F163-L167 HydrophobicContact CD1-CD1 4.16Å; F163-L167 HydrophobicContact CE1-CD1 3.68Å; F163-L167 HydrophobicContact CE1-CG 4.43Å; F163-L167 HydrophobicContact CZ-CD1 4.05Å; F163-L167 HydrophobicContact CZ-CG 4.45Å; F163-L167 WeakPolarHBondContact O-CG 3.43Å; F163-L167 PolarHBondContact O-N 3.24Å; F163-L167 VanDerWaalsContact O-N 3.08Å; A164-L167 PolarHBondContact O-N 2.75Å; D165-L167 PolarHBondContact O-N 2.86Å; L167-I170 HydrophobicContact CD2-CD1 4.47Å; L167-I170 PolarHBondContact O-N 3.26Å; L167-D171 WeakPolarHBondContact O-CB 3.44Å; L167-D171 PolarHBondContact O-N 2.77Å
168	Y	94.9	Very high	92.2	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-66.7	-38.3	172.8	-83.2	20.3	0	0	0	112.6	I129 V132 H136 A164 D165 L166 D171 M172 R230 K233	I129-Y168 HydrophobicContact CG2-CE1 4.24Å; V132-Y168 HydrophobicContact CB-CE1 4.04Å; V132-Y168 HydrophobicContact CG1-CD1 3.92Å; V132-Y168 HydrophobicContact CG1-CE1 3.51Å; H136-Y168 AromaticContact ND1-CZ 3.68Å; H136-Y168 PolarHBondContact ND1-OH 3.34Å; A164-Y168 PolarHBondContact O-N 3.41Å; A164-Y168 VanDerWaalsContact O-N 3.12Å; D165-Y168 WeakPolarHBondContact O-CB 3.35Å; D165-Y168 PolarHBondContact O-N 2.86Å; L166-Y168 VanDerWaalsContact C-N 3.32Å; L166-Y168 PolarHBondContact O-N 3.28Å; Y168-D171 PolarHBondContact O-N 2.95Å; Y168-M172 PolarHBondContact O-N 2.84Å; Y168-M172 VanDerWaalsContact O-N 3.08Å; Y168-R230 HydrophobicContact CE2-CB 4.15Å; Y168-R230 HydrophobicContact CE2-CG 4.22Å; Y168-R230 PolarHBondContact OH-O 3.24Å; Y168-K233 HydrophobicContact CD1-CD 4.06Å; Y168-K233 HydrophobicContact CD2-CD 3.73Å; Y168-K233 HydrophobicContact CE1-CD 4.02Å; Y168-K233 HydrophobicContact CE2-CB 3.95Å; Y168-K233 HydrophobicContact CE2-CD 3.7Å; Y168-K233 HydrophobicContact CE2-CG 4.36Å; Y168-K233 HydrophobicContact CG-CD 3.91Å
169	L	94	Very high	92.1	Very high	82 Å²	82	45 Å²	45	43%	0.429	23%	0.231	S	C	.	.	H	α-helix	trans	-62.2	-45.7	172.1	-77.5	165.3	0	0	0	111.5	D165 L166 D171 M172 T173 L210	D165-L169 PolarHBondContact O-N 2.96Å; L166-L169 WeakPolarHBondContact O-CB 3.49Å; L166-L169 PolarHBondContact O-N 2.89Å; L169-D171 VanDerWaalsContact C-N 3.32Å; L169-D171 PolarHBondContact O-N 3.24Å; L169-M172 HydrophobicContact CD2-CE 4.26Å; L169-M172 WeakPolarHBondContact O-CB 3.5Å; L169-M172 PolarHBondContact O-N 2.97Å; L169-T173 PolarHBondContact O-N 2.86Å; L169-T173 VanDerWaalsContact O-N 3.16Å; L169-L210 HydrophobicContact CD2-CD1 3.86Å; L169-L210 HydrophobicContact CD2-CD2 4.31Å; L169-L210 HydrophobicContact CG-CD1 4.16Å; L169-L210 HydrophobicContact CG-CD2 3.93Å
170	I	94	Very high	91.9	Very high	63 Å²	63	42.4 Å²	42.4	32%	0.323	21%	0.213	S	C	.	.	H	α-helix	trans	-61.4	-42.6	176.6	-65.4	164.1	0	0	0	110.3	W125 L166 L167 M172 T173 I174	W125-I170 HydrophobicContact CH2-CB 4.09Å; W125-I170 HydrophobicContact CH2-CG2 3.53Å; W125-I170 HydrophobicContact CZ2-CB 3.99Å; W125-I170 HydrophobicContact CZ2-CG2 3.56Å; W125-I170 HydrophobicContact CZ3-CG2 4.49Å; L166-I170 HydrophobicContact CD1-CD1 4.35Å; L166-I170 HydrophobicContact CG-CD1 4.11Å; L166-I170 WeakPolarHBondContact O-CG1 3.41Å; L166-I170 PolarHBondContact O-N 2.92Å; L167-I170 HydrophobicContact CD2-CD1 4.47Å; L167-I170 PolarHBondContact O-N 3.26Å; I170-M172 VanDerWaalsContact C-N 3.31Å; I170-M172 PolarHBondContact O-N 3.13Å; I170-T173 PolarHBondContact O-N 2.93Å; I170-T173 PolarHBondContact O-OG1 2.95Å; I170-I174 HydrophobicContact CG2-CD1 3.78Å; I170-I174 HydrophobicContact CG2-CG1 4.37Å; I170-I174 WeakPolarHBondContact O-CG1 3.4Å; I170-I174 PolarHBondContact O-N 3.21Å
171	D	94.3	Very high	91.4	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-61.6	-34.4	176.1	-179.7	69.2	0	0	0	113.5	W125 I129 L167 Y168 L169 I174 S175 K233 K236	W125-D171 HydrophobicContact CZ2-CB 4.33Å; W125-D171 PolarHBondContact NE1-OD1 2.85Å; W125-D171 VanDerWaalsContact NE1-OD1 3.09Å; I129-D171 HydrophobicContact CD1-CB 3.78Å; I129-D171 HydrophobicContact CG1-CB 3.98Å; L167-D171 WeakPolarHBondContact O-CB 3.44Å; L167-D171 PolarHBondContact O-N 2.77Å; Y168-D171 PolarHBondContact O-N 2.95Å; L169-D171 VanDerWaalsContact C-N 3.32Å; L169-D171 PolarHBondContact O-N 3.24Å; D171-I174 PolarHBondContact O-N 3.17Å; D171-S175 WeakPolarHBondContact O-CB 3.3Å; D171-S175 PolarHBondContact O-N 3.45Å; D171-S175 PolarHBondContact O-OG 3.26Å; D171-K233 WeakPolarHBondContact OD2-CE 3.46Å; D171-K233 IonicContact OD2-NZ 3.91Å; D171-K233 PolarHBondContact OD2-NZ 3.09Å; D171-K236 IonicContact OD1-NZ 3.64Å; D171-K236 PolarHBondContact OD1-NZ 2.92Å; D171-K236 WeakPolarHBondContact OD2-CE 3.42Å; D171-K236 IonicContact OD2-NZ 2.89Å; D171-K236 PolarHBondContact OD2-NZ 3.22Å
172	M	91.7	Very high	90.9	Very high	40 Å²	40	47.5 Å²	47.5	20%	0.197	24%	0.238	C	C	.	.	H	α-helix	trans	-64.4	-40.9	171.6	-173.8	172.7	66.6	0	0	111.3	Y168 L169 I170 S175 L176 L210	Y168-M172 PolarHBondContact O-N 2.84Å; Y168-M172 VanDerWaalsContact O-N 3.08Å; L169-M172 HydrophobicContact CD2-CE 4.26Å; L169-M172 WeakPolarHBondContact O-CB 3.5Å; L169-M172 PolarHBondContact O-N 2.97Å; I170-M172 VanDerWaalsContact C-N 3.31Å; I170-M172 PolarHBondContact O-N 3.13Å; M172-S175 PolarHBondContact O-N 2.64Å; M172-L176 WeakPolarHBondContact O-CG 3.27Å; M172-L176 PolarHBondContact O-N 3.37Å; M172-L210 HydrophobicContact CE-CD1 4.4Å; M172-L210 HydrophobicContact SD-CD1 4.39Å
173	T	90.4	Very high	90.5	Very high	76 Å²	76	47.8 Å²	47.8	47%	0.466	25%	0.247	S	C	.	.	H	α-helix	trans	-67.7	-35.3	175.7	70.3	0	0	0	0	113.3	L169 I170 K177	L169-T173 PolarHBondContact O-N 2.86Å; L169-T173 VanDerWaalsContact O-N 3.16Å; I170-T173 PolarHBondContact O-N 2.93Å; I170-T173 PolarHBondContact O-OG1 2.95Å; T173-K177 PolarHBondContact O-N 3.34Å
174	I	90.9	Very high	89.6	Confident	18 Å²	18	44.8 Å²	44.8	9%	0.092	25%	0.25	C	S	.	.	H	α-helix	trans	-69.6	-39.1	174.8	-70.5	168.7	0	0	0	110.3	F115 W125 I170 D171 L176 K177 T178	F115-I174 HydrophobicContact CD2-CG2 3.92Å; F115-I174 HydrophobicContact CE2-CB 4.22Å; F115-I174 HydrophobicContact CE2-CG1 3.83Å; F115-I174 HydrophobicContact CE2-CG2 4Å; F115-I174 HydrophobicContact CG-CG2 4.34Å; F115-I174 HydrophobicContact CZ-CG1 4.03Å; F115-I174 HydrophobicContact CZ-CG2 4.46Å; W125-I174 HydrophobicContact CD2-CD1 3.66Å; W125-I174 HydrophobicContact CE3-CD1 4.22Å; W125-I174 HydrophobicContact CG-CD1 4.05Å; W125-I174 HydrophobicContact CH2-CD1 4.3Å; W125-I174 HydrophobicContact CZ2-CD1 3.76Å; I170-I174 HydrophobicContact CG2-CD1 3.78Å; I170-I174 HydrophobicContact CG2-CG1 4.37Å; I170-I174 WeakPolarHBondContact O-CG1 3.4Å; I170-I174 PolarHBondContact O-N 3.21Å; D171-I174 PolarHBondContact O-N 3.17Å; I174-L176 PolarHBondContact O-N 3.37Å; I174-K177 CarbonylContact O-C 3.52Å; I174-K177 VanDerWaalsContact O-C 3.27Å; I174-K177 WeakPolarHBondContact O-CA 3.45Å; I174-K177 PolarHBondContact O-N 3Å; I174-T178 PolarHBondContact O-N 2.91Å; I174-T178 PolarHBondContact O-OG1 3.33Å
175	S	89	Confident	88.9	Confident	16 Å²	16	48.7 Å²	48.7	11%	0.112	27%	0.273	C	S	.	.	H	α-helix	trans	-65.2	-38.5	177.7	-56.5	0	0	0	0	111.6	D171 M172 K177 T178 Y197 K236	D171-S175 WeakPolarHBondContact O-CB 3.3Å; D171-S175 PolarHBondContact O-N 3.45Å; D171-S175 PolarHBondContact O-OG 3.26Å; M172-S175 PolarHBondContact O-N 2.64Å; S175-K177 PolarHBondContact O-N 3.37Å; S175-T178 PolarHBondContact O-N 3.28Å; S175-Y197 VanDerWaalsContact CB-CE2 3.46Å; S175-K236 PolarHBondContact OG-NZ 3.15Å
176	L	89.2	Confident	88.3	Confident	45 Å²	45	50.4 Å²	50.4	24%	0.236	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-12.8	168.7	-76.1	164.4	0	0	0	114.7	M172 I174 R194 Y197	M172-L176 WeakPolarHBondContact O-CG 3.27Å; M172-L176 PolarHBondContact O-N 3.37Å; I174-L176 PolarHBondContact O-N 3.37Å; L176-R194 HydrophobicContact CD2-CG 4.19Å; L176-Y197 HydrophobicContact CD2-CD1 3.43Å; L176-Y197 VanDerWaalsContact CD2-CD1 3.43Å; L176-Y197 HydrophobicContact CD2-CE1 3.86Å; L176-Y197 HydrophobicContact CD2-CG 4.38Å; L176-Y197 HydrophobicContact CG-CD1 3.81Å; L176-Y197 HydrophobicContact CG-CE1 3.8Å
177	K	88.4	Confident	87.7	Confident	64 Å²	64	48.4 Å²	48.4	28%	0.278	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119	6.6	-178.6	-72.3	-64.1	-166.9	171.9	0	113.7	Y114 F115 T173 I174 S175 M193	Y114-K177 HydrophobicContact CD1-CD 4.08Å; Y114-K177 HydrophobicContact CE1-CD 4.16Å; F115-K177 HydrophobicContact CD2-CB 3.89Å; F115-K177 HydrophobicContact CE2-CB 4.16Å; F115-K177 PolarHBondContact N-O 3.4Å; T173-K177 PolarHBondContact O-N 3.34Å; I174-K177 CarbonylContact O-C 3.52Å; I174-K177 VanDerWaalsContact O-C 3.27Å; I174-K177 WeakPolarHBondContact O-CA 3.45Å; I174-K177 PolarHBondContact O-N 3Å; S175-K177 PolarHBondContact O-N 3.37Å; K177-M193 WeakPolarHBondContact O-CE 3.37Å
178	T	88.5	Confident	87.2	Confident	31 Å²	31	51 Å²	51	19%	0.19	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-94.8	124.7	178.6	-61.4	0	0	0	0	109.9	F115 P117 I174 S175 M193	F115-T178 WeakPolarHBondContact O-CA 3.3Å; P117-T178 HydrophobicContact CB-CG2 3.84Å; I174-T178 PolarHBondContact O-N 2.91Å; I174-T178 PolarHBondContact O-OG1 3.33Å; S175-T178 PolarHBondContact O-N 3.28Å; T178-M193 VanDerWaalsContact C-CE 3.46Å; T178-M193 WeakPolarHBondContact O-CE 3.31Å
179	G	85.8	Confident	86.7	Confident	5 Å²	5	54.5 Å²	54.5	5%	0.052	30%	0.299	C	S	.	.			trans	-62.6	156.6	179	0	0	0	0	0	112.2	F115 P117 Q187	F115-G179 PolarHBondContact O-N 3.45Å; P117-G179 WeakPolarHBondContact CD-O 3.23Å; P117-G179 VanDerWaalsContact CG-O 3.29Å; P117-G179 WeakPolarHBondContact CG-O 3.47Å; G179-Q187 WeakPolarHBondContact CA-O 3.42Å
180	F	86.8	Confident	86.2	Confident	26 Å²	26	51.2 Å²	51.2	11%	0.114	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	164.4	174.8	68.8	-76.3	0	0	0	110.3	E182 Q187 K192 M193 H196	F180-E182 HydrophobicContact CD2-CB 4.22Å; F180-E182 HydrophobicContact CE2-CB 3.74Å; F180-E182 HydrophobicContact CE2-CG 4.14Å; F180-Q187 HydrophobicContact CD1-CB 4.14Å; F180-Q187 HydrophobicContact CE1-CB 3.75Å; F180-Q187 HydrophobicContact CE1-CG 4.45Å; F180-Q187 HydrophobicContact CE2-CB 4.41Å; F180-Q187 HydrophobicContact CE2-CG 4.29Å; F180-Q187 HydrophobicContact CZ-CB 3.9Å; F180-Q187 HydrophobicContact CZ-CG 4.09Å; F180-Q187 PolarHBondContact O-N 2.97Å; F180-K192 HydrophobicContact CE1-CB 4.01Å; F180-K192 HydrophobicContact CZ-CB 4.05Å; F180-M193 HydrophobicContact CD1-CG 4.03Å; F180-M193 HydrophobicContact CE1-CG 4.05Å; F180-H196 HydrophobicContact CD1-CB 4.3Å; F180-H196 AromaticContact CD2-CD2 4Å; F180-H196 HydrophobicContact CE1-CB 4.14Å; F180-H196 HydrophobicContact CE2-CB 4.42Å; F180-H196 AromaticContact CG-CG 4Å; F180-H196 AromaticContact CG-ND1 3.8Å; F180-H196 HydrophobicContact CZ-CB 4.21Å
181	L	84	Confident	85.8	Confident	98 Å²	98	55.3 Å²	55.3	51%	0.513	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	127.1	175.5	-160.2	72.8	0	0	0	108.1
182	E	81.7	Confident	85.5	Confident	70 Å²	70	59.2 Å²	59.2	33%	0.327	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	120.5	176.3	-166.7	178.7	-150	0	0	105.6	F180 G184 V185 Q187 K192	F180-E182 HydrophobicContact CD2-CB 4.22Å; F180-E182 HydrophobicContact CE2-CB 3.74Å; F180-E182 HydrophobicContact CE2-CG 4.14Å; E182-G184 PolarHBondContact O-N 2.84Å; E182-V185 PolarHBondContact N-O 3.48Å; E182-V185 PolarHBondContact O-N 3.46Å; E182-V185 VanDerWaalsContact O-N 3.09Å; E182-Q187 HydrophobicContact CB-CG 3.49Å; E182-Q187 VanDerWaalsContact CB-CG 3.49Å; E182-Q187 HydrophobicContact CG-CG 4.47Å; E182-Q187 WeakPolarHBondContact OE2-CG 3.49Å; E182-K192 IonicContact OE2-NZ 2.64Å; E182-K192 PolarHBondContact OE2-NZ 2.8Å
183	D	82.3	Confident	85.3	Confident	120 Å²	120	57.5 Å²	57.5	64%	0.642	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	57.9	-176.2	-54.2	-26.3	0	0	0	112.7	V185 E979	D183-V185 WeakPolarHBondContact O-CG2 2.97Å; D183-V185 PolarHBondContact O-N 2.74Å; D183-E979 VanDerWaalsContact O-OE2 3.05Å
184	G	76.2	Confident	85.2	Confident	57 Å²	57	60.3 Å²	60.3	59%	0.588	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	-6.6	179.5	0	0	0	0	0	116	E182 E979	E182-G184 PolarHBondContact O-N 2.84Å; G184-E979 PolarHBondContact N-OE2 3.2Å
185	V	80	Confident	85.2	Confident	86 Å²	86	62.5 Å²	62.5	52%	0.521	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	136	-173.5	176.1	0	0	0	0	110.1	E182 D183 Q187	E182-V185 PolarHBondContact N-O 3.48Å; E182-V185 PolarHBondContact O-N 3.46Å; E182-V185 VanDerWaalsContact O-N 3.09Å; D183-V185 WeakPolarHBondContact O-CG2 2.97Å; D183-V185 PolarHBondContact O-N 2.74Å; V185-Q187 PolarHBondContact O-N 2.64Å
186	M	82.4	Confident	85.2	Confident	53 Å²	53	65.4 Å²	65.4	26%	0.261	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	113.5	179.8	-168.5	162.9	-75.4	0	0	110.9	N116 P117 F188	N116-M186 HydrophobicContact CB-SD 4.28Å; N116-M186 WeakPolarHBondContact OD1-CE 3.25Å; N116-M186 PolarHBondContact OD1-SD 2.88Å; N116-M186 VanDerWaalsContact OD1-SD 3.37Å; P117-M186 HydrophobicContact CG-CE 3.71Å; P117-M186 HydrophobicContact CG-SD 4.32Å; M186-F188 HydrophobicContact CB-CE2 4.2Å; M186-F188 HydrophobicContact CG-CD2 4.3Å; M186-F188 HydrophobicContact CG-CE1 4.29Å; M186-F188 HydrophobicContact CG-CE2 3.59Å; M186-F188 HydrophobicContact CG-CZ 3.6Å; M186-F188 HydrophobicContact SD-CE1 4.32Å; M186-F188 HydrophobicContact SD-CE2 3.83Å; M186-F188 HydrophobicContact SD-CZ 3.43Å; M186-F188 WeakPolarHBondContact SD-CZ 3.45Å
187	Q	82.2	Confident	85.3	Confident	43 Å²	43	63.9 Å²	63.9	20%	0.201	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	125.1	-178	-58.8	-64.8	-27.5	0	0	111.1	G179 F180 E182 V185	G179-Q187 WeakPolarHBondContact CA-O 3.42Å; F180-Q187 HydrophobicContact CD1-CB 4.14Å; F180-Q187 HydrophobicContact CE1-CB 3.75Å; F180-Q187 HydrophobicContact CE1-CG 4.45Å; F180-Q187 HydrophobicContact CE2-CB 4.41Å; F180-Q187 HydrophobicContact CE2-CG 4.29Å; F180-Q187 HydrophobicContact CZ-CB 3.9Å; F180-Q187 HydrophobicContact CZ-CG 4.09Å; F180-Q187 PolarHBondContact O-N 2.97Å; E182-Q187 HydrophobicContact CB-CG 3.49Å; E182-Q187 VanDerWaalsContact CB-CG 3.49Å; E182-Q187 HydrophobicContact CG-CG 4.47Å; E182-Q187 WeakPolarHBondContact OE2-CG 3.49Å; V185-Q187 PolarHBondContact O-N 2.64Å
188	F	84.5	Confident	85.4	Confident	78 Å²	78	64.2 Å²	64.2	34%	0.342	34%	0.339	S	S	.	.			trans	-118.8	18.5	176	-67.7	-66.5	0	0	0	113.3	Y114 N116 M186 G190 M193	Y114-F188 HydrophobicContact CD2-CB 4.21Å; Y114-F188 WeakPolarHBondContact CE2-O 3.39Å; Y114-F188 HydrophobicContact CG-CD1 4.29Å; Y114-F188 PolarHBondContact OH-O 3.38Å; N116-F188 HydrophobicContact CB-CZ 4.16Å; M186-F188 HydrophobicContact CB-CE2 4.2Å; M186-F188 HydrophobicContact CG-CD2 4.3Å; M186-F188 HydrophobicContact CG-CE1 4.29Å; M186-F188 HydrophobicContact CG-CE2 3.59Å; M186-F188 HydrophobicContact CG-CZ 3.6Å; M186-F188 HydrophobicContact SD-CE1 4.32Å; M186-F188 HydrophobicContact SD-CE2 3.83Å; M186-F188 HydrophobicContact SD-CZ 3.43Å; M186-F188 WeakPolarHBondContact SD-CZ 3.45Å; F188-G190 PolarHBondContact O-N 3.15Å; F188-M193 VanDerWaalsContact CA-SD 3.56Å
189	D	83.8	Confident	85.5	Confident	72 Å²	72	67.9 Å²	67.9	39%	0.385	36%	0.358	S	S	.	.			trans	-73.9	113.1	171.6	177.2	-3.5	0	0	0	110.1	M191 K192 M193	D189-M191 PolarHBondContact O-N 3.14Å; D189-M191 VanDerWaalsContact O-N 3.13Å; D189-M191 PolarHBondContact OD1-N 2.77Å; D189-K192 HydrophobicContact CB-CB 4.09Å; D189-K192 HydrophobicContact CB-CD 4.14Å; D189-K192 HydrophobicContact CB-CG 4.14Å; D189-K192 PolarHBondContact O-N 2.85Å; D189-K192 VanDerWaalsContact O-N 3.14Å; D189-M193 WeakPolarHBondContact O-CB 3.2Å; D189-M193 WeakPolarHBondContact O-CG 3.42Å; D189-M193 PolarHBondContact O-N 3.32Å
190	G	84.2	Confident	85.7	Confident	13 Å²	13	68 Å²	68	13%	0.134	36%	0.357	C	S	.	.	H	α-helix	trans	-60.4	-21.3	-177.5	0	0	0	0	0	115.2	Y114 F188 R194	Y114-G190 VanDerWaalsContact OH-CA 3.32Å; Y114-G190 WeakPolarHBondContact OH-CA 3.25Å; Y114-G190 PolarHBondContact OH-N 3.3Å; Y114-G190 VanDerWaalsContact OH-N 3.13Å; F188-G190 PolarHBondContact O-N 3.15Å; G190-R194 VanDerWaalsContact O-CD 3.32Å; G190-R194 WeakPolarHBondContact O-CD 3.15Å; G190-R194 WeakPolarHBondContact O-CG 3.49Å
191	M	86.5	Confident	85.8	Confident	150 Å²	150	69 Å²	69	74%	0.739	37%	0.368	S	S	*	.	H	α-helix	trans	-79.1	-48.6	172	-67.3	-160.8	-64.1	0	0	111.2	D189 M193 R194 S195	D189-M191 PolarHBondContact O-N 3.14Å; D189-M191 VanDerWaalsContact O-N 3.13Å; D189-M191 PolarHBondContact OD1-N 2.77Å; M191-M193 PolarHBondContact O-N 2.92Å; M191-R194 PolarHBondContact O-N 2.83Å; M191-S195 PolarHBondContact O-N 2.88Å
192	K	87.8	Confident	86	Confident	83 Å²	83	68.4 Å²	68.4	36%	0.361	36%	0.359	S	S	.	.	H	α-helix	trans	-58	-47.7	175.1	-73.7	-174.5	166.6	-158.8	0	112.2	F180 E182 D189 R194 S195 H196	F180-K192 HydrophobicContact CE1-CB 4.01Å; F180-K192 HydrophobicContact CZ-CB 4.05Å; E182-K192 IonicContact OE2-NZ 2.64Å; E182-K192 PolarHBondContact OE2-NZ 2.8Å; D189-K192 HydrophobicContact CB-CB 4.09Å; D189-K192 HydrophobicContact CB-CD 4.14Å; D189-K192 HydrophobicContact CB-CG 4.14Å; D189-K192 PolarHBondContact O-N 2.85Å; D189-K192 VanDerWaalsContact O-N 3.14Å; K192-R194 VanDerWaalsContact C-N 3.31Å; K192-R194 PolarHBondContact O-N 2.88Å; K192-S195 PolarHBondContact O-N 3.32Å; K192-H196 WeakPolarHBondContact O-CB 3.46Å; K192-H196 PolarHBondContact O-N 2.8Å
193	M	86.6	Confident	86.5	Confident	3 Å²	3	67.5 Å²	67.5	2%	0.015	35%	0.354	C	S	.	.	H	α-helix	trans	-57.9	-43.1	-179.7	-68.5	164.5	62.8	0	0	112.1	Y114 K177 T178 F180 F188 D189 M191 Y197	Y114-M193 HydrophobicContact CD1-CE 3.56Å; Y114-M193 HydrophobicContact CD1-SD 3.8Å; Y114-M193 HydrophobicContact CE1-CE 3.93Å; Y114-M193 HydrophobicContact CE1-SD 3.72Å; Y114-M193 HydrophobicContact CG-CE 4.45Å; K177-M193 WeakPolarHBondContact O-CE 3.37Å; T178-M193 VanDerWaalsContact C-CE 3.46Å; T178-M193 WeakPolarHBondContact O-CE 3.31Å; F180-M193 HydrophobicContact CD1-CG 4.03Å; F180-M193 HydrophobicContact CE1-CG 4.05Å; F188-M193 VanDerWaalsContact CA-SD 3.56Å; D189-M193 WeakPolarHBondContact O-CB 3.2Å; D189-M193 WeakPolarHBondContact O-CG 3.42Å; D189-M193 PolarHBondContact O-N 3.32Å; M191-M193 PolarHBondContact O-N 2.92Å; M193-Y197 WeakPolarHBondContact O-CB 3.42Å; M193-Y197 PolarHBondContact O-N 3.38Å
194	R	89.1	Confident	87	Confident	136 Å²	136	69.1 Å²	69.1	51%	0.513	35%	0.352	S	S	.	.	H	α-helix	trans	-65.8	-47.4	176	-76.2	174.3	169	-178.5	-6.6	111.6	L176 G190 M191 K192 Y197 L198	L176-R194 HydrophobicContact CD2-CG 4.19Å; G190-R194 VanDerWaalsContact O-CD 3.32Å; G190-R194 WeakPolarHBondContact O-CD 3.15Å; G190-R194 WeakPolarHBondContact O-CG 3.49Å; M191-R194 PolarHBondContact O-N 2.83Å; K192-R194 VanDerWaalsContact C-N 3.31Å; K192-R194 PolarHBondContact O-N 2.88Å; R194-Y197 PolarHBondContact O-N 2.96Å; R194-L198 WeakPolarHBondContact O-CB 3.18Å; R194-L198 VanDerWaalsContact O-CG 3.22Å; R194-L198 WeakPolarHBondContact O-CG 3.37Å; R194-L198 PolarHBondContact O-N 3.14Å
195	S	89.6	Confident	87.8	Confident	63 Å²	63	69 Å²	69	44%	0.441	34%	0.337	S	S	.	.	H	α-helix	trans	-59	-49.3	177.9	-171.8	0	0	0	0	111.6	M191 K192 Y197 L198 N199	M191-S195 PolarHBondContact O-N 2.88Å; K192-S195 PolarHBondContact O-N 3.32Å; S195-Y197 PolarHBondContact O-N 2.79Å; S195-L198 PolarHBondContact O-N 2.96Å; S195-N199 WeakPolarHBondContact O-CB 3.46Å; S195-N199 VanDerWaalsContact O-CG 3.29Å; S195-N199 PolarHBondContact O-N 3.37Å; S195-N199 PolarHBondContact O-ND2 2.93Å
196	H	89.3	Confident	88.4	Confident	78 Å²	78	64.9 Å²	64.9	36%	0.361	31%	0.313	S	S	.	.	H	α-helix	trans	-58.4	-45.2	176.5	170.4	-96.9	0	0	0	112.3	F180 K192 S200	F180-H196 HydrophobicContact CD1-CB 4.3Å; F180-H196 AromaticContact CD2-CD2 4Å; F180-H196 HydrophobicContact CE1-CB 4.14Å; F180-H196 HydrophobicContact CE2-CB 4.42Å; F180-H196 AromaticContact CG-CG 4Å; F180-H196 AromaticContact CG-ND1 3.8Å; F180-H196 HydrophobicContact CZ-CB 4.21Å; K192-H196 WeakPolarHBondContact O-CB 3.46Å; K192-H196 PolarHBondContact O-N 2.8Å; H196-S200 VanDerWaalsContact O-CB 3.31Å; H196-S200 WeakPolarHBondContact O-CB 3.44Å; H196-S200 PolarHBondContact O-N 2.9Å; H196-S200 VanDerWaalsContact O-N 3.15Å
197	Y	91.3	Very high	88.9	Confident	13 Å²	13	64.7 Å²	64.7	5%	0.051	32%	0.316	C	S	.	.	H	α-helix	trans	-68.1	-45	178.5	176.1	-102.2	0	0	0	112.7	S175 L176 M193 R194 S195 N199 S200 R202 F203 D206	S175-Y197 VanDerWaalsContact CB-CE2 3.46Å; L176-Y197 HydrophobicContact CD2-CD1 3.43Å; L176-Y197 VanDerWaalsContact CD2-CD1 3.43Å; L176-Y197 HydrophobicContact CD2-CE1 3.86Å; L176-Y197 HydrophobicContact CD2-CG 4.38Å; L176-Y197 HydrophobicContact CG-CD1 3.81Å; L176-Y197 HydrophobicContact CG-CE1 3.8Å; M193-Y197 WeakPolarHBondContact O-CB 3.42Å; M193-Y197 PolarHBondContact O-N 3.38Å; R194-Y197 PolarHBondContact O-N 2.96Å; S195-Y197 PolarHBondContact O-N 2.79Å; Y197-N199 VanDerWaalsContact C-N 3.34Å; Y197-N199 PolarHBondContact O-N 3.46Å; Y197-S200 WeakPolarHBondContact O-CB 3.43Å; Y197-S200 PolarHBondContact O-N 2.99Å; Y197-S200 VanDerWaalsContact O-N 3.12Å; Y197-R202 HydrophobicContact CE2-CB 4.39Å; Y197-F203 HydrophobicContact CD1-CB 4.25Å; Y197-F203 HydrophobicContact CD1-CD2 4.26Å; Y197-F203 HydrophobicContact CE1-CB 3.98Å; Y197-F203 AromaticContact CE1-CD2 3.6Å; Y197-F203 HydrophobicContact CE1-CD2 3.6Å; Y197-F203 HydrophobicContact CE1-CG 4.21Å; Y197-F203 VanDerWaalsContact O-CB 3.3Å; Y197-F203 WeakPolarHBondContact O-CB 3.24Å; Y197-D206 PolarHBondContact OH-OD2 2.91Å
198	L	90.7	Very high	89.3	Confident	70 Å²	70	65.8 Å²	65.8	37%	0.366	32%	0.323	S	S	.	.	H	α-helix	trans	-66.1	-33.3	-179.8	-69.6	170.8	0	0	0	113	R194 S195 S200 F203	R194-L198 WeakPolarHBondContact O-CB 3.18Å; R194-L198 VanDerWaalsContact O-CG 3.22Å; R194-L198 WeakPolarHBondContact O-CG 3.37Å; R194-L198 PolarHBondContact O-N 3.14Å; S195-L198 PolarHBondContact O-N 2.96Å; L198-S200 VanDerWaalsContact C-N 3.32Å; L198-F203 HydrophobicContact CD2-CD1 3.9Å; L198-F203 HydrophobicContact CD2-CD2 3.82Å; L198-F203 HydrophobicContact CD2-CE1 3.75Å; L198-F203 HydrophobicContact CD2-CE2 3.64Å; L198-F203 HydrophobicContact CD2-CG 3.94Å; L198-F203 HydrophobicContact CD2-CZ 3.6Å
199	N	90.5	Very high	89.7	Confident	109 Å²	109	62 Å²	62	58%	0.583	31%	0.306	S	S	*	.	H	α-helix	trans	-80.9	-12	174.7	-67.4	-17.6	0	0	0	113	S195 Y197	S195-N199 WeakPolarHBondContact O-CB 3.46Å; S195-N199 VanDerWaalsContact O-CG 3.29Å; S195-N199 PolarHBondContact O-N 3.37Å; S195-N199 PolarHBondContact O-ND2 2.93Å; Y197-N199 VanDerWaalsContact C-N 3.34Å; Y197-N199 PolarHBondContact O-N 3.46Å
200	S	89.5	Confident	90	Very high	6 Å²	6	60 Å²	60	4%	0.042	30%	0.295	C	S	.	.	S	Bend	trans	-82	143.4	178.1	-168.3	0	0	0	0	111.3	H196 Y197 L198 R202 F203	H196-S200 VanDerWaalsContact O-CB 3.31Å; H196-S200 WeakPolarHBondContact O-CB 3.44Å; H196-S200 PolarHBondContact O-N 2.9Å; H196-S200 VanDerWaalsContact O-N 3.15Å; Y197-S200 WeakPolarHBondContact O-CB 3.43Å; Y197-S200 PolarHBondContact O-N 2.99Å; Y197-S200 VanDerWaalsContact O-N 3.12Å; L198-S200 VanDerWaalsContact C-N 3.32Å; S200-R202 PolarHBondContact O-N 3.41Å; S200-R202 PolarHBondContact OG-NH1 2.85Å; S200-R202 VanDerWaalsContact OG-NH1 3.12Å; S200-F203 PolarHBondContact O-N 3.23Å; S200-F203 VanDerWaalsContact O-N 3.11Å
201	S	88.8	Confident	90.2	Very high	49 Å²	49	62.6 Å²	62.6	34%	0.343	31%	0.305	S	S	.	.	H	α-helix	trans	-52.2	-26.8	171.9	51.7	0	0	0	0	113.4	F203 Y204 I205	S201-F203 VanDerWaalsContact C-N 3.33Å; S201-F203 PolarHBondContact O-N 2.98Å; S201-Y204 PolarHBondContact O-N 3.35Å; S201-I205 WeakPolarHBondContact O-CG1 3.45Å; S201-I205 PolarHBondContact O-N 3.23Å
202	R	89.7	Confident	90	Very high	84 Å²	84	59.1 Å²	59.1	32%	0.317	29%	0.294	S	S	.	.	H	α-helix	trans	-55.2	-42.5	176.4	-59.1	179.6	-172.4	107.9	-9.8	112.9	F25 Y197 S200 Y204 I205 D206	F25-R202 VanDerWaalsContact CZ-NH2 3.35Å; Y197-R202 HydrophobicContact CE2-CB 4.39Å; S200-R202 PolarHBondContact O-N 3.41Å; S200-R202 PolarHBondContact OG-NH1 2.85Å; S200-R202 VanDerWaalsContact OG-NH1 3.12Å; R202-Y204 PolarHBondContact O-N 3.34Å; R202-I205 PolarHBondContact O-N 2.56Å; R202-D206 PolarHBondContact O-N 3.39Å
203	F	91.8	Very high	89.9	Confident	52 Å²	52	57.3 Å²	57.3	23%	0.228	29%	0.288	C	S	.	.	H	α-helix	trans	-63.4	-43.1	179.6	170.6	-114.5	0	0	0	112.2	Y197 L198 S200 S201 I205 D206 C207	Y197-F203 HydrophobicContact CD1-CB 4.25Å; Y197-F203 HydrophobicContact CD1-CD2 4.26Å; Y197-F203 HydrophobicContact CE1-CB 3.98Å; Y197-F203 AromaticContact CE1-CD2 3.6Å; Y197-F203 HydrophobicContact CE1-CD2 3.6Å; Y197-F203 HydrophobicContact CE1-CG 4.21Å; Y197-F203 VanDerWaalsContact O-CB 3.3Å; Y197-F203 WeakPolarHBondContact O-CB 3.24Å; L198-F203 HydrophobicContact CD2-CD1 3.9Å; L198-F203 HydrophobicContact CD2-CD2 3.82Å; L198-F203 HydrophobicContact CD2-CE1 3.75Å; L198-F203 HydrophobicContact CD2-CE2 3.64Å; L198-F203 HydrophobicContact CD2-CG 3.94Å; L198-F203 HydrophobicContact CD2-CZ 3.6Å; S200-F203 PolarHBondContact O-N 3.23Å; S200-F203 VanDerWaalsContact O-N 3.11Å; S201-F203 VanDerWaalsContact C-N 3.33Å; S201-F203 PolarHBondContact O-N 2.98Å; F203-I205 VanDerWaalsContact C-N 3.33Å; F203-I205 PolarHBondContact O-N 3.03Å; F203-D206 PolarHBondContact O-N 2.76Å; F203-C207 WeakPolarHBondContact CE2-SG 3.49Å; F203-C207 WeakPolarHBondContact CZ-SG 3.21Å; F203-C207 WeakPolarHBondContact O-CB 3.33Å; F203-C207 PolarHBondContact O-N 2.93Å; F203-C207 PolarHBondContact O-SG 3.47Å; F203-C207 VanDerWaalsContact O-SG 3.42Å
204	Y	92.4	Very high	89.6	Confident	153 Å²	153	57.8 Å²	57.8	60%	0.6	29%	0.291	S	S	*	.	H	α-helix	trans	-63.8	-38.3	177.5	-63.8	-85.7	0	0	0	112.1	S201 R202 L208	S201-Y204 PolarHBondContact O-N 3.35Å; R202-Y204 PolarHBondContact O-N 3.34Å; Y204-L208 VanDerWaalsContact O-CB 3.27Å; Y204-L208 WeakPolarHBondContact O-CB 3.28Å; Y204-L208 PolarHBondContact O-N 3.19Å
205	I	93.3	Very high	89.3	Confident	55 Å²	55	58.5 Å²	58.5	28%	0.282	30%	0.298	S	S	.	.	H	α-helix	trans	-66.2	-43.5	175.3	-64.2	167.4	0	0	0	111	S201 R202 F203 L208 S209 C232 Y235	S201-I205 WeakPolarHBondContact O-CG1 3.45Å; S201-I205 PolarHBondContact O-N 3.23Å; R202-I205 PolarHBondContact O-N 2.56Å; F203-I205 VanDerWaalsContact C-N 3.33Å; F203-I205 PolarHBondContact O-N 3.03Å; I205-L208 PolarHBondContact O-N 2.94Å; I205-S209 WeakPolarHBondContact O-CB 3.35Å; I205-S209 PolarHBondContact O-N 3.48Å; I205-C232 HydrophobicContact CG2-CB 4.21Å; I205-C232 WeakPolarHBondContact CG2-O 3.44Å; I205-Y235 HydrophobicContact CB-CE1 4.34Å; I205-Y235 HydrophobicContact CG2-CD1 3.78Å; I205-Y235 HydrophobicContact CG2-CE1 3.69Å
206	D	92.8	Very high	89	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-65.4	-42.5	178.4	-74	-34.9	0	0	0	111.6	Y197 R202 F203 S209 L210 K233 Y235	Y197-D206 PolarHBondContact OH-OD2 2.91Å; R202-D206 PolarHBondContact O-N 3.39Å; F203-D206 PolarHBondContact O-N 2.76Å; D206-S209 PolarHBondContact O-N 2.93Å; D206-S209 PolarHBondContact O-OG 2.88Å; D206-L210 PolarHBondContact O-N 3.46Å; D206-K233 VanDerWaalsContact OD1-CE 3.3Å; D206-K233 WeakPolarHBondContact OD1-CE 3.47Å; D206-K233 IonicContact OD1-NZ 2.98Å; D206-K233 PolarHBondContact OD1-NZ 3.07Å; D206-Y235 PolarHBondContact OD1-OH 2.8Å; D206-Y235 PolarHBondContact OD2-OH 3.5Å
207	C	92.3	Very high	88.7	Confident	48 Å²	48	56.4 Å²	56.4	32%	0.324	28%	0.282	S	S	.	.	H	α-helix	trans	-61.2	-44	172.3	-74.6	0	0	0	0	112.7	F203 S209 L210 L211	F203-C207 WeakPolarHBondContact CE2-SG 3.49Å; F203-C207 WeakPolarHBondContact CZ-SG 3.21Å; F203-C207 WeakPolarHBondContact O-CB 3.33Å; F203-C207 PolarHBondContact O-N 2.93Å; F203-C207 PolarHBondContact O-SG 3.47Å; F203-C207 VanDerWaalsContact O-SG 3.42Å; C207-S209 VanDerWaalsContact C-N 3.29Å; C207-S209 PolarHBondContact O-N 3.45Å; C207-L210 PolarHBondContact O-N 2.77Å; C207-L211 PolarHBondContact O-N 3.14Å
208	L	92	Very high	88.1	Confident	66 Å²	66	63.3 Å²	63.3	35%	0.346	32%	0.319	S	S	.	.	H	α-helix	trans	-61.4	-38.8	176.6	-178.1	60.7	0	0	0	111.6	Y204 I205 L210 L211 F229 C232	Y204-L208 VanDerWaalsContact O-CB 3.27Å; Y204-L208 WeakPolarHBondContact O-CB 3.28Å; Y204-L208 PolarHBondContact O-N 3.19Å; I205-L208 PolarHBondContact O-N 2.94Å; L208-L210 PolarHBondContact O-N 3.46Å; L208-L211 HydrophobicContact CD1-CD1 3.71Å; L208-L211 HydrophobicContact CD1-CG 4.45Å; L208-F229 HydrophobicContact CD1-CD1 3.65Å; L208-F229 HydrophobicContact CD1-CE1 4.03Å; L208-F229 HydrophobicContact CG-CD1 4.12Å; L208-C232 HydrophobicContact CD2-CB 4.41Å
209	S	91.3	Very high	87.7	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-68.1	-18.8	178.7	77.6	0	0	0	0	114.4	I205 D206 C207 F229 R230	I205-S209 WeakPolarHBondContact O-CB 3.35Å; I205-S209 PolarHBondContact O-N 3.48Å; D206-S209 PolarHBondContact O-N 2.93Å; D206-S209 PolarHBondContact O-OG 2.88Å; C207-S209 VanDerWaalsContact C-N 3.29Å; C207-S209 PolarHBondContact O-N 3.45Å; S209-F229 WeakPolarHBondContact CA-O 3.44Å; S209-R230 VanDerWaalsContact O-CD 3.23Å; S209-R230 WeakPolarHBondContact O-CD 3.36Å; S209-R230 WeakPolarHBondContact O-CG 3.49Å
210	L	90.7	Very high	87.2	Confident	30 Å²	30	63.3 Å²	63.3	16%	0.157	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	14.7	-175.8	-77	168.8	0	0	0	113.3	L169 M172 D206 C207 L208	L169-L210 HydrophobicContact CD2-CD1 3.86Å; L169-L210 HydrophobicContact CD2-CD2 4.31Å; L169-L210 HydrophobicContact CG-CD1 4.16Å; L169-L210 HydrophobicContact CG-CD2 3.93Å; M172-L210 HydrophobicContact CE-CD1 4.4Å; M172-L210 HydrophobicContact SD-CD1 4.39Å; D206-L210 PolarHBondContact O-N 3.46Å; C207-L210 PolarHBondContact O-N 2.77Å; L208-L210 PolarHBondContact O-N 3.46Å
211	L	88.4	Confident	86.6	Confident	66 Å²	66	64.7 Å²	64.7	35%	0.346	34%	0.341	S	S	.	.			trans	-59.2	127.3	177.7	-74	-178.6	0	0	0	111.2	C207 L208 L213 R230	C207-L211 PolarHBondContact O-N 3.14Å; L208-L211 HydrophobicContact CD1-CD1 3.71Å; L208-L211 HydrophobicContact CD1-CG 4.45Å; L211-L213 HydrophobicContact CB-CD1 4.33Å; L211-L213 HydrophobicContact CB-CG 4.08Å; L211-L213 PolarHBondContact O-N 3.47Å; L211-R230 PolarHBondContact O-NH1 3.46Å
212	P	83.2	Confident	86.1	Confident	78 Å²	78	65.6 Å²	65.6	51%	0.506	34%	0.339	S	S	.	.			trans	-80.9	49.4	-174.1	35.8	-38.7	0	0	0	112.4	D214 F215	P212-D214 PolarHBondContact O-N 2.76Å; P212-F215 HydrophobicContact CB-CD2 3.82Å; P212-F215 HydrophobicContact CB-CE2 3.73Å; P212-F215 HydrophobicContact CG-CD2 4.32Å; P212-F215 HydrophobicContact CG-CE2 4.29Å; P212-F215 VanDerWaalsContact O-CD2 3.25Å; P212-F215 WeakPolarHBondContact O-CD2 3.32Å; P212-F215 PolarHBondContact O-N 2.87Å
213	L	84.2	Confident	85.8	Confident	44 Å²	44	66.7 Å²	66.7	23%	0.23	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-64.2	-17.3	178.8	-64.5	172	0	0	0	112.8	L211 F215 L216 F229	L211-L213 HydrophobicContact CB-CD1 4.33Å; L211-L213 HydrophobicContact CB-CG 4.08Å; L211-L213 PolarHBondContact O-N 3.47Å; L213-F215 PolarHBondContact O-N 3.15Å; L213-F215 VanDerWaalsContact O-N 3.16Å; L213-L216 HydrophobicContact CD2-CD1 4.27Å; L213-L216 VanDerWaalsContact O-CB 3.25Å; L213-L216 WeakPolarHBondContact O-CB 3.5Å; L213-L216 WeakPolarHBondContact O-CG 3.37Å; L213-L216 PolarHBondContact O-N 3.05Å; L213-F229 HydrophobicContact CD1-CD2 3.29Å; L213-F229 HydrophobicContact CD1-CE2 3.37Å; L213-F229 HydrophobicContact CD1-CG 4.26Å; L213-F229 HydrophobicContact CD1-CZ 4.39Å
214	D	81	Confident	85.5	Confident	14 Å²	14	64.4 Å²	64.4	8%	0.075	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-54.8	-26.5	172.8	-62.7	39.7	0	0	0	112.9	Y162 P212 L216 Y217 R227 R230	Y162-D214 WeakPolarHBondContact CE1-OD2 3.48Å; P212-D214 PolarHBondContact O-N 2.76Å; D214-L216 PolarHBondContact O-N 3.09Å; D214-Y217 HydrophobicContact CB-CD2 4.43Å; D214-Y217 HydrophobicContact CB-CE2 4.41Å; D214-Y217 VanDerWaalsContact O-CB 3.25Å; D214-Y217 WeakPolarHBondContact O-CB 3.36Å; D214-Y217 PolarHBondContact O-N 2.83Å; D214-R227 IonicContact OD1-NE 2.78Å; D214-R227 IonicContact OD2-CZ 2.66Å; D214-R227 IonicContact OD2-NE 2.94Å; D214-R227 PolarHBondContact OD2-NE 3.08Å; D214-R227 IonicContact OD2-NH2 2.64Å; D214-R227 PolarHBondContact OD2-NH2 2.84Å; D214-R230 IonicContact OD1-CZ 3.24Å; D214-R230 IonicContact OD1-NH1 3.74Å; D214-R230 PolarHBondContact OD1-NH1 2.75Å; D214-R230 IonicContact OD1-NH2 3.2Å; D214-R230 PolarHBondContact OD1-NH2 2.74Å; D214-R230 IonicContact OD2-NH2 3.43Å
215	F	82	Confident	85.2	Confident	150 Å²	150	60 Å²	60	66%	0.658	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-60.4	-24.9	172.9	-71.5	-56.7	0	0	0	113	P212 L213 Y217 L218	P212-F215 HydrophobicContact CB-CD2 3.82Å; P212-F215 HydrophobicContact CB-CE2 3.73Å; P212-F215 HydrophobicContact CG-CD2 4.32Å; P212-F215 HydrophobicContact CG-CE2 4.29Å; P212-F215 VanDerWaalsContact O-CD2 3.25Å; P212-F215 WeakPolarHBondContact O-CD2 3.32Å; P212-F215 PolarHBondContact O-N 2.87Å; L213-F215 PolarHBondContact O-N 3.15Å; L213-F215 VanDerWaalsContact O-N 3.16Å; F215-Y217 PolarHBondContact O-N 3.04Å; F215-L218 WeakPolarHBondContact O-CB 3.46Å; F215-L218 PolarHBondContact O-N 3.39Å
216	L	84.4	Confident	84.9	Confident	67 Å²	67	59.1 Å²	59.1	35%	0.351	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-70.3	-12.2	174.8	-61.1	172.3	0	0	0	113.1	L213 D214 L218 S219 I220 L226	L213-L216 HydrophobicContact CD2-CD1 4.27Å; L213-L216 VanDerWaalsContact O-CB 3.25Å; L213-L216 WeakPolarHBondContact O-CB 3.5Å; L213-L216 WeakPolarHBondContact O-CG 3.37Å; L213-L216 PolarHBondContact O-N 3.05Å; D214-L216 PolarHBondContact O-N 3.09Å; L216-L218 PolarHBondContact O-N 2.98Å; L216-S219 PolarHBondContact O-N 2.67Å; L216-S219 VanDerWaalsContact O-N 3.16Å; L216-S219 PolarHBondContact O-OG 3.31Å; L216-I220 HydrophobicContact CB-CD1 4.07Å; L216-I220 HydrophobicContact CD1-CD1 4.49Å; L216-I220 WeakPolarHBondContact O-CB 3.42Å; L216-I220 PolarHBondContact O-N 2.66Å; L216-L226 HydrophobicContact CB-CD1 3.93Å; L216-L226 HydrophobicContact CD1-CD1 4.5Å
217	Y	82	Confident	84.9	Confident	30 Å²	30	59.2 Å²	59.2	12%	0.118	32%	0.319	C	S	.	.	H	α-helix	trans	-60.6	-27.3	170.5	-67.3	-16.9	0	0	0	112.3	D214 F215 S219 G221 F222 K223 L226	D214-Y217 HydrophobicContact CB-CD2 4.43Å; D214-Y217 HydrophobicContact CB-CE2 4.41Å; D214-Y217 VanDerWaalsContact O-CB 3.25Å; D214-Y217 WeakPolarHBondContact O-CB 3.36Å; D214-Y217 PolarHBondContact O-N 2.83Å; F215-Y217 PolarHBondContact O-N 3.04Å; Y217-S219 VanDerWaalsContact C-N 3.29Å; Y217-S219 PolarHBondContact O-N 2.74Å; Y217-G221 WeakPolarHBondContact O-CA 3.44Å; Y217-G221 PolarHBondContact O-N 2.64Å; Y217-F222 AromaticContact CD2-CD2 3.99Å; Y217-F222 HydrophobicContact CD2-CD2 3.99Å; Y217-F222 HydrophobicContact CD2-CE2 4.15Å; Y217-F222 AromaticContact CE2-CD2 3.8Å; Y217-F222 HydrophobicContact CE2-CD2 3.8Å; Y217-F222 AromaticContact CE2-CE2 3.53Å; Y217-F222 HydrophobicContact CE2-CE2 3.53Å; Y217-F222 HydrophobicContact CE2-CZ 4.24Å; Y217-F222 HydrophobicContact CG-CD2 4.44Å; Y217-F222 AromaticContact CZ-CE2 3.83Å; Y217-K223 VanDerWaalsContact CE1-O 3.31Å; Y217-K223 WeakPolarHBondContact CE1-O 3.38Å; Y217-K223 PolarHBondContact OH-O 3.12Å; Y217-L226 HydrophobicContact CD1-CD1 3.97Å; Y217-L226 HydrophobicContact CE1-CB 4.24Å; Y217-L226 HydrophobicContact CE1-CD1 3.87Å; Y217-L226 HydrophobicContact CE1-CG 4.47Å
218	L	79.3	Confident	84.8	Confident	159 Å²	159	60.1 Å²	60.1	83%	0.832	32%	0.32	S	S	*	.	H	α-helix	trans	-69.2	-23.3	177.3	-63.4	172.8	0	0	0	113.4	F215 L216	F215-L218 WeakPolarHBondContact O-CB 3.46Å; F215-L218 PolarHBondContact O-N 3.39Å; L216-L218 PolarHBondContact O-N 2.98Å
219	S	81.9	Confident	84.8	Confident	93 Å²	93	60.7 Å²	60.7	65%	0.65	32%	0.32	S	S	*	.	H	α-helix	trans	-115.5	-30.5	-175.9	56.9	0	0	0	0	114.4	L216 Y217	L216-S219 PolarHBondContact O-N 2.67Å; L216-S219 VanDerWaalsContact O-N 3.16Å; L216-S219 PolarHBondContact O-OG 3.31Å; Y217-S219 VanDerWaalsContact C-N 3.29Å; Y217-S219 PolarHBondContact O-N 2.74Å
220	I	79.7	Confident	84.9	Confident	85 Å²	85	60.9 Å²	60.9	44%	0.436	32%	0.32	S	S	.	.	H	α-helix	trans	-103.2	-10.6	-175.7	-53.9	179.9	0	0	0	111.7	L216 K223	L216-I220 HydrophobicContact CB-CD1 4.07Å; L216-I220 HydrophobicContact CD1-CD1 4.49Å; L216-I220 WeakPolarHBondContact O-CB 3.42Å; L216-I220 PolarHBondContact O-N 2.66Å; I220-K223 HydrophobicContact CG2-CD 3.86Å
221	G	78.4	Confident	85	Confident	36 Å²	36	60.7 Å²	60.7	37%	0.371	32%	0.32	S	S	.	.			trans	79.1	174.8	-167	0	0	0	0	0	112.2	Y217 K223	Y217-G221 WeakPolarHBondContact O-CA 3.44Å; Y217-G221 PolarHBondContact O-N 2.64Å; G221-K223 PolarHBondContact O-N 2.97Å
222	F	78.6	Confident	85.3	Confident	68 Å²	68	59.8 Å²	59.8	30%	0.298	32%	0.318	S	S	.	.			trans	-68.5	119.7	-178.2	-169.4	-79.3	0	0	0	111	I149 L158 Y217 S224	I149-F222 HydrophobicContact CD1-CD1 3.57Å; I149-F222 HydrophobicContact CD1-CE1 3.1Å; I149-F222 HydrophobicContact CD1-CZ 3.78Å; I149-F222 HydrophobicContact CG2-CD1 4.38Å; L158-F222 HydrophobicContact CD2-CE2 4Å; Y217-F222 AromaticContact CD2-CD2 3.99Å; Y217-F222 HydrophobicContact CD2-CD2 3.99Å; Y217-F222 HydrophobicContact CD2-CE2 4.15Å; Y217-F222 AromaticContact CE2-CD2 3.8Å; Y217-F222 HydrophobicContact CE2-CD2 3.8Å; Y217-F222 AromaticContact CE2-CE2 3.53Å; Y217-F222 HydrophobicContact CE2-CE2 3.53Å; Y217-F222 HydrophobicContact CE2-CZ 4.24Å; Y217-F222 HydrophobicContact CG-CD2 4.44Å; Y217-F222 AromaticContact CZ-CE2 3.83Å; F222-S224 WeakPolarHBondContact CE1-OG 3.4Å
223	K	83.1	Confident	85.7	Confident	107 Å²	107	56.1 Å²	56.1	47%	0.465	29%	0.294	S	S	.	.			trans	-136.5	108.4	174.1	-67.7	-169.5	-179.8	178.8	0	111.1	Y217 I220 G221 I225 L226	Y217-K223 VanDerWaalsContact CE1-O 3.31Å; Y217-K223 WeakPolarHBondContact CE1-O 3.38Å; Y217-K223 PolarHBondContact OH-O 3.12Å; I220-K223 HydrophobicContact CG2-CD 3.86Å; G221-K223 PolarHBondContact O-N 2.97Å; K223-I225 HydrophobicContact CB-CG2 4.28Å; K223-I225 PolarHBondContact O-N 2.95Å; K223-L226 PolarHBondContact O-N 2.97Å
224	S	85.5	Confident	86.1	Confident	4 Å²	4	55.9 Å²	55.9	3%	0.028	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-50	-35.9	-178.4	-51.1	0	0	0	0	113.7	R143 F222 L226 R227	R143-S224 VanDerWaalsContact C-OG 3.31Å; R143-S224 WeakPolarHBondContact CB-OG 3.47Å; R143-S224 PolarHBondContact O-OG 2.78Å; F222-S224 WeakPolarHBondContact CE1-OG 3.4Å; S224-L226 PolarHBondContact O-N 2.94Å; S224-L226 VanDerWaalsContact O-N 3.16Å; S224-R227 PolarHBondContact O-N 3.2Å
225	I	86.2	Confident	86.6	Confident	60 Å²	60	57.4 Å²	57.4	31%	0.308	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-59.3	-26.8	-176.6	-165.6	61.4	0	0	0	114.5	F144 K223 R227 I228	F144-I225 HydrophobicContact CD1-CD1 4.5Å; F144-I225 HydrophobicContact CD2-CB 3.86Å; F144-I225 HydrophobicContact CD2-CG2 4.46Å; F144-I225 HydrophobicContact CE2-CB 3.88Å; F144-I225 HydrophobicContact CE2-CG1 4.44Å; F144-I225 HydrophobicContact CE2-CG2 4.18Å; F144-I225 HydrophobicContact CG-CB 4.43Å; F144-I225 HydrophobicContact CZ-CB 4.47Å; K223-I225 HydrophobicContact CB-CG2 4.28Å; K223-I225 PolarHBondContact O-N 2.95Å; I225-R227 PolarHBondContact O-N 2.97Å; I225-R227 VanDerWaalsContact O-N 3.08Å; I225-I228 HydrophobicContact CD1-CB 4.38Å; I225-I228 HydrophobicContact CD1-CD1 3.93Å; I225-I228 WeakPolarHBondContact O-CB 3.49Å; I225-I228 VanDerWaalsContact O-CG2 3.29Å; I225-I228 WeakPolarHBondContact O-CG2 3.27Å; I225-I228 PolarHBondContact O-N 3.03Å
226	L	86.5	Confident	87	Confident	36 Å²	36	50.9 Å²	50.9	19%	0.188	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-63	-18.2	-179.7	-67.2	-179.8	0	0	0	113.4	L216 Y217 K223 S224	L216-L226 HydrophobicContact CB-CD1 3.93Å; L216-L226 HydrophobicContact CD1-CD1 4.5Å; Y217-L226 HydrophobicContact CD1-CD1 3.97Å; Y217-L226 HydrophobicContact CE1-CB 4.24Å; Y217-L226 HydrophobicContact CE1-CD1 3.87Å; Y217-L226 HydrophobicContact CE1-CG 4.47Å; K223-L226 PolarHBondContact O-N 2.97Å; S224-L226 PolarHBondContact O-N 2.94Å; S224-L226 VanDerWaalsContact O-N 3.16Å
227	R	91.4	Very high	87.4	Confident	2 Å²	2	48 Å²	48	1%	0.008	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-89.7	0.6	177.7	-70.3	177.1	169.9	165.5	-18.7	114.4	I140 D161 D214 S224 I225 F229 R230	I140-R227 HydrophobicContact CD1-CB 4.18Å; I140-R227 WeakPolarHBondContact CD1-O 3.29Å; D161-R227 VanDerWaalsContact CB-NH1 3.34Å; D161-R227 IonicContact OD1-NH1 2.75Å; D161-R227 IonicContact OD2-CZ 3.15Å; D161-R227 IonicContact OD2-NH1 2.71Å; D161-R227 PolarHBondContact OD2-NH1 2.88Å; D214-R227 IonicContact OD1-NE 2.78Å; D214-R227 IonicContact OD2-CZ 2.66Å; D214-R227 IonicContact OD2-NE 2.94Å; D214-R227 PolarHBondContact OD2-NE 3.08Å; D214-R227 IonicContact OD2-NH2 2.64Å; D214-R227 PolarHBondContact OD2-NH2 2.84Å; S224-R227 PolarHBondContact O-N 3.2Å; I225-R227 PolarHBondContact O-N 2.97Å; I225-R227 VanDerWaalsContact O-N 3.08Å; R227-F229 PolarHBondContact O-N 3.31Å; R227-R230 WeakPolarHBondContact O-CB 3.21Å; R227-R230 WeakPolarHBondContact O-CD 3.29Å; R227-R230 PolarHBondContact O-N 3.03Å
228	I	91	Very high	87.9	Confident	68 Å²	68	50.8 Å²	50.8	35%	0.349	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-55.9	-26.8	-177.8	-162.9	166.9	0	0	0	113.8	I225 R230 L231	I225-I228 HydrophobicContact CD1-CB 4.38Å; I225-I228 HydrophobicContact CD1-CD1 3.93Å; I225-I228 WeakPolarHBondContact O-CB 3.49Å; I225-I228 VanDerWaalsContact O-CG2 3.29Å; I225-I228 WeakPolarHBondContact O-CG2 3.27Å; I225-I228 PolarHBondContact O-N 3.03Å; I228-R230 PolarHBondContact O-N 2.95Å; I228-R230 VanDerWaalsContact O-N 3.17Å; I228-L231 HydrophobicContact CG1-CD1 3.95Å; I228-L231 VanDerWaalsContact O-CB 3.31Å; I228-L231 WeakPolarHBondContact O-CB 3.48Å; I228-L231 WeakPolarHBondContact O-CG 2.89Å; I228-L231 PolarHBondContact O-N 3.4Å
229	F	92.2	Very high	88.4	Confident	77 Å²	77	48.1 Å²	48.1	34%	0.338	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-59.3	-23.2	174.6	-67.3	-82.6	0	0	0	114.3	L208 S209 L213 R227 L231 C232	L208-F229 HydrophobicContact CD1-CD1 3.65Å; L208-F229 HydrophobicContact CD1-CE1 4.03Å; L208-F229 HydrophobicContact CG-CD1 4.12Å; S209-F229 WeakPolarHBondContact CA-O 3.44Å; L213-F229 HydrophobicContact CD1-CD2 3.29Å; L213-F229 HydrophobicContact CD1-CE2 3.37Å; L213-F229 HydrophobicContact CD1-CG 4.26Å; L213-F229 HydrophobicContact CD1-CZ 4.39Å; R227-F229 PolarHBondContact O-N 3.31Å; F229-L231 PolarHBondContact O-N 3.26Å; F229-L231 VanDerWaalsContact O-N 3.13Å; F229-C232 WeakPolarHBondContact O-CB 3.41Å; F229-C232 PolarHBondContact O-N 3.45Å; F229-C232 VanDerWaalsContact O-N 3.09Å; F229-C232 PolarHBondContact O-SG 3.33Å; F229-C232 VanDerWaalsContact O-SG 3.35Å
230	R	93.9	Very high	88.9	Confident	4 Å²	4	46 Å²	46	2%	0.015	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-62.1	-19.7	174.1	-81.8	63	170	-163.8	-14.6	112.6	I140 D165 Y168 S209 L211 D214 R227 I228 C232	I140-R230 HydrophobicContact CD1-CB 4.5Å; D165-R230 IonicContact OD1-CZ 3.64Å; D165-R230 IonicContact OD1-NE 2.65Å; D165-R230 PolarHBondContact OD1-NE 3.08Å; D165-R230 IonicContact OD1-NH2 3.48Å; D165-R230 IonicContact OD2-CZ 3.31Å; D165-R230 IonicContact OD2-NE 2.7Å; D165-R230 PolarHBondContact OD2-NE 3.24Å; D165-R230 IonicContact OD2-NH2 3.46Å; D165-R230 PolarHBondContact OD2-NH2 3.47Å; Y168-R230 HydrophobicContact CE2-CB 4.15Å; Y168-R230 HydrophobicContact CE2-CG 4.22Å; Y168-R230 PolarHBondContact OH-O 3.24Å; S209-R230 VanDerWaalsContact O-CD 3.23Å; S209-R230 WeakPolarHBondContact O-CD 3.36Å; S209-R230 WeakPolarHBondContact O-CG 3.49Å; L211-R230 PolarHBondContact O-NH1 3.46Å; D214-R230 IonicContact OD1-CZ 3.24Å; D214-R230 IonicContact OD1-NH1 3.74Å; D214-R230 PolarHBondContact OD1-NH1 2.75Å; D214-R230 IonicContact OD1-NH2 3.2Å; D214-R230 PolarHBondContact OD1-NH2 2.74Å; D214-R230 IonicContact OD2-NH2 3.43Å; R227-R230 WeakPolarHBondContact O-CB 3.21Å; R227-R230 WeakPolarHBondContact O-CD 3.29Å; R227-R230 PolarHBondContact O-N 3.03Å; I228-R230 PolarHBondContact O-N 2.95Å; I228-R230 VanDerWaalsContact O-N 3.17Å; R230-C232 VanDerWaalsContact C-N 3.3Å; R230-C232 PolarHBondContact O-N 2.71Å
231	L	92.9	Very high	89.4	Confident	27 Å²	27	43.7 Å²	43.7	14%	0.141	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-73.8	-15.9	176.4	-55.9	-176.7	0	0	0	113.5	F133 H136 L137 I140 I228 F229 K233 V234 W269	F133-L231 HydrophobicContact CE2-CD2 4.46Å; H136-L231 HydrophobicContact CB-CD2 4.04Å; L137-L231 HydrophobicContact CB-CD2 4.28Å; L137-L231 HydrophobicContact CD1-CD2 4.21Å; I140-L231 HydrophobicContact CD1-CD2 4.37Å; I228-L231 HydrophobicContact CG1-CD1 3.95Å; I228-L231 VanDerWaalsContact O-CB 3.31Å; I228-L231 WeakPolarHBondContact O-CB 3.48Å; I228-L231 WeakPolarHBondContact O-CG 2.89Å; I228-L231 PolarHBondContact O-N 3.4Å; F229-L231 PolarHBondContact O-N 3.26Å; F229-L231 VanDerWaalsContact O-N 3.13Å; L231-K233 PolarHBondContact O-N 3.03Å; L231-V234 PolarHBondContact O-N 3.33Å; L231-W269 HydrophobicContact CD1-CH2 3.88Å; L231-W269 HydrophobicContact CD1-CZ2 3.87Å
232	C	92.8	Very high	89.9	Confident	47 Å²	47	43.9 Å²	43.9	32%	0.318	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-58.9	-20	175.7	-64.6	0	0	0	0	113	I205 L208 F229 R230 V234	I205-C232 HydrophobicContact CG2-CB 4.21Å; I205-C232 WeakPolarHBondContact CG2-O 3.44Å; L208-C232 HydrophobicContact CD2-CB 4.41Å; F229-C232 WeakPolarHBondContact O-CB 3.41Å; F229-C232 PolarHBondContact O-N 3.45Å; F229-C232 VanDerWaalsContact O-N 3.09Å; F229-C232 PolarHBondContact O-SG 3.33Å; F229-C232 VanDerWaalsContact O-SG 3.35Å; R230-C232 VanDerWaalsContact C-N 3.3Å; R230-C232 PolarHBondContact O-N 2.71Å; C232-V234 PolarHBondContact O-N 2.74Å
233	K	92.4	Very high	90.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-78.7	9.7	-179	-158.3	150.4	179.9	139.9	0	115.2	Y168 D171 D206 L231 Y235 K236	Y168-K233 HydrophobicContact CD1-CD 4.06Å; Y168-K233 HydrophobicContact CD2-CD 3.73Å; Y168-K233 HydrophobicContact CE1-CD 4.02Å; Y168-K233 HydrophobicContact CE2-CB 3.95Å; Y168-K233 HydrophobicContact CE2-CD 3.7Å; Y168-K233 HydrophobicContact CE2-CG 4.36Å; Y168-K233 HydrophobicContact CG-CD 3.91Å; D171-K233 WeakPolarHBondContact OD2-CE 3.46Å; D171-K233 IonicContact OD2-NZ 3.91Å; D171-K233 PolarHBondContact OD2-NZ 3.09Å; D206-K233 VanDerWaalsContact OD1-CE 3.3Å; D206-K233 WeakPolarHBondContact OD1-CE 3.47Å; D206-K233 IonicContact OD1-NZ 2.98Å; D206-K233 PolarHBondContact OD1-NZ 3.07Å; L231-K233 PolarHBondContact O-N 3.03Å; K233-Y235 HydrophobicContact CG-CE1 4.13Å; K233-Y235 PolarHBondContact O-N 3.32Å; K233-K236 HydrophobicContact CG-CB 4.43Å; K233-K236 HydrophobicContact CG-CG 4.03Å; K233-K236 PolarHBondContact O-N 2.72Å; K233-K236 VanDerWaalsContact O-N 3.09Å
234	V	93.5	Very high	90.5	Very high	40 Å²	40	38.2 Å²	38.2	24%	0.242	19%	0.186	C	C	.	.	H	α-helix	trans	-49.1	-29.6	177.6	65.3	0	0	0	0	114.3	F133 L231 C232 K236 F237 W238	F133-V234 HydrophobicContact CE1-CG2 4.17Å; F133-V234 HydrophobicContact CE2-CB 3.71Å; F133-V234 HydrophobicContact CE2-CG2 4.19Å; F133-V234 HydrophobicContact CZ-CB 3.67Å; F133-V234 HydrophobicContact CZ-CG2 3.6Å; L231-V234 PolarHBondContact O-N 3.33Å; C232-V234 PolarHBondContact O-N 2.74Å; V234-K236 VanDerWaalsContact C-N 3.27Å; V234-K236 PolarHBondContact O-N 3.13Å; V234-F237 WeakPolarHBondContact O-CB 3.34Å; V234-F237 PolarHBondContact O-N 3.05Å; V234-W238 HydrophobicContact CG1-CH2 4.26Å; V234-W238 HydrophobicContact CG1-CZ3 4.31Å; V234-W238 HydrophobicContact CG2-CD2 4.11Å; V234-W238 HydrophobicContact CG2-CH2 4.24Å; V234-W238 HydrophobicContact CG2-CZ2 3.75Å; V234-W238 PolarHBondContact O-N 3.16Å; V234-W238 VanDerWaalsContact O-N 3.13Å
235	Y	91	Very high	90.7	Very high	45 Å²	45	40 Å²	40	18%	0.176	19%	0.193	C	C	.	.	H	α-helix	trans	-59.2	-33.1	179.6	81.4	-88.7	0	0	0	113.6	I205 D206 K233 Q239	I205-Y235 HydrophobicContact CB-CE1 4.34Å; I205-Y235 HydrophobicContact CG2-CD1 3.78Å; I205-Y235 HydrophobicContact CG2-CE1 3.69Å; D206-Y235 PolarHBondContact OD1-OH 2.8Å; D206-Y235 PolarHBondContact OD2-OH 3.5Å; K233-Y235 HydrophobicContact CG-CE1 4.13Å; K233-Y235 PolarHBondContact O-N 3.32Å; Y235-Q239 WeakPolarHBondContact O-CB 3.46Å; Y235-Q239 PolarHBondContact O-N 3.07Å
