X5D7B2_HUMAN Loading...

Ca++-dependent secretion activator 2 isoform F

AlphaFold DB , UniProt , Accession X5D7B2, Species HUMAN (Homo sapiens, Human), Gene CADPS2, Length 1,250 aa.

						>X5D7B2_HUMAN|X5D7B2|CADPS2
MLDPSSSEEESDEGLEEESRDVLVAAGSSQRAPPAPTREGRRDAPGRAGGGGAARSVSPSPSVLSEGRDEPQRQLDDEQERRIRLQLYVFVVRCIAYPFNAKQPTDMARRQQKLNKQQLQLLKERFQAFLNGETQIVADEAFCNAVRSYYEVFLKSDRVARMVQSGGCSANDFREVFKKNIEKRVRSLPEIDGLSKETVLSSWIAKYDAIYRGEEDLCKQPNRMALSAVSELILSKEQLYEMFQQILGIKKLEHQLLYNACQLDNADEQAAQIRRELDGRLQLADKMAKERKFPKFIAKDMENMYIEELRSSVNLLMANLESLPVSKGGPEFKLQKLKRSQNSAFLDIGDENEIQLSKSDVVLSFTLEIVIMEVQGLKSVAPNRIVYCTMEVEGEKLQTDQAEASRPQWGTQGDFTTTHPRPVVKVKLFTESTGVLALEDKELGRVILYPTSNSSKSAELHRMVVPKNSQDSDLKIKLAVRMDKPAHMKHSGYLYALGQKVWKRWKKRYFVLVQVSQYTFAMCSYREKKSEPQELMQLEGYTVDYTDPHPGLQGGCMFFNAVKEGDTVIFASDDEQDRILWVQAMYRATGQSYKPVPAIQTQKLNPKGGTLHADAQLYADRFQKHGMDEFISANPCKLDHAFLFRILQRQTLDHRLNDSYSCLGWFSPGQVFVLDEYCARYGVRGCHRHLCYLAELMEHSENGAVIDPTLLHYSFAFCASHVHGNRPDGIGTVSVEEKERFEEIKERLSSLLENQISHFRYCFPFGRPEGALKATLSLLERVLMKDIATPIPAEEVKKVVRKCLEKAALINYTRLTEYAKIEETMNQASPARKLEEILHLAELCIEVLQQNEEHHAEAFAWWPDLLAEHAEKFWALFTVDMDTALEAQPQDSWDSFPLFQLLNNFLRNDTLLCNGKFHKHLQEIFVPLVVRYVDLMESSIAQSIHRGFEQETWQPVNNGSATSEDLFWKLDALQMFVFDLHWPEQEFAHHLEQRLKLMASDMLEACVKRTRTAFELKLQKASKTTDLRIPASVCTMFNVLVDAKKQSTKLCALDGGQEQQYHSKIDDLIDNSVKEIISLLVSKFVSVLEGVLSKLSRYDEGTFFSSILSFTVKAAAKYVDVPKPGMDLADTYIMFVRQNQDILREKVNEEMYIEKLFDQWYSSSMKVICVWLTDRLDLQLHIYQLKTLIKIVKKTYRDFRLQGVLEGTLNSKTYDTVHRRLTVEEATASVSEGGGLQGITMKDSDEEEEG
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.4	Very low	31	Very low	234 Å²	234	149 Å²	149	100%	1.153	83%	0.825	S	S	*	*				0	116.2	0	-164.5	175.1	-175.4	0	0	105
2	L	30	Very low	30.7	Very low	164 Å²	164	149.3 Å²	149.3	86%	0.859	82%	0.824	S	S	*	*			trans	55.4	81.4	178	-59.8	175.6	0	0	0	117.9
3	D	38.1	Very low	30.3	Very low	153 Å²	153	152.5 Å²	152.5	82%	0.818	83%	0.83	S	S	*	*				-77.6	168.2	123.1	-89.6	-49	0	0	0	108.4
4	P	46.3	Very low	30	Very low	112 Å²	112	146 Å²	146	73%	0.727	82%	0.816	S	S	*	*			cis	-135.1	-173.4	28.1	42.3	-22.5	0	0	0	114.5
5	S	24.5	Very low	29.9	Very low	109 Å²	109	147 Å²	147	76%	0.762	82%	0.818	S	S	*	*				168.3	163.1	87.1	-179.8	0	0	0	0	110.2
6	S	27.5	Very low	29.6	Very low	98 Å²	98	147.9 Å²	147.9	69%	0.685	81%	0.814	S	S	*	*			cis	167.9	142.6	-33.5	-149.1	0	0	0	0	105.7
7	S	30.5	Very low	29.4	Very low	93 Å²	93	149.6 Å²	149.6	65%	0.65	82%	0.815	S	S	*	*			cis	-167.7	167.6	-12.7	31.5	0	0	0	0	108.3
8	E	29.1	Very low	29.3	Very low	195 Å²	195	148.4 Å²	148.4	91%	0.911	80%	0.803	S	S	*	*			trans	-90.8	150.3	157.2	-65.4	-176.5	132.7	0	0	109.2
9	E	28	Very low	29	Very low	180 Å²	180	144.4 Å²	144.4	84%	0.841	79%	0.787	S	S	*	*			trans	-125.3	137.5	168.5	-65	178.9	156.5	0	0	106.4
10	E	28.1	Very low	28.9	Very low	186 Å²	186	146.9 Å²	146.9	87%	0.869	78%	0.784	S	S	*	*			cis	119.7	120.3	20.5	-104.3	-164.6	179.4	0	0	111.5
11	S	24.6	Very low	28.8	Very low	115 Å²	115	145.8 Å²	145.8	80%	0.804	78%	0.779	S	S	*	*			trans	171.2	111.7	156.8	22.7	0	0	0	0	106.5
12	D	27.4	Very low	28.5	Very low	152 Å²	152	140.8 Å²	140.8	81%	0.813	76%	0.761	S	S	*	*			cis	71.8	133.4	38.9	-153.2	37.9	0	0	0	112
13	E	25.7	Very low	28.3	Very low	191 Å²	191	140 Å²	140	89%	0.893	76%	0.756	S	S	*	*			cis	-100.7	177.8	3.2	-57.5	168.1	98.2	0	0	112.7
14	G	26.3	Very low	27.7	Very low	62 Å²	62	139 Å²	139	64%	0.639	76%	0.756	S	S	*	*			cis	152.6	130.7	-12.1	0	0	0	0	0	115.4
15	L	27.6	Very low	26.8	Very low	161 Å²	161	137.6 Å²	137.6	84%	0.843	75%	0.753	S	S	*	*			trans	67.9	154.1	155.2	-50	176.1	0	0	0	119.6
16	E	25.5	Very low	26.8	Very low	162 Å²	162	137.7 Å²	137.7	76%	0.757	76%	0.761	S	S	*	*			cis	-154.1	-178.7	3.1	-137.5	159.2	-134	0	0	115
17	E	27.2	Very low	26.7	Very low	177 Å²	177	136 Å²	136	83%	0.827	76%	0.759	S	S	*	*			trans	-73.1	-171.3	-166.1	-47.7	177.2	124.9	0	0	117.9
18	E	26	Very low	26.4	Very low	128 Å²	128	137.3 Å²	137.3	60%	0.598	77%	0.768	S	S	*	*			cis	-145.8	-168	-6.7	-144.7	-142.4	161.8	0	0	106.5	R20	E18-R20 IonicContact OE1-CZ 3.66Å; E18-R20 VanDerWaalsContact OE1-CZ 3.28Å; E18-R20 IonicContact OE1-NE 3Å; E18-R20 PolarHBondContact OE1-NE 2.8Å; E18-R20 IonicContact OE1-NH2 2.68Å; E18-R20 PolarHBondContact OE1-NH2 3.25Å; E18-R20 IonicContact OE2-CZ 3.6Å; E18-R20 IonicContact OE2-NE 2.62Å; E18-R20 IonicContact OE2-NH2 3.52Å
19	S	24.5	Very low	26.3	Very low	72 Å²	72	132.9 Å²	132.9	50%	0.503	76%	0.759	S	S	.	*			cis	-163.9	158.2	10.2	-161.6	0	0	0	0	112
20	R	27.8	Very low	26.3	Very low	194 Å²	194	132.5 Å²	132.5	73%	0.732	76%	0.757	S	S	*	*			trans	26.2	147.4	141.2	-65.5	165.7	-140.1	-173.5	5.7	122.3	E18	E18-R20 IonicContact OE1-CZ 3.66Å; E18-R20 VanDerWaalsContact OE1-CZ 3.28Å; E18-R20 IonicContact OE1-NE 3Å; E18-R20 PolarHBondContact OE1-NE 2.8Å; E18-R20 IonicContact OE1-NH2 2.68Å; E18-R20 PolarHBondContact OE1-NH2 3.25Å; E18-R20 IonicContact OE2-CZ 3.6Å; E18-R20 IonicContact OE2-NE 2.62Å; E18-R20 IonicContact OE2-NH2 3.52Å
21	D	27	Very low	26.2	Very low	124 Å²	124	133.9 Å²	133.9	66%	0.663	75%	0.754	S	S	*	*			cis	-157.4	-160.6	4.1	-128.2	-61	0	0	0	107.9
22	V	26.1	Very low	26.2	Very low	129 Å²	129	132.8 Å²	132.8	78%	0.782	75%	0.752	S	S	*	*			cis	-147	149	18.6	-167	0	0	0	0	112.6
23	L	27.2	Very low	27.4	Very low	146 Å²	146	131 Å²	131	76%	0.764	75%	0.749	S	S	*	*			trans	-33.5	169.9	154.7	-47.2	176.5	0	0	0	117.7
24	V	25.7	Very low	28.1	Very low	133 Å²	133	128 Å²	128	81%	0.806	75%	0.746	S	S	*	*			cis	-178.8	168.8	-8.7	131.1	0	0	0	0	107.8
25	A	26.7	Very low	27.9	Very low	82 Å²	82	129.3 Å²	129.3	68%	0.678	75%	0.751	S	S	*	*			cis	-175.5	171.1	-47	0	0	0	0	0	109.7
26	A	25.3	Very low	28.8	Very low	112 Å²	112	126.9 Å²	126.9	93%	0.926	75%	0.745	S	S	*	*			trans	67.6	155.7	172.2	0	0	0	0	0	118.9
27	G	24.2	Very low	28.8	Very low	62 Å²	62	125 Å²	125	64%	0.639	74%	0.744	S	S	*	*			cis	161.8	152	-11.1	0	0	0	0	0	114.3
28	S	24.6	Very low	28.8	Very low	120 Å²	120	126 Å²	126	84%	0.839	74%	0.741	S	S	*	*			trans	54.6	158.5	159.3	55.1	0	0	0	0	121.4
29	S	26.6	Very low	28.7	Very low	103 Å²	103	127.3 Å²	127.3	72%	0.72	75%	0.747	S	S	*	*			cis	-173	167.8	-24.2	-85.4	0	0	0	0	110.7
30	Q	28.4	Very low	28.7	Very low	172 Å²	172	127.2 Å²	127.2	80%	0.804	76%	0.757	S	S	*	*			trans	71.7	157.7	159.6	-69.7	-172.1	48.2	0	0	119.6
31	R	25.6	Very low	28.6	Very low	214 Å²	214	128.4 Å²	128.4	81%	0.808	76%	0.761	S	S	*	*			cis	-173.3	131	-24.7	178.5	173.7	-168.1	-178.6	4.2	113.4
32	A	25.6	Very low	28.6	Very low	93 Å²	93	132 Å²	132	77%	0.769	77%	0.766	S	S	*	*			trans	74.5	160.5	153	0	0	0	0	0	122.6
33	P	52.8	Low	28.7	Very low	115 Å²	115	132.8 Å²	132.8	75%	0.747	77%	0.765	S	S	*	*			trans	-118.8	-168.9	-165.2	45	-30.8	0	0	0	114.7
34	P	38.9	Very low	28.7	Very low	127 Å²	127	130 Å²	130	83%	0.825	76%	0.764	S	S	*	*				-148.4	-167.9	88.8	39.9	-20.1	0	0	0	116.1
35	A	23.5	Very low	29.5	Very low	89 Å²	89	130.2 Å²	130.2	74%	0.736	77%	0.768	S	S	*	*			trans	-111.4	-160.5	-175.5	0	0	0	0	0	111.5
36	P	46	Very low	29.5	Very low	110 Å²	110	130 Å²	130	71%	0.714	77%	0.773	S	S	*	*			cis	-145.5	-164	-0.5	42.4	-19.9	0	0	0	117.6
37	T	25.9	Very low	29.6	Very low	123 Å²	123	136.6 Å²	136.6	76%	0.755	77%	0.774	S	S	*	*			trans	87.8	132	146.2	41	0	0	0	0	126.4
38	R	25.7	Very low	29.8	Very low	198 Å²	198	138.7 Å²	138.7	75%	0.747	79%	0.786	S	S	*	*			trans	85.2	127.5	138.3	-76.9	179.2	100.3	132.5	14.3	124
39	E	24.5	Very low	29.9	Very low	156 Å²	156	137 Å²	137	73%	0.729	79%	0.787	S	S	*	*			trans	55.8	147.2	137.4	-66.2	160.4	175.3	0	0	121.1
40	G	24.9	Very low	29.9	Very low	69 Å²	69	136.3 Å²	136.3	71%	0.711	80%	0.796	S	S	*	*			cis	164.1	137	-11.8	0	0	0	0	0	115.5
41	R	26.1	Very low	29.8	Very low	220 Å²	220	132.2 Å²	132.2	83%	0.83	80%	0.8	S	S	*	*			trans	62.5	141.1	159.4	-83.6	-177	171.2	177.8	-0.7	122
42	R	27.1	Very low	29.8	Very low	200 Å²	200	126 Å²	126	76%	0.755	80%	0.802	S	S	*	*			trans	73.2	152	151.1	-76	-176.6	-172.2	170.2	0.1	117.6
43	D	27.7	Very low	29.9	Very low	144 Å²	144	126.2 Å²	126.2	77%	0.77	80%	0.804	S	S	*	*			cis	-141.1	174.8	3.4	-101.6	-38.3	0	0	0	112.4
44	A	27.4	Very low	28.9	Very low	89 Å²	89	125.1 Å²	125.1	74%	0.736	81%	0.805	S	S	*	*			trans	-97.9	177.3	168.8	0	0	0	0	0	110.2
45	P	41.3	Very low	28.3	Very low	137 Å²	137	131 Å²	131	89%	0.89	81%	0.811	S	S	*	*			cis	-142.4	-174.9	20.8	43.7	-23.4	0	0	0	116.9
46	G	26.4	Very low	28.4	Very low	77 Å²	77	132.3 Å²	132.3	79%	0.794	82%	0.815	S	S	*	*			trans	-174.1	157	171	0	0	0	0	0	113.1
47	R	28.2	Very low	27.7	Very low	250 Å²	250	133.7 Å²	133.7	94%	0.943	82%	0.821	S	S	*	*			trans	-137.2	138.6	-169.9	-132.7	-175.7	-174.5	-176.8	1.2	113.4
48	A	27.5	Very low	27.8	Very low	107 Å²	107	133.1 Å²	133.1	88%	0.884	82%	0.822	S	S	*	*			trans	67.6	152.6	155.5	0	0	0	0	0	120.1
49	G	27.2	Very low	28.6	Very low	84 Å²	84	129.5 Å²	129.5	87%	0.866	82%	0.824	S	S	*	*			trans	127.4	115.3	174	0	0	0	0	0	112.4
50	G	26.3	Very low	28.8	Very low	88 Å²	88	127.6 Å²	127.6	91%	0.907	83%	0.828	S	S	*	*			trans	-114.9	167.6	177.3	0	0	0	0	0	112.7
51	G	26.9	Very low	29.4	Very low	86 Å²	86	129.9 Å²	129.9	89%	0.887	83%	0.83	S	S	*	*			trans	122.5	118.7	-178.3	0	0	0	0	0	110.8
52	G	26	Very low	29.6	Very low	83 Å²	83	124.8 Å²	124.8	86%	0.856	83%	0.829	S	S	*	*			trans	-123.2	156.1	-172.7	0	0	0	0	0	113.7
53	A	27.9	Very low	30.2	Very low	98 Å²	98	121.2 Å²	121.2	81%	0.81	83%	0.828	S	S	*	*			trans	-158.1	123.2	164.5	0	0	0	0	0	111.8
54	A	30.6	Very low	30.7	Very low	93 Å²	93	122.6 Å²	122.6	77%	0.769	84%	0.835	S	S	*	*			trans	32.1	152.8	147	0	0	0	0	0	124
55	R	27.6	Very low	31.2	Very low	250 Å²	250	124 Å²	124	94%	0.943	84%	0.84	S	S	*	*			trans	85.1	147.9	170.3	-55.7	177.5	172.7	165.3	-2.4	114.6
56	S	25.5	Very low	31.1	Very low	117 Å²	117	122.6 Å²	122.6	82%	0.818	82%	0.821	S	S	*	*			cis	-136.5	167.1	6	56	0	0	0	0	112.3
57	V	30	Very low	31.8	Very low	139 Å²	139	121.6 Å²	121.6	84%	0.842	81%	0.811	S	S	*	*			trans	-128.3	135.7	179.7	173.1	0	0	0	0	109.1
58	S	29.5	Very low	32.7	Very low	111 Å²	111	120.5 Å²	120.5	78%	0.776	81%	0.807	S	S	*	*			trans	145.1	154.3	151.6	-71.7	0	0	0	0	111.7
59	P	42.1	Very low	33.7	Very low	122 Å²	122	119.4 Å²	119.4	79%	0.792	79%	0.786	S	S	*	*			cis	-129.1	162.9	-22.7	36.1	-20.4	0	0	0	113.9
60	S	29	Very low	34.9	Very low	116 Å²	116	120.1 Å²	120.1	81%	0.811	77%	0.767	S	S	*	*			trans	-106.8	150.2	159.6	-61.4	0	0	0	0	109.7
61	P	36.4	Very low	36.5	Very low	116 Å²	116	119.6 Å²	119.6	75%	0.753	75%	0.748	S	S	*	*			trans	-86	158.1	-176.8	34	-35.5	0	0	0	114.5
62	S	31.5	Very low	38.1	Very low	114 Å²	114	121.6 Å²	121.6	80%	0.797	73%	0.734	S	S	*	*			trans	56.2	72.2	155.1	54.3	0	0	0	0	118.8
63	V	39.8	Very low	40	Very low	124 Å²	124	122.9 Å²	122.9	75%	0.752	71%	0.713	S	S	*	*			trans	-75.6	130.8	141.2	175	0	0	0	0	108
64	L	38.6	Very low	41.8	Very low	174 Å²	174	124.2 Å²	124.2	91%	0.911	70%	0.702	S	S	*	*			trans	-170.2	47	153.1	-110.3	171.5	0	0	0	114
65	S	36.8	Very low	43.6	Very low	119 Å²	119	125.5 Å²	125.5	83%	0.832	70%	0.696	S	S	*	*	S	Bend	trans	-154.7	-19.7	165.1	-163.1	0	0	0	0	116.6
66	E	39.5	Very low	45.8	Very low	106 Å²	106	117.9 Å²	117.9	50%	0.495	67%	0.674	S	S	.	*			trans	-94.1	-11.2	-169.2	-62.2	-160.6	84.6	0	0	115.9	R68 D69 R73	E66-R68 PolarHBondContact O-N 2.78Å; E66-D69 PolarHBondContact O-N 2.96Å; E66-D69 VanDerWaalsContact O-N 3.12Å; E66-R73 IonicContact OE1-CZ 3.88Å; E66-R73 IonicContact OE1-NH1 2.78Å; E66-R73 PolarHBondContact OE1-NH1 3.45Å; E66-R73 IonicContact OE1-NH2 3.28Å; E66-R73 PolarHBondContact OE1-NH2 2.95Å
67	G	41.6	Very low	48.4	Very low	57 Å²	57	117.7 Å²	117.7	59%	0.588	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	25.3	-168.3	0	0	0	0	0	117.7
68	R	46.8	Very low	50.9	Low	226 Å²	226	115 Å²	115	85%	0.853	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.1	-29.3	165.2	-79.8	-169.8	175.9	-175	0.6	113.4	E66	E66-R68 PolarHBondContact O-N 2.78Å
69	D	47.9	Very low	53.3	Low	85 Å²	85	115.6 Å²	115.6	46%	0.455	63%	0.632	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.4	-25.9	-175.9	-58.6	-13.6	0	0	0	112.7	E66 P71 Q72 R73	E66-D69 PolarHBondContact O-N 2.96Å; E66-D69 VanDerWaalsContact O-N 3.12Å; D69-P71 VanDerWaalsContact C-CD 3.48Å; D69-Q72 WeakPolarHBondContact O-CA 3.24Å; D69-Q72 PolarHBondContact O-N 3.25Å; D69-R73 HydrophobicContact CB-CG 4.39Å; D69-R73 WeakPolarHBondContact O-CG 3.48Å; D69-R73 PolarHBondContact O-N 2.92Å; D69-R73 IonicContact OD2-CZ 3.28Å; D69-R73 IonicContact OD2-NH2 2.95Å; D69-R73 PolarHBondContact OD2-NH2 3.15Å
70	E	53	Low	55.3	Low	98 Å²	98	112.8 Å²	112.8	46%	0.458	61%	0.609	S	S	.	*	H	α-helix	trans	-45.5	-49	-179.5	-70.4	-175.6	122.2	0	0	114.9	Q72 Q74	E70-Q72 VanDerWaalsContact C-N 3.29Å; E70-Q72 PolarHBondContact O-N 3.12Å; E70-Q74 WeakPolarHBondContact O-CB 3.44Å; E70-Q74 VanDerWaalsContact O-CG 3.24Å; E70-Q74 WeakPolarHBondContact O-CG 3.4Å; E70-Q74 PolarHBondContact O-N 3.08Å; E70-Q74 PolarHBondContact O-NE2 2.76Å
71	P	59.8	Low	58	Low	77 Å²	77	111.7 Å²	111.7	50%	0.5	59%	0.587	S	S	.	*	H	α-helix	trans	-69.5	-26	179.1	28.5	-36	0	0	0	113	D69 L75	D69-P71 VanDerWaalsContact C-CD 3.48Å; P71-L75 VanDerWaalsContact O-CG 3.32Å; P71-L75 WeakPolarHBondContact O-CG 3.32Å; P71-L75 PolarHBondContact O-N 3.38Å
72	Q	59.9	Low	60.4	Low	128 Å²	128	111.9 Å²	111.9	60%	0.598	57%	0.572	S	S	*	*	H	α-helix	trans	-79.6	-44.3	178.7	-168.4	159.1	-28.6	0	0	110.8	D69 E70 Q74 L75 D76	D69-Q72 WeakPolarHBondContact O-CA 3.24Å; D69-Q72 PolarHBondContact O-N 3.25Å; E70-Q72 VanDerWaalsContact C-N 3.29Å; E70-Q72 PolarHBondContact O-N 3.12Å; Q72-Q74 VanDerWaalsContact C-N 3.25Å; Q72-Q74 PolarHBondContact O-N 3.05Å; Q72-L75 WeakPolarHBondContact O-CB 3.47Å; Q72-L75 PolarHBondContact O-N 2.77Å; Q72-D76 PolarHBondContact O-N 3.41Å
73	R	65.9	Low	63.2	Low	111 Å²	111	108.3 Å²	108.3	42%	0.419	54%	0.544	S	S	.	.	H	α-helix	trans	-55	-41.2	170.4	-62.7	178.2	-162.4	169	9	111.5	E66 D69 D76 D77	E66-R73 IonicContact OE1-CZ 3.88Å; E66-R73 IonicContact OE1-NH1 2.78Å; E66-R73 PolarHBondContact OE1-NH1 3.45Å; E66-R73 IonicContact OE1-NH2 3.28Å; E66-R73 PolarHBondContact OE1-NH2 2.95Å; D69-R73 HydrophobicContact CB-CG 4.39Å; D69-R73 WeakPolarHBondContact O-CG 3.48Å; D69-R73 PolarHBondContact O-N 2.92Å; D69-R73 IonicContact OD2-CZ 3.28Å; D69-R73 IonicContact OD2-NH2 2.95Å; D69-R73 PolarHBondContact OD2-NH2 3.15Å; R73-D76 PolarHBondContact O-N 3.21Å; R73-D77 WeakPolarHBondContact O-CB 3.4Å; R73-D77 PolarHBondContact O-N 3.07Å
74	Q	66.9	Low	65.6	Low	126 Å²	126	106.1 Å²	106.1	59%	0.589	52%	0.522	S	S	*	.	H	α-helix	trans	-66.3	-34.7	176	-73.8	170.6	39.7	0	0	113.8	E70 Q72 E78	E70-Q74 WeakPolarHBondContact O-CB 3.44Å; E70-Q74 VanDerWaalsContact O-CG 3.24Å; E70-Q74 WeakPolarHBondContact O-CG 3.4Å; E70-Q74 PolarHBondContact O-N 3.08Å; E70-Q74 PolarHBondContact O-NE2 2.76Å; Q72-Q74 VanDerWaalsContact C-N 3.25Å; Q72-Q74 PolarHBondContact O-N 3.05Å; Q74-E78 PolarHBondContact O-N 3.15Å; Q74-E78 VanDerWaalsContact O-N 3.1Å
75	L	68.4	Low	68	Low	119 Å²	119	97.9 Å²	97.9	62%	0.623	48%	0.479	S	S	*	.	H	α-helix	trans	-70.2	-42.2	174.1	-75.7	165.7	0	0	0	111.3	P71 Q72 E78 Q79	P71-L75 VanDerWaalsContact O-CG 3.32Å; P71-L75 WeakPolarHBondContact O-CG 3.32Å; P71-L75 PolarHBondContact O-N 3.38Å; Q72-L75 WeakPolarHBondContact O-CB 3.47Å; Q72-L75 PolarHBondContact O-N 2.77Å; L75-E78 PolarHBondContact O-N 3.4Å; L75-Q79 WeakPolarHBondContact O-CB 3.34Å; L75-Q79 PolarHBondContact O-N 3.25Å
76	D	73.9	Confident	70.6	Confident	91 Å²	91	93.3 Å²	93.3	49%	0.487	44%	0.444	S	S	.	.	H	α-helix	trans	-64.3	-44.9	176.9	-65.5	-34.1	0	0	0	111.1	Q72 R73 E78 Q79 E80	Q72-D76 PolarHBondContact O-N 3.41Å; R73-D76 PolarHBondContact O-N 3.21Å; D76-E78 PolarHBondContact O-N 3.04Å; D76-Q79 PolarHBondContact O-N 2.96Å; D76-E80 PolarHBondContact O-N 3.34Å
77	D	79.7	Confident	73.1	Confident	112 Å²	112	88.2 Å²	88.2	60%	0.599	42%	0.421	S	S	*	.	H	α-helix	trans	-57.9	-42.8	172.9	-82.9	-23.6	0	0	0	112.3	R73 R81	R73-D77 WeakPolarHBondContact O-CB 3.4Å; R73-D77 PolarHBondContact O-N 3.07Å; D77-R81 WeakPolarHBondContact O-CB 3.47Å; D77-R81 PolarHBondContact O-N 3.25Å
78	E	80.9	Confident	75.5	Confident	83 Å²	83	85.5 Å²	85.5	39%	0.388	39%	0.393	S	S	.	.	H	α-helix	trans	-69.5	-40.8	178.1	-155.4	-160	124.9	0	0	111.4	Q74 L75 D76 R81 R82	Q74-E78 PolarHBondContact O-N 3.15Å; Q74-E78 VanDerWaalsContact O-N 3.1Å; L75-E78 PolarHBondContact O-N 3.4Å; D76-E78 PolarHBondContact O-N 3.04Å; E78-R81 PolarHBondContact O-N 3.38Å; E78-R82 WeakPolarHBondContact O-CG 3.37Å; E78-R82 PolarHBondContact O-N 3.2Å; E78-R82 IonicContact OE1-CZ 2.96Å; E78-R82 IonicContact OE1-NE 3.38Å; E78-R82 PolarHBondContact OE1-NE 3.04Å; E78-R82 IonicContact OE1-NH2 2.76Å; E78-R82 PolarHBondContact OE1-NH2 3.34Å
79	Q	81.4	Confident	77.6	Confident	124 Å²	124	74.8 Å²	74.8	58%	0.579	35%	0.352	S	S	*	.	H	α-helix	trans	-63.4	-43.2	176.5	-176	165.2	-64	0	0	111.3	L75 D76 R82 I83	L75-Q79 WeakPolarHBondContact O-CB 3.34Å; L75-Q79 PolarHBondContact O-N 3.25Å; D76-Q79 PolarHBondContact O-N 2.96Å; Q79-R82 PolarHBondContact O-N 2.97Å; Q79-I83 HydrophobicContact CG-CD1 4.23Å; Q79-I83 WeakPolarHBondContact O-CG1 3.48Å; Q79-I83 PolarHBondContact O-N 3.33Å