236	K	90.5	Very high	90.5	Very high	14 Å²	14	45.9 Å²	45.9	6%	0.061	21%	0.212	C	C	.	.	H	α-helix	trans	-68.1	-37.1	175.3	-71.9	-84	-179.1	149.6	0	111.6	I129 D171 S175 K233 V234 Q239 F240	I129-K236 HydrophobicContact CG2-CB 4.09Å; I129-K236 HydrophobicContact CG2-CG 4.31Å; D171-K236 IonicContact OD1-NZ 3.64Å; D171-K236 PolarHBondContact OD1-NZ 2.92Å; D171-K236 WeakPolarHBondContact OD2-CE 3.42Å; D171-K236 IonicContact OD2-NZ 2.89Å; D171-K236 PolarHBondContact OD2-NZ 3.22Å; S175-K236 PolarHBondContact OG-NZ 3.15Å; K233-K236 HydrophobicContact CG-CB 4.43Å; K233-K236 HydrophobicContact CG-CG 4.03Å; K233-K236 PolarHBondContact O-N 2.72Å; K233-K236 VanDerWaalsContact O-N 3.09Å; V234-K236 VanDerWaalsContact C-N 3.27Å; V234-K236 PolarHBondContact O-N 3.13Å; K236-Q239 PolarHBondContact O-N 3.36Å; K236-F240 PolarHBondContact O-N 2.94Å
237	F	93	Very high	90.3	Very high	5 Å²	5	50.8 Å²	50.8	2%	0.022	23%	0.233	C	C	.	.	H	α-helix	trans	-66.4	-44.9	177.3	169.9	-85.2	0	0	0	111.5	F133 M134 V234 F240 M241 L261 Y262	F133-F237 HydrophobicContact CD1-CB 3.54Å; F133-F237 HydrophobicContact CD1-CD1 4.49Å; F133-F237 AromaticContact CD1-CD2 3.77Å; F133-F237 HydrophobicContact CD1-CD2 3.77Å; F133-F237 AromaticContact CD1-CG 3.68Å; F133-F237 HydrophobicContact CD1-CG 3.68Å; F133-F237 HydrophobicContact CE1-CB 3.93Å; F133-F237 HydrophobicContact CE1-CD1 4.23Å; F133-F237 HydrophobicContact CE1-CD2 4.22Å; F133-F237 AromaticContact CE1-CG 3.86Å; F133-F237 HydrophobicContact CE1-CG 3.86Å; F133-F237 HydrophobicContact CG-CB 4.16Å; M134-F237 HydrophobicContact CE-CD2 4.11Å; M134-F237 HydrophobicContact CE-CE2 3.45Å; M134-F237 VanDerWaalsContact CE-CE2 3.45Å; M134-F237 HydrophobicContact CE-CZ 3.96Å; V234-F237 WeakPolarHBondContact O-CB 3.34Å; V234-F237 PolarHBondContact O-N 3.05Å; F237-F240 PolarHBondContact O-N 3.03Å; F237-M241 HydrophobicContact CD1-CG 4.35Å; F237-M241 HydrophobicContact CD2-CE 4.41Å; F237-M241 HydrophobicContact CE1-CG 3.84Å; F237-M241 HydrophobicContact CE2-CE 3.47Å; F237-M241 VanDerWaalsContact CE2-CE 3.47Å; F237-M241 HydrophobicContact CE2-CG 4.15Å; F237-M241 HydrophobicContact CZ-CE 3.57Å; F237-M241 HydrophobicContact CZ-CG 3.74Å; F237-M241 HydrophobicContact CZ-SD 4.42Å; F237-M241 WeakPolarHBondContact O-CG 3.37Å; F237-M241 PolarHBondContact O-N 2.91Å; F237-L261 HydrophobicContact CE2-CD2 4.07Å; F237-L261 HydrophobicContact CZ-CD2 3.84Å; F237-Y262 AromaticContact CE1-CE1 3.83Å; F237-Y262 HydrophobicContact CE1-CE1 3.83Å; F237-Y262 HydrophobicContact CZ-CE1 4.32Å
238	W	91.7	Very high	90	Very high	89 Å²	89	52.1 Å²	52.1	34%	0.337	24%	0.242	S	C	.	.	H	α-helix	trans	-62.4	-45.7	173.7	-65.9	-27.7	0	0	0	111.8	V234 F240 M241 D242 Y262 I968	V234-W238 HydrophobicContact CG1-CH2 4.26Å; V234-W238 HydrophobicContact CG1-CZ3 4.31Å; V234-W238 HydrophobicContact CG2-CD2 4.11Å; V234-W238 HydrophobicContact CG2-CH2 4.24Å; V234-W238 HydrophobicContact CG2-CZ2 3.75Å; V234-W238 PolarHBondContact O-N 3.16Å; V234-W238 VanDerWaalsContact O-N 3.13Å; W238-F240 VanDerWaalsContact C-N 3.26Å; W238-F240 PolarHBondContact O-N 3.45Å; W238-M241 PolarHBondContact O-N 2.97Å; W238-M241 VanDerWaalsContact O-N 3.14Å; W238-D242 WeakPolarHBondContact O-CB 3.33Å; W238-D242 VanDerWaalsContact O-CG 3.25Å; W238-D242 PolarHBondContact O-N 3.4Å; W238-Y262 PolarHBondContact NE1-OH 3.05Å; W238-Y262 VanDerWaalsContact NE1-OH 3.16Å; W238-I968 HydrophobicContact CH2-CG2 4.28Å
239	Q	89.8	Confident	89.8	Confident	104 Å²	104	54.5 Å²	54.5	49%	0.486	26%	0.255	S	S	.	.	H	α-helix	trans	-56.3	-38.8	175.8	-172.2	-174.8	41.3	0	0	112.9	Y235 K236 R243	Y235-Q239 WeakPolarHBondContact O-CB 3.46Å; Y235-Q239 PolarHBondContact O-N 3.07Å; K236-Q239 PolarHBondContact O-N 3.36Å; Q239-R243 VanDerWaalsContact O-CB 3.26Å; Q239-R243 WeakPolarHBondContact O-CB 3.32Å; Q239-R243 PolarHBondContact O-N 2.89Å
240	F	92.2	Very high	89.4	Confident	48 Å²	48	57.5 Å²	57.5	21%	0.211	27%	0.266	C	S	.	.	H	α-helix	trans	-67.9	-50.4	174.4	172.3	-104.9	0	0	0	111.9	H123 C126 G127 S130 K236 F237 W238 D242 R243 A244	H123-F240 AromaticContact CE1-CD2 3.72Å; H123-F240 AromaticContact CE1-CE2 3.7Å; H123-F240 AromaticContact ND1-CD2 3.86Å; C126-F240 HydrophobicContact CB-CB 4.23Å; C126-F240 HydrophobicContact CB-CD2 4.42Å; G127-F240 VanDerWaalsContact CA-CD2 3.43Å; G127-F240 VanDerWaalsContact CA-CE2 3.4Å; S130-F240 WeakPolarHBondContact OG-CB 3.09Å; S130-F240 WeakPolarHBondContact OG-CG 3.41Å; K236-F240 PolarHBondContact O-N 2.94Å; F237-F240 PolarHBondContact O-N 3.03Å; W238-F240 VanDerWaalsContact C-N 3.26Å; W238-F240 PolarHBondContact O-N 3.45Å; F240-D242 PolarHBondContact O-N 3.44Å; F240-R243 PolarHBondContact O-N 3.27Å; F240-A244 WeakPolarHBondContact O-CB 3.36Å; F240-A244 PolarHBondContact O-N 3.37Å
241	M	90.5	Very high	89	Confident	36 Å²	36	59.8 Å²	59.8	18%	0.177	28%	0.281	C	S	.	.	H	α-helix	trans	-61.8	-43.7	-177.6	-73.9	-64.6	174.3	0	0	112.6	F237 W238 R243 A244 E245 K258 L261	F237-M241 HydrophobicContact CD1-CG 4.35Å; F237-M241 HydrophobicContact CD2-CE 4.41Å; F237-M241 HydrophobicContact CE1-CG 3.84Å; F237-M241 HydrophobicContact CE2-CE 3.47Å; F237-M241 VanDerWaalsContact CE2-CE 3.47Å; F237-M241 HydrophobicContact CE2-CG 4.15Å; F237-M241 HydrophobicContact CZ-CE 3.57Å; F237-M241 HydrophobicContact CZ-CG 3.74Å; F237-M241 HydrophobicContact CZ-SD 4.42Å; F237-M241 WeakPolarHBondContact O-CG 3.37Å; F237-M241 PolarHBondContact O-N 2.91Å; W238-M241 PolarHBondContact O-N 2.97Å; W238-M241 VanDerWaalsContact O-N 3.14Å; M241-R243 VanDerWaalsContact C-N 3.25Å; M241-R243 PolarHBondContact O-N 3.29Å; M241-A244 PolarHBondContact O-N 2.88Å; M241-A244 VanDerWaalsContact O-N 3.16Å; M241-E245 PolarHBondContact O-N 3.3Å; M241-K258 HydrophobicContact CB-CD 4.44Å; M241-L261 HydrophobicContact CE-CD2 3.97Å
242	D	88.2	Confident	88.7	Confident	41 Å²	41	60.6 Å²	60.6	22%	0.219	29%	0.285	C	S	.	.	H	α-helix	trans	-75	-18.5	-179	-56.9	-22.9	0	0	0	112.2	W238 F240 R246 K258	W238-D242 WeakPolarHBondContact O-CB 3.33Å; W238-D242 VanDerWaalsContact O-CG 3.25Å; W238-D242 PolarHBondContact O-N 3.4Å; F240-D242 PolarHBondContact O-N 3.44Å; D242-R246 WeakPolarHBondContact O-CG 3.4Å; D242-R246 PolarHBondContact O-NE 3.01Å; D242-K258 IonicContact OD1-NZ 2.74Å; D242-K258 PolarHBondContact OD1-NZ 3.19Å
243	R	87	Confident	88.4	Confident	40 Å²	40	63.3 Å²	63.3	15%	0.151	30%	0.296	C	S	.	.	H	α-helix	trans	-80.3	-39.3	167.1	-175.1	164.6	176.8	163	3.6	111.3	P117 S118 Q239 F240 M241 R246 H247	P117-R243 PolarHBondContact O-NH1 3.33Å; S118-R243 PolarHBondContact O-NH2 2.84Å; Q239-R243 VanDerWaalsContact O-CB 3.26Å; Q239-R243 WeakPolarHBondContact O-CB 3.32Å; Q239-R243 PolarHBondContact O-N 2.89Å; F240-R243 PolarHBondContact O-N 3.27Å; M241-R243 VanDerWaalsContact C-N 3.25Å; M241-R243 PolarHBondContact O-N 3.29Å; R243-R246 PolarHBondContact O-N 3.26Å; R243-H247 WeakPolarHBondContact CD-NE2 3.45Å; R243-H247 WeakPolarHBondContact CG-NE2 3.33Å; R243-H247 PolarHBondContact NE-NE2 2.77Å; R243-H247 PolarHBondContact O-CD2 3.09Å; R243-H247 PolarHBondContact O-N 3.26Å; R243-H247 VanDerWaalsContact O-N 3.16Å
244	A	88.3	Confident	88.2	Confident	15 Å²	15	66.6 Å²	66.6	12%	0.124	31%	0.312	C	S	.	.	H	α-helix	trans	-64.9	-38.4	175.2	0	0	0	0	0	112.5	F240 M241 R246 H247 T248	F240-A244 WeakPolarHBondContact O-CB 3.36Å; F240-A244 PolarHBondContact O-N 3.37Å; M241-A244 PolarHBondContact O-N 2.88Å; M241-A244 VanDerWaalsContact O-N 3.16Å; A244-R246 VanDerWaalsContact C-N 3.27Å; A244-R246 PolarHBondContact O-N 3.13Å; A244-H247 PolarHBondContact O-N 3.36Å; A244-T248 PolarHBondContact O-N 3.34Å; A244-T248 VanDerWaalsContact O-N 3.13Å
245	E	88.7	Confident	87.9	Confident	41 Å²	41	68.9 Å²	68.9	19%	0.192	32%	0.317	C	S	.	.	H	α-helix	trans	-62.3	-32.5	174.6	-173.9	170.4	174.7	0	0	112.4	M241 T248 P251 M254 R255	M241-E245 PolarHBondContact O-N 3.3Å; E245-T248 WeakPolarHBondContact O-CG2 3.39Å; E245-P251 HydrophobicContact CG-CB 4.34Å; E245-M254 HydrophobicContact CB-CB 4.45Å; E245-R255 IonicContact OE1-CZ 3.5Å; E245-R255 VanDerWaalsContact OE1-CZ 3.32Å; E245-R255 IonicContact OE1-NE 3.69Å; E245-R255 PolarHBondContact OE1-NE 2.86Å; E245-R255 VanDerWaalsContact OE1-NE 3.12Å; E245-R255 IonicContact OE1-NH2 3.48Å; E245-R255 PolarHBondContact OE1-NH2 3.34Å
246	R	82.3	Confident	87.7	Confident	185 Å²	185	68.8 Å²	68.8	70%	0.698	32%	0.322	S	S	*	.	H	α-helix	trans	-80.9	-28.9	178.2	-72.4	-176.5	-69.2	158.4	-5.4	114.6	D242 R243 A244	D242-R246 WeakPolarHBondContact O-CG 3.4Å; D242-R246 PolarHBondContact O-NE 3.01Å; R243-R246 PolarHBondContact O-N 3.26Å; A244-R246 VanDerWaalsContact C-N 3.27Å; A244-R246 PolarHBondContact O-N 3.13Å
247	H	82.6	Confident	87.7	Confident	138 Å²	138	71.3 Å²	71.3	64%	0.639	34%	0.339	S	S	*	.	H	α-helix	trans	-90	-11.6	179.1	-70.8	-59.9	0	0	0	113.7	R243 A244	R243-H247 WeakPolarHBondContact CD-NE2 3.45Å; R243-H247 WeakPolarHBondContact CG-NE2 3.33Å; R243-H247 PolarHBondContact NE-NE2 2.77Å; R243-H247 PolarHBondContact O-CD2 3.09Å; R243-H247 PolarHBondContact O-N 3.26Å; R243-H247 VanDerWaalsContact O-N 3.16Å; A244-H247 PolarHBondContact O-N 3.36Å
248	T	85.7	Confident	87.5	Confident	30 Å²	30	72 Å²	72	18%	0.184	34%	0.342	C	S	.	.			trans	-79.9	143.4	177.1	-173.2	0	0	0	0	112.5	A244 E245 Y250 P251 M254	A244-T248 PolarHBondContact O-N 3.34Å; A244-T248 VanDerWaalsContact O-N 3.13Å; E245-T248 WeakPolarHBondContact O-CG2 3.39Å; T248-Y250 PolarHBondContact O-N 2.93Å; T248-Y250 PolarHBondContact OG1-N 2.78Å; T248-P251 HydrophobicContact CG2-CB 4.49Å; T248-M254 HydrophobicContact CG2-CB 4.07Å; T248-M254 HydrophobicContact CG2-CG 3.42Å; T248-M254 VanDerWaalsContact CG2-CG 3.42Å
249	N	86.2	Confident	87.5	Confident	118 Å²	118	69.1 Å²	69.1	63%	0.631	33%	0.333	S	S	*	.	S	Bend	trans	-73	-8	166	-69.7	-36.9	0	0	0	112.8	P251	N249-P251 WeakPolarHBondContact O-CD 3.29Å
250	Y	84.9	Confident	87.5	Confident	141 Å²	141	69 Å²	69	55%	0.553	34%	0.335	S	S	*	.			trans	-126.8	66.7	-174.1	-53.2	-77.6	0	0	0	111.8	T248 N252 L253 M254	T248-Y250 PolarHBondContact O-N 2.93Å; T248-Y250 PolarHBondContact OG1-N 2.78Å; Y250-N252 VanDerWaalsContact C-N 3.3Å; Y250-N252 PolarHBondContact O-N 3.39Å; Y250-L253 WeakPolarHBondContact O-CB 3.44Å; Y250-L253 PolarHBondContact O-N 3.36Å; Y250-M254 PolarHBondContact O-N 3.46Å
251	P	85.9	Confident	87.5	Confident	52 Å²	52	68.3 Å²	68.3	34%	0.338	33%	0.334	S	S	.	.	H	α-helix	trans	-60.4	-36.2	-174.7	22.8	-34	0	0	0	113.2	E245 T248 N249 L253 M254 R255	E245-P251 HydrophobicContact CG-CB 4.34Å; T248-P251 HydrophobicContact CG2-CB 4.49Å; N249-P251 WeakPolarHBondContact O-CD 3.29Å; P251-L253 VanDerWaalsContact C-N 3.27Å; P251-L253 PolarHBondContact O-N 2.87Å; P251-M254 PolarHBondContact O-N 2.95Å; P251-R255 WeakPolarHBondContact O-CB 3.44Å; P251-R255 PolarHBondContact O-N 3.07Å
252	N	86.1	Confident	87.6	Confident	44 Å²	44	70.4 Å²	70.4	24%	0.235	34%	0.34	C	S	.	.	H	α-helix	trans	-62.6	-32.4	175.4	-69.2	-26.7	0	0	0	112.7	Y250 S256	Y250-N252 VanDerWaalsContact C-N 3.3Å; Y250-N252 PolarHBondContact O-N 3.39Å; N252-S256 WeakPolarHBondContact O-CB 3.46Å; N252-S256 PolarHBondContact O-N 3.26Å; N252-S256 VanDerWaalsContact O-N 3.1Å; N252-S256 PolarHBondContact O-OG 3.03Å
253	L	86.8	Confident	87.7	Confident	103 Å²	103	70.1 Å²	70.1	54%	0.539	34%	0.336	S	S	.	.	H	α-helix	trans	-69.9	-50	176.1	179.9	62.1	0	0	0	110.2	Y250 P251 R255 S256 T257	Y250-L253 WeakPolarHBondContact O-CB 3.44Å; Y250-L253 PolarHBondContact O-N 3.36Å; P251-L253 VanDerWaalsContact C-N 3.27Å; P251-L253 PolarHBondContact O-N 2.87Å; L253-R255 VanDerWaalsContact C-N 3.31Å; L253-R255 PolarHBondContact O-N 3.26Å; L253-S256 WeakPolarHBondContact O-CA 3.41Å; L253-S256 WeakPolarHBondContact O-CB 3.48Å; L253-S256 PolarHBondContact O-N 3.39Å; L253-T257 PolarHBondContact O-N 3.46Å; L253-T257 PolarHBondContact O-OG1 2.89Å
254	M	87.1	Confident	88	Confident	70 Å²	70	71.5 Å²	71.5	35%	0.345	35%	0.346	S	S	.	.	H	α-helix	trans	-60	-40.4	177.9	-71.9	-61.8	172.7	0	0	112.4	E245 T248 Y250 P251 S256 T257 K258	E245-M254 HydrophobicContact CB-CB 4.45Å; T248-M254 HydrophobicContact CG2-CB 4.07Å; T248-M254 HydrophobicContact CG2-CG 3.42Å; T248-M254 VanDerWaalsContact CG2-CG 3.42Å; Y250-M254 PolarHBondContact O-N 3.46Å; P251-M254 PolarHBondContact O-N 2.95Å; M254-S256 VanDerWaalsContact C-N 3.32Å; M254-S256 PolarHBondContact O-N 2.95Å; M254-T257 PolarHBondContact O-N 2.87Å; M254-K258 WeakPolarHBondContact O-CB 3.38Å; M254-K258 PolarHBondContact O-N 3.02Å
255	R	86.9	Confident	88.2	Confident	88 Å²	88	71.5 Å²	71.5	33%	0.332	35%	0.345	S	S	.	.	H	α-helix	trans	-62	-39.4	174.3	-167.4	176.1	-58.9	148.6	4.6	112.5	E245 P251 L253 L259	E245-R255 IonicContact OE1-CZ 3.5Å; E245-R255 VanDerWaalsContact OE1-CZ 3.32Å; E245-R255 IonicContact OE1-NE 3.69Å; E245-R255 PolarHBondContact OE1-NE 2.86Å; E245-R255 VanDerWaalsContact OE1-NE 3.12Å; E245-R255 IonicContact OE1-NH2 3.48Å; E245-R255 PolarHBondContact OE1-NH2 3.34Å; P251-R255 WeakPolarHBondContact O-CB 3.44Å; P251-R255 PolarHBondContact O-N 3.07Å; L253-R255 VanDerWaalsContact C-N 3.31Å; L253-R255 PolarHBondContact O-N 3.26Å; R255-L259 WeakPolarHBondContact O-CB 3.23Å; R255-L259 PolarHBondContact O-N 3.44Å; R255-L259 VanDerWaalsContact O-N 3.16Å
256	S	88.6	Confident	88.4	Confident	42 Å²	42	72.7 Å²	72.7	29%	0.294	35%	0.349	S	S	.	.	H	α-helix	trans	-67.2	-41.4	175.2	-54.9	0	0	0	0	111.6	N252 L253 M254 L259 L260 I461	N252-S256 WeakPolarHBondContact O-CB 3.46Å; N252-S256 PolarHBondContact O-N 3.26Å; N252-S256 VanDerWaalsContact O-N 3.1Å; N252-S256 PolarHBondContact O-OG 3.03Å; L253-S256 WeakPolarHBondContact O-CA 3.41Å; L253-S256 WeakPolarHBondContact O-CB 3.48Å; L253-S256 PolarHBondContact O-N 3.39Å; M254-S256 VanDerWaalsContact C-N 3.32Å; M254-S256 PolarHBondContact O-N 2.95Å; S256-L259 PolarHBondContact O-N 3.08Å; S256-L260 WeakPolarHBondContact O-CB 3.16Å; S256-L260 PolarHBondContact O-N 3.37Å; S256-I461 VanDerWaalsContact OG-CD1 3.23Å; S256-I461 WeakPolarHBondContact OG-CD1 3.46Å
257	T	89.4	Confident	88.8	Confident	67 Å²	67	64.7 Å²	64.7	41%	0.411	32%	0.321	S	S	.	.	H	α-helix	trans	-65.6	-45.7	177.6	-54.8	0	0	0	0	112.1	L253 M254 L259 L260 L261	L253-T257 PolarHBondContact O-N 3.46Å; L253-T257 PolarHBondContact O-OG1 2.89Å; M254-T257 PolarHBondContact O-N 2.87Å; T257-L259 VanDerWaalsContact C-N 3.3Å; T257-L259 PolarHBondContact O-N 3.28Å; T257-L260 PolarHBondContact O-N 3.22Å; T257-L261 WeakPolarHBondContact O-CB 3.47Å; T257-L261 PolarHBondContact O-N 3.15Å
258	K	89.7	Confident	89.3	Confident	21 Å²	21	58.5 Å²	58.5	9%	0.091	29%	0.292	C	S	.	.	H	α-helix	trans	-55.4	-45.9	174.2	-179.5	176.4	178.7	178.5	0	110.9	M241 D242 M254 Y262	M241-K258 HydrophobicContact CB-CD 4.44Å; D242-K258 IonicContact OD1-NZ 2.74Å; D242-K258 PolarHBondContact OD1-NZ 3.19Å; M254-K258 WeakPolarHBondContact O-CB 3.38Å; M254-K258 PolarHBondContact O-N 3.02Å; K258-Y262 WeakPolarHBondContact CE-OH 3.38Å; K258-Y262 HydrophobicContact CG-CE2 3.94Å; K258-Y262 VanDerWaalsContact O-CG 3.3Å; K258-Y262 PolarHBondContact O-N 3.15Å
259	L	90.7	Very high	89.7	Confident	27 Å²	27	60.8 Å²	60.8	14%	0.141	30%	0.297	C	S	.	.	H	α-helix	trans	-67.4	-45.6	179	-175.2	71.8	0	0	0	112.8	R255 S256 T257 L261 Y262 Y263 H457	R255-L259 WeakPolarHBondContact O-CB 3.23Å; R255-L259 PolarHBondContact O-N 3.44Å; R255-L259 VanDerWaalsContact O-N 3.16Å; S256-L259 PolarHBondContact O-N 3.08Å; T257-L259 VanDerWaalsContact C-N 3.3Å; T257-L259 PolarHBondContact O-N 3.28Å; L259-L261 VanDerWaalsContact C-N 3.31Å; L259-L261 PolarHBondContact O-N 3.48Å; L259-Y262 WeakPolarHBondContact O-CB 3.28Å; L259-Y262 PolarHBondContact O-N 3.09Å; L259-Y263 HydrophobicContact CD1-CD2 4.47Å; L259-Y263 HydrophobicContact CD1-CE2 3.7Å; L259-Y263 HydrophobicContact CD2-CE2 3.76Å; L259-Y263 HydrophobicContact CG-CD2 4Å; L259-Y263 HydrophobicContact CG-CE2 3.39Å; L259-Y263 VanDerWaalsContact O-CD2 3.29Å; L259-Y263 WeakPolarHBondContact O-CD2 3.36Å; L259-Y263 PolarHBondContact O-N 3.36Å; L259-H457 HydrophobicContact CD2-CB 3.44Å; L259-H457 VanDerWaalsContact CD2-CB 3.44Å
260	L	90.9	Very high	90	Very high	101 Å²	101	55.9 Å²	55.9	53%	0.529	27%	0.271	S	S	.	.	H	α-helix	trans	-58.4	-43.9	176.4	175.7	62.2	0	0	0	111.5	S256 T257 Y262 Y263 L264	S256-L260 WeakPolarHBondContact O-CB 3.16Å; S256-L260 PolarHBondContact O-N 3.37Å; T257-L260 PolarHBondContact O-N 3.22Å; L260-Y262 VanDerWaalsContact C-N 3.3Å; L260-Y262 PolarHBondContact O-N 2.98Å; L260-Y263 PolarHBondContact O-N 3.2Å; L260-L264 HydrophobicContact CD1-CD1 4.17Å; L260-L264 HydrophobicContact CD1-CG 4.14Å; L260-L264 HydrophobicContact CG-CD1 4.01Å; L260-L264 HydrophobicContact CG-CG 4.4Å; L260-L264 WeakPolarHBondContact O-CG 3.3Å; L260-L264 PolarHBondContact O-N 3.5Å
261	L	92.1	Very high	90.2	Very high	35 Å²	35	49.1 Å²	49.1	18%	0.183	24%	0.244	C	C	.	.	H	α-helix	trans	-62.1	-36.3	178.2	-177	56.7	0	0	0	112.3	M134 W138 F237 M241 T257 L259 T265	M134-L261 HydrophobicContact CE-CD1 3.97Å; M134-L261 HydrophobicContact CE-CD2 3.77Å; M134-L261 HydrophobicContact CE-CG 3.95Å; M134-L261 HydrophobicContact SD-CD1 3.83Å; M134-L261 HydrophobicContact SD-CG 4.42Å; W138-L261 HydrophobicContact CZ2-CD1 4.36Å; F237-L261 HydrophobicContact CE2-CD2 4.07Å; F237-L261 HydrophobicContact CZ-CD2 3.84Å; M241-L261 HydrophobicContact CE-CD2 3.97Å; T257-L261 WeakPolarHBondContact O-CB 3.47Å; T257-L261 PolarHBondContact O-N 3.15Å; L259-L261 VanDerWaalsContact C-N 3.31Å; L259-L261 PolarHBondContact O-N 3.48Å; L261-T265 WeakPolarHBondContact O-CB 3.43Å; L261-T265 PolarHBondContact O-N 2.94Å; L261-T265 PolarHBondContact O-OG1 3.18Å
262	Y	91.9	Very high	90.5	Very high	79 Å²	79	46.7 Å²	46.7	31%	0.31	23%	0.229	S	C	.	.	H	α-helix	trans	-66.5	-44.5	172.2	-64.7	-17.6	0	0	0	112.3	F237 W238 K258 L259 L260 T265 F266	F237-Y262 AromaticContact CE1-CE1 3.83Å; F237-Y262 HydrophobicContact CE1-CE1 3.83Å; F237-Y262 HydrophobicContact CZ-CE1 4.32Å; W238-Y262 PolarHBondContact NE1-OH 3.05Å; W238-Y262 VanDerWaalsContact NE1-OH 3.16Å; K258-Y262 WeakPolarHBondContact CE-OH 3.38Å; K258-Y262 HydrophobicContact CG-CE2 3.94Å; K258-Y262 VanDerWaalsContact O-CG 3.3Å; K258-Y262 PolarHBondContact O-N 3.15Å; L259-Y262 WeakPolarHBondContact O-CB 3.28Å; L259-Y262 PolarHBondContact O-N 3.09Å; L260-Y262 VanDerWaalsContact C-N 3.3Å; L260-Y262 PolarHBondContact O-N 2.98Å; Y262-T265 PolarHBondContact O-N 3.32Å; Y262-F266 WeakPolarHBondContact O-CB 3.33Å; Y262-F266 PolarHBondContact O-N 3.26Å
263	Y	90.8	Very high	90.7	Very high	35 Å²	35	47.1 Å²	47.1	14%	0.137	23%	0.232	C	C	.	.	H	α-helix	trans	-65.4	-42	176.7	-68.3	-54	0	0	0	113.1	L259 L260 T265 F266 L267 L450 T453 V454	L259-Y263 HydrophobicContact CD1-CD2 4.47Å; L259-Y263 HydrophobicContact CD1-CE2 3.7Å; L259-Y263 HydrophobicContact CD2-CE2 3.76Å; L259-Y263 HydrophobicContact CG-CD2 4Å; L259-Y263 HydrophobicContact CG-CE2 3.39Å; L259-Y263 VanDerWaalsContact O-CD2 3.29Å; L259-Y263 WeakPolarHBondContact O-CD2 3.36Å; L259-Y263 PolarHBondContact O-N 3.36Å; L260-Y263 PolarHBondContact O-N 3.2Å; Y263-T265 VanDerWaalsContact C-N 3.33Å; Y263-T265 PolarHBondContact O-N 2.99Å; Y263-F266 PolarHBondContact O-N 2.85Å; Y263-L267 WeakPolarHBondContact O-CB 3.43Å; Y263-L267 WeakPolarHBondContact O-CG 3.32Å; Y263-L267 PolarHBondContact O-N 3.26Å; Y263-L450 HydrophobicContact CD1-CD2 4.05Å; Y263-L450 HydrophobicContact CE1-CB 4.18Å; Y263-L450 HydrophobicContact CE1-CD2 3.74Å; Y263-L450 PolarHBondContact OH-O 3.28Å; Y263-T453 WeakPolarHBondContact OH-CB 3.33Å; Y263-T453 PolarHBondContact OH-OG1 3.22Å; Y263-V454 HydrophobicContact CD2-CG2 4.21Å; Y263-V454 HydrophobicContact CE1-CG2 4Å; Y263-V454 HydrophobicContact CE2-CG2 3.43Å; Y263-V454 VanDerWaalsContact CE2-CG2 3.43Å; Y263-V454 WeakPolarHBondContact OH-CG2 3.43Å; Y263-V454 PolarHBondContact OH-N 3.38Å
264	L	92.1	Very high	90.7	Very high	69 Å²	69	43.9 Å²	43.9	36%	0.361	21%	0.214	S	C	.	.	H	α-helix	trans	-62.3	-41.4	176	-71.2	173.4	0	0	0	111.6	W138 L260 H268	W138-L264 HydrophobicContact CZ2-CB 4.3Å; L260-L264 HydrophobicContact CD1-CD1 4.17Å; L260-L264 HydrophobicContact CD1-CG 4.14Å; L260-L264 HydrophobicContact CG-CD1 4.01Å; L260-L264 HydrophobicContact CG-CG 4.4Å; L260-L264 WeakPolarHBondContact O-CG 3.3Å; L260-L264 PolarHBondContact O-N 3.5Å; L264-H268 WeakPolarHBondContact O-CB 3.18Å; L264-H268 PolarHBondContact O-N 3.03Å
265	T	93	Very high	90.6	Very high	16 Å²	16	41.8 Å²	41.8	10%	0.098	20%	0.203	C	C	.	.	H	α-helix	trans	-63.1	-43.6	173.5	-57.5	0	0	0	0	111.2	L137 W138 L261 Y262 Y263 H268 W269	L137-T265 HydrophobicContact CD1-CG2 4.26Å; L137-T265 HydrophobicContact CD2-CG2 3.69Å; L137-T265 HydrophobicContact CG-CG2 3.73Å; W138-T265 PolarHBondContact NE1-OG1 3.36Å; L261-T265 WeakPolarHBondContact O-CB 3.43Å; L261-T265 PolarHBondContact O-N 2.94Å; L261-T265 PolarHBondContact O-OG1 3.18Å; Y262-T265 PolarHBondContact O-N 3.32Å; Y263-T265 VanDerWaalsContact C-N 3.33Å; Y263-T265 PolarHBondContact O-N 2.99Å; T265-H268 PolarHBondContact O-N 3.45Å; T265-W269 PolarHBondContact O-N 3.13Å
266	F	92.3	Very high	90.6	Very high	65 Å²	65	40.1 Å²	40.1	29%	0.285	20%	0.201	S	C	.	.	H	α-helix	trans	-62	-47.6	178.4	-171.6	-83.5	0	0	0	111.9	Y262 Y263 H268 W269 N270 L422 I446 L450	Y262-F266 WeakPolarHBondContact O-CB 3.33Å; Y262-F266 PolarHBondContact O-N 3.26Å; Y263-F266 PolarHBondContact O-N 2.85Å; F266-H268 VanDerWaalsContact C-N 3.33Å; F266-H268 PolarHBondContact O-N 3.26Å; F266-W269 PolarHBondContact O-N 3.45Å; F266-N270 HydrophobicContact CD1-CB 4.5Å; F266-N270 HydrophobicContact CE1-CB 4.18Å; F266-N270 VanDerWaalsContact O-CB 3.25Å; F266-N270 WeakPolarHBondContact O-CB 3.47Å; F266-N270 PolarHBondContact O-N 3.12Å; F266-L422 HydrophobicContact CD1-CD1 3.74Å; F266-L422 HydrophobicContact CE1-CD1 3.58Å; F266-L422 HydrophobicContact CE1-CD2 3.81Å; F266-L422 HydrophobicContact CE1-CG 4.37Å; F266-I446 HydrophobicContact CE1-CG2 4.11Å; F266-I446 HydrophobicContact CE2-CG2 4.07Å; F266-I446 HydrophobicContact CZ-CG2 3.47Å; F266-I446 VanDerWaalsContact CZ-CG2 3.47Å; F266-L450 HydrophobicContact CD1-CD1 3.5Å; F266-L450 HydrophobicContact CE1-CD1 3.47Å; F266-L450 VanDerWaalsContact CE1-CD1 3.47Å; F266-L450 HydrophobicContact CG-CD1 4.09Å; F266-L450 HydrophobicContact CZ-CD1 4.02Å
267	L	91.5	Very high	90.4	Very high	18 Å²	18	39.5 Å²	39.5	9%	0.094	19%	0.194	C	C	.	.	H	α-helix	trans	-57.2	-44.7	174.8	-77.6	161	0	0	0	111.9	Y263 N270 A271 F415 S418 M419 L422 F423	Y263-L267 WeakPolarHBondContact O-CB 3.43Å; Y263-L267 WeakPolarHBondContact O-CG 3.32Å; Y263-L267 PolarHBondContact O-N 3.26Å; L267-N270 PolarHBondContact O-N 3.43Å; L267-A271 WeakPolarHBondContact O-CB 3.45Å; L267-A271 PolarHBondContact O-N 3.16Å; L267-F415 HydrophobicContact CB-CE2 3.9Å; L267-F415 HydrophobicContact CB-CZ 4.18Å; L267-S418 PolarHBondContact O-OG 3.4Å; L267-M419 HydrophobicContact CD2-CB 4.38Å; L267-L422 HydrophobicContact CD2-CD1 3.8Å; L267-F423 HydrophobicContact CD1-CE2 4.42Å; L267-F423 HydrophobicContact CD2-CE2 4.22Å
268	H	93.8	Very high	89.9	Confident	8 Å²	8	38.7 Å²	38.7	4%	0.037	19%	0.187	C	C	.	.	H	α-helix	trans	-62.2	-47	177	174.6	72.2	0	0	0	112.4	W138 L264 T265 F266 N270 A271 C272 Y411	W138-H268 PolarHBondContact O-NE2 2.91Å; L264-H268 WeakPolarHBondContact O-CB 3.18Å; L264-H268 PolarHBondContact O-N 3.03Å; T265-H268 PolarHBondContact O-N 3.45Å; F266-H268 VanDerWaalsContact C-N 3.33Å; F266-H268 PolarHBondContact O-N 3.26Å; H268-N270 PolarHBondContact O-N 2.61Å; H268-A271 PolarHBondContact O-N 2.85Å; H268-C272 PolarHBondContact O-N 3.19Å; H268-C272 VanDerWaalsContact O-N 3.07Å; H268-C272 PolarHBondContact O-SG 3.48Å; H268-Y411 AromaticContact CE1-CE2 3.9Å; H268-Y411 AromaticContact ND1-CE2 3.64Å; H268-Y411 AromaticContact ND1-CZ 3.69Å; H268-Y411 PolarHBondContact ND1-OH 3.48Å
269	W	93.7	Very high	89.4	Confident	77 Å²	77	40 Å²	40	29%	0.292	20%	0.199	S	C	.	.	H	α-helix	trans	-62.3	-43.1	177.1	-85.7	60.4	0	0	0	111.8	L137 I141 L231 T265 F266 C272 V273	L137-W269 HydrophobicContact CD1-CZ2 4.07Å; L137-W269 PolarHBondContact O-NE1 2.87Å; I141-W269 HydrophobicContact CB-CD2 4.32Å; I141-W269 HydrophobicContact CB-CZ2 4.26Å; I141-W269 HydrophobicContact CD1-CE3 4.47Å; I141-W269 HydrophobicContact CD1-CZ3 4.47Å; I141-W269 HydrophobicContact CG1-CD2 4.2Å; I141-W269 HydrophobicContact CG1-CE3 4.22Å; I141-W269 HydrophobicContact CG2-CD2 4.1Å; I141-W269 HydrophobicContact CG2-CG 4.12Å; I141-W269 HydrophobicContact CG2-CZ2 4.34Å; L231-W269 HydrophobicContact CD1-CH2 3.88Å; L231-W269 HydrophobicContact CD1-CZ2 3.87Å; T265-W269 PolarHBondContact O-N 3.13Å; F266-W269 PolarHBondContact O-N 3.45Å; W269-C272 PolarHBondContact O-N 3.42Å; W269-V273 WeakPolarHBondContact O-CG2 3.43Å; W269-V273 PolarHBondContact O-N 3.11Å
270	N	90.9	Very high	88.9	Confident	15 Å²	15	41.8 Å²	41.8	8%	0.08	21%	0.211	C	C	.	.	H	α-helix	trans	-66.7	-40.6	-179.5	-167	66.6	0	0	0	111.7	F266 L267 H268 C272 V273 F274 S418 L422 Y439 E443	F266-N270 HydrophobicContact CD1-CB 4.5Å; F266-N270 HydrophobicContact CE1-CB 4.18Å; F266-N270 VanDerWaalsContact O-CB 3.25Å; F266-N270 WeakPolarHBondContact O-CB 3.47Å; F266-N270 PolarHBondContact O-N 3.12Å; L267-N270 PolarHBondContact O-N 3.43Å; H268-N270 PolarHBondContact O-N 2.61Å; N270-C272 VanDerWaalsContact C-N 3.35Å; N270-C272 PolarHBondContact O-N 2.93Å; N270-V273 PolarHBondContact O-N 3.38Å; N270-F274 PolarHBondContact O-N 2.79Å; N270-S418 WeakPolarHBondContact CB-OG 3.5Å; N270-S418 PolarHBondContact ND2-OG 2.89Å; N270-L422 HydrophobicContact CB-CD1 4.31Å; N270-Y439 PolarHBondContact ND2-OH 2.97Å; N270-Y439 PolarHBondContact O-OH 3.35Å; N270-Y439 PolarHBondContact OD1-OH 3.34Å; N270-Y439 VanDerWaalsContact OD1-OH 3.12Å; N270-E443 PolarHBondContact ND2-OE1 2.94Å
271	A	90.2	Very high	87.9	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-58.6	-42.1	170.1	0	0	0	0	0	113	L267 H268 F274 Q275 A414 F415 S418	L267-A271 WeakPolarHBondContact O-CB 3.45Å; L267-A271 PolarHBondContact O-N 3.16Å; H268-A271 PolarHBondContact O-N 2.85Å; A271-F274 PolarHBondContact O-N 3.41Å; A271-Q275 PolarHBondContact O-N 2.8Å; A271-Q275 VanDerWaalsContact O-N 3.14Å; A271-A414 HydrophobicContact CB-CB 4.39Å; A271-F415 HydrophobicContact CB-CB 4.29Å; A271-F415 HydrophobicContact CB-CD2 4.29Å; A271-S418 PolarHBondContact N-OG 3.37Å
272	C	91.7	Very high	86.8	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.007	22%	0.216	C	C	.	.	H	α-helix	trans	-67.5	-37.9	176.4	-63.7	0	0	0	0	112.3	I141 A145 H268 W269 N270 Q275 L276	I141-C272 HydrophobicContact CG1-CB 3.69Å; A145-C272 HydrophobicContact CB-CB 3.77Å; A145-C272 VanDerWaalsContact CB-O 3.25Å; A145-C272 WeakPolarHBondContact CB-O 3.49Å; H268-C272 PolarHBondContact O-N 3.19Å; H268-C272 VanDerWaalsContact O-N 3.07Å; H268-C272 PolarHBondContact O-SG 3.48Å; W269-C272 PolarHBondContact O-N 3.42Å; N270-C272 VanDerWaalsContact C-N 3.35Å; N270-C272 PolarHBondContact O-N 2.93Å; C272-Q275 PolarHBondContact O-N 3.29Å; C272-L276 WeakPolarHBondContact O-CB 3.42Å; C272-L276 PolarHBondContact O-N 3.22Å
273	V	90.2	Very high	85.7	Confident	52 Å²	52	40.8 Å²	40.8	32%	0.315	22%	0.221	S	C	.	.	H	α-helix	trans	-66	-41.1	174.7	172.1	0	0	0	0	111.2	W269 N270 Q275 L276 I277 Y439	W269-V273 WeakPolarHBondContact O-CG2 3.43Å; W269-V273 PolarHBondContact O-N 3.11Å; N270-V273 PolarHBondContact O-N 3.38Å; V273-Q275 PolarHBondContact O-N 2.9Å; V273-L276 WeakPolarHBondContact O-CB 3.48Å; V273-L276 PolarHBondContact O-N 2.94Å; V273-I277 HydrophobicContact CG1-CD1 3.91Å; V273-I277 HydrophobicContact CG1-CG1 4.42Å; V273-I277 WeakPolarHBondContact O-CG1 3.38Å; V273-I277 PolarHBondContact O-N 3.48Å; V273-Y439 HydrophobicContact CG1-CD2 4.34Å; V273-Y439 HydrophobicContact CG1-CE2 3.72Å
274	F	86.3	Confident	84.4	Confident	36 Å²	36	44.7 Å²	44.7	16%	0.158	24%	0.243	C	C	.	.	H	α-helix	trans	-57.3	-46.7	174.1	175.2	-102.1	0	0	0	112.1	N270 A271 L276 I277 N278 A414 W417 Y439	N270-F274 PolarHBondContact O-N 2.79Å; A271-F274 PolarHBondContact O-N 3.41Å; F274-L276 VanDerWaalsContact C-N 3.34Å; F274-L276 PolarHBondContact O-N 3.39Å; F274-I277 PolarHBondContact O-N 2.92Å; F274-N278 WeakPolarHBondContact CD1-ND2 3.42Å; F274-N278 WeakPolarHBondContact CE1-ND2 3.42Å; F274-N278 WeakPolarHBondContact CZ-ND2 3.49Å; F274-N278 PolarHBondContact O-N 3.34Å; F274-N278 PolarHBondContact O-ND2 3.36Å; F274-A414 HydrophobicContact CD1-CB 3.96Å; F274-W417 HydrophobicContact CD1-CB 4.08Å; F274-W417 HydrophobicContact CE1-CB 3.67Å; F274-W417 AromaticContact CE1-CD1 3.43Å; F274-W417 VanDerWaalsContact CE1-CD1 3.43Å; F274-W417 AromaticContact CE1-CG 3.65Å; F274-W417 HydrophobicContact CE1-CG 3.65Å; F274-W417 HydrophobicContact CE2-CB 4.2Å; F274-W417 HydrophobicContact CE2-CG 4.28Å; F274-W417 HydrophobicContact CG-CB 4.49Å; F274-W417 HydrophobicContact CZ-CB 3.73Å; F274-W417 AromaticContact CZ-CD1 3.54Å; F274-W417 HydrophobicContact CZ-CD2 4.18Å; F274-W417 AromaticContact CZ-CG 3.5Å; F274-W417 HydrophobicContact CZ-CG 3.5Å; F274-W417 VanDerWaalsContact CZ-CG 3.5Å; F274-Y439 HydrophobicContact CD2-CE1 4.25Å
275	Q	86.9	Confident	82.7	Confident	25 Å²	25	47.2 Å²	47.2	12%	0.117	25%	0.252	C	S	.	.	H	α-helix	trans	-63.9	-37.9	175.4	-174.8	68.5	-3.8	0	0	112.6	A145 F146 A271 C272 V273 I277 N278 S279 E410 A414	A145-Q275 HydrophobicContact CB-CB 4.42Å; F146-Q275 HydrophobicContact CD1-CG 3.87Å; F146-Q275 HydrophobicContact CE1-CB 3.96Å; F146-Q275 HydrophobicContact CE1-CG 3.49Å; F146-Q275 VanDerWaalsContact CE1-CG 3.49Å; F146-Q275 HydrophobicContact CE2-CB 4.18Å; F146-Q275 HydrophobicContact CE2-CG 4.32Å; F146-Q275 HydrophobicContact CG-CG 4.44Å; F146-Q275 HydrophobicContact CZ-CB 3.65Å; F146-Q275 HydrophobicContact CZ-CG 3.72Å; A271-Q275 PolarHBondContact O-N 2.8Å; A271-Q275 VanDerWaalsContact O-N 3.14Å; C272-Q275 PolarHBondContact O-N 3.29Å; V273-Q275 PolarHBondContact O-N 2.9Å; Q275-I277 VanDerWaalsContact C-N 3.32Å; Q275-I277 PolarHBondContact O-N 2.78Å; Q275-N278 PolarHBondContact O-N 2.73Å; Q275-S279 WeakPolarHBondContact O-CB 3.39Å; Q275-S279 PolarHBondContact O-N 3.36Å; Q275-S279 PolarHBondContact O-OG 3.43Å; Q275-E410 PolarHBondContact NE2-OE2 2.72Å; Q275-A414 HydrophobicContact CB-CB 4.44Å
276	L	86.8	Confident	80.5	Confident	54 Å²	54	52 Å²	52	28%	0.283	27%	0.274	S	S	.	.	H	α-helix	trans	-64.4	-36	175.3	-172.8	67.4	0	0	0	112	F144 C272 V273 F274 S279 T280	F144-L276 HydrophobicContact CD1-CD2 4.32Å; F144-L276 HydrophobicContact CE1-CD1 4.16Å; F144-L276 HydrophobicContact CE1-CD2 3.69Å; F144-L276 HydrophobicContact CZ-CD1 4.5Å; C272-L276 WeakPolarHBondContact O-CB 3.42Å; C272-L276 PolarHBondContact O-N 3.22Å; V273-L276 WeakPolarHBondContact O-CB 3.48Å; V273-L276 PolarHBondContact O-N 2.94Å; F274-L276 VanDerWaalsContact C-N 3.34Å; F274-L276 PolarHBondContact O-N 3.39Å; L276-S279 WeakPolarHBondContact CA-OG 3.29Å; L276-S279 PolarHBondContact O-OG 3.13Å; L276-S279 VanDerWaalsContact O-OG 3.13Å; L276-T280 WeakPolarHBondContact O-CB 3.48Å; L276-T280 VanDerWaalsContact O-CG2 3.29Å; L276-T280 WeakPolarHBondContact O-CG2 3.49Å; L276-T280 PolarHBondContact O-N 3.48Å; L276-T280 PolarHBondContact O-OG1 3.17Å
277	I	83.3	Confident	78.7	Confident	28 Å²	28	51.6 Å²	51.6	14%	0.144	28%	0.277	C	S	.	.	H	α-helix	trans	-71	-40.9	176.5	-68.4	170	0	0	0	111.1	V273 F274 Q275 T280 A281 Y439	V273-I277 HydrophobicContact CG1-CD1 3.91Å; V273-I277 HydrophobicContact CG1-CG1 4.42Å; V273-I277 WeakPolarHBondContact O-CG1 3.38Å; V273-I277 PolarHBondContact O-N 3.48Å; F274-I277 PolarHBondContact O-N 2.92Å; Q275-I277 VanDerWaalsContact C-N 3.32Å; Q275-I277 PolarHBondContact O-N 2.78Å; I277-T280 WeakPolarHBondContact CA-OG1 3.09Å; I277-T280 PolarHBondContact O-OG1 2.91Å; I277-T280 VanDerWaalsContact O-OG1 3.09Å; I277-A281 VanDerWaalsContact O-CB 3.32Å; I277-A281 WeakPolarHBondContact O-CB 3.4Å; I277-A281 PolarHBondContact O-N 3.2Å; I277-Y439 HydrophobicContact CD1-CD1 4.28Å; I277-Y439 HydrophobicContact CD1-CD2 3.21Å; I277-Y439 HydrophobicContact CD1-CE2 3.72Å; I277-Y439 HydrophobicContact CD1-CG 3.53Å
278	N	78.8	Confident	76.7	Confident	51 Å²	51	54 Å²	54	27%	0.273	30%	0.296	S	S	.	.	H	α-helix	trans	-65.6	-51	177.3	-66.1	-28.9	0	0	0	111.5	F274 Q275 T280 A281 D282	F274-N278 WeakPolarHBondContact CD1-ND2 3.42Å; F274-N278 WeakPolarHBondContact CE1-ND2 3.42Å; F274-N278 WeakPolarHBondContact CZ-ND2 3.49Å; F274-N278 PolarHBondContact O-N 3.34Å; F274-N278 PolarHBondContact O-ND2 3.36Å; Q275-N278 PolarHBondContact O-N 2.73Å; N278-T280 VanDerWaalsContact C-N 3.3Å; N278-T280 PolarHBondContact O-N 2.86Å; N278-A281 WeakPolarHBondContact O-CB 3.37Å; N278-A281 PolarHBondContact O-N 3.14Å; N278-A281 VanDerWaalsContact O-N 3.09Å; N278-D282 PolarHBondContact O-N 3.11Å
279	S	79.3	Confident	74.1	Confident	49 Å²	49	57.9 Å²	57.9	34%	0.343	32%	0.316	S	S	.	.	H	α-helix	trans	-60.8	-36.1	178.4	56.4	0	0	0	0	113	Q275 L276 S283	Q275-S279 WeakPolarHBondContact O-CB 3.39Å; Q275-S279 PolarHBondContact O-N 3.36Å; Q275-S279 PolarHBondContact O-OG 3.43Å; L276-S279 WeakPolarHBondContact CA-OG 3.29Å; L276-S279 PolarHBondContact O-OG 3.13Å; L276-S279 VanDerWaalsContact O-OG 3.13Å; S279-S283 PolarHBondContact O-N 3.02Å
280	T	79.5	Confident	71.7	Confident	64 Å²	64	59.8 Å²	59.8	39%	0.393	34%	0.336	S	S	.	.	H	α-helix	trans	-71.4	-38.1	172.7	51.6	0	0	0	0	112.9	L276 I277 N278 D282 S283 L284	L276-T280 WeakPolarHBondContact O-CB 3.48Å; L276-T280 VanDerWaalsContact O-CG2 3.29Å; L276-T280 WeakPolarHBondContact O-CG2 3.49Å; L276-T280 PolarHBondContact O-N 3.48Å; L276-T280 PolarHBondContact O-OG1 3.17Å; I277-T280 WeakPolarHBondContact CA-OG1 3.09Å; I277-T280 PolarHBondContact O-OG1 2.91Å; I277-T280 VanDerWaalsContact O-OG1 3.09Å; N278-T280 VanDerWaalsContact C-N 3.3Å; N278-T280 PolarHBondContact O-N 2.86Å; T280-D282 PolarHBondContact O-N 3.35Å; T280-S283 WeakPolarHBondContact CA-OG 3.48Å; T280-S283 PolarHBondContact O-N 3.28Å; T280-S283 PolarHBondContact O-OG 3.34Å; T280-L284 WeakPolarHBondContact O-CG 3.38Å; T280-L284 PolarHBondContact O-N 2.83Å
281	A	71.9	Confident	69.2	Low	30 Å²	30	66.2 Å²	66.2	25%	0.248	37%	0.366	C	S	.	.	H	α-helix	trans	-61.5	-42.2	174.3	0	0	0	0	0	112.2	I277 N278 L284 F285	I277-A281 VanDerWaalsContact O-CB 3.32Å; I277-A281 WeakPolarHBondContact O-CB 3.4Å; I277-A281 PolarHBondContact O-N 3.2Å; N278-A281 WeakPolarHBondContact O-CB 3.37Å; N278-A281 PolarHBondContact O-N 3.14Å; N278-A281 VanDerWaalsContact O-N 3.09Å; A281-L284 PolarHBondContact O-N 3Å; A281-F285 WeakPolarHBondContact O-CB 3.34Å; A281-F285 PolarHBondContact O-N 3.19Å
282	D	68.4	Low	66.3	Low	105 Å²	105	70 Å²	70	56%	0.561	39%	0.393	S	S	*	.	H	α-helix	trans	-63.6	-41.4	174.3	-68.9	-28.1	0	0	0	111.5	N278 T280 L284 F285 M286	N278-D282 PolarHBondContact O-N 3.11Å; T280-D282 PolarHBondContact O-N 3.35Å; D282-L284 VanDerWaalsContact C-N 3.34Å; D282-L284 PolarHBondContact O-N 3.43Å; D282-F285 PolarHBondContact O-N 2.9Å; D282-M286 WeakPolarHBondContact O-CB 3.14Å; D282-M286 WeakPolarHBondContact O-CG 3.27Å; D282-M286 PolarHBondContact O-N 3.46Å
283	S	68.5	Low	63.6	Low	59 Å²	59	74.1 Å²	74.1	41%	0.413	42%	0.419	S	S	.	.	H	α-helix	trans	-62.6	-38.6	175.3	81.2	0	0	0	0	112.8	S279 T280 T287	S279-S283 PolarHBondContact O-N 3.02Å; T280-S283 WeakPolarHBondContact CA-OG 3.48Å; T280-S283 PolarHBondContact O-N 3.28Å; T280-S283 PolarHBondContact O-OG 3.34Å; S283-T287 WeakPolarHBondContact O-CB 3.38Å; S283-T287 PolarHBondContact O-N 2.94Å; S283-T287 PolarHBondContact O-OG1 2.79Å
284	L	62.6	Low	60.7	Low	117 Å²	117	78.9 Å²	78.9	61%	0.613	45%	0.449	S	S	*	.	H	α-helix	trans	-70.7	-37.9	176.8	-72.9	172.7	0	0	0	111.5	T280 A281 D282 T287 S288	T280-L284 WeakPolarHBondContact O-CG 3.38Å; T280-L284 PolarHBondContact O-N 2.83Å; A281-L284 PolarHBondContact O-N 3Å; D282-L284 VanDerWaalsContact C-N 3.34Å; D282-L284 PolarHBondContact O-N 3.43Å; L284-T287 PolarHBondContact O-N 3.08Å; L284-S288 WeakPolarHBondContact O-CB 3.45Å; L284-S288 PolarHBondContact O-N 3.27Å
285	F	56.2	Low	57.9	Low	122 Å²	122	81.7 Å²	81.7	54%	0.535	47%	0.473	S	S	.	.	H	α-helix	trans	-62.9	-47.1	174	-172.5	-109	0	0	0	111	A281 D282 T287 S288 L289	A281-F285 WeakPolarHBondContact O-CB 3.34Å; A281-F285 PolarHBondContact O-N 3.19Å; D282-F285 PolarHBondContact O-N 2.9Å; F285-T287 VanDerWaalsContact C-N 3.33Å; F285-T287 PolarHBondContact O-N 2.9Å; F285-S288 PolarHBondContact O-N 3.19Å; F285-S288 VanDerWaalsContact O-N 3.16Å; F285-S288 PolarHBondContact O-OG 3.35Å; F285-L289 HydrophobicContact CD1-CD1 3.97Å; F285-L289 HydrophobicContact CE1-CD1 3.62Å; F285-L289 HydrophobicContact CZ-CD1 4.09Å; F285-L289 WeakPolarHBondContact O-CG 3.47Å; F285-L289 PolarHBondContact O-N 3.13Å
286	M	47.5	Very low	55.1	Low	115 Å²	115	91.3 Å²	91.3	57%	0.567	51%	0.508	S	S	*	.	H	α-helix	trans	-63.6	-35.6	174.5	-68.2	-66.2	159.7	0	0	112.9	D282 L289 T290	D282-M286 WeakPolarHBondContact O-CB 3.14Å; D282-M286 WeakPolarHBondContact O-CG 3.27Å; D282-M286 PolarHBondContact O-N 3.46Å; M286-L289 PolarHBondContact O-N 3.01Å; M286-L289 HydrophobicContact SD-CD1 4.49Å; M286-T290 WeakPolarHBondContact O-CB 3.48Å; M286-T290 WeakPolarHBondContact O-CG2 3.33Å; M286-T290 PolarHBondContact O-N 2.97Å; M286-T290 PolarHBondContact O-OG1 3.04Å
287	T	54	Low	52.3	Low	57 Å²	57	94.7 Å²	94.7	35%	0.35	53%	0.531	S	S	.	.	H	α-helix	trans	-66	-40.2	173.1	-55.3	0	0	0	0	111.2	S283 L284 F285 L289 T290 Q291	S283-T287 WeakPolarHBondContact O-CB 3.38Å; S283-T287 PolarHBondContact O-N 2.94Å; S283-T287 PolarHBondContact O-OG1 2.79Å; L284-T287 PolarHBondContact O-N 3.08Å; F285-T287 VanDerWaalsContact C-N 3.33Å; F285-T287 PolarHBondContact O-N 2.9Å; T287-L289 VanDerWaalsContact C-N 3.33Å; T287-L289 PolarHBondContact O-N 3.35Å; T287-T290 WeakPolarHBondContact CA-OG1 3.4Å; T287-T290 PolarHBondContact O-N 3.46Å; T287-T290 PolarHBondContact O-OG1 3.06Å; T287-Q291 HydrophobicContact CG2-CG 4.28Å; T287-Q291 WeakPolarHBondContact O-CB 3.46Å; T287-Q291 WeakPolarHBondContact O-CG 3.42Å; T287-Q291 PolarHBondContact O-N 3.07Å
288	S	49.4	Very low	49.6	Very low	70 Å²	70	99.6 Å²	99.6	49%	0.49	56%	0.563	S	S	.	*	H	α-helix	trans	-66.4	-32.5	177.2	77.1	0	0	0	0	113.4	L284 F285	L284-S288 WeakPolarHBondContact O-CB 3.45Å; L284-S288 PolarHBondContact O-N 3.27Å; F285-S288 PolarHBondContact O-N 3.19Å; F285-S288 VanDerWaalsContact O-N 3.16Å; F285-S288 PolarHBondContact O-OG 3.35Å
289	L	39.1	Very low	47.2	Very low	89 Å²	89	104.4 Å²	104.4	47%	0.466	59%	0.587	S	S	.	*	H	α-helix	trans	-74.9	-40.6	174.9	-68.7	172.3	0	0	0	111.9	F285 M286 T287 Q291 S292	F285-L289 HydrophobicContact CD1-CD1 3.97Å; F285-L289 HydrophobicContact CE1-CD1 3.62Å; F285-L289 HydrophobicContact CZ-CD1 4.09Å; F285-L289 WeakPolarHBondContact O-CG 3.47Å; F285-L289 PolarHBondContact O-N 3.13Å; M286-L289 PolarHBondContact O-N 3.01Å; M286-L289 HydrophobicContact SD-CD1 4.49Å; T287-L289 VanDerWaalsContact C-N 3.33Å; T287-L289 PolarHBondContact O-N 3.35Å; L289-Q291 VanDerWaalsContact C-N 3.35Å; L289-S292 PolarHBondContact O-N 3.13Å; L289-S292 PolarHBondContact O-OG 2.66Å
290	T	44.6	Very low	44.8	Very low	116 Å²	116	108.6 Å²	108.6	71%	0.712	61%	0.61	S	S	*	*	H	α-helix	trans	-76.9	-16.6	178.8	50.7	0	0	0	0	114.2	M286 T287	M286-T290 WeakPolarHBondContact O-CB 3.48Å; M286-T290 WeakPolarHBondContact O-CG2 3.33Å; M286-T290 PolarHBondContact O-N 2.97Å; M286-T290 PolarHBondContact O-OG1 3.04Å; T287-T290 WeakPolarHBondContact CA-OG1 3.4Å; T287-T290 PolarHBondContact O-N 3.46Å; T287-T290 PolarHBondContact O-OG1 3.06Å
291	Q	37.6	Very low	42.4	Very low	150 Å²	150	114.4 Å²	114.4	70%	0.701	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	8.6	171.5	-68.9	-175.9	-3.9	0	0	114	T287 L289	T287-Q291 HydrophobicContact CG2-CG 4.28Å; T287-Q291 WeakPolarHBondContact O-CB 3.46Å; T287-Q291 WeakPolarHBondContact O-CG 3.42Å; T287-Q291 PolarHBondContact O-N 3.07Å; L289-Q291 VanDerWaalsContact C-N 3.35Å
292	S	29.8	Very low	40.4	Very low	81 Å²	81	116.3 Å²	116.3	57%	0.566	66%	0.656	S	S	*	*	S	Bend	trans	-69.4	130.1	168	65.8	0	0	0	0	110.1	L289 T294	L289-S292 PolarHBondContact O-N 3.13Å; L289-S292 PolarHBondContact O-OG 2.66Å; S292-T294 PolarHBondContact O-N 3.24Å
293	P	34.5	Very low	38.4	Very low	86 Å²	86	117.2 Å²	117.2	56%	0.558	67%	0.67	S	S	*	*			trans	-79.5	123.4	-149.1	27.5	-36	0	0	0	114.7	S295	P293-S295 PolarHBondContact O-N 3.1Å
294	T	30.1	Very low	36.4	Very low	153 Å²	153	125.5 Å²	125.5	94%	0.939	69%	0.692	S	S	*	*	S	Bend	trans	-69.3	55.8	156.4	52	0	0	0	0	111.3	S292	S292-T294 PolarHBondContact O-N 3.24Å
295	S	27.5	Very low	34.9	Very low	95 Å²	95	125.6 Å²	125.6	66%	0.664	70%	0.698	S	S	*	*			trans	-172.2	60.3	-179.4	41.7	0	0	0	0	112.7	P293	P293-S295 PolarHBondContact O-N 3.1Å
296	R	27.7	Very low	33.7	Very low	226 Å²	226	126.2 Å²	126.2	85%	0.853	71%	0.707	S	S	*	*			trans	-144.7	55.7	159.5	-155	179.5	-72.8	-171.3	-1.7	113.4
297	T	27.8	Very low	32.9	Very low	125 Å²	125	128 Å²	128	77%	0.767	72%	0.717	S	S	*	*			trans	-127.6	136.1	160.4	48.4	0	0	0	0	108.4
298	T	26.9	Very low	31.6	Very low	131 Å²	131	129.3 Å²	129.3	80%	0.804	73%	0.729	S	S	*	*	S	Bend	trans	88.5	122.1	177.1	73.9	0	0	0	0	118.3
299	I	27.7	Very low	30.8	Very low	152 Å²	152	132.6 Å²	132.6	78%	0.779	74%	0.741	S	S	*	*			trans	74.3	88.8	153.7	-50.5	150.8	0	0	0	118.6
300	T	30.8	Very low	30.4	Very low	137 Å²	137	136 Å²	136	84%	0.84	76%	0.759	S	S	*	*				-136.6	139.5	124.7	46	0	0	0	0	107.9
301	E	28.6	Very low	29.7	Very low	187 Å²	187	133.9 Å²	133.9	87%	0.874	76%	0.76	S	S	*	*			trans	-67.3	146.4	-171.1	-59.5	113.6	130.7	0	0	114
302	G	28.4	Very low	29.4	Very low	70 Å²	70	131.4 Å²	131.4	72%	0.722	77%	0.765	S	S	*	*			trans	170.4	53.6	-179.1	0	0	0	0	0	117.7
303	S	26.6	Very low	29.5	Very low	123 Å²	123	134.7 Å²	134.7	86%	0.86	78%	0.781	S	S	*	*			trans	76.1	125.1	163.1	-53.6	0	0	0	0	120.5
304	R	28.2	Very low	29.2	Very low	233 Å²	233	139.1 Å²	139.1	88%	0.879	80%	0.795	S	S	*	*			trans	78.9	86.7	153.8	-73.2	-176.7	170.6	164.8	-1.9	121.2
305	T	29.3	Very low	29.2	Very low	119 Å²	119	137.6 Å²	137.6	73%	0.73	79%	0.785	S	S	*	*				75.7	133	121.2	50.3	0	0	0	0	122
306	N	31.5	Very low	29.2	Very low	135 Å²	135	139.3 Å²	139.3	72%	0.722	79%	0.787	S	S	*	*			trans	85.2	93.9	166.4	-51.9	-16.7	0	0	0	115
307	I	30.2	Very low	29.1	Very low	152 Å²	152	138.4 Å²	138.4	78%	0.779	79%	0.785	S	S	*	*				64.6	123.2	66.9	-56	168.1	0	0	0	111.3
308	S	28.6	Very low	29.2	Very low	85 Å²	85	140.1 Å²	140.1	59%	0.594	78%	0.784	S	S	*	*			cis	-170.3	175.3	-14.1	56.4	0	0	0	0	109.9
309	N	32.3	Very low	29.2	Very low	140 Å²	140	139 Å²	139	75%	0.749	78%	0.777	S	S	*	*			trans	79.3	142.6	161.5	-58.6	-7.5	0	0	0	118.8
310	L	29.6	Very low	29.4	Very low	161 Å²	161	138 Å²	138	84%	0.843	78%	0.778	S	S	*	*			cis	-169.7	150	-22.2	-152.6	80.5	0	0	0	110.1
311	G	30.9	Very low	29.3	Very low	71 Å²	71	138.3 Å²	138.3	73%	0.732	77%	0.774	S	S	*	*			trans	64	118.6	156.6	0	0	0	0	0	118.8
312	A	30	Very low	29.5	Very low	97 Å²	97	136.2 Å²	136.2	80%	0.802	77%	0.768	S	S	*	*			cis	76.1	108.4	38.4	0	0	0	0	0	116.2
313	T	31.9	Very low	29.6	Very low	150 Å²	150	138.8 Å²	138.8	92%	0.92	77%	0.765	S	S	*	*			trans	-177.3	142.9	134.2	20	0	0	0	0	112.1
314	H	28.4	Very low	30	Very low	180 Å²	180	139.6 Å²	139.6	83%	0.833	76%	0.76	S	S	*	*			trans	-88.4	156.3	173.9	-82.8	-120.7	0	0	0	111.4
315	T	30.2	Very low	30.1	Very low	121 Å²	121	132.5 Å²	132.5	74%	0.742	75%	0.746	S	S	*	*				166	139.8	109.5	37.9	0	0	0	0	115.4
316	N	27.9	Very low	30.5	Very low	130 Å²	130	134 Å²	134	70%	0.695	74%	0.744	S	S	*	*			trans	53.7	119.3	138.7	-60	-12.1	0	0	0	124.5
317	Y	25.4	Very low	30.6	Very low	208 Å²	208	137.2 Å²	137.2	82%	0.816	75%	0.746	S	S	*	*				54.8	153.7	126.7	-72.8	-83.6	0	0	0	123.6
318	H	30.5	Very low	30.8	Very low	161 Å²	161	135.3 Å²	135.3	75%	0.745	74%	0.738	S	S	*	*			trans	89	101.2	162.4	-81.2	-73.1	0	0	0	121
319	T	27.4	Very low	31.1	Very low	108 Å²	108	137.9 Å²	137.9	66%	0.663	75%	0.745	S	S	*	*				37.4	150.1	120.4	53.9	0	0	0	0	123
320	T	29.8	Very low	31.2	Very low	130 Å²	130	135.3 Å²	135.3	80%	0.798	74%	0.738	S	S	*	*			trans	81	110.3	172.9	70.3	0	0	0	0	113.6
321	N	29.8	Very low	31.4	Very low	143 Å²	143	134.4 Å²	134.4	77%	0.765	73%	0.734	S	S	*	*				67.7	109.1	59.6	-167.8	24	0	0	0	112.2
322	I	32.4	Very low	31.5	Very low	144 Å²	144	139.1 Å²	139.1	74%	0.738	74%	0.737	S	S	*	*			trans	177.4	125.1	145.9	-94.2	152.5	0	0	0	110.9
323	N	30.2	Very low	31.6	Very low	123 Å²	123	140.8 Å²	140.8	66%	0.658	73%	0.732	S	S	*	*			trans	24.5	133	146	-44.7	-23	0	0	0	121.9
324	N	35	Very low	31.6	Very low	141 Å²	141	139 Å²	139	75%	0.754	72%	0.721	S	S	*	*				158.6	108.3	109.4	-86.2	-31.1	0	0	0	109.9
325	S	31.4	Very low	31.7	Very low	83 Å²	83	138.3 Å²	138.3	58%	0.58	72%	0.724	S	S	*	*				84.1	105.7	78.7	78.2	0	0	0	0	114.3
326	H	37.7	Very low	31.8	Very low	152 Å²	152	140.8 Å²	140.8	70%	0.704	73%	0.727	S	S	*	*				-179	123	127.5	-93.5	-41.7	0	0	0	108.9
327	R	32.3	Very low	31.9	Very low	201 Å²	201	141.3 Å²	141.3	76%	0.758	73%	0.728	S	S	*	*				62.3	131.4	95.5	-76	-165.7	169.4	151.5	-5.6	112.4
328	N	34.7	Very low	32.1	Very low	113 Å²	113	135.7 Å²	135.7	60%	0.604	72%	0.719	S	S	*	*			cis	-165	153.3	20.2	-110	-7.2	0	0	0	111.1
329	N	35.1	Very low	32	Very low	138 Å²	138	134.8 Å²	134.8	74%	0.738	72%	0.719	S	S	*	*			trans	59.4	153.5	139.7	-62.3	1	0	0	0	120.2
330	S	35.6	Very low	31.9	Very low	86 Å²	86	140.7 Å²	140.7	60%	0.601	73%	0.73	S	S	*	*			cis	-179.5	122.8	-12.3	50.5	0	0	0	0	106.6
331	N	33.5	Very low	31.7	Very low	142 Å²	142	139.2 Å²	139.2	76%	0.759	72%	0.724	S	S	*	*				166.7	127.6	94.3	-79.3	-37.4	0	0	0	104.6
332	Q	31.6	Very low	31.5	Very low	171 Å²	171	139.2 Å²	139.2	80%	0.799	73%	0.725	S	S	*	*				68.9	139	66.8	-82.6	-165.1	-12.5	0	0	116.9
333	N	32.9	Very low	31.2	Very low	131 Å²	131	138.5 Å²	138.5	70%	0.701	73%	0.727	S	S	*	*			trans	84	88.1	170.9	-56.8	-10.9	0	0	0	116.4
334	T	30.9	Very low	31.1	Very low	112 Å²	112	136.9 Å²	136.9	69%	0.687	73%	0.725	S	S	*	*				69.6	110.2	80.3	63.1	0	0	0	0	114.5
335	N	32.1	Very low	30.7	Very low	166 Å²	166	136.8 Å²	136.8	89%	0.888	72%	0.724	S	S	*	*				-164.8	143.3	115.3	-94.8	-22.4	0	0	0	113.5
336	H	31.9	Very low	30.4	Very low	174 Å²	174	140.4 Å²	140.4	81%	0.806	74%	0.737	S	S	*	*			trans	-73.8	167.7	-173.6	-99.3	-92	0	0	0	115.3
337	I	30.3	Very low	30	Very low	141 Å²	141	136.6 Å²	136.6	72%	0.723	74%	0.739	S	S	*	*			trans	91.3	94.7	146.7	-71.1	150.2	0	0	0	119.5
338	S	28.2	Very low	29.9	Very low	89 Å²	89	134.1 Å²	134.1	62%	0.622	74%	0.739	S	S	*	*				79.4	151.1	127.6	80.7	0	0	0	0	122.6
339	N	28.9	Very low	29.5	Very low	142 Å²	142	135.1 Å²	135.1	76%	0.759	74%	0.744	S	S	*	*			trans	66.4	102.2	163.1	-62.6	-26.4	0	0	0	116.2
340	R	24.7	Very low	29.1	Very low	233 Å²	233	135.2 Å²	135.2	88%	0.879	75%	0.745	S	S	*	*				82.6	126	70.1	-173	-175.1	-157.7	-162.4	7.5	111.3
341	S	25.5	Very low	28.9	Very low	98 Å²	98	138 Å²	138	69%	0.685	75%	0.753	S	S	*	*			trans	108.3	125.6	163.2	80.1	0	0	0	0	116.6
342	N	25.9	Very low	28.7	Very low	144 Å²	144	135.8 Å²	135.8	77%	0.77	75%	0.749	S	S	*	*			trans	79	113.2	135.5	-63.7	-0.6	0	0	0	121.6
343	V	27.7	Very low	28.5	Very low	129 Å²	129	132.8 Å²	132.8	78%	0.782	75%	0.747	S	S	*	*				97.3	140.6	121.1	169.2	0	0	0	0	119
344	S	27.2	Very low	28.3	Very low	89 Å²	89	133.4 Å²	133.4	62%	0.622	75%	0.749	S	S	*	*			trans	66.7	108.4	158.7	61.8	0	0	0	0	120.6
345	D	26.3	Very low	28.2	Very low	139 Å²	139	135 Å²	135	74%	0.743	75%	0.753	S	S	*	*				68.9	132.8	113	-62.1	-8.9	0	0	0	123.4
346	N	25.8	Very low	28	Very low	159 Å²	159	134.3 Å²	134.3	85%	0.85	75%	0.748	S	S	*	*			trans	61.7	114.2	140.5	-62.1	-28.4	0	0	0	119.8
347	G	28.4	Very low	27.8	Very low	71 Å²	71	137.3 Å²	137.3	73%	0.732	75%	0.752	S	S	*	*			trans	171.8	76.2	163.8	0	0	0	0	0	118.1
348	I	29.8	Very low	27.9	Very low	150 Å²	150	135.5 Å²	135.5	77%	0.769	75%	0.752	S	S	*	*				42.9	112.7	128.8	-61	169.7	0	0	0	119
349	N	27	Very low	27.8	Very low	134 Å²	134	138.5 Å²	138.5	72%	0.717	76%	0.762	S	S	*	*			trans	41.3	125.8	138.3	-46	-11	0	0	0	121.4
350	N	27.7	Very low	28	Very low	140 Å²	140	140.5 Å²	140.5	75%	0.749	77%	0.766	S	S	*	*				176.4	159.3	101.2	-91.9	-18.2	0	0	0	113.2
351	D	30.7	Very low	28.1	Very low	143 Å²	143	133.4 Å²	133.4	77%	0.765	75%	0.752	S	S	*	*			trans	68.9	143.3	156.1	-66.5	-41.4	0	0	0	120.4
352	S	28.6	Very low	28.2	Very low	96 Å²	96	137.2 Å²	137.2	67%	0.671	76%	0.764	S	S	*	*			cis	-170.4	173.2	-17.4	-113.7	0	0	0	0	109.4
353	S	28.9	Very low	28.2	Very low	109 Å²	109	135.1 Å²	135.1	76%	0.762	76%	0.76	S	S	*	*			trans	76.2	139.5	166.7	77.1	0	0	0	0	118.7
354	L	27.2	Very low	28.2	Very low	143 Å²	143	135.6 Å²	135.6	75%	0.749	76%	0.758	S	S	*	*			cis	-158	131.9	-5.5	-106.4	159.6	0	0	0	110.9
355	L	29.5	Very low	28.3	Very low	146 Å²	146	139.6 Å²	139.6	76%	0.764	77%	0.771	S	S	*	*			trans	61.3	153.4	152.7	-48.2	179.2	0	0	0	122.1
356	L	28.1	Very low	28.4	Very low	152 Å²	152	139 Å²	139	80%	0.796	77%	0.768	S	S	*	*			cis	168.8	111.4	-37.5	-122.1	167.5	0	0	0	108.4
357	R	27.9	Very low	28.5	Very low	236 Å²	236	138 Å²	138	89%	0.891	76%	0.763	S	S	*	*			trans	166.6	141.1	148.6	-102.2	-175.5	161.5	174.8	-4.8	109.6
358	S	31.3	Very low	28.4	Very low	103 Å²	103	142.9 Å²	142.9	72%	0.72	77%	0.767	S	S	*	*			cis	-159.2	153.7	-10.3	25.5	0	0	0	0	110
359	N	27.1	Very low	28.4	Very low	153 Å²	153	141.4 Å²	141.4	82%	0.818	76%	0.764	S	S	*	*			trans	-71.6	151.6	-174.8	-54.7	-47	0	0	0	114.5
360	H	33.3	Very low	28.3	Very low	183 Å²	183	140.1 Å²	140.1	85%	0.847	77%	0.766	S	S	*	*			trans	-164.3	95.7	134.5	-98.5	-66.9	0	0	0	107.3
361	S	27.2	Very low	28.1	Very low	85 Å²	85	137.7 Å²	137.7	59%	0.594	77%	0.766	S	S	*	*				67.6	89.4	86	76.1	0	0	0	0	114.7
362	L	27.5	Very low	28.2	Very low	178 Å²	178	138 Å²	138	93%	0.932	77%	0.773	S	S	*	*				-168.2	125.5	120.7	-126	72.3	0	0	0	109.9
363	S	25.3	Very low	28.1	Very low	99 Å²	99	138.8 Å²	138.8	69%	0.692	78%	0.778	S	S	*	*			trans	-125.8	150.6	173.9	55.2	0	0	0	0	109.7
364	N	27.1	Very low	27.9	Very low	139 Å²	139	137.7 Å²	137.7	74%	0.743	78%	0.776	S	S	*	*			trans	74.5	112.8	174.6	-51	-15.6	0	0	0	116
365	I	29.9	Very low	27.9	Very low	174 Å²	174	137.2 Å²	137.2	89%	0.892	78%	0.779	S	S	*	*				-149.8	141.2	115.9	-94.2	147	0	0	0	107
366	N	28.4	Very low	27.8	Very low	127 Å²	127	137.3 Å²	137.3	68%	0.679	78%	0.779	S	S	*	*			trans	-96.1	162	-173.6	-58.8	-42.7	0	0	0	111.8
367	N	27.3	Very low	27.8	Very low	138 Å²	138	135.1 Å²	135.1	74%	0.738	77%	0.772	S	S	*	*			trans	68.6	154.3	150.6	-64	-6.9	0	0	0	119.8
368	E	27.4	Very low	27.7	Very low	173 Å²	173	129.3 Å²	129.3	81%	0.808	77%	0.767	S	S	*	*			trans	68.9	137.2	163.9	-67.5	162.8	-141.4	0	0	115.9
369	T	28.5	Very low	27.5	Very low	118 Å²	118	128.7 Å²	128.7	72%	0.724	77%	0.768	S	S	*	*			cis	-155.2	145.6	3.7	5.2	0	0	0	0	111.4
370	S	24.6	Very low	27.7	Very low	108 Å²	108	129.4 Å²	129.4	76%	0.755	77%	0.772	S	S	*	*			trans	30.6	121.7	132.3	-49.2	0	0	0	0	122.2
371	A	25.3	Very low	27.7	Very low	89 Å²	89	126.7 Å²	126.7	74%	0.736	77%	0.768	S	S	*	*			trans	66.2	110.6	134.8	0	0	0	0	0	121
372	T	31.7	Very low	27.7	Very low	150 Å²	150	129.3 Å²	129.3	92%	0.92	78%	0.776	S	S	*	*				-154.8	101.6	128.7	2.1	0	0	0	0	111.1
373	S	25.8	Very low	28.1	Very low	112 Å²	112	127.5 Å²	127.5	78%	0.783	77%	0.772	S	S	*	*			trans	-57.7	133.5	174.4	-47.4	0	0	0	0	111.5
374	A	26.5	Very low	28.4	Very low	85 Å²	85	126 Å²	126	70%	0.702	77%	0.771	S	S	*	*				92.2	167.8	74.3	0	0	0	0	0	114.2
375	T	25.8	Very low	28.6	Very low	133 Å²	133	123.1 Å²	123.1	82%	0.816	76%	0.762	S	S	*	*			trans	71.7	128.3	-175.5	-2.5	0	0	0	0	112.7
376	I	28.5	Very low	28.7	Very low	149 Å²	149	118.7 Å²	118.7	76%	0.764	74%	0.74	S	S	*	*			cis	-156.7	151.3	36.3	-79	171.7	0	0	0	108.1
377	T	28.3	Very low	29	Very low	106 Å²	106	118.7 Å²	118.7	65%	0.65	74%	0.739	S	S	*	*			cis	-164.1	155.4	-25.6	41.1	0	0	0	0	109.7
378	S	26	Very low	29.1	Very low	113 Å²	113	117.9 Å²	117.9	79%	0.79	74%	0.739	S	S	*	*			trans	56.6	97.4	144.1	67.5	0	0	0	0	122.1
379	A	26.9	Very low	29.2	Very low	90 Å²	90	118.4 Å²	118.4	74%	0.744	74%	0.744	S	S	*	*				165.6	109.5	119.2	0	0	0	0	0	111.1
380	N	29.9	Very low	29.2	Very low	169 Å²	169	115.5 Å²	115.5	90%	0.904	73%	0.728	S	S	*	*			trans	158.2	94.6	154.5	-84	-17.7	0	0	0	109.1
381	T	33.7	Very low	29.6	Very low	125 Å²	125	116 Å²	116	77%	0.767	73%	0.729	S	S	*	*			trans	-84.4	117.8	-178.9	44.2	0	0	0	0	112.1
382	D	28.2	Very low	29.9	Very low	141 Å²	141	117.1 Å²	117.1	75%	0.754	72%	0.722	S	S	*	*			trans	64.8	52.2	141	-51	-25.4	0	0	0	119.8
383	V	34.3	Very low	30.1	Very low	140 Å²	140	115.2 Å²	115.2	85%	0.848	71%	0.706	S	S	*	*	S	Bend	trans	-96.4	7.7	161.2	-144.7	0	0	0	0	112.7
384	G	31.9	Very low	30.4	Very low	66 Å²	66	116.8 Å²	116.8	68%	0.68	70%	0.701	S	S	*	*	S	Bend	trans	-100.4	-3.4	-167.1	0	0	0	0	0	117.2
385	S	32.3	Very low	30.8	Very low	79 Å²	79	115.4 Å²	115.4	55%	0.552	69%	0.686	S	S	*	*	S	Bend	trans	-102.9	-1.5	-166.1	51	0	0	0	0	115.9	T388	S385-T388 PolarHBondContact O-OG1 3.34Å
386	L	30.8	Very low	31.2	Very low	82 Å²	82	115.9 Å²	115.9	43%	0.429	68%	0.677	S	S	.	*	S	Bend	trans	-97.5	3.6	-174.2	-82.9	151.6	0	0	0	115.1	M902 T904	L386-M902 HydrophobicContact CD1-CB 3.64Å; L386-M902 HydrophobicContact CD2-CB 3.65Å; L386-M902 HydrophobicContact CD2-CE 4Å; L386-M902 HydrophobicContact CD2-CG 3.97Å; L386-M902 HydrophobicContact CG-CB 4.29Å; L386-T904 HydrophobicContact CD2-CG2 4.46Å
387	I	34.7	Very low	31.5	Very low	127 Å²	127	114.1 Å²	114.1	65%	0.651	67%	0.669	S	S	*	*	S	Bend	trans	-94.3	-2.6	-178.6	-66.5	170.1	0	0	0	111.9
388	T	31.1	Very low	31.8	Very low	120 Å²	120	116.5 Å²	116.5	74%	0.736	67%	0.671	S	S	*	*			trans	-96.5	11.1	-172.3	45.8	0	0	0	0	115.8	S385	S385-T388 PolarHBondContact O-OG1 3.34Å
389	M	28.1	Very low	32.4	Very low	184 Å²	184	116.5 Å²	116.5	91%	0.906	66%	0.661	S	S	*	*	S	Bend	trans	-113.7	56.3	175.3	-67.4	-160.3	86.2	0	0	114.4
390	S	28.8	Very low	33.3	Very low	58 Å²	58	116.6 Å²	116.6	41%	0.406	65%	0.645	S	S	.	*			trans	-165.9	112.5	145.8	-172.7	0	0	0	0	111.7	N392 L393	S390-N392 PolarHBondContact O-N 3.49Å; S390-N392 VanDerWaalsContact O-N 3.11Å; S390-N392 PolarHBondContact OG-N 3.38Å; S390-L393 PolarHBondContact O-N 3.16Å
391	P	32.5	Very low	33.6	Very low	119 Å²	119	115.4 Å²	115.4	77%	0.773	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.6	-18.9	169.1	-22.4	34.1	0	0	0	113.1	L393 H394	P391-L393 PolarHBondContact O-N 3.29Å; P391-H394 PolarHBondContact O-N 3.09Å
392	N	32.7	Very low	33.7	Very low	111 Å²	111	113.1 Å²	113.1	59%	0.594	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-3.7	-174.9	-59.6	-26.4	0	0	0	114	S390 H394 S395 F396	S390-N392 PolarHBondContact O-N 3.49Å; S390-N392 VanDerWaalsContact O-N 3.11Å; S390-N392 PolarHBondContact OG-N 3.38Å; N392-H394 PolarHBondContact O-N 3.36Å; N392-S395 WeakPolarHBondContact CA-OG 3.39Å; N392-S395 PolarHBondContact O-N 3.16Å; N392-S395 PolarHBondContact O-OG 2.89Å; N392-F396 PolarHBondContact O-N 2.85Å
393	L	35.5	Very low	34.3	Very low	111 Å²	111	112.9 Å²	112.9	58%	0.581	63%	0.631	S	S	*	*	H	α-helix	trans	-68.4	-26.8	168.2	-137.9	76.7	0	0	0	111.2	S390 P391 S395 F396 N397	S390-L393 PolarHBondContact O-N 3.16Å; P391-L393 PolarHBondContact O-N 3.29Å; L393-S395 VanDerWaalsContact C-N 3.34Å; L393-F396 PolarHBondContact O-N 3.36Å; L393-N397 PolarHBondContact O-N 2.7Å
394	H	32.5	Very low	34.9	Very low	144 Å²	144	109.2 Å²	109.2	67%	0.667	62%	0.621	S	S	*	*	H	α-helix	trans	-71.5	-29.1	176.3	-152.5	-8.9	0	0	0	112.4	P391 N392 K398	P391-H394 PolarHBondContact O-N 3.09Å; N392-H394 PolarHBondContact O-N 3.36Å; H394-K398 WeakPolarHBondContact O-CB 3.42Å; H394-K398 PolarHBondContact O-N 3.44Å
395	S	33.5	Very low	35.5	Very low	56 Å²	56	113.5 Å²	113.5	39%	0.392	62%	0.623	S	S	.	*	H	α-helix	trans	-71.4	-33	172.6	38	0	0	0	0	113.2	N392 L393 K398 I399	N392-S395 WeakPolarHBondContact CA-OG 3.39Å; N392-S395 PolarHBondContact O-N 3.16Å; N392-S395 PolarHBondContact O-OG 2.89Å; L393-S395 VanDerWaalsContact C-N 3.34Å; S395-K398 WeakPolarHBondContact O-CA 3.29Å; S395-K398 PolarHBondContact O-N 3.31Å; S395-I399 WeakPolarHBondContact O-CG1 3.21Å; S395-I399 PolarHBondContact O-N 3.39Å
396	F	34.5	Very low	36.2	Very low	143 Å²	143	113.7 Å²	113.7	63%	0.627	62%	0.615	S	S	*	*	H	α-helix	trans	-61.5	-44.9	172.8	-116.7	-89.9	0	0	0	111.3	N392 L393 K398 I399	N392-F396 PolarHBondContact O-N 2.85Å; L393-F396 PolarHBondContact O-N 3.36Å; F396-K398 PolarHBondContact O-N 3.06Å; F396-I399 PolarHBondContact O-N 3.04Å
397	N	35.3	Very low	37.4	Very low	113 Å²	113	117.6 Å²	117.6	60%	0.604	64%	0.636	S	S	*	*	H	α-helix	trans	-69.4	-9.3	171.7	-78.5	-23.2	0	0	0	114.3	L393	L393-N397 PolarHBondContact O-N 2.7Å
398	K	34.9	Very low	38.8	Very low	156 Å²	156	114.6 Å²	114.6	68%	0.678	64%	0.636	S	S	*	*	H	α-helix	trans	-97.9	-20.7	178.4	-142.2	172	-173.7	179.2	0	113.4	H394 S395 F396	H394-K398 WeakPolarHBondContact O-CB 3.42Å; H394-K398 PolarHBondContact O-N 3.44Å; S395-K398 WeakPolarHBondContact O-CA 3.29Å; S395-K398 PolarHBondContact O-N 3.31Å; F396-K398 PolarHBondContact O-N 3.06Å
399	I	38.2	Very low	40.9	Very low	113 Å²	113	116.8 Å²	116.8	58%	0.579	63%	0.632	S	S	*	*	H	α-helix	trans	-65.7	-29.3	166.2	-66.9	164.1	0	0	0	110.2	S395 F396 L401	S395-I399 WeakPolarHBondContact O-CG1 3.21Å; S395-I399 PolarHBondContact O-N 3.39Å; F396-I399 PolarHBondContact O-N 3.04Å; I399-L401 PolarHBondContact O-N 3.35Å
400	H	46.4	Very low	43.4	Very low	91 Å²	91	112 Å²	112	42%	0.421	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.7	14.4	-179.4	-93.4	-86.1	0	0	0	116.6	H413	H400-H413 AromaticContact CE1-CD2 3.66Å; H400-H413 AromaticContact CE1-NE2 3.73Å; H400-H413 AromaticContact NE2-CD2 3.86Å
401	L	35.6	Very low	46.2	Very low	144 Å²	144	112.5 Å²	112.5	75%	0.754	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130	15.9	-176	-78.4	166.2	0	0	0	114.8	I399	I399-L401 PolarHBondContact O-N 3.35Å
402	T	36.5	Very low	48.8	Very low	78 Å²	78	112.2 Å²	112.2	48%	0.479	59%	0.593	S	S	.	*			trans	-101.9	111.1	169.6	55.2	0	0	0	0	110.6	G404	T402-G404 PolarHBondContact O-N 2.92Å
403	P	39.6	Very low	51	Low	136 Å²	136	109.9 Å²	109.9	88%	0.883	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	60.3	-171.5	34.1	-37.6	0	0	0	112.8
404	G	47.4	Very low	53.5	Low	63 Å²	63	104.6 Å²	104.6	65%	0.649	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-177.3	28.5	-176	0	0	0	0	0	117	T402	T402-G404 PolarHBondContact O-N 2.92Å
405	H	44	Very low	56.1	Low	155 Å²	155	100.4 Å²	100.4	72%	0.718	53%	0.53	S	S	*	.			trans	-146.6	28.2	-178.3	-133.4	67.7	0	0	0	114.5
406	H	48.7	Very low	58.5	Low	84 Å²	84	104.1 Å²	104.1	39%	0.389	54%	0.537	S	S	.	.			trans	-94.4	-14.6	-159.1	-86.1	-77.5	0	0	0	116.8	G408	H406-G408 PolarHBondContact O-N 3.41Å
407	D	55.6	Low	60.7	Low	164 Å²	164	99.6 Å²	99.6	88%	0.877	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	6.2	-156.9	-53.2	8	0	0	0	117.3
408	G	62.8	Low	63.1	Low	63 Å²	63	94.2 Å²	94.2	65%	0.649	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.8	-9.1	-172.9	0	0	0	0	0	118	H406	H406-G408 PolarHBondContact O-N 3.41Å
409	Y	76.6	Confident	65.4	Low	166 Å²	166	89.9 Å²	89.9	65%	0.651	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	-1.4	-173.7	-63.6	-73.6	0	0	0	114.4	Y411 L412 H413	Y409-Y411 PolarHBondContact O-N 2.69Å; Y409-L412 PolarHBondContact O-N 3.01Å; Y409-H413 WeakPolarHBondContact O-CB 3.18Å; Y409-H413 PolarHBondContact O-N 2.87Å
410	E	80.5	Confident	67.5	Low	84 Å²	84	85.5 Å²	85.5	39%	0.393	45%	0.447	S	S	.	.	H	α-helix	trans	-59.7	-45	-175.3	-56.4	-163.5	158.3	0	0	113	F146 Q275 H413 A414	F146-E410 HydrophobicContact CD1-CB 4.18Å; F146-E410 HydrophobicContact CE1-CB 3.94Å; Q275-E410 PolarHBondContact NE2-OE2 2.72Å; E410-H413 PolarHBondContact O-N 2.87Å; E410-A414 WeakPolarHBondContact O-CB 3.45Å; E410-A414 PolarHBondContact O-N 3.31Å
411	Y	87	Confident	69	Low	68 Å²	68	81.9 Å²	81.9	27%	0.267	43%	0.432	S	S	.	.	H	α-helix	trans	-63.2	-43.2	178.3	176.8	-101	0	0	0	112.3	Y142 F146 H268 Y409 H413 A414 F415	Y142-Y411 AromaticContact CD2-CD2 3.84Å; Y142-Y411 HydrophobicContact CD2-CD2 3.84Å; Y142-Y411 HydrophobicContact CD2-CE2 4Å; Y142-Y411 AromaticContact CE2-CD2 3.62Å; Y142-Y411 HydrophobicContact CE2-CD2 3.62Å; Y142-Y411 HydrophobicContact CE2-CE2 4.12Å; Y142-Y411 AromaticContact CE2-CG 3.95Å; Y142-Y411 HydrophobicContact CE2-CG 3.95Å; F146-Y411 HydrophobicContact CD2-CD2 4.37Å; F146-Y411 AromaticContact CE2-CD2 3.68Å; F146-Y411 HydrophobicContact CE2-CD2 3.68Å; F146-Y411 HydrophobicContact CE2-CE2 4.48Å; F146-Y411 AromaticContact CZ-CD2 3.8Å; F146-Y411 HydrophobicContact CZ-CD2 3.8Å; F146-Y411 HydrophobicContact CZ-CG 4.44Å; H268-Y411 AromaticContact CE1-CE2 3.9Å; H268-Y411 AromaticContact ND1-CE2 3.64Å; H268-Y411 AromaticContact ND1-CZ 3.69Å; H268-Y411 PolarHBondContact ND1-OH 3.48Å; Y409-Y411 PolarHBondContact O-N 2.69Å; Y411-H413 VanDerWaalsContact C-N 3.34Å; Y411-H413 PolarHBondContact O-N 3.07Å; Y411-A414 PolarHBondContact O-N 3.37Å; Y411-F415 VanDerWaalsContact O-CB 3.31Å; Y411-F415 WeakPolarHBondContact O-CB 3.32Å; Y411-F415 PolarHBondContact O-N 2.93Å
412	L	86.7	Confident	71.3	Confident	113 Å²	113	75.4 Å²	75.4	59%	0.592	40%	0.399	S	S	*	.	H	α-helix	trans	-64.5	-40.7	178.6	-177.2	63.7	0	0	0	111.2	Y409 F415 Y416	Y409-L412 PolarHBondContact O-N 3.01Å; L412-F415 PolarHBondContact O-N 3.43Å; L412-Y416 WeakPolarHBondContact O-CB 3.34Å; L412-Y416 PolarHBondContact O-N 3.35Å
413	H	80	Confident	73.3	Confident	63 Å²	63	74.9 Å²	74.9	29%	0.292	39%	0.39	S	S	.	.	H	α-helix	trans	-63.1	-48	174.5	174.8	-103.2	0	0	0	111.6	H400 Y409 E410 Y411 F415 Y416 W417	H400-H413 AromaticContact CE1-CD2 3.66Å; H400-H413 AromaticContact CE1-NE2 3.73Å; H400-H413 AromaticContact NE2-CD2 3.86Å; Y409-H413 WeakPolarHBondContact O-CB 3.18Å; Y409-H413 PolarHBondContact O-N 2.87Å; E410-H413 PolarHBondContact O-N 2.87Å; Y411-H413 VanDerWaalsContact C-N 3.34Å; Y411-H413 PolarHBondContact O-N 3.07Å; H413-F415 VanDerWaalsContact C-N 3.33Å; H413-F415 PolarHBondContact O-N 3.06Å; H413-Y416 PolarHBondContact O-N 3.46Å; H413-W417 AromaticContact CD2-CD1 3.92Å; H413-W417 AromaticContact CD2-NE1 3.48Å; H413-W417 PolarHBondContact CD2-NE1 2.96Å; H413-W417 AromaticContact CE1-CD1 3.51Å; H413-W417 AromaticContact CE1-NE1 3.15Å; H413-W417 PolarHBondContact CE1-NE1 3.41Å; H413-W417 AromaticContact CG-CD1 3.95Å; H413-W417 AromaticContact CG-NE1 3.96Å; H413-W417 AromaticContact ND1-CD1 3.69Å; H413-W417 AromaticContact ND1-NE1 3.77Å; H413-W417 AromaticContact NE2-CD1 3.64Å; H413-W417 AromaticContact NE2-NE1 2.91Å; H413-W417 PolarHBondContact NE2-NE1 3Å; H413-W417 PolarHBondContact O-N 3.4Å
414	A	86.6	Confident	74.8	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-62.3	-38.4	176.7	0	0	0	0	0	112.7	F146 A271 F274 Q275 E410 Y411 W417 S418	F146-A414 HydrophobicContact CZ-CB 3.95Å; A271-A414 HydrophobicContact CB-CB 4.39Å; F274-A414 HydrophobicContact CD1-CB 3.96Å; Q275-A414 HydrophobicContact CB-CB 4.44Å; E410-A414 WeakPolarHBondContact O-CB 3.45Å; E410-A414 PolarHBondContact O-N 3.31Å; Y411-A414 PolarHBondContact O-N 3.37Å; A414-W417 PolarHBondContact O-N 3.37Å; A414-S418 WeakPolarHBondContact O-CB 3.45Å; A414-S418 PolarHBondContact O-N 3.34Å
415	F	87.5	Confident	75.8	Confident	56 Å²	56	73.6 Å²	73.6	25%	0.246	37%	0.368	C	S	.	.	H	α-helix	trans	-67.4	-41.3	175.5	-168.6	-90.3	0	0	0	112.2	L267 A271 Y411 L412 H413 S418 M419	L267-F415 HydrophobicContact CB-CE2 3.9Å; L267-F415 HydrophobicContact CB-CZ 4.18Å; A271-F415 HydrophobicContact CB-CB 4.29Å; A271-F415 HydrophobicContact CB-CD2 4.29Å; Y411-F415 VanDerWaalsContact O-CB 3.31Å; Y411-F415 WeakPolarHBondContact O-CB 3.32Å; Y411-F415 PolarHBondContact O-N 2.93Å; L412-F415 PolarHBondContact O-N 3.43Å; H413-F415 VanDerWaalsContact C-N 3.33Å; H413-F415 PolarHBondContact O-N 3.06Å; F415-S418 PolarHBondContact O-N 3.42Å; F415-M419 PolarHBondContact O-N 3.5Å
416	Y	84.8	Confident	76.5	Confident	133 Å²	133	68.8 Å²	68.8	52%	0.522	36%	0.361	S	S	.	.	H	α-helix	trans	-59.9	-46.6	173.3	174.3	-99.3	0	0	0	111.8	L412 H413 S418 M419 L420	L412-Y416 WeakPolarHBondContact O-CB 3.34Å; L412-Y416 PolarHBondContact O-N 3.35Å; H413-Y416 PolarHBondContact O-N 3.46Å; Y416-S418 PolarHBondContact O-N 3.44Å; Y416-M419 PolarHBondContact O-N 2.99Å; Y416-L420 HydrophobicContact CE1-CD2 4.47Å; Y416-L420 WeakPolarHBondContact O-CB 3.49Å; Y416-L420 PolarHBondContact O-N 3.15Å
417	W	80.7	Confident	77.3	Confident	48 Å²	48	67.7 Å²	67.7	18%	0.182	37%	0.372	C	S	.	.	H	α-helix	trans	-59	-47.7	174.7	-79.1	112.4	0	0	0	112.4	F274 H413 A414 M419 L420 S421 F428 P429	F274-W417 HydrophobicContact CD1-CB 4.08Å; F274-W417 HydrophobicContact CE1-CB 3.67Å; F274-W417 AromaticContact CE1-CD1 3.43Å; F274-W417 VanDerWaalsContact CE1-CD1 3.43Å; F274-W417 AromaticContact CE1-CG 3.65Å; F274-W417 HydrophobicContact CE1-CG 3.65Å; F274-W417 HydrophobicContact CE2-CB 4.2Å; F274-W417 HydrophobicContact CE2-CG 4.28Å; F274-W417 HydrophobicContact CG-CB 4.49Å; F274-W417 HydrophobicContact CZ-CB 3.73Å; F274-W417 AromaticContact CZ-CD1 3.54Å; F274-W417 HydrophobicContact CZ-CD2 4.18Å; F274-W417 AromaticContact CZ-CG 3.5Å; F274-W417 HydrophobicContact CZ-CG 3.5Å; F274-W417 VanDerWaalsContact CZ-CG 3.5Å; H413-W417 AromaticContact CD2-CD1 3.92Å; H413-W417 AromaticContact CD2-NE1 3.48Å; H413-W417 PolarHBondContact CD2-NE1 2.96Å; H413-W417 AromaticContact CE1-CD1 3.51Å; H413-W417 AromaticContact CE1-NE1 3.15Å; H413-W417 PolarHBondContact CE1-NE1 3.41Å; H413-W417 AromaticContact CG-CD1 3.95Å; H413-W417 AromaticContact CG-NE1 3.96Å; H413-W417 AromaticContact ND1-CD1 3.69Å; H413-W417 AromaticContact ND1-NE1 3.77Å; H413-W417 AromaticContact NE2-CD1 3.64Å; H413-W417 AromaticContact NE2-NE1 2.91Å; H413-W417 PolarHBondContact NE2-NE1 3Å; H413-W417 PolarHBondContact O-N 3.4Å; A414-W417 PolarHBondContact O-N 3.37Å; W417-M419 VanDerWaalsContact C-N 3.31Å; W417-M419 PolarHBondContact O-N 2.85Å; W417-L420 HydrophobicContact CE3-CD2 4.39Å; W417-L420 HydrophobicContact CZ3-CD2 4.01Å; W417-L420 PolarHBondContact O-N 3.41Å; W417-S421 WeakPolarHBondContact O-CB 3.46Å; W417-S421 PolarHBondContact O-N 2.89Å; W417-S421 PolarHBondContact O-OG 3.08Å; W417-S421 VanDerWaalsContact O-OG 3.05Å; W417-F428 HydrophobicContact CE3-CD1 4.03Å; W417-F428 HydrophobicContact CZ3-CB 4.32Å; W417-F428 AromaticContact CZ3-CD1 3.79Å; W417-F428 HydrophobicContact CZ3-CD1 3.79Å; W417-P429 HydrophobicContact CH2-CG 3.83Å; W417-P429 HydrophobicContact CZ2-CG 4.32Å; W417-P429 HydrophobicContact CZ3-CG 4.38Å
418	S	84.7	Confident	77.9	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-62.7	-33.2	178.3	175.9	0	0	0	0	113.7	L267 N270 A271 A414 F415 Y416 S421 L422	L267-S418 PolarHBondContact O-OG 3.4Å; N270-S418 WeakPolarHBondContact CB-OG 3.5Å; N270-S418 PolarHBondContact ND2-OG 2.89Å; A271-S418 PolarHBondContact N-OG 3.37Å; A414-S418 WeakPolarHBondContact O-CB 3.45Å; A414-S418 PolarHBondContact O-N 3.34Å; F415-S418 PolarHBondContact O-N 3.42Å; Y416-S418 PolarHBondContact O-N 3.44Å; S418-S421 WeakPolarHBondContact CA-OG 3.35Å; S418-S421 PolarHBondContact O-OG 2.88Å; S418-L422 WeakPolarHBondContact O-CD1 3.36Å; S418-L422 WeakPolarHBondContact O-CG 3.46Å; S418-L422 PolarHBondContact O-N 2.99Å
419	M	83.8	Confident	78	Confident	65 Å²	65	64.5 Å²	64.5	32%	0.32	34%	0.342	S	S	.	.	H	α-helix	trans	-71.5	-46.5	174.6	-178.4	176.4	174.9	0	0	110	L267 F415 Y416 W417 S421 F423	L267-M419 HydrophobicContact CD2-CB 4.38Å; F415-M419 PolarHBondContact O-N 3.5Å; Y416-M419 PolarHBondContact O-N 2.99Å; W417-M419 VanDerWaalsContact C-N 3.31Å; W417-M419 PolarHBondContact O-N 2.85Å; M419-S421 VanDerWaalsContact C-N 3.34Å; M419-S421 PolarHBondContact O-N 3.5Å; M419-F423 HydrophobicContact CG-CD2 4.03Å; M419-F423 WeakPolarHBondContact O-CB 3.48Å; M419-F423 WeakPolarHBondContact O-CD2 3.33Å; M419-F423 PolarHBondContact O-N 3.21Å; M419-F423 VanDerWaalsContact O-N 3.11Å
420	L	81.8	Confident	77.6	Confident	22 Å²	22	62 Å²	62	12%	0.115	34%	0.344	C	S	.	.	H	α-helix	trans	-61.2	-42.8	-179.5	-160.9	75.1	0	0	0	110.9	Y416 W417 F423 V425 F428	Y416-L420 HydrophobicContact CE1-CD2 4.47Å; Y416-L420 WeakPolarHBondContact O-CB 3.49Å; Y416-L420 PolarHBondContact O-N 3.15Å; W417-L420 HydrophobicContact CE3-CD2 4.39Å; W417-L420 HydrophobicContact CZ3-CD2 4.01Å; W417-L420 PolarHBondContact O-N 3.41Å; L420-F423 CarbonylContact O-C 3.57Å; L420-V425 HydrophobicContact CD1-CB 3.83Å; L420-V425 HydrophobicContact CD1-CG1 3.81Å; L420-F428 VanDerWaalsContact C-CE1 3.46Å; L420-F428 HydrophobicContact CB-CE1 3.7Å; L420-F428 HydrophobicContact CB-CZ 4.24Å; L420-F428 HydrophobicContact CD2-CD1 3.82Å; L420-F428 HydrophobicContact CD2-CE1 3.54Å; L420-F428 HydrophobicContact CD2-CZ 4.09Å; L420-F428 HydrophobicContact CG-CD1 4.25Å; L420-F428 HydrophobicContact CG-CE1 3.45Å; L420-F428 VanDerWaalsContact CG-CE1 3.45Å; L420-F428 HydrophobicContact CG-CZ 3.71Å; L420-F428 WeakPolarHBondContact O-CZ 3.32Å
421	S	78.9	Confident	77.3	Confident	15 Å²	15	59.3 Å²	59.3	11%	0.105	33%	0.334	C	S	.	.	H	α-helix	trans	-70.4	-36.4	-175.8	55.6	0	0	0	0	114.4	W417 S418 M419 E443	W417-S421 WeakPolarHBondContact O-CB 3.46Å; W417-S421 PolarHBondContact O-N 2.89Å; W417-S421 PolarHBondContact O-OG 3.08Å; W417-S421 VanDerWaalsContact O-OG 3.05Å; S418-S421 WeakPolarHBondContact CA-OG 3.35Å; S418-S421 PolarHBondContact O-OG 2.88Å; M419-S421 VanDerWaalsContact C-N 3.34Å; M419-S421 PolarHBondContact O-N 3.5Å; S421-E443 WeakPolarHBondContact CB-OE1 3.48Å; S421-E443 WeakPolarHBondContact CB-OE2 3.4Å; S421-E443 PolarHBondContact OG-OE1 3.44Å; S421-E443 PolarHBondContact OG-OE2 3.48Å
422	L	82.6	Confident	76.6	Confident	8 Å²	8	66.4 Å²	66.4	4%	0.042	37%	0.366	C	S	.	.	H	α-helix	trans	-81	-33.1	179.9	-67.8	171.9	0	0	0	113.3	F266 L267 N270 S418 E443 G447 L450	F266-L422 HydrophobicContact CD1-CD1 3.74Å; F266-L422 HydrophobicContact CE1-CD1 3.58Å; F266-L422 HydrophobicContact CE1-CD2 3.81Å; F266-L422 HydrophobicContact CE1-CG 4.37Å; L267-L422 HydrophobicContact CD2-CD1 3.8Å; N270-L422 HydrophobicContact CB-CD1 4.31Å; S418-L422 WeakPolarHBondContact O-CD1 3.36Å; S418-L422 WeakPolarHBondContact O-CG 3.46Å; S418-L422 PolarHBondContact O-N 2.99Å; L422-E443 HydrophobicContact CD2-CG 3.78Å; L422-E443 HydrophobicContact CG-CG 4.3Å; L422-G447 WeakPolarHBondContact O-CA 3.26Å; L422-L450 HydrophobicContact CD2-CD1 4.28Å
423	F	79.9	Confident	76.2	Confident	66 Å²	66	62.7 Å²	62.7	29%	0.289	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	107.9	176	-69.4	-85.4	0	0	0	108.3	L267 M419 L420 V425 M451	L267-F423 HydrophobicContact CD1-CE2 4.42Å; L267-F423 HydrophobicContact CD2-CE2 4.22Å; M419-F423 HydrophobicContact CG-CD2 4.03Å; M419-F423 WeakPolarHBondContact O-CB 3.48Å; M419-F423 WeakPolarHBondContact O-CD2 3.33Å; M419-F423 PolarHBondContact O-N 3.21Å; M419-F423 VanDerWaalsContact O-N 3.11Å; L420-F423 CarbonylContact O-C 3.57Å; F423-V425 PolarHBondContact O-N 3.24Å; F423-M451 HydrophobicContact CD1-CE 3.46Å; F423-M451 VanDerWaalsContact CD1-CE 3.46Å; F423-M451 HydrophobicContact CE1-CE 3.79Å
424	P	69.5	Low	76.4	Confident	112 Å²	112	65.1 Å²	65.1	73%	0.727	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	70.7	-164.3	27.9	-37.2	0	0	0	114.5
425	V	68.8	Low	76.2	Confident	60 Å²	60	69.8 Å²	69.8	36%	0.364	39%	0.394	S	S	.	.			trans	-103.5	102	174.2	179.1	0	0	0	0	104.9	L420 F423 F428	L420-V425 HydrophobicContact CD1-CB 3.83Å; L420-V425 HydrophobicContact CD1-CG1 3.81Å; F423-V425 PolarHBondContact O-N 3.24Å; V425-F428 WeakPolarHBondContact O-CZ 3.49Å
426	G	60.1	Low	75.8	Confident	54 Å²	54	68 Å²	68	56%	0.557	39%	0.39	S	S	*	.			trans	-61.4	152.4	-174.6	0	0	0	0	0	113.1
427	G	64.6	Low	75.8	Confident	61 Å²	61	66.8 Å²	66.8	63%	0.629	39%	0.385	S	S	*	.			trans	146.3	9	176.5	0	0	0	0	0	116.8
428	F	67.1	Low	76.1	Confident	72 Å²	72	71.1 Å²	71.1	32%	0.316	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-73.7	142.3	-176.3	-41.4	-91.8	0	0	0	113	W417 L420 V425	W417-F428 HydrophobicContact CE3-CD1 4.03Å; W417-F428 HydrophobicContact CZ3-CB 4.32Å; W417-F428 AromaticContact CZ3-CD1 3.79Å; W417-F428 HydrophobicContact CZ3-CD1 3.79Å; L420-F428 VanDerWaalsContact C-CE1 3.46Å; L420-F428 HydrophobicContact CB-CE1 3.7Å; L420-F428 HydrophobicContact CB-CZ 4.24Å; L420-F428 HydrophobicContact CD2-CD1 3.82Å; L420-F428 HydrophobicContact CD2-CE1 3.54Å; L420-F428 HydrophobicContact CD2-CZ 4.09Å; L420-F428 HydrophobicContact CG-CD1 4.25Å; L420-F428 HydrophobicContact CG-CE1 3.45Å; L420-F428 VanDerWaalsContact CG-CE1 3.45Å; L420-F428 HydrophobicContact CG-CZ 3.71Å; L420-F428 WeakPolarHBondContact O-CZ 3.32Å; V425-F428 WeakPolarHBondContact O-CZ 3.49Å
429	P	65.5	Low	76.1	Confident	88 Å²	88	72.5 Å²	72.5	57%	0.571	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-63.1	144	160.6	30.4	-34.5	0	0	0	109.1	W417	W417-P429 HydrophobicContact CH2-CG 3.83Å; W417-P429 HydrophobicContact CZ2-CG 4.32Å; W417-P429 HydrophobicContact CZ3-CG 4.38Å
430	T	69.3	Low	76.2	Confident	113 Å²	113	72.2 Å²	72.2	69%	0.693	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-64.2	130.7	177.2	43.7	0	0	0	0	110.3
431	P	73	Confident	76.5	Confident	28 Å²	28	76.7 Å²	76.7	18%	0.182	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-62	142.6	177.9	19.1	-26.4	0	0	0	110.5	A436 Y437 L440	P431-A436 HydrophobicContact CB-CB 3.56Å; P431-Y437 HydrophobicContact CB-CD2 4.28Å; P431-Y437 HydrophobicContact CB-CE2 4.27Å; P431-Y437 HydrophobicContact CG-CD1 3.71Å; P431-Y437 HydrophobicContact CG-CD2 3.91Å; P431-Y437 HydrophobicContact CG-CE1 3.68Å; P431-Y437 HydrophobicContact CG-CE2 3.88Å; P431-Y437 HydrophobicContact CG-CG 3.8Å; P431-Y437 WeakPolarHBondContact O-CE2 3.38Å; P431-Y437 VanDerWaalsContact O-CZ 3.27Å; P431-Y437 PolarHBondContact O-OH 2.87Å; P431-Y437 VanDerWaalsContact O-OH 3.06Å; P431-L440 HydrophobicContact CG-CD2 4.15Å
432	K	73.7	Confident	77	Confident	217 Å²	217	78.3 Å²	78.3	94%	0.943	44%	0.444	S	S	*	.	S	Bend	trans	-89.1	-21	-174.8	-64.5	-179.8	-177.1	173.6	0	113.7
433	C	77.8	Confident	77.2	Confident	36 Å²	36	78.3 Å²	78.3	24%	0.243	44%	0.444	C	S	.	.	S	Bend	trans	-121.5	148.3	-173.9	60.2	0	0	0	0	111.9	I435 A436 Y437	C433-I435 VanDerWaalsContact C-N 3.25Å; C433-I435 HydrophobicContact CB-CG2 4.28Å; C433-I435 PolarHBondContact O-N 3.46Å; C433-I435 VanDerWaalsContact SG-CG2 3.58Å; C433-A436 PolarHBondContact O-N 2.94Å; C433-A436 VanDerWaalsContact O-N 3.11Å; C433-A436 WeakPolarHBondContact SG-CB 3.22Å; C433-Y437 WeakPolarHBondContact O-CD2 3.28Å; C433-Y437 PolarHBondContact O-N 3.21Å
434	P	83.8	Confident	77.4	Confident	113 Å²	113	76.5 Å²	76.5	73%	0.734	44%	0.444	S	S	*	.	H	α-helix	trans	-57.8	-34	-178.5	-26.6	35.3	0	0	0	114.3	A436 Y437 F438	P434-A436 VanDerWaalsContact C-N 3.34Å; P434-A436 PolarHBondContact O-N 3.3Å; P434-Y437 PolarHBondContact O-N 2.9Å; P434-F438 PolarHBondContact O-N 3.03Å; P434-F438 VanDerWaalsContact O-N 3.1Å
435	I	81.7	Confident	78.4	Confident	98 Å²	98	74.3 Å²	74.3	50%	0.503	43%	0.428	S	S	.	.	H	α-helix	trans	-65.6	-35.9	178.6	-171.6	61.8	0	0	0	112.2	C433 F438 Y439	C433-I435 VanDerWaalsContact C-N 3.25Å; C433-I435 HydrophobicContact CB-CG2 4.28Å; C433-I435 PolarHBondContact O-N 3.46Å; C433-I435 VanDerWaalsContact SG-CG2 3.58Å; I435-F438 PolarHBondContact O-N 3.48Å; I435-Y439 WeakPolarHBondContact O-CB 3.33Å; I435-Y439 PolarHBondContact O-N 3.46Å
436	A	80.4	Confident	79.5	Confident	18 Å²	18	74.8 Å²	74.8	15%	0.149	43%	0.428	C	S	.	.	H	α-helix	trans	-73.9	-30.5	176.1	0	0	0	0	0	112.6	P431 C433 P434 L440	P431-A436 HydrophobicContact CB-CB 3.56Å; C433-A436 PolarHBondContact O-N 2.94Å; C433-A436 VanDerWaalsContact O-N 3.11Å; C433-A436 WeakPolarHBondContact SG-CB 3.22Å; P434-A436 VanDerWaalsContact C-N 3.34Å; P434-A436 PolarHBondContact O-N 3.3Å; A436-L440 VanDerWaalsContact O-CB 3.3Å; A436-L440 WeakPolarHBondContact O-CB 3.31Å; A436-L440 PolarHBondContact O-N 3.48Å
437	Y	83.4	Confident	80.8	Confident	109 Å²	109	72.3 Å²	72.3	43%	0.427	40%	0.403	S	S	.	.	H	α-helix	trans	-62.6	-45.6	168.1	-81.6	-80.2	0	0	0	111.7	P431 C433 P434 L440 I441	P431-Y437 HydrophobicContact CB-CD2 4.28Å; P431-Y437 HydrophobicContact CB-CE2 4.27Å; P431-Y437 HydrophobicContact CG-CD1 3.71Å; P431-Y437 HydrophobicContact CG-CD2 3.91Å; P431-Y437 HydrophobicContact CG-CE1 3.68Å; P431-Y437 HydrophobicContact CG-CE2 3.88Å; P431-Y437 HydrophobicContact CG-CG 3.8Å; P431-Y437 WeakPolarHBondContact O-CE2 3.38Å; P431-Y437 VanDerWaalsContact O-CZ 3.27Å; P431-Y437 PolarHBondContact O-OH 2.87Å; P431-Y437 VanDerWaalsContact O-OH 3.06Å; C433-Y437 WeakPolarHBondContact O-CD2 3.28Å; C433-Y437 PolarHBondContact O-N 3.21Å; P434-Y437 PolarHBondContact O-N 2.9Å; Y437-L440 PolarHBondContact O-N 3.35Å; Y437-I441 VanDerWaalsContact O-CG1 3.3Å; Y437-I441 WeakPolarHBondContact O-CG1 3.35Å; Y437-I441 PolarHBondContact O-N 3.44Å
438	F	87.8	Confident	82	Confident	139 Å²	139	75.5 Å²	75.5	61%	0.61	40%	0.403	S	S	*	.	H	α-helix	trans	-61.9	-46.8	177.9	179.8	-99.6	0	0	0	111.6	P434 I435 L440 I441 C442	P434-F438 PolarHBondContact O-N 3.03Å; P434-F438 VanDerWaalsContact O-N 3.1Å; I435-F438 PolarHBondContact O-N 3.48Å; F438-L440 PolarHBondContact O-N 3.31Å; F438-I441 PolarHBondContact O-N 3.42Å; F438-C442 PolarHBondContact O-N 3.01Å; F438-C442 PolarHBondContact O-SG 3.49Å
439	Y	85.6	Confident	83.1	Confident	29 Å²	29	79 Å²	79	11%	0.114	42%	0.418	C	S	.	.	H	α-helix	trans	-54.8	-52.7	174.2	172.7	-97.9	0	0	0	111.9	N270 V273 F274 I277 I435 I441 C442 E443	N270-Y439 PolarHBondContact ND2-OH 2.97Å; N270-Y439 PolarHBondContact O-OH 3.35Å; N270-Y439 PolarHBondContact OD1-OH 3.34Å; N270-Y439 VanDerWaalsContact OD1-OH 3.12Å; V273-Y439 HydrophobicContact CG1-CD2 4.34Å; V273-Y439 HydrophobicContact CG1-CE2 3.72Å; F274-Y439 HydrophobicContact CD2-CE1 4.25Å; I277-Y439 HydrophobicContact CD1-CD1 4.28Å; I277-Y439 HydrophobicContact CD1-CD2 3.21Å; I277-Y439 HydrophobicContact CD1-CE2 3.72Å; I277-Y439 HydrophobicContact CD1-CG 3.53Å; I435-Y439 WeakPolarHBondContact O-CB 3.33Å; I435-Y439 PolarHBondContact O-N 3.46Å; Y439-I441 VanDerWaalsContact C-N 3.3Å; Y439-I441 PolarHBondContact O-N 3.24Å; Y439-C442 PolarHBondContact O-N 3.47Å; Y439-E443 VanDerWaalsContact CE1-CD 3.4Å; Y439-E443 WeakPolarHBondContact CE1-OE1 3.41Å; Y439-E443 WeakPolarHBondContact CE1-OE2 3.27Å; Y439-E443 WeakPolarHBondContact O-CB 3.49Å; Y439-E443 PolarHBondContact O-N 3.06Å; Y439-E443 PolarHBondContact OH-OE1 3Å
440	L	84.7	Confident	84.2	Confident	59 Å²	59	76.6 Å²	76.6	31%	0.309	40%	0.4	S	S	.	.	H	α-helix	trans	-59.9	-36.5	-179.2	-178.4	63.7	0	0	0	112.9	P431 A436 Y437 F438 G444	P431-L440 HydrophobicContact CG-CD2 4.15Å; A436-L440 VanDerWaalsContact O-CB 3.3Å; A436-L440 WeakPolarHBondContact O-CB 3.31Å; A436-L440 PolarHBondContact O-N 3.48Å; Y437-L440 PolarHBondContact O-N 3.35Å; F438-L440 PolarHBondContact O-N 3.31Å; L440-G444 PolarHBondContact O-N 3.09Å
441	I	87.6	Confident	85	Confident	115 Å²	115	74.1 Å²	74.1	59%	0.59	38%	0.381	S	S	*	.	H	α-helix	trans	-68.3	-47.2	176.2	-68.4	165.2	0	0	0	110.8	Y437 F438 Y439 G444 V445	Y437-I441 VanDerWaalsContact O-CG1 3.3Å; Y437-I441 WeakPolarHBondContact O-CG1 3.35Å; Y437-I441 PolarHBondContact O-N 3.44Å; F438-I441 PolarHBondContact O-N 3.42Å; Y439-I441 VanDerWaalsContact C-N 3.3Å; Y439-I441 PolarHBondContact O-N 3.24Å; I441-G444 PolarHBondContact O-N 3.47Å; I441-V445 WeakPolarHBondContact O-CG2 3.46Å; I441-V445 PolarHBondContact O-N 2.95Å; I441-V445 VanDerWaalsContact O-N 3.09Å
442	C	89.4	Confident	85.8	Confident	49 Å²	49	75.5 Å²	75.5	33%	0.331	40%	0.396	S	S	.	.	H	α-helix	trans	-61.6	-44.6	176.9	-71.3	0	0	0	0	111.7	F438 Y439 V445 I446	F438-C442 PolarHBondContact O-N 3.01Å; F438-C442 PolarHBondContact O-SG 3.49Å; Y439-C442 PolarHBondContact O-N 3.47Å; C442-V445 PolarHBondContact O-N 3.09Å; C442-I446 WeakPolarHBondContact O-CD1 3.28Å; C442-I446 VanDerWaalsContact O-CG1 3.28Å; C442-I446 WeakPolarHBondContact O-CG1 3.39Å; C442-I446 PolarHBondContact O-N 3.3Å
443	E	86.5	Confident	86.6	Confident	8 Å²	8	66.8 Å²	66.8	4%	0.037	36%	0.36	C	S	.	.	H	α-helix	trans	-61.3	-45.7	177.8	-173.4	178.1	-143.7	0	0	111.8	N270 S421 L422 Y439 V445 I446 G447	N270-E443 PolarHBondContact ND2-OE1 2.94Å; S421-E443 WeakPolarHBondContact CB-OE1 3.48Å; S421-E443 WeakPolarHBondContact CB-OE2 3.4Å; S421-E443 PolarHBondContact OG-OE1 3.44Å; S421-E443 PolarHBondContact OG-OE2 3.48Å; L422-E443 HydrophobicContact CD2-CG 3.78Å; L422-E443 HydrophobicContact CG-CG 4.3Å; Y439-E443 VanDerWaalsContact CE1-CD 3.4Å; Y439-E443 WeakPolarHBondContact CE1-OE1 3.41Å; Y439-E443 WeakPolarHBondContact CE1-OE2 3.27Å; Y439-E443 WeakPolarHBondContact O-CB 3.49Å; Y439-E443 PolarHBondContact O-N 3.06Å; Y439-E443 PolarHBondContact OH-OE1 3Å; E443-V445 VanDerWaalsContact C-N 3.35Å; E443-V445 PolarHBondContact O-N 2.92Å; E443-I446 PolarHBondContact O-N 3.33Å; E443-G447 PolarHBondContact O-N 3.33Å
444	G	85.4	Confident	87	Confident	29 Å²	29	67 Å²	67	30%	0.299	36%	0.361	S	S	.	.	H	α-helix	trans	-62.1	-38.1	175.1	0	0	0	0	0	113.4	L440 I441 M448	L440-G444 PolarHBondContact O-N 3.09Å; I441-G444 PolarHBondContact O-N 3.47Å; G444-M448 WeakPolarHBondContact O-CG 3.47Å; G444-M448 PolarHBondContact O-N 3.25Å; G444-M448 VanDerWaalsContact O-N 3.1Å
445	V	90.5	Very high	87.3	Confident	65 Å²	65	66.8 Å²	66.8	39%	0.394	35%	0.353	S	S	.	.	H	α-helix	trans	-64.5	-44.6	173.2	171.9	0	0	0	0	111.2	I441 C442 E443 M448 F449	I441-V445 WeakPolarHBondContact O-CG2 3.46Å; I441-V445 PolarHBondContact O-N 2.95Å; I441-V445 VanDerWaalsContact O-N 3.09Å; C442-V445 PolarHBondContact O-N 3.09Å; E443-V445 VanDerWaalsContact C-N 3.35Å; E443-V445 PolarHBondContact O-N 2.92Å; V445-M448 HydrophobicContact CB-CE 4.47Å; V445-M448 HydrophobicContact CG2-CE 4.17Å; V445-M448 PolarHBondContact O-N 2.94Å; V445-F449 HydrophobicContact CG1-CD2 4.14Å; V445-F449 HydrophobicContact CG1-CE2 3.8Å; V445-F449 WeakPolarHBondContact O-CD2 3.41Å; V445-F449 PolarHBondContact O-N 3.27Å
446	I	90.8	Very high	87.7	Confident	70 Å²	70	63.6 Å²	63.6	36%	0.359	34%	0.344	S	S	.	.	H	α-helix	trans	-66.5	-41.4	178.4	-63.7	160.6	0	0	0	111	F266 C442 E443 M448 F449 L450	F266-I446 HydrophobicContact CE1-CG2 4.11Å; F266-I446 HydrophobicContact CE2-CG2 4.07Å; F266-I446 HydrophobicContact CZ-CG2 3.47Å; F266-I446 VanDerWaalsContact CZ-CG2 3.47Å; C442-I446 WeakPolarHBondContact O-CD1 3.28Å; C442-I446 VanDerWaalsContact O-CG1 3.28Å; C442-I446 WeakPolarHBondContact O-CG1 3.39Å; C442-I446 PolarHBondContact O-N 3.3Å; E443-I446 PolarHBondContact O-N 3.33Å; I446-M448 VanDerWaalsContact C-N 3.33Å; I446-M448 PolarHBondContact O-N 3.06Å; I446-F449 PolarHBondContact O-N 3.01Å; I446-F449 VanDerWaalsContact O-N 3.1Å; I446-L450 HydrophobicContact CG2-CD1 3.83Å; I446-L450 HydrophobicContact CG2-CG 4.16Å; I446-L450 WeakPolarHBondContact O-CG 3.49Å; I446-L450 PolarHBondContact O-N 3.48Å
447	G	88.2	Confident	88.1	Confident	2 Å²	2	64.7 Å²	64.7	2%	0.021	35%	0.346	C	S	.	.	H	α-helix	trans	-57.3	-41.4	175.1	0	0	0	0	0	113.1	L422 E443 F449 L450 M451	L422-G447 WeakPolarHBondContact O-CA 3.26Å; E443-G447 PolarHBondContact O-N 3.33Å; G447-F449 PolarHBondContact O-N 2.98Å; G447-L450 PolarHBondContact O-N 3.11Å; G447-M451 WeakPolarHBondContact O-CB 3.43Å; G447-M451 PolarHBondContact O-N 3.12Å
448	M	89.4	Confident	88.3	Confident	129 Å²	129	63.2 Å²	63.2	64%	0.635	35%	0.348	S	S	*	.	H	α-helix	trans	-59.6	-43.4	172.9	-73.8	-170.9	-69.3	0	0	112.6	G444 V445 I446 A452	G444-M448 WeakPolarHBondContact O-CG 3.47Å; G444-M448 PolarHBondContact O-N 3.25Å; G444-M448 VanDerWaalsContact O-N 3.1Å; V445-M448 HydrophobicContact CB-CE 4.47Å; V445-M448 HydrophobicContact CG2-CE 4.17Å; V445-M448 PolarHBondContact O-N 2.94Å; I446-M448 VanDerWaalsContact C-N 3.33Å; I446-M448 PolarHBondContact O-N 3.06Å; M448-A452 WeakPolarHBondContact O-CB 3.38Å; M448-A452 PolarHBondContact O-N 2.67Å
449	F	90.3	Very high	88.4	Confident	144 Å²	144	59.7 Å²	59.7	63%	0.632	34%	0.341	S	S	*	.	H	α-helix	trans	-66.7	-42.5	176.4	-75	-68.5	0	0	0	112.2	V445 I446 G447 A452 T453	V445-F449 HydrophobicContact CG1-CD2 4.14Å; V445-F449 HydrophobicContact CG1-CE2 3.8Å; V445-F449 WeakPolarHBondContact O-CD2 3.41Å; V445-F449 PolarHBondContact O-N 3.27Å; I446-F449 PolarHBondContact O-N 3.01Å; I446-F449 VanDerWaalsContact O-N 3.1Å; G447-F449 PolarHBondContact O-N 2.98Å; F449-A452 PolarHBondContact O-N 3.18Å; F449-T453 PolarHBondContact O-N 2.98Å; F449-T453 PolarHBondContact O-OG1 3.47Å
450	L	88.7	Confident	88.5	Confident	38 Å²	38	62.4 Å²	62.4	20%	0.199	36%	0.357	C	S	.	.	H	α-helix	trans	-63.3	-43.6	178	-67.3	169.8	0	0	0	111.7	Y263 F266 L422 I446 G447 A452 T453 V454	Y263-L450 HydrophobicContact CD1-CD2 4.05Å; Y263-L450 HydrophobicContact CE1-CB 4.18Å; Y263-L450 HydrophobicContact CE1-CD2 3.74Å; Y263-L450 PolarHBondContact OH-O 3.28Å; F266-L450 HydrophobicContact CD1-CD1 3.5Å; F266-L450 HydrophobicContact CE1-CD1 3.47Å; F266-L450 VanDerWaalsContact CE1-CD1 3.47Å; F266-L450 HydrophobicContact CG-CD1 4.09Å; F266-L450 HydrophobicContact CZ-CD1 4.02Å; L422-L450 HydrophobicContact CD2-CD1 4.28Å; I446-L450 HydrophobicContact CG2-CD1 3.83Å; I446-L450 HydrophobicContact CG2-CG 4.16Å; I446-L450 WeakPolarHBondContact O-CG 3.49Å; I446-L450 PolarHBondContact O-N 3.48Å; G447-L450 PolarHBondContact O-N 3.11Å; L450-A452 VanDerWaalsContact C-N 3.34Å; L450-A452 PolarHBondContact O-N 2.94Å; L450-T453 WeakPolarHBondContact CA-OG1 3.32Å; L450-T453 PolarHBondContact O-N 3.14Å; L450-T453 PolarHBondContact O-OG1 2.88Å; L450-V454 WeakPolarHBondContact O-CG2 3.39Å; L450-V454 PolarHBondContact O-N 2.69Å
451	M	86	Confident	88.6	Confident	61 Å²	61	61.8 Å²	61.8	30%	0.3	35%	0.354	S	S	.	.	H	α-helix	trans	-61.3	-42.8	174.6	-179.8	57	70.6	0	0	111.7	F423 G447 T453 V454 L455	F423-M451 HydrophobicContact CD1-CE 3.46Å; F423-M451 VanDerWaalsContact CD1-CE 3.46Å; F423-M451 HydrophobicContact CE1-CE 3.79Å; G447-M451 WeakPolarHBondContact O-CB 3.43Å; G447-M451 PolarHBondContact O-N 3.12Å; M451-T453 VanDerWaalsContact C-N 3.34Å; M451-T453 PolarHBondContact O-N 3.33Å; M451-V454 PolarHBondContact O-N 3.11Å; M451-L455 HydrophobicContact CG-CD1 4.18Å; M451-L455 WeakPolarHBondContact O-CG 3.46Å; M451-L455 PolarHBondContact O-N 2.95Å; M451-L455 VanDerWaalsContact O-N 3.07Å; M451-L455 HydrophobicContact SD-CD1 4.2Å; M451-L455 HydrophobicContact SD-CG 4.21Å
452	A	90.9	Very high	88.5	Confident	58 Å²	58	60.5 Å²	60.5	48%	0.479	35%	0.351	S	S	.	.	H	α-helix	trans	-61.2	-40.3	176.1	0	0	0	0	0	112.2	M448 F449 L450 G456	M448-A452 WeakPolarHBondContact O-CB 3.38Å; M448-A452 PolarHBondContact O-N 2.67Å; F449-A452 PolarHBondContact O-N 3.18Å; L450-A452 VanDerWaalsContact C-N 3.34Å; L450-A452 PolarHBondContact O-N 2.94Å; A452-G456 PolarHBondContact O-N 3.48Å
453	T	89.4	Confident	88.4	Confident	33 Å²	33	61 Å²	61	20%	0.202	35%	0.353	C	S	.	.	H	α-helix	trans	-68.6	-38.3	175.8	51.8	0	0	0	0	112.4	Y263 F449 L450 M451 G456 H457	Y263-T453 WeakPolarHBondContact OH-CB 3.33Å; Y263-T453 PolarHBondContact OH-OG1 3.22Å; F449-T453 PolarHBondContact O-N 2.98Å; F449-T453 PolarHBondContact O-OG1 3.47Å; L450-T453 WeakPolarHBondContact CA-OG1 3.32Å; L450-T453 PolarHBondContact O-N 3.14Å; L450-T453 PolarHBondContact O-OG1 2.88Å; M451-T453 VanDerWaalsContact C-N 3.34Å; M451-T453 PolarHBondContact O-N 3.33Å; T453-G456 PolarHBondContact O-N 3.08Å; T453-H457 WeakPolarHBondContact O-CB 3.47Å; T453-H457 PolarHBondContact O-CD2 3.2Å; T453-H457 VanDerWaalsContact O-CD2 3.24Å; T453-H457 PolarHBondContact O-N 3.48Å
454	V	87.5	Confident	88.2	Confident	41 Å²	41	63.2 Å²	63.2	25%	0.248	37%	0.365	C	S	.	.	H	α-helix	trans	-56.5	-53.4	173.5	174.5	0	0	0	0	110.1	Y263 L450 M451 G456 H457 V458	Y263-V454 HydrophobicContact CD2-CG2 4.21Å; Y263-V454 HydrophobicContact CE1-CG2 4Å; Y263-V454 HydrophobicContact CE2-CG2 3.43Å; Y263-V454 VanDerWaalsContact CE2-CG2 3.43Å; Y263-V454 WeakPolarHBondContact OH-CG2 3.43Å; Y263-V454 PolarHBondContact OH-N 3.38Å; L450-V454 WeakPolarHBondContact O-CG2 3.39Å; L450-V454 PolarHBondContact O-N 2.69Å; M451-V454 PolarHBondContact O-N 3.11Å; V454-G456 VanDerWaalsContact C-N 3.35Å; V454-G456 PolarHBondContact O-N 3.12Å; V454-H457 PolarHBondContact O-N 3.37Å; V454-V458 HydrophobicContact CG1-CG2 4.42Å; V454-V458 WeakPolarHBondContact O-CG2 3.41Å; V454-V458 PolarHBondContact O-N 3.42Å
455	L	89	Confident	87.9	Confident	108 Å²	108	66.8 Å²	66.8	57%	0.565	38%	0.381	S	S	*	.	H	α-helix	trans	-63.4	-39.8	-177.7	-67.2	172.5	0	0	0	112.1	M451 S459	M451-L455 HydrophobicContact CG-CD1 4.18Å; M451-L455 WeakPolarHBondContact O-CG 3.46Å; M451-L455 PolarHBondContact O-N 2.95Å; M451-L455 VanDerWaalsContact O-N 3.07Å; M451-L455 HydrophobicContact SD-CD1 4.2Å; M451-L455 HydrophobicContact SD-CG 4.21Å; L455-S459 VanDerWaalsContact O-CB 3.29Å; L455-S459 WeakPolarHBondContact O-CB 3.47Å; L455-S459 PolarHBondContact O-N 3.47Å
456	G	90.9	Very high	87.4	Confident	32 Å²	32	64.7 Å²	64.7	33%	0.33	37%	0.369	S	S	.	.	H	α-helix	trans	-60.6	-44.7	173.5	0	0	0	0	0	112.8	A452 T453 V454 S459 N460	A452-G456 PolarHBondContact O-N 3.48Å; T453-G456 PolarHBondContact O-N 3.08Å; V454-G456 VanDerWaalsContact C-N 3.35Å; V454-G456 PolarHBondContact O-N 3.12Å; G456-S459 PolarHBondContact O-N 2.96Å; G456-N460 WeakPolarHBondContact O-CB 3.44Å; G456-N460 VanDerWaalsContact O-CG 3.29Å; G456-N460 PolarHBondContact O-N 3.31Å; G456-N460 PolarHBondContact O-ND2 3.31Å
457	H	88.4	Confident	87	Confident	41 Å²	41	62.5 Å²	62.5	19%	0.19	36%	0.361	C	S	.	.	H	α-helix	trans	-66.8	-43.7	177.6	-87.3	-81.5	0	0	0	113.1	L259 T453 V454 S459 N460 I461	L259-H457 HydrophobicContact CD2-CB 3.44Å; L259-H457 VanDerWaalsContact CD2-CB 3.44Å; T453-H457 WeakPolarHBondContact O-CB 3.47Å; T453-H457 PolarHBondContact O-CD2 3.2Å; T453-H457 VanDerWaalsContact O-CD2 3.24Å; T453-H457 PolarHBondContact O-N 3.48Å; V454-H457 PolarHBondContact O-N 3.37Å; H457-S459 VanDerWaalsContact C-N 3.33Å; H457-S459 PolarHBondContact O-N 3.28Å; H457-N460 PolarHBondContact O-N 3.12Å; H457-I461 WeakPolarHBondContact O-CG1 3.15Å; H457-I461 PolarHBondContact O-N 3.47Å
458	V	88.1	Confident	86.5	Confident	77 Å²	77	64.7 Å²	64.7	47%	0.467	38%	0.379	S	S	.	.	H	α-helix	trans	-61.2	-43.6	175.5	173.6	0	0	0	0	110.6	V454 N460 I461 V462	V454-V458 HydrophobicContact CG1-CG2 4.42Å; V454-V458 WeakPolarHBondContact O-CG2 3.41Å; V454-V458 PolarHBondContact O-N 3.42Å; V458-N460 VanDerWaalsContact C-N 3.35Å; V458-N460 PolarHBondContact O-N 2.94Å; V458-I461 PolarHBondContact O-N 3.03Å; V458-V462 HydrophobicContact CG1-CG2 4.46Å; V458-V462 WeakPolarHBondContact O-CG2 3.39Å; V458-V462 PolarHBondContact O-N 3.23Å
459	S	89.5	Confident	86.1	Confident	65 Å²	65	64.3 Å²	64.3	46%	0.455	38%	0.376	S	S	.	.	H	α-helix	trans	-59.1	-43	174	-174.8	0	0	0	0	112.5	L455 G456 H457 I461 V462 T463	L455-S459 VanDerWaalsContact O-CB 3.29Å; L455-S459 WeakPolarHBondContact O-CB 3.47Å; L455-S459 PolarHBondContact O-N 3.47Å; G456-S459 PolarHBondContact O-N 2.96Å; H457-S459 VanDerWaalsContact C-N 3.33Å; H457-S459 PolarHBondContact O-N 3.28Å; S459-I461 VanDerWaalsContact C-N 3.35Å; S459-I461 PolarHBondContact O-N 2.9Å; S459-V462 PolarHBondContact O-N 3.2Å; S459-T463 WeakPolarHBondContact O-CB 3.25Å; S459-T463 WeakPolarHBondContact O-CG2 3.47Å; S459-T463 PolarHBondContact O-N 2.72Å; S459-T463 PolarHBondContact O-OG1 3Å
460	N	88.1	Confident	85.8	Confident	86 Å²	86	62.9 Å²	62.9	46%	0.46	37%	0.369	S	S	.	.	H	α-helix	trans	-64.2	-35.6	175.7	-76.2	-22.7	0	0	0	112.8	G456 H457 V458 T463 N464	G456-N460 WeakPolarHBondContact O-CB 3.44Å; G456-N460 VanDerWaalsContact O-CG 3.29Å; G456-N460 PolarHBondContact O-N 3.31Å; G456-N460 PolarHBondContact O-ND2 3.31Å; H457-N460 PolarHBondContact O-N 3.12Å; V458-N460 VanDerWaalsContact C-N 3.35Å; V458-N460 PolarHBondContact O-N 2.94Å; N460-T463 WeakPolarHBondContact CA-OG1 3.34Å; N460-T463 PolarHBondContact O-OG1 3.24Å; N460-T463 VanDerWaalsContact O-OG1 3.13Å; N460-N464 WeakPolarHBondContact O-CB 3.47Å; N460-N464 VanDerWaalsContact O-CG 3.29Å; N460-N464 PolarHBondContact O-N 2.75Å; N460-N464 VanDerWaalsContact O-N 3.12Å; N460-N464 PolarHBondContact O-ND2 2.97Å
461	I	85.3	Confident	85.5	Confident	46 Å²	46	64.7 Å²	64.7	24%	0.236	38%	0.377	C	S	.	.	H	α-helix	trans	-69.3	-49.5	175.2	-66	158.7	0	0	0	110.2	S256 H457 V458 S459 T463 N464 V465	S256-I461 VanDerWaalsContact OG-CD1 3.23Å; S256-I461 WeakPolarHBondContact OG-CD1 3.46Å; H457-I461 WeakPolarHBondContact O-CG1 3.15Å; H457-I461 PolarHBondContact O-N 3.47Å; V458-I461 PolarHBondContact O-N 3.03Å; S459-I461 VanDerWaalsContact C-N 3.35Å; S459-I461 PolarHBondContact O-N 2.9Å; I461-T463 VanDerWaalsContact C-N 3.32Å; I461-T463 PolarHBondContact O-N 3.16Å; I461-N464 PolarHBondContact O-N 2.85Å; I461-V465 HydrophobicContact CG2-CG2 4.24Å; I461-V465 WeakPolarHBondContact O-CB 3.48Å; I461-V465 WeakPolarHBondContact O-CG2 3.32Å; I461-V465 PolarHBondContact O-N 2.88Å
462	V	85.1	Confident	85.4	Confident	88 Å²	88	62.5 Å²	62.5	53%	0.533	37%	0.366	S	S	.	.	H	α-helix	trans	-59.3	-42.5	179.8	171.5	0	0	0	0	111.3	V458 S459 S466	V458-V462 HydrophobicContact CG1-CG2 4.46Å; V458-V462 WeakPolarHBondContact O-CG2 3.39Å; V458-V462 PolarHBondContact O-N 3.23Å; S459-V462 PolarHBondContact O-N 3.2Å; V462-S466 WeakPolarHBondContact O-CB 3.47Å; V462-S466 PolarHBondContact O-N 2.93Å; V462-S466 VanDerWaalsContact O-N 3.08Å; V462-S466 PolarHBondContact O-OG 3.08Å
463	T	88.4	Confident	85.2	Confident	59 Å²	59	63.6 Å²	63.6	36%	0.362	36%	0.361	S	S	.	.	H	α-helix	trans	-67.8	-42.1	177.8	49	0	0	0	0	112.9	S459 N460 I461 S466 A467	S459-T463 WeakPolarHBondContact O-CB 3.25Å; S459-T463 WeakPolarHBondContact O-CG2 3.47Å; S459-T463 PolarHBondContact O-N 2.72Å; S459-T463 PolarHBondContact O-OG1 3Å; N460-T463 WeakPolarHBondContact CA-OG1 3.34Å; N460-T463 PolarHBondContact O-OG1 3.24Å; N460-T463 VanDerWaalsContact O-OG1 3.13Å; I461-T463 VanDerWaalsContact C-N 3.32Å; I461-T463 PolarHBondContact O-N 3.16Å; T463-S466 PolarHBondContact O-OG 3.21Å; T463-A467 PolarHBondContact O-N 2.88Å; T463-A467 VanDerWaalsContact O-N 3.11Å
464	N	82.9	Confident	85.3	Confident	56 Å²	56	65 Å²	65	30%	0.299	38%	0.375	S	S	.	.	H	α-helix	trans	-66.9	-43.1	176.9	-77.7	-47.1	0	0	0	112.9	N460 I461 A467	N460-N464 WeakPolarHBondContact O-CB 3.47Å; N460-N464 VanDerWaalsContact O-CG 3.29Å; N460-N464 PolarHBondContact O-N 2.75Å; N460-N464 VanDerWaalsContact O-N 3.12Å; N460-N464 PolarHBondContact O-ND2 2.97Å; I461-N464 PolarHBondContact O-N 2.85Å; N464-A467 WeakPolarHBondContact O-CB 3.48Å; N464-A467 PolarHBondContact O-N 2.79Å
465	V	77.5	Confident	85.2	Confident	103 Å²	103	67.3 Å²	67.3	62%	0.624	38%	0.38	S	S	*	.	H	α-helix	trans	-67	-38.9	179.1	173.2	0	0	0	0	111.4	I461 A467	I461-V465 HydrophobicContact CG2-CG2 4.24Å; I461-V465 WeakPolarHBondContact O-CB 3.48Å; I461-V465 WeakPolarHBondContact O-CG2 3.32Å; I461-V465 PolarHBondContact O-N 2.88Å; V465-A467 VanDerWaalsContact C-N 3.33Å; V465-A467 PolarHBondContact O-N 2.83Å
466	S	81.6	Confident	85.2	Confident	22 Å²	22	62.7 Å²	62.7	15%	0.154	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-2.8	177.7	59.6	0	0	0	0	114.8	V462 T463 A468 Q469 K470	V462-S466 WeakPolarHBondContact O-CB 3.47Å; V462-S466 PolarHBondContact O-N 2.93Å; V462-S466 VanDerWaalsContact O-N 3.08Å; V462-S466 PolarHBondContact O-OG 3.08Å; T463-S466 PolarHBondContact O-OG 3.21Å; S466-A468 PolarHBondContact O-N 3.37Å; S466-Q469 PolarHBondContact O-N 3.21Å; S466-K470 WeakPolarHBondContact O-CB 3.47Å; S466-K470 WeakPolarHBondContact O-CG 3.49Å; S466-K470 PolarHBondContact O-N 3.39Å; S466-K470 WeakPolarHBondContact OG-CE 3.48Å; S466-K470 PolarHBondContact OG-NZ 2.84Å
467	A	81.9	Confident	85.3	Confident	24 Å²	24	64 Å²	64	20%	0.198	36%	0.355	C	S	.	.	H	α-helix	trans	-58.5	-49.3	-171.6	0	0	0	0	0	113.2	T463 N464 V465 Q469 K470 E471	T463-A467 PolarHBondContact O-N 2.88Å; T463-A467 VanDerWaalsContact O-N 3.11Å; N464-A467 WeakPolarHBondContact O-CB 3.48Å; N464-A467 PolarHBondContact O-N 2.79Å; V465-A467 VanDerWaalsContact C-N 3.33Å; V465-A467 PolarHBondContact O-N 2.83Å; A467-Q469 PolarHBondContact O-N 2.86Å; A467-K470 PolarHBondContact O-N 2.9Å; A467-E471 PolarHBondContact O-N 3.12Å