80	E	83.8	Confident	79.7	Confident	63 Å²	63	70.7 Å²	70.7	29%	0.294	33%	0.33	S	S	.	.	H	α-helix	trans	-65.4	-40.7	176	-144.3	-139.6	136.7	0	0	111.2	D76 R82 I83 R84 Q650	D76-E80 PolarHBondContact O-N 3.34Å; E80-R82 VanDerWaalsContact C-N 3.34Å; E80-R82 PolarHBondContact O-N 3.03Å; E80-I83 PolarHBondContact O-N 2.91Å; E80-I83 VanDerWaalsContact O-N 3.17Å; E80-R84 VanDerWaalsContact CD-NE 3.31Å; E80-R84 WeakPolarHBondContact O-CG 3.48Å; E80-R84 PolarHBondContact O-N 3.28Å; E80-R84 IonicContact OE1-CZ 3.33Å; E80-R84 VanDerWaalsContact OE1-CZ 3.22Å; E80-R84 IonicContact OE1-NE 2.64Å; E80-R84 PolarHBondContact OE1-NE 3.34Å; E80-R84 IonicContact OE1-NH2 2.65Å; E80-R84 PolarHBondContact OE1-NH2 3.22Å; E80-R84 IonicContact OE2-CZ 3.86Å; E80-R84 IonicContact OE2-NE 3.34Å; E80-R84 IonicContact OE2-NH2 3.82Å; E80-R84 PolarHBondContact OE2-NH2 2.72Å; E80-Q650 PolarHBondContact OE1-NE2 3.48Å; E80-Q650 VanDerWaalsContact OE1-NE2 3.13Å
81	R	85	Confident	81.6	Confident	92 Å²	92	66 Å²	66	35%	0.347	31%	0.309	S	S	.	.	H	α-helix	trans	-60.4	-40.2	173.1	176.3	173.1	161.8	-84.4	-3.4	112.3	D77 E78 I83 R84 L85 E253	D77-R81 WeakPolarHBondContact O-CB 3.47Å; D77-R81 PolarHBondContact O-N 3.25Å; E78-R81 PolarHBondContact O-N 3.38Å; R81-I83 VanDerWaalsContact C-N 3.35Å; R81-R84 PolarHBondContact O-N 3.29Å; R81-L85 HydrophobicContact CG-CD1 4.07Å; R81-L85 WeakPolarHBondContact O-CB 3.38Å; R81-L85 WeakPolarHBondContact O-CG 3.32Å; R81-L85 PolarHBondContact O-N 2.88Å; R81-E253 IonicContact CZ-OE1 2.68Å; R81-E253 IonicContact NE-OE1 2.8Å; R81-E253 PolarHBondContact NE-OE1 3.39Å; R81-E253 VanDerWaalsContact NE-OE1 3.15Å; R81-E253 IonicContact NH2-OE1 2.72Å; R81-E253 PolarHBondContact NH2-OE1 2.9Å
82	R	87.4	Confident	83	Confident	120 Å²	120	62.4 Å²	62.4	45%	0.453	29%	0.285	S	S	.	.	H	α-helix	trans	-62.1	-42.3	174.6	-71.9	173.7	-178.3	-132.8	10.2	111.1	E78 Q79 E80 L85 Q86 F630	E78-R82 WeakPolarHBondContact O-CG 3.37Å; E78-R82 PolarHBondContact O-N 3.2Å; E78-R82 IonicContact OE1-CZ 2.96Å; E78-R82 IonicContact OE1-NE 3.38Å; E78-R82 PolarHBondContact OE1-NE 3.04Å; E78-R82 IonicContact OE1-NH2 2.76Å; E78-R82 PolarHBondContact OE1-NH2 3.34Å; Q79-R82 PolarHBondContact O-N 2.97Å; E80-R82 VanDerWaalsContact C-N 3.34Å; E80-R82 PolarHBondContact O-N 3.03Å; R82-L85 PolarHBondContact O-N 2.88Å; R82-Q86 PolarHBondContact O-N 2.92Å; R82-F630 HydrophobicContact CB-CE1 4.2Å; R82-F630 HydrophobicContact CB-CZ 4.33Å; R82-F630 HydrophobicContact CG-CE1 4.5Å; R82-F630 HydrophobicContact CG-CZ 4.2Å
83	I	89.3	Confident	84.4	Confident	39 Å²	39	57 Å²	57	20%	0.2	26%	0.259	C	S	.	.	H	α-helix	trans	-63.4	-47.4	176	-68.8	164.7	0	0	0	111.3	Q79 E80 R81 L85 Q86 L87 L643 I646	Q79-I83 HydrophobicContact CG-CD1 4.23Å; Q79-I83 WeakPolarHBondContact O-CG1 3.48Å; Q79-I83 PolarHBondContact O-N 3.33Å; E80-I83 PolarHBondContact O-N 2.91Å; E80-I83 VanDerWaalsContact O-N 3.17Å; R81-I83 VanDerWaalsContact C-N 3.35Å; I83-L85 PolarHBondContact O-N 3.1Å; I83-Q86 PolarHBondContact O-N 2.68Å; I83-L87 HydrophobicContact CG2-CD1 4.36Å; I83-L87 WeakPolarHBondContact O-CB 3.3Å; I83-L87 PolarHBondContact O-N 3.33Å; I83-L643 HydrophobicContact CG2-CD2 3.82Å; I83-I646 HydrophobicContact CG2-CD1 3.88Å
84	R	90.6	Very high	85.5	Confident	79 Å²	79	51.8 Å²	51.8	30%	0.298	24%	0.239	S	C	.	.	H	α-helix	trans	-60.3	-41	176.9	-67.5	178.9	-166.1	-174.1	7.7	112.2	E80 R81 L87 Y88 L247 I249	E80-R84 VanDerWaalsContact CD-NE 3.31Å; E80-R84 WeakPolarHBondContact O-CG 3.48Å; E80-R84 PolarHBondContact O-N 3.28Å; E80-R84 IonicContact OE1-CZ 3.33Å; E80-R84 VanDerWaalsContact OE1-CZ 3.22Å; E80-R84 IonicContact OE1-NE 2.64Å; E80-R84 PolarHBondContact OE1-NE 3.34Å; E80-R84 IonicContact OE1-NH2 2.65Å; E80-R84 PolarHBondContact OE1-NH2 3.22Å; E80-R84 IonicContact OE2-CZ 3.86Å; E80-R84 IonicContact OE2-NE 3.34Å; E80-R84 IonicContact OE2-NH2 3.82Å; E80-R84 PolarHBondContact OE2-NH2 2.72Å; R81-R84 PolarHBondContact O-N 3.29Å; R84-L87 PolarHBondContact O-N 2.78Å; R84-Y88 PolarHBondContact O-N 2.8Å; R84-L247 WeakPolarHBondContact CD-O 3.46Å; R84-I249 HydrophobicContact CB-CD1 4.2Å
85	L	90.2	Very high	86.6	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-63.6	-45.9	174.6	-76.3	166.3	0	0	0	112.1	R81 R82 I83 L87 Y88 V89 I249 E253 L257 M627 F630	R81-L85 HydrophobicContact CG-CD1 4.07Å; R81-L85 WeakPolarHBondContact O-CB 3.38Å; R81-L85 WeakPolarHBondContact O-CG 3.32Å; R81-L85 PolarHBondContact O-N 2.88Å; R82-L85 PolarHBondContact O-N 2.88Å; I83-L85 PolarHBondContact O-N 3.1Å; L85-L87 VanDerWaalsContact C-N 3.34Å; L85-L87 PolarHBondContact O-N 2.9Å; L85-Y88 PolarHBondContact O-N 3.38Å; L85-V89 PolarHBondContact O-N 3.44Å; L85-V89 VanDerWaalsContact O-N 3.13Å; L85-I249 HydrophobicContact CD2-CD1 4.18Å; L85-I249 HydrophobicContact CD2-CG2 4.38Å; L85-I249 HydrophobicContact CG-CD1 4.49Å; L85-E253 HydrophobicContact CD2-CB 4.11Å; L85-L257 HydrophobicContact CD2-CD1 4.08Å; L85-M627 HydrophobicContact CD1-CE 4.14Å; L85-M627 HydrophobicContact CD2-CE 4.18Å; L85-M627 HydrophobicContact CD2-SD 4.31Å; L85-F630 HydrophobicContact CB-CD2 4.4Å; L85-F630 HydrophobicContact CB-CE1 4.47Å; L85-F630 HydrophobicContact CB-CE2 4.33Å; L85-F630 HydrophobicContact CB-CZ 4.36Å; L85-F630 HydrophobicContact CD1-CE2 4.1Å; L85-F630 HydrophobicContact CD1-CZ 4.28Å
86	Q	90.6	Very high	87.4	Confident	22 Å²	22	40.1 Å²	40.1	10%	0.103	18%	0.182	C	C	.	.	H	α-helix	trans	-63.4	-39.6	177.7	-173.7	60.5	86.2	0	0	112.1	R82 I83 V89 F90 F630 A633 L638	R82-Q86 PolarHBondContact O-N 2.92Å; I83-Q86 PolarHBondContact O-N 2.68Å; Q86-V89 PolarHBondContact O-N 3.31Å; Q86-F90 HydrophobicContact CG-CE2 3.79Å; Q86-F90 HydrophobicContact CG-CZ 4.3Å; Q86-F90 VanDerWaalsContact NE2-CZ 3.34Å; Q86-F90 VanDerWaalsContact O-CD2 3.25Å; Q86-F90 WeakPolarHBondContact O-CD2 3.44Å; Q86-F630 HydrophobicContact CB-CD1 3.99Å; Q86-F630 PolarHBondContact NE2-O 3.31Å; Q86-A633 VanDerWaalsContact OE1-CB 3.25Å; Q86-L638 HydrophobicContact CG-CD1 3.94Å
87	L	91.8	Very high	87.8	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-59.9	-45.9	171.4	-94.1	172.2	0	0	0	112	I83 R84 L85 V89 F90 V91 L247 L643 I646 L647 Y677	I83-L87 HydrophobicContact CG2-CD1 4.36Å; I83-L87 WeakPolarHBondContact O-CB 3.3Å; I83-L87 PolarHBondContact O-N 3.33Å; R84-L87 PolarHBondContact O-N 2.78Å; L85-L87 VanDerWaalsContact C-N 3.34Å; L85-L87 PolarHBondContact O-N 2.9Å; L87-V89 VanDerWaalsContact C-N 3.3Å; L87-V89 PolarHBondContact O-N 3.09Å; L87-F90 PolarHBondContact O-N 3.05Å; L87-F90 VanDerWaalsContact O-N 3.11Å; L87-V91 PolarHBondContact O-N 2.84Å; L87-L247 HydrophobicContact CB-CD1 3.91Å; L87-L643 HydrophobicContact CD2-CB 3.92Å; L87-L643 HydrophobicContact CG-CB 4.35Å; L87-L643 HydrophobicContact CG-CD2 4.25Å; L87-I646 HydrophobicContact CD1-CB 4.13Å; L87-I646 HydrophobicContact CD1-CG2 3.94Å; L87-L647 HydrophobicContact CD1-CB 4.33Å; L87-L647 HydrophobicContact CD2-CB 3.99Å; L87-L647 HydrophobicContact CD2-CD2 4.36Å; L87-Y677 HydrophobicContact CD2-CE2 4.15Å
88	Y	92.6	Very high	87.7	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63.5	-35.1	-178.6	-166	-117.1	0	0	0	112.3	R84 L85 F90 V91 V92 Y240 F243 Q244 L247 I249 H254 L257	R84-Y88 PolarHBondContact O-N 2.8Å; L85-Y88 PolarHBondContact O-N 3.38Å; Y88-F90 VanDerWaalsContact C-N 3.34Å; Y88-F90 PolarHBondContact O-N 3.11Å; Y88-V91 PolarHBondContact O-N 3.02Å; Y88-V92 HydrophobicContact CD1-CG2 3.74Å; Y88-V92 HydrophobicContact CD2-CG2 4.24Å; Y88-V92 HydrophobicContact CE1-CG2 3.41Å; Y88-V92 VanDerWaalsContact CE1-CG2 3.41Å; Y88-V92 HydrophobicContact CE2-CG2 3.96Å; Y88-V92 HydrophobicContact CG-CG2 4.15Å; Y88-V92 WeakPolarHBondContact O-CB 3.34Å; Y88-V92 VanDerWaalsContact O-CG2 3.23Å; Y88-V92 WeakPolarHBondContact O-CG2 3.22Å; Y88-V92 PolarHBondContact O-N 3.17Å; Y88-Y240 PolarHBondContact OH-O 3.47Å; Y88-Y240 VanDerWaalsContact OH-O 3.09Å; Y88-F243 HydrophobicContact CE2-CB 4.13Å; Y88-Q244 HydrophobicContact CE2-CB 4.33Å; Y88-L247 HydrophobicContact CD2-CD1 4.04Å; Y88-L247 HydrophobicContact CG-CD1 4.47Å; Y88-I249 HydrophobicContact CD1-CG1 4.16Å; Y88-I249 HydrophobicContact CD1-CG2 4.14Å; Y88-I249 HydrophobicContact CD2-CG1 4.17Å; Y88-I249 HydrophobicContact CE1-CG2 4.39Å; Y88-I249 HydrophobicContact CG-CG1 3.84Å; Y88-H254 HydrophobicContact CE1-CB 4.15Å; Y88-H254 AromaticContact CE1-ND1 3.75Å; Y88-H254 AromaticContact CZ-ND1 3.71Å; Y88-H254 PolarHBondContact OH-ND1 2.77Å; Y88-L257 HydrophobicContact CD1-CD1 4.13Å
89	V	90.9	Very high	87.6	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-56.6	-47.8	171.8	173.6	0	0	0	0	111.2	L85 Q86 L87 V92 R93 L257 F630	L85-V89 PolarHBondContact O-N 3.44Å; L85-V89 VanDerWaalsContact O-N 3.13Å; Q86-V89 PolarHBondContact O-N 3.31Å; L87-V89 VanDerWaalsContact C-N 3.3Å; L87-V89 PolarHBondContact O-N 3.09Å; V89-V92 PolarHBondContact O-N 2.57Å; V89-R93 VanDerWaalsContact O-CG 3.3Å; V89-R93 WeakPolarHBondContact O-CG 3.47Å; V89-R93 PolarHBondContact O-N 2.85Å; V89-L257 HydrophobicContact CG2-CD1 4.01Å; V89-L257 HydrophobicContact CG2-CD2 3.88Å; V89-L257 HydrophobicContact CG2-CG 4.43Å; V89-F630 HydrophobicContact CG2-CB 3.93Å
90	F	91.5	Very high	87.5	Confident	0 Å²	0	26 Å²	26	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-68	-37.4	-179.6	-62	-44.2	0	0	0	113	Q86 L87 Y88 R93 C94 P635 L638 H640 L643 Y677 Y681	Q86-F90 HydrophobicContact CG-CE2 3.79Å; Q86-F90 HydrophobicContact CG-CZ 4.3Å; Q86-F90 VanDerWaalsContact NE2-CZ 3.34Å; Q86-F90 VanDerWaalsContact O-CD2 3.25Å; Q86-F90 WeakPolarHBondContact O-CD2 3.44Å; L87-F90 PolarHBondContact O-N 3.05Å; L87-F90 VanDerWaalsContact O-N 3.11Å; Y88-F90 VanDerWaalsContact C-N 3.34Å; Y88-F90 PolarHBondContact O-N 3.11Å; F90-R93 PolarHBondContact O-N 3.02Å; F90-C94 PolarHBondContact O-N 3.13Å; F90-C94 VanDerWaalsContact O-N 3.16Å; F90-C94 PolarHBondContact O-SG 3.24Å; F90-P635 HydrophobicContact CE1-CB 4.16Å; F90-P635 HydrophobicContact CE1-CG 3.9Å; F90-P635 HydrophobicContact CZ-CB 4.48Å; F90-L638 HydrophobicContact CE2-CD1 3.59Å; F90-L638 HydrophobicContact CZ-CD1 3.58Å; F90-H640 AromaticContact CD2-CE1 3.92Å; F90-H640 AromaticContact CE2-CE1 3.91Å; F90-L643 HydrophobicContact CE2-CD1 4.44Å; F90-Y677 HydrophobicContact CB-CD2 4.32Å; F90-Y677 HydrophobicContact CB-CE2 3.7Å; F90-Y681 HydrophobicContact CB-CE2 3.8Å; F90-Y681 HydrophobicContact CD1-CE1 4.06Å; F90-Y681 AromaticContact CD1-CZ 3.86Å; F90-Y681 HydrophobicContact CG-CE2 4.38Å; F90-Y681 PolarHBondContact O-OH 2.96Å
91	V	92.3	Very high	87.1	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-64.9	-46.5	174	167.4	0	0	0	0	111.7	L87 Y88 R93 C94 I95 F243 L647 V673 Y677	L87-V91 PolarHBondContact O-N 2.84Å; Y88-V91 PolarHBondContact O-N 3.02Å; V91-R93 VanDerWaalsContact C-N 3.28Å; V91-R93 PolarHBondContact O-N 3.3Å; V91-C94 WeakPolarHBondContact O-CB 3.29Å; V91-C94 PolarHBondContact O-N 3.25Å; V91-C94 VanDerWaalsContact O-N 3.11Å; V91-I95 HydrophobicContact CG1-CD1 3.82Å; V91-I95 WeakPolarHBondContact O-CG1 3.49Å; V91-I95 PolarHBondContact O-N 3.11Å; V91-F243 HydrophobicContact CG1-CB 3.67Å; V91-F243 HydrophobicContact CG1-CD1 3.88Å; V91-F243 HydrophobicContact CG1-CD2 4.2Å; V91-F243 HydrophobicContact CG1-CG 3.64Å; V91-L647 HydrophobicContact CG2-CD1 3.88Å; V91-L647 HydrophobicContact CG2-CD2 3.85Å; V91-V673 HydrophobicContact CG1-CG1 3.93Å; V91-Y677 HydrophobicContact CG2-CD2 4.41Å
92	V	90.8	Very high	86.7	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-58.9	-40.4	176	168.3	0	0	0	0	110.6	Y88 V89 C94 I95 A96 Y240 C261	Y88-V92 HydrophobicContact CD1-CG2 3.74Å; Y88-V92 HydrophobicContact CD2-CG2 4.24Å; Y88-V92 HydrophobicContact CE1-CG2 3.41Å; Y88-V92 VanDerWaalsContact CE1-CG2 3.41Å; Y88-V92 HydrophobicContact CE2-CG2 3.96Å; Y88-V92 HydrophobicContact CG-CG2 4.15Å; Y88-V92 WeakPolarHBondContact O-CB 3.34Å; Y88-V92 VanDerWaalsContact O-CG2 3.23Å; Y88-V92 WeakPolarHBondContact O-CG2 3.22Å; Y88-V92 PolarHBondContact O-N 3.17Å; V89-V92 PolarHBondContact O-N 2.57Å; V92-C94 PolarHBondContact O-N 2.84Å; V92-I95 PolarHBondContact O-N 3.27Å; V92-A96 WeakPolarHBondContact O-CB 3.24Å; V92-A96 PolarHBondContact O-N 3Å; V92-Y240 HydrophobicContact CB-CE1 4.34Å; V92-Y240 HydrophobicContact CG1-CE1 3.95Å; V92-Y240 HydrophobicContact CG2-CD1 4.19Å; V92-Y240 HydrophobicContact CG2-CE1 4.34Å; V92-C261 HydrophobicContact CG1-CB 3.54Å
93	R	88.9	Confident	86	Confident	15 Å²	15	24.3 Å²	24.3	6%	0.057	12%	0.115	C	C	.	.	H	α-helix	trans	-62.7	-37.2	174.9	-72	-178.7	-169.4	-173.8	10.5	113.6	V89 F90 V91 Y97 E276 I631 R680	V89-R93 VanDerWaalsContact O-CG 3.3Å; V89-R93 WeakPolarHBondContact O-CG 3.47Å; V89-R93 PolarHBondContact O-N 2.85Å; F90-R93 PolarHBondContact O-N 3.02Å; V91-R93 VanDerWaalsContact C-N 3.28Å; V91-R93 PolarHBondContact O-N 3.3Å; R93-Y97 HydrophobicContact CB-CE1 4.31Å; R93-Y97 WeakPolarHBondContact CB-OH 3.33Å; R93-Y97 WeakPolarHBondContact CD-OH 3.33Å; R93-Y97 HydrophobicContact CG-CE1 4.41Å; R93-Y97 VanDerWaalsContact CG-OH 3.24Å; R93-Y97 WeakPolarHBondContact CG-OH 3.38Å; R93-Y97 PolarHBondContact O-N 3.22Å; R93-E276 IonicContact CZ-OE1 3.7Å; R93-E276 IonicContact NH1-OE1 3.17Å; R93-E276 PolarHBondContact NH1-OE1 3.44Å; R93-I631 PolarHBondContact NH2-O 3.4Å; R93-R680 PolarHBondContact O-NH1 2.96Å
94	C	89.5	Confident	85.2	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.007	12%	0.117	C	C	.	.	H	α-helix	trans	-67.7	-40.5	175	-70.4	0	0	0	0	112.1	F90 V91 V92 P98 E676	F90-C94 PolarHBondContact O-N 3.13Å; F90-C94 VanDerWaalsContact O-N 3.16Å; F90-C94 PolarHBondContact O-SG 3.24Å; V91-C94 WeakPolarHBondContact O-CB 3.29Å; V91-C94 PolarHBondContact O-N 3.25Å; V91-C94 VanDerWaalsContact O-N 3.11Å; V92-C94 PolarHBondContact O-N 2.84Å; C94-P98 WeakPolarHBondContact O-CB 3.48Å; C94-E676 HydrophobicContact CB-CB 4.2Å; C94-E676 HydrophobicContact CB-CG 3.84Å
95	I	89.2	Confident	84	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-73.3	-36.1	177.8	-58.6	161.3	0	0	0	111.5	V91 V92 P98 K236 L239 Y240 F243 V673	V91-I95 HydrophobicContact CG1-CD1 3.82Å; V91-I95 WeakPolarHBondContact O-CG1 3.49Å; V91-I95 PolarHBondContact O-N 3.11Å; V92-I95 PolarHBondContact O-N 3.27Å; I95-P98 WeakPolarHBondContact O-CD 3.36Å; I95-K236 HydrophobicContact CG2-CB 4.12Å; I95-K236 HydrophobicContact CG2-CG 4.2Å; I95-K236 WeakPolarHBondContact O-CD 3.34Å; I95-K236 WeakPolarHBondContact O-CE 3.21Å; I95-K236 PolarHBondContact O-NZ 3.25Å; I95-L239 HydrophobicContact CD1-CB 3.99Å; I95-L239 HydrophobicContact CG1-CB 4.16Å; I95-L239 HydrophobicContact CG2-CB 3.87Å; I95-L239 HydrophobicContact CG2-CD1 4.22Å; I95-Y240 HydrophobicContact CB-CD1 4.09Å; I95-Y240 HydrophobicContact CB-CE1 3.56Å; I95-Y240 HydrophobicContact CD1-CD1 3.87Å; I95-Y240 HydrophobicContact CD1-CE1 4.19Å; I95-Y240 HydrophobicContact CG1-CE1 4.49Å; I95-Y240 HydrophobicContact CG2-CD1 3.88Å; I95-Y240 HydrophobicContact CG2-CD2 4.29Å; I95-Y240 HydrophobicContact CG2-CE1 3.47Å; I95-Y240 VanDerWaalsContact CG2-CE1 3.47Å; I95-Y240 HydrophobicContact CG2-CE2 3.89Å; I95-Y240 HydrophobicContact CG2-CG 4.27Å; I95-Y240 VanDerWaalsContact CG2-CZ 3.47Å; I95-F243 HydrophobicContact CD1-CD2 4.24Å; I95-V673 HydrophobicContact CD1-CG2 4.28Å; I95-V673 HydrophobicContact CG1-CG1 4.48Å; I95-V673 HydrophobicContact CG1-CG2 3.72Å
96	A	84.8	Confident	82.4	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-66.9	-43.1	-177.1	0	0	0	0	0	112.6	V92 K236 Y240	V92-A96 WeakPolarHBondContact O-CB 3.24Å; V92-A96 PolarHBondContact O-N 3Å; A96-K236 PolarHBondContact O-NZ 3.33Å; A96-Y240 WeakPolarHBondContact CA-OH 3.24Å; A96-Y240 WeakPolarHBondContact CB-OH 3.49Å; A96-Y240 PolarHBondContact N-OH 2.91Å
97	Y	83	Confident	81	Confident	8 Å²	8	33.6 Å²	33.6	3%	0.031	18%	0.177	C	C	.	.	S	Bend	trans	-142.7	73.1	-178.5	43.9	-85.2	0	0	0	112.3	R93 L263 Q269 Q272 I273 R680	R93-Y97 HydrophobicContact CB-CE1 4.31Å; R93-Y97 WeakPolarHBondContact CB-OH 3.33Å; R93-Y97 WeakPolarHBondContact CD-OH 3.33Å; R93-Y97 HydrophobicContact CG-CE1 4.41Å; R93-Y97 VanDerWaalsContact CG-OH 3.24Å; R93-Y97 WeakPolarHBondContact CG-OH 3.38Å; R93-Y97 PolarHBondContact O-N 3.22Å; Y97-L263 HydrophobicContact CE1-CD1 4.45Å; Y97-Q269 HydrophobicContact CD1-CG 4.18Å; Y97-Q269 HydrophobicContact CD2-CB 4.45Å; Y97-Q269 HydrophobicContact CG-CB 4.02Å; Y97-Q269 HydrophobicContact CG-CG 4.09Å; Y97-Q272 HydrophobicContact CE2-CB 4.23Å; Y97-Q272 HydrophobicContact CE2-CG 3.96Å; Y97-Q272 WeakPolarHBondContact OH-CG 3.46Å; Y97-I273 HydrophobicContact CD2-CD1 3.91Å; Y97-I273 HydrophobicContact CD2-CG1 3.67Å; Y97-I273 HydrophobicContact CE2-CG1 3.91Å; Y97-R680 PolarHBondContact OH-NH2 2.81Å
98	P	77.8	Confident	79.3	Confident	42 Å²	42	37.8 Å²	37.8	27%	0.273	21%	0.212	S	C	.	.			trans	-74.1	144.1	176.2	31.2	-35.5	0	0	0	111.5	C94 I95 F672 E676	C94-P98 WeakPolarHBondContact O-CB 3.48Å; I95-P98 WeakPolarHBondContact O-CD 3.36Å; P98-F672 HydrophobicContact CB-CE2 4.16Å; P98-F672 HydrophobicContact CB-CZ 3.66Å; P98-F672 HydrophobicContact CG-CZ 3.98Å; P98-E676 VanDerWaalsContact CA-OE1 3.27Å; P98-E676 WeakPolarHBondContact CA-OE1 3.29Å