468	A	77.2	Confident	85.4	Confident	47 Å²	47	64.3 Å²	64.3	39%	0.388	36%	0.362	S	S	.	.	H	α-helix	trans	-64.8	-37.9	-178.8	0	0	0	0	0	112.8	S466 E471 F472	S466-A468 PolarHBondContact O-N 3.37Å; A468-E471 PolarHBondContact O-N 3.45Å; A468-F472 PolarHBondContact O-N 2.9Å
469	Q	81.5	Confident	85.7	Confident	122 Å²	122	62.6 Å²	62.6	57%	0.57	35%	0.351	S	S	*	.	H	α-helix	trans	-69.5	-41.3	177	-171.9	-179.4	2.1	0	0	111.4	S466 A467 F472 Q473 W504	S466-Q469 PolarHBondContact O-N 3.21Å; A467-Q469 PolarHBondContact O-N 2.86Å; Q469-F472 PolarHBondContact O-N 2.88Å; Q469-Q473 VanDerWaalsContact O-CB 3.31Å; Q469-Q473 WeakPolarHBondContact O-CB 3.47Å; Q469-Q473 PolarHBondContact O-N 3.42Å; Q469-W504 HydrophobicContact CB-CH2 4.01Å; Q469-W504 HydrophobicContact CB-CZ2 4.42Å; Q469-W504 HydrophobicContact CG-CH2 4.4Å; Q469-W504 HydrophobicContact CG-CZ2 4.43Å
470	K	83.6	Confident	85.8	Confident	113 Å²	113	63.2 Å²	63.2	49%	0.491	35%	0.346	S	S	.	.	H	α-helix	trans	-62.3	-41.5	173.8	-76.7	169.4	174.2	160.7	0	112.1	S466 A467 A474	S466-K470 WeakPolarHBondContact O-CB 3.47Å; S466-K470 WeakPolarHBondContact O-CG 3.49Å; S466-K470 PolarHBondContact O-N 3.39Å; S466-K470 WeakPolarHBondContact OG-CE 3.48Å; S466-K470 PolarHBondContact OG-NZ 2.84Å; A467-K470 PolarHBondContact O-N 2.9Å; K470-A474 WeakPolarHBondContact O-CB 3.32Å; K470-A474 PolarHBondContact O-N 3.34Å
471	E	82.6	Confident	86.1	Confident	76 Å²	76	64.5 Å²	64.5	36%	0.355	35%	0.353	S	S	.	.	H	α-helix	trans	-64.4	-45.1	176.5	-169.2	-177.2	168.6	0	0	111.7	A467 A468 A474 R475	A467-E471 PolarHBondContact O-N 3.12Å; A468-E471 PolarHBondContact O-N 3.45Å; E471-A474 PolarHBondContact O-N 3.05Å; E471-R475 VanDerWaalsContact O-CG 3.32Å; E471-R475 WeakPolarHBondContact O-CG 3Å; E471-R475 PolarHBondContact O-N 2.96Å; E471-R475 VanDerWaalsContact O-N 3.09Å; E471-R475 IonicContact OE1-CZ 3.34Å; E471-R475 IonicContact OE1-NE 2.7Å; E471-R475 PolarHBondContact OE1-NE 3.15Å; E471-R475 IonicContact OE1-NH2 2.66Å; E471-R475 PolarHBondContact OE1-NH2 3.12Å
472	F	83.2	Confident	86.5	Confident	16 Å²	16	69.1 Å²	69.1	7%	0.07	37%	0.368	C	S	.	.	H	α-helix	trans	-61	-48.7	175	173.6	-109.7	0	0	0	112.2	A468 Q469 A474 R475 L476 F500 W504 I509	A468-F472 PolarHBondContact O-N 2.9Å; Q469-F472 PolarHBondContact O-N 2.88Å; F472-A474 VanDerWaalsContact C-N 3.34Å; F472-A474 PolarHBondContact O-N 3.36Å; F472-R475 WeakPolarHBondContact O-CB 3.44Å; F472-R475 PolarHBondContact O-N 2.87Å; F472-R475 VanDerWaalsContact O-N 3.15Å; F472-L476 HydrophobicContact CZ-CD1 4.29Å; F472-L476 WeakPolarHBondContact O-CB 3.3Å; F472-L476 PolarHBondContact O-N 3.45Å; F472-F500 HydrophobicContact CE2-CB 4.33Å; F472-F500 AromaticContact CE2-CD1 3.92Å; F472-F500 HydrophobicContact CE2-CD1 3.92Å; F472-F500 HydrophobicContact CZ-CB 4.31Å; F472-W504 HydrophobicContact CB-CE3 3.64Å; F472-W504 HydrophobicContact CB-CH2 4.48Å; F472-W504 HydrophobicContact CB-CZ3 3.51Å; F472-W504 AromaticContact CD1-CD2 3.95Å; F472-W504 HydrophobicContact CD1-CD2 3.95Å; F472-W504 AromaticContact CD1-CE3 3.63Å; F472-W504 HydrophobicContact CD1-CE3 3.63Å; F472-W504 HydrophobicContact CD1-CG 4.39Å; F472-W504 HydrophobicContact CD1-CZ3 4.16Å; F472-W504 AromaticContact CD2-CE3 3.87Å; F472-W504 HydrophobicContact CD2-CE3 3.87Å; F472-W504 HydrophobicContact CE1-CB 4.1Å; F472-W504 HydrophobicContact CE1-CD2 4.15Å; F472-W504 HydrophobicContact CE1-CE3 4.2Å; F472-W504 HydrophobicContact CE1-CG 4.1Å; F472-W504 HydrophobicContact CE2-CB 4.01Å; F472-W504 HydrophobicContact CE2-CE3 4.37Å; F472-W504 HydrophobicContact CG-CD2 4.19Å; F472-W504 AromaticContact CG-CE3 3.42Å; F472-W504 HydrophobicContact CG-CE3 3.42Å; F472-W504 VanDerWaalsContact CG-CE3 3.42Å; F472-W504 AromaticContact CG-CZ3 3.85Å; F472-W504 HydrophobicContact CG-CZ3 3.85Å; F472-W504 HydrophobicContact CZ-CB 3.72Å; F472-W504 HydrophobicContact CZ-CG 4.23Å; F472-I509 HydrophobicContact CD2-CD1 3.35Å; F472-I509 HydrophobicContact CD2-CG1 4.35Å; F472-I509 HydrophobicContact CE2-CD1 3.51Å; F472-I509 HydrophobicContact CE2-CG1 4.44Å; F472-I509 HydrophobicContact CG-CD1 4.21Å
473	Q	88.1	Confident	87	Confident	81 Å²	81	65.5 Å²	65.5	38%	0.379	35%	0.345	S	S	.	.	H	α-helix	trans	-59.1	-45.1	179	-173	61.8	38.7	0	0	111.4	Q469 R475 L476 D477	Q469-Q473 VanDerWaalsContact O-CB 3.31Å; Q469-Q473 WeakPolarHBondContact O-CB 3.47Å; Q469-Q473 PolarHBondContact O-N 3.42Å; Q473-R475 VanDerWaalsContact C-N 3.32Å; Q473-R475 PolarHBondContact O-N 2.72Å; Q473-L476 WeakPolarHBondContact O-CB 3.14Å; Q473-L476 PolarHBondContact O-N 3.36Å; Q473-D477 VanDerWaalsContact NE2-CG 3.32Å; Q473-D477 PolarHBondContact NE2-OD1 3.2Å; Q473-D477 PolarHBondContact NE2-OD2 3.1Å; Q473-D477 WeakPolarHBondContact O-CB 3.49Å; Q473-D477 VanDerWaalsContact O-CG 3.24Å; Q473-D477 PolarHBondContact O-N 2.95Å
474	A	89.8	Confident	87.1	Confident	61 Å²	61	66.5 Å²	66.5	50%	0.504	36%	0.355	S	S	.	.	H	α-helix	trans	-61.7	-37.1	176.8	0	0	0	0	0	113.1	K470 E471 F472 S478	K470-A474 WeakPolarHBondContact O-CB 3.32Å; K470-A474 PolarHBondContact O-N 3.34Å; E471-A474 PolarHBondContact O-N 3.05Å; F472-A474 VanDerWaalsContact C-N 3.34Å; F472-A474 PolarHBondContact O-N 3.36Å; A474-S478 WeakPolarHBondContact O-CB 2.84Å; A474-S478 PolarHBondContact O-N 2.91Å
475	R	86.2	Confident	87.7	Confident	91 Å²	91	70.2 Å²	70.2	34%	0.343	37%	0.374	S	S	.	.	H	α-helix	trans	-66.7	-46.6	173.2	-68.9	172.1	-177.2	-162.4	7.8	111.3	E471 F472 Q473 D477 S478 V479 I509	E471-R475 VanDerWaalsContact O-CG 3.32Å; E471-R475 WeakPolarHBondContact O-CG 3Å; E471-R475 PolarHBondContact O-N 2.96Å; E471-R475 VanDerWaalsContact O-N 3.09Å; E471-R475 IonicContact OE1-CZ 3.34Å; E471-R475 IonicContact OE1-NE 2.7Å; E471-R475 PolarHBondContact OE1-NE 3.15Å; E471-R475 IonicContact OE1-NH2 2.66Å; E471-R475 PolarHBondContact OE1-NH2 3.12Å; F472-R475 WeakPolarHBondContact O-CB 3.44Å; F472-R475 PolarHBondContact O-N 2.87Å; F472-R475 VanDerWaalsContact O-N 3.15Å; Q473-R475 VanDerWaalsContact C-N 3.32Å; Q473-R475 PolarHBondContact O-N 2.72Å; R475-D477 PolarHBondContact O-N 3.26Å; R475-S478 WeakPolarHBondContact O-CB 3.43Å; R475-S478 PolarHBondContact O-N 3.27Å; R475-V479 WeakPolarHBondContact O-CG2 3.45Å; R475-V479 PolarHBondContact O-N 3.12Å; R475-V479 VanDerWaalsContact O-N 3.09Å; R475-I509 VanDerWaalsContact NH1-CG2 3.32Å
476	L	89.4	Confident	88.5	Confident	10 Å²	10	73.2 Å²	73.2	5%	0.052	37%	0.374	C	S	.	.	H	α-helix	trans	-58.6	-46.6	177.8	-172.2	91	0	0	0	111.2	F472 Q473 V479 K480 F500	F472-L476 HydrophobicContact CZ-CD1 4.29Å; F472-L476 WeakPolarHBondContact O-CB 3.3Å; F472-L476 PolarHBondContact O-N 3.45Å; Q473-L476 WeakPolarHBondContact O-CB 3.14Å; Q473-L476 PolarHBondContact O-N 3.36Å; L476-V479 PolarHBondContact O-N 2.93Å; L476-K480 HydrophobicContact CD2-CD 4.3Å; L476-K480 VanDerWaalsContact CD2-NZ 3.3Å; L476-K480 HydrophobicContact CG-CD 4.28Å; L476-K480 WeakPolarHBondContact O-CG 3.32Å; L476-K480 PolarHBondContact O-N 3.04Å; L476-F500 HydrophobicContact CD1-CB 3.63Å; L476-F500 HydrophobicContact CD1-CD1 4.29Å; L476-F500 HydrophobicContact CD1-CG 3.94Å
477	D	92.1	Very high	89.1	Confident	61 Å²	61	83.1 Å²	83.1	33%	0.326	41%	0.408	S	S	.	.	H	α-helix	trans	-68	-35.6	-180	-67.2	-24.5	0	0	0	111.8	Q473 R475 V479 K480 N481	Q473-D477 VanDerWaalsContact NE2-CG 3.32Å; Q473-D477 PolarHBondContact NE2-OD1 3.2Å; Q473-D477 PolarHBondContact NE2-OD2 3.1Å; Q473-D477 WeakPolarHBondContact O-CB 3.49Å; Q473-D477 VanDerWaalsContact O-CG 3.24Å; Q473-D477 PolarHBondContact O-N 2.95Å; R475-D477 PolarHBondContact O-N 3.26Å; D477-V479 PolarHBondContact O-N 2.87Å; D477-K480 PolarHBondContact O-N 2.69Å; D477-N481 VanDerWaalsContact O-CB 3.28Å; D477-N481 WeakPolarHBondContact O-CB 3.41Å; D477-N481 PolarHBondContact O-N 3.05Å; D477-N481 PolarHBondContact O-ND2 3.35Å; D477-N481 VanDerWaalsContact O-ND2 3.08Å
478	S	92.2	Very high	89.6	Confident	47 Å²	47	83.4 Å²	83.4	33%	0.329	41%	0.407	S	S	.	.	H	α-helix	trans	-59.5	-44.6	171	-172.2	0	0	0	0	112	A474 R475 N481 Y482	A474-S478 WeakPolarHBondContact O-CB 2.84Å; A474-S478 PolarHBondContact O-N 2.91Å; R475-S478 WeakPolarHBondContact O-CB 3.43Å; R475-S478 PolarHBondContact O-N 3.27Å; S478-N481 PolarHBondContact O-N 2.84Å; S478-Y482 PolarHBondContact O-N 2.87Å
479	V	92.8	Very high	90.5	Very high	41 Å²	41	85.2 Å²	85.2	25%	0.248	42%	0.415	C	S	.	.	H	α-helix	trans	-69.4	-42.3	177.7	176	0	0	0	0	111.7	R475 L476 D477 N481 Y482 M483 V496 F500	R475-V479 WeakPolarHBondContact O-CG2 3.45Å; R475-V479 PolarHBondContact O-N 3.12Å; R475-V479 VanDerWaalsContact O-N 3.09Å; L476-V479 PolarHBondContact O-N 2.93Å; D477-V479 PolarHBondContact O-N 2.87Å; V479-N481 VanDerWaalsContact C-N 3.35Å; V479-N481 PolarHBondContact O-N 2.7Å; V479-Y482 WeakPolarHBondContact O-CB 3.26Å; V479-Y482 PolarHBondContact O-N 2.61Å; V479-M483 HydrophobicContact CG1-CE 4.18Å; V479-M483 HydrophobicContact CG1-CG 4.42Å; V479-M483 HydrophobicContact CG1-SD 4.35Å; V479-M483 WeakPolarHBondContact O-CG 3.36Å; V479-M483 PolarHBondContact O-N 3.08Å; V479-V496 HydrophobicContact CG1-CG1 3.86Å; V479-F500 HydrophobicContact CB-CE2 4.36Å; V479-F500 HydrophobicContact CG1-CE2 4.08Å; V479-F500 HydrophobicContact CG2-CE2 4.09Å; V479-F500 HydrophobicContact CG2-CZ 3.83Å
480	K	92.6	Very high	91	Very high	77 Å²	77	83 Å²	83	34%	0.335	42%	0.418	S	S	.	.	H	α-helix	trans	-58.3	-45.2	173.5	-74.9	174.5	175.5	177.9	0	111.8	L476 D477 Y482 M483 S484	L476-K480 HydrophobicContact CD2-CD 4.3Å; L476-K480 VanDerWaalsContact CD2-NZ 3.3Å; L476-K480 HydrophobicContact CG-CD 4.28Å; L476-K480 WeakPolarHBondContact O-CG 3.32Å; L476-K480 PolarHBondContact O-N 3.04Å; D477-K480 PolarHBondContact O-N 2.69Å; K480-Y482 PolarHBondContact O-N 3.37Å; K480-M483 HydrophobicContact CG-CE 4.34Å; K480-M483 PolarHBondContact O-N 3.11Å; K480-S484 WeakPolarHBondContact O-CB 3.47Å; K480-S484 PolarHBondContact O-N 3.4Å
481	N	93.4	Very high	91.4	Very high	114 Å²	114	81.8 Å²	81.8	61%	0.61	42%	0.423	S	S	*	.	H	α-helix	trans	-61.4	-41.5	175.6	-74.9	-31.2	0	0	0	112	D477 S478 V479 L485	D477-N481 VanDerWaalsContact O-CB 3.28Å; D477-N481 WeakPolarHBondContact O-CB 3.41Å; D477-N481 PolarHBondContact O-N 3.05Å; D477-N481 PolarHBondContact O-ND2 3.35Å; D477-N481 VanDerWaalsContact O-ND2 3.08Å; S478-N481 PolarHBondContact O-N 2.84Å; V479-N481 VanDerWaalsContact C-N 3.35Å; V479-N481 PolarHBondContact O-N 2.7Å; N481-L485 VanDerWaalsContact O-CB 3.28Å; N481-L485 WeakPolarHBondContact O-CB 3.3Å; N481-L485 PolarHBondContact O-N 3.13Å
482	Y	94.4	Very high	91.8	Very high	143 Å²	143	82 Å²	82	56%	0.561	43%	0.427	S	S	*	.	H	α-helix	trans	-62.7	-46.3	174.4	-179.4	-87.3	0	0	0	112.4	S478 V479 K480 S484 L485 R486	S478-Y482 PolarHBondContact O-N 2.87Å; V479-Y482 WeakPolarHBondContact O-CB 3.26Å; V479-Y482 PolarHBondContact O-N 2.61Å; K480-Y482 PolarHBondContact O-N 3.37Å; Y482-S484 VanDerWaalsContact C-N 3.34Å; Y482-S484 PolarHBondContact O-N 3.44Å; Y482-L485 PolarHBondContact O-N 3.35Å; Y482-R486 HydrophobicContact CD1-CG 4.32Å; Y482-R486 HydrophobicContact CE1-CG 3.93Å; Y482-R486 HydrophobicContact CE2-CG 4.23Å; Y482-R486 WeakPolarHBondContact O-CB 3.37Å; Y482-R486 WeakPolarHBondContact O-CG 3.31Å; Y482-R486 PolarHBondContact O-N 3.4Å
483	M	94.6	Very high	92.2	Very high	11 Å²	11	84.1 Å²	84.1	5%	0.054	44%	0.437	C	S	.	.	H	α-helix	trans	-63.1	-39.9	179.1	-70	-170.4	-58.5	0	0	112.3	V479 K480 R487 V488 Q493 V496	V479-M483 HydrophobicContact CG1-CE 4.18Å; V479-M483 HydrophobicContact CG1-CG 4.42Å; V479-M483 HydrophobicContact CG1-SD 4.35Å; V479-M483 WeakPolarHBondContact O-CG 3.36Å; V479-M483 PolarHBondContact O-N 3.08Å; K480-M483 HydrophobicContact CG-CE 4.34Å; K480-M483 PolarHBondContact O-N 3.11Å; M483-R487 PolarHBondContact O-N 2.98Å; M483-V488 HydrophobicContact CB-CB 4.09Å; M483-V488 HydrophobicContact CB-CG2 4.11Å; M483-V488 HydrophobicContact CG-CB 4.38Å; M483-V488 HydrophobicContact CG-CG2 4.21Å; M483-V488 PolarHBondContact O-N 3.33Å; M483-Q493 HydrophobicContact CB-CG 4.17Å; M483-Q493 HydrophobicContact CE-CB 4.1Å; M483-Q493 HydrophobicContact CE-CG 4.29Å; M483-Q493 HydrophobicContact SD-CB 4.15Å; M483-Q493 HydrophobicContact SD-CG 4.02Å; M483-V496 HydrophobicContact CE-CB 4.39Å; M483-V496 HydrophobicContact CE-CG1 4.15Å; M483-V496 HydrophobicContact SD-CB 3.91Å; M483-V496 HydrophobicContact SD-CG1 3.91Å; M483-V496 HydrophobicContact SD-CG2 4.14Å
484	S	91.6	Very high	92.4	Very high	81 Å²	81	86 Å²	86	57%	0.566	45%	0.446	S	S	*	.	H	α-helix	trans	-63.4	-50.7	173.5	-177.5	0	0	0	0	111.6	K480 Y482 R486 R487	K480-S484 WeakPolarHBondContact O-CB 3.47Å; K480-S484 PolarHBondContact O-N 3.4Å; Y482-S484 VanDerWaalsContact C-N 3.34Å; Y482-S484 PolarHBondContact O-N 3.44Å; S484-R486 VanDerWaalsContact C-N 3.25Å; S484-R486 PolarHBondContact O-N 3.16Å; S484-R487 PolarHBondContact O-N 2.8Å
485	L	94.9	Very high	92.4	Very high	134 Å²	134	89 Å²	89	70%	0.702	44%	0.444	S	S	*	.	H	α-helix	trans	-58.3	-35.8	178.4	-179.7	64.3	0	0	0	112.8	N481 Y482	N481-L485 VanDerWaalsContact O-CB 3.28Å; N481-L485 WeakPolarHBondContact O-CB 3.3Å; N481-L485 PolarHBondContact O-N 3.13Å; Y482-L485 PolarHBondContact O-N 3.35Å
486	R	95.2	Very high	92.7	Very high	166 Å²	166	86.5 Å²	86.5	63%	0.626	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	2.3	178.7	-62.4	-59	-176.1	-179.4	-0.7	114.4	Y482 S484 V488	Y482-R486 HydrophobicContact CD1-CG 4.32Å; Y482-R486 HydrophobicContact CE1-CG 3.93Å; Y482-R486 HydrophobicContact CE2-CG 4.23Å; Y482-R486 WeakPolarHBondContact O-CB 3.37Å; Y482-R486 WeakPolarHBondContact O-CG 3.31Å; Y482-R486 PolarHBondContact O-N 3.4Å; S484-R486 VanDerWaalsContact C-N 3.25Å; S484-R486 PolarHBondContact O-N 3.16Å; R486-V488 VanDerWaalsContact C-N 3.28Å; R486-V488 HydrophobicContact CB-CG2 4.15Å; R486-V488 PolarHBondContact O-N 2.97Å
487	R	93	Very high	92.7	Very high	230 Å²	230	88.1 Å²	88.1	87%	0.868	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	43.8	-179	-57.7	-178.5	179.1	-179.6	-1.6	113.1	M483 S484	M483-R487 PolarHBondContact O-N 2.98Å; S484-R487 PolarHBondContact O-N 2.8Å
488	V	94.2	Very high	92.6	Very high	29 Å²	29	88.8 Å²	88.8	18%	0.176	45%	0.451	C	S	.	.			trans	-62.1	137.8	178.9	175.6	0	0	0	0	110.1	M483 R486 L492 Q493	M483-V488 HydrophobicContact CB-CB 4.09Å; M483-V488 HydrophobicContact CB-CG2 4.11Å; M483-V488 HydrophobicContact CG-CB 4.38Å; M483-V488 HydrophobicContact CG-CG2 4.21Å; M483-V488 PolarHBondContact O-N 3.33Å; R486-V488 VanDerWaalsContact C-N 3.28Å; R486-V488 HydrophobicContact CB-CG2 4.15Å; R486-V488 PolarHBondContact O-N 2.97Å; V488-L492 HydrophobicContact CG1-CB 3.92Å; V488-L492 HydrophobicContact CG1-CD2 3.89Å; V488-L492 HydrophobicContact CG1-CG 3.98Å; V488-Q493 HydrophobicContact CB-CG 4.2Å; V488-Q493 HydrophobicContact CG1-CG 4.09Å; V488-Q493 PolarHBondContact O-NE2 3.4Å
489	P	95	Very high	92.3	Very high	86 Å²	86	90.8 Å²	90.8	56%	0.558	45%	0.451	S	S	*	.			trans	-57	140.6	178.5	-26.7	35.3	0	0	0	113.3	S491 L492 Q493	P489-S491 VanDerWaalsContact C-N 3.28Å; P489-S491 PolarHBondContact O-N 3.22Å; P489-L492 PolarHBondContact O-N 3.06Å; P489-Q493 PolarHBondContact O-N 3.47Å; P489-Q493 VanDerWaalsContact O-N 3.08Å
490	A	92.7	Very high	92.1	Very high	75 Å²	75	90.4 Å²	90.4	62%	0.62	45%	0.446	S	S	*	.	H	α-helix	trans	-55.5	-38.1	-174.2	0	0	0	0	0	113.8	L492 Q493 E494	A490-L492 VanDerWaalsContact C-N 3.28Å; A490-L492 PolarHBondContact O-N 3.49Å; A490-Q493 WeakPolarHBondContact O-CB 3.42Å; A490-Q493 PolarHBondContact O-N 2.92Å; A490-Q493 VanDerWaalsContact O-N 3.13Å; A490-E494 PolarHBondContact O-N 3.01Å
491	S	91.6	Very high	91.8	Very high	87 Å²	87	89.4 Å²	89.4	61%	0.608	44%	0.444	S	S	*	.	H	α-helix	trans	-61.7	-32.9	176	52.2	0	0	0	0	113.6	P489 R495	P489-S491 VanDerWaalsContact C-N 3.28Å; P489-S491 PolarHBondContact O-N 3.22Å; S491-R495 WeakPolarHBondContact O-CB 3.31Å; S491-R495 PolarHBondContact O-N 3.38Å
492	L	91.4	Very high	91.4	Very high	81 Å²	81	86.5 Å²	86.5	42%	0.424	43%	0.426	S	S	.	.	H	α-helix	trans	-80.2	-32.7	174.3	-174.4	57	0	0	0	111.3	V488 P489 A490 R495 V496	V488-L492 HydrophobicContact CG1-CB 3.92Å; V488-L492 HydrophobicContact CG1-CD2 3.89Å; V488-L492 HydrophobicContact CG1-CG 3.98Å; P489-L492 PolarHBondContact O-N 3.06Å; A490-L492 VanDerWaalsContact C-N 3.28Å; A490-L492 PolarHBondContact O-N 3.49Å; L492-R495 PolarHBondContact O-N 2.94Å; L492-V496 VanDerWaalsContact O-CG2 3.29Å; L492-V496 WeakPolarHBondContact O-CG2 3.42Å; L492-V496 PolarHBondContact O-N 3.16Å
493	Q	91.5	Very high	90.9	Very high	60 Å²	60	80.7 Å²	80.7	28%	0.28	41%	0.405	S	S	.	.	H	α-helix	trans	-62.8	-48.3	173	-58.7	-171.3	19.2	0	0	111.8	M483 V488 P489 A490 R495 V496 I497	M483-Q493 HydrophobicContact CB-CG 4.17Å; M483-Q493 HydrophobicContact CE-CB 4.1Å; M483-Q493 HydrophobicContact CE-CG 4.29Å; M483-Q493 HydrophobicContact SD-CB 4.15Å; M483-Q493 HydrophobicContact SD-CG 4.02Å; V488-Q493 HydrophobicContact CB-CG 4.2Å; V488-Q493 HydrophobicContact CG1-CG 4.09Å; V488-Q493 PolarHBondContact O-NE2 3.4Å; P489-Q493 PolarHBondContact O-N 3.47Å; P489-Q493 VanDerWaalsContact O-N 3.08Å; A490-Q493 WeakPolarHBondContact O-CB 3.42Å; A490-Q493 PolarHBondContact O-N 2.92Å; A490-Q493 VanDerWaalsContact O-N 3.13Å; Q493-R495 PolarHBondContact O-N 3.49Å; Q493-V496 PolarHBondContact O-N 3.05Å; Q493-I497 WeakPolarHBondContact O-CG1 3.23Å; Q493-I497 PolarHBondContact O-N 2.9Å
494	E	91.3	Very high	90.2	Very high	121 Å²	121	84.2 Å²	84.2	57%	0.565	42%	0.417	S	S	*	.	H	α-helix	trans	-57.4	-47.9	176.1	-175.2	-174.4	171.5	0	0	111	A490 V496 I497 N498	A490-E494 PolarHBondContact O-N 3.01Å; E494-V496 VanDerWaalsContact C-N 3.33Å; E494-V496 PolarHBondContact O-N 3.17Å; E494-I497 PolarHBondContact O-N 3.37Å; E494-N498 WeakPolarHBondContact O-CB 3.39Å; E494-N498 VanDerWaalsContact O-CG 3.25Å; E494-N498 PolarHBondContact O-N 3.39Å
495	R	90.5	Very high	89.7	Confident	124 Å²	124	89.2 Å²	89.2	47%	0.468	43%	0.425	S	S	.	.	H	α-helix	trans	-59.8	-38.9	176.4	178.3	179.6	144.5	135.3	6.4	113.1	S491 L492 Q493 W499 D566	S491-R495 WeakPolarHBondContact O-CB 3.31Å; S491-R495 PolarHBondContact O-N 3.38Å; L492-R495 PolarHBondContact O-N 2.94Å; Q493-R495 PolarHBondContact O-N 3.49Å; R495-W499 WeakPolarHBondContact O-CB 3.44Å; R495-W499 PolarHBondContact O-N 3.34Å; R495-D566 IonicContact CZ-OD1 2.72Å; R495-D566 IonicContact CZ-OD2 2.69Å; R495-D566 IonicContact NH1-OD1 2.85Å; R495-D566 PolarHBondContact NH1-OD1 3.18Å; R495-D566 IonicContact NH2-OD1 2.75Å; R495-D566 PolarHBondContact NH2-OD1 3.38Å; R495-D566 IonicContact NH2-OD2 3.12Å; R495-D566 PolarHBondContact NH2-OD2 3.25Å
496	V	91.5	Very high	88.7	Confident	38 Å²	38	85.2 Å²	85.2	23%	0.23	41%	0.407	C	S	.	.	H	α-helix	trans	-67.7	-43.6	175.4	168.3	0	0	0	0	110.9	V479 M483 L492 Q493 E494 W499 F500	V479-V496 HydrophobicContact CG1-CG1 3.86Å; M483-V496 HydrophobicContact CE-CB 4.39Å; M483-V496 HydrophobicContact CE-CG1 4.15Å; M483-V496 HydrophobicContact SD-CB 3.91Å; M483-V496 HydrophobicContact SD-CG1 3.91Å; M483-V496 HydrophobicContact SD-CG2 4.14Å; L492-V496 VanDerWaalsContact O-CG2 3.29Å; L492-V496 WeakPolarHBondContact O-CG2 3.42Å; L492-V496 PolarHBondContact O-N 3.16Å; Q493-V496 PolarHBondContact O-N 3.05Å; E494-V496 VanDerWaalsContact C-N 3.33Å; E494-V496 PolarHBondContact O-N 3.17Å; V496-W499 PolarHBondContact O-N 2.66Å; V496-F500 HydrophobicContact CG1-CD2 3.88Å; V496-F500 HydrophobicContact CG1-CE2 3.96Å; V496-F500 WeakPolarHBondContact O-CD2 3.42Å; V496-F500 PolarHBondContact O-N 3.48Å
497	I	91.2	Very high	87.5	Confident	44 Å²	44	82.4 Å²	82.4	23%	0.226	40%	0.404	C	S	.	.	H	α-helix	trans	-62.4	-49.7	178.5	-67.6	164.7	0	0	0	110.5	Q493 E494 W499 F500 D501	Q493-I497 WeakPolarHBondContact O-CG1 3.23Å; Q493-I497 PolarHBondContact O-N 2.9Å; E494-I497 PolarHBondContact O-N 3.37Å; I497-W499 PolarHBondContact O-N 2.7Å; I497-W499 VanDerWaalsContact O-N 3.15Å; I497-F500 WeakPolarHBondContact O-CA 3.33Å; I497-F500 WeakPolarHBondContact O-CB 3.28Å; I497-F500 PolarHBondContact O-N 3.11Å; I497-D501 PolarHBondContact O-N 3.48Å
498	N	89.2	Confident	86.2	Confident	76 Å²	76	74.7 Å²	74.7	41%	0.406	38%	0.376	S	S	.	.	H	α-helix	trans	-57.7	-32.3	177.5	-67.3	-12.3	0	0	0	112.8	E494 F502	E494-N498 WeakPolarHBondContact O-CB 3.39Å; E494-N498 VanDerWaalsContact O-CG 3.25Å; E494-N498 PolarHBondContact O-N 3.39Å; N498-F502 WeakPolarHBondContact O-CB 3.38Å; N498-F502 PolarHBondContact O-N 3.32Å
499	W	86.6	Confident	84.5	Confident	89 Å²	89	75 Å²	75	34%	0.337	38%	0.377	S	S	.	.	H	α-helix	trans	-72.5	-40.3	173.8	178.4	86	0	0	0	112.6	R495 V496 I497 F502 L503	R495-W499 WeakPolarHBondContact O-CB 3.44Å; R495-W499 PolarHBondContact O-N 3.34Å; V496-W499 PolarHBondContact O-N 2.66Å; I497-W499 PolarHBondContact O-N 2.7Å; I497-W499 VanDerWaalsContact O-N 3.15Å; W499-F502 PolarHBondContact O-N 3.39Å; W499-L503 HydrophobicContact CD2-CD1 3.92Å; W499-L503 HydrophobicContact CD2-CG 4.41Å; W499-L503 HydrophobicContact CE3-CD1 3.74Å; W499-L503 HydrophobicContact CH2-CD1 3.48Å; W499-L503 VanDerWaalsContact CH2-CD1 3.48Å; W499-L503 HydrophobicContact CZ2-CD1 3.63Å; W499-L503 HydrophobicContact CZ2-CG 4.45Å; W499-L503 HydrophobicContact CZ3-CD1 3.52Å; W499-L503 WeakPolarHBondContact O-CG 3.35Å; W499-L503 PolarHBondContact O-N 3.24Å
500	F	87.3	Confident	82.8	Confident	33 Å²	33	74.3 Å²	74.3	15%	0.145	37%	0.371	C	S	.	.	H	α-helix	trans	-63.2	-40.6	172.3	-92.2	-84.9	0	0	0	112.1	F472 L476 V479 V496 I497 L503 W504	F472-F500 HydrophobicContact CE2-CB 4.33Å; F472-F500 AromaticContact CE2-CD1 3.92Å; F472-F500 HydrophobicContact CE2-CD1 3.92Å; F472-F500 HydrophobicContact CZ-CB 4.31Å; L476-F500 HydrophobicContact CD1-CB 3.63Å; L476-F500 HydrophobicContact CD1-CD1 4.29Å; L476-F500 HydrophobicContact CD1-CG 3.94Å; V479-F500 HydrophobicContact CB-CE2 4.36Å; V479-F500 HydrophobicContact CG1-CE2 4.08Å; V479-F500 HydrophobicContact CG2-CE2 4.09Å; V479-F500 HydrophobicContact CG2-CZ 3.83Å; V496-F500 HydrophobicContact CG1-CD2 3.88Å; V496-F500 HydrophobicContact CG1-CE2 3.96Å; V496-F500 WeakPolarHBondContact O-CD2 3.42Å; V496-F500 PolarHBondContact O-N 3.48Å; I497-F500 WeakPolarHBondContact O-CA 3.33Å; I497-F500 WeakPolarHBondContact O-CB 3.28Å; I497-F500 PolarHBondContact O-N 3.11Å; F500-L503 WeakPolarHBondContact O-CB 3.48Å; F500-L503 PolarHBondContact O-N 2.72Å; F500-W504 PolarHBondContact O-N 3.09Å
501	D	86.6	Confident	81.3	Confident	56 Å²	56	73.7 Å²	73.7	30%	0.299	36%	0.358	S	S	.	.	H	α-helix	trans	-64.8	-45.8	176.7	-64.5	-26.6	0	0	0	110.8	I497 L503 W504 Y505	I497-D501 PolarHBondContact O-N 3.48Å; D501-L503 VanDerWaalsContact C-N 3.31Å; D501-L503 PolarHBondContact O-N 2.92Å; D501-W504 WeakPolarHBondContact O-CB 3.49Å; D501-W504 PolarHBondContact O-N 2.89Å; D501-W504 VanDerWaalsContact O-N 3.08Å; D501-Y505 HydrophobicContact CB-CE2 4.36Å; D501-Y505 WeakPolarHBondContact O-CD2 3.41Å; D501-Y505 PolarHBondContact O-N 3Å
502	F	84.8	Confident	80.2	Confident	52 Å²	52	74.3 Å²	74.3	23%	0.228	35%	0.351	C	S	.	.	H	α-helix	trans	-58.1	-41.5	173.7	177.9	-89.7	0	0	0	112.5	N498 W499 W504 Y505 T506 L561 Y630	N498-F502 WeakPolarHBondContact O-CB 3.38Å; N498-F502 PolarHBondContact O-N 3.32Å; W499-F502 PolarHBondContact O-N 3.39Å; F502-W504 VanDerWaalsContact C-N 3.3Å; F502-W504 PolarHBondContact O-N 3.13Å; F502-Y505 PolarHBondContact O-N 2.95Å; F502-T506 WeakPolarHBondContact CE1-OG1 3.46Å; F502-T506 WeakPolarHBondContact CZ-OG1 3.32Å; F502-T506 WeakPolarHBondContact O-CB 3.34Å; F502-T506 PolarHBondContact O-N 3.04Å; F502-T506 PolarHBondContact O-OG1 3.04Å; F502-L561 HydrophobicContact CD1-CD2 3.66Å; F502-L561 HydrophobicContact CE1-CD1 3.7Å; F502-L561 HydrophobicContact CE1-CD2 3.59Å; F502-L561 HydrophobicContact CE1-CG 4.28Å; F502-L561 HydrophobicContact CZ-CD1 4.42Å; F502-Y630 HydrophobicContact CB-CE1 4Å; F502-Y630 HydrophobicContact CB-CE2 4.47Å; F502-Y630 AromaticContact CD1-CD1 3.7Å; F502-Y630 HydrophobicContact CD1-CD1 3.7Å; F502-Y630 AromaticContact CD1-CE1 3.83Å; F502-Y630 HydrophobicContact CD1-CE1 3.83Å; F502-Y630 HydrophobicContact CD1-CG 4.19Å; F502-Y630 HydrophobicContact CD2-CD1 4.04Å; F502-Y630 AromaticContact CD2-CD2 3.66Å; F502-Y630 HydrophobicContact CD2-CD2 3.66Å; F502-Y630 HydrophobicContact CD2-CE1 4.08Å; F502-Y630 AromaticContact CD2-CE2 3.7Å; F502-Y630 HydrophobicContact CD2-CE2 3.7Å; F502-Y630 AromaticContact CD2-CG 3.83Å; F502-Y630 HydrophobicContact CD2-CG 3.83Å; F502-Y630 AromaticContact CD2-CZ 3.91Å; F502-Y630 AromaticContact CE1-CD1 3.76Å; F502-Y630 HydrophobicContact CE1-CD1 3.76Å; F502-Y630 HydrophobicContact CE1-CE1 4.37Å; F502-Y630 AromaticContact CE1-CG 3.96Å; F502-Y630 HydrophobicContact CE1-CG 3.96Å; F502-Y630 HydrophobicContact CE2-CD1 4.09Å; F502-Y630 AromaticContact CE2-CD2 3.62Å; F502-Y630 HydrophobicContact CE2-CD2 3.62Å; F502-Y630 HydrophobicContact CE2-CE2 4.16Å; F502-Y630 AromaticContact CE2-CG 3.57Å; F502-Y630 HydrophobicContact CE2-CG 3.57Å; F502-Y630 AromaticContact CG-CD1 3.85Å; F502-Y630 HydrophobicContact CG-CD1 3.85Å; F502-Y630 HydrophobicContact CG-CD2 4.25Å; F502-Y630 AromaticContact CG-CE1 3.67Å; F502-Y630 HydrophobicContact CG-CE1 3.67Å; F502-Y630 HydrophobicContact CG-CE2 4.09Å; F502-Y630 HydrophobicContact CG-CG 4.13Å; F502-Y630 AromaticContact CG-CZ 3.79Å; F502-Y630 AromaticContact CZ-CD1 3.95Å; F502-Y630 HydrophobicContact CZ-CD1 3.95Å; F502-Y630 HydrophobicContact CZ-CD2 4.18Å; F502-Y630 AromaticContact CZ-CG 3.64Å; F502-Y630 HydrophobicContact CZ-CG 3.64Å
503	L	84	Confident	79.1	Confident	21 Å²	21	76.3 Å²	76.3	11%	0.11	36%	0.358	C	S	.	.	H	α-helix	trans	-62.2	-36.7	175.2	-78.2	178.4	0	0	0	112.5	W499 F500 D501 N507 K508 I509 L561	W499-L503 HydrophobicContact CD2-CD1 3.92Å; W499-L503 HydrophobicContact CD2-CG 4.41Å; W499-L503 HydrophobicContact CE3-CD1 3.74Å; W499-L503 HydrophobicContact CH2-CD1 3.48Å; W499-L503 VanDerWaalsContact CH2-CD1 3.48Å; W499-L503 HydrophobicContact CZ2-CD1 3.63Å; W499-L503 HydrophobicContact CZ2-CG 4.45Å; W499-L503 HydrophobicContact CZ3-CD1 3.52Å; W499-L503 WeakPolarHBondContact O-CG 3.35Å; W499-L503 PolarHBondContact O-N 3.24Å; F500-L503 WeakPolarHBondContact O-CB 3.48Å; F500-L503 PolarHBondContact O-N 2.72Å; D501-L503 VanDerWaalsContact C-N 3.31Å; D501-L503 PolarHBondContact O-N 2.92Å; L503-N507 PolarHBondContact O-N 3.3Å; L503-K508 HydrophobicContact CD2-CB 3.91Å; L503-K508 PolarHBondContact O-N 3.32Å; L503-K508 VanDerWaalsContact O-N 3.09Å; L503-I509 HydrophobicContact CB-CD1 4.42Å; L503-I509 HydrophobicContact CB-CG1 3.76Å; L503-L561 HydrophobicContact CD2-CD2 3.59Å; L503-L561 HydrophobicContact CG-CD2 4.26Å
504	W	80.8	Confident	78	Confident	85 Å²	85	79.7 Å²	79.7	32%	0.322	37%	0.372	S	S	.	.	H	α-helix	trans	-66.2	-52.3	175	-179.2	-101.8	0	0	0	111.7	Q469 F472 F500 D501 F502 T506 N507 I509	Q469-W504 HydrophobicContact CB-CH2 4.01Å; Q469-W504 HydrophobicContact CB-CZ2 4.42Å; Q469-W504 HydrophobicContact CG-CH2 4.4Å; Q469-W504 HydrophobicContact CG-CZ2 4.43Å; F472-W504 HydrophobicContact CB-CE3 3.64Å; F472-W504 HydrophobicContact CB-CH2 4.48Å; F472-W504 HydrophobicContact CB-CZ3 3.51Å; F472-W504 AromaticContact CD1-CD2 3.95Å; F472-W504 HydrophobicContact CD1-CD2 3.95Å; F472-W504 AromaticContact CD1-CE3 3.63Å; F472-W504 HydrophobicContact CD1-CE3 3.63Å; F472-W504 HydrophobicContact CD1-CG 4.39Å; F472-W504 HydrophobicContact CD1-CZ3 4.16Å; F472-W504 AromaticContact CD2-CE3 3.87Å; F472-W504 HydrophobicContact CD2-CE3 3.87Å; F472-W504 HydrophobicContact CE1-CB 4.1Å; F472-W504 HydrophobicContact CE1-CD2 4.15Å; F472-W504 HydrophobicContact CE1-CE3 4.2Å; F472-W504 HydrophobicContact CE1-CG 4.1Å; F472-W504 HydrophobicContact CE2-CB 4.01Å; F472-W504 HydrophobicContact CE2-CE3 4.37Å; F472-W504 HydrophobicContact CG-CD2 4.19Å; F472-W504 AromaticContact CG-CE3 3.42Å; F472-W504 HydrophobicContact CG-CE3 3.42Å; F472-W504 VanDerWaalsContact CG-CE3 3.42Å; F472-W504 AromaticContact CG-CZ3 3.85Å; F472-W504 HydrophobicContact CG-CZ3 3.85Å; F472-W504 HydrophobicContact CZ-CB 3.72Å; F472-W504 HydrophobicContact CZ-CG 4.23Å; F500-W504 PolarHBondContact O-N 3.09Å; D501-W504 WeakPolarHBondContact O-CB 3.49Å; D501-W504 PolarHBondContact O-N 2.89Å; D501-W504 VanDerWaalsContact O-N 3.08Å; F502-W504 VanDerWaalsContact C-N 3.3Å; F502-W504 PolarHBondContact O-N 3.13Å; W504-T506 VanDerWaalsContact C-N 3.26Å; W504-T506 PolarHBondContact O-N 3.32Å; W504-N507 PolarHBondContact O-N 3.2Å; W504-I509 VanDerWaalsContact CA-CD1 3.42Å; W504-I509 HydrophobicContact CB-CD1 3.82Å; W504-I509 HydrophobicContact CD2-CD1 4.33Å; W504-I509 HydrophobicContact CE3-CD1 3.59Å; W504-I509 HydrophobicContact CG-CD1 4.47Å
505	Y	80.6	Confident	77	Confident	187 Å²	187	77.7 Å²	77.7	73%	0.733	37%	0.367	S	S	*	.	H	α-helix	trans	-59.6	-36.3	177.3	-71.5	-63.8	0	0	0	113	D501 F502 N507	D501-Y505 HydrophobicContact CB-CE2 4.36Å; D501-Y505 WeakPolarHBondContact O-CD2 3.41Å; D501-Y505 PolarHBondContact O-N 3Å; F502-Y505 PolarHBondContact O-N 2.95Å; Y505-N507 VanDerWaalsContact C-N 3.27Å; Y505-N507 PolarHBondContact O-N 2.86Å
506	T	74.6	Confident	76.3	Confident	50 Å²	50	73.5 Å²	73.5	31%	0.307	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	0.6	179.7	-39.4	0	0	0	0	113.2	F502 W504 K508	F502-T506 WeakPolarHBondContact CE1-OG1 3.46Å; F502-T506 WeakPolarHBondContact CZ-OG1 3.32Å; F502-T506 WeakPolarHBondContact O-CB 3.34Å; F502-T506 PolarHBondContact O-N 3.04Å; F502-T506 PolarHBondContact O-OG1 3.04Å; W504-T506 VanDerWaalsContact C-N 3.26Å; W504-T506 PolarHBondContact O-N 3.32Å; T506-K508 HydrophobicContact CG2-CD 3.63Å; T506-K508 HydrophobicContact CG2-CG 3.98Å; T506-K508 PolarHBondContact O-N 2.79Å
507	N	68.9	Low	75.6	Confident	106 Å²	106	81.7 Å²	81.7	57%	0.567	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	18	-173.2	-69.9	-82.5	0	0	0	115.2	L503 W504 Y505 I509	L503-N507 PolarHBondContact O-N 3.3Å; W504-N507 PolarHBondContact O-N 3.2Å; Y505-N507 VanDerWaalsContact C-N 3.27Å; Y505-N507 PolarHBondContact O-N 2.86Å; N507-I509 VanDerWaalsContact C-N 3.31Å; N507-I509 PolarHBondContact O-N 3.29Å
508	K	65.6	Low	75.1	Confident	68 Å²	68	86.5 Å²	86.5	30%	0.296	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	5.8	-174.5	-80.3	176.2	-178.8	159	0	115	L503 T506 T510 D632	L503-K508 HydrophobicContact CD2-CB 3.91Å; L503-K508 PolarHBondContact O-N 3.32Å; L503-K508 VanDerWaalsContact O-N 3.09Å; T506-K508 HydrophobicContact CG2-CD 3.63Å; T506-K508 HydrophobicContact CG2-CG 3.98Å; T506-K508 PolarHBondContact O-N 2.79Å; K508-T510 PolarHBondContact O-N 2.95Å; K508-D632 IonicContact NZ-OD1 2.64Å; K508-D632 PolarHBondContact NZ-OD1 2.92Å; K508-D632 IonicContact NZ-OD2 2.79Å; K508-D632 PolarHBondContact NZ-OD2 2.79Å
509	I	58	Low	74.7	Confident	36 Å²	36	85.8 Å²	85.8	19%	0.185	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-21.3	176	-60.2	156.3	0	0	0	111.4	F472 R475 L503 W504 N507 D511	F472-I509 HydrophobicContact CD2-CD1 3.35Å; F472-I509 HydrophobicContact CD2-CG1 4.35Å; F472-I509 HydrophobicContact CE2-CD1 3.51Å; F472-I509 HydrophobicContact CE2-CG1 4.44Å; F472-I509 HydrophobicContact CG-CD1 4.21Å; R475-I509 VanDerWaalsContact NH1-CG2 3.32Å; L503-I509 HydrophobicContact CB-CD1 4.42Å; L503-I509 HydrophobicContact CB-CG1 3.76Å; W504-I509 VanDerWaalsContact CA-CD1 3.42Å; W504-I509 HydrophobicContact CB-CD1 3.82Å; W504-I509 HydrophobicContact CD2-CD1 4.33Å; W504-I509 HydrophobicContact CE3-CD1 3.59Å; W504-I509 HydrophobicContact CG-CD1 4.47Å; N507-I509 VanDerWaalsContact C-N 3.31Å; N507-I509 PolarHBondContact O-N 3.29Å; I509-D511 PolarHBondContact O-N 3.29Å; I509-D511 VanDerWaalsContact O-N 3.13Å
510	T	59.3	Low	74.6	Confident	71 Å²	71	85.5 Å²	85.5	44%	0.436	41%	0.412	S	S	.	.	S	Bend	trans	-65.5	110.3	173.9	-50.4	0	0	0	0	109.3	K508 E512 V515	K508-T510 PolarHBondContact O-N 2.95Å; T510-E512 PolarHBondContact O-N 3.18Å; T510-V515 HydrophobicContact CG2-CG2 3.42Å; T510-V515 VanDerWaalsContact CG2-CG2 3.42Å
511	D	62.5	Low	74.2	Confident	63 Å²	63	91.4 Å²	91.4	34%	0.337	44%	0.435	S	S	.	.			trans	-68.4	101	177.1	-168.8	-10.8	0	0	0	109	I509 E513 K514 V515	I509-D511 PolarHBondContact O-N 3.29Å; I509-D511 VanDerWaalsContact O-N 3.13Å; D511-E513 PolarHBondContact O-N 2.94Å; D511-E513 VanDerWaalsContact O-N 3.16Å; D511-K514 HydrophobicContact CB-CB 4.16Å; D511-K514 HydrophobicContact CB-CD 4.02Å; D511-K514 HydrophobicContact CB-CG 3.9Å; D511-K514 WeakPolarHBondContact O-CA 3.4Å; D511-K514 WeakPolarHBondContact O-CB 3.32Å; D511-K514 PolarHBondContact O-N 3.35Å; D511-K514 IonicContact OD2-NZ 3.99Å; D511-K514 PolarHBondContact OD2-NZ 2.96Å; D511-V515 PolarHBondContact O-N 3.3Å
512	E	68	Low	73.8	Confident	100 Å²	100	95.4 Å²	95.4	47%	0.467	45%	0.45	S	S	.	.	H	α-helix	trans	-53.4	-36.8	-175.1	-66.4	178.3	169.7	0	0	111.5	T510 K514 V515 L516	T510-E512 PolarHBondContact O-N 3.18Å; E512-K514 VanDerWaalsContact C-N 3.32Å; E512-K514 PolarHBondContact O-N 3.45Å; E512-V515 PolarHBondContact O-N 3.49Å; E512-L516 WeakPolarHBondContact O-CB 3.33Å; E512-L516 VanDerWaalsContact O-CG 3.28Å; E512-L516 WeakPolarHBondContact O-CG 3.1Å; E512-L516 PolarHBondContact O-N 3.4Å
513	E	67.6	Low	73.8	Confident	123 Å²	123	96.6 Å²	96.6	58%	0.575	46%	0.458	S	S	*	.	H	α-helix	trans	-61.1	-38.5	174.9	-69.1	-174.7	-166.2	0	0	112.3	D511 R517	D511-E513 PolarHBondContact O-N 2.94Å; D511-E513 VanDerWaalsContact O-N 3.16Å; E513-R517 WeakPolarHBondContact O-CB 3.35Å; E513-R517 PolarHBondContact O-N 3.08Å
514	K	69.4	Low	73.7	Confident	131 Å²	131	98.8 Å²	98.8	57%	0.57	47%	0.467	S	S	*	.	H	α-helix	trans	-69.3	-36.9	178.2	-68.7	-171.3	178.3	85.8	0	112.3	D511 E512	D511-K514 HydrophobicContact CB-CB 4.16Å; D511-K514 HydrophobicContact CB-CD 4.02Å; D511-K514 HydrophobicContact CB-CG 3.9Å; D511-K514 WeakPolarHBondContact O-CA 3.4Å; D511-K514 WeakPolarHBondContact O-CB 3.32Å; D511-K514 PolarHBondContact O-N 3.35Å; D511-K514 IonicContact OD2-NZ 3.99Å; D511-K514 PolarHBondContact OD2-NZ 2.96Å; E512-K514 VanDerWaalsContact C-N 3.32Å; E512-K514 PolarHBondContact O-N 3.45Å
515	V	71.1	Confident	73.5	Confident	78 Å²	78	95.6 Å²	95.6	47%	0.473	46%	0.458	S	S	.	.	H	α-helix	trans	-70.7	-46.8	177.3	-179.2	0	0	0	0	110.4	T510 D511 E512 R517	T510-V515 HydrophobicContact CG2-CG2 3.42Å; T510-V515 VanDerWaalsContact CG2-CG2 3.42Å; D511-V515 PolarHBondContact O-N 3.3Å; E512-V515 PolarHBondContact O-N 3.49Å; V515-R517 VanDerWaalsContact C-N 3.33Å; V515-R517 PolarHBondContact O-N 3.18Å
516	L	75.4	Confident	73.6	Confident	36 Å²	36	91.1 Å²	91.1	19%	0.188	44%	0.444	C	S	.	.	H	α-helix	trans	-77.7	-13.4	-176.4	-62	175.6	0	0	0	113.7	E512 N518 L519 K524 I527	E512-L516 WeakPolarHBondContact O-CB 3.33Å; E512-L516 VanDerWaalsContact O-CG 3.28Å; E512-L516 WeakPolarHBondContact O-CG 3.1Å; E512-L516 PolarHBondContact O-N 3.4Å; L516-N518 VanDerWaalsContact C-N 3.28Å; L516-N518 PolarHBondContact O-N 2.81Å; L516-L519 HydrophobicContact CD2-CD1 3.76Å; L516-L519 PolarHBondContact O-N 2.83Å; L516-K524 HydrophobicContact CB-CD 4.19Å; L516-K524 HydrophobicContact CB-CG 4.26Å; L516-K524 HydrophobicContact CD1-CG 4.42Å; L516-I527 HydrophobicContact CD2-CD1 4.35Å; L516-I527 HydrophobicContact CD2-CG2 4.37Å
517	R	77.4	Confident	74.1	Confident	211 Å²	211	92 Å²	92	80%	0.796	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-29.7	-178.6	176.3	171.9	179.5	-175	-1.5	114.2	E513 V515 L519	E513-R517 WeakPolarHBondContact O-CB 3.35Å; E513-R517 PolarHBondContact O-N 3.08Å; V515-R517 VanDerWaalsContact C-N 3.33Å; V515-R517 PolarHBondContact O-N 3.18Å; R517-L519 VanDerWaalsContact C-N 3.34Å
518	N	79.6	Confident	74.7	Confident	145 Å²	145	87.4 Å²	87.4	78%	0.775	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-4.2	-178.2	-64.1	-7.4	0	0	0	112.8	L516	L516-N518 VanDerWaalsContact C-N 3.28Å; L516-N518 PolarHBondContact O-N 2.81Å
519	L	81.1	Confident	75.4	Confident	61 Å²	61	86.7 Å²	86.7	32%	0.319	42%	0.422	S	S	.	.	S	Bend	trans	-89.8	141	178.9	-69.7	169	0	0	0	110.9	L516 R517 L523 I527	L516-L519 HydrophobicContact CD2-CD1 3.76Å; L516-L519 PolarHBondContact O-N 2.83Å; R517-L519 VanDerWaalsContact C-N 3.34Å; L519-L523 HydrophobicContact CD2-CD1 4.31Å; L519-I527 HydrophobicContact CD1-CD1 3.63Å
520	P	85.3	Confident	76.6	Confident	82 Å²	82	90.8 Å²	90.8	53%	0.532	44%	0.44	S	S	.	.			trans	-50.3	141.9	165.3	-27.2	34.3	0	0	0	111.8	K522 L523 K524	P520-K522 PolarHBondContact O-N 2.83Å; P520-K522 VanDerWaalsContact O-N 3.08Å; P520-L523 HydrophobicContact CG-CD1 4.48Å; P520-L523 PolarHBondContact O-N 3.26Å; P520-K524 PolarHBondContact O-N 3.37Å
521	Y	77.7	Confident	77.4	Confident	158 Å²	158	91.4 Å²	91.4	62%	0.62	44%	0.443	S	S	*	.	H	α-helix	trans	-51.6	-37.6	-177	179.2	-97	0	0	0	113.2	K524 A525 L555	Y521-K524 PolarHBondContact O-N 3.11Å; Y521-A525 WeakPolarHBondContact O-CB 3.45Å; Y521-A525 PolarHBondContact O-N 3.02Å; Y521-L555 HydrophobicContact CE1-CD1 4.27Å; Y521-L555 HydrophobicContact CE2-CD1 4.09Å; Y521-L555 WeakPolarHBondContact OH-CD1 3.37Å
522	K	79	Confident	78.2	Confident	139 Å²	139	89.5 Å²	89.5	60%	0.604	43%	0.432	S	S	*	.	H	α-helix	trans	-59.7	-49.3	175.4	-178.2	171.3	176.7	173	0	112.8	P520 K524 A525 E526	P520-K522 PolarHBondContact O-N 2.83Å; P520-K522 VanDerWaalsContact O-N 3.08Å; K522-K524 VanDerWaalsContact C-N 3.33Å; K522-K524 PolarHBondContact O-N 2.98Å; K522-A525 WeakPolarHBondContact O-CB 3.41Å; K522-A525 PolarHBondContact O-N 3.42Å; K522-E526 WeakPolarHBondContact CE-OE1 3.43Å; K522-E526 WeakPolarHBondContact CG-OE1 3.45Å; K522-E526 WeakPolarHBondContact O-CG 3.48Å; K522-E526 PolarHBondContact O-N 3.06Å
523	L	84.9	Confident	78.7	Confident	78 Å²	78	86.2 Å²	86.2	41%	0.408	42%	0.418	S	S	.	.	H	α-helix	trans	-66.2	-36.6	177	-66	-176.8	0	0	0	111.6	L519 P520 A525 E526 I527	L519-L523 HydrophobicContact CD2-CD1 4.31Å; P520-L523 HydrophobicContact CG-CD1 4.48Å; P520-L523 PolarHBondContact O-N 3.26Å; L523-A525 VanDerWaalsContact C-N 3.31Å; L523-A525 PolarHBondContact O-N 3.28Å; L523-E526 PolarHBondContact O-N 3.27Å; L523-I527 WeakPolarHBondContact O-CB 3.34Å; L523-I527 WeakPolarHBondContact O-CD1 3.49Å; L523-I527 VanDerWaalsContact O-CG1 3.23Å; L523-I527 WeakPolarHBondContact O-CG1 3.37Å; L523-I527 PolarHBondContact O-N 3.1Å
524	K	81.2	Confident	79.2	Confident	67 Å²	67	85.7 Å²	85.7	29%	0.291	42%	0.419	S	S	.	.	H	α-helix	trans	-60.7	-41.4	172.8	-175.5	178.2	177.9	-175.7	0	111.6	L516 P520 Y521 K522 A528 L555	L516-K524 HydrophobicContact CB-CD 4.19Å; L516-K524 HydrophobicContact CB-CG 4.26Å; L516-K524 HydrophobicContact CD1-CG 4.42Å; P520-K524 PolarHBondContact O-N 3.37Å; Y521-K524 PolarHBondContact O-N 3.11Å; K522-K524 VanDerWaalsContact C-N 3.33Å; K522-K524 PolarHBondContact O-N 2.98Å; K524-A528 WeakPolarHBondContact O-CB 3.39Å; K524-A528 PolarHBondContact O-N 3.43Å; K524-L555 HydrophobicContact CG-CD2 4.3Å
525	A	77.6	Confident	79.4	Confident	17 Å²	17	80.3 Å²	80.3	14%	0.14	40%	0.397	C	S	.	.	H	α-helix	trans	-65.9	-49.4	176	0	0	0	0	0	112	Y521 K522 L523 I527 A528 I529 L555	Y521-A525 WeakPolarHBondContact O-CB 3.45Å; Y521-A525 PolarHBondContact O-N 3.02Å; K522-A525 WeakPolarHBondContact O-CB 3.41Å; K522-A525 PolarHBondContact O-N 3.42Å; L523-A525 VanDerWaalsContact C-N 3.31Å; L523-A525 PolarHBondContact O-N 3.28Å; A525-I527 PolarHBondContact O-N 2.95Å; A525-A528 PolarHBondContact O-N 3.41Å; A525-I529 WeakPolarHBondContact O-CB 3.46Å; A525-I529 WeakPolarHBondContact O-CD1 3.42Å; A525-I529 WeakPolarHBondContact O-CG1 3.46Å; A525-I529 PolarHBondContact O-N 2.99Å; A525-L555 HydrophobicContact CB-CD1 3.89Å; A525-L555 HydrophobicContact CB-CD2 4.09Å; A525-L555 HydrophobicContact CB-CG 4.33Å
526	E	82.6	Confident	79.8	Confident	93 Å²	93	76.6 Å²	76.6	44%	0.435	38%	0.375	S	S	.	.	H	α-helix	trans	-58.6	-44.1	178.4	-72	171	-169.2	0	0	112	K522 L523 H530	K522-E526 WeakPolarHBondContact CE-OE1 3.43Å; K522-E526 WeakPolarHBondContact CG-OE1 3.45Å; K522-E526 WeakPolarHBondContact O-CG 3.48Å; K522-E526 PolarHBondContact O-N 3.06Å; L523-E526 PolarHBondContact O-N 3.27Å; E526-H530 PolarHBondContact O-N 3.36Å
527	I	84.9	Confident	80	Confident	70 Å²	70	79 Å²	79	36%	0.359	38%	0.383	S	S	.	.	H	α-helix	trans	-62.9	-50.7	174.3	-68.6	164.6	0	0	0	110.9	L516 L519 L523 A525 I529 H530 V531	L516-I527 HydrophobicContact CD2-CD1 4.35Å; L516-I527 HydrophobicContact CD2-CG2 4.37Å; L519-I527 HydrophobicContact CD1-CD1 3.63Å; L523-I527 WeakPolarHBondContact O-CB 3.34Å; L523-I527 WeakPolarHBondContact O-CD1 3.49Å; L523-I527 VanDerWaalsContact O-CG1 3.23Å; L523-I527 WeakPolarHBondContact O-CG1 3.37Å; L523-I527 PolarHBondContact O-N 3.1Å; A525-I527 PolarHBondContact O-N 2.95Å; I527-I529 VanDerWaalsContact C-N 3.27Å; I527-I529 PolarHBondContact O-N 2.95Å; I527-H530 PolarHBondContact O-N 3.33Å; I527-H530 VanDerWaalsContact O-N 3.14Å; I527-V531 HydrophobicContact CG2-CG2 4.16Å; I527-V531 VanDerWaalsContact O-CG2 3.29Å; I527-V531 WeakPolarHBondContact O-CG2 3.4Å; I527-V531 PolarHBondContact O-N 2.9Å
528	A	80.1	Confident	80	Confident	9 Å²	9	74.5 Å²	74.5	7%	0.074	37%	0.372	C	S	.	.	H	α-helix	trans	-63	-36.4	-176.8	0	0	0	0	0	111.5	K524 A525 H532 V554 L555	K524-A528 WeakPolarHBondContact O-CB 3.39Å; K524-A528 PolarHBondContact O-N 3.43Å; A525-A528 PolarHBondContact O-N 3.41Å; A528-H532 VanDerWaalsContact O-CB 3.29Å; A528-H532 WeakPolarHBondContact O-CB 3.35Å; A528-H532 PolarHBondContact O-CD2 3.41Å; A528-H532 PolarHBondContact O-N 3.19Å; A528-V554 HydrophobicContact CB-CG1 3.35Å; A528-V554 VanDerWaalsContact O-CG1 3.29Å; A528-V554 WeakPolarHBondContact O-CG1 3.47Å; A528-L555 HydrophobicContact CB-CD2 4.37Å
529	I	81.2	Confident	80.1	Confident	52 Å²	52	67.6 Å²	67.6	27%	0.267	34%	0.335	S	S	.	.	H	α-helix	trans	-62.2	-53.2	172.3	-68.9	164.7	0	0	0	109.1	A525 I527 V531 H532 L533 V554	A525-I529 WeakPolarHBondContact O-CB 3.46Å; A525-I529 WeakPolarHBondContact O-CD1 3.42Å; A525-I529 WeakPolarHBondContact O-CG1 3.46Å; A525-I529 PolarHBondContact O-N 2.99Å; I527-I529 VanDerWaalsContact C-N 3.27Å; I527-I529 PolarHBondContact O-N 2.95Å; I529-V531 VanDerWaalsContact C-N 3.28Å; I529-V531 PolarHBondContact O-N 3.33Å; I529-H532 PolarHBondContact O-N 3.12Å; I529-L533 HydrophobicContact CG2-CB 4.09Å; I529-L533 HydrophobicContact CG2-CD2 3.94Å; I529-L533 HydrophobicContact CG2-CG 4.43Å; I529-L533 WeakPolarHBondContact O-CA 3.47Å; I529-L533 WeakPolarHBondContact O-CB 3.41Å; I529-L533 PolarHBondContact O-N 3.4Å; I529-V554 HydrophobicContact CG1-CG1 4.23Å
530	H	82.1	Confident	79.8	Confident	122 Å²	122	71.5 Å²	71.5	57%	0.565	35%	0.351	S	S	*	.	H	α-helix	trans	-59.7	-36.1	-178.9	-167.7	77.3	0	0	0	113.3	E526 I527	E526-H530 PolarHBondContact O-N 3.36Å; I527-H530 PolarHBondContact O-N 3.33Å; I527-H530 VanDerWaalsContact O-N 3.14Å
531	V	77.4	Confident	79.4	Confident	85 Å²	85	68.4 Å²	68.4	52%	0.515	33%	0.33	S	S	.	.	H	α-helix	trans	-80.4	-33.9	-179	-179	0	0	0	0	113.1	I527 I529	I527-V531 HydrophobicContact CG2-CG2 4.16Å; I527-V531 VanDerWaalsContact O-CG2 3.29Å; I527-V531 WeakPolarHBondContact O-CG2 3.4Å; I527-V531 PolarHBondContact O-N 2.9Å; I529-V531 VanDerWaalsContact C-N 3.28Å; I529-V531 PolarHBondContact O-N 3.33Å
532	H	78.3	Confident	79.3	Confident	22 Å²	22	61.1 Å²	61.1	10%	0.102	30%	0.302	C	S	.	.	H	α-helix	trans	-113	-20.1	-170.2	-55.7	-38.6	0	0	0	115.2	A528 I529 N534 T535 L536 V554 F634	A528-H532 VanDerWaalsContact O-CB 3.29Å; A528-H532 WeakPolarHBondContact O-CB 3.35Å; A528-H532 PolarHBondContact O-CD2 3.41Å; A528-H532 PolarHBondContact O-N 3.19Å; I529-H532 PolarHBondContact O-N 3.12Å; H532-N534 VanDerWaalsContact C-N 3.29Å; H532-N534 PolarHBondContact O-N 2.89Å; H532-T535 PolarHBondContact O-N 3.19Å; H532-L536 HydrophobicContact CB-CD1 4.5Å; H532-L536 WeakPolarHBondContact O-CG 3.5Å; H532-L536 PolarHBondContact O-N 3.45Å; H532-V554 HydrophobicContact CB-CG1 4.5Å; H532-V554 HydrophobicContact CB-CG2 4.26Å; H532-F634 AromaticContact CE1-CE1 3.49Å; H532-F634 VanDerWaalsContact CE1-CE1 3.49Å; H532-F634 WeakPolarHBondContact CE1-CE1 3.31Å; H532-F634 AromaticContact CE1-CZ 3.78Å; H532-F634 AromaticContact ND1-CE1 3.44Å; H532-F634 WeakPolarHBondContact ND1-CE1 3.35Å; H532-F634 AromaticContact ND1-CZ 3.27Å; H532-F634 VanDerWaalsContact ND1-CZ 3.27Å; H532-F634 WeakPolarHBondContact ND1-CZ 3.37Å
533	L	79.1	Confident	79.2	Confident	32 Å²	32	60 Å²	60	17%	0.168	30%	0.298	C	S	.	.	H	α-helix	trans	-59.9	-38.3	-175.4	-173.2	72.2	0	0	0	112.2	I529 L536 K537 L550	I529-L533 HydrophobicContact CG2-CB 4.09Å; I529-L533 HydrophobicContact CG2-CD2 3.94Å; I529-L533 HydrophobicContact CG2-CG 4.43Å; I529-L533 WeakPolarHBondContact O-CA 3.47Å; I529-L533 WeakPolarHBondContact O-CB 3.41Å; I529-L533 PolarHBondContact O-N 3.4Å; L533-L536 PolarHBondContact O-N 2.96Å; L533-K537 HydrophobicContact CD1-CD 4.44Å; L533-K537 HydrophobicContact CD1-CG 4.34Å; L533-K537 HydrophobicContact CD2-CD 4.43Å; L533-K537 HydrophobicContact CG-CD 4.07Å; L533-K537 HydrophobicContact CG-CG 4.25Å; L533-K537 WeakPolarHBondContact O-CB 3.24Å; L533-K537 WeakPolarHBondContact O-CG 3.42Å; L533-K537 PolarHBondContact O-N 3.45Å; L533-L550 HydrophobicContact CD1-CB 4.1Å; L533-L550 HydrophobicContact CD1-CD1 3.91Å; L533-L550 HydrophobicContact CD1-CG 4.47Å
534	N	77.6	Confident	78.8	Confident	111 Å²	111	62.2 Å²	62.2	59%	0.594	31%	0.311	S	S	*	.	H	α-helix	trans	-65	-45.2	179	-71.9	-17.3	0	0	0	112.1	H532 L536 Q538	H532-N534 VanDerWaalsContact C-N 3.29Å; H532-N534 PolarHBondContact O-N 2.89Å; N534-L536 VanDerWaalsContact C-N 3.31Å; N534-L536 PolarHBondContact O-N 3.41Å; N534-Q538 WeakPolarHBondContact O-CG 3.38Å; N534-Q538 PolarHBondContact O-N 3.44Å
535	T	74.3	Confident	78.7	Confident	19 Å²	19	60 Å²	60	12%	0.117	30%	0.303	C	S	.	.	H	α-helix	trans	-65.1	-37.4	174.9	-50	0	0	0	0	111	H532 Q538 V539 N582 F634	H532-T535 PolarHBondContact O-N 3.19Å; T535-Q538 WeakPolarHBondContact O-CB 3.14Å; T535-Q538 PolarHBondContact O-N 2.96Å; T535-V539 WeakPolarHBondContact O-CG2 3.38Å; T535-N582 HydrophobicContact CG2-CB 4.33Å; T535-N582 WeakPolarHBondContact CG2-OD1 3.45Å; T535-N582 PolarHBondContact OG1-OD1 2.97Å; T535-N582 VanDerWaalsContact OG1-OD1 3.08Å; T535-F634 HydrophobicContact CG2-CE2 3.99Å
536	L	79.1	Confident	79	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-70.2	-41.1	178.5	-71.4	172.6	0	0	0	113.3	H532 L533 N534 Q538 V539 F542 L550 L553 V554 L557 I580	H532-L536 HydrophobicContact CB-CD1 4.5Å; H532-L536 WeakPolarHBondContact O-CG 3.5Å; H532-L536 PolarHBondContact O-N 3.45Å; L533-L536 PolarHBondContact O-N 2.96Å; N534-L536 VanDerWaalsContact C-N 3.31Å; N534-L536 PolarHBondContact O-N 3.41Å; L536-Q538 PolarHBondContact O-N 2.95Å; L536-V539 WeakPolarHBondContact O-CB 3.39Å; L536-V539 WeakPolarHBondContact O-CG2 3.36Å; L536-V539 PolarHBondContact O-N 2.91Å; L536-F542 HydrophobicContact CB-CD2 4.43Å; L536-F542 HydrophobicContact CD2-CD2 3.89Å; L536-F542 HydrophobicContact CD2-CE2 3.85Å; L536-L550 HydrophobicContact CB-CD2 3.86Å; L536-L550 HydrophobicContact CD1-CD2 4.17Å; L536-L553 HydrophobicContact CD2-CD2 4.4Å; L536-V554 HydrophobicContact CD1-CB 4.46Å; L536-V554 HydrophobicContact CD1-CG2 3.27Å; L536-L557 HydrophobicContact CD1-CD1 3.85Å; L536-L557 HydrophobicContact CD2-CD1 3.93Å; L536-L557 HydrophobicContact CG-CD1 4.21Å; L536-I580 HydrophobicContact CD2-CD1 3.66Å
537	K	80.2	Confident	78.8	Confident	85 Å²	85	65.6 Å²	65.6	37%	0.37	33%	0.326	S	S	.	.	H	α-helix	trans	-65	-21.8	174.3	-75.3	-173	174.5	-174.2	0	112.4	L533 V539 Q543 E547 L550	L533-K537 HydrophobicContact CD1-CD 4.44Å; L533-K537 HydrophobicContact CD1-CG 4.34Å; L533-K537 HydrophobicContact CD2-CD 4.43Å; L533-K537 HydrophobicContact CG-CD 4.07Å; L533-K537 HydrophobicContact CG-CG 4.25Å; L533-K537 WeakPolarHBondContact O-CB 3.24Å; L533-K537 WeakPolarHBondContact O-CG 3.42Å; L533-K537 PolarHBondContact O-N 3.45Å; K537-V539 VanDerWaalsContact C-N 3.33Å; K537-Q543 WeakPolarHBondContact O-CG 3.44Å; K537-E547 IonicContact NZ-OE1 3.21Å; K537-E547 PolarHBondContact NZ-OE1 3.47Å; K537-L550 HydrophobicContact CG-CD1 4.26Å