99	F	77.4	Confident	77.7	Confident	14 Å²	14	47.5 Å²	47.5	6%	0.061	25%	0.248	C	C	.	.			trans	-144.2	-13.7	-177.1	69.7	-80	0	0	0	115.3	I273 L277 L316 L320 L323 E676 R680	F99-I273 HydrophobicContact CB-CD1 4.19Å; F99-I273 HydrophobicContact CD1-CD1 3.47Å; F99-I273 VanDerWaalsContact CD1-CD1 3.47Å; F99-I273 HydrophobicContact CD1-CG1 3.97Å; F99-I273 HydrophobicContact CD1-CG2 4.11Å; F99-I273 HydrophobicContact CD2-CG2 4.39Å; F99-I273 HydrophobicContact CE1-CB 4.45Å; F99-I273 HydrophobicContact CE1-CD1 3.99Å; F99-I273 HydrophobicContact CE1-CG1 3.97Å; F99-I273 HydrophobicContact CE1-CG2 3.58Å; F99-I273 HydrophobicContact CE2-CG2 3.89Å; F99-I273 HydrophobicContact CG-CD1 3.88Å; F99-I273 HydrophobicContact CG-CG2 4.49Å; F99-I273 HydrophobicContact CZ-CG2 3.46Å; F99-I273 VanDerWaalsContact CZ-CG2 3.46Å; F99-L277 HydrophobicContact CE2-CD1 4.39Å; F99-L277 HydrophobicContact CZ-CD1 4.41Å; F99-L316 HydrophobicContact CE2-CB 4.13Å; F99-L316 HydrophobicContact CE2-CD2 4.14Å; F99-L316 HydrophobicContact CZ-CD2 4.44Å; F99-L320 HydrophobicContact CB-CD1 3.74Å; F99-L320 HydrophobicContact CD2-CB 3.95Å; F99-L320 HydrophobicContact CD2-CD1 4.11Å; F99-L320 HydrophobicContact CE2-CB 4.49Å; F99-L320 HydrophobicContact CG-CD1 4.03Å; F99-L323 HydrophobicContact CB-CD1 3.82Å; F99-E676 VanDerWaalsContact CD1-OE1 3.26Å; F99-E676 WeakPolarHBondContact CD1-OE1 3.27Å; F99-E676 PolarHBondContact N-OE1 3.11Å; F99-R680 HydrophobicContact CE1-CG 4.46Å
100	N	80.4	Confident	76.5	Confident	50 Å²	50	50.7 Å²	50.7	27%	0.267	26%	0.261	S	S	.	.	S	Bend	trans	-111.3	-55.4	-178	179.9	78.4	0	0	0	113.1	L316 N319 E676 A679	N100-L316 HydrophobicContact CB-CD2 3.81Å; N100-L316 WeakPolarHBondContact OD1-CD2 3.4Å; N100-N319 PolarHBondContact OD1-ND2 3.17Å; N100-E676 WeakPolarHBondContact CB-OE2 3.27Å; N100-E676 PolarHBondContact N-OE1 3.12Å; N100-E676 PolarHBondContact N-OE2 2.92Å; N100-A679 WeakPolarHBondContact ND2-CB 3.21Å
101	A	75.9	Confident	75.5	Confident	18 Å²	18	54.8 Å²	54.8	15%	0.149	28%	0.28	C	S	.	.			trans	-75.4	158.2	-179.5	0	0	0	0	0	112.5	F672 D675 E676	A101-F672 HydrophobicContact CB-CD2 3.68Å; A101-F672 HydrophobicContact CB-CE2 4Å; A101-D675 HydrophobicContact CB-CB 4.09Å; A101-E676 HydrophobicContact CB-CB 4.15Å; A101-E676 WeakPolarHBondContact CB-OE2 3.47Å; A101-E676 PolarHBondContact N-OE2 3.43Å
102	K	75.9	Confident	74.7	Confident	183 Å²	183	60.3 Å²	60.3	80%	0.796	31%	0.305	S	S	*	.			trans	-128.6	144.9	169.6	-63	178	-176	172	0	107.9	P104	K102-P104 WeakPolarHBondContact O-CD 3.32Å
103	Q	73.1	Confident	74.3	Confident	37 Å²	37	61.5 Å²	61.5	17%	0.173	31%	0.311	C	S	.	.			trans	-65	124.6	177.5	-68.9	-169.3	42	0	0	110.1	T105 L234 F672	Q103-T105 PolarHBondContact O-N 3.45Å; Q103-L234 PolarHBondContact NE2-O 3Å; Q103-F672 HydrophobicContact CG-CB 3.89Å; Q103-F672 HydrophobicContact CG-CD1 3.81Å; Q103-F672 HydrophobicContact CG-CD2 3.89Å; Q103-F672 HydrophobicContact CG-CE1 4.31Å; Q103-F672 HydrophobicContact CG-CE2 4.38Å; Q103-F672 HydrophobicContact CG-CG 3.58Å
104	P	71.6	Confident	74	Confident	37 Å²	37	61 Å²	61	24%	0.24	31%	0.309	C	S	.	.			trans	-64.1	120.4	179.8	-23.7	34.4	0	0	0	112	K102 M107 P668 V671	K102-P104 WeakPolarHBondContact O-CD 3.32Å; P104-M107 HydrophobicContact CB-CG 4.15Å; P104-M107 HydrophobicContact CB-SD 4.33Å; P104-P668 WeakPolarHBondContact CD-O 3.4Å; P104-P668 WeakPolarHBondContact O-CB 3.45Å; P104-V671 HydrophobicContact CG-CG1 4.17Å
105	T	65.9	Low	73.7	Confident	99 Å²	99	64.5 Å²	64.5	61%	0.607	33%	0.328	S	S	*	.	S	Bend	trans	-87.7	-11.1	177.1	53.6	0	0	0	0	113.6	Q103 I233	Q103-T105 PolarHBondContact O-N 3.45Å; T105-I233 HydrophobicContact CG2-CD1 4.04Å; T105-I233 HydrophobicContact CG2-CG1 4.32Å
106	D	57.3	Low	73.5	Confident	155 Å²	155	71.2 Å²	71.2	83%	0.829	36%	0.357	S	S	*	.			trans	-114.2	74.9	-174.5	-166.5	14.8	0	0	0	110.1
107	M	61.3	Low	73.6	Confident	45 Å²	45	79.2 Å²	79.2	22%	0.222	39%	0.394	C	S	.	.			trans	-133.7	138.9	171.8	-64.6	-163.9	85.7	0	0	109.7	P104 W665 P668	P104-M107 HydrophobicContact CB-CG 4.15Å; P104-M107 HydrophobicContact CB-SD 4.33Å; M107-W665 HydrophobicContact CE-CE3 4.46Å; M107-P668 HydrophobicContact CB-CG 4.29Å; M107-P668 HydrophobicContact CG-CG 4.23Å; M107-P668 HydrophobicContact SD-CB 4.28Å; M107-P668 HydrophobicContact SD-CG 3.72Å
108	A	55	Low	73.7	Confident	89 Å²	89	81.8 Å²	81.8	74%	0.736	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-57.7	144.1	-175.2	0	0	0	0	0	113.3	R110	A108-R110 PolarHBondContact O-N 2.99Å
109	R	59.3	Low	74.2	Confident	203 Å²	203	80.2 Å²	80.2	77%	0.766	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-59.9	124.8	175	-86.5	-172.2	174.1	175	0.9	110.4
110	R	65.1	Low	74.7	Confident	67 Å²	67	84 Å²	84	25%	0.253	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-83.1	140	175.3	-65.9	137.5	-163.7	-103.4	-6.9	109.9	A108 Y660 W665 F666	A108-R110 PolarHBondContact O-N 2.99Å; R110-Y660 HydrophobicContact CB-CD1 4.44Å; R110-W665 PolarHBondContact NH1-O 3.29Å; R110-F666 PolarHBondContact NH1-O 3.43Å; R110-F666 PolarHBondContact NH2-O 2.95Å
111	Q	70.1	Confident	75.2	Confident	86 Å²	86	85.3 Å²	85.3	40%	0.402	42%	0.42	S	S	.	.			trans	-105.2	151	178.6	-67.8	174.2	-22.9	0	0	109.9	K113 S169 N171 Y660 S661	Q111-K113 PolarHBondContact O-N 3.34Å; Q111-S169 PolarHBondContact OE1-OG 3.02Å; Q111-S169 VanDerWaalsContact OE1-OG 3.13Å; Q111-N171 VanDerWaalsContact OE1-CB 3.25Å; Q111-Y660 CarbonylContact O-C 3.57Å; Q111-Y660 WeakPolarHBondContact O-CA 3.39Å; Q111-S661 PolarHBondContact O-N 3.18Å
112	Q	75.5	Confident	75.8	Confident	116 Å²	116	84.7 Å²	84.7	54%	0.542	42%	0.415	S	S	.	.	B	Isolated β-bridge	trans	-63.3	129.9	-179.6	-166.8	176.5	4.8	0	0	110.4	S169 S659	Q112-S169 WeakPolarHBondContact O-CA 3.35Å; Q112-S169 WeakPolarHBondContact O-CB 3.27Å; Q112-S659 WeakPolarHBondContact CG-O 3.14Å
113	K	82.6	Confident	76.5	Confident	26 Å²	26	77.8 Å²	77.8	11%	0.113	39%	0.385	C	S	.	.	B	Isolated β-bridge	trans	-70	137.7	176.1	167.1	171.5	157.1	-179.1	0	109.2	Q111 Q118 G166 L656 S659	Q111-K113 PolarHBondContact O-N 3.34Å; K113-Q118 PolarHBondContact O-OE1 2.7Å; K113-G166 VanDerWaalsContact CE-CA 3.42Å; K113-L656 PolarHBondContact NZ-O 3.41Å; K113-S659 PolarHBondContact N-O 3.26Å
114	L	82.6	Confident	77.4	Confident	3 Å²	3	80.5 Å²	80.5	2%	0.016	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-81	127.9	170.5	-78.2	171.7	0	0	0	109.8	Q118 V163 C168 F173	L114-Q118 HydrophobicContact CD2-CB 3.95Å; L114-V163 HydrophobicContact CB-CG2 4.38Å; L114-C168 PolarHBondContact N-O 3.32Å; L114-C168 VanDerWaalsContact N-O 3.1Å; L114-F173 HydrophobicContact CD1-CD1 4Å; L114-F173 HydrophobicContact CD1-CD2 3.46Å; L114-F173 VanDerWaalsContact CD1-CD2 3.46Å; L114-F173 HydrophobicContact CD1-CE1 4Å; L114-F173 HydrophobicContact CD1-CE2 3.47Å; L114-F173 VanDerWaalsContact CD1-CE2 3.47Å; L114-F173 HydrophobicContact CD1-CG 3.75Å; L114-F173 HydrophobicContact CD1-CZ 3.75Å
115	N	83.7	Confident	78.3	Confident	75 Å²	75	81.5 Å²	81.5	40%	0.401	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-98.9	159.7	173.9	-71.7	-25.8	0	0	0	111.4	Q117 Q118 L119	N115-Q117 PolarHBondContact O-N 3.21Å; N115-Q117 VanDerWaalsContact O-N 3.09Å; N115-Q118 WeakPolarHBondContact O-CA 3.35Å; N115-Q118 WeakPolarHBondContact O-CB 3.47Å; N115-Q118 PolarHBondContact O-N 3.37Å; N115-L119 PolarHBondContact O-N 2.98Å
116	K	85.8	Confident	79.5	Confident	142 Å²	142	76.8 Å²	76.8	62%	0.617	37%	0.367	S	S	*	.	H	α-helix	trans	-51.1	-37.1	-178.3	-173.8	172.5	-179.5	171.7	0	114.1	Q120	K116-Q120 PolarHBondContact O-N 2.92Å
117	Q	85.9	Confident	81.1	Confident	168 Å²	168	73.5 Å²	73.5	79%	0.785	35%	0.347	S	S	*	.	H	α-helix	trans	-68	-38.3	175.7	-69.9	174.4	-19.4	0	0	112.8	N115 Q120 L121	N115-Q117 PolarHBondContact O-N 3.21Å; N115-Q117 VanDerWaalsContact O-N 3.09Å; Q117-Q120 PolarHBondContact O-N 2.92Å; Q117-L121 PolarHBondContact O-N 3.04Å
118	Q	84.8	Confident	82.4	Confident	62 Å²	62	72.3 Å²	72.3	29%	0.29	34%	0.344	S	S	.	.	H	α-helix	trans	-71.8	-36.5	177.9	-67.4	166.5	-49.6	0	0	111.5	K113 L114 N115 Q120 L121 L122	K113-Q118 PolarHBondContact O-OE1 2.7Å; L114-Q118 HydrophobicContact CD2-CB 3.95Å; N115-Q118 WeakPolarHBondContact O-CA 3.35Å; N115-Q118 WeakPolarHBondContact O-CB 3.47Å; N115-Q118 PolarHBondContact O-N 3.37Å; Q118-Q120 VanDerWaalsContact C-N 3.31Å; Q118-Q120 PolarHBondContact O-N 2.99Å; Q118-L121 PolarHBondContact O-N 2.84Å; Q118-L122 VanDerWaalsContact O-CB 3.27Å; Q118-L122 WeakPolarHBondContact O-CB 3.45Å; Q118-L122 PolarHBondContact O-N 3.27Å
119	L	88.3	Confident	84.1	Confident	9 Å²	9	68.7 Å²	68.7	5%	0.047	31%	0.312	C	S	.	.	H	α-helix	trans	-59.7	-42.2	170.7	175.2	65.1	0	0	0	111.4	N115 L122 K123 V159 A160 V163 F173	N115-L119 PolarHBondContact O-N 2.98Å; L119-L122 PolarHBondContact O-N 2.83Å; L119-K123 WeakPolarHBondContact O-CG 3.42Å; L119-K123 PolarHBondContact O-N 2.98Å; L119-V159 HydrophobicContact CD1-CG1 4.49Å; L119-A160 HydrophobicContact CD2-CB 4.4Å; L119-V163 HydrophobicContact CB-CG1 4.09Å; L119-V163 HydrophobicContact CB-CG2 4.39Å; L119-V163 HydrophobicContact CD2-CB 4.17Å; L119-V163 HydrophobicContact CD2-CG1 4.2Å; L119-V163 HydrophobicContact CD2-CG2 4.06Å; L119-F173 HydrophobicContact CD1-CE1 3.76Å; L119-F173 HydrophobicContact CD1-CZ 3.97Å
120	Q	88.9	Confident	85.6	Confident	93 Å²	93	61.2 Å²	61.2	44%	0.435	29%	0.287	S	S	.	.	H	α-helix	trans	-66.2	-47.7	178.8	-176.5	56.6	32.1	0	0	111.7	K116 Q117 Q118 L122 K123 E124	K116-Q120 PolarHBondContact O-N 2.92Å; Q117-Q120 PolarHBondContact O-N 2.92Å; Q118-Q120 VanDerWaalsContact C-N 3.31Å; Q118-Q120 PolarHBondContact O-N 2.99Å; Q120-L122 PolarHBondContact O-N 3.45Å; Q120-K123 WeakPolarHBondContact O-CB 3.4Å; Q120-K123 PolarHBondContact O-N 2.97Å; Q120-K123 VanDerWaalsContact O-N 3.15Å; Q120-E124 WeakPolarHBondContact CG-OE1 3.44Å; Q120-E124 PolarHBondContact NE2-OE1 2.91Å; Q120-E124 WeakPolarHBondContact O-CG 3.44Å; Q120-E124 PolarHBondContact O-N 3.32Å
121	L	89.5	Confident	86.7	Confident	78 Å²	78	62.9 Å²	62.9	41%	0.408	30%	0.301	S	S	.	.	H	α-helix	trans	-58.8	-35.7	173.7	180	62.7	0	0	0	112.4	Q117 Q118 E124 R125	Q117-L121 PolarHBondContact O-N 3.04Å; Q118-L121 PolarHBondContact O-N 2.84Å; L121-E124 PolarHBondContact O-N 2.89Å; L121-R125 VanDerWaalsContact O-CG 3.29Å; L121-R125 WeakPolarHBondContact O-CG 3.38Å; L121-R125 PolarHBondContact O-N 2.68Å
122	L	89.2	Confident	87.4	Confident	6 Å²	6	61.7 Å²	61.7	3%	0.031	31%	0.312	C	S	.	.	H	α-helix	trans	-69.6	-40	176.6	-172.5	64.5	0	0	0	112	Q118 L119 Q120 E124 R125 F126 L154 F173 Y211	Q118-L122 VanDerWaalsContact O-CB 3.27Å; Q118-L122 WeakPolarHBondContact O-CB 3.45Å; Q118-L122 PolarHBondContact O-N 3.27Å; L119-L122 PolarHBondContact O-N 2.83Å; Q120-L122 PolarHBondContact O-N 3.45Å; L122-E124 VanDerWaalsContact C-N 3.34Å; L122-R125 PolarHBondContact O-N 3.06Å; L122-F126 HydrophobicContact CD1-CD2 3.77Å; L122-F126 HydrophobicContact CD1-CE2 3.58Å; L122-F126 HydrophobicContact CG-CD2 4.15Å; L122-F126 HydrophobicContact CG-CE2 4.25Å; L122-F126 WeakPolarHBondContact O-CD2 3.49Å; L122-F126 PolarHBondContact O-N 3.15Å; L122-L154 HydrophobicContact CD2-CD2 3.98Å; L122-L154 HydrophobicContact CG-CD2 4.45Å; L122-F173 HydrophobicContact CD2-CD1 3.57Å; L122-F173 HydrophobicContact CD2-CE1 3.92Å; L122-Y211 HydrophobicContact CD1-CD2 3.51Å; L122-Y211 HydrophobicContact CD1-CE2 3.93Å; L122-Y211 HydrophobicContact CD1-CG 4.26Å; L122-Y211 HydrophobicContact CD2-CD2 4.28Å; L122-Y211 HydrophobicContact CD2-CE2 4.09Å
123	K	91.1	Very high	87.7	Confident	38 Å²	38	62.5 Å²	62.5	17%	0.165	32%	0.316	C	S	.	.	H	α-helix	trans	-58.2	-47.2	171.5	-74.9	177	173	-170.8	0	110.9	L119 Q120 F126 Q127 Y150 L154	L119-K123 WeakPolarHBondContact O-CG 3.42Å; L119-K123 PolarHBondContact O-N 2.98Å; Q120-K123 WeakPolarHBondContact O-CB 3.4Å; Q120-K123 PolarHBondContact O-N 2.97Å; Q120-K123 VanDerWaalsContact O-N 3.15Å; K123-F126 PolarHBondContact O-N 3.44Å; K123-Q127 VanDerWaalsContact O-CB 3.32Å; K123-Q127 WeakPolarHBondContact O-CB 3.4Å; K123-Q127 PolarHBondContact O-N 2.93Å; K123-Y150 HydrophobicContact CB-CE2 4.25Å; K123-Y150 WeakPolarHBondContact O-CE2 3.34Å; K123-L154 WeakPolarHBondContact CE-O 3.48Å; K123-L154 HydrophobicContact CG-CB 4.45Å; K123-L154 PolarHBondContact NZ-O 3.42Å
124	E	91.1	Very high	87.8	Confident	94 Å²	94	63 Å²	63	44%	0.439	32%	0.321	S	S	.	.	H	α-helix	trans	-61.6	-44.6	179.3	-71.9	158.3	-169.6	0	0	111.7	Q120 L121 L122 F126 Q127 A128	Q120-E124 WeakPolarHBondContact CG-OE1 3.44Å; Q120-E124 PolarHBondContact NE2-OE1 2.91Å; Q120-E124 WeakPolarHBondContact O-CG 3.44Å; Q120-E124 PolarHBondContact O-N 3.32Å; L121-E124 PolarHBondContact O-N 2.89Å; L122-E124 VanDerWaalsContact C-N 3.34Å; E124-F126 PolarHBondContact O-N 3.25Å; E124-Q127 PolarHBondContact O-N 2.72Å; E124-A128 WeakPolarHBondContact O-CB 3.26Å; E124-A128 PolarHBondContact O-N 3.41Å
125	R	90.3	Very high	87.6	Confident	57 Å²	57	70.6 Å²	70.6	22%	0.215	36%	0.357	C	S	.	.	H	α-helix	trans	-62.1	-42.2	175.8	-73.8	170.1	178.1	-157.1	-11.1	113.3	L121 L122 F129 Y211 R212	L121-R125 VanDerWaalsContact O-CG 3.29Å; L121-R125 WeakPolarHBondContact O-CG 3.38Å; L121-R125 PolarHBondContact O-N 2.68Å; L122-R125 PolarHBondContact O-N 3.06Å; R125-F129 PolarHBondContact O-N 2.91Å; R125-Y211 PolarHBondContact NH1-O 2.82Å; R125-R212 VanDerWaalsContact CZ-O 3.32Å; R125-R212 PolarHBondContact NH1-O 3.12Å; R125-R212 PolarHBondContact NH2-O 3.34Å
126	F	91.8	Very high	87.6	Confident	0 Å²	0	69 Å²	69	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-69.9	-34.4	177	-88.4	-111.4	0	0	0	112.2	L122 K123 E124 L130 V146 Y149 Y150 L154 Y207 I210	L122-F126 HydrophobicContact CD1-CD2 3.77Å; L122-F126 HydrophobicContact CD1-CE2 3.58Å; L122-F126 HydrophobicContact CG-CD2 4.15Å; L122-F126 HydrophobicContact CG-CE2 4.25Å; L122-F126 WeakPolarHBondContact O-CD2 3.49Å; L122-F126 PolarHBondContact O-N 3.15Å; K123-F126 PolarHBondContact O-N 3.44Å; E124-F126 PolarHBondContact O-N 3.25Å; F126-L130 WeakPolarHBondContact O-CG 3.42Å; F126-L130 PolarHBondContact O-N 3.2Å; F126-L130 VanDerWaalsContact O-N 3.1Å; F126-V146 HydrophobicContact CD1-CG1 3.75Å; F126-V146 HydrophobicContact CE1-CG1 4.06Å; F126-Y149 HydrophobicContact CD1-CD1 4.02Å; F126-Y149 HydrophobicContact CD1-CE1 4.25Å; F126-Y149 AromaticContact CE1-CD1 3.63Å; F126-Y149 HydrophobicContact CE1-CD1 3.63Å; F126-Y149 AromaticContact CE1-CE1 3.69Å; F126-Y149 HydrophobicContact CE1-CE1 3.69Å; F126-Y149 HydrophobicContact CZ-CD1 4.45Å; F126-Y149 HydrophobicContact CZ-CE1 4.07Å; F126-Y150 HydrophobicContact CB-CD2 3.84Å; F126-Y150 HydrophobicContact CB-CE2 4.49Å; F126-L154 HydrophobicContact CB-CD1 3.9Å; F126-L154 HydrophobicContact CD1-CD1 3.72Å; F126-L154 HydrophobicContact CD2-CD1 4.13Å; F126-L154 HydrophobicContact CE1-CD1 4.36Å; F126-L154 HydrophobicContact CG-CD1 3.62Å; F126-Y207 HydrophobicContact CE1-CD2 4.18Å; F126-Y207 HydrophobicContact CE1-CE2 4.25Å; F126-Y207 HydrophobicContact CE2-CE2 4.44Å; F126-Y207 AromaticContact CZ-CD2 3.61Å; F126-Y207 HydrophobicContact CZ-CD2 3.61Å; F126-Y207 AromaticContact CZ-CE2 3.55Å; F126-Y207 HydrophobicContact CZ-CE2 3.55Å; F126-I210 HydrophobicContact CD1-CG2 4.48Å; F126-I210 HydrophobicContact CD2-CG2 3.47Å; F126-I210 VanDerWaalsContact CD2-CG2 3.47Å; F126-I210 HydrophobicContact CE1-CG2 4.46Å; F126-I210 HydrophobicContact CE2-CB 4.07Å; F126-I210 HydrophobicContact CE2-CG2 3.44Å; F126-I210 VanDerWaalsContact CE2-CG2 3.44Å; F126-I210 HydrophobicContact CG-CG2 4Å; F126-I210 HydrophobicContact CZ-CB 4.27Å; F126-I210 HydrophobicContact CZ-CG2 3.96Å
127	Q	91.4	Very high	87.4	Confident	87 Å²	87	68.2 Å²	68.2	41%	0.407	35%	0.354	S	S	.	.	H	α-helix	trans	-71.2	-41.8	176.1	-169.9	169	-3.2	0	0	112.1	K123 E124 F129 L130 N131 Y150	K123-Q127 VanDerWaalsContact O-CB 3.32Å; K123-Q127 WeakPolarHBondContact O-CB 3.4Å; K123-Q127 PolarHBondContact O-N 2.93Å; E124-Q127 PolarHBondContact O-N 2.72Å; Q127-F129 VanDerWaalsContact C-N 3.31Å; Q127-F129 PolarHBondContact O-N 3.4Å; Q127-L130 CarbonylContact O-C 3.56Å; Q127-L130 PolarHBondContact O-N 3.17Å; Q127-L130 VanDerWaalsContact O-N 3.11Å; Q127-N131 WeakPolarHBondContact O-CB 3.3Å; Q127-N131 VanDerWaalsContact O-CG 3.25Å; Q127-N131 PolarHBondContact O-N 2.94Å; Q127-N131 PolarHBondContact O-OD1 3.43Å; Q127-Y150 HydrophobicContact CB-CE2 4.09Å; Q127-Y150 PolarHBondContact OE1-OH 3.13Å
128	A	89	Confident	87.3	Confident	20 Å²	20	62.1 Å²	62.1	17%	0.165	33%	0.333	C	S	.	.	H	α-helix	trans	-59.1	-40.7	173.4	0	0	0	0	0	112	E124 N131 G132 E133 T134	E124-A128 WeakPolarHBondContact O-CB 3.26Å; E124-A128 PolarHBondContact O-N 3.41Å; A128-N131 PolarHBondContact O-N 2.95Å; A128-G132 PolarHBondContact O-N 2.57Å; A128-E133 HydrophobicContact CB-CB 4.19Å; A128-E133 WeakPolarHBondContact O-CB 3.23Å; A128-E133 PolarHBondContact O-N 3.02Å; A128-T134 HydrophobicContact CB-CG2 4.35Å
129	F	91.1	Very high	87.3	Confident	12 Å²	12	62 Å²	62	5%	0.053	33%	0.334	C	S	.	.	H	α-helix	trans	-60.5	-46.9	171.5	169.7	-91.8	0	0	0	112.1	R125 Q127 N131 G132 T134 I136 A138 F142 V146 I210	R125-F129 PolarHBondContact O-N 2.91Å; Q127-F129 VanDerWaalsContact C-N 3.31Å; Q127-F129 PolarHBondContact O-N 3.4Å; F129-N131 VanDerWaalsContact C-N 3.27Å; F129-N131 PolarHBondContact O-N 2.87Å; F129-G132 PolarHBondContact O-N 2.93Å; F129-T134 HydrophobicContact CB-CG2 4.26Å; F129-T134 WeakPolarHBondContact CD2-OG1 3.28Å; F129-I136 HydrophobicContact CD2-CB 4.18Å; F129-I136 HydrophobicContact CD2-CG2 4.44Å; F129-I136 HydrophobicContact CE2-CB 4.14Å; F129-I136 HydrophobicContact CE2-CG2 4.06Å; F129-A138 HydrophobicContact CE2-CB 3.97Å; F129-A138 HydrophobicContact CZ-CB 3.66Å; F129-F142 HydrophobicContact CE1-CD1 4.44Å; F129-F142 HydrophobicContact CE1-CE1 4.19Å; F129-F142 HydrophobicContact CE2-CE1 4.14Å; F129-F142 AromaticContact CZ-CD1 3.78Å; F129-F142 HydrophobicContact CZ-CD1 3.78Å; F129-F142 AromaticContact CZ-CE1 3.59Å; F129-F142 HydrophobicContact CZ-CE1 3.59Å; F129-V146 HydrophobicContact CD1-CB 4.37Å; F129-V146 HydrophobicContact CD1-CG1 3.68Å; F129-V146 HydrophobicContact CE1-CB 3.94Å; F129-V146 HydrophobicContact CE1-CG1 3.77Å; F129-V146 HydrophobicContact CE1-CG2 4.05Å; F129-I210 HydrophobicContact CB-CD1 4.31Å; F129-I210 HydrophobicContact CB-CG1 4.35Å; F129-I210 HydrophobicContact CB-CG2 4.25Å; F129-I210 HydrophobicContact CD1-CD1 3.93Å; F129-I210 HydrophobicContact CD2-CD1 3.74Å; F129-I210 HydrophobicContact CD2-CG1 3.95Å; F129-I210 HydrophobicContact CE1-CD1 4.22Å; F129-I210 HydrophobicContact CE2-CD1 4.05Å; F129-I210 HydrophobicContact CG-CD1 3.69Å; F129-I210 HydrophobicContact CG-CG1 4.09Å; F129-I210 HydrophobicContact CZ-CD1 4.29Å
130	L	89.3	Confident	87.2	Confident	46 Å²	46	68.8 Å²	68.8	24%	0.241	37%	0.365	C	S	.	.	H	α-helix	trans	-66.7	-25.8	178.8	-71.4	170.4	0	0	0	113.7	F126 Q127 G132 V146 R147 Y150	F126-L130 WeakPolarHBondContact O-CG 3.42Å; F126-L130 PolarHBondContact O-N 3.2Å; F126-L130 VanDerWaalsContact O-N 3.1Å; Q127-L130 CarbonylContact O-C 3.56Å; Q127-L130 PolarHBondContact O-N 3.17Å; Q127-L130 VanDerWaalsContact O-N 3.11Å; L130-G132 VanDerWaalsContact C-N 3.31Å; L130-V146 HydrophobicContact CD2-CB 4.46Å; L130-V146 HydrophobicContact CD2-CG1 4.12Å; L130-V146 HydrophobicContact CG-CG1 4.27Å; L130-R147 HydrophobicContact CD1-CB 4.47Å; L130-R147 HydrophobicContact CD1-CG 4.49Å; L130-R147 HydrophobicContact CD2-CB 3.92Å; L130-R147 HydrophobicContact CD2-CG 4.46Å; L130-Y150 HydrophobicContact CD1-CD1 4.06Å; L130-Y150 HydrophobicContact CD1-CG 3.99Å
131	N	88.6	Confident	87.1	Confident	102 Å²	102	66.1 Å²	66.1	55%	0.545	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-11.7	172.3	-69	-4.5	0	0	0	113.3	Q127 A128 F129 E133	Q127-N131 WeakPolarHBondContact O-CB 3.3Å; Q127-N131 VanDerWaalsContact O-CG 3.25Å; Q127-N131 PolarHBondContact O-N 2.94Å; Q127-N131 PolarHBondContact O-OD1 3.43Å; A128-N131 PolarHBondContact O-N 2.95Å; F129-N131 VanDerWaalsContact C-N 3.27Å; F129-N131 PolarHBondContact O-N 2.87Å; N131-E133 HydrophobicContact CB-CG 3.88Å; N131-E133 VanDerWaalsContact CB-OE1 3.23Å; N131-E133 WeakPolarHBondContact CB-OE1 3.33Å; N131-E133 PolarHBondContact ND2-OE1 3.11Å
132	G	84.1	Confident	87	Confident	62 Å²	62	62.4 Å²	62.4	64%	0.639	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	17.8	-174.6	0	0	0	0	0	114.8	A128 F129 L130 T134	A128-G132 PolarHBondContact O-N 2.57Å; F129-G132 PolarHBondContact O-N 2.93Å; L130-G132 VanDerWaalsContact C-N 3.31Å; G132-T134 VanDerWaalsContact C-N 3.33Å
133	E	83.3	Confident	87	Confident	133 Å²	133	63.7 Å²	63.7	62%	0.621	35%	0.349	S	S	*	.			trans	-80.4	-11.4	-177.1	-62.7	168.4	-150.6	0	0	113.5	A128 N131	A128-E133 HydrophobicContact CB-CB 4.19Å; A128-E133 WeakPolarHBondContact O-CB 3.23Å; A128-E133 PolarHBondContact O-N 3.02Å; N131-E133 HydrophobicContact CB-CG 3.88Å; N131-E133 VanDerWaalsContact CB-OE1 3.23Å; N131-E133 WeakPolarHBondContact CB-OE1 3.33Å; N131-E133 PolarHBondContact ND2-OE1 3.11Å
134	T	83.5	Confident	86.9	Confident	35 Å²	35	64.6 Å²	64.6	22%	0.215	36%	0.356	C	S	.	.	S	Bend	trans	-107.1	147	-175.8	63.6	0	0	0	0	112.8	A128 F129 G132 I136	A128-T134 HydrophobicContact CB-CG2 4.35Å; F129-T134 HydrophobicContact CB-CG2 4.26Å; F129-T134 WeakPolarHBondContact CD2-OG1 3.28Å; G132-T134 VanDerWaalsContact C-N 3.33Å; T134-I136 PolarHBondContact O-N 3.06Å
135	Q	79.8	Confident	86.7	Confident	164 Å²	164	60.1 Å²	60.1	77%	0.766	34%	0.335	S	S	*	.			trans	-76.1	21.2	-178.8	-61.2	176.4	64.2	0	0	115.1	E214	Q135-E214 PolarHBondContact N-OE1 3.43Å; Q135-E214 PolarHBondContact NE2-OE2 3.11Å; Q135-E214 VanDerWaalsContact NE2-OE2 3.1Å
136	I	83.9	Confident	86.8	Confident	40 Å²	40	57.4 Å²	57.4	21%	0.205	32%	0.324	C	S	.	.			trans	-91	108.6	-172	-60.6	174.9	0	0	0	110.5	F129 T134 A138 K206 A209 I210	F129-I136 HydrophobicContact CD2-CB 4.18Å; F129-I136 HydrophobicContact CD2-CG2 4.44Å; F129-I136 HydrophobicContact CE2-CB 4.14Å; F129-I136 HydrophobicContact CE2-CG2 4.06Å; T134-I136 PolarHBondContact O-N 3.06Å; I136-A138 PolarHBondContact O-N 3.33Å; I136-K206 HydrophobicContact CG2-CB 4.4Å; I136-K206 HydrophobicContact CG2-CG 4.43Å; I136-A209 HydrophobicContact CD1-CB 3.99Å; I136-I210 HydrophobicContact CD1-CB 4.36Å; I136-I210 HydrophobicContact CD1-CG1 3.57Å
137	V	80.1	Confident	86.7	Confident	127 Å²	127	62.9 Å²	62.9	77%	0.77	35%	0.345	S	S	*	.			trans	-65.4	114.7	-178.9	-177.2	0	0	0	0	111.5	K206	V137-K206 VanDerWaalsContact O-CE 3.28Å; V137-K206 WeakPolarHBondContact O-CE 3.33Å; V137-K206 PolarHBondContact O-NZ 2.97Å
138	A	84.4	Confident	86.5	Confident	40 Å²	40	60 Å²	60	33%	0.331	34%	0.335	S	S	.	.			trans	-122	147.7	-176.2	0	0	0	0	0	112.3	F129 I136 F142 C143	F129-A138 HydrophobicContact CE2-CB 3.97Å; F129-A138 HydrophobicContact CZ-CB 3.66Å; I136-A138 PolarHBondContact O-N 3.33Å; A138-F142 HydrophobicContact CB-CD1 3.89Å; A138-C143 VanDerWaalsContact CB-SG 3.51Å
139	D	85.8	Confident	86.5	Confident	58 Å²	58	59 Å²	59	31%	0.31	33%	0.327	S	S	.	.			trans	-93.4	158.1	166.7	50.6	88	0	0	0	109.5	A141 F142 C143 W203 K206	D139-A141 VanDerWaalsContact C-N 3.28Å; D139-A141 PolarHBondContact O-N 3.33Å; D139-F142 PolarHBondContact O-N 3.23Å; D139-F142 VanDerWaalsContact OD1-CB 3.27Å; D139-F142 WeakPolarHBondContact OD1-CB 3.36Å; D139-F142 PolarHBondContact OD1-N 2.87Å; D139-C143 PolarHBondContact O-N 3.1Å; D139-W203 WeakPolarHBondContact OD1-CZ2 3.49Å; D139-W203 PolarHBondContact OD2-NE1 3.39Å; D139-K206 IonicContact OD2-NZ 3.88Å; D139-K206 PolarHBondContact OD2-NZ 2.68Å
140	E	85.6	Confident	86.5	Confident	152 Å²	152	59.1 Å²	59.1	71%	0.71	33%	0.327	S	S	*	.	H	α-helix	trans	-61.5	-36.8	-175	-166.2	-172.4	156.8	0	0	112.4	C143 N144	E140-C143 PolarHBondContact O-N 3.03Å; E140-N144 WeakPolarHBondContact O-CB 3.4Å; E140-N144 VanDerWaalsContact O-CG 3.24Å; E140-N144 PolarHBondContact O-N 3.5Å; E140-N144 PolarHBondContact O-ND2 3.24Å
141	A	85.4	Confident	86.3	Confident	37 Å²	37	61.3 Å²	61.3	31%	0.306	34%	0.336	S	S	.	.	H	α-helix	trans	-62.8	-42.8	177.3	0	0	0	0	0	112	D139 N144 A145 W203	D139-A141 VanDerWaalsContact C-N 3.28Å; D139-A141 PolarHBondContact O-N 3.33Å; A141-N144 PolarHBondContact O-N 2.89Å; A141-A145 WeakPolarHBondContact O-CB 3.29Å; A141-A145 PolarHBondContact O-N 2.95Å; A141-W203 HydrophobicContact CB-CH2 3.83Å; A141-W203 HydrophobicContact CB-CZ2 3.76Å
142	F	89.2	Confident	86.1	Confident	0 Å²	0	59 Å²	59	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-63.8	-44.5	171.7	-176.7	-107.4	0	0	0	112	F129 A138 D139 N144 A145 V146 F177 W203 K206 I210	F129-F142 HydrophobicContact CE1-CD1 4.44Å; F129-F142 HydrophobicContact CE1-CE1 4.19Å; F129-F142 HydrophobicContact CE2-CE1 4.14Å; F129-F142 AromaticContact CZ-CD1 3.78Å; F129-F142 HydrophobicContact CZ-CD1 3.78Å; F129-F142 AromaticContact CZ-CE1 3.59Å; F129-F142 HydrophobicContact CZ-CE1 3.59Å; A138-F142 HydrophobicContact CB-CD1 3.89Å; D139-F142 PolarHBondContact O-N 3.23Å; D139-F142 VanDerWaalsContact OD1-CB 3.27Å; D139-F142 WeakPolarHBondContact OD1-CB 3.36Å; D139-F142 PolarHBondContact OD1-N 2.87Å; F142-N144 VanDerWaalsContact C-N 3.32Å; F142-N144 PolarHBondContact O-N 3.04Å; F142-A145 PolarHBondContact O-N 3.37Å; F142-V146 HydrophobicContact CD1-CG2 4.09Å; F142-V146 HydrophobicContact CD2-CG2 4.3Å; F142-V146 HydrophobicContact CE1-CG2 3.68Å; F142-V146 HydrophobicContact CE2-CG2 3.92Å; F142-V146 HydrophobicContact CG-CG2 4.39Å; F142-V146 HydrophobicContact CZ-CG2 3.58Å; F142-V146 WeakPolarHBondContact O-CG2 3.38Å; F142-V146 PolarHBondContact O-N 3.34Å; F142-F177 HydrophobicContact CD2-CZ 4.48Å; F142-F177 HydrophobicContact CE2-CE1 4.2Å; F142-F177 AromaticContact CE2-CZ 3.75Å; F142-F177 HydrophobicContact CE2-CZ 3.75Å; F142-F177 HydrophobicContact CZ-CZ 4.4Å; F142-W203 HydrophobicContact CB-CD2 4.22Å; F142-W203 HydrophobicContact CB-CZ2 4.03Å; F142-W203 HydrophobicContact CD2-CB 3.76Å; F142-W203 AromaticContact CD2-CD1 3.82Å; F142-W203 AromaticContact CD2-CD2 3.62Å; F142-W203 HydrophobicContact CD2-CD2 3.62Å; F142-W203 HydrophobicContact CD2-CE3 4.06Å; F142-W203 AromaticContact CD2-CG 3.47Å; F142-W203 HydrophobicContact CD2-CG 3.47Å; F142-W203 VanDerWaalsContact CD2-CG 3.47Å; F142-W203 HydrophobicContact CE2-CB 3.85Å; F142-W203 HydrophobicContact CE2-CG 4.09Å; F142-W203 WeakPolarHBondContact CE2-O 3.31Å; F142-W203 HydrophobicContact CG-CD2 4.39Å; F142-W203 HydrophobicContact CG-CG 4.36Å; F142-K206 HydrophobicContact CD1-CD 3.91Å; F142-K206 HydrophobicContact CD2-CD 4.44Å; F142-K206 HydrophobicContact CE1-CB 3.72Å; F142-K206 HydrophobicContact CE1-CD 3.85Å; F142-K206 HydrophobicContact CE1-CG 4.41Å; F142-K206 HydrophobicContact CE2-CB 3.94Å; F142-K206 HydrophobicContact CE2-CD 4.38Å; F142-K206 HydrophobicContact CG-CD 4.21Å; F142-K206 HydrophobicContact CZ-CB 3.34Å; F142-K206 HydrophobicContact CZ-CD 4.11Å; F142-K206 HydrophobicContact CZ-CG 4.36Å; F142-I210 HydrophobicContact CE1-CD1 4.12Å; F142-I210 HydrophobicContact CZ-CD1 4.14Å
143	C	88.6	Confident	86.4	Confident	33 Å²	33	56.2 Å²	56.2	22%	0.223	30%	0.295	C	S	.	.	H	α-helix	trans	-58.9	-42.2	176.3	-72.4	0	0	0	0	112.3	A138 D139 E140 V146 R147	A138-C143 VanDerWaalsContact CB-SG 3.51Å; D139-C143 PolarHBondContact O-N 3.1Å; E140-C143 PolarHBondContact O-N 3.03Å; C143-V146 PolarHBondContact O-N 2.88Å; C143-R147 WeakPolarHBondContact O-CB 3.45Å; C143-R147 PolarHBondContact O-N 2.87Å
144	N	87.9	Confident	86.6	Confident	57 Å²	57	49.9 Å²	49.9	31%	0.305	27%	0.266	S	S	.	.	H	α-helix	trans	-68.3	-36.4	177.3	-69.2	-18.8	0	0	0	111.9	E140 A141 F142 R147 S148	E140-N144 WeakPolarHBondContact O-CB 3.4Å; E140-N144 VanDerWaalsContact O-CG 3.24Å; E140-N144 PolarHBondContact O-N 3.5Å; E140-N144 PolarHBondContact O-ND2 3.24Å; A141-N144 PolarHBondContact O-N 2.89Å; F142-N144 VanDerWaalsContact C-N 3.32Å; F142-N144 PolarHBondContact O-N 3.04Å; N144-R147 PolarHBondContact OD1-NH1 2.8Å; N144-S148 PolarHBondContact O-N 3.1Å
145	A	88.7	Confident	86.8	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-67	-42.6	172.6	0	0	0	0	0	112.9	A141 F142 S148 Y149 I181 W203	A141-A145 WeakPolarHBondContact O-CB 3.29Å; A141-A145 PolarHBondContact O-N 2.95Å; F142-A145 PolarHBondContact O-N 3.37Å; A145-S148 PolarHBondContact O-N 2.85Å; A145-Y149 PolarHBondContact O-N 3.34Å; A145-I181 HydrophobicContact CB-CG2 3.94Å; A145-W203 HydrophobicContact CB-CZ3 4.02Å
146	V	90.9	Very high	87.2	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-65.3	-39.4	175.9	173.8	0	0	0	0	111.2	F126 F129 L130 F142 C143 Y149 Y150 F177 I210	F126-V146 HydrophobicContact CD1-CG1 3.75Å; F126-V146 HydrophobicContact CE1-CG1 4.06Å; F129-V146 HydrophobicContact CD1-CB 4.37Å; F129-V146 HydrophobicContact CD1-CG1 3.68Å; F129-V146 HydrophobicContact CE1-CB 3.94Å; F129-V146 HydrophobicContact CE1-CG1 3.77Å; F129-V146 HydrophobicContact CE1-CG2 4.05Å; L130-V146 HydrophobicContact CD2-CB 4.46Å; L130-V146 HydrophobicContact CD2-CG1 4.12Å; L130-V146 HydrophobicContact CG-CG1 4.27Å; F142-V146 HydrophobicContact CD1-CG2 4.09Å; F142-V146 HydrophobicContact CD2-CG2 4.3Å; F142-V146 HydrophobicContact CE1-CG2 3.68Å; F142-V146 HydrophobicContact CE2-CG2 3.92Å; F142-V146 HydrophobicContact CG-CG2 4.39Å; F142-V146 HydrophobicContact CZ-CG2 3.58Å; F142-V146 WeakPolarHBondContact O-CG2 3.38Å; F142-V146 PolarHBondContact O-N 3.34Å; C143-V146 PolarHBondContact O-N 2.88Å; V146-Y149 PolarHBondContact O-N 3.47Å; V146-Y150 WeakPolarHBondContact O-CB 3.24Å; V146-Y150 PolarHBondContact O-N 3.1Å; V146-F177 HydrophobicContact CG2-CE2 4.04Å; V146-F177 HydrophobicContact CG2-CZ 4.05Å; V146-I210 HydrophobicContact CG2-CD1 4.49Å
147	R	89.9	Confident	87.2	Confident	116 Å²	116	49.3 Å²	49.3	44%	0.438	27%	0.265	S	S	.	.	H	α-helix	trans	-61.7	-46.5	174.1	-164.5	-178	-59.9	111.6	4.3	111.5	L130 C143 N144 Y149 Y150 E151	L130-R147 HydrophobicContact CD1-CB 4.47Å; L130-R147 HydrophobicContact CD1-CG 4.49Å; L130-R147 HydrophobicContact CD2-CB 3.92Å; L130-R147 HydrophobicContact CD2-CG 4.46Å; C143-R147 WeakPolarHBondContact O-CB 3.45Å; C143-R147 PolarHBondContact O-N 2.87Å; N144-R147 PolarHBondContact OD1-NH1 2.8Å; R147-Y149 PolarHBondContact O-N 2.99Å; R147-Y150 PolarHBondContact O-N 2.69Å; R147-E151 PolarHBondContact O-N 2.94Å
148	S	86.6	Confident	87.5	Confident	26 Å²	26	44.5 Å²	44.5	18%	0.182	23%	0.233	C	C	.	.	H	α-helix	trans	-58.5	-45.8	174.5	169.4	0	0	0	0	112.3	N144 A145 Y150 V152 R184	N144-S148 PolarHBondContact O-N 3.1Å; A145-S148 PolarHBondContact O-N 2.85Å; S148-Y150 VanDerWaalsContact C-N 3.35Å; S148-Y150 PolarHBondContact O-N 2.95Å; S148-V152 VanDerWaalsContact O-CB 3.28Å; S148-V152 WeakPolarHBondContact O-CB 3.4Å; S148-V152 WeakPolarHBondContact O-CG2 3.16Å; S148-V152 PolarHBondContact O-N 2.86Å; S148-R184 VanDerWaalsContact CB-NH2 3.25Å; S148-R184 PolarHBondContact OG-NH2 3.33Å
149	Y	90.4	Very high	87.7	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.217	C	C	.	.	I	π-helix	trans	-64.7	-36.9	176.9	175.8	-107.2	0	0	0	112.9	F126 A145 V146 R147 F153 L154 F173 V176 F177 Y207	F126-Y149 HydrophobicContact CD1-CD1 4.02Å; F126-Y149 HydrophobicContact CD1-CE1 4.25Å; F126-Y149 AromaticContact CE1-CD1 3.63Å; F126-Y149 HydrophobicContact CE1-CD1 3.63Å; F126-Y149 AromaticContact CE1-CE1 3.69Å; F126-Y149 HydrophobicContact CE1-CE1 3.69Å; F126-Y149 HydrophobicContact CZ-CD1 4.45Å; F126-Y149 HydrophobicContact CZ-CE1 4.07Å; A145-Y149 PolarHBondContact O-N 3.34Å; V146-Y149 PolarHBondContact O-N 3.47Å; R147-Y149 PolarHBondContact O-N 2.99Å; Y149-F153 HydrophobicContact CD2-CB 3.87Å; Y149-F153 AromaticContact CD2-CD1 3.94Å; Y149-F153 HydrophobicContact CD2-CD1 3.94Å; Y149-F153 HydrophobicContact CD2-CG 4.14Å; Y149-F153 HydrophobicContact CE1-CD1 4.47Å; Y149-F153 HydrophobicContact CE2-CB 4.03Å; Y149-F153 AromaticContact CE2-CD1 3.21Å; Y149-F153 HydrophobicContact CE2-CD1 3.21Å; Y149-F153 AromaticContact CE2-CE1 3.8Å; Y149-F153 HydrophobicContact CE2-CE1 3.8Å; Y149-F153 AromaticContact CE2-CG 3.77Å; Y149-F153 HydrophobicContact CE2-CG 3.77Å; Y149-F153 AromaticContact CZ-CD1 3.54Å; Y149-F153 AromaticContact CZ-CE1 3.91Å; Y149-F153 WeakPolarHBondContact O-CA 3.45Å; Y149-F153 WeakPolarHBondContact O-CB 2.78Å; Y149-F153 PolarHBondContact O-N 3.41Å; Y149-F153 VanDerWaalsContact O-N 3.1Å; Y149-L154 HydrophobicContact CD1-CD1 3.94Å; Y149-L154 HydrophobicContact CD1-CG 4Å; Y149-L154 HydrophobicContact CE1-CD1 3.69Å; Y149-L154 HydrophobicContact CE1-CD2 3.84Å; Y149-L154 HydrophobicContact CE1-CG 3.64Å; Y149-L154 PolarHBondContact O-N 2.9Å; Y149-F173 PolarHBondContact OH-O 2.97Å; Y149-F173 VanDerWaalsContact OH-O 3.13Å; Y149-V176 HydrophobicContact CE2-CG1 4.38Å; Y149-F177 AromaticContact CD1-CD2 3.79Å; Y149-F177 HydrophobicContact CD1-CD2 3.79Å; Y149-F177 HydrophobicContact CD1-CE2 4.46Å; Y149-F177 HydrophobicContact CD2-CB 4.03Å; Y149-F177 AromaticContact CD2-CD2 3.88Å; Y149-F177 HydrophobicContact CD2-CD2 3.88Å; Y149-F177 HydrophobicContact CD2-CG 4.48Å; Y149-F177 HydrophobicContact CE1-CB 4.42Å; Y149-F177 HydrophobicContact CE1-CD2 4.26Å; Y149-F177 HydrophobicContact CE2-CB 3.75Å; Y149-F177 HydrophobicContact CE2-CD2 4.36Å; Y149-F177 HydrophobicContact CG-CB 4.49Å; Y149-F177 AromaticContact CG-CD2 3.56Å; Y149-F177 HydrophobicContact CG-CD2 3.56Å; Y149-F177 HydrophobicContact CG-CE2 4.33Å; Y149-F177 HydrophobicContact CG-CG 4.49Å; Y149-Y207 AromaticContact CE1-CE2 3.86Å; Y149-Y207 HydrophobicContact CE1-CE2 3.86Å
150	Y	90.4	Very high	87.7	Confident	14 Å²	14	40.7 Å²	40.7	6%	0.055	21%	0.209	C	C	.	.	I	π-helix	trans	-67.6	-46.8	177.8	176.3	-96.1	0	0	0	112.4	K123 F126 Q127 L130 V146 R147 S148 L154 K155	K123-Y150 HydrophobicContact CB-CE2 4.25Å; K123-Y150 WeakPolarHBondContact O-CE2 3.34Å; F126-Y150 HydrophobicContact CB-CD2 3.84Å; F126-Y150 HydrophobicContact CB-CE2 4.49Å; Q127-Y150 HydrophobicContact CB-CE2 4.09Å; Q127-Y150 PolarHBondContact OE1-OH 3.13Å; L130-Y150 HydrophobicContact CD1-CD1 4.06Å; L130-Y150 HydrophobicContact CD1-CG 3.99Å; V146-Y150 WeakPolarHBondContact O-CB 3.24Å; V146-Y150 PolarHBondContact O-N 3.1Å; R147-Y150 PolarHBondContact O-N 2.69Å; S148-Y150 VanDerWaalsContact C-N 3.35Å; S148-Y150 PolarHBondContact O-N 2.95Å; Y150-L154 HydrophobicContact CD2-CB 4.43Å; Y150-L154 HydrophobicContact CD2-CD1 4.03Å; Y150-L154 PolarHBondContact O-N 3.47Å; Y150-K155 HydrophobicContact CD1-CD 4.14Å; Y150-K155 HydrophobicContact CE1-CD 3.73Å; Y150-K155 VanDerWaalsContact CE1-CE 3.44Å; Y150-K155 HydrophobicContact CE1-CG 4.32Å; Y150-K155 WeakPolarHBondContact O-CB 3.17Å; Y150-K155 PolarHBondContact O-N 3.47Å
151	E	86.2	Confident	87.6	Confident	92 Å²	92	39.8 Å²	39.8	43%	0.43	20%	0.199	S	C	.	.	I	π-helix	trans	-72.3	-51.9	178.6	-62.4	-57.5	141.1	0	0	112.8	R147 K155	R147-E151 PolarHBondContact O-N 2.94Å; E151-K155 WeakPolarHBondContact O-CB 3.37Å; E151-K155 IonicContact OE1-NZ 2.96Å; E151-K155 PolarHBondContact OE1-NZ 3.43Å; E151-K155 WeakPolarHBondContact OE2-CD 3.27Å; E151-K155 WeakPolarHBondContact OE2-CE 3.48Å; E151-K155 IonicContact OE2-NZ 3.45Å; E151-K155 PolarHBondContact OE2-NZ 2.71Å