538	Q	76.8	Confident	78.6	Confident	118 Å²	118	63.7 Å²	63.7	55%	0.551	32%	0.324	S	S	*	.	H	α-helix	trans	-73	-24.1	170.2	-71.9	169.5	1.2	0	0	113.1	N534 T535 L536 E540 Q543	N534-Q538 WeakPolarHBondContact O-CG 3.38Å; N534-Q538 PolarHBondContact O-N 3.44Å; T535-Q538 WeakPolarHBondContact O-CB 3.14Å; T535-Q538 PolarHBondContact O-N 2.96Å; L536-Q538 PolarHBondContact O-N 2.95Å; Q538-E540 PolarHBondContact O-N 3.5Å; Q538-Q543 PolarHBondContact O-NE2 3.19Å
539	V	80.9	Confident	78.8	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.32	C	S	.	.	S	Bend	trans	-73.7	121.9	179.7	-165.3	0	0	0	0	109.8	T535 L536 K537 I541 F542 Q543 I580 Y605	T535-V539 WeakPolarHBondContact O-CG2 3.38Å; L536-V539 WeakPolarHBondContact O-CB 3.39Å; L536-V539 WeakPolarHBondContact O-CG2 3.36Å; L536-V539 PolarHBondContact O-N 2.91Å; K537-V539 VanDerWaalsContact C-N 3.33Å; V539-I541 HydrophobicContact CB-CG1 4.42Å; V539-I541 HydrophobicContact CG1-CD1 4.14Å; V539-I541 HydrophobicContact CG1-CG1 3.51Å; V539-I541 PolarHBondContact O-N 3.41Å; V539-I541 VanDerWaalsContact O-N 3.07Å; V539-F542 HydrophobicContact CB-CD2 3.83Å; V539-F542 HydrophobicContact CB-CE2 4.42Å; V539-F542 HydrophobicContact CG1-CD2 4.18Å; V539-F542 HydrophobicContact CG1-CE2 4.38Å; V539-F542 HydrophobicContact CG2-CD2 4.21Å; V539-F542 PolarHBondContact O-N 2.79Å; V539-Q543 PolarHBondContact O-N 3.26Å; V539-I580 HydrophobicContact CG2-CG2 3.58Å; V539-Y605 HydrophobicContact CG1-CD1 3.3Å; V539-Y605 HydrophobicContact CG1-CE1 3.94Å; V539-Y605 HydrophobicContact CG1-CG 4.01Å
540	E	75.6	Confident	78.9	Confident	142 Å²	142	60.9 Å²	60.9	66%	0.664	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-35.2	-174.9	-63.9	176.8	177.1	0	0	114.2	Q538 F542	Q538-E540 PolarHBondContact O-N 3.5Å; E540-F542 PolarHBondContact O-N 3.08Å
541	I	76.3	Confident	78.8	Confident	18 Å²	18	57.1 Å²	57.1	9%	0.092	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-19.4	177.4	43.7	168.6	0	0	0	114.5	V539 T545 Y605 L655	V539-I541 HydrophobicContact CB-CG1 4.42Å; V539-I541 HydrophobicContact CG1-CD1 4.14Å; V539-I541 HydrophobicContact CG1-CG1 3.51Å; V539-I541 PolarHBondContact O-N 3.41Å; V539-I541 VanDerWaalsContact O-N 3.07Å; I541-T545 PolarHBondContact O-OG1 3.44Å; I541-Y605 HydrophobicContact CB-CE1 4.4Å; I541-Y605 HydrophobicContact CD1-CD1 4.08Å; I541-Y605 HydrophobicContact CD1-CD2 3.79Å; I541-Y605 HydrophobicContact CD1-CE1 4.05Å; I541-Y605 HydrophobicContact CD1-CE2 3.75Å; I541-Y605 HydrophobicContact CD1-CG 3.96Å; I541-Y605 HydrophobicContact CG1-CD1 4.02Å; I541-Y605 HydrophobicContact CG1-CE1 3.74Å; I541-Y605 HydrophobicContact CG1-CE2 4.29Å; I541-Y605 HydrophobicContact CG1-CG 4.42Å; I541-Y605 HydrophobicContact CG2-CE1 3.97Å; I541-Y605 HydrophobicContact CG2-CE2 4.12Å; I541-Y605 VanDerWaalsContact CG2-CZ 3.46Å; I541-Y605 WeakPolarHBondContact CG2-OH 3.43Å; I541-L655 HydrophobicContact CD1-CD1 4.03Å
542	F	77.3	Confident	79	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.018	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-5.3	-172.6	-55.4	-38.3	0	0	0	114.3	L536 V539 E540 D544 T545 F549 L550 L553 M578 I580	L536-F542 HydrophobicContact CB-CD2 4.43Å; L536-F542 HydrophobicContact CD2-CD2 3.89Å; L536-F542 HydrophobicContact CD2-CE2 3.85Å; V539-F542 HydrophobicContact CB-CD2 3.83Å; V539-F542 HydrophobicContact CB-CE2 4.42Å; V539-F542 HydrophobicContact CG1-CD2 4.18Å; V539-F542 HydrophobicContact CG1-CE2 4.38Å; V539-F542 HydrophobicContact CG2-CD2 4.21Å; V539-F542 PolarHBondContact O-N 2.79Å; E540-F542 PolarHBondContact O-N 3.08Å; F542-D544 VanDerWaalsContact C-N 3.31Å; F542-D544 PolarHBondContact O-N 3.21Å; F542-T545 PolarHBondContact O-N 3.44Å; F542-F549 AromaticContact CD1-CE1 3.58Å; F542-F549 HydrophobicContact CD1-CE1 3.58Å; F542-F549 HydrophobicContact CD1-CZ 4.27Å; F542-F549 AromaticContact CE1-CE1 3.5Å; F542-F549 HydrophobicContact CE1-CE1 3.5Å; F542-F549 VanDerWaalsContact CE1-CE1 3.5Å; F542-F549 AromaticContact CE1-CZ 3.77Å; F542-F549 HydrophobicContact CE1-CZ 3.77Å; F542-F549 HydrophobicContact CZ-CE1 4.37Å; F542-L550 HydrophobicContact CB-CD2 3.92Å; F542-L550 HydrophobicContact CG-CD2 4.25Å; F542-L553 HydrophobicContact CD2-CD2 4.36Å; F542-L553 HydrophobicContact CE1-CD2 4Å; F542-L553 HydrophobicContact CE2-CD2 3.66Å; F542-L553 HydrophobicContact CZ-CD2 3.44Å; F542-L553 VanDerWaalsContact CZ-CD2 3.44Å; F542-M578 HydrophobicContact CZ-CE 4.24Å; F542-I580 HydrophobicContact CE2-CD1 3.89Å
543	Q	76	Confident	79.4	Confident	115 Å²	115	54.1 Å²	54.1	54%	0.537	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-44.8	175.6	-74.1	174	19.4	0	0	111.9	K537 Q538 V539	K537-Q543 WeakPolarHBondContact O-CG 3.44Å; Q538-Q543 PolarHBondContact O-NE2 3.19Å; V539-Q543 PolarHBondContact O-N 3.26Å
544	D	75.9	Confident	79.6	Confident	125 Å²	125	52.7 Å²	52.7	67%	0.668	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	31.7	-177.2	-58.2	-31.1	0	0	0	113.3	F542 K654	F542-D544 VanDerWaalsContact C-N 3.31Å; F542-D544 PolarHBondContact O-N 3.21Å; D544-K654 PolarHBondContact O-NZ 3.14Å
545	T	80	Confident	79.7	Confident	22 Å²	22	49.3 Å²	49.3	14%	0.135	25%	0.25	C	S	.	.	S	Bend	trans	-114.8	146	-177	-53.9	0	0	0	0	111.8	I541 F542 F549 A651	I541-T545 PolarHBondContact O-OG1 3.44Å; F542-T545 PolarHBondContact O-N 3.44Å; T545-F549 HydrophobicContact CG2-CB 3.82Å; T545-F549 HydrophobicContact CG2-CD1 3.33Å; T545-F549 HydrophobicContact CG2-CD2 4.46Å; T545-F549 HydrophobicContact CG2-CE1 4.02Å; T545-F549 HydrophobicContact CG2-CG 3.61Å; T545-A651 HydrophobicContact CG2-CB 3.78Å
546	E	82.9	Confident	80.2	Confident	101 Å²	101	51.2 Å²	51.2	47%	0.472	26%	0.257	S	S	.	.			trans	-53.5	136.7	180	-64.2	163.3	-147	0	0	111.9	G548 F549 L550 Y648 N650	E546-G548 PolarHBondContact O-N 3.21Å; E546-F549 WeakPolarHBondContact O-CB 3.41Å; E546-F549 PolarHBondContact O-N 3.5Å; E546-F549 VanDerWaalsContact O-N 3.1Å; E546-L550 PolarHBondContact O-N 3.36Å; E546-Y648 WeakPolarHBondContact OE2-CD1 3.22Å; E546-N650 PolarHBondContact OE1-ND2 3.47Å
547	E	79.2	Confident	80.3	Confident	126 Å²	126	52.4 Å²	52.4	59%	0.589	26%	0.263	S	S	*	.	H	α-helix	trans	-64.5	-25	-176.8	-61.3	-159.1	133	0	0	113	K537 L550 S551	K537-E547 IonicContact NZ-OE1 3.21Å; K537-E547 PolarHBondContact NZ-OE1 3.47Å; E547-L550 PolarHBondContact O-N 3.2Å; E547-S551 PolarHBondContact O-N 3.06Å
548	G	80.4	Confident	80.5	Confident	29 Å²	29	53.4 Å²	53.4	30%	0.299	26%	0.264	S	S	.	.	H	α-helix	trans	-56.4	-51.8	170.2	0	0	0	0	0	112.3	E546 L550 S551 E552	E546-G548 PolarHBondContact O-N 3.21Å; G548-L550 VanDerWaalsContact C-N 3.31Å; G548-L550 PolarHBondContact O-N 3.06Å; G548-S551 PolarHBondContact O-N 3.24Å; G548-S551 PolarHBondContact O-OG 2.99Å; G548-E552 PolarHBondContact O-N 3Å; G548-E552 VanDerWaalsContact O-N 3.09Å
549	F	84.5	Confident	80.8	Confident	1 Å²	1	49.9 Å²	49.9	0%	0.004	25%	0.251	C	S	.	.	H	α-helix	trans	-56.6	-43.5	174.4	168.8	-87.3	0	0	0	112	F542 T545 E546 E552 L553 V644 L645 Y648 A651	F542-F549 AromaticContact CD1-CE1 3.58Å; F542-F549 HydrophobicContact CD1-CE1 3.58Å; F542-F549 HydrophobicContact CD1-CZ 4.27Å; F542-F549 AromaticContact CE1-CE1 3.5Å; F542-F549 HydrophobicContact CE1-CE1 3.5Å; F542-F549 VanDerWaalsContact CE1-CE1 3.5Å; F542-F549 AromaticContact CE1-CZ 3.77Å; F542-F549 HydrophobicContact CE1-CZ 3.77Å; F542-F549 HydrophobicContact CZ-CE1 4.37Å; T545-F549 HydrophobicContact CG2-CB 3.82Å; T545-F549 HydrophobicContact CG2-CD1 3.33Å; T545-F549 HydrophobicContact CG2-CD2 4.46Å; T545-F549 HydrophobicContact CG2-CE1 4.02Å; T545-F549 HydrophobicContact CG2-CG 3.61Å; E546-F549 WeakPolarHBondContact O-CB 3.41Å; E546-F549 PolarHBondContact O-N 3.5Å; E546-F549 VanDerWaalsContact O-N 3.1Å; F549-E552 WeakPolarHBondContact O-CB 3.42Å; F549-E552 PolarHBondContact O-N 2.76Å; F549-L553 HydrophobicContact CE1-CD2 3.93Å; F549-L553 HydrophobicContact CZ-CD1 4.16Å; F549-L553 HydrophobicContact CZ-CD2 4.17Å; F549-L553 VanDerWaalsContact O-CB 3.31Å; F549-L553 WeakPolarHBondContact O-CB 3.23Å; F549-L553 PolarHBondContact O-N 3.2Å; F549-V644 HydrophobicContact CD2-CG1 3.37Å; F549-V644 HydrophobicContact CE2-CB 4.43Å; F549-V644 HydrophobicContact CE2-CG1 3.48Å; F549-V644 VanDerWaalsContact CE2-CG1 3.48Å; F549-V644 HydrophobicContact CG-CG1 4.33Å; F549-L645 HydrophobicContact CE2-CD2 3.95Å; F549-Y648 HydrophobicContact CB-CD1 3.83Å; F549-Y648 HydrophobicContact CB-CD2 3.99Å; F549-Y648 HydrophobicContact CB-CE1 4.07Å; F549-Y648 HydrophobicContact CB-CE2 4.24Å; F549-Y648 HydrophobicContact CB-CG 3.78Å; F549-Y648 AromaticContact CD2-CD2 3.93Å; F549-Y648 HydrophobicContact CD2-CD2 3.93Å; F549-Y648 AromaticContact CD2-CG 3.93Å; F549-Y648 HydrophobicContact CD2-CG 3.93Å; F549-Y648 HydrophobicContact CG-CD2 4.48Å; F549-Y648 HydrophobicContact CG-CG 4.35Å; F549-A651 HydrophobicContact CD2-CB 3.8Å; F549-A651 HydrophobicContact CE2-CB 3.78Å; F549-A651 HydrophobicContact CG-CB 4.24Å; F549-A651 HydrophobicContact CZ-CB 4.19Å
550	L	83	Confident	81	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-61.6	-46.1	177.7	-81.9	171.7	0	0	0	111.6	L533 L536 K537 F542 E546 E547 G548 E552 L553 V554	L533-L550 HydrophobicContact CD1-CB 4.1Å; L533-L550 HydrophobicContact CD1-CD1 3.91Å; L533-L550 HydrophobicContact CD1-CG 4.47Å; L536-L550 HydrophobicContact CB-CD2 3.86Å; L536-L550 HydrophobicContact CD1-CD2 4.17Å; K537-L550 HydrophobicContact CG-CD1 4.26Å; F542-L550 HydrophobicContact CB-CD2 3.92Å; F542-L550 HydrophobicContact CG-CD2 4.25Å; E546-L550 PolarHBondContact O-N 3.36Å; E547-L550 PolarHBondContact O-N 3.2Å; G548-L550 VanDerWaalsContact C-N 3.31Å; G548-L550 PolarHBondContact O-N 3.06Å; L550-E552 PolarHBondContact O-N 3.42Å; L550-L553 PolarHBondContact O-N 3.38Å; L550-V554 WeakPolarHBondContact O-CB 3.48Å; L550-V554 WeakPolarHBondContact O-CG2 3.47Å; L550-V554 PolarHBondContact O-N 3.31Å
551	S	79.8	Confident	81.6	Confident	43 Å²	43	46.1 Å²	46.1	30%	0.301	24%	0.237	S	C	.	.	H	α-helix	trans	-62	-40.5	179.4	73	0	0	0	0	113.4	E547 G548	E547-S551 PolarHBondContact O-N 3.06Å; G548-S551 PolarHBondContact O-N 3.24Å; G548-S551 PolarHBondContact O-OG 2.99Å
552	E	82.8	Confident	82.3	Confident	43 Å²	43	46.7 Å²	46.7	20%	0.201	24%	0.238	C	C	.	.	H	α-helix	trans	-61.9	-43.8	173.7	-91.1	-92.3	133.6	0	0	112.2	G548 F549 L550 K556 V644 Y648	G548-E552 PolarHBondContact O-N 3Å; G548-E552 VanDerWaalsContact O-N 3.09Å; F549-E552 WeakPolarHBondContact O-CB 3.42Å; F549-E552 PolarHBondContact O-N 2.76Å; L550-E552 PolarHBondContact O-N 3.42Å; E552-K556 WeakPolarHBondContact O-CD 3.37Å; E552-K556 IonicContact OE1-NZ 2.66Å; E552-K556 IonicContact OE2-NZ 2.74Å; E552-K556 PolarHBondContact OE2-NZ 2.76Å; E552-V644 HydrophobicContact CB-CG1 4.15Å; E552-V644 HydrophobicContact CB-CG2 4.34Å; E552-Y648 HydrophobicContact CG-CE2 4.19Å
553	L	85.4	Confident	82.9	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-68.4	-48.7	-177.7	-163.1	74.5	0	0	0	111.3	L536 F542 F549 L550 L555 K556 L557 L636 L641	L536-L553 HydrophobicContact CD2-CD2 4.4Å; F542-L553 HydrophobicContact CD2-CD2 4.36Å; F542-L553 HydrophobicContact CE1-CD2 4Å; F542-L553 HydrophobicContact CE2-CD2 3.66Å; F542-L553 HydrophobicContact CZ-CD2 3.44Å; F542-L553 VanDerWaalsContact CZ-CD2 3.44Å; F549-L553 HydrophobicContact CE1-CD2 3.93Å; F549-L553 HydrophobicContact CZ-CD1 4.16Å; F549-L553 HydrophobicContact CZ-CD2 4.17Å; F549-L553 VanDerWaalsContact O-CB 3.31Å; F549-L553 WeakPolarHBondContact O-CB 3.23Å; F549-L553 PolarHBondContact O-N 3.2Å; L550-L553 PolarHBondContact O-N 3.38Å; L553-L555 PolarHBondContact O-N 3.21Å; L553-K556 WeakPolarHBondContact O-CA 3.29Å; L553-K556 PolarHBondContact O-N 2.95Å; L553-L557 PolarHBondContact O-N 2.97Å; L553-L636 HydrophobicContact CD1-CD1 4.32Å; L553-L636 HydrophobicContact CD1-CD2 3.39Å; L553-L636 HydrophobicContact CG-CD2 4.32Å; L553-L641 HydrophobicContact CD1-CD1 4.26Å
554	V	83.2	Confident	83.6	Confident	3 Å²	3	44.5 Å²	44.5	2%	0.018	24%	0.235	C	C	.	.	H	α-helix	trans	-47.4	-46.2	178.8	157.5	0	0	0	0	112	A528 I529 H532 L536 L550 K556 L557	A528-V554 HydrophobicContact CB-CG1 3.35Å; A528-V554 VanDerWaalsContact O-CG1 3.29Å; A528-V554 WeakPolarHBondContact O-CG1 3.47Å; I529-V554 HydrophobicContact CG1-CG1 4.23Å; H532-V554 HydrophobicContact CB-CG1 4.5Å; H532-V554 HydrophobicContact CB-CG2 4.26Å; L536-V554 HydrophobicContact CD1-CB 4.46Å; L536-V554 HydrophobicContact CD1-CG2 3.27Å; L550-V554 WeakPolarHBondContact O-CB 3.48Å; L550-V554 WeakPolarHBondContact O-CG2 3.47Å; L550-V554 PolarHBondContact O-N 3.31Å; V554-K556 PolarHBondContact O-N 2.7Å; V554-L557 PolarHBondContact O-N 2.65Å
555	L	79.7	Confident	84.2	Confident	39 Å²	39	39.5 Å²	39.5	20%	0.204	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-13.6	-178.4	-77.5	170.4	0	0	0	114.6	Y521 K524 A525 A528 L553	Y521-L555 HydrophobicContact CE1-CD1 4.27Å; Y521-L555 HydrophobicContact CE2-CD1 4.09Å; Y521-L555 WeakPolarHBondContact OH-CD1 3.37Å; K524-L555 HydrophobicContact CG-CD2 4.3Å; A525-L555 HydrophobicContact CB-CD1 3.89Å; A525-L555 HydrophobicContact CB-CD2 4.09Å; A525-L555 HydrophobicContact CB-CG 4.33Å; A528-L555 HydrophobicContact CB-CD2 4.37Å; L553-L555 PolarHBondContact O-N 3.21Å
556	K	84.5	Confident	84.8	Confident	60 Å²	60	39.8 Å²	39.8	26%	0.261	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-1.3	-177.6	-61.2	167.7	-169.9	168.3	0	112.3	E552 L553 V554 L636 D640 V644	E552-K556 WeakPolarHBondContact O-CD 3.37Å; E552-K556 IonicContact OE1-NZ 2.66Å; E552-K556 IonicContact OE2-NZ 2.74Å; E552-K556 PolarHBondContact OE2-NZ 2.76Å; L553-K556 WeakPolarHBondContact O-CA 3.29Å; L553-K556 PolarHBondContact O-N 2.95Å; V554-K556 PolarHBondContact O-N 2.7Å; K556-L636 HydrophobicContact CB-CD1 3.82Å; K556-D640 HydrophobicContact CB-CB 4.25Å; K556-D640 HydrophobicContact CD-CB 4.16Å; K556-D640 HydrophobicContact CG-CB 4.49Å; K556-V644 HydrophobicContact CD-CG2 3.85Å; K556-V644 VanDerWaalsContact NZ-CG2 3.27Å
557	L	82.8	Confident	85.3	Confident	24 Å²	24	38.9 Å²	38.9	13%	0.126	21%	0.207	C	C	.	.			trans	-76.9	140.5	173.7	-63	178.6	0	0	0	111.3	L536 L553 V554 I580 F634 L636	L536-L557 HydrophobicContact CD1-CD1 3.85Å; L536-L557 HydrophobicContact CD2-CD1 3.93Å; L536-L557 HydrophobicContact CG-CD1 4.21Å; L553-L557 PolarHBondContact O-N 2.97Å; V554-L557 PolarHBondContact O-N 2.65Å; L557-I580 HydrophobicContact CD2-CD1 4.34Å; L557-F634 HydrophobicContact CB-CB 4.38Å; L557-F634 HydrophobicContact CB-CD1 4.26Å; L557-F634 HydrophobicContact CD1-CB 4.29Å; L557-F634 HydrophobicContact CD1-CD1 4.44Å; L557-F634 HydrophobicContact CD1-CG 4.24Å; L557-F634 HydrophobicContact CD2-CB 4.22Å; L557-L636 HydrophobicContact CD2-CB 4.04Å; L557-L636 HydrophobicContact CD2-CD1 4.28Å
558	R	83.6	Confident	85.9	Confident	106 Å²	106	33.5 Å²	33.5	40%	0.4	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	127.8	173.3	-175.7	177.4	-178.9	-140.7	-5.6	110.4	C635 S754	R558-C635 PolarHBondContact N-O 3.32Å; R558-C635 PolarHBondContact O-N 3.47Å; R558-S754 PolarHBondContact NH2-OG 3.19Å
559	V	82.5	Confident	86.5	Confident	44 Å²	44	32.3 Å²	32.3	27%	0.267	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	133.2	174.7	-177	0	0	0	0	110.4	F634	V559-F634 HydrophobicContact CG2-CD1 3.91Å; V559-F634 HydrophobicContact CG2-CE1 3.63Å
560	V	85.7	Confident	86.8	Confident	36 Å²	36	39 Å²	39	22%	0.218	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	131.7	174.3	-174.1	0	0	0	0	109.3	F562 L633 C635	V560-F562 HydrophobicContact CB-CE2 4.16Å; V560-F562 HydrophobicContact CG1-CD2 4.16Å; V560-F562 HydrophobicContact CG1-CE2 3.47Å; V560-F562 VanDerWaalsContact CG1-CE2 3.47Å; V560-F562 HydrophobicContact CG1-CZ 3.9Å; V560-L633 PolarHBondContact N-O 2.85Å; V560-L633 PolarHBondContact O-N 3.42Å; V560-C635 HydrophobicContact CG2-CB 3.68Å
561	L	87.8	Confident	87.1	Confident	28 Å²	28	43.3 Å²	43.3	15%	0.147	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	132.2	178.4	175.8	71.5	0	0	0	110.7	F502 L503 Y630 D632	F502-L561 HydrophobicContact CD1-CD2 3.66Å; F502-L561 HydrophobicContact CE1-CD1 3.7Å; F502-L561 HydrophobicContact CE1-CD2 3.59Å; F502-L561 HydrophobicContact CE1-CG 4.28Å; F502-L561 HydrophobicContact CZ-CD1 4.42Å; L503-L561 HydrophobicContact CD2-CD2 3.59Å; L503-L561 HydrophobicContact CG-CD2 4.26Å; L561-Y630 HydrophobicContact CD1-CD1 4.36Å; L561-D632 WeakPolarHBondContact CD1-OD1 3.4Å
562	F	90.7	Very high	87.5	Confident	30 Å²	30	42.7 Å²	42.7	13%	0.132	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	143.4	171.7	-70.9	-90.8	0	0	0	111.4	V560 D566 V568 Y630 S631 L633	V560-F562 HydrophobicContact CB-CE2 4.16Å; V560-F562 HydrophobicContact CG1-CD2 4.16Å; V560-F562 HydrophobicContact CG1-CE2 3.47Å; V560-F562 VanDerWaalsContact CG1-CE2 3.47Å; V560-F562 HydrophobicContact CG1-CZ 3.9Å; F562-D566 HydrophobicContact CB-CB 4.49Å; F562-D566 HydrophobicContact CD1-CB 4.27Å; F562-V568 HydrophobicContact CD1-CG2 3.91Å; F562-V568 HydrophobicContact CD2-CG1 4.49Å; F562-V568 HydrophobicContact CD2-CG2 4.04Å; F562-V568 HydrophobicContact CE1-CB 4.23Å; F562-V568 HydrophobicContact CE1-CG1 4.17Å; F562-V568 HydrophobicContact CE1-CG2 4.11Å; F562-V568 HydrophobicContact CE2-CG1 3.88Å; F562-V568 HydrophobicContact CE2-CG2 4.23Å; F562-V568 HydrophobicContact CG-CG2 3.88Å; F562-V568 HydrophobicContact CZ-CB 4.26Å; F562-V568 HydrophobicContact CZ-CG1 3.7Å; F562-V568 HydrophobicContact CZ-CG2 4.27Å; F562-Y630 WeakPolarHBondContact O-CA 3.31Å; F562-S631 PolarHBondContact N-O 2.94Å; F562-S631 PolarHBondContact O-N 3.49Å; F562-L633 HydrophobicContact CD2-CD1 3.65Å; F562-L633 HydrophobicContact CD2-CG 4.06Å; F562-L633 HydrophobicContact CE2-CD1 3.71Å; F562-L633 HydrophobicContact CE2-CG 4.34Å
563	A	89.5	Confident	87.8	Confident	9 Å²	9	44.8 Å²	44.8	7%	0.074	22%	0.223	C	C	.	.			trans	-85.9	160.2	178.2	0	0	0	0	0	111.7	G565 D566 G629 Y630	A563-G565 PolarHBondContact O-N 3.35Å; A563-D566 WeakPolarHBondContact CB-OD2 3.47Å; A563-D566 PolarHBondContact N-OD2 3.36Å; A563-D566 VanDerWaalsContact O-CB 3.32Å; A563-D566 WeakPolarHBondContact O-CB 3.46Å; A563-D566 PolarHBondContact O-N 2.66Å; A563-D566 VanDerWaalsContact O-N 3.12Å; A563-G629 CarbonylContact C-O 3.59Å; A563-Y630 HydrophobicContact CB-CD1 4.4Å; A563-Y630 HydrophobicContact CB-CE1 3.99Å
564	P	91.8	Very high	88	Confident	64 Å²	64	50.1 Å²	50.1	42%	0.416	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	129.6	175.4	21.1	-33.8	0	0	0	112	L628 G629 Y630	P564-L628 WeakPolarHBondContact CB-O 3.25Å; P564-G629 WeakPolarHBondContact CA-O 3.31Å; P564-Y630 HydrophobicContact CG-CD2 4.41Å; P564-Y630 HydrophobicContact CG-CE2 4.14Å
565	G	89.1	Confident	88.1	Confident	19 Å²	19	50 Å²	50	20%	0.196	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.4	-1.8	-178.9	0	0	0	0	0	115.5	A563 R626 S627	A563-G565 PolarHBondContact O-N 3.35Å; G565-R626 PolarHBondContact O-NE 2.97Å; G565-S627 WeakPolarHBondContact CA-O 3.45Å; G565-S627 PolarHBondContact N-O 3.39Å
566	D	91.8	Very high	88.5	Confident	28 Å²	28	53.3 Å²	53.3	15%	0.15	26%	0.263	C	S	.	.			trans	-78.7	138.6	-177.9	-74.8	-6.9	0	0	0	113.6	R495 F562 A563 R626 S627	R495-D566 IonicContact CZ-OD1 2.72Å; R495-D566 IonicContact CZ-OD2 2.69Å; R495-D566 IonicContact NH1-OD1 2.85Å; R495-D566 PolarHBondContact NH1-OD1 3.18Å; R495-D566 IonicContact NH2-OD1 2.75Å; R495-D566 PolarHBondContact NH2-OD1 3.38Å; R495-D566 IonicContact NH2-OD2 3.12Å; R495-D566 PolarHBondContact NH2-OD2 3.25Å; F562-D566 HydrophobicContact CB-CB 4.49Å; F562-D566 HydrophobicContact CD1-CB 4.27Å; A563-D566 WeakPolarHBondContact CB-OD2 3.47Å; A563-D566 PolarHBondContact N-OD2 3.36Å; A563-D566 VanDerWaalsContact O-CB 3.32Å; A563-D566 WeakPolarHBondContact O-CB 3.46Å; A563-D566 PolarHBondContact O-N 2.66Å; A563-D566 VanDerWaalsContact O-N 3.12Å; D566-R626 CarbonylContact O-C 3.52Å; D566-R626 VanDerWaalsContact O-CA 3.28Å; D566-R626 WeakPolarHBondContact O-CA 3.5Å; D566-S627 PolarHBondContact O-N 2.8Å
567	Y	92.7	Very high	88.9	Confident	83 Å²	83	52.5 Å²	52.5	33%	0.325	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	118.5	171.6	-73	-98.5	0	0	0	109.5	R570 L589 V625 R626	Y567-R570 HydrophobicContact CD1-CG 4.15Å; Y567-R570 HydrophobicContact CG-CG 4.36Å; Y567-L589 HydrophobicContact CE1-CD1 3.64Å; Y567-V625 CarbonylContact C-O 3.52Å; Y567-V625 WeakPolarHBondContact CA-O 3.43Å; Y567-R626 HydrophobicContact CD1-CB 4.32Å; Y567-R626 HydrophobicContact CD2-CG 4.37Å; Y567-R626 HydrophobicContact CE1-CB 4.34Å; Y567-R626 HydrophobicContact CE2-CG 4.33Å
568	V	93.3	Very high	89.2	Confident	12 Å²	12	51.4 Å²	51.4	7%	0.073	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	-34.2	174.4	-176.4	0	0	0	0	110.8	F562 Y579 L586 F606 V625 L633	F562-V568 HydrophobicContact CD1-CG2 3.91Å; F562-V568 HydrophobicContact CD2-CG1 4.49Å; F562-V568 HydrophobicContact CD2-CG2 4.04Å; F562-V568 HydrophobicContact CE1-CB 4.23Å; F562-V568 HydrophobicContact CE1-CG1 4.17Å; F562-V568 HydrophobicContact CE1-CG2 4.11Å; F562-V568 HydrophobicContact CE2-CG1 3.88Å; F562-V568 HydrophobicContact CE2-CG2 4.23Å; F562-V568 HydrophobicContact CG-CG2 3.88Å; F562-V568 HydrophobicContact CZ-CB 4.26Å; F562-V568 HydrophobicContact CZ-CG1 3.7Å; F562-V568 HydrophobicContact CZ-CG2 4.27Å; V568-Y579 HydrophobicContact CG1-CD2 3.7Å; V568-Y579 HydrophobicContact CG1-CE1 4.43Å; V568-Y579 HydrophobicContact CG1-CE2 3.54Å; V568-Y579 HydrophobicContact CG1-CG 4.18Å; V568-L586 HydrophobicContact CG2-CD2 4.25Å; V568-F606 HydrophobicContact CB-CE2 4.35Å; V568-F606 HydrophobicContact CB-CZ 4.2Å; V568-F606 HydrophobicContact CG1-CE2 3.94Å; V568-F606 HydrophobicContact CG1-CZ 3.72Å; V568-V625 PolarHBondContact N-O 3.04Å; V568-L633 HydrophobicContact CB-CD1 4.46Å; V568-L633 HydrophobicContact CG1-CD1 3.73Å; V568-L633 HydrophobicContact CG2-CD1 3.89Å
569	C	92.5	Very high	89.6	Confident	5 Å²	5	47.2 Å²	47.2	3%	0.034	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	157.4	167.4	59	0	0	0	0	110.2	E573 R621 S624 V625	C569-E573 WeakPolarHBondContact CA-OE2 3.21Å; C569-R621 HydrophobicContact CB-CG 4.04Å; C569-S624 CarbonylContact O-C 3.27Å; C569-S624 WeakPolarHBondContact O-CA 3.39Å; C569-V625 PolarHBondContact O-N 2.88Å
570	R	91.6	Very high	90	Very high	141 Å²	141	45.1 Å²	45.1	53%	0.532	23%	0.226	S	C	.	.			trans	-115.4	148.9	173.3	-53.6	178	175	-160	-2.3	110.3	Y567 G572 E573 R621	Y567-R570 HydrophobicContact CD1-CG 4.15Å; Y567-R570 HydrophobicContact CG-CG 4.36Å; R570-G572 PolarHBondContact O-N 3.24Å; R570-E573 HydrophobicContact CB-CG 4Å; R570-E573 WeakPolarHBondContact CB-OE1 3.3Å; R570-E573 WeakPolarHBondContact CD-OE1 3.27Å; R570-E573 WeakPolarHBondContact CG-OE1 3.07Å; R570-E573 PolarHBondContact N-OE2 2.88Å; R570-E573 WeakPolarHBondContact O-CB 3.41Å; R570-E573 PolarHBondContact O-N 3.29Å; R570-R621 VanDerWaalsContact O-CB 3.27Å; R570-R621 WeakPolarHBondContact O-CB 3.31Å
571	K	88.8	Confident	90.3	Very high	93 Å²	93	43.4 Å²	43.4	40%	0.404	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	134	172.8	-175.5	172.7	-174	176.4	0	110.5	E573 D591 T622 S624	K571-E573 PolarHBondContact O-N 3.16Å; K571-D591 WeakPolarHBondContact CD-OD1 3.34Å; K571-D591 IonicContact NZ-OD1 3.92Å; K571-D591 PolarHBondContact NZ-OD1 2.87Å; K571-D591 IonicContact NZ-OD2 3.46Å; K571-D591 PolarHBondContact NZ-OD2 3.46Å; K571-T622 WeakPolarHBondContact CE-O 3.48Å; K571-T622 WeakPolarHBondContact CG-O 3.12Å; K571-S624 PolarHBondContact N-OG 3.4Å
572	G	86.9	Confident	90.2	Very high	29 Å²	29	43.9 Å²	43.9	30%	0.299	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.9	-15.4	178.9	0	0	0	0	0	116.4	R570 R620 R621	R570-G572 PolarHBondContact O-N 3.24Å; G572-R620 PolarHBondContact O-NH1 2.93Å; G572-R621 PolarHBondContact N-O 2.97Å
573	E	90	Very high	90.1	Very high	87 Å²	87	49.2 Å²	49.2	41%	0.407	24%	0.237	S	C	.	.	S	Bend	trans	-63.4	157.5	173.9	-70.7	177	167.4	0	0	112	C569 R570 K571 G575 R620 R621	C569-E573 WeakPolarHBondContact CA-OE2 3.21Å; R570-E573 HydrophobicContact CB-CG 4Å; R570-E573 WeakPolarHBondContact CB-OE1 3.3Å; R570-E573 WeakPolarHBondContact CD-OE1 3.27Å; R570-E573 WeakPolarHBondContact CG-OE1 3.07Å; R570-E573 PolarHBondContact N-OE2 2.88Å; R570-E573 WeakPolarHBondContact O-CB 3.41Å; R570-E573 PolarHBondContact O-N 3.29Å; K571-E573 PolarHBondContact O-N 3.16Å; E573-G575 PolarHBondContact O-N 2.91Å; E573-R620 CarbonylContact O-C 3.51Å; E573-R620 VanDerWaalsContact O-CA 3.23Å; E573-R620 WeakPolarHBondContact O-CA 3.33Å; E573-R621 HydrophobicContact CB-CG 4.11Å; E573-R621 WeakPolarHBondContact O-CG 3.39Å; E573-R621 PolarHBondContact O-N 3.33Å
574	I	89	Confident	90.1	Very high	113 Å²	113	50.3 Å²	50.3	58%	0.579	25%	0.249	S	C	*	.	B	Isolated β-bridge	trans	-79.9	116.6	178.6	-59.2	172.5	0	0	0	109.8	K576	I574-K576 HydrophobicContact CG2-CG 4.49Å; I574-K576 PolarHBondContact O-N 2.71Å; I574-K576 VanDerWaalsContact O-N 3.13Å
575	G	86.5	Confident	90.2	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.01	25%	0.251	C	S	.	.			trans	-80.4	91.9	-178.5	0	0	0	0	0	113	E573 N619	E573-G575 PolarHBondContact O-N 2.91Å; G575-N619 PolarHBondContact N-O 2.88Å
576	K	88.4	Confident	90.5	Very high	107 Å²	107	51.3 Å²	51.3	47%	0.465	24%	0.241	S	C	.	.			trans	-82.9	-13.9	176.8	-57.4	-176.9	-170.9	175	0	114.7	I574 K638 D749	I574-K576 HydrophobicContact CG2-CG 4.49Å; I574-K576 PolarHBondContact O-N 2.71Å; I574-K576 VanDerWaalsContact O-N 3.13Å; K576-K638 WeakPolarHBondContact O-CB 3.48Å; K576-K638 PolarHBondContact O-N 3.26Å; K576-D749 IonicContact NZ-OD1 3.59Å; K576-D749 PolarHBondContact NZ-OD1 2.99Å
577	Q	91.1	Very high	90.7	Very high	43 Å²	43	52.2 Å²	52.2	20%	0.201	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	152.4	-165.2	-73.7	160.4	-6.4	0	0	111.1	Y579 R621 C635 L636	Q577-Y579 PolarHBondContact OE1-OH 3.04Å; Q577-R621 VanDerWaalsContact O-CZ 3.26Å; Q577-R621 PolarHBondContact O-NH1 3.21Å; Q577-R621 PolarHBondContact O-NH2 3.48Å; Q577-C635 VanDerWaalsContact CG-SG 3.56Å; Q577-C635 PolarHBondContact OE1-SG 2.8Å; Q577-L636 CarbonylContact C-O 3.54Å; Q577-L636 VanDerWaalsContact CA-O 3.25Å; Q577-L636 WeakPolarHBondContact CA-O 3.27Å
578	M	89.9	Confident	90.7	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	156.3	166.8	60.7	178.7	-125	0	0	109.3	F542 I580 I611 C635 L636 L641	F542-M578 HydrophobicContact CZ-CE 4.24Å; M578-I580 HydrophobicContact CE-CD1 3.96Å; M578-I580 HydrophobicContact CE-CG1 4.15Å; M578-I611 HydrophobicContact CB-CD1 3.51Å; M578-I611 HydrophobicContact CG-CD1 3.96Å; M578-C635 WeakPolarHBondContact O-CA 3.47Å; M578-L636 HydrophobicContact CE-CB 4.19Å; M578-L636 HydrophobicContact CE-CD2 3.65Å; M578-L636 HydrophobicContact CG-CB 3.8Å; M578-L636 HydrophobicContact CG-CD2 4.29Å; M578-L636 PolarHBondContact N-O 3.44Å; M578-L636 PolarHBondContact O-N 2.82Å; M578-L636 HydrophobicContact SD-CD2 3.98Å; M578-L641 HydrophobicContact SD-CD1 4.3Å; M578-L641 HydrophobicContact SD-CD2 3.69Å
579	Y	92.3	Very high	90.6	Very high	18 Å²	18	48.5 Å²	48.5	7%	0.071	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	136.6	-178.9	-61.2	-70.9	0	0	0	110.7	V568 Q577 Y605 F606 L633 F634 C635	V568-Y579 HydrophobicContact CG1-CD2 3.7Å; V568-Y579 HydrophobicContact CG1-CE1 4.43Å; V568-Y579 HydrophobicContact CG1-CE2 3.54Å; V568-Y579 HydrophobicContact CG1-CG 4.18Å; Q577-Y579 PolarHBondContact OE1-OH 3.04Å; Y579-Y605 CarbonylContact O-C 3.53Å; Y579-Y605 VanDerWaalsContact O-CA 3.25Å; Y579-Y605 WeakPolarHBondContact O-CA 3.31Å; Y579-F606 HydrophobicContact CD2-CD2 4.36Å; Y579-F606 AromaticContact CD2-CE2 3.66Å; Y579-F606 HydrophobicContact CD2-CE2 3.66Å; Y579-F606 AromaticContact CD2-CZ 3.81Å; Y579-F606 HydrophobicContact CD2-CZ 3.81Å; Y579-F606 HydrophobicContact CG-CE1 4.45Å; Y579-F606 HydrophobicContact CG-CE2 4.29Å; Y579-F606 AromaticContact CG-CZ 3.99Å; Y579-F606 HydrophobicContact CG-CZ 3.99Å; Y579-F606 PolarHBondContact N-O 2.86Å; Y579-F606 PolarHBondContact O-N 3.36Å; Y579-L633 HydrophobicContact CD1-CB 4.31Å; Y579-L633 HydrophobicContact CD1-CD1 4.37Å; Y579-L633 HydrophobicContact CG-CD1 4.34Å; Y579-F634 CarbonylContact C-O 3.26Å; Y579-F634 VanDerWaalsContact CA-O 3.31Å; Y579-F634 WeakPolarHBondContact CA-O 3.46Å; Y579-C635 HydrophobicContact CD1-CB 3.94Å; Y579-C635 HydrophobicContact CE1-CB 3.83Å
580	I	90.7	Very high	90.2	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	127.9	172.3	-54.2	166.5	0	0	0	106.9	L536 V539 F542 L557 M578 N582 L633 F634	L536-I580 HydrophobicContact CD2-CD1 3.66Å; V539-I580 HydrophobicContact CG2-CG2 3.58Å; F542-I580 HydrophobicContact CE2-CD1 3.89Å; L557-I580 HydrophobicContact CD2-CD1 4.34Å; M578-I580 HydrophobicContact CE-CD1 3.96Å; M578-I580 HydrophobicContact CE-CG1 4.15Å; I580-N582 PolarHBondContact O-N 3.24Å; I580-L633 CarbonylContact O-C 3.52Å; I580-L633 VanDerWaalsContact O-CA 3.3Å; I580-L633 WeakPolarHBondContact O-CA 3.45Å; I580-F634 HydrophobicContact CB-CB 4.28Å; I580-F634 PolarHBondContact N-O 3.13Å; I580-F634 PolarHBondContact O-N 3.47Å
581	V	91.1	Very high	89.8	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	111	-179.5	-173.1	0	0	0	0	109	L586 L600 H601 A602 G603 S604 F606 L633	V581-L586 HydrophobicContact CG2-CD1 3.82Å; V581-L586 HydrophobicContact CG2-CG 4.37Å; V581-L600 HydrophobicContact CG2-CB 4.34Å; V581-H601 VanDerWaalsContact CB-O 3.3Å; V581-H601 WeakPolarHBondContact CB-O 3.38Å; V581-H601 WeakPolarHBondContact CG1-O 3.39Å; V581-A602 WeakPolarHBondContact O-CA 3.42Å; V581-G603 PolarHBondContact O-N 3.27Å; V581-S604 PolarHBondContact N-O 3.26Å; V581-F606 HydrophobicContact CG2-CE1 4.2Å; V581-L633 HydrophobicContact CB-CD2 4.11Å; V581-L633 HydrophobicContact CG1-CD2 4.08Å; V581-L633 HydrophobicContact CG2-CD2 3.91Å
582	N	86.4	Confident	89.5	Confident	37 Å²	37	47 Å²	47	20%	0.198	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-47.7	174.1	-173.3	23.1	0	0	0	110.6	T535 I580 A602 D632 F634	T535-N582 HydrophobicContact CG2-CB 4.33Å; T535-N582 WeakPolarHBondContact CG2-OD1 3.45Å; T535-N582 PolarHBondContact OG1-OD1 2.97Å; T535-N582 VanDerWaalsContact OG1-OD1 3.08Å; I580-N582 PolarHBondContact O-N 3.24Å; N582-A602 WeakPolarHBondContact O-CB 3.29Å; N582-D632 WeakPolarHBondContact CA-O 3.47Å; N582-D632 HydrophobicContact CB-CB 4.25Å; N582-D632 WeakPolarHBondContact CB-O 3.5Å; N582-D632 PolarHBondContact N-O 3.28Å; N582-F634 HydrophobicContact CB-CD2 3.86Å; N582-F634 HydrophobicContact CB-CE2 3.53Å; N582-F634 HydrophobicContact CB-CZ 4.15Å; N582-F634 WeakPolarHBondContact ND2-CZ 3.39Å
583	R	88.2	Confident	89.1	Confident	143 Å²	143	46.6 Å²	46.6	54%	0.54	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	153.4	177.9	-58.6	-175.7	177.3	-172	-0.9	110.7	S631 D632	R583-S631 CarbonylContact O-C 3.43Å; R583-S631 VanDerWaalsContact O-CA 3.32Å; R583-S631 WeakPolarHBondContact O-CA 3.38Å; R583-D632 HydrophobicContact CB-CB 4.06Å; R583-D632 PolarHBondContact N-O 3.24Å; R583-D632 VanDerWaalsContact N-O 3.14Å; R583-D632 PolarHBondContact O-N 3.15Å
584	G	90	Very high	88.6	Confident	31 Å²	31	50.1 Å²	50.1	32%	0.32	25%	0.25	S	S	.	.	S	Bend	trans	98.1	-170.3	-178.8	0	0	0	0	0	113.4
585	K	94.3	Very high	88.6	Confident	104 Å²	104	48.2 Å²	48.2	45%	0.452	24%	0.244	S	C	.	.			trans	-138.9	136.4	-179.9	-64.7	-171.5	-177.7	-170.1	0	109.6	L600 L628 S631	K585-L600 WeakPolarHBondContact CA-O 3.16Å; K585-L628 HydrophobicContact CB-CB 4.44Å; K585-L628 HydrophobicContact CB-CD2 4.46Å; K585-L628 WeakPolarHBondContact O-CB 3.19Å; K585-L628 PolarHBondContact O-N 3.3Å; K585-S631 PolarHBondContact N-OG 3.41Å; K585-S631 PolarHBondContact O-OG 2.97Å
586	L	95.5	Very high	88.7	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	142.7	177.7	-47.1	176.1	0	0	0	110.2	V568 V581 T599 L600 F606 V625 R626 L633	V568-L586 HydrophobicContact CG2-CD2 4.25Å; V581-L586 HydrophobicContact CG2-CD1 3.82Å; V581-L586 HydrophobicContact CG2-CG 4.37Å; L586-T599 CarbonylContact O-C 3.48Å; L586-T599 WeakPolarHBondContact O-CA 3.45Å; L586-L600 HydrophobicContact CB-CB 4.23Å; L586-L600 HydrophobicContact CD1-CD1 4.39Å; L586-L600 PolarHBondContact N-O 2.87Å; L586-L600 VanDerWaalsContact N-O 3.08Å; L586-L600 PolarHBondContact O-N 3.23Å; L586-F606 HydrophobicContact CD1-CD1 4.26Å; L586-F606 HydrophobicContact CD1-CE1 3.27Å; L586-F606 HydrophobicContact CD1-CZ 3.5Å; L586-V625 HydrophobicContact CB-CG1 3.81Å; L586-V625 HydrophobicContact CD1-CG1 3.85Å; L586-V625 HydrophobicContact CG-CG1 4.42Å; L586-R626 CarbonylContact C-O 3.51Å; L586-R626 WeakPolarHBondContact CA-O 3.31Å; L586-L633 HydrophobicContact CD1-CD1 4.12Å; L586-L633 HydrophobicContact CD1-CD2 3.94Å; L586-L633 HydrophobicContact CD2-CD2 4.46Å
587	H	94.6	Very high	88.6	Confident	48 Å²	48	50.8 Å²	50.8	22%	0.222	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	129.2	168.8	-68.9	176.4	0	0	0	109.9	L589 V596 T599 V625 R626	H587-L589 HydrophobicContact CB-CD2 4.32Å; H587-V596 HydrophobicContact CB-CG1 4.04Å; H587-V596 HydrophobicContact CB-CG2 4.26Å; H587-T599 PolarHBondContact CD2-OG1 2.8Å; H587-T599 VanDerWaalsContact CD2-OG1 3.28Å; H587-V625 WeakPolarHBondContact O-CA 3.38Å; H587-R626 PolarHBondContact N-O 2.85Å; H587-R626 PolarHBondContact O-N 3.42Å
588	V	92.8	Very high	88.5	Confident	7 Å²	7	50.6 Å²	50.6	4%	0.042	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	118.7	163.1	-172.9	0	0	0	0	106.8	L597 A598 L600 A623 S624 V625	V588-L597 HydrophobicContact CG1-CB 4.47Å; V588-L597 PolarHBondContact O-N 3.28Å; V588-A598 HydrophobicContact CB-CB 4.23Å; V588-A598 HydrophobicContact CG2-CB 4.17Å; V588-A598 PolarHBondContact N-O 3.04Å; V588-L600 HydrophobicContact CG2-CD1 4.01Å; V588-L600 HydrophobicContact CG2-CD2 4.22Å; V588-L600 HydrophobicContact CG2-CG 3.93Å; V588-A623 HydrophobicContact CG1-CB 3.7Å; V588-S624 WeakPolarHBondContact CA-O 3.23Å; V588-V625 HydrophobicContact CG2-CG2 4.33Å
589	L	91.8	Very high	88.6	Confident	9 Å²	9	53.1 Å²	53.1	5%	0.047	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	142.9	-176.4	-62.2	169	0	0	0	110.6	Y567 H587 T595 V596 S624 R626	Y567-L589 HydrophobicContact CE1-CD1 3.64Å; H587-L589 HydrophobicContact CB-CD2 4.32Å; L589-T595 CarbonylContact C-O 3.57Å; L589-T595 VanDerWaalsContact CA-O 3.28Å; L589-T595 WeakPolarHBondContact CA-O 3.26Å; L589-V596 HydrophobicContact CD2-CG2 4.08Å; L589-S624 PolarHBondContact N-O 3.36Å; L589-R626 HydrophobicContact CD1-CB 3.68Å; L589-R626 HydrophobicContact CD1-CG 4.44Å; L589-R626 HydrophobicContact CG-CB 4.43Å
590	G	85.1	Confident	88.6	Confident	5 Å²	5	53.5 Å²	53.5	5%	0.052	29%	0.289	C	S	.	.			trans	-72.3	-175.8	173.7	0	0	0	0	0	113.4	D592 G593 T595	G590-D592 PolarHBondContact O-N 3.38Å; G590-G593 PolarHBondContact O-N 2.82Å; G590-T595 WeakPolarHBondContact CA-OG1 3.27Å; G590-T595 PolarHBondContact N-O 3.09Å
591	D	83.2	Confident	88.7	Confident	119 Å²	119	57.5 Å²	57.5	64%	0.636	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-22.4	-174.2	-75.2	13.7	0	0	0	113.5	K571 G593	K571-D591 WeakPolarHBondContact CD-OD1 3.34Å; K571-D591 IonicContact NZ-OD1 3.92Å; K571-D591 PolarHBondContact NZ-OD1 2.87Å; K571-D591 IonicContact NZ-OD2 3.46Å; K571-D591 PolarHBondContact NZ-OD2 3.46Å; D591-G593 VanDerWaalsContact C-N 3.33Å
592	D	81.7	Confident	88.5	Confident	83 Å²	83	60.2 Å²	60.2	44%	0.444	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-13	173.6	72	-42.3	0	0	0	113.3	G590 H594 T595	G590-D592 PolarHBondContact O-N 3.38Å; D592-H594 PolarHBondContact O-CD2 3.35Å; D592-H594 VanDerWaalsContact O-CD2 3.3Å; D592-H594 PolarHBondContact O-N 3.25Å; D592-H594 PolarHBondContact OD1-N 3.26Å; D592-H594 WeakPolarHBondContact OD2-CB 3.48Å; D592-H594 PolarHBondContact OD2-N 2.75Å; D592-T595 VanDerWaalsContact CG-N 3.34Å; D592-T595 WeakPolarHBondContact OD1-CB 3.2Å; D592-T595 PolarHBondContact OD1-N 2.85Å; D592-T595 PolarHBondContact OD1-OG1 3.17Å; D592-T595 WeakPolarHBondContact OD2-CG2 3.25Å; D592-T595 PolarHBondContact OD2-N 3.24Å
593	G	78.8	Confident	88.4	Confident	21 Å²	21	59 Å²	59	22%	0.216	33%	0.325	C	S	.	.	S	Bend	trans	73.5	0	-177.1	0	0	0	0	0	115.4	G590 D591	G590-G593 PolarHBondContact O-N 2.82Å; D591-G593 VanDerWaalsContact C-N 3.33Å
594	H	80.4	Confident	88.5	Confident	162 Å²	162	53.9 Å²	53.9	75%	0.75	31%	0.312	S	S	*	.	S	Bend	trans	-119.1	-37	-178.5	-66.1	-78.2	0	0	0	113.2	D592 V596	D592-H594 PolarHBondContact O-CD2 3.35Å; D592-H594 VanDerWaalsContact O-CD2 3.3Å; D592-H594 PolarHBondContact O-N 3.25Å; D592-H594 PolarHBondContact OD1-N 3.26Å; D592-H594 WeakPolarHBondContact OD2-CB 3.48Å; D592-H594 PolarHBondContact OD2-N 2.75Å; H594-V596 PolarHBondContact O-N 3.22Å
595	T	87.6	Confident	88.5	Confident	72 Å²	72	53.4 Å²	53.4	44%	0.442	30%	0.301	S	S	.	.	S	Bend	trans	-62.7	133.4	171.9	58.4	0	0	0	0	110.8	L589 G590 D592	L589-T595 CarbonylContact C-O 3.57Å; L589-T595 VanDerWaalsContact CA-O 3.28Å; L589-T595 WeakPolarHBondContact CA-O 3.26Å; G590-T595 WeakPolarHBondContact CA-OG1 3.27Å; G590-T595 PolarHBondContact N-O 3.09Å; D592-T595 VanDerWaalsContact CG-N 3.34Å; D592-T595 WeakPolarHBondContact OD1-CB 3.2Å; D592-T595 PolarHBondContact OD1-N 2.85Å; D592-T595 PolarHBondContact OD1-OG1 3.17Å; D592-T595 WeakPolarHBondContact OD2-CG2 3.25Å; D592-T595 PolarHBondContact OD2-N 3.24Å
596	V	88.8	Confident	88.3	Confident	71 Å²	71	49.2 Å²	49.2	43%	0.43	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	111.2	172.4	179.6	0	0	0	0	107.8	H587 L589 H594	H587-V596 HydrophobicContact CB-CG1 4.04Å; H587-V596 HydrophobicContact CB-CG2 4.26Å; L589-V596 HydrophobicContact CD2-CG2 4.08Å; H594-V596 PolarHBondContact O-N 3.22Å
597	L	87.2	Confident	88	Confident	92 Å²	92	49.7 Å²	49.7	48%	0.482	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	-36.6	177.5	-62	180	0	0	0	111.9	V588	V588-L597 HydrophobicContact CG1-CB 4.47Å; V588-L597 PolarHBondContact O-N 3.28Å
598	A	88.7	Confident	87.5	Confident	39 Å²	39	47.9 Å²	47.9	32%	0.322	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	156.2	179.7	0	0	0	0	0	111.7	V588	V588-A598 HydrophobicContact CB-CB 4.23Å; V588-A598 HydrophobicContact CG2-CB 4.17Å; V588-A598 PolarHBondContact N-O 3.04Å
599	T	92.5	Very high	87	Confident	54 Å²	54	48.1 Å²	48.1	33%	0.331	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	116.4	171.7	-61.6	0	0	0	0	110.1	L586 H587 H601	L586-T599 CarbonylContact O-C 3.48Å; L586-T599 WeakPolarHBondContact O-CA 3.45Å; H587-T599 PolarHBondContact CD2-OG1 2.8Å; H587-T599 VanDerWaalsContact CD2-OG1 3.28Å; T599-H601 PolarHBondContact O-CE1 3.42Å; T599-H601 PolarHBondContact O-ND1 3.4Å
600	L	92	Very high	86.4	Confident	26 Å²	26	47.8 Å²	47.8	14%	0.136	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	135.8	176.6	-52.5	178.1	0	0	0	110	V581 K585 L586 V588 F606 V625	V581-L600 HydrophobicContact CG2-CB 4.34Å; K585-L600 WeakPolarHBondContact CA-O 3.16Å; L586-L600 HydrophobicContact CB-CB 4.23Å; L586-L600 HydrophobicContact CD1-CD1 4.39Å; L586-L600 PolarHBondContact N-O 2.87Å; L586-L600 VanDerWaalsContact N-O 3.08Å; L586-L600 PolarHBondContact O-N 3.23Å; V588-L600 HydrophobicContact CG2-CD1 4.01Å; V588-L600 HydrophobicContact CG2-CD2 4.22Å; V588-L600 HydrophobicContact CG2-CG 3.93Å; L600-F606 HydrophobicContact CD1-CB 4.04Å; L600-F606 HydrophobicContact CD1-CD1 3.57Å; L600-F606 HydrophobicContact CD1-CE1 4.16Å; L600-F606 HydrophobicContact CD1-CG 3.87Å; L600-V625 HydrophobicContact CD1-CG1 4.43Å
601	H	91.5	Very high	86.3	Confident	85 Å²	85	47.6 Å²	47.6	39%	0.394	28%	0.276	S	S	.	.			trans	-114.8	174.6	-177.9	-66.5	84.9	0	0	0	110.2	V581 T599 G603 S604	V581-H601 VanDerWaalsContact CB-O 3.3Å; V581-H601 WeakPolarHBondContact CB-O 3.38Å; V581-H601 WeakPolarHBondContact CG1-O 3.39Å; T599-H601 PolarHBondContact O-CE1 3.42Å; T599-H601 PolarHBondContact O-ND1 3.4Å; H601-G603 PolarHBondContact O-N 3.29Å; H601-S604 PolarHBondContact N-OG 3.47Å; H601-S604 WeakPolarHBondContact O-CB 3.44Å; H601-S604 PolarHBondContact O-N 3.17Å; H601-S604 PolarHBondContact O-OG 3.39Å; H601-S604 VanDerWaalsContact O-OG 3.1Å
602	A	88.4	Confident	86	Confident	56 Å²	56	42.3 Å²	42.3	46%	0.463	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	139	171.5	0	0	0	0	0	111	V581 N582 S604	V581-A602 WeakPolarHBondContact O-CA 3.42Å; N582-A602 WeakPolarHBondContact O-CB 3.29Å; A602-S604 VanDerWaalsContact C-N 3.28Å; A602-S604 PolarHBondContact O-N 2.93Å
603	G	84.6	Confident	85.8	Confident	11 Å²	11	42.2 Å²	42.2	11%	0.113	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	-17.7	-171.3	0	0	0	0	0	114.6	V581 H601	V581-G603 PolarHBondContact O-N 3.27Å; H601-G603 PolarHBondContact O-N 3.29Å
604	S	89.3	Confident	85.3	Confident	37 Å²	37	42.5 Å²	42.5	26%	0.259	24%	0.244	S	C	.	.			trans	-72.1	154.8	171	-53.7	0	0	0	0	111.8	V581 H601 A602	V581-S604 PolarHBondContact N-O 3.26Å; H601-S604 PolarHBondContact N-OG 3.47Å; H601-S604 WeakPolarHBondContact O-CB 3.44Å; H601-S604 PolarHBondContact O-N 3.17Å; H601-S604 PolarHBondContact O-OG 3.39Å; H601-S604 VanDerWaalsContact O-OG 3.1Å; A602-S604 VanDerWaalsContact C-N 3.28Å; A602-S604 PolarHBondContact O-N 2.93Å
605	Y	90.3	Very high	84.4	Confident	20 Å²	20	36.8 Å²	36.8	8%	0.078	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	158.8	175.6	65.6	-77.9	0	0	0	110.9	V539 I541 Y579 E608 D658 K662	V539-Y605 HydrophobicContact CG1-CD1 3.3Å; V539-Y605 HydrophobicContact CG1-CE1 3.94Å; V539-Y605 HydrophobicContact CG1-CG 4.01Å; I541-Y605 HydrophobicContact CB-CE1 4.4Å; I541-Y605 HydrophobicContact CD1-CD1 4.08Å; I541-Y605 HydrophobicContact CD1-CD2 3.79Å; I541-Y605 HydrophobicContact CD1-CE1 4.05Å; I541-Y605 HydrophobicContact CD1-CE2 3.75Å; I541-Y605 HydrophobicContact CD1-CG 3.96Å; I541-Y605 HydrophobicContact CG1-CD1 4.02Å; I541-Y605 HydrophobicContact CG1-CE1 3.74Å; I541-Y605 HydrophobicContact CG1-CE2 4.29Å; I541-Y605 HydrophobicContact CG1-CG 4.42Å; I541-Y605 HydrophobicContact CG2-CE1 3.97Å; I541-Y605 HydrophobicContact CG2-CE2 4.12Å; I541-Y605 VanDerWaalsContact CG2-CZ 3.46Å; I541-Y605 WeakPolarHBondContact CG2-OH 3.43Å; Y579-Y605 CarbonylContact O-C 3.53Å; Y579-Y605 VanDerWaalsContact O-CA 3.25Å; Y579-Y605 WeakPolarHBondContact O-CA 3.31Å; Y605-E608 HydrophobicContact CE2-CG 4.32Å; Y605-D658 VanDerWaalsContact OH-CG 3.3Å; Y605-D658 PolarHBondContact OH-OD2 3.47Å; Y605-K662 VanDerWaalsContact CE2-NZ 3.29Å; Y605-K662 PolarHBondContact OH-NZ 2.77Å
606	F	90.3	Very high	83.2	Confident	17 Å²	17	41.3 Å²	41.3	8%	0.075	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	158.9	-179.9	65	-77.4	0	0	0	112.9	V568 Y579 V581 L586 L600 V625 L633	V568-F606 HydrophobicContact CB-CE2 4.35Å; V568-F606 HydrophobicContact CB-CZ 4.2Å; V568-F606 HydrophobicContact CG1-CE2 3.94Å; V568-F606 HydrophobicContact CG1-CZ 3.72Å; Y579-F606 HydrophobicContact CD2-CD2 4.36Å; Y579-F606 AromaticContact CD2-CE2 3.66Å; Y579-F606 HydrophobicContact CD2-CE2 3.66Å; Y579-F606 AromaticContact CD2-CZ 3.81Å; Y579-F606 HydrophobicContact CD2-CZ 3.81Å; Y579-F606 HydrophobicContact CG-CE1 4.45Å; Y579-F606 HydrophobicContact CG-CE2 4.29Å; Y579-F606 AromaticContact CG-CZ 3.99Å; Y579-F606 HydrophobicContact CG-CZ 3.99Å; Y579-F606 PolarHBondContact N-O 2.86Å; Y579-F606 PolarHBondContact O-N 3.36Å; V581-F606 HydrophobicContact CG2-CE1 4.2Å; L586-F606 HydrophobicContact CD1-CD1 4.26Å; L586-F606 HydrophobicContact CD1-CE1 3.27Å; L586-F606 HydrophobicContact CD1-CZ 3.5Å; L600-F606 HydrophobicContact CD1-CB 4.04Å; L600-F606 HydrophobicContact CD1-CD1 3.57Å; L600-F606 HydrophobicContact CD1-CE1 4.16Å; L600-F606 HydrophobicContact CD1-CG 3.87Å; F606-V625 HydrophobicContact CD2-CB 4.38Å; F606-V625 HydrophobicContact CD2-CG1 4.37Å; F606-V625 HydrophobicContact CD2-CG2 3.9Å; F606-V625 HydrophobicContact CE2-CB 3.95Å; F606-V625 HydrophobicContact CE2-CG1 3.84Å; F606-V625 HydrophobicContact CE2-CG2 3.98Å; F606-V625 HydrophobicContact CZ-CG1 3.94Å; F606-L633 HydrophobicContact CE1-CD1 4.33Å; F606-L633 HydrophobicContact CZ-CD1 4.04Å
607	G	88.2	Confident	82.1	Confident	9 Å²	9	42.6 Å²	42.6	9%	0.093	25%	0.254	C	S	.	.			trans	96.4	5	177.2	0	0	0	0	0	114.7	R621	G607-R621 VanDerWaalsContact CA-NH1 3.28Å; G607-R621 PolarHBondContact O-NH1 2.89Å
608	E	83.8	Confident	81.4	Confident	10 Å²	10	39.5 Å²	39.5	5%	0.047	24%	0.244	C	C	.	.	H	α-helix	trans	-55.7	-44.3	172	71.3	-74.5	-137.5	0	0	112.6	Y605 S610 I611 L612 K662	Y605-E608 HydrophobicContact CE2-CG 4.32Å; E608-S610 PolarHBondContact O-N 2.69Å; E608-I611 PolarHBondContact O-N 3.22Å; E608-L612 PolarHBondContact O-N 2.86Å; E608-L612 VanDerWaalsContact O-N 3.1Å; E608-K662 WeakPolarHBondContact OE1-CD 3.23Å; E608-K662 WeakPolarHBondContact OE1-CE 3.41Å; E608-K662 IonicContact OE1-NZ 2.71Å; E608-K662 PolarHBondContact OE1-NZ 3.07Å
609	L	83.4	Confident	81.1	Confident	13 Å²	13	40.9 Å²	40.9	7%	0.068	25%	0.247	C	C	.	.	H	α-helix	trans	-55.1	-48.6	-175.4	-61.9	176.2	0	0	0	112.2	I611 N613 L614 A659 I663	L609-I611 VanDerWaalsContact C-N 3.27Å; L609-I611 PolarHBondContact O-N 3.43Å; L609-N613 PolarHBondContact O-N 2.92Å; L609-L614 PolarHBondContact O-N 3.12Å; L609-A659 HydrophobicContact CD2-CB 3.71Å; L609-I663 HydrophobicContact CD2-CD1 3.97Å; L609-I663 HydrophobicContact CD2-CG1 3.8Å
610	S	80	Confident	80.9	Confident	2 Å²	2	44.8 Å²	44.8	1%	0.014	26%	0.255	C	S	.	.	H	α-helix	trans	-70.9	-20	-178.9	-44.9	0	0	0	0	113.9	E608 R620 R621 K638	E608-S610 PolarHBondContact O-N 2.69Å; S610-R620 WeakPolarHBondContact CB-O 3.44Å; S610-R620 VanDerWaalsContact OG-C 3.26Å; S610-R620 PolarHBondContact OG-O 2.92Å; S610-R621 WeakPolarHBondContact OG-CA 3.39Å; S610-K638 PolarHBondContact O-NZ 3.07Å
611	I	81.1	Confident	80.7	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-85	-38.4	179.6	-74.5	166.7	0	0	0	111.2	M578 E608 L609 N613 K638 L641 W642	M578-I611 HydrophobicContact CB-CD1 3.51Å; M578-I611 HydrophobicContact CG-CD1 3.96Å; E608-I611 PolarHBondContact O-N 3.22Å; L609-I611 VanDerWaalsContact C-N 3.27Å; L609-I611 PolarHBondContact O-N 3.43Å; I611-N613 VanDerWaalsContact C-N 3.29Å; I611-N613 PolarHBondContact O-OD1 2.86Å; I611-K638 HydrophobicContact CG1-CB 4.23Å; I611-K638 HydrophobicContact CG1-CD 4.5Å; I611-K638 HydrophobicContact CG1-CG 4.49Å; I611-K638 HydrophobicContact CG2-CB 4.37Å; I611-K638 HydrophobicContact CG2-CG 4.07Å; I611-K638 WeakPolarHBondContact O-CE 3.39Å; I611-K638 PolarHBondContact O-NZ 2.95Å; I611-L641 HydrophobicContact CG2-CD2 3.71Å; I611-W642 PolarHBondContact O-NE1 3.13Å
612	L	78.4	Confident	80.4	Confident	9 Å²	9	42.8 Å²	42.8	5%	0.047	25%	0.248	C	C	.	.	H	α-helix	trans	-77.6	-13.5	177.9	-61.4	172.4	0	0	0	113.9	E608 L614 W642 L645 L655 E656 A659	E608-L612 PolarHBondContact O-N 2.86Å; E608-L612 VanDerWaalsContact O-N 3.1Å; L612-L614 VanDerWaalsContact C-N 3.27Å; L612-L614 HydrophobicContact CB-CB 4.39Å; L612-L614 HydrophobicContact CB-CD1 3.91Å; L612-L614 HydrophobicContact CD1-CD2 4.22Å; L612-W642 HydrophobicContact CD2-CZ2 4.37Å; L612-L645 HydrophobicContact CD2-CD1 4.45Å; L612-L655 HydrophobicContact CD1-CD2 3.62Å; L612-L655 HydrophobicContact CD2-CD2 3.61Å; L612-L655 HydrophobicContact CG-CD2 3.84Å; L612-E656 HydrophobicContact CD1-CG 4.08Å; L612-E656 HydrophobicContact CD2-CG 4.14Å; L612-A659 HydrophobicContact CD1-CB 3.68Å
613	N	76	Confident	80.3	Confident	81 Å²	81	41.2 Å²	41.2	43%	0.433	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.2	25.5	-172.1	-38.1	-10	0	0	0	112.9	L609 I611 N619 K638	L609-N613 PolarHBondContact O-N 2.92Å; I611-N613 VanDerWaalsContact C-N 3.29Å; I611-N613 PolarHBondContact O-OD1 2.86Å; N613-N619 WeakPolarHBondContact CB-OD1 3.34Å; N613-N619 PolarHBondContact OD1-OD1 3.22Å; N613-K638 PolarHBondContact OD1-NZ 3.26Å
614	L	69	Low	80.7	Confident	27 Å²	27	41.5 Å²	41.5	14%	0.141	24%	0.236	C	C	.	.			trans	-83.4	131.4	-176.5	-105.4	60.5	0	0	0	111.7	L609 L612 A659 Y660 I663	L609-L614 PolarHBondContact O-N 3.12Å; L612-L614 VanDerWaalsContact C-N 3.27Å; L612-L614 HydrophobicContact CB-CB 4.39Å; L612-L614 HydrophobicContact CB-CD1 3.91Å; L612-L614 HydrophobicContact CD1-CD2 4.22Å; L614-A659 HydrophobicContact CD2-CB 3.73Å; L614-Y660 HydrophobicContact CD2-CD1 4.21Å; L614-Y660 HydrophobicContact CD2-CD2 3.92Å; L614-Y660 HydrophobicContact CD2-CE1 3.93Å; L614-Y660 HydrophobicContact CD2-CE2 3.61Å; L614-Y660 HydrophobicContact CD2-CG 4.2Å; L614-Y660 HydrophobicContact CG-CE1 4.12Å; L614-Y660 HydrophobicContact CG-CE2 4.36Å; L614-I663 HydrophobicContact CB-CD1 4.07Å