152	V	83.7	Confident	87.6	Confident	52 Å²	52	38.3 Å²	38.3	32%	0.315	19%	0.186	S	C	.	.	I	π-helix	trans	-78	-37	-171.3	-177.8	0	0	0	0	112.3	S148 F765	S148-V152 VanDerWaalsContact O-CB 3.28Å; S148-V152 WeakPolarHBondContact O-CB 3.4Å; S148-V152 WeakPolarHBondContact O-CG2 3.16Å; S148-V152 PolarHBondContact O-N 2.86Å; V152-F765 HydrophobicContact CG1-CE1 4.32Å; V152-F765 WeakPolarHBondContact O-CZ 3.43Å
153	F	89.1	Confident	87.4	Confident	4 Å²	4	38.4 Å²	38.4	2%	0.018	19%	0.187	C	C	.	.	I	π-helix	trans	-104.7	-64.1	-176.1	-179.3	-97.8	0	0	0	112.8	Y149 K155 S156 V159 F173 V176 F765	Y149-F153 HydrophobicContact CD2-CB 3.87Å; Y149-F153 AromaticContact CD2-CD1 3.94Å; Y149-F153 HydrophobicContact CD2-CD1 3.94Å; Y149-F153 HydrophobicContact CD2-CG 4.14Å; Y149-F153 HydrophobicContact CE1-CD1 4.47Å; Y149-F153 HydrophobicContact CE2-CB 4.03Å; Y149-F153 AromaticContact CE2-CD1 3.21Å; Y149-F153 HydrophobicContact CE2-CD1 3.21Å; Y149-F153 AromaticContact CE2-CE1 3.8Å; Y149-F153 HydrophobicContact CE2-CE1 3.8Å; Y149-F153 AromaticContact CE2-CG 3.77Å; Y149-F153 HydrophobicContact CE2-CG 3.77Å; Y149-F153 AromaticContact CZ-CD1 3.54Å; Y149-F153 AromaticContact CZ-CE1 3.91Å; Y149-F153 WeakPolarHBondContact O-CA 3.45Å; Y149-F153 WeakPolarHBondContact O-CB 2.78Å; Y149-F153 PolarHBondContact O-N 3.41Å; Y149-F153 VanDerWaalsContact O-N 3.1Å; F153-K155 PolarHBondContact O-N 3.26Å; F153-S156 VanDerWaalsContact O-CB 3.3Å; F153-S156 WeakPolarHBondContact O-CB 3.43Å; F153-S156 PolarHBondContact O-N 3Å; F153-V159 HydrophobicContact CD1-CG2 4.44Å; F153-V159 HydrophobicContact CD2-CG2 3.6Å; F153-V159 HydrophobicContact CE1-CG1 4.22Å; F153-V159 HydrophobicContact CE1-CG2 4.33Å; F153-V159 HydrophobicContact CE2-CG2 3.45Å; F153-V159 VanDerWaalsContact CE2-CG2 3.45Å; F153-V159 HydrophobicContact CG-CG2 4.11Å; F153-V159 HydrophobicContact CZ-CG1 4.1Å; F153-V159 HydrophobicContact CZ-CG2 3.85Å; F153-V159 VanDerWaalsContact O-CG2 3.32Å; F153-V159 WeakPolarHBondContact O-CG2 3.35Å; F153-F173 HydrophobicContact CE1-CB 4.38Å; F153-F173 AromaticContact CE1-CD1 3.65Å; F153-F173 HydrophobicContact CE1-CD1 3.65Å; F153-F173 HydrophobicContact CE1-CD2 4.13Å; F153-F173 AromaticContact CE1-CE1 3.84Å; F153-F173 HydrophobicContact CE1-CE1 3.84Å; F153-F173 HydrophobicContact CE1-CE2 4.29Å; F153-F173 AromaticContact CE1-CG 3.8Å; F153-F173 HydrophobicContact CE1-CG 3.8Å; F153-F173 HydrophobicContact CE1-CZ 4.16Å; F153-F173 HydrophobicContact CZ-CD1 4.4Å; F153-F173 HydrophobicContact CZ-CD2 4.07Å; F153-F173 HydrophobicContact CZ-CE2 4.17Å; F153-F173 HydrophobicContact CZ-CG 4.18Å; F153-F173 HydrophobicContact CZ-CZ 4.39Å; F153-V176 HydrophobicContact CD2-CG1 3.62Å; F153-V176 HydrophobicContact CE2-CB 4.12Å; F153-V176 HydrophobicContact CE2-CG1 3.68Å; F153-V176 HydrophobicContact CE2-CG2 4.1Å; F153-V176 HydrophobicContact CG-CG1 4.1Å; F153-V176 HydrophobicContact CZ-CB 4.24Å; F153-V176 HydrophobicContact CZ-CG1 4.2Å; F153-V176 HydrophobicContact CZ-CG2 4.36Å; F153-F765 HydrophobicContact CB-CE1 4.49Å; F153-F765 HydrophobicContact CB-CZ 4.45Å; F153-F765 HydrophobicContact CD2-CB 4.33Å; F153-F765 AromaticContact CD2-CD1 3.88Å; F153-F765 HydrophobicContact CD2-CD1 3.88Å; F153-F765 AromaticContact CD2-CD2 3.49Å; F153-F765 HydrophobicContact CD2-CD2 3.49Å; F153-F765 VanDerWaalsContact CD2-CD2 3.49Å; F153-F765 HydrophobicContact CD2-CE1 4.03Å; F153-F765 AromaticContact CD2-CE2 3.66Å; F153-F765 HydrophobicContact CD2-CE2 3.66Å; F153-F765 AromaticContact CD2-CG 3.62Å; F153-F765 HydrophobicContact CD2-CG 3.62Å; F153-F765 AromaticContact CD2-CZ 3.93Å; F153-F765 HydrophobicContact CD2-CZ 3.93Å; F153-F765 HydrophobicContact CE2-CB 4.16Å; F153-F765 AromaticContact CE2-CD2 3.65Å; F153-F765 HydrophobicContact CE2-CD2 3.65Å; F153-F765 HydrophobicContact CE2-CE2 4.19Å; F153-F765 AromaticContact CE2-CG 3.87Å; F153-F765 HydrophobicContact CE2-CG 3.87Å
154	L	88.7	Confident	87	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.202	C	C	.	.	I	π-helix	trans	-62.1	-40.5	-170.6	-67.3	177.5	0	0	0	112.7	L122 K123 F126 Y149 Y150 S156 F173	L122-L154 HydrophobicContact CD2-CD2 3.98Å; L122-L154 HydrophobicContact CG-CD2 4.45Å; K123-L154 WeakPolarHBondContact CE-O 3.48Å; K123-L154 HydrophobicContact CG-CB 4.45Å; K123-L154 PolarHBondContact NZ-O 3.42Å; F126-L154 HydrophobicContact CB-CD1 3.9Å; F126-L154 HydrophobicContact CD1-CD1 3.72Å; F126-L154 HydrophobicContact CD2-CD1 4.13Å; F126-L154 HydrophobicContact CE1-CD1 4.36Å; F126-L154 HydrophobicContact CG-CD1 3.62Å; Y149-L154 HydrophobicContact CD1-CD1 3.94Å; Y149-L154 HydrophobicContact CD1-CG 4Å; Y149-L154 HydrophobicContact CE1-CD1 3.69Å; Y149-L154 HydrophobicContact CE1-CD2 3.84Å; Y149-L154 HydrophobicContact CE1-CG 3.64Å; Y149-L154 PolarHBondContact O-N 2.9Å; Y150-L154 HydrophobicContact CD2-CB 4.43Å; Y150-L154 HydrophobicContact CD2-CD1 4.03Å; Y150-L154 PolarHBondContact O-N 3.47Å; L154-S156 VanDerWaalsContact C-N 3.32Å; L154-S156 PolarHBondContact O-N 3.46Å; L154-F173 HydrophobicContact CD2-CD1 3.75Å; L154-F173 HydrophobicContact CD2-CE1 3.67Å
155	K	88.4	Confident	86.5	Confident	88 Å²	88	41 Å²	41	38%	0.383	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-21.7	176.5	-90.1	167.8	156.2	179.7	0	114.1	Y150 E151 F153	Y150-K155 HydrophobicContact CD1-CD 4.14Å; Y150-K155 HydrophobicContact CE1-CD 3.73Å; Y150-K155 VanDerWaalsContact CE1-CE 3.44Å; Y150-K155 HydrophobicContact CE1-CG 4.32Å; Y150-K155 WeakPolarHBondContact O-CB 3.17Å; Y150-K155 PolarHBondContact O-N 3.47Å; E151-K155 WeakPolarHBondContact O-CB 3.37Å; E151-K155 IonicContact OE1-NZ 2.96Å; E151-K155 PolarHBondContact OE1-NZ 3.43Å; E151-K155 WeakPolarHBondContact OE2-CD 3.27Å; E151-K155 WeakPolarHBondContact OE2-CE 3.48Å; E151-K155 IonicContact OE2-NZ 3.45Å; E151-K155 PolarHBondContact OE2-NZ 2.71Å; F153-K155 PolarHBondContact O-N 3.26Å
156	S	86.4	Confident	85.7	Confident	24 Å²	24	41.3 Å²	41.3	17%	0.168	20%	0.201	C	C	.	.			trans	-63.9	131.8	-169.6	-166.5	0	0	0	0	114.6	F153 L154 R158 V159 A160	F153-S156 VanDerWaalsContact O-CB 3.3Å; F153-S156 WeakPolarHBondContact O-CB 3.43Å; F153-S156 PolarHBondContact O-N 3Å; L154-S156 VanDerWaalsContact C-N 3.32Å; L154-S156 PolarHBondContact O-N 3.46Å; S156-R158 PolarHBondContact O-N 3.36Å; S156-R158 VanDerWaalsContact O-N 3.13Å; S156-V159 PolarHBondContact O-N 2.9Å; S156-A160 PolarHBondContact O-N 3.34Å
157	D	84.9	Confident	84.7	Confident	116 Å²	116	41.5 Å²	41.5	62%	0.62	20%	0.202	S	C	*	.	H	α-helix	trans	-62.3	-19.1	173.9	-68.2	-52.9	0	0	0	114.1	R161	D157-R161 WeakPolarHBondContact O-CB 3.45Å; D157-R161 PolarHBondContact O-N 3.13Å; D157-R161 PolarHBondContact O-NE 2.76Å
158	R	86.4	Confident	84.1	Confident	26 Å²	26	36 Å²	36	10%	0.098	18%	0.181	C	C	.	.	H	α-helix	trans	-65.4	-46.6	170.9	-60.6	-173.3	-78.6	173.1	-8.1	110.5	S156 R161 M162 R760 Y761 P764	S156-R158 PolarHBondContact O-N 3.36Å; S156-R158 VanDerWaalsContact O-N 3.13Å; R158-R161 PolarHBondContact O-N 2.94Å; R158-M162 WeakPolarHBondContact O-CB 3.3Å; R158-M162 PolarHBondContact O-N 2.83Å; R158-R760 VanDerWaalsContact CD-O 3.26Å; R158-R760 WeakPolarHBondContact CD-O 3.43Å; R158-Y761 HydrophobicContact CG-CD1 3.9Å; R158-Y761 HydrophobicContact CG-CE1 3.89Å; R158-P764 HydrophobicContact CB-CB 4Å; R158-P764 HydrophobicContact CB-CG 4.12Å
159	V	87.5	Confident	84	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-70.4	-39.6	176.1	180	0	0	0	0	110.8	L119 F153 S156 R161 M162 V163 F173 F765	L119-V159 HydrophobicContact CD1-CG1 4.49Å; F153-V159 HydrophobicContact CD1-CG2 4.44Å; F153-V159 HydrophobicContact CD2-CG2 3.6Å; F153-V159 HydrophobicContact CE1-CG1 4.22Å; F153-V159 HydrophobicContact CE1-CG2 4.33Å; F153-V159 HydrophobicContact CE2-CG2 3.45Å; F153-V159 VanDerWaalsContact CE2-CG2 3.45Å; F153-V159 HydrophobicContact CG-CG2 4.11Å; F153-V159 HydrophobicContact CZ-CG1 4.1Å; F153-V159 HydrophobicContact CZ-CG2 3.85Å; F153-V159 VanDerWaalsContact O-CG2 3.32Å; F153-V159 WeakPolarHBondContact O-CG2 3.35Å; S156-V159 PolarHBondContact O-N 2.9Å; V159-R161 VanDerWaalsContact C-N 3.3Å; V159-R161 PolarHBondContact O-N 3.37Å; V159-M162 HydrophobicContact CG1-CE 4.35Å; V159-M162 HydrophobicContact CG2-CE 4.47Å; V159-M162 PolarHBondContact O-N 3.33Å; V159-V163 HydrophobicContact CG1-CG2 4.48Å; V159-V163 WeakPolarHBondContact O-CG2 3.45Å; V159-V163 PolarHBondContact O-N 3.11Å; V159-F173 HydrophobicContact CG1-CE1 4.06Å; V159-F173 HydrophobicContact CG1-CE2 4.02Å; V159-F173 HydrophobicContact CG1-CZ 3.37Å; V159-F765 HydrophobicContact CG2-CD2 4Å; V159-F765 HydrophobicContact CG2-CE2 3.69Å
160	A	85.8	Confident	83.6	Confident	17 Å²	17	36.3 Å²	36.3	14%	0.14	19%	0.185	C	C	.	.	H	α-helix	trans	-60	-39	175.5	0	0	0	0	0	112.3	L119 S156 Q164	L119-A160 HydrophobicContact CD2-CB 4.4Å; S156-A160 PolarHBondContact O-N 3.34Å; A160-Q164 WeakPolarHBondContact O-CG 3.25Å; A160-Q164 PolarHBondContact O-N 3.19Å; A160-Q164 PolarHBondContact O-NE2 2.84Å
161	R	83.9	Confident	83.2	Confident	133 Å²	133	38.5 Å²	38.5	50%	0.502	20%	0.198	S	C	.	.	H	α-helix	trans	-70.3	-43.1	172.6	-81	-176.4	-82.3	-173.2	-10.6	112.7	D157 R158 V159 V163 Q164 S165	D157-R161 WeakPolarHBondContact O-CB 3.45Å; D157-R161 PolarHBondContact O-N 3.13Å; D157-R161 PolarHBondContact O-NE 2.76Å; R158-R161 PolarHBondContact O-N 2.94Å; V159-R161 VanDerWaalsContact C-N 3.3Å; V159-R161 PolarHBondContact O-N 3.37Å; R161-V163 VanDerWaalsContact C-N 3.28Å; R161-V163 PolarHBondContact O-N 3.12Å; R161-Q164 PolarHBondContact O-N 3.48Å; R161-S165 PolarHBondContact O-N 2.93Å; R161-S165 PolarHBondContact O-OG 3.31Å
162	M	85.1	Confident	83.2	Confident	6 Å²	6	35.2 Å²	35.2	3%	0.03	18%	0.183	C	C	.	.	H	α-helix	trans	-59.3	-36.1	176.3	-172.3	175.4	60.8	0	0	113.2	R158 V159 S165 G166 G167 C168 F173 P764 R767	R158-M162 WeakPolarHBondContact O-CB 3.3Å; R158-M162 PolarHBondContact O-N 2.83Å; V159-M162 HydrophobicContact CG1-CE 4.35Å; V159-M162 HydrophobicContact CG2-CE 4.47Å; V159-M162 PolarHBondContact O-N 3.33Å; M162-S165 WeakPolarHBondContact CA-OG 3.44Å; M162-S165 PolarHBondContact O-OG 2.98Å; M162-G166 PolarHBondContact O-N 2.95Å; M162-G167 PolarHBondContact O-N 3.23Å; M162-G167 VanDerWaalsContact O-N 3.13Å; M162-C168 HydrophobicContact CE-CB 3.81Å; M162-C168 HydrophobicContact CG-CB 3.91Å; M162-C168 HydrophobicContact SD-CB 4.03Å; M162-F173 HydrophobicContact CE-CE2 4.43Å; M162-P764 HydrophobicContact CB-CG 4.35Å; M162-P764 HydrophobicContact SD-CB 4.21Å; M162-P764 HydrophobicContact SD-CG 4.25Å; M162-R767 HydrophobicContact SD-CB 3.97Å
163	V	85.3	Confident	83.5	Confident	3 Å²	3	32.7 Å²	32.7	2%	0.018	17%	0.168	C	C	.	.	H	α-helix	trans	-68.9	-39	172.3	164.8	0	0	0	0	111.7	L114 L119 V159 R161 G166 C168 F173	L114-V163 HydrophobicContact CB-CG2 4.38Å; L119-V163 HydrophobicContact CB-CG1 4.09Å; L119-V163 HydrophobicContact CB-CG2 4.39Å; L119-V163 HydrophobicContact CD2-CB 4.17Å; L119-V163 HydrophobicContact CD2-CG1 4.2Å; L119-V163 HydrophobicContact CD2-CG2 4.06Å; V159-V163 HydrophobicContact CG1-CG2 4.48Å; V159-V163 WeakPolarHBondContact O-CG2 3.45Å; V159-V163 PolarHBondContact O-N 3.11Å; R161-V163 VanDerWaalsContact C-N 3.28Å; R161-V163 PolarHBondContact O-N 3.12Å; V163-G166 PolarHBondContact O-N 2.98Å; V163-C168 VanDerWaalsContact CG2-SG 3.5Å; V163-F173 HydrophobicContact CG2-CE2 4.18Å; V163-F173 HydrophobicContact CG2-CZ 3.81Å
164	Q	81.6	Confident	83.5	Confident	114 Å²	114	35.8 Å²	35.8	53%	0.533	18%	0.18	S	C	.	.	H	α-helix	trans	-69	-39.5	177.7	-75.4	168.1	90	0	0	112.4	A160 R161 G166	A160-Q164 WeakPolarHBondContact O-CG 3.25Å; A160-Q164 PolarHBondContact O-N 3.19Å; A160-Q164 PolarHBondContact O-NE2 2.84Å; R161-Q164 PolarHBondContact O-N 3.48Å; Q164-G166 PolarHBondContact O-N 3.47Å
165	S	76.6	Confident	83.5	Confident	30 Å²	30	37.5 Å²	37.5	21%	0.21	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-11.3	174.1	65	0	0	0	0	113.9	R161 M162 G167 G703 V705	R161-S165 PolarHBondContact O-N 2.93Å; R161-S165 PolarHBondContact O-OG 3.31Å; M162-S165 WeakPolarHBondContact CA-OG 3.44Å; M162-S165 PolarHBondContact O-OG 2.98Å; S165-G167 VanDerWaalsContact C-N 3.32Å; S165-G167 PolarHBondContact O-N 3.23Å; S165-G703 WeakPolarHBondContact CB-O 3.3Å; S165-V705 VanDerWaalsContact OG-CG2 3.3Å; S165-V705 WeakPolarHBondContact OG-CG2 3.3Å
166	G	72.3	Confident	83.5	Confident	7 Å²	7	33.8 Å²	33.8	7%	0.072	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	14.3	179.1	0	0	0	0	0	115.4	K113 M162 V163 Q164 C168	K113-G166 VanDerWaalsContact CE-CA 3.42Å; M162-G166 PolarHBondContact O-N 2.95Å; V163-G166 PolarHBondContact O-N 2.98Å; Q164-G166 PolarHBondContact O-N 3.47Å; G166-C168 VanDerWaalsContact C-N 3.28Å; G166-C168 PolarHBondContact O-N 3.25Å
167	G	69.4	Low	83.7	Confident	3 Å²	3	32.6 Å²	32.6	3%	0.031	16%	0.164	C	C	.	.			trans	-74.4	-8.6	-175.1	0	0	0	0	0	115.8	M162 S165	M162-G167 PolarHBondContact O-N 3.23Å; M162-G167 VanDerWaalsContact O-N 3.13Å; S165-G167 VanDerWaalsContact C-N 3.32Å; S165-G167 PolarHBondContact O-N 3.23Å
168	C	78.3	Confident	83.9	Confident	1 Å²	1	30 Å²	30	1%	0.007	15%	0.148	C	C	.	.			trans	-127.7	146.3	-171.2	59.9	0	0	0	0	114.3	L114 M162 V163 G166 D172 F173	L114-C168 PolarHBondContact N-O 3.32Å; L114-C168 VanDerWaalsContact N-O 3.1Å; M162-C168 HydrophobicContact CE-CB 3.81Å; M162-C168 HydrophobicContact CG-CB 3.91Å; M162-C168 HydrophobicContact SD-CB 4.03Å; V163-C168 VanDerWaalsContact CG2-SG 3.5Å; G166-C168 VanDerWaalsContact C-N 3.28Å; G166-C168 PolarHBondContact O-N 3.25Å; C168-D172 HydrophobicContact CB-CB 4.44Å; C168-F173 HydrophobicContact CB-CE2 4.23Å
169	S	83.4	Confident	83.8	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.007	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-104.9	172.9	175.1	73.4	0	0	0	0	112.7	Q111 Q112 N171 D172	Q111-S169 PolarHBondContact OE1-OG 3.02Å; Q111-S169 VanDerWaalsContact OE1-OG 3.13Å; Q112-S169 WeakPolarHBondContact O-CA 3.35Å; Q112-S169 WeakPolarHBondContact O-CB 3.27Å; S169-N171 PolarHBondContact O-N 3.04Å; S169-N171 PolarHBondContact OG-N 3.09Å; S169-N171 VanDerWaalsContact OG-N 3.12Å; S169-D172 WeakPolarHBondContact CB-OD2 3.2Å; S169-D172 PolarHBondContact N-OD2 3.23Å; S169-D172 PolarHBondContact O-N 3.21Å; S169-D172 PolarHBondContact OG-N 3.48Å; S169-D172 PolarHBondContact OG-OD2 2.8Å
170	A	81.4	Confident	83.6	Confident	31 Å²	31	33.9 Å²	33.9	26%	0.256	17%	0.166	S	C	.	.	H	α-helix	trans	-57.8	-28.9	167.5	0	0	0	0	0	113.6	R174 Y211	A170-R174 PolarHBondContact O-N 3.4Å; A170-Y211 HydrophobicContact CB-CE2 4.3Å; A170-Y211 WeakPolarHBondContact CB-OH 3.45Å
171	N	83.9	Confident	83.8	Confident	60 Å²	60	33 Å²	33	32%	0.321	16%	0.16	S	C	.	.	H	α-helix	trans	-78.1	-34.1	-178.4	-168.4	78.1	0	0	0	112	Q111 S169 F173 R174 E175	Q111-N171 VanDerWaalsContact OE1-CB 3.25Å; S169-N171 PolarHBondContact O-N 3.04Å; S169-N171 PolarHBondContact OG-N 3.09Å; S169-N171 VanDerWaalsContact OG-N 3.12Å; N171-F173 VanDerWaalsContact C-N 3.32Å; N171-F173 PolarHBondContact O-N 2.91Å; N171-R174 WeakPolarHBondContact O-CB 3.44Å; N171-R174 PolarHBondContact O-N 3.24Å; N171-E175 PolarHBondContact O-N 3.42Å
172	D	86.1	Confident	83.8	Confident	23 Å²	23	28.9 Å²	28.9	12%	0.123	15%	0.146	C	C	.	.	H	α-helix	trans	-61.8	-42.5	176	-65	-67.7	0	0	0	111.4	C168 S169 R174 E175 V176 R767	C168-D172 HydrophobicContact CB-CB 4.44Å; S169-D172 WeakPolarHBondContact CB-OD2 3.2Å; S169-D172 PolarHBondContact N-OD2 3.23Å; S169-D172 PolarHBondContact O-N 3.21Å; S169-D172 PolarHBondContact OG-N 3.48Å; S169-D172 PolarHBondContact OG-OD2 2.8Å; D172-R174 VanDerWaalsContact C-N 3.34Å; D172-R174 PolarHBondContact O-N 3.17Å; D172-E175 PolarHBondContact O-N 2.71Å; D172-V176 VanDerWaalsContact O-CG2 3.31Å; D172-V176 WeakPolarHBondContact O-CG2 3.49Å; D172-V176 PolarHBondContact O-N 2.9Å; D172-R767 HydrophobicContact CB-CG 4.44Å; D172-R767 WeakPolarHBondContact OD1-CD 3.4Å; D172-R767 IonicContact OD1-NH1 2.96Å; D172-R767 PolarHBondContact OD1-NH1 3.28Å
173	F	89.3	Confident	83.2	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-59.7	-45.5	174.5	-83.6	-128.2	0	0	0	111.1	L114 L119 L122 Y149 F153 L154 V159 M162 V163 C168 N171 V176 F177	L114-F173 HydrophobicContact CD1-CD1 4Å; L114-F173 HydrophobicContact CD1-CD2 3.46Å; L114-F173 VanDerWaalsContact CD1-CD2 3.46Å; L114-F173 HydrophobicContact CD1-CE1 4Å; L114-F173 HydrophobicContact CD1-CE2 3.47Å; L114-F173 VanDerWaalsContact CD1-CE2 3.47Å; L114-F173 HydrophobicContact CD1-CG 3.75Å; L114-F173 HydrophobicContact CD1-CZ 3.75Å; L119-F173 HydrophobicContact CD1-CE1 3.76Å; L119-F173 HydrophobicContact CD1-CZ 3.97Å; L122-F173 HydrophobicContact CD2-CD1 3.57Å; L122-F173 HydrophobicContact CD2-CE1 3.92Å; Y149-F173 PolarHBondContact OH-O 2.97Å; Y149-F173 VanDerWaalsContact OH-O 3.13Å; F153-F173 HydrophobicContact CE1-CB 4.38Å; F153-F173 AromaticContact CE1-CD1 3.65Å; F153-F173 HydrophobicContact CE1-CD1 3.65Å; F153-F173 HydrophobicContact CE1-CD2 4.13Å; F153-F173 AromaticContact CE1-CE1 3.84Å; F153-F173 HydrophobicContact CE1-CE1 3.84Å; F153-F173 HydrophobicContact CE1-CE2 4.29Å; F153-F173 AromaticContact CE1-CG 3.8Å; F153-F173 HydrophobicContact CE1-CG 3.8Å; F153-F173 HydrophobicContact CE1-CZ 4.16Å; F153-F173 HydrophobicContact CZ-CD1 4.4Å; F153-F173 HydrophobicContact CZ-CD2 4.07Å; F153-F173 HydrophobicContact CZ-CE2 4.17Å; F153-F173 HydrophobicContact CZ-CG 4.18Å; F153-F173 HydrophobicContact CZ-CZ 4.39Å; L154-F173 HydrophobicContact CD2-CD1 3.75Å; L154-F173 HydrophobicContact CD2-CE1 3.67Å; V159-F173 HydrophobicContact CG1-CE1 4.06Å; V159-F173 HydrophobicContact CG1-CE2 4.02Å; V159-F173 HydrophobicContact CG1-CZ 3.37Å; M162-F173 HydrophobicContact CE-CE2 4.43Å; V163-F173 HydrophobicContact CG2-CE2 4.18Å; V163-F173 HydrophobicContact CG2-CZ 3.81Å; C168-F173 HydrophobicContact CB-CE2 4.23Å; N171-F173 VanDerWaalsContact C-N 3.32Å; N171-F173 PolarHBondContact O-N 2.91Å; F173-V176 PolarHBondContact O-N 2.77Å; F173-F177 PolarHBondContact O-N 3.35Å