615	G	61.4	Low	80.9	Confident	41 Å²	41	40 Å²	40	42%	0.423	23%	0.225	S	C	.	.	S	Bend	trans	92.5	166.6	178.7	0	0	0	0	0	114.7	N617 G618	G615-N617 PolarHBondContact O-N 3.28Å; G615-G618 PolarHBondContact O-N 3.28Å; G615-G618 VanDerWaalsContact O-N 3.12Å
616	N	62.8	Low	81.1	Confident	168 Å²	168	44 Å²	44	90%	0.898	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-17.2	-170.2	-63.7	4.8	0	0	0	115
617	N	64.8	Low	81.3	Confident	97 Å²	97	43.3 Å²	43.3	52%	0.519	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-1	-176.7	-64.7	-15	0	0	0	113.6	G615 N619 R620	G615-N617 PolarHBondContact O-N 3.28Å; N617-N619 PolarHBondContact O-N 3.04Å; N617-R620 WeakPolarHBondContact O-CB 3.45Å; N617-R620 PolarHBondContact O-N 3.46Å
618	G	74.1	Confident	81.5	Confident	27 Å²	27	47.6 Å²	47.6	28%	0.278	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.5	-127.4	178.9	0	0	0	0	0	112.7	G615 R620	G615-G618 PolarHBondContact O-N 3.28Å; G615-G618 VanDerWaalsContact O-N 3.12Å; G618-R620 PolarHBondContact O-N 3.3Å; G618-R620 VanDerWaalsContact O-N 3.1Å
619	N	81.9	Confident	81.9	Confident	69 Å²	69	48.5 Å²	48.5	37%	0.369	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	17.7	-173	-61.9	9.5	0	0	0	114	G575 N613 N617 K638	G575-N619 PolarHBondContact N-O 2.88Å; N613-N619 WeakPolarHBondContact CB-OD1 3.34Å; N613-N619 PolarHBondContact OD1-OD1 3.22Å; N617-N619 PolarHBondContact O-N 3.04Å; N619-K638 PolarHBondContact ND2-NZ 3.3Å
620	R	87.1	Confident	82.2	Confident	135 Å²	135	51.5 Å²	51.5	51%	0.509	28%	0.28	S	S	.	.	B	Isolated β-bridge	trans	-94.6	154.7	-178.7	-63.9	-175.1	-179.8	-85.2	1.9	112.5	G572 E573 S610 N617 G618	G572-R620 PolarHBondContact O-NH1 2.93Å; E573-R620 CarbonylContact O-C 3.51Å; E573-R620 VanDerWaalsContact O-CA 3.23Å; E573-R620 WeakPolarHBondContact O-CA 3.33Å; S610-R620 WeakPolarHBondContact CB-O 3.44Å; S610-R620 VanDerWaalsContact OG-C 3.26Å; S610-R620 PolarHBondContact OG-O 2.92Å; N617-R620 WeakPolarHBondContact O-CB 3.45Å; N617-R620 PolarHBondContact O-N 3.46Å; G618-R620 PolarHBondContact O-N 3.3Å; G618-R620 VanDerWaalsContact O-N 3.1Å
621	R	88.5	Confident	82.8	Confident	14 Å²	14	51.4 Å²	51.4	5%	0.053	28%	0.28	C	S	.	.			trans	-72.9	127.4	174.8	-67.1	-66	-165.7	-155.8	5.6	110.5	C569 R570 G572 E573 Q577 G607 S610	C569-R621 HydrophobicContact CB-CG 4.04Å; R570-R621 VanDerWaalsContact O-CB 3.27Å; R570-R621 WeakPolarHBondContact O-CB 3.31Å; G572-R621 PolarHBondContact N-O 2.97Å; E573-R621 HydrophobicContact CB-CG 4.11Å; E573-R621 WeakPolarHBondContact O-CG 3.39Å; E573-R621 PolarHBondContact O-N 3.33Å; Q577-R621 VanDerWaalsContact O-CZ 3.26Å; Q577-R621 PolarHBondContact O-NH1 3.21Å; Q577-R621 PolarHBondContact O-NH2 3.48Å; G607-R621 VanDerWaalsContact CA-NH1 3.28Å; G607-R621 PolarHBondContact O-NH1 2.89Å; S610-R621 WeakPolarHBondContact OG-CA 3.39Å
622	T	85.3	Confident	83.1	Confident	55 Å²	55	52 Å²	52	34%	0.337	28%	0.283	S	S	.	.	S	Bend	trans	-75.7	-31.7	-177.6	-44.8	0	0	0	0	113.4	K571	K571-T622 WeakPolarHBondContact CE-O 3.48Å; K571-T622 WeakPolarHBondContact CG-O 3.12Å
623	A	87	Confident	83.7	Confident	23 Å²	23	51.6 Å²	51.6	19%	0.19	28%	0.281	C	S	.	.	S	Bend	trans	-139.5	164.3	-177.4	0	0	0	0	0	111.5	V588	V588-A623 HydrophobicContact CG1-CB 3.7Å
624	S	91.9	Very high	84.3	Confident	17 Å²	17	47.9 Å²	47.9	12%	0.119	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	137.5	171.8	-64.2	0	0	0	0	109.9	C569 K571 V588 L589	C569-S624 CarbonylContact O-C 3.27Å; C569-S624 WeakPolarHBondContact O-CA 3.39Å; K571-S624 PolarHBondContact N-OG 3.4Å; V588-S624 WeakPolarHBondContact CA-O 3.23Å; L589-S624 PolarHBondContact N-O 3.36Å
625	V	94.1	Very high	85.4	Confident	6 Å²	6	47 Å²	47	4%	0.036	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	127.5	179.2	-176.8	0	0	0	0	109.8	Y567 V568 C569 L586 H587 V588 L600 F606	Y567-V625 CarbonylContact C-O 3.52Å; Y567-V625 WeakPolarHBondContact CA-O 3.43Å; V568-V625 PolarHBondContact N-O 3.04Å; C569-V625 PolarHBondContact O-N 2.88Å; L586-V625 HydrophobicContact CB-CG1 3.81Å; L586-V625 HydrophobicContact CD1-CG1 3.85Å; L586-V625 HydrophobicContact CG-CG1 4.42Å; H587-V625 WeakPolarHBondContact O-CA 3.38Å; V588-V625 HydrophobicContact CG2-CG2 4.33Å; L600-V625 HydrophobicContact CD1-CG1 4.43Å; F606-V625 HydrophobicContact CD2-CB 4.38Å; F606-V625 HydrophobicContact CD2-CG1 4.37Å; F606-V625 HydrophobicContact CD2-CG2 3.9Å; F606-V625 HydrophobicContact CE2-CB 3.95Å; F606-V625 HydrophobicContact CE2-CG1 3.84Å; F606-V625 HydrophobicContact CE2-CG2 3.98Å; F606-V625 HydrophobicContact CZ-CG1 3.94Å
626	R	94.6	Very high	86.7	Confident	105 Å²	105	45.1 Å²	45.1	40%	0.396	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	135.2	-174.7	-170.6	-179.2	-177	-152.1	-7.5	111.5	G565 D566 Y567 L586 H587 L589	G565-R626 PolarHBondContact O-NE 2.97Å; D566-R626 CarbonylContact O-C 3.52Å; D566-R626 VanDerWaalsContact O-CA 3.28Å; D566-R626 WeakPolarHBondContact O-CA 3.5Å; Y567-R626 HydrophobicContact CD1-CB 4.32Å; Y567-R626 HydrophobicContact CD2-CG 4.37Å; Y567-R626 HydrophobicContact CE1-CB 4.34Å; Y567-R626 HydrophobicContact CE2-CG 4.33Å; L586-R626 CarbonylContact C-O 3.51Å; L586-R626 WeakPolarHBondContact CA-O 3.31Å; H587-R626 PolarHBondContact N-O 2.85Å; H587-R626 PolarHBondContact O-N 3.42Å; L589-R626 HydrophobicContact CD1-CB 3.68Å; L589-R626 HydrophobicContact CD1-CG 4.44Å; L589-R626 HydrophobicContact CG-CB 4.43Å
627	S	94.9	Very high	88	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.014	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	131.7	175.5	-164.4	0	0	0	0	111.2	G565 D566 G629 S631	G565-S627 WeakPolarHBondContact CA-O 3.45Å; G565-S627 PolarHBondContact N-O 3.39Å; D566-S627 PolarHBondContact O-N 2.8Å; S627-G629 PolarHBondContact OG-O 2.86Å; S627-S631 WeakPolarHBondContact OG-CB 3.41Å; S627-S631 PolarHBondContact OG-OG 3.11Å
628	L	92.5	Very high	89.2	Confident	98 Å²	98	35.7 Å²	35.7	51%	0.513	19%	0.187	S	C	.	.	S	Bend	trans	-81.2	-48.5	176.2	-177.2	65.3	0	0	0	111	P564 K585	P564-L628 WeakPolarHBondContact CB-O 3.25Å; K585-L628 HydrophobicContact CB-CB 4.44Å; K585-L628 HydrophobicContact CB-CD2 4.46Å; K585-L628 WeakPolarHBondContact O-CB 3.19Å; K585-L628 PolarHBondContact O-N 3.3Å
629	G	91.7	Very high	90	Very high	29 Å²	29	37.8 Å²	37.8	30%	0.299	20%	0.197	S	C	.	.	S	Bend	trans	-112.2	-159.1	175.3	0	0	0	0	0	112.1	A563 P564 S627	A563-G629 CarbonylContact C-O 3.59Å; P564-G629 WeakPolarHBondContact CA-O 3.31Å; S627-G629 PolarHBondContact OG-O 2.86Å
630	Y	90	Very high	90.3	Very high	76 Å²	76	36.5 Å²	36.5	30%	0.298	19%	0.19	S	C	.	.			trans	-70.3	126.8	158.3	-73	-82.4	0	0	0	109.1	F502 L561 F562 A563 P564	F502-Y630 HydrophobicContact CB-CE1 4Å; F502-Y630 HydrophobicContact CB-CE2 4.47Å; F502-Y630 AromaticContact CD1-CD1 3.7Å; F502-Y630 HydrophobicContact CD1-CD1 3.7Å; F502-Y630 AromaticContact CD1-CE1 3.83Å; F502-Y630 HydrophobicContact CD1-CE1 3.83Å; F502-Y630 HydrophobicContact CD1-CG 4.19Å; F502-Y630 HydrophobicContact CD2-CD1 4.04Å; F502-Y630 AromaticContact CD2-CD2 3.66Å; F502-Y630 HydrophobicContact CD2-CD2 3.66Å; F502-Y630 HydrophobicContact CD2-CE1 4.08Å; F502-Y630 AromaticContact CD2-CE2 3.7Å; F502-Y630 HydrophobicContact CD2-CE2 3.7Å; F502-Y630 AromaticContact CD2-CG 3.83Å; F502-Y630 HydrophobicContact CD2-CG 3.83Å; F502-Y630 AromaticContact CD2-CZ 3.91Å; F502-Y630 AromaticContact CE1-CD1 3.76Å; F502-Y630 HydrophobicContact CE1-CD1 3.76Å; F502-Y630 HydrophobicContact CE1-CE1 4.37Å; F502-Y630 AromaticContact CE1-CG 3.96Å; F502-Y630 HydrophobicContact CE1-CG 3.96Å; F502-Y630 HydrophobicContact CE2-CD1 4.09Å; F502-Y630 AromaticContact CE2-CD2 3.62Å; F502-Y630 HydrophobicContact CE2-CD2 3.62Å; F502-Y630 HydrophobicContact CE2-CE2 4.16Å; F502-Y630 AromaticContact CE2-CG 3.57Å; F502-Y630 HydrophobicContact CE2-CG 3.57Å; F502-Y630 AromaticContact CG-CD1 3.85Å; F502-Y630 HydrophobicContact CG-CD1 3.85Å; F502-Y630 HydrophobicContact CG-CD2 4.25Å; F502-Y630 AromaticContact CG-CE1 3.67Å; F502-Y630 HydrophobicContact CG-CE1 3.67Å; F502-Y630 HydrophobicContact CG-CE2 4.09Å; F502-Y630 HydrophobicContact CG-CG 4.13Å; F502-Y630 AromaticContact CG-CZ 3.79Å; F502-Y630 AromaticContact CZ-CD1 3.95Å; F502-Y630 HydrophobicContact CZ-CD1 3.95Å; F502-Y630 HydrophobicContact CZ-CD2 4.18Å; F502-Y630 AromaticContact CZ-CG 3.64Å; F502-Y630 HydrophobicContact CZ-CG 3.64Å; L561-Y630 HydrophobicContact CD1-CD1 4.36Å; F562-Y630 WeakPolarHBondContact O-CA 3.31Å; A563-Y630 HydrophobicContact CB-CD1 4.4Å; A563-Y630 HydrophobicContact CB-CE1 3.99Å; P564-Y630 HydrophobicContact CG-CD2 4.41Å; P564-Y630 HydrophobicContact CG-CE2 4.14Å
631	S	90.8	Very high	90.4	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	132.5	-177.7	-57.9	0	0	0	0	111.7	F562 R583 K585 S627	F562-S631 PolarHBondContact N-O 2.94Å; F562-S631 PolarHBondContact O-N 3.49Å; R583-S631 CarbonylContact O-C 3.43Å; R583-S631 VanDerWaalsContact O-CA 3.32Å; R583-S631 WeakPolarHBondContact O-CA 3.38Å; K585-S631 PolarHBondContact N-OG 3.41Å; K585-S631 PolarHBondContact O-OG 2.97Å; S627-S631 WeakPolarHBondContact OG-CB 3.41Å; S627-S631 PolarHBondContact OG-OG 3.11Å
632	D	88.9	Confident	90.4	Very high	13 Å²	13	33 Å²	33	7%	0.07	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	117	175.1	-64.8	-37.7	0	0	0	109.4	K508 L561 N582 R583	K508-D632 IonicContact NZ-OD1 2.64Å; K508-D632 PolarHBondContact NZ-OD1 2.92Å; K508-D632 IonicContact NZ-OD2 2.79Å; K508-D632 PolarHBondContact NZ-OD2 2.79Å; L561-D632 WeakPolarHBondContact CD1-OD1 3.4Å; N582-D632 WeakPolarHBondContact CA-O 3.47Å; N582-D632 HydrophobicContact CB-CB 4.25Å; N582-D632 WeakPolarHBondContact CB-O 3.5Å; N582-D632 PolarHBondContact N-O 3.28Å; R583-D632 HydrophobicContact CB-CB 4.06Å; R583-D632 PolarHBondContact N-O 3.24Å; R583-D632 VanDerWaalsContact N-O 3.14Å; R583-D632 PolarHBondContact O-N 3.15Å
633	L	90.8	Very high	90.6	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	135.5	179.1	-49.9	-174.8	0	0	0	110	V560 F562 V568 Y579 I580 V581 L586 F606	V560-L633 PolarHBondContact N-O 2.85Å; V560-L633 PolarHBondContact O-N 3.42Å; F562-L633 HydrophobicContact CD2-CD1 3.65Å; F562-L633 HydrophobicContact CD2-CG 4.06Å; F562-L633 HydrophobicContact CE2-CD1 3.71Å; F562-L633 HydrophobicContact CE2-CG 4.34Å; V568-L633 HydrophobicContact CB-CD1 4.46Å; V568-L633 HydrophobicContact CG1-CD1 3.73Å; V568-L633 HydrophobicContact CG2-CD1 3.89Å; Y579-L633 HydrophobicContact CD1-CB 4.31Å; Y579-L633 HydrophobicContact CD1-CD1 4.37Å; Y579-L633 HydrophobicContact CG-CD1 4.34Å; I580-L633 CarbonylContact O-C 3.52Å; I580-L633 VanDerWaalsContact O-CA 3.3Å; I580-L633 WeakPolarHBondContact O-CA 3.45Å; V581-L633 HydrophobicContact CB-CD2 4.11Å; V581-L633 HydrophobicContact CG1-CD2 4.08Å; V581-L633 HydrophobicContact CG2-CD2 3.91Å; L586-L633 HydrophobicContact CD1-CD1 4.12Å; L586-L633 HydrophobicContact CD1-CD2 3.94Å; L586-L633 HydrophobicContact CD2-CD2 4.46Å; F606-L633 HydrophobicContact CE1-CD1 4.33Å; F606-L633 HydrophobicContact CZ-CD1 4.04Å
634	F	89	Confident	90.7	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.009	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	120.5	161.9	-63.4	-66.8	0	0	0	108.7	H532 T535 L557 V559 Y579 I580 N582	H532-F634 AromaticContact CE1-CE1 3.49Å; H532-F634 VanDerWaalsContact CE1-CE1 3.49Å; H532-F634 WeakPolarHBondContact CE1-CE1 3.31Å; H532-F634 AromaticContact CE1-CZ 3.78Å; H532-F634 AromaticContact ND1-CE1 3.44Å; H532-F634 WeakPolarHBondContact ND1-CE1 3.35Å; H532-F634 AromaticContact ND1-CZ 3.27Å; H532-F634 VanDerWaalsContact ND1-CZ 3.27Å; H532-F634 WeakPolarHBondContact ND1-CZ 3.37Å; T535-F634 HydrophobicContact CG2-CE2 3.99Å; L557-F634 HydrophobicContact CB-CB 4.38Å; L557-F634 HydrophobicContact CB-CD1 4.26Å; L557-F634 HydrophobicContact CD1-CB 4.29Å; L557-F634 HydrophobicContact CD1-CD1 4.44Å; L557-F634 HydrophobicContact CD1-CG 4.24Å; L557-F634 HydrophobicContact CD2-CB 4.22Å; V559-F634 HydrophobicContact CG2-CD1 3.91Å; V559-F634 HydrophobicContact CG2-CE1 3.63Å; Y579-F634 CarbonylContact C-O 3.26Å; Y579-F634 VanDerWaalsContact CA-O 3.31Å; Y579-F634 WeakPolarHBondContact CA-O 3.46Å; I580-F634 HydrophobicContact CB-CB 4.28Å; I580-F634 PolarHBondContact N-O 3.13Å; I580-F634 PolarHBondContact O-N 3.47Å; N582-F634 HydrophobicContact CB-CD2 3.86Å; N582-F634 HydrophobicContact CB-CE2 3.53Å; N582-F634 HydrophobicContact CB-CZ 4.15Å; N582-F634 WeakPolarHBondContact ND2-CZ 3.39Å
635	C	90.5	Very high	90.5	Very high	9 Å²	9	33.7 Å²	33.7	6%	0.061	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	133.2	173.2	174.3	0	0	0	0	109.8	R558 V560 Q577 M578 Y579	R558-C635 PolarHBondContact N-O 3.32Å; R558-C635 PolarHBondContact O-N 3.47Å; V560-C635 HydrophobicContact CG2-CB 3.68Å; Q577-C635 VanDerWaalsContact CG-SG 3.56Å; Q577-C635 PolarHBondContact OE1-SG 2.8Å; M578-C635 WeakPolarHBondContact O-CA 3.47Å; Y579-C635 HydrophobicContact CD1-CB 3.94Å; Y579-C635 HydrophobicContact CE1-CB 3.83Å
636	L	89.5	Confident	90.2	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	133.5	169	-177.1	69.7	0	0	0	110	L553 K556 L557 Q577 M578 D640 L641	L553-L636 HydrophobicContact CD1-CD1 4.32Å; L553-L636 HydrophobicContact CD1-CD2 3.39Å; L553-L636 HydrophobicContact CG-CD2 4.32Å; K556-L636 HydrophobicContact CB-CD1 3.82Å; L557-L636 HydrophobicContact CD2-CB 4.04Å; L557-L636 HydrophobicContact CD2-CD1 4.28Å; Q577-L636 CarbonylContact C-O 3.54Å; Q577-L636 VanDerWaalsContact CA-O 3.25Å; Q577-L636 WeakPolarHBondContact CA-O 3.27Å; M578-L636 HydrophobicContact CE-CB 4.19Å; M578-L636 HydrophobicContact CE-CD2 3.65Å; M578-L636 HydrophobicContact CG-CB 3.8Å; M578-L636 HydrophobicContact CG-CD2 4.29Å; M578-L636 PolarHBondContact N-O 3.44Å; M578-L636 PolarHBondContact O-N 2.82Å; M578-L636 HydrophobicContact SD-CD2 3.98Å; L636-D640 HydrophobicContact CD1-CB 4.26Å; L636-L641 HydrophobicContact CD2-CB 3.7Å; L636-L641 HydrophobicContact CD2-CD1 3.62Å; L636-L641 HydrophobicContact CD2-CG 4.14Å; L636-L641 HydrophobicContact CG-CB 4.19Å
637	S	90.9	Very high	90	Very high	25 Å²	25	42.6 Å²	42.6	18%	0.175	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	148.7	-179	95.2	0	0	0	0	112.1	S639 D640 L641	S637-S639 VanDerWaalsContact C-N 3.3Å; S637-S639 PolarHBondContact O-N 3.07Å; S637-S639 PolarHBondContact OG-N 3.21Å; S637-S639 PolarHBondContact OG-OG 3.08Å; S637-D640 WeakPolarHBondContact CB-OD2 3.46Å; S637-D640 PolarHBondContact O-N 3.02Å; S637-D640 VanDerWaalsContact O-N 3.17Å; S637-D640 WeakPolarHBondContact OG-CB 3.25Å; S637-D640 PolarHBondContact OG-N 3.16Å; S637-D640 PolarHBondContact OG-OD2 2.77Å; S637-L641 PolarHBondContact O-N 2.96Å
638	K	89.3	Confident	89.7	Confident	43 Å²	43	44.9 Å²	44.9	19%	0.187	22%	0.221	C	C	.	.	H	α-helix	trans	-52.4	-48.3	172.8	177.8	158.3	-167.8	155.9	0	111.5	K576 S610 I611 N613 N619 D640 W642	K576-K638 WeakPolarHBondContact O-CB 3.48Å; K576-K638 PolarHBondContact O-N 3.26Å; S610-K638 PolarHBondContact O-NZ 3.07Å; I611-K638 HydrophobicContact CG1-CB 4.23Å; I611-K638 HydrophobicContact CG1-CD 4.5Å; I611-K638 HydrophobicContact CG1-CG 4.49Å; I611-K638 HydrophobicContact CG2-CB 4.37Å; I611-K638 HydrophobicContact CG2-CG 4.07Å; I611-K638 WeakPolarHBondContact O-CE 3.39Å; I611-K638 PolarHBondContact O-NZ 2.95Å; N613-K638 PolarHBondContact OD1-NZ 3.26Å; N619-K638 PolarHBondContact ND2-NZ 3.3Å; K638-D640 VanDerWaalsContact C-N 3.29Å; K638-D640 PolarHBondContact O-N 2.99Å; K638-W642 WeakPolarHBondContact O-CB 3.43Å; K638-W642 PolarHBondContact O-N 3.26Å
639	S	89.9	Confident	89.5	Confident	71 Å²	71	43.9 Å²	43.9	50%	0.497	22%	0.22	S	C	.	.	H	α-helix	trans	-63.3	-32.9	-179.7	40.3	0	0	0	0	113.5	S637 K643	S637-S639 VanDerWaalsContact C-N 3.3Å; S637-S639 PolarHBondContact O-N 3.07Å; S637-S639 PolarHBondContact OG-N 3.21Å; S637-S639 PolarHBondContact OG-OG 3.08Å; S639-K643 WeakPolarHBondContact O-CD 3.31Å; S639-K643 WeakPolarHBondContact O-CE 3.36Å; S639-K643 VanDerWaalsContact O-CG 3.24Å; S639-K643 WeakPolarHBondContact O-CG 3.31Å; S639-K643 PolarHBondContact O-N 3.16Å
640	D	90.1	Very high	89.2	Confident	42 Å²	42	47.3 Å²	47.3	23%	0.225	23%	0.232	C	C	.	.	H	α-helix	trans	-84.8	-37.8	-177.1	-62	-41.9	0	0	0	111.7	K556 L636 S637 K638 K643 V644	K556-D640 HydrophobicContact CB-CB 4.25Å; K556-D640 HydrophobicContact CD-CB 4.16Å; K556-D640 HydrophobicContact CG-CB 4.49Å; L636-D640 HydrophobicContact CD1-CB 4.26Å; S637-D640 WeakPolarHBondContact CB-OD2 3.46Å; S637-D640 PolarHBondContact O-N 3.02Å; S637-D640 VanDerWaalsContact O-N 3.17Å; S637-D640 WeakPolarHBondContact OG-CB 3.25Å; S637-D640 PolarHBondContact OG-N 3.16Å; S637-D640 PolarHBondContact OG-OD2 2.77Å; K638-D640 VanDerWaalsContact C-N 3.29Å; K638-D640 PolarHBondContact O-N 2.99Å; D640-K643 PolarHBondContact O-N 3.17Å; D640-K643 IonicContact OD1-NZ 3.32Å; D640-K643 PolarHBondContact OD1-NZ 3.19Å; D640-V644 WeakPolarHBondContact O-CG2 3.48Å; D640-V644 PolarHBondContact O-N 3.49Å
641	L	88.5	Confident	89	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.3	-48.4	168.8	-176	65.6	0	0	0	111.2	L553 M578 I611 L636 S637 K643 V644 L645	L553-L641 HydrophobicContact CD1-CD1 4.26Å; M578-L641 HydrophobicContact SD-CD1 4.3Å; M578-L641 HydrophobicContact SD-CD2 3.69Å; I611-L641 HydrophobicContact CG2-CD2 3.71Å; L636-L641 HydrophobicContact CD2-CB 3.7Å; L636-L641 HydrophobicContact CD2-CD1 3.62Å; L636-L641 HydrophobicContact CD2-CG 4.14Å; L636-L641 HydrophobicContact CG-CB 4.19Å; S637-L641 PolarHBondContact O-N 2.96Å; L641-K643 VanDerWaalsContact C-N 3.27Å; L641-K643 PolarHBondContact O-N 2.94Å; L641-V644 PolarHBondContact O-N 3.45Å; L641-V644 VanDerWaalsContact O-N 3.15Å; L641-L645 HydrophobicContact CD1-CD1 3.94Å; L641-L645 HydrophobicContact CD1-CD2 4.24Å; L641-L645 HydrophobicContact CD1-CG 3.83Å; L641-L645 HydrophobicContact CD2-CD1 3.98Å; L641-L645 HydrophobicContact CG-CD1 3.63Å; L641-L645 HydrophobicContact CG-CG 3.91Å; L641-L645 WeakPolarHBondContact O-CB 3.35Å; L641-L645 WeakPolarHBondContact O-CG 3.42Å; L641-L645 PolarHBondContact O-N 3.48Å
642	W	88.2	Confident	88.8	Confident	75 Å²	75	48.5 Å²	48.5	28%	0.284	24%	0.237	S	C	.	.	H	α-helix	trans	-64.4	-26.8	-179.1	-85.3	108.7	0	0	0	114	I611 L612 K638 K646	I611-W642 PolarHBondContact O-NE1 3.13Å; L612-W642 HydrophobicContact CD2-CZ2 4.37Å; K638-W642 WeakPolarHBondContact O-CB 3.43Å; K638-W642 PolarHBondContact O-N 3.26Å; W642-K646 PolarHBondContact O-N 2.87Å
643	K	89.7	Confident	88.7	Confident	107 Å²	107	51.4 Å²	51.4	47%	0.465	26%	0.259	S	S	.	.	H	α-helix	trans	-66.1	-52.2	170	-70.6	162.9	-161.9	164.1	0	110.5	S639 D640 L641 L645 K646	S639-K643 WeakPolarHBondContact O-CD 3.31Å; S639-K643 WeakPolarHBondContact O-CE 3.36Å; S639-K643 VanDerWaalsContact O-CG 3.24Å; S639-K643 WeakPolarHBondContact O-CG 3.31Å; S639-K643 PolarHBondContact O-N 3.16Å; D640-K643 PolarHBondContact O-N 3.17Å; D640-K643 IonicContact OD1-NZ 3.32Å; D640-K643 PolarHBondContact OD1-NZ 3.19Å; L641-K643 VanDerWaalsContact C-N 3.27Å; L641-K643 PolarHBondContact O-N 2.94Å; K643-L645 PolarHBondContact O-N 2.87Å; K643-K646 WeakPolarHBondContact O-CB 3.42Å; K643-K646 PolarHBondContact O-N 3.11Å
644	V	88.7	Confident	88.4	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.6	-43.9	-179.3	-174.4	0	0	0	0	111.2	F549 E552 K556 D640 L641 K646 E647 Y648	F549-V644 HydrophobicContact CD2-CG1 3.37Å; F549-V644 HydrophobicContact CE2-CB 4.43Å; F549-V644 HydrophobicContact CE2-CG1 3.48Å; F549-V644 VanDerWaalsContact CE2-CG1 3.48Å; F549-V644 HydrophobicContact CG-CG1 4.33Å; E552-V644 HydrophobicContact CB-CG1 4.15Å; E552-V644 HydrophobicContact CB-CG2 4.34Å; K556-V644 HydrophobicContact CD-CG2 3.85Å; K556-V644 VanDerWaalsContact NZ-CG2 3.27Å; D640-V644 WeakPolarHBondContact O-CG2 3.48Å; D640-V644 PolarHBondContact O-N 3.49Å; L641-V644 PolarHBondContact O-N 3.45Å; L641-V644 VanDerWaalsContact O-N 3.15Å; V644-K646 PolarHBondContact O-N 2.64Å; V644-E647 PolarHBondContact O-N 3.27Å; V644-Y648 HydrophobicContact CG1-CD2 3.91Å; V644-Y648 HydrophobicContact CG1-CE2 4.37Å; V644-Y648 WeakPolarHBondContact O-CD2 3.39Å; V644-Y648 PolarHBondContact O-N 3.36Å
645	L	87.4	Confident	88.2	Confident	2 Å²	2	56 Å²	56	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-66.9	-14	178	-67.5	-174.9	0	0	0	114.3	F549 L612 L641 K643 A651 R652 L655	F549-L645 HydrophobicContact CE2-CD2 3.95Å; L612-L645 HydrophobicContact CD2-CD1 4.45Å; L641-L645 HydrophobicContact CD1-CD1 3.94Å; L641-L645 HydrophobicContact CD1-CD2 4.24Å; L641-L645 HydrophobicContact CD1-CG 3.83Å; L641-L645 HydrophobicContact CD2-CD1 3.98Å; L641-L645 HydrophobicContact CG-CD1 3.63Å; L641-L645 HydrophobicContact CG-CG 3.91Å; L641-L645 WeakPolarHBondContact O-CB 3.35Å; L641-L645 WeakPolarHBondContact O-CG 3.42Å; L641-L645 PolarHBondContact O-N 3.48Å; K643-L645 PolarHBondContact O-N 2.87Å; L645-A651 HydrophobicContact CD2-CB 4.35Å; L645-R652 HydrophobicContact CB-CB 4.15Å; L645-R652 HydrophobicContact CB-CG 4.36Å; L645-R652 HydrophobicContact CD1-CG 4.38Å; L645-R652 HydrophobicContact CD2-CB 4.01Å; L645-R652 HydrophobicContact CG-CB 4.46Å; L645-L655 HydrophobicContact CD1-CD2 4.4Å
646	K	89	Confident	87.9	Confident	179 Å²	179	57.4 Å²	57.4	78%	0.778	29%	0.285	S	S	*	.	H	α-helix	trans	-76.4	-33.1	171.1	-173.8	-174.7	174.4	-170.3	0	111.6	W642 K643 V644	W642-K646 PolarHBondContact O-N 2.87Å; K643-K646 WeakPolarHBondContact O-CB 3.42Å; K643-K646 PolarHBondContact O-N 3.11Å; V644-K646 PolarHBondContact O-N 2.64Å
647	E	89.3	Confident	87.7	Confident	120 Å²	120	59.9 Å²	59.9	56%	0.561	31%	0.305	S	S	*	.	H	α-helix	trans	-86.8	-32.1	-177.8	-65.8	173.2	-150.3	0	0	111.5	V644 P649	V644-E647 PolarHBondContact O-N 3.27Å; E647-P649 WeakPolarHBondContact O-CD 3.38Å
648	Y	89	Confident	87.4	Confident	49 Å²	49	59.2 Å²	59.2	19%	0.192	30%	0.299	C	S	.	.			trans	-115.1	79.3	179.8	-61	-87.3	0	0	0	112	E546 F549 E552 V644 N650 A651 R652	E546-Y648 WeakPolarHBondContact OE2-CD1 3.22Å; F549-Y648 HydrophobicContact CB-CD1 3.83Å; F549-Y648 HydrophobicContact CB-CD2 3.99Å; F549-Y648 HydrophobicContact CB-CE1 4.07Å; F549-Y648 HydrophobicContact CB-CE2 4.24Å; F549-Y648 HydrophobicContact CB-CG 3.78Å; F549-Y648 AromaticContact CD2-CD2 3.93Å; F549-Y648 HydrophobicContact CD2-CD2 3.93Å; F549-Y648 AromaticContact CD2-CG 3.93Å; F549-Y648 HydrophobicContact CD2-CG 3.93Å; F549-Y648 HydrophobicContact CG-CD2 4.48Å; F549-Y648 HydrophobicContact CG-CG 4.35Å; E552-Y648 HydrophobicContact CG-CE2 4.19Å; V644-Y648 HydrophobicContact CG1-CD2 3.91Å; V644-Y648 HydrophobicContact CG1-CE2 4.37Å; V644-Y648 WeakPolarHBondContact O-CD2 3.39Å; V644-Y648 PolarHBondContact O-N 3.36Å; Y648-N650 VanDerWaalsContact C-N 3.29Å; Y648-N650 PolarHBondContact O-N 3.29Å; Y648-A651 PolarHBondContact O-N 2.9Å; Y648-R652 PolarHBondContact O-N 3.08Å
649	P	88	Confident	87	Confident	77 Å²	77	57.1 Å²	57.1	50%	0.5	29%	0.29	S	S	.	.	H	α-helix	trans	-64.5	-30.8	-176.9	26	-34.8	0	0	0	113.2	E647 A651 R652 S653	E647-P649 WeakPolarHBondContact O-CD 3.38Å; P649-A651 PolarHBondContact O-N 3.28Å; P649-R652 WeakPolarHBondContact O-CB 3.25Å; P649-R652 PolarHBondContact O-N 2.76Å; P649-R652 VanDerWaalsContact O-N 3.16Å; P649-S653 PolarHBondContact O-N 3.02Å; P649-S653 PolarHBondContact O-OG 3.44Å
650	N	86.5	Confident	86.7	Confident	101 Å²	101	59.9 Å²	59.9	54%	0.54	29%	0.291	S	S	.	.	H	α-helix	trans	-59.4	-44.9	176.3	-65.4	-25	0	0	0	111.8	E546 Y648 R652 S653 K654	E546-N650 PolarHBondContact OE1-ND2 3.47Å; Y648-N650 VanDerWaalsContact C-N 3.29Å; Y648-N650 PolarHBondContact O-N 3.29Å; N650-R652 VanDerWaalsContact C-N 3.32Å; N650-R652 PolarHBondContact O-N 3.41Å; N650-S653 PolarHBondContact O-N 3.03Å; N650-K654 PolarHBondContact O-N 3.02Å
651	A	84.3	Confident	86.4	Confident	8 Å²	8	65.1 Å²	65.1	7%	0.066	31%	0.307	C	S	.	.	H	α-helix	trans	-64.7	-38.5	176.5	0	0	0	0	0	111.3	T545 F549 L645 Y648 P649 K654 L655	T545-A651 HydrophobicContact CG2-CB 3.78Å; F549-A651 HydrophobicContact CD2-CB 3.8Å; F549-A651 HydrophobicContact CE2-CB 3.78Å; F549-A651 HydrophobicContact CG-CB 4.24Å; F549-A651 HydrophobicContact CZ-CB 4.19Å; L645-A651 HydrophobicContact CD2-CB 4.35Å; Y648-A651 PolarHBondContact O-N 2.9Å; P649-A651 PolarHBondContact O-N 3.28Å; A651-K654 PolarHBondContact O-N 3.29Å; A651-L655 WeakPolarHBondContact O-CB 3.43Å; A651-L655 PolarHBondContact O-N 3.16Å
652	R	86.6	Confident	85.9	Confident	94 Å²	94	66.8 Å²	66.8	36%	0.355	31%	0.314	S	S	.	.	H	α-helix	trans	-61	-49.1	175.2	-177	-178.9	167.1	-168.5	-9.5	112	L645 Y648 P649 N650 K654 L655 E656	L645-R652 HydrophobicContact CB-CB 4.15Å; L645-R652 HydrophobicContact CB-CG 4.36Å; L645-R652 HydrophobicContact CD1-CG 4.38Å; L645-R652 HydrophobicContact CD2-CB 4.01Å; L645-R652 HydrophobicContact CG-CB 4.46Å; Y648-R652 PolarHBondContact O-N 3.08Å; P649-R652 WeakPolarHBondContact O-CB 3.25Å; P649-R652 PolarHBondContact O-N 2.76Å; P649-R652 VanDerWaalsContact O-N 3.16Å; N650-R652 VanDerWaalsContact C-N 3.32Å; N650-R652 PolarHBondContact O-N 3.41Å; R652-K654 VanDerWaalsContact C-N 3.33Å; R652-K654 PolarHBondContact O-N 3.12Å; R652-L655 PolarHBondContact O-N 3.5Å; R652-E656 HydrophobicContact CG-CG 4.41Å; R652-E656 IonicContact CZ-OE1 2.61Å; R652-E656 IonicContact NE-OE1 2.66Å; R652-E656 PolarHBondContact NE-OE1 2.89Å; R652-E656 IonicContact NH2-OE1 3.41Å; R652-E656 PolarHBondContact NH2-OE1 2.92Å; R652-E656 PolarHBondContact O-N 3.43Å
653	S	86.6	Confident	85.3	Confident	74 Å²	74	64.5 Å²	64.5	52%	0.517	31%	0.308	S	S	.	.	H	α-helix	trans	-63.3	-36.6	179.9	-62.8	0	0	0	0	112.7	P649 N650 A657	P649-S653 PolarHBondContact O-N 3.02Å; P649-S653 PolarHBondContact O-OG 3.44Å; N650-S653 PolarHBondContact O-N 3.03Å; S653-A657 VanDerWaalsContact O-CB 3.25Å; S653-A657 WeakPolarHBondContact O-CB 3.49Å; S653-A657 PolarHBondContact O-N 3.22Å
654	K	85.6	Confident	84.8	Confident	92 Å²	92	63.4 Å²	63.4	40%	0.4	31%	0.307	S	S	.	.	H	α-helix	trans	-63.2	-44.5	172.6	-70.5	-175	-178.9	-169	0	112	D544 N650 A651 R652 A657 D658	D544-K654 PolarHBondContact O-NZ 3.14Å; N650-K654 PolarHBondContact O-N 3.02Å; A651-K654 PolarHBondContact O-N 3.29Å; R652-K654 VanDerWaalsContact C-N 3.33Å; R652-K654 PolarHBondContact O-N 3.12Å; K654-A657 PolarHBondContact O-N 3.3Å; K654-D658 PolarHBondContact O-N 3.07Å
655	L	84	Confident	84.1	Confident	6 Å²	6	69.3 Å²	69.3	3%	0.031	33%	0.334	C	S	.	.	H	α-helix	trans	-72.3	-32.7	-177.9	-171.9	141.7	0	0	0	112.5	I541 L612 L645 A651 R652 A659	I541-L655 HydrophobicContact CD1-CD1 4.03Å; L612-L655 HydrophobicContact CD1-CD2 3.62Å; L612-L655 HydrophobicContact CD2-CD2 3.61Å; L612-L655 HydrophobicContact CG-CD2 3.84Å; L645-L655 HydrophobicContact CD1-CD2 4.4Å; A651-L655 WeakPolarHBondContact O-CB 3.43Å; A651-L655 PolarHBondContact O-N 3.16Å; R652-L655 PolarHBondContact O-N 3.5Å; L655-A659 WeakPolarHBondContact O-CB 3.33Å; L655-A659 PolarHBondContact O-N 3.27Å
656	E	85	Confident	83.1	Confident	40 Å²	40	73.9 Å²	73.9	19%	0.187	35%	0.352	C	S	.	.	H	α-helix	trans	-68.9	-43.9	168.4	-74.4	175.4	174.6	0	0	112	L612 R652 D658 A659 Y660	L612-E656 HydrophobicContact CD1-CG 4.08Å; L612-E656 HydrophobicContact CD2-CG 4.14Å; R652-E656 HydrophobicContact CG-CG 4.41Å; R652-E656 IonicContact CZ-OE1 2.61Å; R652-E656 IonicContact NE-OE1 2.66Å; R652-E656 PolarHBondContact NE-OE1 2.89Å; R652-E656 IonicContact NH2-OE1 3.41Å; R652-E656 PolarHBondContact NH2-OE1 2.92Å; R652-E656 PolarHBondContact O-N 3.43Å; E656-D658 PolarHBondContact O-N 3.43Å; E656-A659 WeakPolarHBondContact O-CB 3.14Å; E656-A659 PolarHBondContact O-N 3.07Å; E656-Y660 WeakPolarHBondContact O-CD2 3.35Å; E656-Y660 PolarHBondContact O-N 2.9Å
657	A	85.8	Confident	81.8	Confident	52 Å²	52	71.8 Å²	71.8	43%	0.43	35%	0.345	S	S	.	.	H	α-helix	trans	-61.1	-42.1	177.5	0	0	0	0	0	112.2	S653 K654 Y660 R661	S653-A657 VanDerWaalsContact O-CB 3.25Å; S653-A657 WeakPolarHBondContact O-CB 3.49Å; S653-A657 PolarHBondContact O-N 3.22Å; K654-A657 PolarHBondContact O-N 3.3Å; A657-Y660 PolarHBondContact O-N 3.46Å; A657-R661 WeakPolarHBondContact O-CG 3.43Å; A657-R661 PolarHBondContact O-N 2.92Å; A657-R661 VanDerWaalsContact O-N 3.08Å
658	D	83.8	Confident	80.2	Confident	11 Å²	11	72.3 Å²	72.3	6%	0.059	35%	0.352	C	S	.	.	H	α-helix	trans	-65.4	-42.1	174.8	-174.1	73.4	0	0	0	112.9	Y605 K654 E656 Y660 R661 K662	Y605-D658 VanDerWaalsContact OH-CG 3.3Å; Y605-D658 PolarHBondContact OH-OD2 3.47Å; K654-D658 PolarHBondContact O-N 3.07Å; E656-D658 PolarHBondContact O-N 3.43Å; D658-Y660 VanDerWaalsContact C-N 3.28Å; D658-Y660 PolarHBondContact O-N 2.93Å; D658-R661 WeakPolarHBondContact O-CB 3.31Å; D658-R661 PolarHBondContact O-N 3.26Å; D658-R661 IonicContact OD1-CZ 3.42Å; D658-R661 IonicContact OD1-NE 3.34Å; D658-R661 PolarHBondContact OD1-NE 2.83Å; D658-R661 IonicContact OD1-NH2 2.69Å; D658-R661 PolarHBondContact OD1-NH2 3.43Å; D658-K662 PolarHBondContact O-N 2.97Å; D658-K662 WeakPolarHBondContact OD2-CD 3.05Å; D658-K662 WeakPolarHBondContact OD2-CE 3.29Å; D658-K662 IonicContact OD2-NZ 2.7Å; D658-K662 PolarHBondContact OD2-NZ 3.11Å
659	A	81.8	Confident	78.6	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-55.3	-43.1	173.9	0	0	0	0	0	111.9	L609 L612 L614 L655 E656 K662 I663	L609-A659 HydrophobicContact CD2-CB 3.71Å; L612-A659 HydrophobicContact CD1-CB 3.68Å; L614-A659 HydrophobicContact CD2-CB 3.73Å; L655-A659 WeakPolarHBondContact O-CB 3.33Å; L655-A659 PolarHBondContact O-N 3.27Å; E656-A659 WeakPolarHBondContact O-CB 3.14Å; E656-A659 PolarHBondContact O-N 3.07Å; A659-K662 PolarHBondContact O-N 2.86Å; A659-I663 VanDerWaalsContact O-CG1 3.3Å; A659-I663 WeakPolarHBondContact O-CG1 3.38Å; A659-I663 PolarHBondContact O-N 3.01Å
660	Y	82.1	Confident	76.2	Confident	128 Å²	128	75.5 Å²	75.5	50%	0.502	37%	0.372	S	S	.	.	H	α-helix	trans	-63.9	-41.8	173.2	-73.9	-64.4	0	0	0	113	L614 E656 A657 D658 K662 I663 N664	L614-Y660 HydrophobicContact CD2-CD1 4.21Å; L614-Y660 HydrophobicContact CD2-CD2 3.92Å; L614-Y660 HydrophobicContact CD2-CE1 3.93Å; L614-Y660 HydrophobicContact CD2-CE2 3.61Å; L614-Y660 HydrophobicContact CD2-CG 4.2Å; L614-Y660 HydrophobicContact CG-CE1 4.12Å; L614-Y660 HydrophobicContact CG-CE2 4.36Å; E656-Y660 WeakPolarHBondContact O-CD2 3.35Å; E656-Y660 PolarHBondContact O-N 2.9Å; A657-Y660 PolarHBondContact O-N 3.46Å; D658-Y660 VanDerWaalsContact C-N 3.28Å; D658-Y660 PolarHBondContact O-N 2.93Å; Y660-K662 VanDerWaalsContact C-N 3.33Å; Y660-K662 PolarHBondContact O-N 2.84Å; Y660-I663 PolarHBondContact O-N 3.19Å; Y660-N664 VanDerWaalsContact O-CG 3.29Å; Y660-N664 PolarHBondContact O-N 3.32Å
661	R	83.6	Confident	74.1	Confident	153 Å²	153	78.4 Å²	78.4	58%	0.577	38%	0.382	S	S	*	.	H	α-helix	trans	-57.2	-46.7	175.2	-67.8	-169.9	-57.8	-173.4	2	111.5	A657 D658 N664 Q665	A657-R661 WeakPolarHBondContact O-CG 3.43Å; A657-R661 PolarHBondContact O-N 2.92Å; A657-R661 VanDerWaalsContact O-N 3.08Å; D658-R661 WeakPolarHBondContact O-CB 3.31Å; D658-R661 PolarHBondContact O-N 3.26Å; D658-R661 IonicContact OD1-CZ 3.42Å; D658-R661 IonicContact OD1-NE 3.34Å; D658-R661 PolarHBondContact OD1-NE 2.83Å; D658-R661 IonicContact OD1-NH2 2.69Å; D658-R661 PolarHBondContact OD1-NH2 3.43Å; R661-N664 PolarHBondContact O-N 3.32Å; R661-Q665 WeakPolarHBondContact O-CG 3.48Å; R661-Q665 PolarHBondContact O-N 3.12Å
662	K	78.4	Confident	71.7	Confident	34 Å²	34	85.9 Å²	85.9	15%	0.148	42%	0.416	C	S	.	.	H	α-helix	trans	-65.6	-42.4	178.9	-77	170.1	177.1	155.8	0	112.8	Y605 E608 D658 A659 Y660 N664 Q665 Y666	Y605-K662 VanDerWaalsContact CE2-NZ 3.29Å; Y605-K662 PolarHBondContact OH-NZ 2.77Å; E608-K662 WeakPolarHBondContact OE1-CD 3.23Å; E608-K662 WeakPolarHBondContact OE1-CE 3.41Å; E608-K662 IonicContact OE1-NZ 2.71Å; E608-K662 PolarHBondContact OE1-NZ 3.07Å; D658-K662 PolarHBondContact O-N 2.97Å; D658-K662 WeakPolarHBondContact OD2-CD 3.05Å; D658-K662 WeakPolarHBondContact OD2-CE 3.29Å; D658-K662 IonicContact OD2-NZ 2.7Å; D658-K662 PolarHBondContact OD2-NZ 3.11Å; A659-K662 PolarHBondContact O-N 2.86Å; Y660-K662 VanDerWaalsContact C-N 3.33Å; Y660-K662 PolarHBondContact O-N 2.84Å; K662-N664 VanDerWaalsContact C-N 3.29Å; K662-N664 PolarHBondContact O-N 3.49Å; K662-Q665 PolarHBondContact O-N 2.77Å; K662-Y666 HydrophobicContact CB-CD2 4.49Å; K662-Y666 HydrophobicContact CB-CE2 4.2Å; K662-Y666 WeakPolarHBondContact O-CD2 3.1Å; K662-Y666 PolarHBondContact O-N 2.84Å
663	I	77.2	Confident	69.2	Low	28 Å²	28	88 Å²	88	14%	0.144	43%	0.434	C	S	.	.	H	α-helix	trans	-55.9	-47.6	174.5	-71	165.1	0	0	0	110.3	L609 L614 A659 Y660 Q665 Y666 Q667	L609-I663 HydrophobicContact CD2-CD1 3.97Å; L609-I663 HydrophobicContact CD2-CG1 3.8Å; L614-I663 HydrophobicContact CB-CD1 4.07Å; A659-I663 VanDerWaalsContact O-CG1 3.3Å; A659-I663 WeakPolarHBondContact O-CG1 3.38Å; A659-I663 PolarHBondContact O-N 3.01Å; Y660-I663 PolarHBondContact O-N 3.19Å; I663-Q665 PolarHBondContact O-N 3.25Å; I663-Y666 PolarHBondContact O-N 3.19Å; I663-Q667 HydrophobicContact CG2-CG 4.45Å; I663-Q667 WeakPolarHBondContact O-CG 3.05Å; I663-Q667 PolarHBondContact O-N 3.06Å
664	N	77.4	Confident	66.7	Low	83 Å²	83	90.9 Å²	90.9	44%	0.444	44%	0.442	S	S	.	.	H	α-helix	trans	-65.5	-38.8	179.8	-65.5	-9.4	0	0	0	112.1	Y660 R661 K662 Q667 N668	Y660-N664 VanDerWaalsContact O-CG 3.29Å; Y660-N664 PolarHBondContact O-N 3.32Å; R661-N664 PolarHBondContact O-N 3.32Å; K662-N664 VanDerWaalsContact C-N 3.29Å; K662-N664 PolarHBondContact O-N 3.49Å; N664-Q667 PolarHBondContact O-N 3.42Å; N664-N668 VanDerWaalsContact O-CB 3.31Å; N664-N668 WeakPolarHBondContact O-CB 3.29Å; N664-N668 PolarHBondContact O-N 3.16Å; N664-N668 PolarHBondContact O-ND2 2.9Å
665	Q	74	Confident	64.1	Low	124 Å²	124	95.6 Å²	95.6	58%	0.579	46%	0.463	S	S	*	.	H	α-helix	trans	-60	-45.7	173	-75.6	174.1	-12.2	0	0	111.9	R661 K662 I663 N668 I669	R661-Q665 WeakPolarHBondContact O-CG 3.48Å; R661-Q665 PolarHBondContact O-N 3.12Å; K662-Q665 PolarHBondContact O-N 2.77Å; I663-Q665 PolarHBondContact O-N 3.25Å; Q665-N668 PolarHBondContact O-N 3.27Å; Q665-I669 WeakPolarHBondContact O-CG1 3.11Å
666	Y	66.6	Low	61.5	Low	99 Å²	99	102.4 Å²	102.4	39%	0.388	50%	0.499	S	S	.	.	H	α-helix	trans	-70.1	-29.7	178.3	-67.6	-58.8	0	0	0	113.7	K662 I663 I669	K662-Y666 HydrophobicContact CB-CD2 4.49Å; K662-Y666 HydrophobicContact CB-CE2 4.2Å; K662-Y666 WeakPolarHBondContact O-CD2 3.1Å; K662-Y666 PolarHBondContact O-N 2.84Å; I663-Y666 PolarHBondContact O-N 3.19Å; Y666-I669 HydrophobicContact CD1-CD1 4.38Å
667	Q	61.4	Low	58.8	Low	135 Å²	135	108.6 Å²	108.6	63%	0.631	53%	0.526	S	S	*	.	H	α-helix	trans	-73.6	-29.6	174.3	-73.7	179.2	-6.8	0	0	112.9	I663 N664	I663-Q667 HydrophobicContact CG2-CG 4.45Å; I663-Q667 WeakPolarHBondContact O-CG 3.05Å; I663-Q667 PolarHBondContact O-N 3.06Å; N664-Q667 PolarHBondContact O-N 3.42Å
668	N	56.1	Low	56.1	Low	130 Å²	130	111.5 Å²	111.5	70%	0.695	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	5.6	-177.2	-70	-19.9	0	0	0	114.5	N664 Q665 P670	N664-N668 VanDerWaalsContact O-CB 3.31Å; N664-N668 WeakPolarHBondContact O-CB 3.29Å; N664-N668 PolarHBondContact O-N 3.16Å; N664-N668 PolarHBondContact O-ND2 2.9Å; Q665-N668 PolarHBondContact O-N 3.27Å; N668-P670 WeakPolarHBondContact O-CD 3.43Å
669	I	55.8	Low	53.3	Low	103 Å²	103	119.1 Å²	119.1	53%	0.528	58%	0.581	S	S	.	*	S	Bend	trans	-88.4	105	171.2	-65	162.6	0	0	0	108.2	Q665 Y666	Q665-I669 WeakPolarHBondContact O-CG1 3.11Å; Y666-I669 HydrophobicContact CD1-CD1 4.38Å
670	P	38.4	Very low	50.6	Low	91 Å²	91	127.9 Å²	127.9	59%	0.591	62%	0.619	S	S	*	*			trans	-67.3	139.8	177.4	28.4	-34.4	0	0	0	110.4	N668 Q672	N668-P670 WeakPolarHBondContact O-CD 3.43Å; P670-Q672 PolarHBondContact O-N 3.31Å
671	Q	41.4	Very low	48	Very low	161 Å²	161	126.9 Å²	126.9	75%	0.752	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-68.7	24.7	177.6	-66.4	-179.4	-26.2	0	0	113.9	I674	Q671-I674 HydrophobicContact CB-CD1 3.97Å; Q671-I674 VanDerWaalsContact O-CD1 3.28Å; Q671-I674 WeakPolarHBondContact O-CD1 3.38Å; Q671-I674 VanDerWaalsContact O-CG1 3.28Å; Q671-I674 WeakPolarHBondContact O-CG1 3.39Å
672	Q	34	Very low	45.2	Very low	166 Å²	166	127 Å²	127	78%	0.776	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-91.2	-8.3	-169.1	-77.4	-175.8	-28.3	0	0	115.4	P670 I674	P670-Q672 PolarHBondContact O-N 3.31Å; Q672-I674 PolarHBondContact O-N 3.38Å; Q672-I674 VanDerWaalsContact O-N 3.13Å
673	N	33.5	Very low	42.7	Very low	138 Å²	138	130.2 Å²	130.2	74%	0.738	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-80	22.2	169.7	-78.2	1.5	0	0	0	113.8
674	I	33.9	Very low	40.3	Very low	134 Å²	134	137.7 Å²	137.7	69%	0.687	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-92	5.8	-174.2	-66.7	-179.4	0	0	0	112.9	Q671 Q672	Q671-I674 HydrophobicContact CB-CD1 3.97Å; Q671-I674 VanDerWaalsContact O-CD1 3.28Å; Q671-I674 WeakPolarHBondContact O-CD1 3.38Å; Q671-I674 VanDerWaalsContact O-CG1 3.28Å; Q671-I674 WeakPolarHBondContact O-CG1 3.39Å; Q672-I674 PolarHBondContact O-N 3.38Å; Q672-I674 VanDerWaalsContact O-N 3.13Å
675	K	30.9	Very low	37.8	Very low	191 Å²	191	141 Å²	141	83%	0.83	71%	0.711	S	S	*	*	S	Bend	trans	-120.5	-16.5	-177.8	-71.1	-168.6	175.5	-176.6	0	117.6
676	D	29.4	Very low	35.5	Very low	150 Å²	150	144.8 Å²	144.8	80%	0.802	72%	0.719	S	S	*	*			trans	-123	62.5	-175.9	-65.5	-57.3	0	0	0	112.9
677	F	28.2	Very low	33.4	Very low	170 Å²	170	148.4 Å²	148.4	75%	0.746	74%	0.737	S	S	*	*			trans	-131.2	121.3	161.7	-88.4	-81.2	0	0	0	110.3	N679	F677-N679 PolarHBondContact O-N 3.38Å
678	P	29.4	Very low	31.8	Very low	112 Å²	112	146.8 Å²	146.8	73%	0.727	74%	0.736	S	S	*	*			trans	-67.5	130.2	174.3	27.5	-32.6	0	0	0	109.5	K680	P678-K680 PolarHBondContact O-N 3.27Å
679	N	25.8	Very low	30.3	Very low	171 Å²	171	149.3 Å²	149.3	91%	0.914	75%	0.746	S	S	*	*			trans	-63.4	77.1	171.1	-87.3	-28.5	0	0	0	111.1	F677 S681	F677-N679 PolarHBondContact O-N 3.38Å; N679-S681 PolarHBondContact O-N 2.77Å
680	K	25.2	Very low	28.8	Very low	185 Å²	185	150.5 Å²	150.5	80%	0.804	75%	0.753	S	S	*	*			trans	-83.6	97.5	153.8	-91.3	-175	174.1	177.9	0	107.5	P678 I682	P678-K680 PolarHBondContact O-N 3.27Å; K680-I682 VanDerWaalsContact C-N 3.35Å; K680-I682 PolarHBondContact O-N 2.88Å
681	S	27	Very low	28.3	Very low	107 Å²	107	151.5 Å²	151.5	75%	0.748	76%	0.763	S	S	*	*			trans	-51.2	104.7	153.3	38.4	0	0	0	0	107.8	N679 P683	N679-S681 PolarHBondContact O-N 2.77Å; S681-P683 WeakPolarHBondContact O-CD 3.44Å; S681-P683 VanDerWaalsContact O-N 3.13Å
682	I	26	Very low	27.5	Very low	156 Å²	156	148.5 Å²	148.5	80%	0.8	76%	0.755	S	S	*	*			trans	-62.1	117.1	172.5	-58.5	172.8	0	0	0	105.3	K680 F684	K680-I682 VanDerWaalsContact C-N 3.35Å; K680-I682 PolarHBondContact O-N 2.88Å; I682-F684 PolarHBondContact O-N 3.41Å
683	P	25.3	Very low	27.3	Very low	101 Å²	101	147.2 Å²	147.2	66%	0.656	75%	0.754	S	S	*	*			trans	-57.9	136.4	176.9	-21.4	33.4	0	0	0	108.1	S681 E685	S681-P683 WeakPolarHBondContact O-CD 3.44Å; S681-P683 VanDerWaalsContact O-N 3.13Å; P683-E685 PolarHBondContact O-N 2.88Å
684	F	27.5	Very low	26.9	Very low	185 Å²	185	146.1 Å²	146.1	81%	0.811	75%	0.754	S	S	*	*			trans	-71.4	72.4	166.2	-171	-95.1	0	0	0	107.9	I682 R686	I682-F684 PolarHBondContact O-N 3.41Å; F684-R686 HydrophobicContact CD1-CB 4.33Å; F684-R686 HydrophobicContact CE1-CB 4.09Å; F684-R686 PolarHBondContact O-N 2.99Å
685	E	24.3	Very low	26.7	Very low	153 Å²	153	148 Å²	148	72%	0.715	76%	0.763	S	S	*	*			trans	-61.5	99.8	160.4	-84.3	-157	144.5	0	0	106.4	P683 K687	P683-E685 PolarHBondContact O-N 2.88Å; E685-K687 PolarHBondContact O-N 3.36Å
686	R	25.2	Very low	26.5	Very low	203 Å²	203	145.3 Å²	145.3	77%	0.766	76%	0.757	S	S	*	*			trans	-65.1	72.2	156.7	-169.2	-166.1	-51.5	-177.1	4.5	106.8	F684 V688	F684-R686 HydrophobicContact CD1-CB 4.33Å; F684-R686 HydrophobicContact CE1-CB 4.09Å; F684-R686 PolarHBondContact O-N 2.99Å; R686-V688 PolarHBondContact O-N 3.47Å
687	K	23.6	Very low	26.4	Very low	174 Å²	174	147.9 Å²	147.9	76%	0.757	76%	0.757	S	S	*	*			trans	-66.2	90.8	171.2	-143.4	178.6	-169.5	-173.7	0	105.4	E685 M689	E685-K687 PolarHBondContact O-N 3.36Å; K687-M689 PolarHBondContact O-N 2.92Å; K687-M689 VanDerWaalsContact O-N 3.13Å
688	V	25.9	Very low	26.4	Very low	102 Å²	102	146.7 Å²	146.7	62%	0.618	76%	0.757	S	S	*	*			trans	-46.9	122.5	159.7	176.2	0	0	0	0	104.4	R686 N690	R686-V688 PolarHBondContact O-N 3.47Å; V688-N690 PolarHBondContact O-N 2.98Å
689	M	26.3	Very low	26.2	Very low	182 Å²	182	142.6 Å²	142.6	90%	0.897	74%	0.735	S	S	*	*			trans	-75.4	76.2	-175.2	-165.8	157.9	-179.4	0	0	107.9	K687 S691	K687-M689 PolarHBondContact O-N 2.92Å; K687-M689 VanDerWaalsContact O-N 3.13Å; M689-S691 PolarHBondContact O-N 3.47Å
690	N	23.7	Very low	26.2	Very low	128 Å²	128	141.6 Å²	141.6	68%	0.684	72%	0.719	S	S	*	*			trans	-55.7	128.4	168.6	-76.2	0.2	0	0	0	107	V688 T692	V688-N690 PolarHBondContact O-N 2.98Å; N690-T692 PolarHBondContact O-N 3.29Å
691	S	26.8	Very low	26.2	Very low	112 Å²	112	138 Å²	138	78%	0.783	72%	0.718	S	S	*	*	S	Bend	trans	-60.7	107.5	178.8	49.3	0	0	0	0	110.6	M689	M689-S691 PolarHBondContact O-N 3.47Å
692	T	26.1	Very low	26.2	Very low	98 Å²	98	134.1 Å²	134.1	60%	0.601	69%	0.692	S	S	*	*			trans	172.7	87.2	154.4	23.7	0	0	0	0	109.7	N690 F1222	N690-T692 PolarHBondContact O-N 3.29Å; T692-F1222 HydrophobicContact CG2-CE1 4.11Å
693	D	28.5	Very low	26.3	Very low	140 Å²	140	133.8 Å²	133.8	75%	0.749	69%	0.691	S	S	*	*			trans	-162.5	102.8	160.9	-97.6	-31.8	0	0	0	107.9	M695	D693-M695 PolarHBondContact O-N 2.91Å; D693-M695 VanDerWaalsContact O-N 3.15Å
694	P	26.6	Very low	26.4	Very low	115 Å²	115	133.8 Å²	133.8	75%	0.747	70%	0.699	S	S	*	*			trans	-84.7	91.2	-169.9	32.3	-33.9	0	0	0	112.4	N696	P694-N696 PolarHBondContact O-N 3.36Å
695	M	29.4	Very low	26.3	Very low	174 Å²	174	132 Å²	132	86%	0.857	70%	0.697	S	S	*	*			trans	-98.1	74.2	168.1	-90.8	-70	-173.7	0	0	112.2	D693 Y697	D693-M695 PolarHBondContact O-N 2.91Å; D693-M695 VanDerWaalsContact O-N 3.15Å; M695-Y697 PolarHBondContact O-N 3.43Å; M695-Y697 VanDerWaalsContact O-N 3.09Å
696	N	25.7	Very low	26.4	Very low	134 Å²	134	129.7 Å²	129.7	72%	0.717	69%	0.69	S	S	*	*			trans	17.2	75	153.8	-141.1	-10.4	0	0	0	117.7	P694	P694-N696 PolarHBondContact O-N 3.36Å
697	Y	28.9	Very low	26.5	Very low	203 Å²	203	123.8 Å²	123.8	80%	0.796	68%	0.68	S	S	*	*			trans	-129.9	95.9	160.5	-102.1	-84.6	0	0	0	108.7	M695 G699	M695-Y697 PolarHBondContact O-N 3.43Å; M695-Y697 VanDerWaalsContact O-N 3.09Å; Y697-G699 PolarHBondContact O-N 2.98Å
698	I	27.3	Very low	26.8	Very low	146 Å²	146	121.4 Å²	121.4	75%	0.749	68%	0.68	S	S	*	*			trans	-71.9	104.2	-169.8	-61.7	175.3	0	0	0	111.5
699	G	25.4	Very low	26.9	Very low	26 Å²	26	126 Å²	126	27%	0.268	70%	0.695	S	S	.	*				106.2	54.1	118.2	0	0	0	0	0	119.5	Y697 Q861	Y697-G699 PolarHBondContact O-N 2.98Å; G699-Q861 PolarHBondContact O-OE1 3.23Å
700	Y	24.5	Very low	27	Very low	149 Å²	149	124.8 Å²	124.8	58%	0.584	69%	0.691	S	S	*	*			trans	-137.7	38.2	167	-72.6	-92.2	0	0	0	115.1	G859 K860 Q861	Y700-G859 WeakPolarHBondContact CE1-O 3.43Å; Y700-G859 PolarHBondContact OH-O 3.3Å; Y700-K860 HydrophobicContact CE1-CG 4.23Å; Y700-Q861 HydrophobicContact CD1-CB 3.75Å; Y700-Q861 HydrophobicContact CD1-CG 3.85Å; Y700-Q861 HydrophobicContact CE1-CB 3.91Å; Y700-Q861 HydrophobicContact CE1-CG 4.5Å
701	S	27.2	Very low	27.2	Very low	110 Å²	110	128.5 Å²	128.5	77%	0.769	70%	0.695	S	S	*	*			trans	-105	119.7	161.8	50.4	0	0	0	0	109.6	Q861	S701-Q861 PolarHBondContact O-NE2 3.17Å
702	A	27.1	Very low	27.3	Very low	25 Å²	25	129.1 Å²	129.1	21%	0.207	69%	0.69	C	S	.	*			trans	-100.9	126	-179.8	0	0	0	0	0	111	A704 Q861 H863	A702-A704 PolarHBondContact O-N 3.5Å; A702-Q861 HydrophobicContact CB-CG 4.29Å; A702-H863 HydrophobicContact CB-CB 3.45Å; A702-H863 VanDerWaalsContact CB-CB 3.45Å
703	L	26	Very low	27.4	Very low	150 Å²	150	131.7 Å²	131.7	79%	0.785	70%	0.7	S	S	*	*			trans	33.6	73.9	138	-64	167.3	0	0	0	116	L705	L703-L705 HydrophobicContact CD2-CD1 3.85Å
704	A	27.4	Very low	27.5	Very low	100 Å²	100	132.4 Å²	132.4	83%	0.826	70%	0.704	S	S	*	*			trans	-99.1	104.8	135.2	0	0	0	0	0	106.8	A702	A702-A704 PolarHBondContact O-N 3.5Å
705	L	27.4	Very low	27.9	Very low	147 Å²	147	131.8 Å²	131.8	77%	0.77	70%	0.7	S	S	*	*			trans	-71.1	123.4	155.4	-89.1	79.4	0	0	0	106.5	L703	L703-L705 HydrophobicContact CD2-CD1 3.85Å
706	D	25.6	Very low	27.9	Very low	105 Å²	105	129.3 Å²	129.3	56%	0.561	69%	0.694	S	S	*	*				-155.4	-179.5	106.4	-150.4	-7.8	0	0	0	110.4	L1170	D706-L1170 WeakPolarHBondContact OD2-CD2 3.35Å
707	S	28.2	Very low	28	Very low	79 Å²	79	129.7 Å²	129.7	55%	0.552	70%	0.695	S	S	*	*			trans	-110.7	161.2	-136.9	-52.2	0	0	0	0	114.7
708	T	28.8	Very low	27.9	Very low	125 Å²	125	126.4 Å²	126.4	77%	0.767	69%	0.691	S	S	*	*			trans	56.7	91.1	153.3	50.2	0	0	0	0	118.4	L710	T708-L710 PolarHBondContact O-N 2.62Å
709	H	28.2	Very low	28.2	Very low	199 Å²	199	127.5 Å²	127.5	92%	0.921	69%	0.693	S	S	*	*			trans	-59.5	111.6	142.6	-112.5	-98.7	0	0	0	109.9
710	L	28.5	Very low	28.2	Very low	156 Å²	156	133.6 Å²	133.6	82%	0.817	72%	0.72	S	S	*	*			trans	-176.6	138.3	157.6	-96.9	152.8	0	0	0	107.8	T708	T708-L710 PolarHBondContact O-N 2.62Å
711	R	27.4	Very low	28.4	Very low	206 Å²	206	131.8 Å²	131.8	78%	0.777	73%	0.729	S	S	*	*			cis	-170.5	127.4	-28.3	171.3	179.1	-165	-157.8	7.4	107.4
712	N	28.9	Very low	28.3	Very low	124 Å²	124	135.3 Å²	135.3	66%	0.663	73%	0.733	S	S	*	*			trans	59.6	134.1	163.8	-57.3	-2	0	0	0	117.6
713	N	28.9	Very low	28.3	Very low	152 Å²	152	139.7 Å²	139.7	81%	0.813	76%	0.762	S	S	*	*				-164.4	137	66.7	-91.2	-49.5	0	0	0	113.1
714	N	31	Very low	28.3	Very low	155 Å²	155	141.2 Å²	141.2	83%	0.829	77%	0.765	S	S	*	*			trans	-69.3	173	152.6	-93.2	-19.9	0	0	0	109.3
715	P	34.7	Very low	28.2	Very low	103 Å²	103	144.9 Å²	144.9	67%	0.669	77%	0.77	S	S	*	*			cis	-154.9	171.5	35.2	43.4	-21.2	0	0	0	120.3
716	T	28.8	Very low	28	Very low	121 Å²	121	144.7 Å²	144.7	74%	0.742	77%	0.769	S	S	*	*			trans	50.1	141.1	140.7	54.7	0	0	0	0	123.3
717	I	28.3	Very low	28	Very low	143 Å²	143	148.1 Å²	148.1	73%	0.733	78%	0.784	S	S	*	*				-170.6	126	107.4	-95.9	158.9	0	0	0	111
718	N	27.1	Very low	27.8	Very low	133 Å²	133	152.3 Å²	152.3	71%	0.711	80%	0.801	S	S	*	*			trans	49.1	155.6	148.9	-65.5	-17.8	0	0	0	121.8
719	Q	32.4	Very low	27.7	Very low	170 Å²	170	151 Å²	151	79%	0.794	80%	0.796	S	S	*	*			cis	-154	167.4	13.2	-136.4	153.7	26	0	0	112.5
720	N	25.5	Very low	27.6	Very low	154 Å²	154	149 Å²	149	82%	0.824	79%	0.793	S	S	*	*			trans	-77	158.4	-173.2	-54.7	-43.6	0	0	0	115.1
721	S	28.1	Very low	27.5	Very low	110 Å²	110	150.1 Å²	150.1	77%	0.769	79%	0.793	S	S	*	*				-177.9	135.1	120.2	53.8	0	0	0	0	115.2
722	H	26.2	Very low	27.4	Very low	184 Å²	184	147.7 Å²	147.7	85%	0.852	79%	0.791	S	S	*	*			trans	-12.6	149.3	155.2	-60.9	-97.6	0	0	0	118.4
723	S	27.8	Very low	27.1	Very low	118 Å²	118	148 Å²	148	83%	0.825	80%	0.801	S	S	*	*				-167.3	161.2	58.5	51.6	0	0	0	0	114.6
724	Q	24.5	Very low	26.9	Very low	181 Å²	181	145.3 Å²	145.3	85%	0.846	79%	0.786	S	S	*	*			trans	-75	155.3	172.4	-64.9	162.9	-68	0	0	112.4
725	L	26	Very low	26.6	Very low	177 Å²	177	144.4 Å²	144.4	93%	0.927	79%	0.786	S	S	*	*			trans	-166.5	125.7	137.8	-106.2	163.7	0	0	0	110.1
726	D	22.3	Very low	26	Very low	143 Å²	143	149 Å²	149	77%	0.765	79%	0.79	S	S	*	*			trans	-70.8	148	174.7	-72.2	-59.6	0	0	0	112.3
727	M	26.5	Very low	25.8	Very low	178 Å²	178	149.4 Å²	149.4	88%	0.877	79%	0.792	S	S	*	*			trans	-152.4	111.1	145.1	-99.4	-56.3	134.5	0	0	111
728	N	24.1	Very low	25.6	Very low	167 Å²	167	147.1 Å²	147.1	89%	0.893	79%	0.789	S	S	*	*			trans	-74.8	124.3	160.3	-105.1	-26.9	0	0	0	108.8
729	S	27.2	Very low	25.5	Very low	96 Å²	96	147.8 Å²	147.8	67%	0.671	79%	0.792	S	S	*	*			trans	-154	123.2	159.6	63	0	0	0	0	112.2