174	R	88.8	Confident	83	Confident	69 Å²	69	37.4 Å²	37.4	26%	0.26	18%	0.18	S	C	.	.	H	α-helix	trans	-62.6	-44.8	178.3	-174.3	-178.3	-172.7	-87.5	9.7	112.9	A170 N171 D172 F177 K178 I204 Y207 D208	A170-R174 PolarHBondContact O-N 3.4Å; N171-R174 WeakPolarHBondContact O-CB 3.44Å; N171-R174 PolarHBondContact O-N 3.24Å; D172-R174 VanDerWaalsContact C-N 3.34Å; D172-R174 PolarHBondContact O-N 3.17Å; R174-F177 PolarHBondContact O-N 2.63Å; R174-K178 WeakPolarHBondContact O-CB 3.38Å; R174-K178 PolarHBondContact O-N 3.46Å; R174-I204 VanDerWaalsContact CZ-CG2 3.45Å; R174-Y207 HydrophobicContact CB-CD1 4.45Å; R174-Y207 HydrophobicContact CB-CE1 3.7Å; R174-Y207 HydrophobicContact CG-CD1 4Å; R174-Y207 HydrophobicContact CG-CE1 3.73Å; R174-Y207 PolarHBondContact N-OH 3.46Å; R174-D208 WeakPolarHBondContact CD-OD1 3.36Å; R174-D208 IonicContact CZ-OD1 3.74Å; R174-D208 IonicContact CZ-OD2 3.52Å; R174-D208 IonicContact NE-OD1 3.72Å; R174-D208 PolarHBondContact NE-OD1 3.23Å; R174-D208 IonicContact NE-OD2 3.54Å; R174-D208 PolarHBondContact NE-OD2 3.16Å; R174-D208 VanDerWaalsContact NE-OD2 3.16Å; R174-D208 IonicContact NH2-OD1 3.59Å; R174-D208 IonicContact NH2-OD2 2.66Å; R174-D208 PolarHBondContact NH2-OD2 2.76Å
175	E	87.9	Confident	83.1	Confident	36 Å²	36	32.2 Å²	32.2	17%	0.168	16%	0.156	C	C	.	.	H	α-helix	trans	-77.2	-21.6	179.5	-62.7	-58.9	114	0	0	112.9	N171 D172 K178 K179	N171-E175 PolarHBondContact O-N 3.42Å; D172-E175 PolarHBondContact O-N 2.71Å; E175-K178 WeakPolarHBondContact OE2-CD 3.21Å; E175-K178 IonicContact OE2-NZ 3.85Å; E175-K178 PolarHBondContact OE2-NZ 2.86Å; E175-K179 PolarHBondContact O-N 2.82Å; E175-K179 VanDerWaalsContact O-N 3.09Å
176	V	88.6	Confident	83.1	Confident	9 Å²	9	38.7 Å²	38.7	6%	0.055	18%	0.176	C	C	.	.	H	α-helix	trans	-71.3	-43.8	165.7	173.4	0	0	0	0	111.2	Y149 F153 D172 F173 K178 K179 N180 F765 R767	Y149-V176 HydrophobicContact CE2-CG1 4.38Å; F153-V176 HydrophobicContact CD2-CG1 3.62Å; F153-V176 HydrophobicContact CE2-CB 4.12Å; F153-V176 HydrophobicContact CE2-CG1 3.68Å; F153-V176 HydrophobicContact CE2-CG2 4.1Å; F153-V176 HydrophobicContact CG-CG1 4.1Å; F153-V176 HydrophobicContact CZ-CB 4.24Å; F153-V176 HydrophobicContact CZ-CG1 4.2Å; F153-V176 HydrophobicContact CZ-CG2 4.36Å; D172-V176 VanDerWaalsContact O-CG2 3.31Å; D172-V176 WeakPolarHBondContact O-CG2 3.49Å; D172-V176 PolarHBondContact O-N 2.9Å; F173-V176 PolarHBondContact O-N 2.77Å; V176-K178 VanDerWaalsContact C-N 3.28Å; V176-K178 PolarHBondContact O-N 2.89Å; V176-K179 PolarHBondContact O-N 3.38Å; V176-N180 PolarHBondContact O-N 2.89Å; V176-N180 VanDerWaalsContact O-N 3.16Å; V176-F765 HydrophobicContact CG1-CB 4.31Å; V176-F765 HydrophobicContact CG2-CB 4.23Å; V176-R767 HydrophobicContact CG2-CG 3.85Å
177	F	90.3	Very high	83.2	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-56.6	-45.3	172.4	179.7	-105.5	0	0	0	111.1	F142 V146 Y149 F173 R174 N180 I181 I204 Y207	F142-F177 HydrophobicContact CD2-CZ 4.48Å; F142-F177 HydrophobicContact CE2-CE1 4.2Å; F142-F177 AromaticContact CE2-CZ 3.75Å; F142-F177 HydrophobicContact CE2-CZ 3.75Å; F142-F177 HydrophobicContact CZ-CZ 4.4Å; V146-F177 HydrophobicContact CG2-CE2 4.04Å; V146-F177 HydrophobicContact CG2-CZ 4.05Å; Y149-F177 AromaticContact CD1-CD2 3.79Å; Y149-F177 HydrophobicContact CD1-CD2 3.79Å; Y149-F177 HydrophobicContact CD1-CE2 4.46Å; Y149-F177 HydrophobicContact CD2-CB 4.03Å; Y149-F177 AromaticContact CD2-CD2 3.88Å; Y149-F177 HydrophobicContact CD2-CD2 3.88Å; Y149-F177 HydrophobicContact CD2-CG 4.48Å; Y149-F177 HydrophobicContact CE1-CB 4.42Å; Y149-F177 HydrophobicContact CE1-CD2 4.26Å; Y149-F177 HydrophobicContact CE2-CB 3.75Å; Y149-F177 HydrophobicContact CE2-CD2 4.36Å; Y149-F177 HydrophobicContact CG-CB 4.49Å; Y149-F177 AromaticContact CG-CD2 3.56Å; Y149-F177 HydrophobicContact CG-CD2 3.56Å; Y149-F177 HydrophobicContact CG-CE2 4.33Å; Y149-F177 HydrophobicContact CG-CG 4.49Å; F173-F177 PolarHBondContact O-N 3.35Å; R174-F177 PolarHBondContact O-N 2.63Å; F177-N180 WeakPolarHBondContact O-CB 3.33Å; F177-N180 PolarHBondContact O-N 2.98Å; F177-I181 HydrophobicContact CD1-CD1 4.31Å; F177-I181 HydrophobicContact CD1-CG2 4.47Å; F177-I181 HydrophobicContact CD2-CG2 4.47Å; F177-I181 HydrophobicContact CE1-CD1 3.91Å; F177-I181 HydrophobicContact CE1-CG1 4.46Å; F177-I181 HydrophobicContact CE1-CG2 3.93Å; F177-I181 HydrophobicContact CE2-CG2 3.94Å; F177-I181 HydrophobicContact CZ-CG2 3.65Å; F177-I181 WeakPolarHBondContact O-CG1 3.34Å; F177-I181 PolarHBondContact O-N 2.93Å; F177-I204 HydrophobicContact CD1-CD1 4.04Å; F177-I204 HydrophobicContact CE1-CD1 4.49Å; F177-Y207 HydrophobicContact CB-CD2 3.78Å; F177-Y207 HydrophobicContact CB-CE2 3.7Å; F177-Y207 AromaticContact CD1-CD2 3.35Å; F177-Y207 HydrophobicContact CD1-CD2 3.35Å; F177-Y207 HydrophobicContact CD1-CE2 4.18Å; F177-Y207 AromaticContact CD1-CG 3.67Å; F177-Y207 HydrophobicContact CD1-CG 3.67Å; F177-Y207 AromaticContact CD2-CD2 3.97Å; F177-Y207 HydrophobicContact CD2-CD2 3.97Å; F177-Y207 HydrophobicContact CD2-CE2 4.42Å; F177-Y207 AromaticContact CE1-CD2 3.88Å; F177-Y207 HydrophobicContact CE1-CD2 3.88Å; F177-Y207 HydrophobicContact CE1-CG 4.07Å; F177-Y207 HydrophobicContact CE2-CD2 4.43Å; F177-Y207 AromaticContact CG-CD2 3.39Å; F177-Y207 HydrophobicContact CG-CD2 3.39Å; F177-Y207 AromaticContact CG-CE2 3.85Å; F177-Y207 HydrophobicContact CG-CE2 3.85Å; F177-Y207 HydrophobicContact CG-CG 4.18Å; F177-Y207 HydrophobicContact CZ-CD2 4.39Å
178	K	89.6	Confident	83.6	Confident	62 Å²	62	45.7 Å²	45.7	27%	0.27	22%	0.218	S	C	.	.	H	α-helix	trans	-55.5	-50.5	175.1	-171.7	-166.3	172.6	-158	0	112.9	R174 E175 V176 N180 I181 E182 I204	R174-K178 WeakPolarHBondContact O-CB 3.38Å; R174-K178 PolarHBondContact O-N 3.46Å; E175-K178 WeakPolarHBondContact OE2-CD 3.21Å; E175-K178 IonicContact OE2-NZ 3.85Å; E175-K178 PolarHBondContact OE2-NZ 2.86Å; V176-K178 VanDerWaalsContact C-N 3.28Å; V176-K178 PolarHBondContact O-N 2.89Å; K178-N180 VanDerWaalsContact C-N 3.34Å; K178-N180 PolarHBondContact O-N 3.49Å; K178-I181 VanDerWaalsContact O-CG1 3.23Å; K178-I181 WeakPolarHBondContact O-CG1 3.46Å; K178-I181 PolarHBondContact O-N 3.21Å; K178-E182 VanDerWaalsContact CE-OE1 3.28Å; K178-E182 WeakPolarHBondContact CE-OE1 3.13Å; K178-E182 HydrophobicContact CG-CG 4.47Å; K178-E182 IonicContact NZ-OE1 2.73Å; K178-E182 WeakPolarHBondContact O-CG 3.29Å; K178-E182 PolarHBondContact O-N 2.89Å; K178-I204 HydrophobicContact CB-CD1 3.77Å; K178-I204 HydrophobicContact CG-CD1 4.02Å
179	K	84.2	Confident	83.4	Confident	77 Å²	77	50.5 Å²	50.5	34%	0.335	25%	0.249	S	C	.	.	H	α-helix	trans	-59.6	-42.2	178.7	-74.2	-171.7	-176.7	-177.9	0	112	E175 V176 I181 E182 E769	E175-K179 PolarHBondContact O-N 2.82Å; E175-K179 VanDerWaalsContact O-N 3.09Å; V176-K179 PolarHBondContact O-N 3.38Å; K179-I181 PolarHBondContact O-N 3.49Å; K179-E182 PolarHBondContact O-N 3.29Å; K179-E769 IonicContact NZ-OE1 2.65Å; K179-E769 PolarHBondContact NZ-OE1 3.33Å
180	N	84.8	Confident	82.9	Confident	29 Å²	29	58.5 Å²	58.5	16%	0.155	29%	0.287	C	S	.	.	H	α-helix	trans	-59.5	-47.1	174.9	-177.8	-19.3	0	0	0	111.8	V176 F177 K178 R184	V176-N180 PolarHBondContact O-N 2.89Å; V176-N180 VanDerWaalsContact O-N 3.16Å; F177-N180 WeakPolarHBondContact O-CB 3.33Å; F177-N180 PolarHBondContact O-N 2.98Å; K178-N180 VanDerWaalsContact C-N 3.34Å; K178-N180 PolarHBondContact O-N 3.49Å; N180-R184 PolarHBondContact OD1-NE 3.46Å
181	I	88.3	Confident	82.6	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-73.7	-27.8	179.4	63.7	165.6	0	0	0	113.9	A145 F177 K178 K179 K183 R184 V185 L200 W203 I204	A145-I181 HydrophobicContact CB-CG2 3.94Å; F177-I181 HydrophobicContact CD1-CD1 4.31Å; F177-I181 HydrophobicContact CD1-CG2 4.47Å; F177-I181 HydrophobicContact CD2-CG2 4.47Å; F177-I181 HydrophobicContact CE1-CD1 3.91Å; F177-I181 HydrophobicContact CE1-CG1 4.46Å; F177-I181 HydrophobicContact CE1-CG2 3.93Å; F177-I181 HydrophobicContact CE2-CG2 3.94Å; F177-I181 HydrophobicContact CZ-CG2 3.65Å; F177-I181 WeakPolarHBondContact O-CG1 3.34Å; F177-I181 PolarHBondContact O-N 2.93Å; K178-I181 VanDerWaalsContact O-CG1 3.23Å; K178-I181 WeakPolarHBondContact O-CG1 3.46Å; K178-I181 PolarHBondContact O-N 3.21Å; K179-I181 PolarHBondContact O-N 3.49Å; I181-K183 PolarHBondContact O-N 2.93Å; I181-R184 PolarHBondContact O-N 3.29Å; I181-V185 WeakPolarHBondContact O-CB 3.29Å; I181-V185 WeakPolarHBondContact O-CG2 3.38Å; I181-V185 PolarHBondContact O-N 2.97Å; I181-L200 HydrophobicContact CD1-CD1 3.62Å; I181-L200 HydrophobicContact CG1-CD1 3.65Å; I181-W203 HydrophobicContact CB-CE3 3.75Å; I181-W203 HydrophobicContact CB-CZ3 4.08Å; I181-W203 HydrophobicContact CD1-CB 3.76Å; I181-W203 HydrophobicContact CD1-CE3 4.17Å; I181-W203 HydrophobicContact CG2-CE3 3.71Å; I181-W203 HydrophobicContact CG2-CZ3 4.02Å; I181-I204 HydrophobicContact CD1-CD1 3.91Å; I181-I204 HydrophobicContact CD1-CG1 4.01Å
182	E	84.9	Confident	81.7	Confident	46 Å²	46	67.4 Å²	67.4	22%	0.215	33%	0.329	C	S	.	.	H	α-helix	trans	-59.7	-44.7	178	-84.5	-172.6	-141.5	0	0	112.2	K178 K179 R186 L200	K178-E182 VanDerWaalsContact CE-OE1 3.28Å; K178-E182 WeakPolarHBondContact CE-OE1 3.13Å; K178-E182 HydrophobicContact CG-CG 4.47Å; K178-E182 IonicContact NZ-OE1 2.73Å; K178-E182 WeakPolarHBondContact O-CG 3.29Å; K178-E182 PolarHBondContact O-N 2.89Å; K179-E182 PolarHBondContact O-N 3.29Å; E182-R186 WeakPolarHBondContact O-CG 3.34Å; E182-R186 PolarHBondContact O-N 3.38Å; E182-R186 VanDerWaalsContact O-N 3.08Å; E182-R186 IonicContact OE2-CZ 3.46Å; E182-R186 IonicContact OE2-NH2 3.37Å; E182-R186 PolarHBondContact OE2-NH2 3.47Å; E182-L200 HydrophobicContact CB-CD1 4.45Å; E182-L200 HydrophobicContact CG-CD1 3.62Å; E182-L200 HydrophobicContact CG-CD2 3.9Å; E182-L200 HydrophobicContact CG-CG 4.44Å
183	K	72	Confident	81	Confident	95 Å²	95	70.6 Å²	70.6	41%	0.413	37%	0.367	S	S	.	.	H	α-helix	trans	-60.7	-49.9	173.8	-80.3	-170.9	176.4	177.8	0	111.2	I181 V185 R186 S187 E853	I181-K183 PolarHBondContact O-N 2.93Å; K183-V185 PolarHBondContact O-N 3.47Å; K183-R186 WeakPolarHBondContact O-CB 3.45Å; K183-R186 PolarHBondContact O-N 2.89Å; K183-S187 PolarHBondContact O-N 3.16Å; K183-S187 VanDerWaalsContact O-N 3.13Å; K183-S187 PolarHBondContact O-OG 2.84Å; K183-E853 VanDerWaalsContact CD-OE2 3.26Å; K183-E853 WeakPolarHBondContact CD-OE2 3.41Å; K183-E853 WeakPolarHBondContact CE-OE2 3.12Å; K183-E853 IonicContact NZ-OE2 3.45Å; K183-E853 PolarHBondContact NZ-OE2 3Å
184	R	81.2	Confident	80.5	Confident	93 Å²	93	75 Å²	75	35%	0.351	39%	0.39	S	S	.	.	H	α-helix	trans	-57.9	-45.2	-178.4	-66.1	176	-179.3	-81.2	-6.7	112.2	S148 N180 I181 S187 L188	S148-R184 VanDerWaalsContact CB-NH2 3.25Å; S148-R184 PolarHBondContact OG-NH2 3.33Å; N180-R184 PolarHBondContact OD1-NE 3.46Å; I181-R184 PolarHBondContact O-N 3.29Å; R184-S187 WeakPolarHBondContact CA-OG 3.33Å; R184-S187 PolarHBondContact O-N 3.35Å; R184-S187 PolarHBondContact O-OG 3.37Å; R184-L188 PolarHBondContact O-N 3.09Å
185	V	83.2	Confident	80.3	Confident	5 Å²	5	74.4 Å²	74.4	3%	0.03	40%	0.397	C	S	.	.	H	α-helix	trans	-71.4	-30.7	179.7	174.5	0	0	0	0	112.2	I181 K183 L188 K196 V199 W203	I181-V185 WeakPolarHBondContact O-CB 3.29Å; I181-V185 WeakPolarHBondContact O-CG2 3.38Å; I181-V185 PolarHBondContact O-N 2.97Å; K183-V185 PolarHBondContact O-N 3.47Å; V185-L188 PolarHBondContact O-N 3.04Å; V185-K196 HydrophobicContact CG1-CB 3.93Å; V185-K196 HydrophobicContact CG1-CG 4.22Å; V185-K196 WeakPolarHBondContact CG1-O 3.39Å; V185-V199 HydrophobicContact CG1-CB 4.18Å; V185-V199 HydrophobicContact CG1-CG1 4.14Å; V185-V199 HydrophobicContact CG2-CG1 4.04Å; V185-W203 HydrophobicContact CG2-CD2 4.34Å; V185-W203 HydrophobicContact CG2-CE3 3.82Å; V185-W203 HydrophobicContact CG2-CH2 4.09Å; V185-W203 HydrophobicContact CG2-CZ3 3.68Å
186	R	78.3	Confident	80.2	Confident	165 Å²	165	75.9 Å²	75.9	62%	0.623	40%	0.403	S	S	*	.	H	α-helix	trans	-62.8	-43.1	170.8	-71.3	168.4	-155.7	-168	8.2	111.5	E182 K183 L188 K196	E182-R186 WeakPolarHBondContact O-CG 3.34Å; E182-R186 PolarHBondContact O-N 3.38Å; E182-R186 VanDerWaalsContact O-N 3.08Å; E182-R186 IonicContact OE2-CZ 3.46Å; E182-R186 IonicContact OE2-NH2 3.37Å; E182-R186 PolarHBondContact OE2-NH2 3.47Å; K183-R186 WeakPolarHBondContact O-CB 3.45Å; K183-R186 PolarHBondContact O-N 2.89Å; R186-L188 VanDerWaalsContact C-N 3.31Å; R186-L188 PolarHBondContact O-N 3.12Å; R186-K196 PolarHBondContact O-NZ 2.98Å
187	S	73.5	Confident	80	Confident	98 Å²	98	82.7 Å²	82.7	69%	0.685	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-8.9	178.4	51.1	0	0	0	0	115.7	K183 R184	K183-S187 PolarHBondContact O-N 3.16Å; K183-S187 VanDerWaalsContact O-N 3.13Å; K183-S187 PolarHBondContact O-OG 2.84Å; R184-S187 WeakPolarHBondContact CA-OG 3.33Å; R184-S187 PolarHBondContact O-N 3.35Å; R184-S187 PolarHBondContact O-OG 3.37Å
188	L	76.7	Confident	79.8	Confident	59 Å²	59	86.2 Å²	86.2	31%	0.309	46%	0.456	S	S	.	.	S	Bend	trans	-69.3	144.5	173	-71.1	176.2	0	0	0	111	R184 V185 R186 K196 W203	R184-L188 PolarHBondContact O-N 3.09Å; V185-L188 PolarHBondContact O-N 3.04Å; R186-L188 VanDerWaalsContact C-N 3.31Å; R186-L188 PolarHBondContact O-N 3.12Å; L188-K196 VanDerWaalsContact O-CE 3.25Å; L188-K196 WeakPolarHBondContact O-CE 3.41Å; L188-K196 PolarHBondContact O-NZ 3.05Å; L188-W203 HydrophobicContact CD1-CH2 4.5Å
189	P	75.5	Confident	79.7	Confident	102 Å²	102	84.7 Å²	84.7	66%	0.662	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-60.3	156	168.8	28.7	-35.3	0	0	0	110.4
190	E	72.3	Confident	79.9	Confident	170 Å²	170	82.6 Å²	82.6	79%	0.794	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-77.6	138.9	179.7	-51.4	-156.7	141.9	0	0	110.3	K196	E190-K196 IonicContact OE1-NZ 2.72Å
191	I	74.4	Confident	80.1	Confident	106 Å²	106	85 Å²	85	54%	0.544	46%	0.463	S	S	.	.	B	Isolated β-bridge	trans	-119.8	123.9	-175.8	-58	176.3	0	0	0	107.5	G193 L194	I191-G193 PolarHBondContact O-N 3.36Å; I191-L194 HydrophobicContact CB-CB 4.45Å; I191-L194 PolarHBondContact O-N 3.21Å
192	D	65.8	Low	80.2	Confident	172 Å²	172	87.8 Å²	87.8	92%	0.92	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	124.8	-178.1	-80.5	-43.9	0	0	0	112
193	G	71.7	Confident	80.5	Confident	89 Å²	89	86 Å²	86	92%	0.918	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.2	-0.6	179	0	0	0	0	0	116.5	I191	I191-G193 PolarHBondContact O-N 3.36Å
194	L	79.3	Confident	81.5	Confident	92 Å²	92	82.2 Å²	82.2	48%	0.482	46%	0.457	S	S	.	.	B	Isolated β-bridge	trans	-122.5	107.6	-179.1	-95.8	162.4	0	0	0	112.6	I191 T198 V199	I191-L194 HydrophobicContact CB-CB 4.45Å; I191-L194 PolarHBondContact O-N 3.21Å; L194-T198 HydrophobicContact CD2-CG2 4.11Å; L194-V199 HydrophobicContact CD2-CG2 4.44Å
195	S	84.4	Confident	81.9	Confident	58 Å²	58	80.5 Å²	80.5	41%	0.406	46%	0.463	S	S	.	.			trans	-72.5	144.9	175.8	78.3	0	0	0	0	112	E197 T198 V199	S195-E197 PolarHBondContact O-N 3.33Å; S195-T198 WeakPolarHBondContact O-CA 3.44Å; S195-T198 WeakPolarHBondContact O-CB 3.41Å; S195-T198 PolarHBondContact O-N 3.38Å; S195-T198 PolarHBondContact OG-N 3.44Å; S195-T198 PolarHBondContact OG-OG1 2.74Å; S195-V199 PolarHBondContact O-N 3.35Å; S195-V199 VanDerWaalsContact O-N 3.11Å
196	K	84.4	Confident	82.3	Confident	67 Å²	67	81.9 Å²	81.9	29%	0.291	47%	0.469	S	S	.	.	H	α-helix	trans	-57.2	-32	177.2	-72.7	179.9	172.9	178.4	0	112.6	V185 R186 L188 E190 V199 L200	V185-K196 HydrophobicContact CG1-CB 3.93Å; V185-K196 HydrophobicContact CG1-CG 4.22Å; V185-K196 WeakPolarHBondContact CG1-O 3.39Å; R186-K196 PolarHBondContact O-NZ 2.98Å; L188-K196 VanDerWaalsContact O-CE 3.25Å; L188-K196 WeakPolarHBondContact O-CE 3.41Å; L188-K196 PolarHBondContact O-NZ 3.05Å; E190-K196 IonicContact OE1-NZ 2.72Å; K196-V199 PolarHBondContact O-N 2.88Å; K196-L200 WeakPolarHBondContact O-CB 3.39Å; K196-L200 PolarHBondContact O-N 3.13Å
197	E	85.3	Confident	82.9	Confident	152 Å²	152	74.1 Å²	74.1	71%	0.71	44%	0.439	S	S	*	.	H	α-helix	trans	-67.6	-34.4	172.2	-61.2	-176.4	151.6	0	0	113.6	S195 S201	S195-E197 PolarHBondContact O-N 3.33Å; E197-S201 WeakPolarHBondContact O-CB 3.29Å; E197-S201 PolarHBondContact O-N 3.17Å; E197-S201 PolarHBondContact O-OG 3.09Å
198	T	86.8	Confident	83.7	Confident	74 Å²	74	71 Å²	71	45%	0.454	42%	0.415	S	S	.	.	H	α-helix	trans	-69.7	-41.5	175.9	-55.9	0	0	0	0	110.6	L194 S195 S201 S202	L194-T198 HydrophobicContact CD2-CG2 4.11Å; S195-T198 WeakPolarHBondContact O-CA 3.44Å; S195-T198 WeakPolarHBondContact O-CB 3.41Å; S195-T198 PolarHBondContact O-N 3.38Å; S195-T198 PolarHBondContact OG-N 3.44Å; S195-T198 PolarHBondContact OG-OG1 2.74Å; T198-S201 PolarHBondContact O-N 2.96Å; T198-S202 VanDerWaalsContact O-CB 3.31Å; T198-S202 WeakPolarHBondContact O-CB 3.38Å; T198-S202 PolarHBondContact O-N 3.28Å