730	N	24.6	Very low	25.1	Very low	159 Å²	159	143.9 Å²	143.9	85%	0.85	78%	0.784	S	S	*	*			trans	-53.2	137.7	168.6	-52.7	-61.5	0	0	0	110.8
731	H	28.2	Very low	25.1	Very low	178 Å²	178	144.1 Å²	144.1	82%	0.824	79%	0.785	S	S	*	*			trans	-144.6	128.5	149.9	-97.3	-64	0	0	0	112.4
732	E	24.6	Very low	24.9	Very low	155 Å²	155	142.1 Å²	142.1	72%	0.724	78%	0.782	S	S	*	*			trans	-61.4	150.4	171.8	-56.3	163.8	105	0	0	111.3	L734	E732-L734 WeakPolarHBondContact OE1-CD1 3.19Å
733	C	23.3	Very low	24.8	Very low	132 Å²	132	138.4 Å²	138.4	89%	0.892	78%	0.777	S	S	*	*			trans	-118.5	84.5	148.7	-160	0	0	0	0	109
734	L	23.5	Very low	24.7	Very low	95 Å²	95	139.5 Å²	139.5	50%	0.497	77%	0.773	S	S	.	*			trans	-66.9	122	178.1	-114.1	162.9	0	0	0	111.3	E732 R736	E732-L734 WeakPolarHBondContact OE1-CD1 3.19Å; L734-R736 HydrophobicContact CD2-CB 4.13Å; L734-R736 HydrophobicContact CD2-CG 3.64Å
735	V	24.7	Very low	24.8	Very low	135 Å²	135	133.4 Å²	133.4	82%	0.818	76%	0.759	S	S	*	*			trans	-130.6	86.9	147.4	-176	0	0	0	0	108.4
736	R	22.6	Very low	24.7	Very low	200 Å²	200	136 Å²	136	76%	0.755	76%	0.758	S	S	*	*			trans	-70.5	132.2	160.1	-88.5	173.9	179	161.1	0.2	108.8	L734	L734-R736 HydrophobicContact CD2-CB 4.13Å; L734-R736 HydrophobicContact CD2-CG 3.64Å
737	V	24.8	Very low	24.9	Very low	130 Å²	130	132.3 Å²	132.3	79%	0.788	75%	0.754	S	S	*	*				-130.2	106	129.5	-178.3	0	0	0	0	106.8
738	S	22.6	Very low	24.8	Very low	95 Å²	95	129.6 Å²	129.6	66%	0.664	75%	0.752	S	S	*	*			trans	-108.3	121.9	164.4	-56.4	0	0	0	0	106.5
739	N	26.5	Very low	25	Very low	147 Å²	147	125 Å²	125	79%	0.786	73%	0.728	S	S	*	*			trans	-174.4	99.6	161.1	-91.5	-5.9	0	0	0	102.9
740	S	24.2	Very low	25	Very low	87 Å²	87	126.4 Å²	126.4	61%	0.608	73%	0.734	S	S	*	*				74.5	119.2	89.4	67.6	0	0	0	0	112.1
741	D	24.7	Very low	25.2	Very low	159 Å²	159	121.2 Å²	121.2	85%	0.85	71%	0.71	S	S	*	*			trans	76.1	118.1	161.4	-46.7	-33.3	0	0	0	119.7
742	G	24.4	Very low	25.2	Very low	68 Å²	68	120.4 Å²	120.4	70%	0.701	70%	0.7	S	S	*	*			trans	86.2	129.5	136.1	0	0	0	0	0	119.1
743	S	24.3	Very low	25.2	Very low	107 Å²	107	119.3 Å²	119.3	75%	0.748	71%	0.708	S	S	*	*			trans	52.8	120.6	153.7	55	0	0	0	0	119.9
744	D	25.5	Very low	25.3	Very low	140 Å²	140	117.2 Å²	117.2	75%	0.749	70%	0.695	S	S	*	*			trans	51.3	133.6	134.6	-51.2	-24.2	0	0	0	120.9
745	G	25.4	Very low	25.3	Very low	53 Å²	53	115.2 Å²	115.2	55%	0.546	69%	0.692	S	S	.	*			trans	138.4	102.9	166.2	0	0	0	0	0	115.9
746	Y	24.9	Very low	25.3	Very low	233 Å²	233	118.4 Å²	118.4	91%	0.914	70%	0.695	S	S	*	*			trans	32.1	90.4	149.5	-71.3	-89	0	0	0	119.9
747	G	25.5	Very low	25.5	Very low	65 Å²	65	115.2 Å²	115.2	67%	0.67	69%	0.693	S	S	*	*			trans	-104.7	122.2	165	0	0	0	0	0	113.2
748	S	25.9	Very low	25.6	Very low	121 Å²	121	114.3 Å²	114.3	85%	0.846	69%	0.689	S	S	*	*			trans	-57.1	127.1	-173.7	-44.9	0	0	0	0	115.1	P750	S748-P750 WeakPolarHBondContact O-CD 3.38Å
749	D	26.8	Very low	25.7	Very low	70 Å²	70	115.6 Å²	115.6	37%	0.374	69%	0.693	S	S	.	*			trans	-76.9	124.4	172	-83.8	-23.6	0	0	0	112	K576 S751 R752	K576-D749 IonicContact NZ-OD1 3.59Å; K576-D749 PolarHBondContact NZ-OD1 2.99Å; D749-S751 PolarHBondContact O-N 3.24Å; D749-R752 HydrophobicContact CB-CB 4.18Å; D749-R752 PolarHBondContact O-N 2.86Å
750	P	27.9	Very low	25.7	Very low	125 Å²	125	114.3 Å²	114.3	81%	0.812	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-66.7	-16.8	169.3	-19	32.9	0	0	0	113.2	S748 R752	S748-P750 WeakPolarHBondContact O-CD 3.38Å; P750-R752 VanDerWaalsContact C-N 3.26Å; P750-R752 PolarHBondContact O-N 3.43Å
751	S	29.1	Very low	25.9	Very low	50 Å²	50	116.8 Å²	116.8	35%	0.35	70%	0.695	S	S	.	*	G	3₁₀ helix	trans	-85.3	16.4	179.1	54.7	0	0	0	0	114.2	D749	D749-S751 PolarHBondContact O-N 3.24Å
752	R	27.5	Very low	26	Very low	161 Å²	161	120.9 Å²	120.9	61%	0.608	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-118.9	13.9	-172.8	-133.8	179.8	-171.3	-159.5	3.2	116	D749 P750 S754 A755	D749-R752 HydrophobicContact CB-CB 4.18Å; D749-R752 PolarHBondContact O-N 2.86Å; P750-R752 VanDerWaalsContact C-N 3.26Å; P750-R752 PolarHBondContact O-N 3.43Å; R752-S754 PolarHBondContact O-N 2.98Å; R752-A755 PolarHBondContact O-N 3.05Å
753	C	25.2	Very low	26.1	Very low	133 Å²	133	121 Å²	121	90%	0.899	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	15.5	171.9	-69.3	0	0	0	0	115.3
754	S	26.3	Very low	26.3	Very low	88 Å²	88	119.3 Å²	119.3	62%	0.615	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.9	4.5	173.9	66.3	0	0	0	0	114	R558 R752	R558-S754 PolarHBondContact NH2-OG 3.19Å; R752-S754 PolarHBondContact O-N 2.98Å
755	A	23.7	Very low	26.5	Very low	52 Å²	52	118.6 Å²	118.6	43%	0.43	68%	0.676	S	S	.	*			trans	-145.2	98.7	-176.4	0	0	0	0	0	113.4	R752	R752-A755 PolarHBondContact O-N 3.05Å
756	F	24.3	Very low	26.5	Very low	202 Å²	202	119.6 Å²	119.6	89%	0.886	67%	0.673	S	S	*	*			trans	172.7	68.4	147.3	-98.3	-63.9	0	0	0	111.2
757	L	27.2	Very low	26.5	Very low	134 Å²	134	112.1 Å²	112.1	70%	0.702	65%	0.654	S	S	*	*			trans	-141.8	147	168	-79.7	176.9	0	0	0	110.6
758	P	25.8	Very low	26.5	Very low	110 Å²	110	113.1 Å²	113.1	71%	0.714	66%	0.657	S	S	*	*			trans	-74	150	-168.8	29.8	-35.7	0	0	0	113.4	P760	P758-P760 WeakPolarHBondContact O-CD 3.4Å
759	T	24.6	Very low	26.5	Very low	122 Å²	122	114 Å²	114	75%	0.748	65%	0.65	S	S	*	*			trans	-76.2	134.9	-179.3	46.8	0	0	0	0	113.7
760	P	27	Very low	26.4	Very low	120 Å²	120	116 Å²	116	78%	0.779	67%	0.665	S	S	*	*			trans	-128.8	-179.1	136.8	18.3	2.9	0	0	0	113.1	P758	P758-P760 WeakPolarHBondContact O-CD 3.4Å
761	Q	28	Very low	26.3	Very low	140 Å²	140	114 Å²	114	65%	0.654	65%	0.65	S	S	*	*			trans	-92.1	158.8	-152.3	-60.8	177.1	-13.3	0	0	117.3
762	R	27.3	Very low	26.1	Very low	244 Å²	244	119.6 Å²	119.6	92%	0.921	67%	0.673	S	S	*	*			trans	41	103.1	155.6	-88.8	-176.1	171.4	179.1	-1.9	118.1
763	S	26.3	Very low	26.2	Very low	70 Å²	70	118 Å²	118	49%	0.49	68%	0.676	S	S	.	*	P	Polyproline II helix	trans	-96.5	147.4	147.2	47.2	0	0	0	0	110.4
764	P	28.7	Very low	26.3	Very low	72 Å²	72	118.7 Å²	118.7	47%	0.468	67%	0.671	S	S	.	*	P	Polyproline II helix	trans	-69.3	132.5	165.3	30	-32	0	0	0	108.6
765	T	28.8	Very low	26.4	Very low	126 Å²	126	119.9 Å²	119.9	77%	0.773	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-56.8	124.4	178	43.3	0	0	0	0	110.7
766	P	26.5	Very low	26.6	Very low	74 Å²	74	124.7 Å²	124.7	48%	0.481	70%	0.695	S	S	.	*	P	Polyproline II helix	trans	-63.2	140.5	162.3	29.5	-32.6	0	0	0	108.2	A768	P766-A768 PolarHBondContact O-N 3.37Å
767	S	24.5	Very low	26.8	Very low	75 Å²	75	122.9 Å²	122.9	52%	0.524	69%	0.687	S	S	.	*	P	Polyproline II helix	trans	-49.6	122.1	-175.2	-43.1	0	0	0	0	111.2	I769	S767-I769 PolarHBondContact O-N 2.6Å
768	A	25.4	Very low	26.8	Very low	87 Å²	87	120.9 Å²	120.9	72%	0.719	68%	0.68	S	S	*	*			trans	-66.8	100	170.8	0	0	0	0	0	108	P766 V770	P766-A768 PolarHBondContact O-N 3.37Å; A768-V770 VanDerWaalsContact C-N 3.25Å; A768-V770 PolarHBondContact O-N 3.42Å
769	I	25.5	Very low	26.9	Very low	139 Å²	139	123.6 Å²	123.6	71%	0.713	68%	0.683	S	S	*	*			trans	-71	89.6	172.1	-54.5	178.6	0	0	0	106.8	S767 V771	S767-I769 PolarHBondContact O-N 2.6Å; I769-V771 VanDerWaalsContact C-N 3.25Å; I769-V771 HydrophobicContact CG2-CG2 3.66Å; I769-V771 PolarHBondContact O-N 2.9Å
770	V	25.5	Very low	27.1	Very low	113 Å²	113	124.6 Å²	124.6	69%	0.685	68%	0.683	S	S	*	*			trans	-70	92	163.2	-179.9	0	0	0	0	106.4	A768 M772	A768-V770 VanDerWaalsContact C-N 3.25Å; A768-V770 PolarHBondContact O-N 3.42Å; V770-M772 VanDerWaalsContact C-N 3.28Å; V770-M772 HydrophobicContact CG1-CG 4.18Å; V770-M772 PolarHBondContact O-N 3.11Å
771	V	24.9	Very low	27.1	Very low	82 Å²	82	125.5 Å²	125.5	50%	0.497	69%	0.686	S	S	.	*			trans	-69.6	91.2	168.2	-177.7	0	0	0	0	107.2	I769 N773	I769-V771 VanDerWaalsContact C-N 3.25Å; I769-V771 HydrophobicContact CG2-CG2 3.66Å; I769-V771 PolarHBondContact O-N 2.9Å; V771-N773 HydrophobicContact CG1-CB 4.45Å; V771-N773 WeakPolarHBondContact CG1-OD1 3.42Å; V771-N773 PolarHBondContact O-N 3.39Å
772	M	26	Very low	27.1	Very low	168 Å²	168	123.5 Å²	123.5	83%	0.828	69%	0.688	S	S	*	*			trans	-69.3	84	160.7	-76.8	-170.7	170.3	0	0	108.3	V770 N774	V770-M772 VanDerWaalsContact C-N 3.28Å; V770-M772 HydrophobicContact CG1-CG 4.18Å; V770-M772 PolarHBondContact O-N 3.11Å; M772-N774 PolarHBondContact O-N 3.48Å
773	N	28.4	Very low	27.1	Very low	127 Å²	127	118.3 Å²	118.3	68%	0.679	68%	0.678	S	S	*	*			trans	-70.9	115.6	162.7	-91.8	-4.6	0	0	0	107.7	V771 P775	V771-N773 HydrophobicContact CG1-CB 4.45Å; V771-N773 WeakPolarHBondContact CG1-OD1 3.42Å; V771-N773 PolarHBondContact O-N 3.39Å; N773-P775 WeakPolarHBondContact O-CD 3.41Å
774	N	28.6	Very low	27.3	Very low	148 Å²	148	124 Å²	124	79%	0.791	70%	0.697	S	S	*	*			trans	-97.4	120.9	179.5	-174	16.3	0	0	0	109.4	M772	M772-N774 PolarHBondContact O-N 3.48Å
775	P	27.8	Very low	27.4	Very low	112 Å²	112	123.9 Å²	123.9	73%	0.727	71%	0.709	S	S	*	*			trans	-136.8	51.2	173.2	40.8	-22.7	0	0	0	114	N773	N773-P775 WeakPolarHBondContact O-CD 3.41Å
776	D	28.3	Very low	27.6	Very low	154 Å²	154	123.5 Å²	123.5	82%	0.824	71%	0.708	S	S	*	*			trans	-109	70.3	171.9	-85.1	-41.8	0	0	0	113.7
777	K	27.4	Very low	27.7	Very low	164 Å²	164	128.2 Å²	128.2	71%	0.713	72%	0.722	S	S	*	*			trans	-145.4	98.2	151.8	-82	-178.6	-172.5	154.9	0	109.2	D854	K777-D854 IonicContact NZ-OD2 2.79Å
778	T	28	Very low	27.9	Very low	91 Å²	91	131.2 Å²	131.2	56%	0.558	73%	0.73	S	S	*	*				172.3	122.9	114.1	45.1	0	0	0	0	115
779	H	27	Very low	28	Very low	167 Å²	167	134.9 Å²	134.9	77%	0.773	73%	0.733	S	S	*	*			trans	62.4	155.7	155.9	-43.6	-64.4	0	0	0	116.4
780	I	29	Very low	28.3	Very low	144 Å²	144	134.1 Å²	134.1	74%	0.738	74%	0.736	S	S	*	*			cis	-148	131.9	23.8	-64.6	169.3	0	0	0	109.5
781	T	26.8	Very low	28.3	Very low	138 Å²	138	135.5 Å²	135.5	85%	0.847	74%	0.74	S	S	*	*			trans	60.6	150.9	163.4	60.5	0	0	0	0	118.9
782	S	28.6	Very low	28.6	Very low	99 Å²	99	136.7 Å²	136.7	69%	0.692	75%	0.749	S	S	*	*			cis	-149.4	143.3	10.9	50.6	0	0	0	0	113.5
783	N	28	Very low	28.8	Very low	135 Å²	135	134.4 Å²	134.4	72%	0.722	75%	0.745	S	S	*	*			trans	39.3	104.9	144.6	-55.1	-8.3	0	0	0	120.9
784	H	30.5	Very low	28.9	Very low	189 Å²	189	134.3 Å²	134.3	88%	0.875	74%	0.743	S	S	*	*				165.7	126.3	101.4	-87.4	-71.1	0	0	0	111.1
785	G	30.3	Very low	29	Very low	70 Å²	70	136.9 Å²	136.9	72%	0.722	75%	0.748	S	S	*	*			trans	-115.1	-146.6	167.2	0	0	0	0	0	110.7
786	P	32.4	Very low	29	Very low	118 Å²	118	138.6 Å²	138.6	77%	0.766	75%	0.751	S	S	*	*			cis	-141.2	-160.9	-11.7	23.9	3.8	0	0	0	112.9
787	F	27.9	Very low	29.1	Very low	173 Å²	173	138 Å²	138	76%	0.759	75%	0.753	S	S	*	*			trans	119	101.6	151.9	-87.5	-120.1	0	0	0	121.8
788	I	30.5	Very low	29.2	Very low	138 Å²	138	134.8 Å²	134.8	71%	0.708	76%	0.756	S	S	*	*				78.7	119.7	125.6	-66.7	-167.1	0	0	0	121.9
789	Q	26.8	Very low	29.3	Very low	164 Å²	164	133.7 Å²	133.7	77%	0.766	76%	0.763	S	S	*	*			trans	-95.6	167.7	157.2	-63.7	177.7	-22.5	0	0	111.3
790	P	30.5	Very low	29.4	Very low	122 Å²	122	135 Å²	135	79%	0.792	77%	0.77	S	S	*	*			trans	-130.8	119.6	141.3	34	-20.8	0	0	0	113.4
791	N	27	Very low	29.4	Very low	142 Å²	142	132.3 Å²	132.3	76%	0.759	76%	0.764	S	S	*	*			trans	-78	166.5	147.7	-86.2	-18.9	0	0	0	108.8
792	P	31.6	Very low	29.5	Very low	107 Å²	107	134.3 Å²	134.3	70%	0.695	76%	0.764	S	S	*	*				-151.4	150.6	111.9	38.7	-22.6	0	0	0	116.8
793	T	29.8	Very low	29.3	Very low	121 Å²	121	134 Å²	134	74%	0.742	76%	0.761	S	S	*	*			trans	66.6	156.4	138.1	55.9	0	0	0	0	120.6
794	I	31	Very low	29.4	Very low	125 Å²	125	133.1 Å²	133.1	64%	0.641	76%	0.761	S	S	*	*			cis	-155.3	140.6	-0	-120	153.6	0	0	0	108.7
795	F	30.6	Very low	29.2	Very low	201 Å²	201	132.8 Å²	132.8	88%	0.882	75%	0.753	S	S	*	*				-175.3	128.1	118.9	-108.6	-73.8	0	0	0	111.5
796	N	26.2	Very low	29.1	Very low	149 Å²	149	136.2 Å²	136.2	80%	0.797	75%	0.75	S	S	*	*			trans	-102.7	151.6	-175.1	-81.8	-26.5	0	0	0	112.3
797	V	30.5	Very low	28.9	Very low	142 Å²	142	135.1 Å²	135.1	86%	0.861	74%	0.738	S	S	*	*			trans	-150.9	94.4	133.4	-179	0	0	0	0	106.5
798	A	30.1	Very low	28.9	Very low	95 Å²	95	136.8 Å²	136.8	79%	0.785	74%	0.739	S	S	*	*				76.1	126.2	97.8	0	0	0	0	0	115.3
799	G	29.5	Very low	28.7	Very low	69 Å²	69	135.2 Å²	135.2	71%	0.711	74%	0.74	S	S	*	*			cis	177.1	-171.3	-4.4	0	0	0	0	0	116.1
800	Q	29.1	Very low	28.7	Very low	195 Å²	195	132 Å²	132	91%	0.911	74%	0.736	S	S	*	*			trans	65.6	137.3	165.4	-63.6	179.4	-8.8	0	0	118.5
801	S	28.8	Very low	28.7	Very low	87 Å²	87	130.9 Å²	130.9	61%	0.608	73%	0.731	S	S	*	*			cis	-170.3	143.6	-11.6	45.2	0	0	0	0	112.3
802	Q	29.2	Very low	28.8	Very low	180 Å²	180	130.7 Å²	130.7	84%	0.841	74%	0.735	S	S	*	*			trans	66.8	148.3	144.6	-74.3	169.7	-15.4	0	0	120.4
803	S	25.9	Very low	28.8	Very low	91 Å²	91	130.5 Å²	130.5	64%	0.636	73%	0.733	S	S	*	*			cis	179.8	176.3	-27.9	43.8	0	0	0	0	109.9
804	V	28.5	Very low	28.7	Very low	118 Å²	118	129.9 Å²	129.9	72%	0.715	73%	0.73	S	S	*	*			trans	88.9	132	152.8	177.7	0	0	0	0	119.2
805	Y	27.7	Very low	28.5	Very low	181 Å²	181	130 Å²	130	71%	0.71	74%	0.736	S	S	*	*			cis	-159.3	155.5	-11.7	-123.9	-133.1	0	0	0	108.8
806	E	27.7	Very low	28.4	Very low	143 Å²	143	126.2 Å²	126.2	67%	0.668	73%	0.73	S	S	*	*			trans	42.2	157	135.5	-67.8	-163.7	147.3	0	0	123.7
807	N	28.4	Very low	28.4	Very low	95 Å²	95	125.4 Å²	125.4	51%	0.508	73%	0.725	S	S	.	*			cis	-160.6	157.1	3.8	-127	-32.8	0	0	0	113.3
808	R	28	Very low	28.3	Very low	207 Å²	207	125.5 Å²	125.5	78%	0.781	72%	0.721	S	S	*	*			trans	48.3	120.1	140.3	-80.7	166.1	-171	-165.9	0.3	122
809	S	26.7	Very low	28.1	Very low	105 Å²	105	125.6 Å²	125.6	73%	0.734	72%	0.716	S	S	*	*				67.8	139.5	91.6	81.8	0	0	0	0	115
810	S	26.7	Very low	28	Very low	97 Å²	97	130.9 Å²	130.9	68%	0.678	73%	0.727	S	S	*	*			cis	-170.7	179	9.9	41.8	0	0	0	0	110
811	S	30.7	Very low	28.1	Very low	99 Å²	99	125.1 Å²	125.1	69%	0.692	72%	0.72	S	S	*	*			trans	59.2	110.7	160	47.6	0	0	0	0	119.3
812	V	28.6	Very low	27.9	Very low	138 Å²	138	128.3 Å²	128.3	84%	0.836	73%	0.73	S	S	*	*				69.2	125.8	76.4	169.8	0	0	0	0	113.8
813	P	31.8	Very low	27.9	Very low	102 Å²	102	129.5 Å²	129.5	66%	0.662	73%	0.733	S	S	*	*				-136.4	-153.6	-55.1	39	-17.2	0	0	0	111.6
814	T	27.3	Very low	27.9	Very low	109 Å²	109	131 Å²	131	67%	0.669	74%	0.739	S	S	*	*			trans	76.1	117.2	152	37.5	0	0	0	0	122.4
815	T	26.6	Very low	28	Very low	126 Å²	126	129.8 Å²	129.8	77%	0.773	74%	0.74	S	S	*	*			trans	95.8	138.6	131	59.7	0	0	0	0	122.7
816	V	29.2	Very low	27.8	Very low	123 Å²	123	129.3 Å²	129.3	75%	0.745	75%	0.747	S	S	*	*			trans	77.7	103.7	159.2	-157.7	0	0	0	0	120
817	N	26.1	Very low	27.9	Very low	132 Å²	132	127.4 Å²	127.4	71%	0.706	75%	0.748	S	S	*	*			trans	27.6	156.7	131	-53.4	2.7	0	0	0	124.2
818	D	28.2	Very low	27.8	Very low	144 Å²	144	127.3 Å²	127.3	77%	0.77	76%	0.755	S	S	*	*			trans	68	142.8	153.7	-55.1	-33.1	0	0	0	117.3
819	S	25.7	Very low	27.9	Very low	96 Å²	96	123.8 Å²	123.8	67%	0.671	75%	0.752	S	S	*	*			cis	175.4	176.1	-17.1	60	0	0	0	0	105.2
820	L	27	Very low	28.1	Very low	180 Å²	180	126.7 Å²	126.7	94%	0.942	75%	0.754	S	S	*	*			trans	74.4	142.3	163.9	-124.6	74.9	0	0	0	119.1
821	G	30.5	Very low	28.1	Very low	75 Å²	75	129 Å²	129	77%	0.773	76%	0.759	S	S	*	*			trans	140.2	80	158.6	0	0	0	0	0	117.7
822	N	25.3	Very low	28.1	Very low	154 Å²	154	132 Å²	132	82%	0.824	76%	0.762	S	S	*	*			trans	-71	157.4	160.1	-70.6	-33.4	0	0	0	111
823	F	29.4	Very low	28.1	Very low	205 Å²	205	132.8 Å²	132.8	90%	0.899	76%	0.756	S	S	*	*				-173.8	169.4	124.8	-107.9	-73.6	0	0	0	112.8
824	T	26.7	Very low	27.8	Very low	123 Å²	123	133.9 Å²	133.9	76%	0.755	76%	0.761	S	S	*	*			trans	-127.6	175.4	-153.1	43	0	0	0	0	115.3
825	A	28.8	Very low	27.8	Very low	91 Å²	91	133.5 Å²	133.5	75%	0.752	76%	0.762	S	S	*	*			trans	86.8	154.4	159.3	0	0	0	0	0	117.3
826	M	24.4	Very low	27.7	Very low	171 Å²	171	134.1 Å²	134.1	84%	0.842	76%	0.76	S	S	*	*			cis	-165.1	167.2	-2.6	-138.4	166.6	165	0	0	112.5
827	C	29.3	Very low	27.5	Very low	104 Å²	104	133.5 Å²	133.5	70%	0.703	76%	0.76	S	S	*	*			trans	71.5	151.1	158.2	-64.1	0	0	0	0	120.9
828	S	28	Very low	27.5	Very low	93 Å²	93	134.9 Å²	134.9	65%	0.65	77%	0.766	S	S	*	*			cis	-171.8	146.4	-19.6	-91.6	0	0	0	0	111.8
829	N	29.4	Very low	27.4	Very low	133 Å²	133	134.5 Å²	134.5	71%	0.711	77%	0.769	S	S	*	*			trans	55.6	156.1	151.4	-60.9	22.9	0	0	0	120
830	E	31.4	Very low	27.6	Very low	165 Å²	165	134.6 Å²	134.6	77%	0.771	78%	0.776	S	S	*	*			cis	-155.1	-174.8	2.1	-129.5	154.2	-132.3	0	0	112.2
831	N	25.9	Very low	27.5	Very low	146 Å²	146	135 Å²	135	78%	0.781	77%	0.772	S	S	*	*			trans	-90.5	161.4	-165.6	-49.6	-67.3	0	0	0	115.6
832	E	30.5	Very low	27.5	Very low	162 Å²	162	136.1 Å²	136.1	76%	0.757	77%	0.766	S	S	*	*				168.2	136	107.2	-83.4	-145.7	119	0	0	116.8
833	Q	29.3	Very low	27.7	Very low	154 Å²	154	135.6 Å²	135.6	72%	0.72	76%	0.763	S	S	*	*			trans	46.4	112	140.3	-53.5	-164.2	39.7	0	0	125.3
834	V	25.8	Very low	27.5	Very low	126 Å²	126	135.7 Å²	135.7	76%	0.764	76%	0.763	S	S	*	*				76.9	134	119.9	178.5	0	0	0	0	122.5
835	C	25.8	Very low	27.4	Very low	101 Å²	101	135.5 Å²	135.5	68%	0.682	77%	0.766	S	S	*	*			trans	89.7	102.2	155.8	-89.7	0	0	0	0	122.8
836	N	25.8	Very low	27.1	Very low	139 Å²	139	136.3 Å²	136.3	74%	0.743	77%	0.766	S	S	*	*				63.6	115.9	127.4	-65.2	-3	0	0	0	122.6
837	C	24	Very low	27.1	Very low	109 Å²	109	139.9 Å²	139.9	74%	0.736	77%	0.77	S	S	*	*			trans	57.9	98.7	132.7	-56.7	0	0	0	0	119.3
838	L	25.9	Very low	26.9	Very low	161 Å²	161	143 Å²	143	84%	0.843	78%	0.779	S	S	*	*				172.8	129.7	105.1	-91.2	151	0	0	0	111.3
839	V	26	Very low	26.7	Very low	137 Å²	137	146 Å²	146	83%	0.83	78%	0.78	S	S	*	*			trans	23.9	103.6	148.4	-174	0	0	0	0	118.2
840	A	29.8	Very low	26.4	Very low	98 Å²	98	145 Å²	145	81%	0.81	78%	0.781	S	S	*	*				170	109.4	127.6	0	0	0	0	0	112.2
841	E	26.4	Very low	26.1	Very low	187 Å²	187	148.7 Å²	148.7	87%	0.874	79%	0.79	S	S	*	*			trans	-76.9	166.1	161	-98.5	-172.7	-162.7	0	0	110.4
842	P	30.4	Very low	26.1	Very low	99 Å²	99	150 Å²	150	64%	0.643	79%	0.791	S	S	*	*			cis	-151	-176.8	37.8	38.8	-15.4	0	0	0	119.3
843	N	28.1	Very low	25.8	Very low	143 Å²	143	149.9 Å²	149.9	77%	0.765	80%	0.796	S	S	*	*			trans	86.4	78.3	154.8	-61.2	-32.5	0	0	0	120.9
844	K	26.7	Very low	25.5	Very low	207 Å²	207	148.6 Å²	148.6	90%	0.9	79%	0.794	S	S	*	*				178.2	156.5	118.4	-97.3	165.2	-176.7	176.5	0	112.2
845	C	22.6	Very low	25.5	Very low	120 Å²	120	148.2 Å²	148.2	81%	0.811	80%	0.796	S	S	*	*			trans	76	114.9	175.1	-75.2	0	0	0	0	120.3
846	S	22.9	Very low	25.4	Very low	108 Å²	108	149.9 Å²	149.9	76%	0.755	80%	0.797	S	S	*	*			trans	49.7	130	140.1	62	0	0	0	0	122.2
847	R	24.1	Very low	25.4	Very low	245 Å²	245	149 Å²	149	93%	0.925	80%	0.799	S	S	*	*			trans	80.7	154.3	177.3	-70.3	179	158.9	169.8	-5.7	115.7
848	L	25.3	Very low	25.4	Very low	169 Å²	169	152.2 Å²	152.2	89%	0.885	80%	0.801	S	S	*	*			trans	64.7	101.5	176.2	-65.8	158	0	0	0	116
849	K	23.6	Very low	25.4	Very low	157 Å²	157	146.7 Å²	146.7	68%	0.683	78%	0.783	S	S	*	*			trans	-70.9	126.2	164.3	-73.5	179.7	176	177.2	0	109
850	P	24.9	Very low	25.4	Very low	112 Å²	112	145.8 Å²	145.8	73%	0.727	77%	0.768	S	S	*	*			trans	-69.5	142	171.9	-16.5	30.9	0	0	0	111.5	Q852	P850-Q852 PolarHBondContact O-N 3.26Å
851	Y	23.4	Very low	25.3	Very low	242 Å²	242	144 Å²	144	95%	0.949	74%	0.743	S	S	*	*			trans	-73.4	101.9	169.3	-117.5	-103.6	0	0	0	108.8
852	Q	25.7	Very low	25.2	Very low	175 Å²	175	143 Å²	143	82%	0.818	73%	0.731	S	S	*	*			trans	-111.3	99.8	170.8	-89.2	-174.2	-31.9	0	0	111	P850 D854	P850-Q852 PolarHBondContact O-N 3.26Å; Q852-D854 PolarHBondContact O-N 3.42Å
853	N	24.3	Very low	25	Very low	158 Å²	158	144.9 Å²	144.9	85%	0.845	73%	0.731	S	S	*	*			trans	37.7	68.2	145.7	-62.4	-9	0	0	0	118.1
854	D	24.6	Very low	25	Very low	128 Å²	128	145.2 Å²	145.2	68%	0.684	73%	0.732	S	S	*	*			trans	-84.1	133.2	142.9	-86.1	-43.1	0	0	0	108.3	K777 Q852 I856	K777-D854 IonicContact NZ-OD2 2.79Å; Q852-D854 PolarHBondContact O-N 3.42Å; D854-I856 PolarHBondContact O-N 2.63Å; D854-I856 VanDerWaalsContact O-N 3.15Å
855	S	24.3	Very low	24.9	Very low	117 Å²	117	140.6 Å²	140.6	82%	0.818	73%	0.726	S	S	*	*			trans	-66.9	109.3	-169	54.8	0	0	0	0	113.1	P857	S855-P857 WeakPolarHBondContact O-CD 3.35Å
856	I	25.3	Very low	25	Very low	137 Å²	137	143.8 Å²	143.8	70%	0.703	73%	0.731	S	S	*	*			trans	-70.4	122.5	175.4	-58	170.8	0	0	0	109.7	D854 F858	D854-I856 PolarHBondContact O-N 2.63Å; D854-I856 VanDerWaalsContact O-N 3.15Å; I856-F858 PolarHBondContact O-N 2.83Å; I856-F858 VanDerWaalsContact O-N 3.15Å
857	P	24.5	Very low	25.1	Very low	119 Å²	119	143.9 Å²	143.9	77%	0.773	73%	0.729	S	S	*	*			trans	-69.8	110.6	167	28.4	-31.2	0	0	0	109.1	S855 G859	S855-P857 WeakPolarHBondContact O-CD 3.35Å; P857-G859 PolarHBondContact O-N 3.01Å
858	F	25.3	Very low	25.2	Very low	177 Å²	177	138.3 Å²	138.3	78%	0.776	72%	0.722	S	S	*	*			trans	-58.5	108.5	-177.8	-90.6	-107.2	0	0	0	112.1	I856	I856-F858 PolarHBondContact O-N 2.83Å; I856-F858 VanDerWaalsContact O-N 3.15Å
859	G	24.4	Very low	25.3	Very low	46 Å²	46	137.6 Å²	137.6	47%	0.474	72%	0.719	S	S	.	*			trans	-100.1	21.2	174.3	0	0	0	0	0	114.6	Y700 P857 Q861	Y700-G859 WeakPolarHBondContact CE1-O 3.43Å; Y700-G859 PolarHBondContact OH-O 3.3Å; P857-G859 PolarHBondContact O-N 3.01Å; G859-Q861 PolarHBondContact O-N 3.46Å; G859-Q861 VanDerWaalsContact O-N 3.15Å
860	K	26.8	Very low	25.4	Very low	118 Å²	118	137.6 Å²	137.6	51%	0.513	73%	0.726	S	S	.	*			trans	-75.5	105.9	-168.5	-89.2	-173.7	174.7	179.9	0	114.2	Y700	Y700-K860 HydrophobicContact CE1-CG 4.23Å
861	Q	27.7	Very low	25.6	Very low	59 Å²	59	142.5 Å²	142.5	28%	0.276	74%	0.736	S	S	.	*				86.1	115.4	114.5	-157.9	168	-5	0	0	117.2	G699 Y700 S701 A702 G859 H863	G699-Q861 PolarHBondContact O-OE1 3.23Å; Y700-Q861 HydrophobicContact CD1-CB 3.75Å; Y700-Q861 HydrophobicContact CD1-CG 3.85Å; Y700-Q861 HydrophobicContact CE1-CB 3.91Å; Y700-Q861 HydrophobicContact CE1-CG 4.5Å; S701-Q861 PolarHBondContact O-NE2 3.17Å; A702-Q861 HydrophobicContact CB-CG 4.29Å; G859-Q861 PolarHBondContact O-N 3.46Å; G859-Q861 VanDerWaalsContact O-N 3.15Å; Q861-H863 PolarHBondContact O-N 3.44Å
862	R	24.8	Very low	25.8	Very low	168 Å²	168	135.6 Å²	135.6	63%	0.634	72%	0.723	S	S	*	*	S	Bend	trans	-67.3	125.7	168.3	-72.4	176.8	174.6	150.8	-1.5	109.4
863	H	26.2	Very low	26.1	Very low	138 Å²	138	133.4 Å²	133.4	64%	0.639	72%	0.722	S	S	*	*			trans	163.3	94.5	145	-98.2	-90.6	0	0	0	105.4	A702 Q861	A702-H863 HydrophobicContact CB-CB 3.45Å; A702-H863 VanDerWaalsContact CB-CB 3.45Å; Q861-H863 PolarHBondContact O-N 3.44Å
864	L	28	Very low	26.3	Very low	150 Å²	150	133.5 Å²	133.5	79%	0.785	72%	0.723	S	S	*	*			trans	-133.9	81.8	177.7	-85.9	166.1	0	0	0	109.9
865	S	24.9	Very low	26.4	Very low	110 Å²	110	134.7 Å²	134.7	77%	0.769	73%	0.729	S	S	*	*				-53.6	137.1	125.7	36.2	0	0	0	0	107.8	P867	S865-P867 VanDerWaalsContact O-CD 3.27Å; S865-P867 WeakPolarHBondContact O-CD 3.47Å
866	M	24.8	Very low	26.4	Very low	187 Å²	187	133.9 Å²	133.9	92%	0.921	72%	0.723	S	S	*	*			trans	-70.6	135.1	177.1	-70.7	-177.2	170.2	0	0	110.9
867	P	25.2	Very low	26.6	Very low	109 Å²	109	135.6 Å²	135.6	71%	0.708	73%	0.726	S	S	*	*			trans	-116.7	116.3	148.8	32	-17.3	0	0	0	109.5	S865	S865-P867 VanDerWaalsContact O-CD 3.27Å; S865-P867 WeakPolarHBondContact O-CD 3.47Å
868	T	26.2	Very low	26.8	Very low	128 Å²	128	138.9 Å²	138.9	79%	0.785	72%	0.724	S	S	*	*			trans	-72.5	129	166.1	1	0	0	0	0	109.3
869	N	26.7	Very low	26.9	Very low	154 Å²	154	138.3 Å²	138.3	82%	0.824	72%	0.724	S	S	*	*			trans	136.2	110.8	151.8	-69.6	-15.1	0	0	0	111.8
870	L	26.1	Very low	27	Very low	157 Å²	157	140.5 Å²	140.5	82%	0.822	73%	0.729	S	S	*	*			trans	-150.3	91.4	163.1	-132.6	148.4	0	0	0	109
871	F	29.1	Very low	27	Very low	215 Å²	215	141.4 Å²	141.4	94%	0.943	74%	0.74	S	S	*	*			trans	-118.1	119.6	152.2	-102.3	-80.1	0	0	0	105.5
872	S	27.6	Very low	26.9	Very low	97 Å²	97	143.9 Å²	143.9	68%	0.678	76%	0.764	S	S	*	*			trans	-120.2	125.4	171.9	54.4	0	0	0	0	108
873	T	31.5	Very low	27	Very low	129 Å²	129	140.7 Å²	140.7	79%	0.791	77%	0.767	S	S	*	*			trans	-126.6	144.5	164.2	47.4	0	0	0	0	107.4
874	D	29.3	Very low	27	Very low	161 Å²	161	142.6 Å²	142.6	86%	0.861	78%	0.777	S	S	*	*			trans	-68.9	161.5	-148.7	-54.4	-79.2	0	0	0	116.9
875	D	25	Very low	26.9	Very low	153 Å²	153	142.5 Å²	142.5	82%	0.818	78%	0.776	S	S	*	*			trans	-54.8	148	172.2	-67	-60.5	0	0	0	112.8
876	S	26	Very low	27.1	Very low	100 Å²	100	146.4 Å²	146.4	70%	0.699	78%	0.779	S	S	*	*				166	160.8	99.4	53.5	0	0	0	0	115.1
877	F	28.6	Very low	27	Very low	172 Å²	172	146.9 Å²	146.9	75%	0.754	78%	0.779	S	S	*	*			trans	86.7	97.9	164.9	-72.2	-92	0	0	0	122.4
878	Y	27.8	Very low	27	Very low	189 Å²	189	146.6 Å²	146.6	74%	0.741	78%	0.78	S	S	*	*				77.4	107.8	127	-86.3	-118.8	0	0	0	123.3
879	H	27.8	Very low	26.9	Very low	164 Å²	164	148.7 Å²	148.7	76%	0.759	79%	0.786	S	S	*	*				67.1	158.2	121.9	-91.3	-73.9	0	0	0	120.7
880	P	27.4	Very low	27	Very low	92 Å²	92	147.6 Å²	147.6	60%	0.597	79%	0.785	S	S	*	*				-138.1	-161.5	-127.6	35.8	-10.1	0	0	0	113.9
881	N	25.5	Very low	26.9	Very low	138 Å²	138	149.7 Å²	149.7	74%	0.738	79%	0.787	S	S	*	*			trans	114.2	133.3	156.3	-64.3	-22.6	0	0	0	115.7
882	S	25.4	Very low	26.8	Very low	111 Å²	111	144.9 Å²	144.9	78%	0.776	78%	0.78	S	S	*	*			trans	54.7	134.6	150.1	53.6	0	0	0	0	118.7
883	S	28	Very low	26.7	Very low	100 Å²	100	146.3 Å²	146.3	70%	0.699	79%	0.785	S	S	*	*			cis	-173.8	149.4	6.5	38.6	0	0	0	0	109.5
884	Q	25.7	Very low	26.3	Very low	179 Å²	179	145.7 Å²	145.7	84%	0.836	78%	0.783	S	S	*	*			trans	35.8	120	152.9	-56.9	-170.8	12.6	0	0	119.4
885	L	27.1	Very low	26.2	Very low	147 Å²	147	146.5 Å²	146.5	77%	0.77	79%	0.786	S	S	*	*				-178.3	127.7	112.5	-98.2	156	0	0	0	113.5
886	K	27.8	Very low	26.3	Very low	192 Å²	192	142.8 Å²	142.8	84%	0.835	78%	0.776	S	S	*	*			trans	61.1	130.9	153.9	-75.6	174.7	177.5	178.9	0	120.7
887	E	23.8	Very low	26.2	Very low	197 Å²	197	146.6 Å²	146.6	92%	0.921	79%	0.788	S	S	*	*			trans	-70.4	132	178.2	-58.4	155.9	128.2	0	0	112.2
888	S	25.3	Very low	26.2	Very low	104 Å²	104	145 Å²	145	73%	0.727	78%	0.782	S	S	*	*			trans	-155.7	113.6	153.5	63.9	0	0	0	0	111.5	V890	S888-V890 PolarHBondContact O-N 3.14Å
889	N	23.9	Very low	26.3	Very low	172 Å²	172	139.2 Å²	139.2	92%	0.92	77%	0.77	S	S	*	*			trans	-3.8	100	161.3	-64.6	-40.7	0	0	0	117.7
890	V	28.1	Very low	26.2	Very low	131 Å²	131	134.2 Å²	134.2	79%	0.794	76%	0.762	S	S	*	*			trans	-137.1	102.6	153.8	-175.7	0	0	0	0	109.5	S888 S892	S888-V890 PolarHBondContact O-N 3.14Å; V890-S892 PolarHBondContact O-N 3.46Å
891	K	24.8	Very low	26.2	Very low	201 Å²	201	136.8 Å²	136.8	87%	0.874	78%	0.776	S	S	*	*			trans	-71.7	110.1	162.4	-78.7	180	174.6	178.1	0	108	T893	K891-T893 PolarHBondContact O-N 3.23Å; K891-T893 VanDerWaalsContact O-N 3.17Å
892	S	26.1	Very low	26.3	Very low	113 Å²	113	135.4 Å²	135.4	79%	0.79	77%	0.767	S	S	*	*			trans	-65.2	111.4	170.9	50.2	0	0	0	0	110.2	V890	V890-S892 PolarHBondContact O-N 3.46Å
893	T	25.6	Very low	26.3	Very low	127 Å²	127	138.2 Å²	138.2	78%	0.779	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-69.2	125.6	-175.6	46.5	0	0	0	0	113.3	K891	K891-T893 PolarHBondContact O-N 3.23Å; K891-T893 VanDerWaalsContact O-N 3.17Å
894	P	24.3	Very low	26.3	Very low	117 Å²	117	137.8 Å²	137.8	76%	0.76	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-75.5	141.3	152.7	32	-30.4	0	0	0	109.4	A896	P894-A896 PolarHBondContact O-N 3.43Å
895	I	25.4	Very low	26.1	Very low	178 Å²	178	136.7 Å²	136.7	91%	0.913	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-62.8	120.8	-174.1	-66.7	166.2	0	0	0	110.4
896	A	27.2	Very low	26.1	Very low	75 Å²	75	138.8 Å²	138.8	62%	0.62	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-88	119.8	-175.9	0	0	0	0	0	112.6	P894 H898	P894-A896 PolarHBondContact O-N 3.43Å; A896-H898 PolarHBondContact O-N 3.43Å
897	L	25	Very low	26	Very low	180 Å²	180	137 Å²	137	94%	0.942	76%	0.761	S	S	*	*			trans	-83	84.6	146.1	-91.9	155.8	0	0	0	107.9
898	H	27.8	Very low	26	Very low	137 Å²	137	131.3 Å²	131.3	63%	0.634	74%	0.744	S	S	*	*			trans	-69.2	145.8	159	-114.5	-109.1	0	0	0	107.7	A896	A896-H898 PolarHBondContact O-N 3.43Å
899	S	29.7	Very low	25.9	Very low	69 Å²	69	133.3 Å²	133.3	48%	0.483	75%	0.746	S	S	.	*			cis	-151.1	165.4	27.1	49.7	0	0	0	0	110.6
900	G	26.7	Very low	26	Very low	58 Å²	58	132.9 Å²	132.9	60%	0.598	74%	0.739	S	S	*	*			cis	164.5	118.7	-4.5	0	0	0	0	0	110.7
901	V	27.3	Very low	25.8	Very low	146 Å²	146	137.3 Å²	137.3	89%	0.885	74%	0.741	S	S	*	*			trans	-137.3	113.9	160.6	176.3	0	0	0	0	106.1
902	M	26.5	Very low	25.7	Very low	110 Å²	110	136.6 Å²	136.6	54%	0.542	74%	0.738	S	S	.	*			trans	-101	136.8	-178.6	-74.3	-92.2	-113	0	0	109.7	L386 T904	L386-M902 HydrophobicContact CD1-CB 3.64Å; L386-M902 HydrophobicContact CD2-CB 3.65Å; L386-M902 HydrophobicContact CD2-CE 4Å; L386-M902 HydrophobicContact CD2-CG 3.97Å; L386-M902 HydrophobicContact CG-CB 4.29Å; M902-T904 HydrophobicContact CE-CG2 4.44Å; M902-T904 HydrophobicContact SD-CG2 4.3Å
903	I	26.1	Very low	25.7	Very low	170 Å²	170	139.8 Å²	139.8	87%	0.872	74%	0.741	S	S	*	*			trans	-121.6	116.5	157.2	-61.5	176.7	0	0	0	104.8
904	T	27.3	Very low	25.8	Very low	90 Å²	90	140.1 Å²	140.1	55%	0.552	74%	0.742	S	S	*	*			trans	-123.7	140	179.6	48.1	0	0	0	0	110.1	L386 M902	L386-T904 HydrophobicContact CD2-CG2 4.46Å; M902-T904 HydrophobicContact CE-CG2 4.44Å; M902-T904 HydrophobicContact SD-CG2 4.3Å
905	D	23.2	Very low	25.8	Very low	156 Å²	156	142.8 Å²	142.8	83%	0.834	74%	0.744	S	S	*	*			trans	-61.9	150.2	-172.7	-54.5	-76.4	0	0	0	114.6
906	F	25.9	Very low	25.8	Very low	192 Å²	192	141.7 Å²	141.7	84%	0.842	74%	0.74	S	S	*	*			trans	-148.6	126.2	155.2	-121.3	-88.2	0	0	0	112.1
907	H	26.5	Very low	25.8	Very low	153 Å²	153	146.8 Å²	146.8	71%	0.708	75%	0.752	S	S	*	*			trans	37	107.5	156.4	-85.7	-95.9	0	0	0	119.7
908	S	23.8	Very low	25.8	Very low	79 Å²	79	147.9 Å²	147.9	55%	0.552	75%	0.749	S	S	*	*				83	126.4	77.1	83	0	0	0	0	115.9
909	N	23.7	Very low	25.6	Very low	145 Å²	145	148.3 Å²	148.3	78%	0.775	76%	0.755	S	S	*	*			trans	87.9	130.9	157.5	-55.8	-25.5	0	0	0	119.1
910	Q	24.9	Very low	25.5	Very low	164 Å²	164	154.6 Å²	154.6	77%	0.766	77%	0.774	S	S	*	*			trans	69.2	131	175.5	-35.6	-177.6	-10.5	0	0	114.3
911	W	24.8	Very low	25.3	Very low	223 Å²	223	162.1 Å²	162.1	85%	0.845	78%	0.784	S	S	*	*			cis	-134.8	155.7	20	-82.1	73.7	0	0	0	113.1
912	K	22.3	Very low	25.1	Very low	186 Å²	186	163.6 Å²	163.6	81%	0.809	78%	0.779	S	S	*	*			trans	-86	174.9	165.4	-77.6	-179.4	171.7	-179.6	0	110.2
913	E	24.9	Very low	25	Very low	180 Å²	180	165.2 Å²	165.2	84%	0.841	79%	0.79	S	S	*	*			trans	78.6	132.3	172	-51.1	176.8	158.3	0	0	113
914	V	28	Very low	24.9	Very low	134 Å²	134	163.4 Å²	163.4	81%	0.812	79%	0.791	S	S	*	*			cis	-136.1	129.1	16.2	173.4	0	0	0	0	110.9
915	E	24.6	Very low	24.7	Very low	173 Å²	173	166.6 Å²	166.6	81%	0.808	80%	0.799	S	S	*	*			trans	-88.4	149.6	154.4	-88.2	-171.2	123.9	0	0	110.2
916	N	25.3	Very low	24.8	Very low	155 Å²	155	169.3 Å²	169.3	83%	0.829	80%	0.804	S	S	*	*			trans	116.8	101.6	163.3	-65.2	-53.1	0	0	0	115.4
917	E	28.4	Very low	24.6	Very low	183 Å²	183	166 Å²	166	86%	0.855	80%	0.795	S	S	*	*				-160.6	98.4	120	-115.8	-177.2	-175.9	0	0	112.3
918	K	24	Very low	24.5	Very low	203 Å²	203	165.2 Å²	165.2	88%	0.883	81%	0.805	S	S	*	*			trans	-110.8	84.1	154.4	-86.7	-177.7	177.7	169	0	108
919	L	24.3	Very low	24.5	Very low	145 Å²	145	165.8 Å²	165.8	76%	0.759	81%	0.809	S	S	*	*			trans	-170.1	117.5	155.6	-131.9	75.2	0	0	0	110
920	F	26.4	Very low	24.5	Very low	201 Å²	201	165.3 Å²	165.3	88%	0.882	80%	0.804	S	S	*	*				-173.6	122.8	122.4	-115.6	-83.1	0	0	0	110.5
921	R	23.2	Very low	24.5	Very low	216 Å²	216	166.5 Å²	166.5	82%	0.815	81%	0.806	S	S	*	*			trans	-93.6	155.7	169.6	-76.6	-175.7	178.2	-169	-0.2	109.6
922	K	22.8	Very low	24.4	Very low	178 Å²	178	159.1 Å²	159.1	77%	0.774	80%	0.8	S	S	*	*			trans	75.1	148.8	144	-87.8	-176.6	174.4	-170.6	0	119.4
923	N	23.8	Very low	24.4	Very low	144 Å²	144	159.2 Å²	159.2	77%	0.77	80%	0.8	S	S	*	*			trans	76.8	102.6	161.4	-57.7	-6.9	0	0	0	117.8
924	C	25.4	Very low	24.3	Very low	132 Å²	132	158.3 Å²	158.3	89%	0.892	80%	0.796	S	S	*	*				-162.5	120.2	107.4	-100.3	0	0	0	0	111.2
925	H	22.8	Very low	24.1	Very low	156 Å²	156	157.4 Å²	157.4	72%	0.722	79%	0.791	S	S	*	*			trans	-72.6	152.4	162.9	-114.9	-109.9	0	0	0	109.1	D927	H925-D927 IonicContact CE1-OD2 2.77Å; H925-D927 IonicContact ND1-OD2 2.67Å; H925-D927 PolarHBondContact ND1-OD2 3.49Å
926	F	25.9	Very low	24	Very low	214 Å²	214	157.1 Å²	157.1	94%	0.939	79%	0.793	S	S	*	*			trans	-159.8	126.1	132.1	-121.8	-77.6	0	0	0	111.2
927	D	21.8	Very low	23.9	Very low	123 Å²	123	155.2 Å²	155.2	66%	0.658	79%	0.787	S	S	*	*			trans	-78.6	153.8	175.4	-70.3	-84.3	0	0	0	112.1	H925	H925-D927 IonicContact CE1-OD2 2.77Å; H925-D927 IonicContact ND1-OD2 2.67Å; H925-D927 PolarHBondContact ND1-OD2 3.49Å
928	C	24.1	Very low	23.7	Very low	136 Å²	136	152 Å²	152	92%	0.919	79%	0.785	S	S	*	*				-159.2	153.7	118.5	-147.2	0	0	0	0	112.9
929	S	22.6	Very low	23.7	Very low	90 Å²	90	148.4 Å²	148.4	63%	0.629	78%	0.775	S	S	*	*			trans	-109	158.7	-170.6	174.9	0	0	0	0	111.9
930	M	24.2	Very low	23.7	Very low	136 Å²	136	149.8 Å²	149.8	67%	0.67	78%	0.782	S	S	*	*				159.6	135.6	123.6	-85.1	-79.7	160.7	0	0	114
931	K	24.1	Very low	23.5	Very low	188 Å²	188	143.8 Å²	143.8	82%	0.817	76%	0.76	S	S	*	*			trans	51.4	124	146.5	-62.1	159	178.2	159.6	0	118.1
932	G	22.6	Very low	23.6	Very low	69 Å²	69	137.6 Å²	137.6	71%	0.711	75%	0.749	S	S	*	*			cis	102.5	106.3	10.6	0	0	0	0	0	112.9
933	K	22.9	Very low	23.6	Very low	187 Å²	187	133.4 Å²	133.4	81%	0.813	74%	0.743	S	S	*	*			trans	179.5	134.2	142.5	-105.2	175.1	177	-172	0	115.1
934	Q	24	Very low	23.7	Very low	161 Å²	161	132.9 Å²	132.9	75%	0.752	74%	0.74	S	S	*	*			trans	63	95.2	138.8	-71.1	168.5	-44.9	0	0	121.3
935	T	22	Very low	23.8	Very low	115 Å²	115	134.3 Å²	134.3	71%	0.706	73%	0.733	S	S	*	*			trans	-19.1	133.1	131.7	-34.8	0	0	0	0	116.3	T937	T935-T937 HydrophobicContact CG2-CG2 4.08Å
936	I	24.2	Very low	23.8	Very low	168 Å²	168	134.1 Å²	134.1	86%	0.862	74%	0.737	S	S	*	*			trans	-132.8	122.3	138.6	-63.9	-175.1	0	0	0	108.1
937	T	22.5	Very low	23.8	Very low	115 Å²	115	126.6 Å²	126.6	71%	0.706	72%	0.72	S	S	*	*			trans	-91	143.7	170.2	43.9	0	0	0	0	110.4	T935	T935-T937 HydrophobicContact CG2-CG2 4.08Å
938	S	24.4	Very low	23.9	Very low	115 Å²	115	126.9 Å²	126.9	80%	0.804	73%	0.727	S	S	*	*			trans	-153.6	106.1	152.5	58.8	0	0	0	0	110.3
939	N	23.1	Very low	24	Very low	128 Å²	128	126 Å²	126	68%	0.684	72%	0.716	S	S	*	*			trans	-70.3	166.5	165.4	-67.6	-12	0	0	0	110.7	D941	N939-D941 HydrophobicContact CB-CB 4.48Å
940	L	24.8	Very low	24.2	Very low	173 Å²	173	129 Å²	129	91%	0.906	73%	0.726	S	S	*	*			trans	156.9	88.4	153.7	-89.7	156.8	0	0	0	105.4
941	D	23.1	Very low	24.2	Very low	75 Å²	75	125.7 Å²	125.7	40%	0.401	73%	0.727	S	S	.	*			cis	74	127.2	27.6	-143.7	-6.3	0	0	0	115.3	N939	N939-D941 HydrophobicContact CB-CB 4.48Å
942	S	24.4	Very low	24.2	Very low	86 Å²	86	126.2 Å²	126.2	60%	0.601	73%	0.729	S	S	*	*			trans	61.4	164.9	176.9	92.1	0	0	0	0	115.3
943	S	23.9	Very low	24.3	Very low	91 Å²	91	134.2 Å²	134.2	64%	0.636	74%	0.738	S	S	*	*			cis	-170	164.9	-2.9	29.5	0	0	0	0	105.2
944	N	24.4	Very low	24.4	Very low	132 Å²	132	131.6 Å²	131.6	71%	0.706	74%	0.737	S	S	*	*			cis	-178.2	-172.7	-10.3	-95.4	-20	0	0	0	104.9
945	H	27.1	Very low	24.5	Very low	163 Å²	163	130.6 Å²	130.6	76%	0.755	74%	0.735	S	S	*	*			trans	83	133.1	162.8	-53.3	-65.8	0	0	0	117.4
946	D	24.3	Very low	24.5	Very low	151 Å²	151	127.2 Å²	127.2	81%	0.807	72%	0.715	S	S	*	*			cis	-168.1	168.9	-25.8	-119	-32.4	0	0	0	107.9
947	G	25.8	Very low	24.6	Very low	56 Å²	56	126.1 Å²	126.1	58%	0.577	71%	0.709	S	S	*	*			trans	108.9	64.6	154	0	0	0	0	0	119.4
948	T	24.2	Very low	24.8	Very low	130 Å²	130	125 Å²	125	80%	0.798	70%	0.699	S	S	*	*				48.6	121	123.5	54.8	0	0	0	0	122.7
949	V	25.8	Very low	24.7	Very low	116 Å²	116	125.2 Å²	125.2	70%	0.703	70%	0.698	S	S	*	*				102.6	125.6	121.1	166.3	0	0	0	0	120.4
950	N	26.4	Very low	24.9	Very low	154 Å²	154	125 Å²	125	82%	0.824	69%	0.691	S	S	*	*			trans	65.5	127.1	168.3	-60.6	-12.8	0	0	0	118.4
951	G	25.1	Very low	24.8	Very low	67 Å²	67	125.1 Å²	125.1	69%	0.691	69%	0.688	S	S	*	*			cis	148.5	122.4	-7.3	0	0	0	0	0	113.5
952	K	23.8	Very low	24.9	Very low	198 Å²	198	131.5 Å²	131.5	86%	0.861	71%	0.712	S	S	*	*			trans	-174.7	122.6	158.5	-103.1	153.4	-171.9	176.8	0	109.5
953	R	24.9	Very low	24.9	Very low	238 Å²	238	131.4 Å²	131.4	90%	0.898	72%	0.716	S	S	*	*			trans	-111.4	112.7	174.9	-78.6	-172.2	-153.2	174	8.8	111.1
954	V	23.6	Very low	25.1	Very low	131 Å²	131	132 Å²	132	79%	0.794	72%	0.72	S	S	*	*			trans	-89	122.2	163.1	-180	0	0	0	0	107.6
955	I	26.1	Very low	25.3	Very low	140 Å²	140	131.9 Å²	131.9	72%	0.718	72%	0.724	S	S	*	*			trans	-103.6	114	176	-60.5	178.5	0	0	0	108.2	I957	I955-I957 PolarHBondContact O-N 2.76Å
956	P	23.6	Very low	25.2	Very low	44 Å²	44	129.6 Å²	129.6	29%	0.286	72%	0.724	S	S	.	*			trans	-81.7	119.6	176.9	31.1	-31.4	0	0	0	110.4	I958 R1093	P956-I958 PolarHBondContact O-N 3.12Å; P956-R1093 VanDerWaalsContact CB-NH2 3.32Å
957	I	25.9	Very low	25.4	Very low	145 Å²	145	126.4 Å²	126.4	74%	0.744	71%	0.714	S	S	*	*			trans	-70.1	121	169.5	-64	174.1	0	0	0	107.9	I955	I955-I957 PolarHBondContact O-N 2.76Å
958	I	26	Very low	25.3	Very low	93 Å²	93	130.4 Å²	130.4	48%	0.477	72%	0.72	S	S	.	*			trans	-90.3	109.1	-179.9	-58.9	175.7	0	0	0	108.1	P956 F960	P956-I958 PolarHBondContact O-N 3.12Å; I958-F960 HydrophobicContact CG2-CD2 3.53Å; I958-F960 HydrophobicContact CG2-CE2 3.54Å
959	C	22.7	Very low	25.5	Very low	118 Å²	118	127.4 Å²	127.4	80%	0.797	70%	0.704	S	S	*	*			trans	-62.7	132.1	164.5	-63	0	0	0	0	109.3
960	F	26.3	Very low	25.5	Very low	123 Å²	123	128.5 Å²	128.5	54%	0.539	70%	0.702	S	S	.	*			trans	-131.6	120.4	162.3	-99.4	-68.5	0	0	0	110.8	I958	I958-F960 HydrophobicContact CG2-CD2 3.53Å; I958-F960 HydrophobicContact CG2-CE2 3.54Å
961	E	23.1	Very low	25.5	Very low	177 Å²	177	125.6 Å²	125.6	83%	0.827	70%	0.7	S	S	*	*			trans	-68	144.4	177.4	-178.2	-174.7	174.6	0	0	111.8
962	K	25.9	Very low	25.6	Very low	209 Å²	209	128 Å²	128	91%	0.909	70%	0.701	S	S	*	*			trans	-152.2	114.9	152.7	-131.3	174.2	-172.7	178.7	0	111.9
963	A	23.9	Very low	25.7	Very low	84 Å²	84	126.2 Å²	126.2	69%	0.694	70%	0.699	S	S	*	*			trans	-68.3	134.2	179.5	0	0	0	0	0	112.6
964	S	28.2	Very low	25.9	Very low	103 Å²	103	118.5 Å²	118.5	72%	0.72	68%	0.682	S	S	*	*			trans	-174.4	92.9	136.3	22.6	0	0	0	0	112.8
965	T	29.6	Very low	26	Very low	129 Å²	129	121.6 Å²	121.6	79%	0.791	69%	0.687	S	S	*	*			trans	67.6	148.5	152.3	52.7	0	0	0	0	120.5
966	P	25	Very low	26.1	Very low	116 Å²	116	120.5 Å²	120.5	75%	0.753	68%	0.683	S	S	*	*			trans	-105.5	142.3	-154	37.8	-30.1	0	0	0	114.8
967	S	26.6	Very low	26.3	Very low	84 Å²	84	127 Å²	127	59%	0.587	71%	0.71	S	S	*	*			trans	-147.4	148.6	152.5	60.2	0	0	0	0	109.5	S969	S967-S969 PolarHBondContact O-N 3.45Å
968	I	25.6	Very low	26.3	Very low	140 Å²	140	129.8 Å²	129.8	72%	0.718	72%	0.719	S	S	*	*			trans	-75.5	110.4	-163.3	-63.1	162.1	0	0	0	111.2	W238	W238-I968 HydrophobicContact CH2-CG2 4.28Å
969	S	27	Very low	26.3	Very low	66 Å²	66	129.9 Å²	129.9	46%	0.462	72%	0.718	S	S	.	*			trans	-161.5	109.5	152.2	57.9	0	0	0	0	109.9	S967 A971	S967-S969 PolarHBondContact O-N 3.45Å; S969-A971 PolarHBondContact O-N 2.9Å
970	E	25.5	Very low	26.5	Very low	139 Å²	139	135.5 Å²	135.5	65%	0.65	72%	0.724	S	S	*	*			trans	-60.2	119.5	172.6	-69.4	172.3	127.3	0	0	109.7	T972	E970-T972 VanDerWaalsContact C-N 3.33Å; E970-T972 PolarHBondContact O-N 2.73Å
971	A	27.3	Very low	26.5	Very low	94 Å²	94	138.7 Å²	138.7	78%	0.777	74%	0.741	S	S	*	*			trans	-71.3	94.2	167.9	0	0	0	0	0	108.3	S969 I973	S969-A971 PolarHBondContact O-N 2.9Å; A971-I973 VanDerWaalsContact C-N 3.27Å; A971-I973 PolarHBondContact O-N 3.1Å
972	T	26.5	Very low	26.7	Very low	118 Å²	118	132 Å²	132	72%	0.724	72%	0.716	S	S	*	*			trans	-62.8	90.8	167.3	36.6	0	0	0	0	109.3	E970 S974	E970-T972 VanDerWaalsContact C-N 3.33Å; E970-T972 PolarHBondContact O-N 2.73Å; T972-S974 PolarHBondContact O-N 2.79Å
973	I	26.2	Very low	26.7	Very low	159 Å²	159	127.3 Å²	127.3	82%	0.815	71%	0.705	S	S	*	*			trans	-62.9	109.6	152.2	-63.9	173.7	0	0	0	104.7	A971	A971-I973 VanDerWaalsContact C-N 3.27Å; A971-I973 PolarHBondContact O-N 3.1Å
974	S	28.5	Very low	26.9	Very low	76 Å²	76	134 Å²	134	53%	0.531	71%	0.713	S	S	.	*			trans	-68.4	141.2	170	53	0	0	0	0	109.3	T972 D976	T972-S974 PolarHBondContact O-N 2.79Å; S974-D976 VanDerWaalsContact C-N 3.29Å; S974-D976 WeakPolarHBondContact CB-OD2 3.4Å; S974-D976 PolarHBondContact O-N 3.42Å; S974-D976 PolarHBondContact OG-OD2 3.39Å
975	E	25.6	Very low	26.8	Very low	196 Å²	196	137.1 Å²	137.1	92%	0.916	72%	0.717	S	S	*	*			trans	-70.7	85.3	173.8	-64.7	162	130.8	0	0	109
976	D	28.5	Very low	26.7	Very low	118 Å²	118	139 Å²	139	63%	0.631	72%	0.716	S	S	*	*			trans	-122.7	31.3	177.5	-76.2	-60.9	0	0	0	111.9	S974	S974-D976 VanDerWaalsContact C-N 3.29Å; S974-D976 WeakPolarHBondContact CB-OD2 3.4Å; S974-D976 PolarHBondContact O-N 3.42Å; S974-D976 PolarHBondContact OG-OD2 3.39Å
977	E	27.9	Very low	26.8	Very low	180 Å²	180	140.5 Å²	140.5	84%	0.841	72%	0.724	S	S	*	*	S	Bend	trans	-141.8	46	172.6	-83.3	-156.6	148.2	0	0	114
978	Q	26.4	Very low	26.8	Very low	203 Å²	203	141.7 Å²	141.7	95%	0.949	73%	0.732	S	S	*	*	S	Bend	trans	-124.1	1.3	165.8	-80.4	-159.3	-6.3	0	0	116.3
979	E	26	Very low	27	Very low	95 Å²	95	144.4 Å²	144.4	44%	0.444	74%	0.741	S	S	.	*	S	Bend	trans	-135.2	60.7	-177.2	-157.1	174	-159.1	0	0	114.7	D183 G184	D183-E979 VanDerWaalsContact O-OE2 3.05Å; G184-E979 PolarHBondContact N-OE2 3.2Å
980	Y	27.8	Very low	27.1	Very low	237 Å²	237	147.1 Å²	147.1	93%	0.929	76%	0.757	S	S	*	*	S	Bend	trans	-152	46.1	161.8	-114.1	-72.9	0	0	0	113.7
981	Q	26.5	Very low	27.2	Very low	189 Å²	189	145.8 Å²	145.8	88%	0.883	76%	0.763	S	S	*	*	S	Bend	trans	-140.6	33.8	177.7	-134.2	163.2	29.4	0	0	114.9
982	A	26.3	Very low	27.3	Very low	38 Å²	38	146.6 Å²	146.6	31%	0.314	76%	0.763	S	S	.	*			trans	-142.9	49.9	-178.2	0	0	0	0	0	114.3	R46	R46-A982 PolarHBondContact NH1-O 3.46Å; R46-A982 PolarHBondContact NH2-O 3.35Å
983	V	26.9	Very low	27.3	Very low	110 Å²	110	146.4 Å²	146.4	67%	0.667	77%	0.767	S	S	*	*	S	Bend	trans	-147.1	143.5	156.7	-163.2	0	0	0	0	109
984	Y	26.7	Very low	27.6	Very low	223 Å²	223	143.6 Å²	143.6	88%	0.875	76%	0.759	S	S	*	*	S	Bend	trans	76.4	65.7	-180	-67	-79	0	0	0	118.2
985	E	26.8	Very low	27.6	Very low	169 Å²	169	148.3 Å²	148.3	79%	0.79	77%	0.77	S	S	*	*				-152.3	158.4	127.9	-116.7	172.1	-175.6	0	0	109.8
986	H	28.2	Very low	27.7	Very low	168 Å²	168	144.8 Å²	144.8	78%	0.778	76%	0.756	S	S	*	*			trans	76.4	72.1	-179.5	-52.4	-62.4	0	0	0	119.6
987	T	25.4	Very low	27.7	Very low	149 Å²	149	145.2 Å²	145.2	91%	0.914	76%	0.759	S	S	*	*			trans	-120.1	83.7	140.5	45.9	0	0	0	0	110.5
988	S	27.8	Very low	27.7	Very low	109 Å²	109	145 Å²	145	76%	0.762	76%	0.755	S	S	*	*			trans	-162.3	76.4	164.6	61.9	0	0	0	0	110.1
989	Q	29	Very low	27.8	Very low	197 Å²	197	141.5 Å²	141.5	92%	0.921	75%	0.748	S	S	*	*			trans	-86.7	152.7	164.5	-90.6	-168.2	-19.3	0	0	110.7
990	P	30.1	Very low	28.1	Very low	122 Å²	122	142.4 Å²	142.4	79%	0.792	76%	0.762	S	S	*	*			trans	-99.1	147	-168.1	37.2	-33.4	0	0	0	113.6
991	S	27.6	Very low	28	Very low	111 Å²	111	135.1 Å²	135.1	78%	0.776	75%	0.751	S	S	*	*			trans	-164.1	127.9	155.3	48.8	0	0	0	0	112.2
992	S	28.4	Very low	28.2	Very low	111 Å²	111	137.5 Å²	137.5	78%	0.776	75%	0.753	S	S	*	*			trans	19.4	140	139.9	53.9	0	0	0	0	120.2
993	S	27.8	Very low	28.2	Very low	114 Å²	114	140.6 Å²	140.6	80%	0.797	77%	0.772	S	S	*	*			cis	-168.8	-163.6	1.6	70.6	0	0	0	0	108.7
994	P	32.2	Very low	28.4	Very low	101 Å²	101	140.6 Å²	140.6	66%	0.656	78%	0.777	S	S	*	*			trans	-103.5	175.8	-149.2	34.3	-17.5	0	0	0	115.5
995	F	28	Very low	28.4	Very low	175 Å²	175	135 Å²	135	77%	0.768	77%	0.771	S	S	*	*				170	115.3	122.3	-105.5	-105.6	0	0	0	113.3
996	I	26.9	Very low	28.4	Very low	121 Å²	121	135.4 Å²	135.4	62%	0.621	78%	0.775	S	S	*	*				52.7	112.5	125.7	-57.3	-169.2	0	0	0	121.6
997	N	29.2	Very low	28.4	Very low	127 Å²	127	133.5 Å²	133.5	68%	0.679	77%	0.77	S	S	*	*				-177.8	121.7	109.6	-96.3	-48.9	0	0	0	110
998	K	28.1	Very low	28.3	Very low	177 Å²	177	135.5 Å²	135.5	77%	0.77	77%	0.766	S	S	*	*				65.2	133.7	97.7	-69.4	-168.8	-173	175	0	114.3
999	T	27.9	Very low	28.3	Very low	129 Å²	129	136.2 Å²	136.2	79%	0.791	77%	0.771	S	S	*	*			cis	-162.7	178.7	6.5	9.4	0	0	0	0	109.6
1000	P	32.4	Very low	28.1	Very low	114 Å²	114	136 Å²	136	74%	0.74	77%	0.77	S	S	*	*			trans	-122.4	-178	-144.8	46.7	-38.3	0	0	0	117.9
1001	A	26.7	Very low	28.3	Very low	84 Å²	84	135.5 Å²	135.5	69%	0.694	77%	0.766	S	S	*	*			trans	70.1	130.1	142.5	0	0	0	0	0	121.4
1002	Y	30.9	Very low	28.3	Very low	238 Å²	238	137 Å²	137	93%	0.933	77%	0.771	S	S	*	*			trans	-145	155.7	135.7	-113.3	-82	0	0	0	110.4
1003	S	26.3	Very low	28.2	Very low	103 Å²	103	140.9 Å²	140.9	72%	0.72	78%	0.776	S	S	*	*			trans	-139.6	145.8	-158	56.8	0	0	0	0	114.1
1004	S	29.6	Very low	28.1	Very low	110 Å²	110	139 Å²	139	77%	0.769	78%	0.776	S	S	*	*			trans	178.2	133.1	142.6	48.8	0	0	0	0	109.4
1005	S	26.3	Very low	27.7	Very low	107 Å²	107	142.9 Å²	142.9	75%	0.748	78%	0.782	S	S	*	*			cis	114.8	105.9	11.1	69.4	0	0	0	0	112.4
1006	M	28.2	Very low	27.7	Very low	176 Å²	176	145.6 Å²	145.6	87%	0.867	79%	0.789	S	S	*	*			trans	169.1	146.7	141.9	-93.3	-151.6	163	0	0	109.1
1007	L	27.2	Very low	27.5	Very low	128 Å²	128	145.1 Å²	145.1	67%	0.67	80%	0.795	S	S	*	*			cis	-173	117.2	-29.4	-138	143.2	0	0	0	106.1
1008	K	24.8	Very low	27.3	Very low	192 Å²	192	145.6 Å²	145.6	84%	0.835	80%	0.803	S	S	*	*			trans	30.7	137.6	149.3	-53.2	-179.8	179.7	180	0	122.4
1009	S	26.4	Very low	27.1	Very low	123 Å²	123	145 Å²	145	86%	0.86	80%	0.803	S	S	*	*				-164	152.8	102.1	57	0	0	0	0	112.6
1010	E	25	Very low	26.9	Very low	193 Å²	193	146.9 Å²	146.9	90%	0.902	81%	0.807	S	S	*	*			trans	-113.8	178.1	-168.5	-110.4	-165.3	145.4	0	0	112.4
1011	P	34.1	Very low	26.5	Very low	111 Å²	111	150.7 Å²	150.7	72%	0.721	81%	0.811	S	S	*	*			trans	-96.1	171.5	-149.1	39.5	-40.1	0	0	0	115.9
1012	T	28.1	Very low	26.6	Very low	142 Å²	142	154 Å²	154	87%	0.871	82%	0.816	S	S	*	*			trans	-131.8	135.2	166.4	48.1	0	0	0	0	113.3
1013	H	25.8	Very low	26.3	Very low	193 Å²	193	148.5 Å²	148.5	89%	0.894	81%	0.809	S	S	*	*			trans	-68.8	141.3	173.7	-89.7	-88.4	0	0	0	112.3
1014	G	26.7	Very low	26.3	Very low	76 Å²	76	150.3 Å²	150.3	78%	0.784	80%	0.804	S	S	*	*			trans	-137.1	86.7	168.2	0	0	0	0	0	112.1
1015	K	23.2	Very low	26.2	Very low	181 Å²	181	152.3 Å²	152.3	79%	0.787	80%	0.801	S	S	*	*			trans	-72.7	127.6	172.9	-65.8	171.7	178.5	172.8	0	109.9
1016	Y	27.2	Very low	26.2	Very low	233 Å²	233	151.2 Å²	151.2	91%	0.914	78%	0.783	S	S	*	*			trans	-144	115.2	146.9	-85.9	-69.8	0	0	0	111.8
1017	C	22.5	Very low	26.4	Very low	110 Å²	110	146.7 Å²	146.7	74%	0.743	77%	0.766	S	S	*	*			trans	-94.6	129.4	167.3	-66.4	0	0	0	0	109.4
1018	T	26	Very low	26.7	Very low	138 Å²	138	145.4 Å²	145.4	85%	0.847	77%	0.765	S	S	*	*			trans	-134.4	91.5	156.7	38	0	0	0	0	110.6
1019	H	23.8	Very low	26.9	Very low	165 Å²	165	142.9 Å²	142.9	76%	0.764	76%	0.76	S	S	*	*			trans	-6.2	126	134.5	-67.6	-95.5	0	0	0	116.7
1020	L	24.1	Very low	26.9	Very low	167 Å²	167	147.1 Å²	147.1	87%	0.874	76%	0.758	S	S	*	*				-169.2	96.3	126.5	-122.3	72.5	0	0	0	108.2
1021	K	23.7	Very low	27	Very low	194 Å²	194	143.3 Å²	143.3	84%	0.843	75%	0.748	S	S	*	*				76.9	89.5	77.8	-157.8	174.3	-170.1	179	0	113.6
1022	I	28.7	Very low	26.7	Very low	153 Å²	153	142.2 Å²	142.2	79%	0.785	75%	0.748	S	S	*	*			trans	-77.5	142.2	173.2	-57.4	160.2	0	0	0	110.8
1023	P	25.3	Very low	26.7	Very low	123 Å²	123	147.6 Å²	147.6	80%	0.799	75%	0.753	S	S	*	*			trans	-106.3	141.7	156.2	33.6	-25	0	0	0	112.9
1024	K	25.4	Very low	26.7	Very low	142 Å²	142	150.2 Å²	150.2	62%	0.617	75%	0.754	S	S	*	*			trans	-120.3	130.7	172.7	-70.5	176.3	170.7	-177.8	0	109.5	I1051	K1024-I1051 HydrophobicContact CD-CD1 3.66Å; K1024-I1051 HydrophobicContact CG-CD1 4.13Å
1025	H	28	Very low	27.1	Very low	152 Å²	152	151.4 Å²	151.4	70%	0.704	75%	0.748	S	S	*	*			trans	-167.1	161.4	162.1	-98.2	-95.1	0	0	0	108.6
1026	K	25.6	Very low	27.5	Very low	83 Å²	83	148.8 Å²	148.8	36%	0.361	75%	0.75	S	S	.	*			cis	-168.7	111.8	-42.2	-118.5	-168.3	152.9	-159.8	0	110.2	G1050 I1051 F1052	K1026-G1050 CarbonylContact C-O 3.56Å; K1026-G1050 VanDerWaalsContact C-O 3.26Å; K1026-G1050 WeakPolarHBondContact CA-O 3.25Å; K1026-G1050 PolarHBondContact N-O 3.41Å; K1026-I1051 VanDerWaalsContact CA-O 3.29Å; K1026-I1051 WeakPolarHBondContact CA-O 3.48Å; K1026-I1051 WeakPolarHBondContact CG-O 3.48Å; K1026-F1052 VanDerWaalsContact C-CD2 3.5Å; K1026-F1052 HydrophobicContact CB-CD2 3.33Å; K1026-F1052 HydrophobicContact CB-CE2 3.41Å; K1026-F1052 VanDerWaalsContact CB-CE2 3.41Å; K1026-F1052 HydrophobicContact CB-CG 4.4Å; K1026-F1052 HydrophobicContact CB-CZ 4.47Å; K1026-F1052 HydrophobicContact CD-CD1 4.18Å; K1026-F1052 HydrophobicContact CD-CD2 3.49Å; K1026-F1052 VanDerWaalsContact CD-CD2 3.49Å; K1026-F1052 HydrophobicContact CD-CE1 4.02Å; K1026-F1052 HydrophobicContact CD-CE2 3.38Å; K1026-F1052 HydrophobicContact CD-CG 3.93Å; K1026-F1052 HydrophobicContact CD-CZ 3.64Å; K1026-F1052 VanDerWaalsContact CE-CD1 3.45Å; K1026-F1052 HydrophobicContact CG-CB 4.43Å; K1026-F1052 HydrophobicContact CG-CD2 3.16Å; K1026-F1052 HydrophobicContact CG-CE2 3.49Å; K1026-F1052 VanDerWaalsContact CG-CE2 3.49Å; K1026-F1052 HydrophobicContact CG-CG 3.77Å; K1026-F1052 HydrophobicContact CG-CZ 4.26Å
1027	T	33.3	Very low	27.4	Very low	82 Å²	82	149 Å²	149	50%	0.503	75%	0.749	S	S	.	*			trans	-71.9	152.4	178.5	50.6	0	0	0	0	116.1	G1050 F1052	T1027-G1050 WeakPolarHBondContact CG2-O 3.29Å; T1027-G1050 PolarHBondContact N-O 3.1Å; T1027-F1052 WeakPolarHBondContact O-CD2 3.28Å; T1027-F1052 WeakPolarHBondContact O-CE2 3.19Å; T1027-F1052 WeakPolarHBondContact O-CG 3.47Å
1028	P	32.5	Very low	27.8	Very low	101 Å²	101	149 Å²	149	66%	0.656	75%	0.748	S	S	*	*				-159.5	161.5	101.9	40.6	-21.2	0	0	0	119.6
1029	N	29.6	Very low	27.8	Very low	138 Å²	138	152.7 Å²	152.7	74%	0.738	75%	0.748	S	S	*	*			trans	76.9	125.1	134.7	-80.2	3.1	0	0	0	126.9
1030	W	26	Very low	27.9	Very low	212 Å²	212	153.8 Å²	153.8	80%	0.803	75%	0.751	S	S	*	*			trans	116	109.9	131.6	-84.4	41.3	0	0	0	122.8
1031	T	28	Very low	27.9	Very low	113 Å²	113	151.3 Å²	151.3	69%	0.693	74%	0.742	S	S	*	*			trans	73.6	115.3	135.7	55.2	0	0	0	0	124.4
1032	A	27.4	Very low	27.9	Very low	89 Å²	89	147.8 Å²	147.8	74%	0.736	74%	0.741	S	S	*	*				78	104	130	0	0	0	0	0	122.1
1033	R	27.4	Very low	27.6	Very low	255 Å²	255	145.4 Å²	145.4	96%	0.962	74%	0.738	S	S	*	*				-176	169.3	97.2	-90.8	176.5	-164	-137.7	4.1	111
1034	R	26.6	Very low	27.7	Very low	247 Å²	247	148.4 Å²	148.4	93%	0.932	74%	0.741	S	S	*	*			trans	-98.1	167.9	-162.2	-86.6	-167.1	-169.1	-156.2	6.5	115.2
1035	P	35	Very low	27.7	Very low	101 Å²	101	149.8 Å²	149.8	66%	0.656	75%	0.749	S	S	*	*			trans	-104	-167.9	-159.1	45.9	-39.1	0	0	0	113.5
1036	P	32	Very low	27.5	Very low	126 Å²	126	153.4 Å²	153.4	82%	0.818	76%	0.758	S	S	*	*				-142.7	175.2	74.5	33	-11.3	0	0	0	116.4
1037	W	25.8	Very low	27.6	Very low	237 Å²	237	158.6 Å²	158.6	90%	0.898	78%	0.78	S	S	*	*			trans	-115.3	150.3	-171.9	-85.1	82.1	0	0	0	115
1038	P	30.1	Very low	27.5	Very low	110 Å²	110	159.6 Å²	159.6	71%	0.714	79%	0.789	S	S	*	*			trans	-116.3	171.4	151.5	38	-27.9	0	0	0	113.5
1039	Y	26.5	Very low	27.3	Very low	217 Å²	217	160.1 Å²	160.1	85%	0.851	80%	0.795	S	S	*	*			trans	-70.8	134.6	178.3	-82.7	-104.6	0	0	0	114.2
1040	K	24.3	Very low	27.1	Very low	188 Å²	188	154.7 Å²	154.7	82%	0.817	77%	0.771	S	S	*	*				177.1	137.8	126	-103.6	179.2	-179.3	178.5	0	115.8
1041	T	25.2	Very low	27.3	Very low	115 Å²	115	149 Å²	149	71%	0.706	76%	0.756	S	S	*	*			trans	41.9	117.5	144.8	57.5	0	0	0	0	123.6
1042	C	22.9	Very low	27.2	Very low	119 Å²	119	149 Å²	149	80%	0.804	75%	0.746	S	S	*	*				65.2	138.5	128	-65.5	0	0	0	0	123.5
1043	S	23.6	Very low	27.2	Very low	103 Å²	103	152.3 Å²	152.3	72%	0.72	74%	0.744	S	S	*	*			trans	69.8	107.9	153.5	-57.9	0	0	0	0	118.6
1044	H	27.5	Very low	27.3	Very low	187 Å²	187	145.3 Å²	145.3	87%	0.866	73%	0.73	S	S	*	*				-170.8	157.7	103.6	-108.3	-90.2	0	0	0	112.1
1045	H	24.7	Very low	27.3	Very low	171 Å²	171	136.6 Å²	136.6	79%	0.792	72%	0.717	S	S	*	*			trans	-63.6	140.5	175.6	-78.4	-118.4	0	0	0	112.6
1046	Y	24.6	Very low	26.9	Very low	227 Å²	227	139.9 Å²	139.9	89%	0.89	72%	0.723	S	S	*	*				168.9	139.6	112	-106.2	-96.3	0	0	0	112.2
1047	K	26.9	Very low	26.7	Very low	192 Å²	192	140.6 Å²	140.6	84%	0.835	72%	0.718	S	S	*	*			trans	-95	172	162.1	-119.2	-179.3	-179.6	175.7	0	107.5
1048	P	31.4	Very low	26.5	Very low	104 Å²	104	133.6 Å²	133.6	68%	0.675	71%	0.705	S	S	*	*			cis	-148	174.3	15.5	40.5	-18.6	0	0	0	119.5
1049	S	28.2	Very low	26.2	Very low	112 Å²	112	134.9 Å²	134.9	78%	0.783	71%	0.706	S	S	*	*			trans	50.1	140.9	139.2	63.3	0	0	0	0	125.3
1050	G	26.3	Very low	26.1	Very low	23 Å²	23	133.1 Å²	133.1	24%	0.237	71%	0.706	C	S	.	*			trans	177.2	29.4	161.6	0	0	0	0	0	125.1	K1026 T1027	K1026-G1050 CarbonylContact C-O 3.56Å; K1026-G1050 VanDerWaalsContact C-O 3.26Å; K1026-G1050 WeakPolarHBondContact CA-O 3.25Å; K1026-G1050 PolarHBondContact N-O 3.41Å; T1027-G1050 WeakPolarHBondContact CG2-O 3.29Å; T1027-G1050 PolarHBondContact N-O 3.1Å
1051	I	29	Very low	26.1	Very low	94 Å²	94	128.6 Å²	128.6	48%	0.482	70%	0.697	S	S	.	*			trans	-22.5	135.8	174.6	-59.3	153.3	0	0	0	119.6	K1024 K1026	K1024-I1051 HydrophobicContact CD-CD1 3.66Å; K1024-I1051 HydrophobicContact CG-CD1 4.13Å; K1026-I1051 VanDerWaalsContact CA-O 3.29Å; K1026-I1051 WeakPolarHBondContact CA-O 3.48Å; K1026-I1051 WeakPolarHBondContact CG-O 3.48Å
1052	F	25.3	Very low	26	Very low	112 Å²	112	131.6 Å²	131.6	49%	0.491	70%	0.701	S	S	.	*			trans	-111.7	135.1	151.4	-123.7	-100.3	0	0	0	113.3	K1026 T1027	K1026-F1052 VanDerWaalsContact C-CD2 3.5Å; K1026-F1052 HydrophobicContact CB-CD2 3.33Å; K1026-F1052 HydrophobicContact CB-CE2 3.41Å; K1026-F1052 VanDerWaalsContact CB-CE2 3.41Å; K1026-F1052 HydrophobicContact CB-CG 4.4Å; K1026-F1052 HydrophobicContact CB-CZ 4.47Å; K1026-F1052 HydrophobicContact CD-CD1 4.18Å; K1026-F1052 HydrophobicContact CD-CD2 3.49Å; K1026-F1052 VanDerWaalsContact CD-CD2 3.49Å; K1026-F1052 HydrophobicContact CD-CE1 4.02Å; K1026-F1052 HydrophobicContact CD-CE2 3.38Å; K1026-F1052 HydrophobicContact CD-CG 3.93Å; K1026-F1052 HydrophobicContact CD-CZ 3.64Å; K1026-F1052 VanDerWaalsContact CE-CD1 3.45Å; K1026-F1052 HydrophobicContact CG-CB 4.43Å; K1026-F1052 HydrophobicContact CG-CD2 3.16Å; K1026-F1052 HydrophobicContact CG-CE2 3.49Å; K1026-F1052 VanDerWaalsContact CG-CE2 3.49Å; K1026-F1052 HydrophobicContact CG-CG 3.77Å; K1026-F1052 HydrophobicContact CG-CZ 4.26Å; T1027-F1052 WeakPolarHBondContact O-CD2 3.28Å; T1027-F1052 WeakPolarHBondContact O-CE2 3.19Å; T1027-F1052 WeakPolarHBondContact O-CG 3.47Å
1053	K	29.2	Very low	26.1	Very low	158 Å²	158	133.4 Å²	133.4	69%	0.687	70%	0.697	S	S	*	*			trans	-87.9	-178.9	163.4	-70.4	179.2	168	-172.8	0	109.1
1054	T	28	Very low	26.1	Very low	109 Å²	109	134.9 Å²	134.9	67%	0.669	70%	0.697	S	S	*	*				175.3	154.1	57.2	15.5	0	0	0	0	111.8
1055	G	28	Very low	26	Very low	64 Å²	64	133.7 Å²	133.7	66%	0.66	70%	0.697	S	S	*	*			trans	166.5	98	156.5	0	0	0	0	0	109.5
1056	H	26.5	Very low	26	Very low	170 Å²	170	131.6 Å²	131.6	79%	0.787	70%	0.702	S	S	*	*				61.8	127.4	84.4	-79.1	-78.2	0	0	0	111.9
1057	I	26.6	Very low	26.1	Very low	141 Å²	141	129 Å²	129	72%	0.723	70%	0.7	S	S	*	*			cis	-160	120.9	30.8	-102.4	143.8	0	0	0	107.3
1058	S	22.7	Very low	26	Very low	89 Å²	89	129.1 Å²	129.1	62%	0.622	70%	0.701	S	S	*	*				50	127.6	100.8	71.3	0	0	0	0	120.1
1059	N	23	Very low	25.7	Very low	138 Å²	138	132.4 Å²	132.4	74%	0.738	71%	0.713	S	S	*	*			trans	89.3	134.1	149.8	-63.2	-4.6	0	0	0	121.6
1060	H	24.2	Very low	25.6	Very low	180 Å²	180	131.1 Å²	131.1	83%	0.833	71%	0.709	S	S	*	*			trans	61	149.3	162.1	-66.4	-70.2	0	0	0	117.3
1061	S	23.6	Very low	25.6	Very low	92 Å²	92	137.5 Å²	137.5	64%	0.643	74%	0.736	S	S	*	*			cis	-172.3	141.3	-15.5	47.6	0	0	0	0	110.2
1062	K	24.3	Very low	25.4	Very low	178 Å²	178	142.4 Å²	142.4	77%	0.774	76%	0.756	S	S	*	*			trans	60.6	157.5	161.5	-68.6	-177.8	169.5	-171.6	0	118.3
1063	E	23.9	Very low	25.3	Very low	158 Å²	158	141.4 Å²	141.4	74%	0.738	76%	0.763	S	S	*	*			trans	58.2	121.8	164	-68.1	138.2	-133.5	0	0	115.6
1064	D	24.1	Very low	25	Very low	134 Å²	134	144.1 Å²	144.1	72%	0.717	77%	0.771	S	S	*	*			cis	-146.7	152.9	-1.2	-77	-49.1	0	0	0	108.5
1065	N	26.5	Very low	24.8	Very low	162 Å²	162	147.8 Å²	147.8	87%	0.866	78%	0.777	S	S	*	*			trans	-169.5	81.6	154.7	-101.5	-52.4	0	0	0	111	M1067	N1065-M1067 PolarHBondContact O-N 2.93Å
1066	S	24.7	Very low	24.7	Very low	127 Å²	127	152.6 Å²	152.6	89%	0.888	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	50.7	-175.8	45.1	0	0	0	0	114.2
1067	M	25.1	Very low	24.6	Very low	171 Å²	171	151.6 Å²	151.6	84%	0.842	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.2	26.9	174.5	-137.7	-176.1	80.4	0	0	116.5	N1065	N1065-M1067 PolarHBondContact O-N 2.93Å
1068	F	25.7	Very low	24.7	Very low	195 Å²	195	154.8 Å²	154.8	86%	0.855	79%	0.791	S	S	*	*	S	Bend	trans	-127.6	4	-180	-112.9	-89.7	0	0	0	116.3
1069	N	25.4	Very low	25.1	Very low	174 Å²	174	155.4 Å²	155.4	93%	0.93	79%	0.792	S	S	*	*	S	Bend	trans	-123.9	15.1	-179.4	-87.3	-23.2	0	0	0	114.6
1070	A	25.3	Very low	25.5	Very low	84 Å²	84	155 Å²	155	69%	0.694	79%	0.789	S	S	*	*	S	Bend	trans	-99.9	153.1	156.8	0	0	0	0	0	108.3
1071	I	26.3	Very low	26	Very low	157 Å²	157	153.7 Å²	153.7	81%	0.805	78%	0.783	S	S	*	*			trans	74.2	44.5	-175.7	-35.3	168.1	0	0	0	114.3
1072	H	25.5	Very low	26.5	Very low	198 Å²	198	155.8 Å²	155.8	92%	0.917	78%	0.783	S	S	*	*	S	Bend	trans	-109.2	19.8	147.4	-151.3	-64.9	0	0	0	112
1073	S	23.8	Very low	27	Very low	91 Å²	91	153.1 Å²	153.1	64%	0.636	78%	0.776	S	S	*	*	S	Bend	trans	-146.9	156.1	169.5	-170.7	0	0	0	0	107.5
1074	Y	22.2	Very low	27.6	Very low	215 Å²	215	151 Å²	151	84%	0.843	77%	0.769	S	S	*	*			trans	79.3	81.3	-165.4	-72.8	-90.9	0	0	0	117.4
1075	K	24.2	Very low	28.2	Very low	186 Å²	186	151 Å²	151	81%	0.809	77%	0.765	S	S	*	*				-3.4	140.1	121.7	-90.3	176.4	169.1	177.3	0	116.4
1076	H	25	Very low	28.7	Very low	164 Å²	164	149.4 Å²	149.4	76%	0.759	75%	0.752	S	S	*	*			trans	72.1	96.6	169.4	-67.3	-89.4	0	0	0	117.9
1077	N	25.3	Very low	29.4	Very low	150 Å²	150	148.1 Å²	148.1	80%	0.802	73%	0.734	S	S	*	*				176	150	102.1	-95.4	-22.3	0	0	0	115.1	T1079	N1077-T1079 PolarHBondContact O-N 3.36Å
1078	K	27.1	Very low	30.1	Very low	208 Å²	208	143.3 Å²	143.3	90%	0.904	72%	0.718	S	S	*	*			trans	-72.2	91.3	-171.8	-178	-173.1	-176.2	-176	0	114
1079	T	32.6	Very low	30.7	Very low	102 Å²	102	138.9 Å²	138.9	63%	0.626	70%	0.696	S	S	*	*			trans	-143.9	-23.8	175.1	48.4	0	0	0	0	117.7	N1077 H1081	N1077-T1079 PolarHBondContact O-N 3.36Å; T1079-H1081 VanDerWaalsContact C-N 3.29Å; T1079-H1081 PolarHBondContact O-N 2.97Å; T1079-H1081 VanDerWaalsContact O-N 3.11Å
1080	N	30.6	Very low	31.5	Very low	130 Å²	130	134.9 Å²	134.9	70%	0.695	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-4.6	-167.3	-73.9	-16.7	0	0	0	117.1
1081	H	34.8	Very low	32.2	Very low	152 Å²	152	134.5 Å²	134.5	70%	0.704	66%	0.663	S	S	*	*	H	α-helix	trans	-82.7	-28.6	-172.8	-139.1	-54.9	0	0	0	113.9	T1079 E1085	T1079-H1081 VanDerWaalsContact C-N 3.29Å; T1079-H1081 PolarHBondContact O-N 2.97Å; T1079-H1081 VanDerWaalsContact O-N 3.11Å; H1081-E1085 PolarHBondContact O-N 3.45Å
1082	E	33.4	Very low	33	Very low	136 Å²	136	134.5 Å²	134.5	64%	0.636	65%	0.654	S	S	*	*	H	α-helix	trans	-70.5	-32.5	180	-64.7	-178.4	139.2	0	0	112.1	I1084 E1085 H1086	E1082-I1084 PolarHBondContact O-N 3.31Å; E1082-E1085 PolarHBondContact O-N 2.72Å; E1082-H1086 PolarHBondContact O-N 3.26Å
1083	L	34.8	Very low	33.6	Very low	121 Å²	121	129.6 Å²	129.6	63%	0.634	63%	0.628	S	S	*	*	H	α-helix	trans	-71.6	-32.2	-176.4	-142.4	146.6	0	0	0	112	L1087	L1083-L1087 HydrophobicContact CD2-CD1 4.11Å; L1083-L1087 WeakPolarHBondContact O-CG 3.41Å; L1083-L1087 PolarHBondContact O-N 3.11Å
1084	I	38.4	Very low	34.8	Very low	114 Å²	114	129.5 Å²	129.5	59%	0.585	62%	0.619	S	S	*	*	H	α-helix	trans	-76.7	-38.2	176.5	-60.9	176.6	0	0	0	111.2	E1082 L1087 S1088	E1082-I1084 PolarHBondContact O-N 3.31Å; I1084-L1087 PolarHBondContact O-N 3.5Å; I1084-S1088 PolarHBondContact O-N 3.35Å
1085	E	35.9	Very low	35.6	Very low	134 Å²	134	122.8 Å²	122.8	63%	0.626	60%	0.598	S	S	*	*	H	α-helix	trans	-65.1	-40.4	171.9	-77.4	-154.3	138.5	0	0	112.1	H1081 E1082 L1087 S1088 Y1089	H1081-E1085 PolarHBondContact O-N 3.45Å; E1082-E1085 PolarHBondContact O-N 2.72Å; E1085-L1087 VanDerWaalsContact C-N 3.33Å; E1085-L1087 PolarHBondContact O-N 3.37Å; E1085-S1088 PolarHBondContact O-N 3.46Å; E1085-S1088 PolarHBondContact O-OG 3.04Å; E1085-S1088 VanDerWaalsContact O-OG 3.06Å; E1085-Y1089 VanDerWaalsContact O-CB 3.28Å; E1085-Y1089 WeakPolarHBondContact O-CB 3.38Å; E1085-Y1089 PolarHBondContact O-N 3.43Å
1086	H	37.2	Very low	36.8	Very low	129 Å²	129	118 Å²	118	60%	0.597	58%	0.577	S	S	*	*	H	α-helix	trans	-59.8	-42.3	174.6	-102.9	-96.5	0	0	0	112.4	E1082 L1090	E1082-H1086 PolarHBondContact O-N 3.26Å; H1086-L1090 VanDerWaalsContact O-CB 3.31Å; H1086-L1090 WeakPolarHBondContact O-CB 2.78Å; H1086-L1090 WeakPolarHBondContact O-CG 3.38Å; H1086-L1090 PolarHBondContact O-N 3.38Å
1087	L	39.7	Very low	37.7	Very low	99 Å²	99	114.3 Å²	114.3	52%	0.518	56%	0.562	S	S	.	*	H	α-helix	trans	-68	-39.3	177	-76.3	166.4	0	0	0	112.7	L1083 I1084 E1085 T1091	L1083-L1087 HydrophobicContact CD2-CD1 4.11Å; L1083-L1087 WeakPolarHBondContact O-CG 3.41Å; L1083-L1087 PolarHBondContact O-N 3.11Å; I1084-L1087 PolarHBondContact O-N 3.5Å; E1085-L1087 VanDerWaalsContact C-N 3.33Å; E1085-L1087 PolarHBondContact O-N 3.37Å; L1087-T1091 WeakPolarHBondContact O-CB 3.37Å; L1087-T1091 PolarHBondContact O-N 3.23Å; L1087-T1091 PolarHBondContact O-OG1 2.98Å
1088	S	38.5	Very low	38.6	Very low	71 Å²	71	112.4 Å²	112.4	50%	0.497	55%	0.549	S	S	.	.	H	α-helix	trans	-69.8	-38.5	177.1	76.1	0	0	0	0	111.9	I1084 E1085 T1091 Y1092	I1084-S1088 PolarHBondContact O-N 3.35Å; E1085-S1088 PolarHBondContact O-N 3.46Å; E1085-S1088 PolarHBondContact O-OG 3.04Å; E1085-S1088 VanDerWaalsContact O-OG 3.06Å; S1088-T1091 PolarHBondContact O-N 3.38Å; S1088-Y1092 WeakPolarHBondContact O-CB 3.48Å; S1088-Y1092 PolarHBondContact O-N 2.84Å
1089	Y	39.1	Very low	39.4	Very low	102 Å²	102	107.7 Å²	107.7	40%	0.4	53%	0.533	S	S	.	.	H	α-helix	trans	-67.7	-42.4	175	-178.9	-99.9	0	0	0	112.3	E1085 T1091 Y1092 R1093	E1085-Y1089 VanDerWaalsContact O-CB 3.28Å; E1085-Y1089 WeakPolarHBondContact O-CB 3.38Å; E1085-Y1089 PolarHBondContact O-N 3.43Å; Y1089-T1091 VanDerWaalsContact C-N 3.34Å; Y1089-Y1092 PolarHBondContact O-N 3.02Å; Y1089-R1093 VanDerWaalsContact O-CB 3.26Å; Y1089-R1093 WeakPolarHBondContact O-CB 3.47Å; Y1089-R1093 PolarHBondContact O-N 3.31Å
1090	L	41.6	Very low	39.9	Very low	89 Å²	89	105.8 Å²	105.8	47%	0.466	52%	0.517	S	S	.	.	H	α-helix	trans	-58.1	-47.1	170.8	-86.6	161.4	0	0	0	110.9	H1086 Y1092 R1093 I1094	H1086-L1090 VanDerWaalsContact O-CB 3.31Å; H1086-L1090 WeakPolarHBondContact O-CB 2.78Å; H1086-L1090 WeakPolarHBondContact O-CG 3.38Å; H1086-L1090 PolarHBondContact O-N 3.38Å; L1090-Y1092 PolarHBondContact O-N 2.91Å; L1090-R1093 PolarHBondContact O-N 3.31Å; L1090-I1094 WeakPolarHBondContact O-CB 3.49Å; L1090-I1094 VanDerWaalsContact O-CG1 3.24Å; L1090-I1094 WeakPolarHBondContact O-CG1 3.48Å; L1090-I1094 PolarHBondContact O-N 3.07Å
1091	T	40.5	Very low	40.6	Very low	77 Å²	77	104.1 Å²	104.1	47%	0.472	51%	0.509	S	S	.	.	H	α-helix	trans	-61.7	-42.7	178.1	-55.7	0	0	0	0	111.8	L1087 S1088 Y1089 N1095	L1087-T1091 WeakPolarHBondContact O-CB 3.37Å; L1087-T1091 PolarHBondContact O-N 3.23Å; L1087-T1091 PolarHBondContact O-OG1 2.98Å; S1088-T1091 PolarHBondContact O-N 3.38Å; Y1089-T1091 VanDerWaalsContact C-N 3.34Å; T1091-N1095 WeakPolarHBondContact O-CB 3.22Å; T1091-N1095 PolarHBondContact O-N 3.13Å; T1091-N1095 PolarHBondContact O-ND2 3.39Å
1092	Y	43	Very low	41	Very low	156 Å²	156	104.2 Å²	104.2	61%	0.612	50%	0.504	S	S	*	.	H	α-helix	trans	-64.2	-41.6	174.8	175.4	-100	0	0	0	112.2	S1088 Y1089 L1090 N1095 K1096	S1088-Y1092 WeakPolarHBondContact O-CB 3.48Å; S1088-Y1092 PolarHBondContact O-N 2.84Å; Y1089-Y1092 PolarHBondContact O-N 3.02Å; L1090-Y1092 PolarHBondContact O-N 2.91Å; Y1092-N1095 PolarHBondContact O-N 3.15Å; Y1092-K1096 WeakPolarHBondContact O-CB 3.17Å; Y1092-K1096 PolarHBondContact O-N 3.48Å
1093	R	38.9	Very low	41.3	Very low	96 Å²	96	103.9 Å²	103.9	36%	0.362	50%	0.5	S	S	.	.	H	α-helix	trans	-71.8	-36.3	-178.4	-162.9	172.5	-178.3	-160.7	-3.7	112.1	P956 Y1089 L1090 K1096 L1097	P956-R1093 VanDerWaalsContact CB-NH2 3.32Å; Y1089-R1093 VanDerWaalsContact O-CB 3.26Å; Y1089-R1093 WeakPolarHBondContact O-CB 3.47Å; Y1089-R1093 PolarHBondContact O-N 3.31Å; L1090-R1093 PolarHBondContact O-N 3.31Å; R1093-K1096 PolarHBondContact O-N 3.46Å; R1093-L1097 WeakPolarHBondContact O-CB 3.43Å; R1093-L1097 WeakPolarHBondContact O-CG 3.4Å; R1093-L1097 PolarHBondContact O-N 2.91Å
1094	I	48	Very low	41.8	Very low	88 Å²	88	102.4 Å²	102.4	45%	0.451	49%	0.493	S	S	.	.	H	α-helix	trans	-62	-53.2	169.2	-69.5	163.9	0	0	0	109.6	L1090 K1096 L1097 E1098	L1090-I1094 WeakPolarHBondContact O-CB 3.49Å; L1090-I1094 VanDerWaalsContact O-CG1 3.24Å; L1090-I1094 WeakPolarHBondContact O-CG1 3.48Å; L1090-I1094 PolarHBondContact O-N 3.07Å; I1094-K1096 PolarHBondContact O-N 3.02Å; I1094-L1097 PolarHBondContact O-N 3.29Å; I1094-L1097 VanDerWaalsContact O-N 3.08Å; I1094-E1098 HydrophobicContact CG2-CG 4.33Å; I1094-E1098 WeakPolarHBondContact O-CG 3.09Å; I1094-E1098 PolarHBondContact O-N 2.82Å
1095	N	40.1	Very low	42	Very low	75 Å²	75	103 Å²	103	40%	0.401	49%	0.493	S	S	.	.	H	α-helix	trans	-57.5	-33.9	176.6	-83.4	-70.1	0	0	0	112.9	T1091 Y1092 N1099	T1091-N1095 WeakPolarHBondContact O-CB 3.22Å; T1091-N1095 PolarHBondContact O-N 3.13Å; T1091-N1095 PolarHBondContact O-ND2 3.39Å; Y1092-N1095 PolarHBondContact O-N 3.15Å; N1095-N1099 WeakPolarHBondContact O-CB 3.45Å; N1095-N1099 PolarHBondContact O-N 2.94Å; N1095-N1099 PolarHBondContact O-ND2 3.17Å
1096	K	49.2	Very low	42.3	Very low	85 Å²	85	100.2 Å²	100.2	37%	0.37	48%	0.483	S	S	.	.	H	α-helix	trans	-70.4	-44.8	175.1	-175.2	174.4	172.7	-178.8	0	111.9	Y1092 R1093 I1094 N1099 E1100	Y1092-K1096 WeakPolarHBondContact O-CB 3.17Å; Y1092-K1096 PolarHBondContact O-N 3.48Å; R1093-K1096 PolarHBondContact O-N 3.46Å; I1094-K1096 PolarHBondContact O-N 3.02Å; K1096-N1099 PolarHBondContact O-N 3.23Å; K1096-E1100 WeakPolarHBondContact CE-OE1 3.36Å; K1096-E1100 IonicContact NZ-OE1 3.06Å; K1096-E1100 WeakPolarHBondContact O-CB 3.38Å; K1096-E1100 WeakPolarHBondContact O-CG 3.48Å; K1096-E1100 PolarHBondContact O-N 3.3Å
1097	L	43.7	Very low	42.5	Very low	86 Å²	86	97.3 Å²	97.3	45%	0.45	47%	0.471	S	S	.	.	H	α-helix	trans	-66.1	-36.1	176.4	-73.3	167.4	0	0	0	112.1	R1093 I1094 N1101	R1093-L1097 WeakPolarHBondContact O-CB 3.43Å; R1093-L1097 WeakPolarHBondContact O-CG 3.4Å; R1093-L1097 PolarHBondContact O-N 2.91Å; I1094-L1097 PolarHBondContact O-N 3.29Å; I1094-L1097 VanDerWaalsContact O-N 3.08Å; L1097-N1101 VanDerWaalsContact O-CB 3.26Å; L1097-N1101 WeakPolarHBondContact O-CB 3.08Å; L1097-N1101 PolarHBondContact O-N 3.09Å; L1097-N1101 PolarHBondContact O-ND2 3.45Å
1098	E	44.4	Very low	42.6	Very low	110 Å²	110	97.9 Å²	97.9	51%	0.514	47%	0.474	S	S	.	.	H	α-helix	trans	-65.5	-42.5	172.6	-74.1	-176.3	155.7	0	0	111.6	I1094 N1101 Y1102	I1094-E1098 HydrophobicContact CG2-CG 4.33Å; I1094-E1098 WeakPolarHBondContact O-CG 3.09Å; I1094-E1098 PolarHBondContact O-N 2.82Å; E1098-N1101 PolarHBondContact O-N 2.93Å; E1098-Y1102 WeakPolarHBondContact O-CB 3.21Å; E1098-Y1102 PolarHBondContact O-N 2.73Å
1099	N	42.4	Very low	42.8	Very low	109 Å²	109	100.5 Å²	100.5	58%	0.583	48%	0.477	S	S	*	.	H	α-helix	trans	-68.4	-39.3	175.2	-83.6	-70.3	0	0	0	112.9	N1095 K1096 Y1102 F1103	N1095-N1099 WeakPolarHBondContact O-CB 3.45Å; N1095-N1099 PolarHBondContact O-N 2.94Å; N1095-N1099 PolarHBondContact O-ND2 3.17Å; K1096-N1099 PolarHBondContact O-N 3.23Å; N1099-Y1102 PolarHBondContact O-N 2.83Å; N1099-F1103 VanDerWaalsContact O-CB 3.31Å; N1099-F1103 WeakPolarHBondContact O-CB 3.44Å; N1099-F1103 PolarHBondContact O-N 3.47Å
1100	E	44.2	Very low	42.9	Very low	62 Å²	62	99.4 Å²	99.4	29%	0.29	48%	0.478	S	S	.	.	H	α-helix	trans	-67.5	-38.1	175.1	-74.9	177.9	175.9	0	0	111.2	K1096 F1103 L1104	K1096-E1100 WeakPolarHBondContact CE-OE1 3.36Å; K1096-E1100 IonicContact NZ-OE1 3.06Å; K1096-E1100 WeakPolarHBondContact O-CB 3.38Å; K1096-E1100 WeakPolarHBondContact O-CG 3.48Å; K1096-E1100 PolarHBondContact O-N 3.3Å; E1100-F1103 PolarHBondContact O-N 3.2Å; E1100-L1104 WeakPolarHBondContact O-CB 3.47Å; E1100-L1104 WeakPolarHBondContact O-CG 3.4Å; E1100-L1104 PolarHBondContact O-N 3.07Å
1101	N	44.3	Very low	42.9	Very low	96 Å²	96	101.5 Å²	101.5	51%	0.513	49%	0.485	S	S	.	.	H	α-helix	trans	-67.6	-39.6	170.7	-84.9	-43.2	0	0	0	112.9	L1097 E1098 F1103 L1104 Q1105	L1097-N1101 VanDerWaalsContact O-CB 3.26Å; L1097-N1101 WeakPolarHBondContact O-CB 3.08Å; L1097-N1101 PolarHBondContact O-N 3.09Å; L1097-N1101 PolarHBondContact O-ND2 3.45Å; E1098-N1101 PolarHBondContact O-N 2.93Å; N1101-F1103 VanDerWaalsContact C-N 3.3Å; N1101-F1103 PolarHBondContact O-N 3.18Å; N1101-L1104 PolarHBondContact O-N 2.94Å; N1101-Q1105 VanDerWaalsContact O-CB 3.27Å; N1101-Q1105 WeakPolarHBondContact O-CB 3.44Å; N1101-Q1105 WeakPolarHBondContact O-CG 3.48Å; N1101-Q1105 PolarHBondContact O-N 3.49Å
1102	Y	43.1	Very low	42.8	Very low	153 Å²	153	100.3 Å²	100.3	60%	0.6	48%	0.481	S	S	*	.	H	α-helix	trans	-64.6	-35	173	-114.4	-85.2	0	0	0	111.8	E1098 N1099 N1106	E1098-Y1102 WeakPolarHBondContact O-CB 3.21Å; E1098-Y1102 PolarHBondContact O-N 2.73Å; N1099-Y1102 PolarHBondContact O-N 2.83Å; Y1102-N1106 WeakPolarHBondContact O-CB 3.32Å; Y1102-N1106 PolarHBondContact O-N 3.48Å; Y1102-N1106 PolarHBondContact O-ND2 3.05Å
1103	F	41.2	Very low	42.5	Very low	129 Å²	129	95.4 Å²	95.4	57%	0.566	47%	0.465	S	S	*	.	H	α-helix	trans	-75	-37.1	177.1	-167.2	-104.9	0	0	0	112.1	N1099 E1100 N1101 N1107	N1099-F1103 VanDerWaalsContact O-CB 3.31Å; N1099-F1103 WeakPolarHBondContact O-CB 3.44Å; N1099-F1103 PolarHBondContact O-N 3.47Å; E1100-F1103 PolarHBondContact O-N 3.2Å; N1101-F1103 VanDerWaalsContact C-N 3.3Å; N1101-F1103 PolarHBondContact O-N 3.18Å; F1103-N1107 VanDerWaalsContact CD1-ND2 3.27Å; F1103-N1107 WeakPolarHBondContact CD1-ND2 3.46Å; F1103-N1107 WeakPolarHBondContact CE1-ND2 3.3Å; F1103-N1107 WeakPolarHBondContact CZ-ND2 3.38Å; F1103-N1107 WeakPolarHBondContact O-CB 3.29Å; F1103-N1107 PolarHBondContact O-N 3.24Å; F1103-N1107 PolarHBondContact O-ND2 3.31Å
1104	L	44.5	Very low	42.4	Very low	90 Å²	90	93.9 Å²	93.9	47%	0.471	47%	0.469	S	S	.	.	H	α-helix	trans	-67.6	-46.8	171.3	-82.2	162.8	0	0	0	111.5	E1100 N1101 N1107 L1108	E1100-L1104 WeakPolarHBondContact O-CB 3.47Å; E1100-L1104 WeakPolarHBondContact O-CG 3.4Å; E1100-L1104 PolarHBondContact O-N 3.07Å; N1101-L1104 PolarHBondContact O-N 2.94Å; L1104-N1107 PolarHBondContact O-N 2.91Å; L1104-L1108 VanDerWaalsContact O-CB 3.31Å; L1104-L1108 WeakPolarHBondContact O-CB 3.3Å; L1104-L1108 WeakPolarHBondContact O-CG 3.49Å; L1104-L1108 PolarHBondContact O-N 3.3Å
1105	Q	42.6	Very low	41.8	Very low	127 Å²	127	95.1 Å²	95.1	59%	0.593	47%	0.474	S	S	*	.	H	α-helix	trans	-59.9	-46.5	173.5	-79.3	-172.6	-14.9	0	0	111.2	N1101 N1107 L1108 F1109	N1101-Q1105 VanDerWaalsContact O-CB 3.27Å; N1101-Q1105 WeakPolarHBondContact O-CB 3.44Å; N1101-Q1105 WeakPolarHBondContact O-CG 3.48Å; N1101-Q1105 PolarHBondContact O-N 3.49Å; Q1105-N1107 PolarHBondContact O-N 3.09Å; Q1105-L1108 PolarHBondContact O-N 3.11Å; Q1105-F1109 WeakPolarHBondContact O-CB 3.42Å; Q1105-F1109 PolarHBondContact O-N 3.47Å
1106	N	42.1	Very low	41.7	Very low	76 Å²	76	98 Å²	98	41%	0.406	49%	0.487	S	S	.	.	H	α-helix	trans	-66.6	-35.1	177.6	-83.6	-35.9	0	0	0	112.9	Y1102 N1110	Y1102-N1106 WeakPolarHBondContact O-CB 3.32Å; Y1102-N1106 PolarHBondContact O-N 3.48Å; Y1102-N1106 PolarHBondContact O-ND2 3.05Å; N1106-N1110 WeakPolarHBondContact O-CB 3.44Å; N1106-N1110 PolarHBondContact O-N 3.09Å; N1106-N1110 PolarHBondContact O-ND2 3.32Å; N1106-N1110 VanDerWaalsContact O-ND2 3.11Å
1107	N	42.1	Very low	41.3	Very low	68 Å²	68	97.9 Å²	97.9	36%	0.364	49%	0.493	S	S	.	.	H	α-helix	trans	-73.4	-38.3	175.4	-78.9	-51.3	0	0	0	112.6	F1103 L1104 Q1105 Q1111	F1103-N1107 VanDerWaalsContact CD1-ND2 3.27Å; F1103-N1107 WeakPolarHBondContact CD1-ND2 3.46Å; F1103-N1107 WeakPolarHBondContact CE1-ND2 3.3Å; F1103-N1107 WeakPolarHBondContact CZ-ND2 3.38Å; F1103-N1107 WeakPolarHBondContact O-CB 3.29Å; F1103-N1107 PolarHBondContact O-N 3.24Å; F1103-N1107 PolarHBondContact O-ND2 3.31Å; L1104-N1107 PolarHBondContact O-N 2.91Å; Q1105-N1107 PolarHBondContact O-N 3.09Å; N1107-Q1111 WeakPolarHBondContact O-CB 2.97Å; N1107-Q1111 WeakPolarHBondContact O-CG 3.33Å; N1107-Q1111 PolarHBondContact O-N 3.41Å
1108	L	41.8	Very low	40.9	Very low	111 Å²	111	101 Å²	101	58%	0.581	51%	0.506	S	S	*	.	H	α-helix	trans	-65.5	-40.9	172.3	-78	161.1	0	0	0	111.4	L1104 Q1105 Q1111 S1112	L1104-L1108 VanDerWaalsContact O-CB 3.31Å; L1104-L1108 WeakPolarHBondContact O-CB 3.3Å; L1104-L1108 WeakPolarHBondContact O-CG 3.49Å; L1104-L1108 PolarHBondContact O-N 3.3Å; Q1105-L1108 PolarHBondContact O-N 3.11Å; L1108-Q1111 PolarHBondContact O-N 2.97Å; L1108-S1112 WeakPolarHBondContact O-CB 3.5Å; L1108-S1112 PolarHBondContact O-N 3.5Å; L1108-S1112 PolarHBondContact O-OG 2.71Å
1109	F	41.1	Very low	40.5	Very low	125 Å²	125	104.2 Å²	104.2	55%	0.548	52%	0.521	S	S	.	.	H	α-helix	trans	-70.7	-37	177.1	-166	-111	0	0	0	112	Q1105 S1112 N1113	Q1105-F1109 WeakPolarHBondContact O-CB 3.42Å; Q1105-F1109 PolarHBondContact O-N 3.47Å; F1109-S1112 WeakPolarHBondContact CA-OG 3.49Å; F1109-S1112 PolarHBondContact O-OG 2.94Å; F1109-N1113 WeakPolarHBondContact CD1-ND2 3.46Å; F1109-N1113 WeakPolarHBondContact CE1-ND2 3.39Å; F1109-N1113 WeakPolarHBondContact CZ-ND2 3.43Å; F1109-N1113 WeakPolarHBondContact O-CB 3.48Å; F1109-N1113 PolarHBondContact O-N 2.97Å; F1109-N1113 PolarHBondContact O-ND2 3.07Å; F1109-N1113 VanDerWaalsContact O-ND2 3.12Å
1110	N	42.1	Very low	40	Very low	80 Å²	80	106.8 Å²	106.8	43%	0.428	53%	0.529	S	S	.	.	H	α-helix	trans	-73.5	-35	173.8	-74	-28.3	0	0	0	112.2	N1106 S1114	N1106-N1110 WeakPolarHBondContact O-CB 3.44Å; N1106-N1110 PolarHBondContact O-N 3.09Å; N1106-N1110 PolarHBondContact O-ND2 3.32Å; N1106-N1110 VanDerWaalsContact O-ND2 3.11Å; N1110-S1114 WeakPolarHBondContact O-CB 3.49Å; N1110-S1114 PolarHBondContact O-N 3.1Å; N1110-S1114 PolarHBondContact O-OG 2.91Å
1111	Q	41.5	Very low	39.4	Very low	132 Å²	132	112 Å²	112	62%	0.617	55%	0.554	S	S	*	*	H	α-helix	trans	-66.7	-46.7	170.6	-79.5	-174.5	-22.9	0	0	111.2	N1107 L1108 N1113 S1114 M1115	N1107-Q1111 WeakPolarHBondContact O-CB 2.97Å; N1107-Q1111 WeakPolarHBondContact O-CG 3.33Å; N1107-Q1111 PolarHBondContact O-N 3.41Å; L1108-Q1111 PolarHBondContact O-N 2.97Å; Q1111-N1113 VanDerWaalsContact C-N 3.34Å; Q1111-N1113 PolarHBondContact O-N 3.38Å; Q1111-S1114 PolarHBondContact O-N 3.06Å; Q1111-S1114 PolarHBondContact O-OG 3.06Å; Q1111-M1115 PolarHBondContact O-N 2.69Å
1112	S	37.4	Very low	38.8	Very low	53 Å²	53	116.9 Å²	116.9	37%	0.371	57%	0.573	S	S	.	*	H	α-helix	trans	-62.4	-40.8	177	67.7	0	0	0	0	112.2	L1108 F1109 M1115 M1116	L1108-S1112 WeakPolarHBondContact O-CB 3.5Å; L1108-S1112 PolarHBondContact O-N 3.5Å; L1108-S1112 PolarHBondContact O-OG 2.71Å; F1109-S1112 WeakPolarHBondContact CA-OG 3.49Å; F1109-S1112 PolarHBondContact O-OG 2.94Å; S1112-M1115 PolarHBondContact O-N 3.16Å; S1112-M1116 PolarHBondContact O-N 3.43Å
1113	N	37.1	Very low	38.3	Very low	52 Å²	52	118.3 Å²	118.3	28%	0.278	59%	0.585	S	S	.	*	H	α-helix	trans	-74.4	-33.4	177.9	-67.5	-19.5	0	0	0	112.4	F1109 Q1111 M1115 M1116 T1117	F1109-N1113 WeakPolarHBondContact CD1-ND2 3.46Å; F1109-N1113 WeakPolarHBondContact CE1-ND2 3.39Å; F1109-N1113 WeakPolarHBondContact CZ-ND2 3.43Å; F1109-N1113 WeakPolarHBondContact O-CB 3.48Å; F1109-N1113 PolarHBondContact O-N 2.97Å; F1109-N1113 PolarHBondContact O-ND2 3.07Å; F1109-N1113 VanDerWaalsContact O-ND2 3.12Å; Q1111-N1113 VanDerWaalsContact C-N 3.34Å; Q1111-N1113 PolarHBondContact O-N 3.38Å; N1113-M1115 VanDerWaalsContact C-N 3.3Å; N1113-M1115 PolarHBondContact O-N 3.42Å; N1113-M1116 PolarHBondContact O-N 3.3Å; N1113-T1117 VanDerWaalsContact O-CB 3.29Å; N1113-T1117 WeakPolarHBondContact O-CB 3.37Å; N1113-T1117 PolarHBondContact O-N 2.92Å; N1113-T1117 PolarHBondContact O-OG1 3.3Å
1114	S	38.2	Very low	37.8	Very low	65 Å²	65	117.1 Å²	117.1	46%	0.455	59%	0.591	S	S	.	*	H	α-helix	trans	-65.5	-33.4	171.8	75.8	0	0	0	0	112.6	N1110 Q1111	N1110-S1114 WeakPolarHBondContact O-CB 3.49Å; N1110-S1114 PolarHBondContact O-N 3.1Å; N1110-S1114 PolarHBondContact O-OG 2.91Å; Q1111-S1114 PolarHBondContact O-N 3.06Å; Q1111-S1114 PolarHBondContact O-OG 3.06Å
1115	M	35.1	Very low	37.1	Very low	114 Å²	114	119 Å²	119	56%	0.562	61%	0.608	S	S	*	*	H	α-helix	trans	-73	-39.8	172.5	-86.4	-173.9	159.9	0	0	112.4	Q1111 S1112 N1113	Q1111-M1115 PolarHBondContact O-N 2.69Å; S1112-M1115 PolarHBondContact O-N 3.16Å; N1113-M1115 VanDerWaalsContact C-N 3.3Å; N1113-M1115 PolarHBondContact O-N 3.42Å
1116	M	37.2	Very low	36.7	Very low	134 Å²	134	118.7 Å²	118.7	66%	0.66	62%	0.617	S	S	*	*	H	α-helix	trans	-73.1	-36	177.6	-79.9	-170.9	165.1	0	0	113.6	S1112 N1113 Q1118 Q1119	S1112-M1116 PolarHBondContact O-N 3.43Å; N1113-M1116 PolarHBondContact O-N 3.3Å; M1116-Q1118 VanDerWaalsContact C-N 3.31Å; M1116-Q1118 PolarHBondContact O-N 3.22Å; M1116-Q1119 PolarHBondContact O-N 2.78Å
1117	T	40.8	Very low	36.1	Very low	83 Å²	83	120.3 Å²	120.3	51%	0.509	63%	0.632	S	S	.	*	H	α-helix	trans	-77	-17.4	-176	-41	0	0	0	0	112.5	N1113 Q1119	N1113-T1117 VanDerWaalsContact O-CB 3.29Å; N1113-T1117 WeakPolarHBondContact O-CB 3.37Å; N1113-T1117 PolarHBondContact O-N 2.92Å; N1113-T1117 PolarHBondContact O-OG1 3.3Å; T1117-Q1119 VanDerWaalsContact C-N 3.33Å
1118	Q	36.5	Very low	35.7	Very low	153 Å²	153	125.1 Å²	125.1	72%	0.715	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	2.3	171.7	-71.6	-169.5	6.7	0	0	114.2	M1116	M1116-Q1118 VanDerWaalsContact C-N 3.31Å; M1116-Q1118 PolarHBondContact O-N 3.22Å
1119	Q	35.7	Very low	35.2	Very low	176 Å²	176	126.5 Å²	126.5	82%	0.822	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.9	10.1	174	-76	-171	-29.7	0	0	114.4	M1116 T1117	M1116-Q1119 PolarHBondContact O-N 2.78Å; T1117-Q1119 VanDerWaalsContact C-N 3.33Å
1120	Q	31.7	Very low	34.7	Very low	163 Å²	163	127.9 Å²	127.9	76%	0.762	66%	0.664	S	S	*	*	S	Bend	trans	-129.3	17.8	-177.3	-74.6	-170.7	-21.4	0	0	115.4
1121	Q	30.4	Very low	34	Very low	172 Å²	172	130.8 Å²	130.8	80%	0.804	68%	0.675	S	S	*	*			trans	-121.5	65.2	175.1	-73.9	-170.9	-22.6	0	0	113.1
1122	Q	31.9	Very low	33.5	Very low	198 Å²	198	131.4 Å²	131.4	93%	0.925	68%	0.677	S	S	*	*			trans	-146.9	103.4	152.9	-101.9	172.4	2.3	0	0	108.3
1123	Q	32.3	Very low	33.1	Very low	183 Å²	183	136.4 Å²	136.4	86%	0.855	70%	0.695	S	S	*	*			trans	-120.7	171.8	171.3	-63.2	179.8	-41.4	0	0	107.8
1124	P	32.1	Very low	32.8	Very low	104 Å²	104	139.6 Å²	139.6	68%	0.675	72%	0.716	S	S	*	*				-121.1	159.7	-58	36.1	-23.7	0	0	0	110.8	P1126	P1124-P1126 WeakPolarHBondContact O-CD 3.47Å
1125	P	30	Very low	32.4	Very low	129 Å²	129	144.7 Å²	144.7	84%	0.838	73%	0.733	S	S	*	*			trans	-77.1	130.2	180	30	-33.6	0	0	0	113
1126	P	34.2	Very low	32.3	Very low	121 Å²	121	144.1 Å²	144.1	79%	0.786	74%	0.737	S	S	*	*			trans	-80.5	162.8	167.1	-11.6	29.6	0	0	0	113	P1124	P1124-P1126 WeakPolarHBondContact O-CD 3.47Å
1127	P	29.4	Very low	31.8	Very low	111 Å²	111	142.7 Å²	142.7	72%	0.721	74%	0.741	S	S	*	*			trans	-103.2	-179.3	-169.2	39.8	-35.8	0	0	0	115.5
1128	Q	33.2	Very low	31.2	Very low	168 Å²	168	146 Å²	146	79%	0.785	76%	0.755	S	S	*	*			trans	87.2	138	170.7	-54.7	179.7	8.9	0	0	115.2
1129	Q	31.6	Very low	30.6	Very low	141 Å²	141	142.9 Å²	142.9	66%	0.659	75%	0.75	S	S	*	*			cis	-161	151.4	-1.1	-122.1	174.2	9	0	0	111.2
1130	Q	29.9	Very low	30.3	Very low	154 Å²	154	142.5 Å²	142.5	72%	0.72	75%	0.748	S	S	*	*			trans	65.9	145	156.2	-62.2	173	-1.9	0	0	118
1131	Q	28.9	Very low	30.1	Very low	140 Å²	140	142.3 Å²	142.3	65%	0.654	75%	0.747	S	S	*	*			cis	-159.1	144.2	-1.3	-125.2	173.2	-27.1	0	0	111.9
1132	H	30.8	Very low	29.8	Very low	145 Å²	145	142 Å²	142	67%	0.671	74%	0.743	S	S	*	*			trans	60.1	144.9	154.4	-61	-38.8	0	0	0	120.1
1133	Q	28.7	Very low	29.6	Very low	159 Å²	159	143.5 Å²	143.5	74%	0.743	74%	0.74	S	S	*	*			cis	-156.5	137.8	3.2	-131.6	167.5	-30.8	0	0	111.8
1134	V	30.4	Very low	29.3	Very low	119 Å²	119	140 Å²	140	72%	0.721	74%	0.736	S	S	*	*			trans	55.2	135.8	132.2	161.8	0	0	0	0	120.4
1135	Q	29	Very low	29.3	Very low	172 Å²	172	140.5 Å²	140.5	80%	0.804	74%	0.739	S	S	*	*			cis	-172.4	-172	-16.2	-127.4	-169.2	-14.9	0	0	108.8
1136	P	33.2	Very low	29.2	Very low	101 Å²	101	140.5 Å²	140.5	66%	0.656	74%	0.737	S	S	*	*				-134.7	-149.8	-129.6	44.2	-21.8	0	0	0	115.2
1137	S	27.3	Very low	29	Very low	104 Å²	104	140.4 Å²	140.4	73%	0.727	73%	0.734	S	S	*	*			trans	90.3	148.6	155.4	85.7	0	0	0	0	117.7
1138	L	27.5	Very low	28.7	Very low	154 Å²	154	142.5 Å²	142.5	81%	0.806	74%	0.739	S	S	*	*			cis	-156.1	151.9	-8.7	-145.9	73.7	0	0	0	111.7
1139	S	24.9	Very low	28.4	Very low	87 Å²	87	142.1 Å²	142.1	61%	0.608	74%	0.742	S	S	*	*			trans	11	145	149.5	66.4	0	0	0	0	121.7
1140	Q	29.5	Very low	28.2	Very low	167 Å²	167	141.1 Å²	141.1	78%	0.78	75%	0.745	S	S	*	*				-168.7	147.1	65.9	-79.1	-175.8	-3.4	0	0	114.3
1141	Q	26.6	Very low	28	Very low	159 Å²	159	145.7 Å²	145.7	74%	0.743	76%	0.756	S	S	*	*			trans	27.2	147.6	138.3	-50.2	-174.3	-4.5	0	0	121
1142	K	25.8	Very low	27.8	Very low	167 Å²	167	148.3 Å²	148.3	73%	0.726	77%	0.765	S	S	*	*			cis	-169.3	133.7	34.5	-154.5	172.2	-179.4	177.2	0	113.2
1143	W	26.4	Very low	27.6	Very low	229 Å²	229	152.6 Å²	152.6	87%	0.867	78%	0.777	S	S	*	*			trans	31.2	126.7	145.4	-57.7	59.1	0	0	0	119.8
1144	S	26.6	Very low	27.5	Very low	110 Å²	110	150.1 Å²	150.1	77%	0.769	78%	0.777	S	S	*	*				-169.8	166.8	70	-61.2	0	0	0	0	112.9
1145	P	32.4	Very low	27.4	Very low	113 Å²	113	151.8 Å²	151.8	73%	0.734	78%	0.781	S	S	*	*			trans	-120.4	-162.6	-155.2	44.3	-33.8	0	0	0	117
1146	T	27.5	Very low	27.2	Very low	129 Å²	129	147.8 Å²	147.8	79%	0.791	77%	0.77	S	S	*	*			trans	83.6	134.5	169.3	3.1	0	0	0	0	116
1147	V	29.2	Very low	26.9	Very low	119 Å²	119	149.9 Å²	149.9	72%	0.721	77%	0.774	S	S	*	*			cis	-133.3	137.9	10.7	179.5	0	0	0	0	111
1148	N	24.5	Very low	26.9	Very low	156 Å²	156	152.8 Å²	152.8	83%	0.834	77%	0.774	S	S	*	*			trans	-85.6	128.6	170.7	-101.1	-51.7	0	0	0	111.2
1149	L	26.8	Very low	27	Very low	160 Å²	160	149.5 Å²	149.5	84%	0.838	76%	0.764	S	S	*	*			trans	-131.6	24.3	175.3	-142.7	121.9	0	0	0	114.7
1150	T	27.4	Very low	27.1	Very low	120 Å²	120	150.2 Å²	150.2	74%	0.736	77%	0.765	S	S	*	*			trans	-142.1	82.1	-179.8	45.4	0	0	0	0	112.5
1151	R	24.9	Very low	27.1	Very low	250 Å²	250	148 Å²	148	94%	0.943	76%	0.758	S	S	*	*			trans	-178.5	86.5	158.8	-106.5	169.9	-170.5	-170.1	4.1	111.2
1152	K	24.7	Very low	27.3	Very low	194 Å²	194	145 Å²	145	84%	0.843	75%	0.75	S	S	*	*			trans	-157.8	25.1	167.7	-126.1	174.3	-173.5	-179	0	118.1
1153	Y	26.8	Very low	27.5	Very low	235 Å²	235	144.5 Å²	144.5	92%	0.922	75%	0.749	S	S	*	*			trans	-139.5	71.8	167.5	-70.5	-70	0	0	0	111.8
1154	S	26.2	Very low	27.6	Very low	107 Å²	107	138.2 Å²	138.2	75%	0.748	73%	0.729	S	S	*	*			trans	-108.8	90.9	162.6	57.1	0	0	0	0	108.5
1155	L	28.7	Very low	27.9	Very low	154 Å²	154	139.7 Å²	139.7	81%	0.806	72%	0.724	S	S	*	*			trans	-61.9	133.7	172	-80.4	157	0	0	0	109.4	I1157	L1155-I1157 PolarHBondContact O-N 3.22Å; L1155-I1157 VanDerWaalsContact O-N 3.11Å
1156	P	25.2	Very low	27.7	Very low	89 Å²	89	142 Å²	142	58%	0.578	72%	0.722	S	S	*	*			trans	-70	109.7	170.8	28.4	-31.6	0	0	0	108.9	K1158	P1156-K1158 VanDerWaalsContact C-N 3.26Å; P1156-K1158 PolarHBondContact O-N 2.99Å
1157	I	25.8	Very low	27.9	Very low	144 Å²	144	140.6 Å²	140.6	74%	0.738	71%	0.707	S	S	*	*			trans	-67.7	89.7	168	-59.6	173.7	0	0	0	107.4	L1155	L1155-I1157 PolarHBondContact O-N 3.22Å; L1155-I1157 VanDerWaalsContact O-N 3.11Å
1158	K	26.8	Very low	28	Very low	165 Å²	165	139.6 Å²	139.6	72%	0.717	70%	0.698	S	S	*	*			trans	-127.3	76.9	171	-87	-169.8	173.7	178.5	0	110.2	P1156	P1156-K1158 VanDerWaalsContact C-N 3.26Å; P1156-K1158 PolarHBondContact O-N 2.99Å
1159	S	29.7	Very low	28.2	Very low	85 Å²	85	142 Å²	142	59%	0.594	70%	0.697	S	S	*	*			trans	-178.5	47.3	144.4	40.1	0	0	0	0	112.2	N1161 V1162	S1159-N1161 PolarHBondContact O-N 2.7Å; S1159-V1162 PolarHBondContact O-N 3.33Å
1160	T	28.5	Very low	28.2	Very low	102 Å²	102	139.7 Å²	139.7	63%	0.626	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	11.4	161.4	4.5	0	0	0	0	113.8
1161	N	29.5	Very low	28.2	Very low	120 Å²	120	140.8 Å²	140.8	64%	0.642	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	-11.1	-179.6	-68.4	15.4	0	0	0	113.5	S1159 Q1165	S1159-N1161 PolarHBondContact O-N 2.7Å; N1161-Q1165 WeakPolarHBondContact O-CB 3.35Å; N1161-Q1165 PolarHBondContact O-N 2.87Å
1162	V	30.1	Very low	28.4	Very low	96 Å²	96	135.6 Å²	135.6	58%	0.582	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-26.7	179.6	-177	0	0	0	0	112.1	S1159	S1159-V1162 PolarHBondContact O-N 3.33Å
1163	F	28.8	Very low	28.8	Very low	158 Å²	158	132 Å²	132	69%	0.693	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-33.9	175.4	-147.6	-104.3	0	0	0	112	F1166 Q1167	F1163-F1166 PolarHBondContact O-N 2.86Å; F1163-Q1167 PolarHBondContact O-N 3.37Å
1164	Q	30.5	Very low	28.7	Very low	97 Å²	97	127.9 Å²	127.9	45%	0.453	66%	0.659	S	S	.	*	H	α-helix	trans	-65.6	-43.7	173.3	-149.8	72.3	26.2	0	0	111.6	F1166 Q1167 D1168	Q1164-F1166 PolarHBondContact O-N 2.85Å; Q1164-F1166 VanDerWaalsContact O-N 3.12Å; Q1164-Q1167 PolarHBondContact O-N 3.44Å; Q1164-D1168 PolarHBondContact O-N 3.43Å
1165	Q	31.1	Very low	28.8	Very low	140 Å²	140	129.3 Å²	129.3	65%	0.654	66%	0.658	S	S	*	*	H	α-helix	trans	-68	-10.9	179	-164.5	166.9	28.6	0	0	113.7	N1161	N1161-Q1165 WeakPolarHBondContact O-CB 3.35Å; N1161-Q1165 PolarHBondContact O-N 2.87Å
1166	F	28.8	Very low	28.7	Very low	162 Å²	162	128 Å²	128	71%	0.711	65%	0.651	S	S	*	*	H	α-helix	trans	-96.3	-16.4	170.2	-118.2	-86.5	0	0	0	113.5	F1163 Q1164	F1163-F1166 PolarHBondContact O-N 2.86Å; Q1164-F1166 PolarHBondContact O-N 2.85Å; Q1164-F1166 VanDerWaalsContact O-N 3.12Å
1167	Q	32.3	Very low	28.7	Very low	100 Å²	100	131.6 Å²	131.6	47%	0.467	66%	0.66	S	S	.	*	H	α-helix	trans	-95.9	-25.5	175.7	-74.7	-164.7	-23.2	0	0	113.4	F1163 Q1164 Y1169 L1170	F1163-Q1167 PolarHBondContact O-N 3.37Å; Q1164-Q1167 PolarHBondContact O-N 3.44Å; Q1167-Y1169 PolarHBondContact O-N 2.93Å; Q1167-L1170 PolarHBondContact O-N 3.38Å
1168	D	30.7	Very low	28.8	Very low	98 Å²	98	132 Å²	132	52%	0.524	66%	0.661	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.7	-5.7	175.4	-65.8	-31.6	0	0	0	113.4	Q1164 K1171	Q1164-D1168 PolarHBondContact O-N 3.43Å; D1168-K1171 IonicContact OD1-NZ 2.78Å
1169	Y	28.6	Very low	28.8	Very low	207 Å²	207	131 Å²	131	81%	0.812	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-4.1	171.2	-106	-86.5	0	0	0	114.3	Q1167	Q1167-Y1169 PolarHBondContact O-N 2.93Å
1170	L	27.1	Very low	28.6	Very low	110 Å²	110	134.3 Å²	134.3	58%	0.576	68%	0.675	S	S	*	*	S	Bend	trans	-131.2	33.3	-173.7	-77.7	166.8	0	0	0	112.9	D706 Q1167	D706-L1170 WeakPolarHBondContact OD2-CD2 3.35Å; Q1167-L1170 PolarHBondContact O-N 3.38Å
1171	K	26.5	Very low	28.6	Very low	143 Å²	143	134.4 Å²	134.4	62%	0.622	68%	0.677	S	S	*	*			trans	-113	83.1	169.7	-75.6	176.7	-178.2	162.1	0	110.6	D1168	D1168-K1171 IonicContact OD1-NZ 2.78Å
1172	I	29.1	Very low	28.5	Very low	142 Å²	142	140 Å²	140	73%	0.728	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-85.2	122.5	160.9	-61.2	175.4	0	0	0	107.1
1173	P	33.2	Very low	28.2	Very low	119 Å²	119	139.7 Å²	139.7	77%	0.773	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-88.2	116.4	177	32.3	-30.1	0	0	0	111.1	N1175	P1173-N1175 PolarHBondContact O-N 3.4Å
1174	D	26.1	Very low	27.9	Very low	148 Å²	148	138.4 Å²	138.4	79%	0.791	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-70.9	119.7	163.5	-76	-41.6	0	0	0	110
1175	N	28.6	Very low	27.6	Very low	136 Å²	136	140.5 Å²	140.5	73%	0.727	70%	0.702	S	S	*	*			trans	177.7	126.4	140.6	-97.5	-24.8	0	0	0	113.8	P1173	P1173-N1175 PolarHBondContact O-N 3.4Å
1176	I	25.7	Very low	27.2	Very low	128 Å²	128	142.7 Å²	142.7	66%	0.656	71%	0.705	S	S	*	*				62.1	132.3	124	-64.9	173.1	0	0	0	117.3
1177	Q	25.4	Very low	26.9	Very low	164 Å²	164	140.7 Å²	140.7	77%	0.766	70%	0.702	S	S	*	*			cis	-156.4	175.8	-1.1	-92	159	-1.4	0	0	104.9
1178	I	27.7	Very low	26.5	Very low	151 Å²	151	142.9 Å²	142.9	77%	0.774	71%	0.712	S	S	*	*				-178.6	155.3	68.1	-74.2	178.6	0	0	0	107.2
1179	N	26.9	Very low	26.2	Very low	145 Å²	145	142.2 Å²	142.2	78%	0.775	72%	0.715	S	S	*	*			trans	-63.6	154.8	-179.4	-48.5	-43.4	0	0	0	116.1
1180	D	25.5	Very low	26	Very low	155 Å²	155	140.5 Å²	140.5	83%	0.829	71%	0.712	S	S	*	*			trans	32.4	161.7	137.2	-88.2	-31.2	0	0	0	123.7
1181	P	29.1	Very low	25.9	Very low	103 Å²	103	141.3 Å²	141.3	67%	0.669	72%	0.717	S	S	*	*			cis	-130.1	164.1	-23.4	37	-22.8	0	0	0	112.4
1182	R	26.4	Very low	25.8	Very low	239 Å²	239	141.3 Å²	141.3	90%	0.902	72%	0.723	S	S	*	*			trans	-158.4	104.7	146.9	-114.1	167.7	-161.5	-172.5	4.9	112.3
1183	S	24.5	Very low	25.6	Very low	88 Å²	88	142.4 Å²	142.4	62%	0.615	72%	0.722	S	S	*	*			trans	-3.7	136.6	142.8	59.8	0	0	0	0	117.2
1184	N	23.2	Very low	25.2	Very low	132 Å²	132	146.4 Å²	146.4	71%	0.706	73%	0.728	S	S	*	*				49.3	138.5	122.8	-62	32.8	0	0	0	118.7
1185	E	23	Very low	25.1	Very low	140 Å²	140	146.4 Å²	146.4	65%	0.654	73%	0.728	S	S	*	*			cis	-174.1	169.1	9	-112.1	173.6	115.9	0	0	106.1
1186	Y	22.2	Very low	24.9	Very low	186 Å²	186	147.5 Å²	147.5	73%	0.729	73%	0.732	S	S	*	*			trans	42.7	117	145.9	-76.2	-110.4	0	0	0	120.1
1187	D	22.6	Very low	25	Very low	121 Å²	121	146 Å²	146	65%	0.647	73%	0.733	S	S	*	*				103.4	172.6	73.7	-163.2	7.6	0	0	0	110.3
1188	H	25.2	Very low	24.9	Very low	145 Å²	145	147.1 Å²	147.1	67%	0.671	74%	0.738	S	S	*	*			trans	71.3	82.1	161.9	-79	-60	0	0	0	120.5
1189	S	23.5	Very low	24.9	Very low	85 Å²	85	144.9 Å²	144.9	59%	0.594	74%	0.736	S	S	*	*				72.4	157.3	103.4	79.6	0	0	0	0	122.8
1190	K	25.2	Very low	24.9	Very low	171 Å²	171	144.7 Å²	144.7	74%	0.743	74%	0.735	S	S	*	*			trans	75.2	110.3	156.8	-67.8	175.3	-178	171.6	0	116.2
1191	D	24.3	Very low	24.8	Very low	126 Å²	126	143.8 Å²	143.8	67%	0.674	73%	0.729	S	S	*	*				91.4	146.6	97.1	-67	-27.1	0	0	0	109.3
1192	L	25.1	Very low	24.6	Very low	143 Å²	143	146.2 Å²	146.2	75%	0.749	73%	0.732	S	S	*	*			cis	-139.2	139.9	23	-91.4	90.5	0	0	0	112.5
1193	K	24.8	Very low	24.7	Very low	166 Å²	166	143 Å²	143	72%	0.722	72%	0.724	S	S	*	*				28.9	132.8	119.8	-59.6	169.6	176.7	168.6	0	119.7
1194	F	24.3	Very low	24.7	Very low	203 Å²	203	144.8 Å²	144.8	89%	0.89	73%	0.727	S	S	*	*				-139.5	119.2	121.2	-122.3	-81.1	0	0	0	112.2
1195	N	23.8	Very low	24.8	Very low	147 Å²	147	146.1 Å²	146.1	79%	0.786	73%	0.729	S	S	*	*			trans	-93	140.2	168.7	-93.2	-14.7	0	0	0	109.4
1196	I	25.2	Very low	25	Very low	159 Å²	159	148 Å²	148	82%	0.815	74%	0.738	S	S	*	*			trans	-145	125.1	147.7	-56.1	-177.2	0	0	0	104.9
1197	S	26.1	Very low	25.1	Very low	98 Å²	98	146.1 Å²	146.1	69%	0.685	74%	0.74	S	S	*	*			cis	-147.9	154.9	5	40.2	0	0	0	0	111.9
1198	Q	25.2	Very low	25.2	Very low	187 Å²	187	147.5 Å²	147.5	87%	0.874	75%	0.747	S	S	*	*			trans	12.3	126.2	148.7	-63.5	169.1	-17.2	0	0	117.3
1199	S	26.4	Very low	25.3	Very low	103 Å²	103	146.5 Å²	146.5	72%	0.72	75%	0.751	S	S	*	*				-164.4	143.6	75.4	32.8	0	0	0	0	113.9
1200	N	26.7	Very low	25.4	Very low	142 Å²	142	148.6 Å²	148.6	76%	0.759	76%	0.755	S	S	*	*			trans	49.4	105	154.1	-57.1	-12.2	0	0	0	118.8
1201	L	24.6	Very low	25.5	Very low	135 Å²	135	149.4 Å²	149.4	71%	0.707	76%	0.759	S	S	*	*				79.5	120.5	73.5	-90.5	151.5	0	0	0	113.1
1202	Q	24.8	Very low	25.7	Very low	155 Å²	155	148.3 Å²	148.3	72%	0.724	76%	0.759	S	S	*	*			trans	52.9	128	148.8	-75.8	174.1	-18.6	0	0	116.3
1203	K	27.2	Very low	25.7	Very low	171 Å²	171	149 Å²	149	74%	0.743	76%	0.763	S	S	*	*			cis	179.9	141	48.5	-131.4	162.3	-170.2	-178.6	0	105.5
1204	N	24.4	Very low	25.8	Very low	125 Å²	125	149 Å²	149	67%	0.668	77%	0.769	S	S	*	*				25.3	112.4	93.3	-83.3	47.6	0	0	0	112
1205	E	26.2	Very low	25.9	Very low	160 Å²	160	145.6 Å²	145.6	75%	0.748	77%	0.765	S	S	*	*			cis	-172.2	-178.9	44.1	-100.7	134.5	-160.6	0	0	108.9	N1207	E1205-N1207 PolarHBondContact O-N 2.84Å
1206	E	26.8	Very low	26	Very low	179 Å²	179	145.9 Å²	145.9	84%	0.836	77%	0.767	S	S	*	*			trans	-48.4	123	169.2	-57.8	165	138.7	0	0	112
1207	N	24.7	Very low	26.2	Very low	147 Å²	147	145 Å²	145	79%	0.786	76%	0.764	S	S	*	*				172.9	147	128.6	-94.4	-61.9	0	0	0	113.7	E1205	E1205-N1207 PolarHBondContact O-N 2.84Å
1208	L	24.5	Very low	26.3	Very low	150 Å²	150	147.1 Å²	147.1	79%	0.785	77%	0.768	S	S	*	*			trans	65.4	106.8	165.3	-87	78.2	0	0	0	121.7
1209	V	27.1	Very low	26.4	Very low	125 Å²	125	144.2 Å²	144.2	76%	0.758	77%	0.767	S	S	*	*				69	128.6	122.1	179.4	0	0	0	0	121.5
1210	D	26	Very low	26.4	Very low	129 Å²	129	144.5 Å²	144.5	69%	0.69	77%	0.766	S	S	*	*			trans	88.3	100.9	157.4	-88.8	-24.5	0	0	0	123
1211	K	27.8	Very low	26.5	Very low	187 Å²	187	144 Å²	144	81%	0.813	77%	0.767	S	S	*	*			trans	84.5	153.2	136.3	-76.1	174.1	-178.5	162.3	0	121.6
1212	P	28	Very low	26.5	Very low	104 Å²	104	143.7 Å²	143.7	68%	0.675	76%	0.761	S	S	*	*			trans	-118.7	160.2	-145.4	41.7	-31.3	0	0	0	115.9
1213	N	25.3	Very low	26.7	Very low	156 Å²	156	142.3 Å²	142.3	83%	0.834	76%	0.763	S	S	*	*			trans	161.5	102	132.5	-84.9	-24.3	0	0	0	112.9
1214	I	26.1	Very low	26.7	Very low	166 Å²	166	142.7 Å²	142.7	85%	0.851	77%	0.772	S	S	*	*			trans	-149.3	146.3	164.9	-14.6	178.5	0	0	0	104.1
1215	T	27.8	Very low	26.6	Very low	132 Å²	132	149.2 Å²	149.2	81%	0.81	80%	0.799	S	S	*	*			cis	-148.9	150.5	29.3	44.3	0	0	0	0	113.1
1216	N	25.2	Very low	26.7	Very low	154 Å²	154	148.7 Å²	148.7	82%	0.824	80%	0.801	S	S	*	*			trans	-140.3	115.7	161	-165.9	11	0	0	0	107.5
1217	N	30.2	Very low	26.7	Very low	140 Å²	140	147.1 Å²	147.1	75%	0.749	80%	0.799	S	S	*	*			trans	175.5	116.7	158.8	-94.5	-27.8	0	0	0	113.1
1218	N	28.2	Very low	26.8	Very low	143 Å²	143	147.1 Å²	147.1	77%	0.765	80%	0.8	S	S	*	*			trans	40.9	110.9	134.2	-54.2	-17.5	0	0	0	121
1219	C	26.3	Very low	26.9	Very low	126 Å²	126	146.9 Å²	146.9	85%	0.851	80%	0.801	S	S	*	*				-152.5	139.4	123.8	-115.3	0	0	0	0	110
1220	P	26	Very low	26.9	Very low	109 Å²	109	148.3 Å²	148.3	71%	0.708	80%	0.804	S	S	*	*			trans	-86.9	143	-177.2	34.3	-33.4	0	0	0	111.7
1221	V	29.4	Very low	26.9	Very low	130 Å²	130	149.5 Å²	149.5	79%	0.788	81%	0.811	S	S	*	*			trans	-121.8	111.9	167.9	178.1	0	0	0	0	108.2	T1223	V1221-T1223 HydrophobicContact CG1-CG2 4.47Å
1222	F	24.7	Very low	26.9	Very low	129 Å²	129	146.9 Å²	146.9	57%	0.566	81%	0.811	S	S	*	*			trans	-78.6	130.3	165.6	-81.8	-90.1	0	0	0	109.3	T692	T692-F1222 HydrophobicContact CG2-CE1 4.11Å
1223	T	29	Very low	26.8	Very low	126 Å²	126	150.2 Å²	150.2	77%	0.773	82%	0.822	S	S	*	*			trans	-124.8	129.7	158.4	44.9	0	0	0	0	107.3	V1221	V1221-T1223 HydrophobicContact CG1-CG2 4.47Å
1224	L	26	Very low	26.9	Very low	180 Å²	180	149.7 Å²	149.7	94%	0.942	82%	0.82	S	S	*	*			trans	-71.6	130.4	-173.3	-75.4	81.3	0	0	0	111.9
1225	E	24.1	Very low	27	Very low	261 Å²	261	148.2 Å²	148.2	100%	1.22	82%	0.818	S	S	*	*				-151.6	0	128.3	-144.4	170.9	-146.8	0	0	109.6

Retrieved 1,225 of 1,225 residues in 259.9 ms (Link to these results)

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