199	V	86.6	Confident	84.2	Confident	30 Å²	30	69.7 Å²	69.7	18%	0.182	41%	0.413	C	S	.	.	H	α-helix	trans	-60.6	-49.4	173.1	178.8	0	0	0	0	110.4	V185 L194 S195 K196 S201 S202 W203	V185-V199 HydrophobicContact CG1-CB 4.18Å; V185-V199 HydrophobicContact CG1-CG1 4.14Å; V185-V199 HydrophobicContact CG2-CG1 4.04Å; L194-V199 HydrophobicContact CD2-CG2 4.44Å; S195-V199 PolarHBondContact O-N 3.35Å; S195-V199 VanDerWaalsContact O-N 3.11Å; K196-V199 PolarHBondContact O-N 2.88Å; V199-S201 PolarHBondContact O-N 3.06Å; V199-S202 WeakPolarHBondContact O-CB 3.2Å; V199-S202 PolarHBondContact O-N 3.45Å; V199-W203 HydrophobicContact CG1-CD2 4.33Å; V199-W203 HydrophobicContact CG1-CG 4.49Å; V199-W203 HydrophobicContact CG1-CZ2 4.38Å; V199-W203 PolarHBondContact O-N 3.19Å
200	L	88.5	Confident	84.9	Confident	33 Å²	33	65 Å²	65	17%	0.173	38%	0.382	C	S	.	.	H	α-helix	trans	-55.7	-48.6	176.7	-171.8	74.9	0	0	0	111.8	I181 E182 K196 S202 W203 I204	I181-L200 HydrophobicContact CD1-CD1 3.62Å; I181-L200 HydrophobicContact CG1-CD1 3.65Å; E182-L200 HydrophobicContact CB-CD1 4.45Å; E182-L200 HydrophobicContact CG-CD1 3.62Å; E182-L200 HydrophobicContact CG-CD2 3.9Å; E182-L200 HydrophobicContact CG-CG 4.44Å; K196-L200 WeakPolarHBondContact O-CB 3.39Å; K196-L200 PolarHBondContact O-N 3.13Å; L200-S202 PolarHBondContact O-N 3.34Å; L200-W203 PolarHBondContact O-N 3Å; L200-I204 WeakPolarHBondContact O-CG1 3.08Å; L200-I204 PolarHBondContact O-N 3.01Å
201	S	89.2	Confident	85.5	Confident	79 Å²	79	59.9 Å²	59.9	55%	0.552	36%	0.356	S	S	*	.	H	α-helix	trans	-63.9	-39.4	179.7	-58.9	0	0	0	0	112.5	E197 T198 V199 I204 A205	E197-S201 WeakPolarHBondContact O-CB 3.29Å; E197-S201 PolarHBondContact O-N 3.17Å; E197-S201 PolarHBondContact O-OG 3.09Å; T198-S201 PolarHBondContact O-N 2.96Å; V199-S201 PolarHBondContact O-N 3.06Å; S201-I204 PolarHBondContact O-N 3.09Å; S201-A205 PolarHBondContact O-N 2.72Å
202	S	89.7	Confident	86	Confident	58 Å²	58	61 Å²	61	41%	0.406	35%	0.353	S	S	.	.	H	α-helix	trans	-63.4	-47.1	174.8	179.5	0	0	0	0	111.6	T198 V199 L200 I204 A205 K206	T198-S202 VanDerWaalsContact O-CB 3.31Å; T198-S202 WeakPolarHBondContact O-CB 3.38Å; T198-S202 PolarHBondContact O-N 3.28Å; V199-S202 WeakPolarHBondContact O-CB 3.2Å; V199-S202 PolarHBondContact O-N 3.45Å; L200-S202 PolarHBondContact O-N 3.34Å; S202-I204 VanDerWaalsContact C-N 3.34Å; S202-I204 PolarHBondContact O-N 3.29Å; S202-A205 WeakPolarHBondContact O-CB 3.25Å; S202-A205 PolarHBondContact O-N 3.27Å; S202-A205 VanDerWaalsContact O-N 3.15Å; S202-K206 WeakPolarHBondContact O-CG 3.49Å; S202-K206 PolarHBondContact O-N 3.11Å
203	W	92	Very high	86.3	Confident	9 Å²	9	53.7 Å²	53.7	3%	0.034	32%	0.319	C	S	.	.	H	α-helix	trans	-64.1	-36.8	177.8	-75	15.6	0	0	0	112.5	D139 A141 F142 A145 I181 V185 L188 V199 L200 K206 Y207	D139-W203 WeakPolarHBondContact OD1-CZ2 3.49Å; D139-W203 PolarHBondContact OD2-NE1 3.39Å; A141-W203 HydrophobicContact CB-CH2 3.83Å; A141-W203 HydrophobicContact CB-CZ2 3.76Å; F142-W203 HydrophobicContact CB-CD2 4.22Å; F142-W203 HydrophobicContact CB-CZ2 4.03Å; F142-W203 HydrophobicContact CD2-CB 3.76Å; F142-W203 AromaticContact CD2-CD1 3.82Å; F142-W203 AromaticContact CD2-CD2 3.62Å; F142-W203 HydrophobicContact CD2-CD2 3.62Å; F142-W203 HydrophobicContact CD2-CE3 4.06Å; F142-W203 AromaticContact CD2-CG 3.47Å; F142-W203 HydrophobicContact CD2-CG 3.47Å; F142-W203 VanDerWaalsContact CD2-CG 3.47Å; F142-W203 HydrophobicContact CE2-CB 3.85Å; F142-W203 HydrophobicContact CE2-CG 4.09Å; F142-W203 WeakPolarHBondContact CE2-O 3.31Å; F142-W203 HydrophobicContact CG-CD2 4.39Å; F142-W203 HydrophobicContact CG-CG 4.36Å; A145-W203 HydrophobicContact CB-CZ3 4.02Å; I181-W203 HydrophobicContact CB-CE3 3.75Å; I181-W203 HydrophobicContact CB-CZ3 4.08Å; I181-W203 HydrophobicContact CD1-CB 3.76Å; I181-W203 HydrophobicContact CD1-CE3 4.17Å; I181-W203 HydrophobicContact CG2-CE3 3.71Å; I181-W203 HydrophobicContact CG2-CZ3 4.02Å; V185-W203 HydrophobicContact CG2-CD2 4.34Å; V185-W203 HydrophobicContact CG2-CE3 3.82Å; V185-W203 HydrophobicContact CG2-CH2 4.09Å; V185-W203 HydrophobicContact CG2-CZ3 3.68Å; L188-W203 HydrophobicContact CD1-CH2 4.5Å; V199-W203 HydrophobicContact CG1-CD2 4.33Å; V199-W203 HydrophobicContact CG1-CG 4.49Å; V199-W203 HydrophobicContact CG1-CZ2 4.38Å; V199-W203 PolarHBondContact O-N 3.19Å; L200-W203 PolarHBondContact O-N 3Å; W203-K206 PolarHBondContact O-N 3.41Å; W203-Y207 PolarHBondContact O-N 3.36Å
204	I	92.3	Very high	85.6	Confident	15 Å²	15	53.8 Å²	53.8	8%	0.077	30%	0.296	C	S	.	.	H	α-helix	trans	-66.4	-39.6	171.7	-68.7	-66	0	0	0	111.8	R174 F177 K178 I181 L200 S201 S202 K206 Y207 D208	R174-I204 VanDerWaalsContact CZ-CG2 3.45Å; F177-I204 HydrophobicContact CD1-CD1 4.04Å; F177-I204 HydrophobicContact CE1-CD1 4.49Å; K178-I204 HydrophobicContact CB-CD1 3.77Å; K178-I204 HydrophobicContact CG-CD1 4.02Å; I181-I204 HydrophobicContact CD1-CD1 3.91Å; I181-I204 HydrophobicContact CD1-CG1 4.01Å; L200-I204 WeakPolarHBondContact O-CG1 3.08Å; L200-I204 PolarHBondContact O-N 3.01Å; S201-I204 PolarHBondContact O-N 3.09Å; S202-I204 VanDerWaalsContact C-N 3.34Å; S202-I204 PolarHBondContact O-N 3.29Å; I204-K206 VanDerWaalsContact C-N 3.32Å; I204-K206 PolarHBondContact O-N 3.18Å; I204-Y207 WeakPolarHBondContact O-CB 3.39Å; I204-Y207 PolarHBondContact O-N 2.8Å; I204-D208 WeakPolarHBondContact O-CB 3.21Å; I204-D208 PolarHBondContact O-N 3.21Å
205	A	89.8	Confident	84.2	Confident	57 Å²	57	57.4 Å²	57.4	47%	0.471	31%	0.31	S	S	.	.	H	α-helix	trans	-64.1	-36.3	174.6	0	0	0	0	0	112.4	S201 S202 D208 A209	S201-A205 PolarHBondContact O-N 2.72Å; S202-A205 WeakPolarHBondContact O-CB 3.25Å; S202-A205 PolarHBondContact O-N 3.27Å; S202-A205 VanDerWaalsContact O-N 3.15Å; A205-D208 PolarHBondContact O-N 3.45Å; A205-A209 PolarHBondContact O-N 3.02Å; A205-A209 VanDerWaalsContact O-N 3.11Å
206	K	91	Very high	82.4	Confident	35 Å²	35	58 Å²	58	15%	0.152	31%	0.309	C	S	.	.	H	α-helix	trans	-65.5	-44.9	171.4	-65.7	-179.6	-166.6	-168.7	0	111.7	I136 V137 D139 F142 S202 W203 I204 D208 A209 I210	I136-K206 HydrophobicContact CG2-CB 4.4Å; I136-K206 HydrophobicContact CG2-CG 4.43Å; V137-K206 VanDerWaalsContact O-CE 3.28Å; V137-K206 WeakPolarHBondContact O-CE 3.33Å; V137-K206 PolarHBondContact O-NZ 2.97Å; D139-K206 IonicContact OD2-NZ 3.88Å; D139-K206 PolarHBondContact OD2-NZ 2.68Å; F142-K206 HydrophobicContact CD1-CD 3.91Å; F142-K206 HydrophobicContact CD2-CD 4.44Å; F142-K206 HydrophobicContact CE1-CB 3.72Å; F142-K206 HydrophobicContact CE1-CD 3.85Å; F142-K206 HydrophobicContact CE1-CG 4.41Å; F142-K206 HydrophobicContact CE2-CB 3.94Å; F142-K206 HydrophobicContact CE2-CD 4.38Å; F142-K206 HydrophobicContact CG-CD 4.21Å; F142-K206 HydrophobicContact CZ-CB 3.34Å; F142-K206 HydrophobicContact CZ-CD 4.11Å; F142-K206 HydrophobicContact CZ-CG 4.36Å; S202-K206 WeakPolarHBondContact O-CG 3.49Å; S202-K206 PolarHBondContact O-N 3.11Å; W203-K206 PolarHBondContact O-N 3.41Å; I204-K206 VanDerWaalsContact C-N 3.32Å; I204-K206 PolarHBondContact O-N 3.18Å; K206-D208 PolarHBondContact O-N 2.87Å; K206-A209 WeakPolarHBondContact O-CB 3.31Å; K206-A209 PolarHBondContact O-N 3.49Å; K206-A209 VanDerWaalsContact O-N 3.13Å; K206-I210 WeakPolarHBondContact O-CG1 3.46Å; K206-I210 PolarHBondContact O-N 3.42Å
207	Y	91.5	Very high	80.4	Confident	2 Å²	2	61.9 Å²	61.9	1%	0.008	33%	0.332	C	S	.	.	H	α-helix	trans	-55.4	-49.2	172.2	171.1	-81.3	0	0	0	111.6	F126 Y149 R174 F177 W203 I204 A209 I210 Y211	F126-Y207 HydrophobicContact CE1-CD2 4.18Å; F126-Y207 HydrophobicContact CE1-CE2 4.25Å; F126-Y207 HydrophobicContact CE2-CE2 4.44Å; F126-Y207 AromaticContact CZ-CD2 3.61Å; F126-Y207 HydrophobicContact CZ-CD2 3.61Å; F126-Y207 AromaticContact CZ-CE2 3.55Å; F126-Y207 HydrophobicContact CZ-CE2 3.55Å; Y149-Y207 AromaticContact CE1-CE2 3.86Å; Y149-Y207 HydrophobicContact CE1-CE2 3.86Å; R174-Y207 HydrophobicContact CB-CD1 4.45Å; R174-Y207 HydrophobicContact CB-CE1 3.7Å; R174-Y207 HydrophobicContact CG-CD1 4Å; R174-Y207 HydrophobicContact CG-CE1 3.73Å; R174-Y207 PolarHBondContact N-OH 3.46Å; F177-Y207 HydrophobicContact CB-CD2 3.78Å; F177-Y207 HydrophobicContact CB-CE2 3.7Å; F177-Y207 AromaticContact CD1-CD2 3.35Å; F177-Y207 HydrophobicContact CD1-CD2 3.35Å; F177-Y207 HydrophobicContact CD1-CE2 4.18Å; F177-Y207 AromaticContact CD1-CG 3.67Å; F177-Y207 HydrophobicContact CD1-CG 3.67Å; F177-Y207 AromaticContact CD2-CD2 3.97Å; F177-Y207 HydrophobicContact CD2-CD2 3.97Å; F177-Y207 HydrophobicContact CD2-CE2 4.42Å; F177-Y207 AromaticContact CE1-CD2 3.88Å; F177-Y207 HydrophobicContact CE1-CD2 3.88Å; F177-Y207 HydrophobicContact CE1-CG 4.07Å; F177-Y207 HydrophobicContact CE2-CD2 4.43Å; F177-Y207 AromaticContact CG-CD2 3.39Å; F177-Y207 HydrophobicContact CG-CD2 3.39Å; F177-Y207 AromaticContact CG-CE2 3.85Å; F177-Y207 HydrophobicContact CG-CE2 3.85Å; F177-Y207 HydrophobicContact CG-CG 4.18Å; F177-Y207 HydrophobicContact CZ-CD2 4.39Å; W203-Y207 PolarHBondContact O-N 3.36Å; I204-Y207 WeakPolarHBondContact O-CB 3.39Å; I204-Y207 PolarHBondContact O-N 2.8Å; Y207-A209 PolarHBondContact O-N 2.7Å; Y207-I210 PolarHBondContact O-N 2.81Å; Y207-Y211 HydrophobicContact CE1-CD2 4.32Å; Y207-Y211 WeakPolarHBondContact O-CB 3.41Å; Y207-Y211 PolarHBondContact O-N 3.15Å
208	D	90.1	Very high	78.3	Confident	32 Å²	32	60.6 Å²	60.6	17%	0.171	34%	0.338	C	S	.	.	H	α-helix	trans	-63	-26	-179.4	-76	-26.2	0	0	0	111.5	R174 I204 A205 K206 R212	R174-D208 WeakPolarHBondContact CD-OD1 3.36Å; R174-D208 IonicContact CZ-OD1 3.74Å; R174-D208 IonicContact CZ-OD2 3.52Å; R174-D208 IonicContact NE-OD1 3.72Å; R174-D208 PolarHBondContact NE-OD1 3.23Å; R174-D208 IonicContact NE-OD2 3.54Å; R174-D208 PolarHBondContact NE-OD2 3.16Å; R174-D208 VanDerWaalsContact NE-OD2 3.16Å; R174-D208 IonicContact NH2-OD1 3.59Å; R174-D208 IonicContact NH2-OD2 2.66Å; R174-D208 PolarHBondContact NH2-OD2 2.76Å; I204-D208 WeakPolarHBondContact O-CB 3.21Å; I204-D208 PolarHBondContact O-N 3.21Å; A205-D208 PolarHBondContact O-N 3.45Å; K206-D208 PolarHBondContact O-N 2.87Å; D208-R212 VanDerWaalsContact C-NH2 3.35Å; D208-R212 WeakPolarHBondContact O-CG 3.43Å; D208-R212 PolarHBondContact O-N 3.18Å; D208-R212 PolarHBondContact O-NE 3.46Å; D208-R212 PolarHBondContact O-NH1 3.01Å; D208-R212 PolarHBondContact O-NH2 3.33Å
209	A	88.3	Confident	76.1	Confident	32 Å²	32	64.5 Å²	64.5	26%	0.264	35%	0.349	S	S	.	.	H	α-helix	trans	-75.2	-48	171.6	0	0	0	0	0	112.9	I136 A205 K206 Y207 Y211 R212 G213	I136-A209 HydrophobicContact CD1-CB 3.99Å; A205-A209 PolarHBondContact O-N 3.02Å; A205-A209 VanDerWaalsContact O-N 3.11Å; K206-A209 WeakPolarHBondContact O-CB 3.31Å; K206-A209 PolarHBondContact O-N 3.49Å; K206-A209 VanDerWaalsContact O-N 3.13Å; Y207-A209 PolarHBondContact O-N 2.7Å; A209-Y211 VanDerWaalsContact C-N 3.27Å; A209-Y211 PolarHBondContact O-N 2.79Å; A209-R212 PolarHBondContact O-N 3.45Å; A209-G213 PolarHBondContact O-N 3.42Å
210	I	88.9	Confident	73.4	Confident	4 Å²	4	70.2 Å²	70.2	2%	0.021	37%	0.374	C	S	.	.	H	α-helix	trans	-58.2	-42.7	175.1	-58.6	164.6	0	0	0	110.1	F126 F129 I136 F142 V146 K206 Y207 R212 G213	F126-I210 HydrophobicContact CD1-CG2 4.48Å; F126-I210 HydrophobicContact CD2-CG2 3.47Å; F126-I210 VanDerWaalsContact CD2-CG2 3.47Å; F126-I210 HydrophobicContact CE1-CG2 4.46Å; F126-I210 HydrophobicContact CE2-CB 4.07Å; F126-I210 HydrophobicContact CE2-CG2 3.44Å; F126-I210 VanDerWaalsContact CE2-CG2 3.44Å; F126-I210 HydrophobicContact CG-CG2 4Å; F126-I210 HydrophobicContact CZ-CB 4.27Å; F126-I210 HydrophobicContact CZ-CG2 3.96Å; F129-I210 HydrophobicContact CB-CD1 4.31Å; F129-I210 HydrophobicContact CB-CG1 4.35Å; F129-I210 HydrophobicContact CB-CG2 4.25Å; F129-I210 HydrophobicContact CD1-CD1 3.93Å; F129-I210 HydrophobicContact CD2-CD1 3.74Å; F129-I210 HydrophobicContact CD2-CG1 3.95Å; F129-I210 HydrophobicContact CE1-CD1 4.22Å; F129-I210 HydrophobicContact CE2-CD1 4.05Å; F129-I210 HydrophobicContact CG-CD1 3.69Å; F129-I210 HydrophobicContact CG-CG1 4.09Å; F129-I210 HydrophobicContact CZ-CD1 4.29Å; I136-I210 HydrophobicContact CD1-CB 4.36Å; I136-I210 HydrophobicContact CD1-CG1 3.57Å; F142-I210 HydrophobicContact CE1-CD1 4.12Å; F142-I210 HydrophobicContact CZ-CD1 4.14Å; V146-I210 HydrophobicContact CG2-CD1 4.49Å; K206-I210 WeakPolarHBondContact O-CG1 3.46Å; K206-I210 PolarHBondContact O-N 3.42Å; Y207-I210 PolarHBondContact O-N 2.81Å; I210-R212 VanDerWaalsContact C-N 3.34Å; I210-R212 PolarHBondContact O-N 2.82Å; I210-G213 PolarHBondContact O-N 3.42Å
211	Y	86	Confident	71	Confident	62 Å²	62	75.4 Å²	75.4	24%	0.243	41%	0.409	C	S	.	.	H	α-helix	trans	-58.9	-42.7	178.1	-173.9	-82.4	0	0	0	112.2	L122 R125 A170 Y207 A209	L122-Y211 HydrophobicContact CD1-CD2 3.51Å; L122-Y211 HydrophobicContact CD1-CE2 3.93Å; L122-Y211 HydrophobicContact CD1-CG 4.26Å; L122-Y211 HydrophobicContact CD2-CD2 4.28Å; L122-Y211 HydrophobicContact CD2-CE2 4.09Å; R125-Y211 PolarHBondContact NH1-O 2.82Å; A170-Y211 HydrophobicContact CB-CE2 4.3Å; A170-Y211 WeakPolarHBondContact CB-OH 3.45Å; Y207-Y211 HydrophobicContact CE1-CD2 4.32Å; Y207-Y211 WeakPolarHBondContact O-CB 3.41Å; Y207-Y211 PolarHBondContact O-N 3.15Å; A209-Y211 VanDerWaalsContact C-N 3.27Å; A209-Y211 PolarHBondContact O-N 2.79Å
212	R	83.8	Confident	68.5	Low	128 Å²	128	77.1 Å²	77.1	48%	0.483	41%	0.412	S	S	.	.	H	α-helix	trans	-74.2	-37.1	178.7	-77.1	-175.5	-67.7	-91.3	-3.2	113.7	R125 D208 A209 I210	R125-R212 VanDerWaalsContact CZ-O 3.32Å; R125-R212 PolarHBondContact NH1-O 3.12Å; R125-R212 PolarHBondContact NH2-O 3.34Å; D208-R212 VanDerWaalsContact C-NH2 3.35Å; D208-R212 WeakPolarHBondContact O-CG 3.43Å; D208-R212 PolarHBondContact O-N 3.18Å; D208-R212 PolarHBondContact O-NE 3.46Å; D208-R212 PolarHBondContact O-NH1 3.01Å; D208-R212 PolarHBondContact O-NH2 3.33Å; A209-R212 PolarHBondContact O-N 3.45Å; I210-R212 VanDerWaalsContact C-N 3.34Å; I210-R212 PolarHBondContact O-N 2.82Å
213	G	73.4	Confident	65.9	Low	20 Å²	20	84.6 Å²	84.6	21%	0.206	43%	0.432	C	S	.	.			trans	71.1	170.8	-172.2	0	0	0	0	0	113.4	A209 I210 E215	A209-G213 PolarHBondContact O-N 3.42Å; I210-G213 PolarHBondContact O-N 3.42Å; G213-E215 PolarHBondContact O-N 3.16Å
214	E	57.1	Low	63.2	Low	90 Å²	90	92.5 Å²	92.5	42%	0.421	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-73.7	-22.1	-171.4	-58.9	-165.5	176.3	0	0	113.9	Q135 D216	Q135-E214 PolarHBondContact N-OE1 3.43Å; Q135-E214 PolarHBondContact NE2-OE2 3.11Å; Q135-E214 VanDerWaalsContact NE2-OE2 3.1Å; E214-D216 PolarHBondContact O-N 3.41Å
215	E	49.8	Very low	60.4	Low	169 Å²	169	95.9 Å²	95.9	79%	0.79	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-66.9	-30.8	-174.2	-65.5	-172.1	120.3	0	0	115.1	G213	G213-E215 PolarHBondContact O-N 3.16Å
216	D	46	Very low	57.7	Low	70 Å²	70	100.5 Å²	100.5	37%	0.374	52%	0.517	S	S	.	.	G	3₁₀ helix	trans	-90.7	-1.1	-172.9	-102.4	-36.4	0	0	0	114.5	E214 C218 K219	E214-D216 PolarHBondContact O-N 3.41Å; D216-C218 PolarHBondContact O-N 3.35Å; D216-K219 PolarHBondContact O-N 3.04Å; D216-K219 VanDerWaalsContact O-N 3.09Å; D216-K219 WeakPolarHBondContact OD1-CD 3.28Å; D216-K219 WeakPolarHBondContact OD1-CE 3.47Å; D216-K219 IonicContact OD1-NZ 2.75Å; D216-K219 PolarHBondContact OD1-NZ 2.99Å
217	L	42.8	Very low	55.1	Low	149 Å²	149	101.6 Å²	101.6	78%	0.78	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-59.2	-15.2	177.4	-72.3	170.5	0	0	0	113.9
218	C	40.3	Very low	52.6	Low	124 Å²	124	102.4 Å²	102.4	84%	0.838	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-79	-14.6	178.1	-162.9	0	0	0	0	114	D216	D216-C218 PolarHBondContact O-N 3.35Å
219	K	40.8	Very low	50.2	Low	156 Å²	156	106.2 Å²	106.2	68%	0.678	56%	0.56	S	S	*	*	S	Bend	trans	-103.2	115.9	-176.5	-64.7	175.7	-163.8	139.6	0	111.9	D216	D216-K219 PolarHBondContact O-N 3.04Å; D216-K219 VanDerWaalsContact O-N 3.09Å; D216-K219 WeakPolarHBondContact OD1-CD 3.28Å; D216-K219 WeakPolarHBondContact OD1-CE 3.47Å; D216-K219 IonicContact OD1-NZ 2.75Å; D216-K219 PolarHBondContact OD1-NZ 2.99Å
220	Q	31.2	Very low	47.9	Very low	151 Å²	151	108.7 Å²	108.7	71%	0.706	58%	0.576	S	S	*	*			trans	-60	142.8	170.2	-73.9	-173.5	-11.5	0	0	111.7	N222	Q220-N222 HydrophobicContact CB-CB 4.35Å; Q220-N222 PolarHBondContact O-N 2.86Å; Q220-N222 PolarHBondContact OE1-ND2 3.24Å
221	P	37.9	Very low	46	Very low	142 Å²	142	114.1 Å²	114.1	92%	0.922	60%	0.601	S	S	*	*			trans	-76	69.6	173.3	33.3	-36.2	0	0	0	111
222	N	35.5	Very low	44.7	Very low	114 Å²	114	113.6 Å²	113.6	61%	0.61	60%	0.602	S	S	*	*			trans	-110.5	136.8	-173	-126.7	-40.9	0	0	0	111.8	Q220	Q220-N222 HydrophobicContact CB-CB 4.35Å; Q220-N222 PolarHBondContact O-N 2.86Å; Q220-N222 PolarHBondContact OE1-ND2 3.24Å
223	R	35.1	Very low	43.9	Very low	216 Å²	216	112 Å²	112	82%	0.815	60%	0.603	S	S	*	*	S	Bend	trans	73.8	-1.3	175.3	-70.8	-173.6	164.6	-164.7	-4.8	122.1	A225 L226	R223-A225 VanDerWaalsContact C-N 3.28Å; R223-A225 PolarHBondContact O-N 3.08Å; R223-L226 PolarHBondContact O-N 3.47Å
224	M	34.8	Very low	44.2	Very low	174 Å²	174	112.8 Å²	112.8	86%	0.857	60%	0.601	S	S	*	*	H	α-helix	trans	-59.7	-32.4	176.2	-82.9	-174.6	166.5	0	0	114.7	L226	M224-L226 VanDerWaalsContact C-N 3.34Å; M224-L226 PolarHBondContact O-N 3.4Å
225	A	33.5	Very low	45.5	Very low	86 Å²	86	110.6 Å²	110.6	71%	0.711	60%	0.596	S	S	*	*	H	α-helix	trans	-66.4	-27.5	-174.4	0	0	0	0	0	115.2	R223	R223-A225 VanDerWaalsContact C-N 3.28Å; R223-A225 PolarHBondContact O-N 3.08Å
226	L	33.3	Very low	47.1	Very low	154 Å²	154	106.4 Å²	106.4	81%	0.806	58%	0.576	S	S	*	*	H	α-helix	trans	-98.5	-16.6	-175.3	-73	168	0	0	0	113.8	R223 M224	R223-L226 PolarHBondContact O-N 3.47Å; M224-L226 VanDerWaalsContact C-N 3.34Å; M224-L226 PolarHBondContact O-N 3.4Å
227	S	37.4	Very low	49.1	Very low	58 Å²	58	108.3 Å²	108.3	41%	0.406	58%	0.582	S	S	.	*	H	α-helix	trans	-70.1	-36.5	171.8	-164.5	0	0	0	0	111.6	V229 S230 E231	S227-V229 PolarHBondContact O-N 2.89Å; S227-S230 WeakPolarHBondContact O-CB 3.3Å; S227-S230 PolarHBondContact O-N 3.23Å; S227-E231 PolarHBondContact OG-OE1 3.45Å
228	A	39.4	Very low	51.2	Low	19 Å²	19	105.2 Å²	105.2	16%	0.157	56%	0.564	C	S	.	*	T	Hydrogen-bonded Turn	trans	-67.6	1.9	-165.7	0	0	0	0	0	116.7
229	V	38.7	Very low	53.5	Low	112 Å²	112	99.4 Å²	99.4	68%	0.679	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-29.8	168.2	-177.2	0	0	0	0	111	S227 E231 L232	S227-V229 PolarHBondContact O-N 2.89Å; V229-E231 PolarHBondContact O-N 3.11Å; V229-L232 PolarHBondContact O-N 3.15Å
230	S	39.3	Very low	55.9	Low	84 Å²	84	92.2 Å²	92.2	59%	0.587	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-4.5	179.4	-165.5	0	0	0	0	114	S227	S227-S230 WeakPolarHBondContact O-CB 3.3Å; S227-S230 PolarHBondContact O-N 3.23Å
231	E	49.5	Very low	58.7	Low	118 Å²	118	90.3 Å²	90.3	55%	0.551	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-14.4	177.2	-71.3	162.8	-162.8	0	0	112.9	S227 V229	S227-E231 PolarHBondContact OG-OE1 3.45Å; V229-E231 PolarHBondContact O-N 3.11Å
232	L	58.7	Low	61.2	Low	52 Å²	52	84.8 Å²	84.8	27%	0.272	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-29.3	-178.9	-88.1	153.7	0	0	0	113.4	V229 P668	V229-L232 PolarHBondContact O-N 3.15Å; L232-P668 HydrophobicContact CD2-CG 4.41Å
233	I	68.5	Low	63.9	Low	95 Å²	95	79.3 Å²	79.3	49%	0.487	42%	0.417	S	S	.	.	S	Bend	trans	-118.6	109.6	176.3	-56.9	177	0	0	0	108	T105	T105-I233 HydrophobicContact CG2-CD1 4.04Å; T105-I233 HydrophobicContact CG2-CG1 4.32Å
234	L	78	Confident	66.6	Low	35 Å²	35	70 Å²	70	18%	0.183	38%	0.383	C	S	.	.			trans	-81.1	141.9	179.3	-63.5	-178.3	0	0	0	111.3	Q103 Q238 L239 M242	Q103-L234 PolarHBondContact NE2-O 3Å; L234-Q238 HydrophobicContact CB-CB 4.19Å; L234-Q238 HydrophobicContact CD2-CB 4.37Å; L234-L239 HydrophobicContact CB-CD2 4.04Å; L234-L239 HydrophobicContact CB-CG 4.08Å; L234-L239 HydrophobicContact CD1-CD2 3.94Å; L234-M242 HydrophobicContact CD1-CE 4.48Å; L234-M242 HydrophobicContact CD1-SD 4.2Å
235	S	84.4	Confident	69.3	Low	45 Å²	45	67.8 Å²	67.8	32%	0.315	37%	0.37	S	S	.	.			trans	-68.6	164.7	170.4	94.2	0	0	0	0	111.2	E237 Q238 L239	S235-E237 VanDerWaalsContact C-N 3.27Å; S235-E237 WeakPolarHBondContact CB-OE2 3.13Å; S235-E237 PolarHBondContact O-N 3.35Å; S235-E237 PolarHBondContact OG-N 2.85Å; S235-E237 PolarHBondContact OG-OE2 3.09Å; S235-Q238 PolarHBondContact O-N 2.83Å; S235-Q238 PolarHBondContact OG-N 2.98Å; S235-L239 WeakPolarHBondContact O-CG 3.23Å; S235-L239 PolarHBondContact O-N 3.25Å
236	K	85.1	Confident	72	Confident	81 Å²	81	64.3 Å²	64.3	35%	0.352	34%	0.34	S	S	.	.	H	α-helix	trans	-62.7	-39.1	177.7	-73.4	-169.1	175.2	-175	0	111.4	I95 A96 L239 Y240	I95-K236 HydrophobicContact CG2-CB 4.12Å; I95-K236 HydrophobicContact CG2-CG 4.2Å; I95-K236 WeakPolarHBondContact O-CD 3.34Å; I95-K236 WeakPolarHBondContact O-CE 3.21Å; I95-K236 PolarHBondContact O-NZ 3.25Å; A96-K236 PolarHBondContact O-NZ 3.33Å; K236-L239 WeakPolarHBondContact O-CB 2.94Å; K236-L239 PolarHBondContact O-N 2.94Å; K236-Y240 HydrophobicContact CB-CD2 4.42Å; K236-Y240 HydrophobicContact CB-CE2 3.87Å; K236-Y240 WeakPolarHBondContact O-CD2 3.44Å; K236-Y240 PolarHBondContact O-N 2.77Å
237	E	87.3	Confident	74.8	Confident	110 Å²	110	57 Å²	57	51%	0.514	30%	0.302	S	S	.	.	H	α-helix	trans	-58.1	-49.6	177.2	-55.6	67.9	-144.4	0	0	110.2	S235 L239 Y240 E241	S235-E237 VanDerWaalsContact C-N 3.27Å; S235-E237 WeakPolarHBondContact CB-OE2 3.13Å; S235-E237 PolarHBondContact O-N 3.35Å; S235-E237 PolarHBondContact OG-N 2.85Å; S235-E237 PolarHBondContact OG-OE2 3.09Å; E237-L239 VanDerWaalsContact C-N 3.34Å; E237-L239 PolarHBondContact O-N 3.49Å; E237-Y240 PolarHBondContact O-N 2.76Å; E237-E241 PolarHBondContact O-N 3.49Å
238	Q	87.1	Confident	77.3	Confident	84 Å²	84	56.7 Å²	56.7	39%	0.393	31%	0.307	S	S	.	.	H	α-helix	trans	-61.4	-39.2	175.6	-67.8	173.9	-42.1	0	0	112.5	L234 S235 M242	L234-Q238 HydrophobicContact CB-CB 4.19Å; L234-Q238 HydrophobicContact CD2-CB 4.37Å; S235-Q238 PolarHBondContact O-N 2.83Å; S235-Q238 PolarHBondContact OG-N 2.98Å; Q238-M242 VanDerWaalsContact O-CB 3.25Å; Q238-M242 WeakPolarHBondContact O-CB 3.28Å; Q238-M242 PolarHBondContact O-N 2.77Å
239	L	88.6	Confident	79.8	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-65.9	-40.3	174.9	-68.7	173.5	0	0	0	112.3	I95 L234 S235 K236 E237 M242 F243 F672 V673	I95-L239 HydrophobicContact CD1-CB 3.99Å; I95-L239 HydrophobicContact CG1-CB 4.16Å; I95-L239 HydrophobicContact CG2-CB 3.87Å; I95-L239 HydrophobicContact CG2-CD1 4.22Å; L234-L239 HydrophobicContact CB-CD2 4.04Å; L234-L239 HydrophobicContact CB-CG 4.08Å; L234-L239 HydrophobicContact CD1-CD2 3.94Å; S235-L239 WeakPolarHBondContact O-CG 3.23Å; S235-L239 PolarHBondContact O-N 3.25Å; K236-L239 WeakPolarHBondContact O-CB 2.94Å; K236-L239 PolarHBondContact O-N 2.94Å; E237-L239 VanDerWaalsContact C-N 3.34Å; E237-L239 PolarHBondContact O-N 3.49Å; L239-M242 HydrophobicContact CD2-CE 3.86Å; L239-F243 PolarHBondContact O-N 2.86Å; L239-F672 HydrophobicContact CD1-CD1 3.88Å; L239-F672 HydrophobicContact CD1-CE1 3.72Å; L239-V673 HydrophobicContact CD1-CG2 4.47Å; L239-V673 HydrophobicContact CD2-CG2 4.3Å
240	Y	91.1	Very high	82.2	Confident	5 Å²	5	57.2 Å²	57.2	2%	0.02	30%	0.297	C	S	.	.	H	α-helix	trans	-65	-44.3	175.9	-65.6	-58.9	0	0	0	111.9	Y88 V92 I95 A96 K236 E237 Q244 Y258 Q262	Y88-Y240 PolarHBondContact OH-O 3.47Å; Y88-Y240 VanDerWaalsContact OH-O 3.09Å; V92-Y240 HydrophobicContact CB-CE1 4.34Å; V92-Y240 HydrophobicContact CG1-CE1 3.95Å; V92-Y240 HydrophobicContact CG2-CD1 4.19Å; V92-Y240 HydrophobicContact CG2-CE1 4.34Å; I95-Y240 HydrophobicContact CB-CD1 4.09Å; I95-Y240 HydrophobicContact CB-CE1 3.56Å; I95-Y240 HydrophobicContact CD1-CD1 3.87Å; I95-Y240 HydrophobicContact CD1-CE1 4.19Å; I95-Y240 HydrophobicContact CG1-CE1 4.49Å; I95-Y240 HydrophobicContact CG2-CD1 3.88Å; I95-Y240 HydrophobicContact CG2-CD2 4.29Å; I95-Y240 HydrophobicContact CG2-CE1 3.47Å; I95-Y240 VanDerWaalsContact CG2-CE1 3.47Å; I95-Y240 HydrophobicContact CG2-CE2 3.89Å; I95-Y240 HydrophobicContact CG2-CG 4.27Å; I95-Y240 VanDerWaalsContact CG2-CZ 3.47Å; A96-Y240 WeakPolarHBondContact CA-OH 3.24Å; A96-Y240 WeakPolarHBondContact CB-OH 3.49Å; A96-Y240 PolarHBondContact N-OH 2.91Å; K236-Y240 HydrophobicContact CB-CD2 4.42Å; K236-Y240 HydrophobicContact CB-CE2 3.87Å; K236-Y240 WeakPolarHBondContact O-CD2 3.44Å; K236-Y240 PolarHBondContact O-N 2.77Å; E237-Y240 PolarHBondContact O-N 2.76Å; Y240-Q244 WeakPolarHBondContact O-CB 3.08Å; Y240-Q244 PolarHBondContact O-N 3.3Å; Y240-Y258 HydrophobicContact CD1-CD2 4.43Å; Y240-Y258 HydrophobicContact CD2-CD2 4.06Å; Y240-Y258 AromaticContact CD2-CE2 3.7Å; Y240-Y258 HydrophobicContact CD2-CE2 3.7Å; Y240-Y258 HydrophobicContact CE1-CD2 4.35Å; Y240-Y258 HydrophobicContact CE2-CD2 4.02Å; Y240-Y258 AromaticContact CE2-CE2 3.46Å; Y240-Y258 HydrophobicContact CE2-CE2 3.46Å; Y240-Y258 VanDerWaalsContact CE2-CE2 3.46Å; Y240-Y258 HydrophobicContact CG-CD2 4.3Å; Y240-Y258 HydrophobicContact CG-CE2 4.38Å; Y240-Y258 AromaticContact CZ-CE2 3.92Å; Y240-Q262 PolarHBondContact OH-NE2 3.23Å
241	E	89.7	Confident	84.4	Confident	111 Å²	111	61 Å²	61	52%	0.519	30%	0.303	S	S	.	.	H	α-helix	trans	-63.3	-44.6	177	-71.4	-170.3	152.4	0	0	111.6	E237 Q244 Q245	E237-E241 PolarHBondContact O-N 3.49Å; E241-Q244 WeakPolarHBondContact O-CB 3.17Å; E241-Q244 PolarHBondContact O-N 3.22Å; E241-Q245 VanDerWaalsContact O-CG 3.32Å; E241-Q245 WeakPolarHBondContact O-CG 3.23Å; E241-Q245 PolarHBondContact O-N 2.91Å
242	M	90.1	Very high	86.1	Confident	26 Å²	26	60.5 Å²	60.5	13%	0.128	30%	0.303	C	S	.	.	H	α-helix	trans	-60.5	-50.1	177.6	-175.5	-177.7	70	0	0	111.4	L234 Q238 L239 Q244 Q245 I246 Q670	L234-M242 HydrophobicContact CD1-CE 4.48Å; L234-M242 HydrophobicContact CD1-SD 4.2Å; Q238-M242 VanDerWaalsContact O-CB 3.25Å; Q238-M242 WeakPolarHBondContact O-CB 3.28Å; Q238-M242 PolarHBondContact O-N 2.77Å; L239-M242 HydrophobicContact CD2-CE 3.86Å; M242-Q244 PolarHBondContact O-N 3.02Å; M242-Q245 PolarHBondContact O-N 3.1Å; M242-I246 HydrophobicContact CG-CD1 3.98Å; M242-I246 VanDerWaalsContact O-CG1 3.32Å; M242-I246 WeakPolarHBondContact O-CG1 3.44Å; M242-I246 PolarHBondContact O-N 3.02Å; M242-Q670 HydrophobicContact CE-CB 4.49Å; M242-Q670 HydrophobicContact CE-CG 3.64Å; M242-Q670 HydrophobicContact SD-CG 3.87Å
243	F	92.1	Very high	87.5	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-74	-23.7	178.7	-83.5	-79.2	0	0	0	114	Y88 V91 I95 L239 Q245 I246 L247 L647 Q670 V673	Y88-F243 HydrophobicContact CE2-CB 4.13Å; V91-F243 HydrophobicContact CG1-CB 3.67Å; V91-F243 HydrophobicContact CG1-CD1 3.88Å; V91-F243 HydrophobicContact CG1-CD2 4.2Å; V91-F243 HydrophobicContact CG1-CG 3.64Å; I95-F243 HydrophobicContact CD1-CD2 4.24Å; L239-F243 PolarHBondContact O-N 2.86Å; F243-Q245 VanDerWaalsContact C-N 3.33Å; F243-I246 HydrophobicContact CD1-CB 4.39Å; F243-I246 HydrophobicContact CD1-CD1 3.76Å; F243-I246 HydrophobicContact CD1-CG2 4.45Å; F243-I246 HydrophobicContact CE1-CD1 3.79Å; F243-I246 HydrophobicContact CG-CD1 4.15Å; F243-I246 HydrophobicContact CZ-CD1 4.21Å; F243-L247 PolarHBondContact O-N 3.47Å; F243-L247 VanDerWaalsContact O-N 3.15Å; F243-L647 HydrophobicContact CD1-CD1 4.22Å; F243-L647 HydrophobicContact CE1-CD1 4.05Å; F243-Q670 HydrophobicContact CZ-CG 4.5Å; F243-V673 HydrophobicContact CD2-CB 4.3Å; F243-V673 HydrophobicContact CD2-CG1 4.08Å; F243-V673 HydrophobicContact CD2-CG2 4.17Å; F243-V673 HydrophobicContact CE1-CG1 4.18Å; F243-V673 HydrophobicContact CE2-CB 3.44Å; F243-V673 VanDerWaalsContact CE2-CB 3.44Å; F243-V673 HydrophobicContact CE2-CG1 3.55Å; F243-V673 HydrophobicContact CE2-CG2 3.61Å; F243-V673 HydrophobicContact CZ-CB 3.67Å; F243-V673 HydrophobicContact CZ-CG1 3.61Å; F243-V673 HydrophobicContact CZ-CG2 4.36Å
244	Q	92.4	Very high	88.4	Confident	21 Å²	21	56 Å²	56	10%	0.098	28%	0.279	C	S	.	.	H	α-helix	trans	-62.8	-43.1	168.3	-170.1	-160	-22.6	0	0	110.4	Y88 Y240 E241 M242 G248 I249 H254	Y88-Q244 HydrophobicContact CE2-CB 4.33Å; Y240-Q244 WeakPolarHBondContact O-CB 3.08Å; Y240-Q244 PolarHBondContact O-N 3.3Å; E241-Q244 WeakPolarHBondContact O-CB 3.17Å; E241-Q244 PolarHBondContact O-N 3.22Å; M242-Q244 PolarHBondContact O-N 3.02Å; Q244-G248 PolarHBondContact O-N 3.4Å; Q244-G248 VanDerWaalsContact O-N 3.11Å; Q244-I249 HydrophobicContact CG-CB 3.94Å; Q244-I249 VanDerWaalsContact CG-O 3.29Å; Q244-I249 WeakPolarHBondContact CG-O 3.48Å; Q244-I249 PolarHBondContact NE2-O 2.57Å; Q244-I249 PolarHBondContact O-N 3.3Å; Q244-H254 HydrophobicContact CG-CB 4.03Å
245	Q	90.6	Very high	88.7	Confident	126 Å²	126	59.7 Å²	59.7	59%	0.589	30%	0.295	S	S	*	.	H	α-helix	trans	-69.4	-43.8	177.6	-68.7	172.4	35.6	0	0	112.1	E241 M242 F243 L247 G248	E241-Q245 VanDerWaalsContact O-CG 3.32Å; E241-Q245 WeakPolarHBondContact O-CG 3.23Å; E241-Q245 PolarHBondContact O-N 2.91Å; M242-Q245 PolarHBondContact O-N 3.1Å; F243-Q245 VanDerWaalsContact C-N 3.33Å; Q245-L247 PolarHBondContact O-N 2.98Å; Q245-G248 PolarHBondContact O-N 3.3Å
246	I	91.4	Very high	88.7	Confident	14 Å²	14	58.9 Å²	58.9	7%	0.072	29%	0.287	C	S	.	.	H	α-helix	trans	-55.2	-49.8	176.9	-71.2	163.7	0	0	0	111.5	M242 F243 G248 Q650 T651 H654 Q670	M242-I246 HydrophobicContact CG-CD1 3.98Å; M242-I246 VanDerWaalsContact O-CG1 3.32Å; M242-I246 WeakPolarHBondContact O-CG1 3.44Å; M242-I246 PolarHBondContact O-N 3.02Å; F243-I246 HydrophobicContact CD1-CB 4.39Å; F243-I246 HydrophobicContact CD1-CD1 3.76Å; F243-I246 HydrophobicContact CD1-CG2 4.45Å; F243-I246 HydrophobicContact CE1-CD1 3.79Å; F243-I246 HydrophobicContact CG-CD1 4.15Å; F243-I246 HydrophobicContact CZ-CD1 4.21Å; I246-G248 VanDerWaalsContact C-N 3.34Å; I246-Q650 HydrophobicContact CG2-CB 4.04Å; I246-T651 HydrophobicContact CD1-CG2 4.2Å; I246-H654 HydrophobicContact CG1-CB 3.83Å; I246-Q670 HydrophobicContact CD1-CG 4.46Å
247	L	92	Very high	88.8	Confident	1 Å²	1	55 Å²	55	1%	0.005	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	4.9	-177.8	-60	-174.6	0	0	0	113.7	R84 L87 Y88 F243 Q245 I249 L647 Q650	R84-L247 WeakPolarHBondContact CD-O 3.46Å; L87-L247 HydrophobicContact CB-CD1 3.91Å; Y88-L247 HydrophobicContact CD2-CD1 4.04Å; Y88-L247 HydrophobicContact CG-CD1 4.47Å; F243-L247 PolarHBondContact O-N 3.47Å; F243-L247 VanDerWaalsContact O-N 3.15Å; Q245-L247 PolarHBondContact O-N 2.98Å; L247-I249 VanDerWaalsContact C-N 3.31Å; L247-I249 HydrophobicContact CB-CD1 4.06Å; L247-I249 HydrophobicContact CB-CG1 3.84Å; L247-I249 WeakPolarHBondContact O-CD1 3.27Å; L247-I249 PolarHBondContact O-N 3.01Å; L247-L647 HydrophobicContact CD1-CD1 4.34Å; L247-L647 HydrophobicContact CD2-CD1 3.93Å; L247-L647 HydrophobicContact CG-CD1 4.44Å; L247-Q650 HydrophobicContact CD2-CB 4.45Å
248	G	89.9	Confident	88.7	Confident	50 Å²	50	53 Å²	53	52%	0.515	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	26.2	177.5	0	0	0	0	0	115.9	Q244 Q245 I246	Q244-G248 PolarHBondContact O-N 3.4Å; Q244-G248 VanDerWaalsContact O-N 3.11Å; Q245-G248 PolarHBondContact O-N 3.3Å; I246-G248 VanDerWaalsContact C-N 3.34Å
249	I	91.3	Very high	88.5	Confident	12 Å²	12	53.6 Å²	53.6	6%	0.062	26%	0.264	C	S	.	.			trans	-76.5	136.2	-171.7	-53.4	-58.8	0	0	0	111.1	R84 L85 Y88 Q244 L247 E253 H254	R84-I249 HydrophobicContact CB-CD1 4.2Å; L85-I249 HydrophobicContact CD2-CD1 4.18Å; L85-I249 HydrophobicContact CD2-CG2 4.38Å; L85-I249 HydrophobicContact CG-CD1 4.49Å; Y88-I249 HydrophobicContact CD1-CG1 4.16Å; Y88-I249 HydrophobicContact CD1-CG2 4.14Å; Y88-I249 HydrophobicContact CD2-CG1 4.17Å; Y88-I249 HydrophobicContact CE1-CG2 4.39Å; Y88-I249 HydrophobicContact CG-CG1 3.84Å; Q244-I249 HydrophobicContact CG-CB 3.94Å; Q244-I249 VanDerWaalsContact CG-O 3.29Å; Q244-I249 WeakPolarHBondContact CG-O 3.48Å; Q244-I249 PolarHBondContact NE2-O 2.57Å; Q244-I249 PolarHBondContact O-N 3.3Å; L247-I249 VanDerWaalsContact C-N 3.31Å; L247-I249 HydrophobicContact CB-CD1 4.06Å; L247-I249 HydrophobicContact CB-CG1 3.84Å; L247-I249 WeakPolarHBondContact O-CD1 3.27Å; L247-I249 PolarHBondContact O-N 3.01Å; I249-E253 HydrophobicContact CG2-CB 3.81Å; I249-H254 HydrophobicContact CG2-CB 4.31Å
250	K	89.3	Confident	88.1	Confident	130 Å²	130	55.4 Å²	55.4	57%	0.565	28%	0.28	S	S	*	.			trans	-73.2	146.8	-178.8	-57.2	171	-171.7	168.9	0	110.5	L252 E253 H254	K250-L252 PolarHBondContact O-N 3.47Å; K250-L252 VanDerWaalsContact O-N 3.11Å; K250-E253 HydrophobicContact CB-CB 4.48Å; K250-E253 HydrophobicContact CB-CG 4.03Å; K250-E253 VanDerWaalsContact CB-OE2 3.23Å; K250-E253 WeakPolarHBondContact CB-OE2 3.42Å; K250-E253 VanDerWaalsContact CG-OE2 3.3Å; K250-E253 WeakPolarHBondContact CG-OE2 3.46Å; K250-E253 PolarHBondContact N-OE2 2.83Å; K250-E253 WeakPolarHBondContact O-CA 2.96Å; K250-E253 WeakPolarHBondContact O-CB 3.34Å; K250-E253 PolarHBondContact O-N 3.4Å; K250-H254 PolarHBondContact O-N 2.83Å
251	K	86.4	Confident	87.7	Confident	163 Å²	163	55.5 Å²	55.5	71%	0.709	28%	0.281	S	S	*	.	H	α-helix	trans	-54.2	-36.1	-176.6	-71	-169.3	174.8	-164.9	0	114	Q255	K251-Q255 WeakPolarHBondContact O-CB 3.46Å; K251-Q255 PolarHBondContact O-N 2.89Å
252	L	85.3	Confident	87.2	Confident	108 Å²	108	52.5 Å²	52.5	57%	0.565	27%	0.267	S	S	*	.	H	α-helix	trans	-68.4	-41.7	175.3	-177.4	65.5	0	0	0	112.5	K250 Q255 L256	K250-L252 PolarHBondContact O-N 3.47Å; K250-L252 VanDerWaalsContact O-N 3.11Å; L252-Q255 PolarHBondContact O-N 3.39Å; L252-L256 HydrophobicContact CG-CD1 4.48Å; L252-L256 WeakPolarHBondContact O-CG 3.36Å; L252-L256 PolarHBondContact O-N 3.15Å
253	E	86.3	Confident	86.6	Confident	18 Å²	18	53.4 Å²	53.4	8%	0.084	27%	0.272	C	S	.	.	H	α-helix	trans	-65.8	-45.7	178.2	-59.1	168.5	153.8	0	0	109.7	R81 L85 I249 K250 Q255 L256 L257 M627	R81-E253 IonicContact CZ-OE1 2.68Å; R81-E253 IonicContact NE-OE1 2.8Å; R81-E253 PolarHBondContact NE-OE1 3.39Å; R81-E253 VanDerWaalsContact NE-OE1 3.15Å; R81-E253 IonicContact NH2-OE1 2.72Å; R81-E253 PolarHBondContact NH2-OE1 2.9Å; L85-E253 HydrophobicContact CD2-CB 4.11Å; I249-E253 HydrophobicContact CG2-CB 3.81Å; K250-E253 HydrophobicContact CB-CB 4.48Å; K250-E253 HydrophobicContact CB-CG 4.03Å; K250-E253 VanDerWaalsContact CB-OE2 3.23Å; K250-E253 WeakPolarHBondContact CB-OE2 3.42Å; K250-E253 VanDerWaalsContact CG-OE2 3.3Å; K250-E253 WeakPolarHBondContact CG-OE2 3.46Å; K250-E253 PolarHBondContact N-OE2 2.83Å; K250-E253 WeakPolarHBondContact O-CA 2.96Å; K250-E253 WeakPolarHBondContact O-CB 3.34Å; K250-E253 PolarHBondContact O-N 3.4Å; E253-Q255 PolarHBondContact O-N 2.91Å; E253-L256 PolarHBondContact O-N 3.28Å; E253-L257 WeakPolarHBondContact O-CG 3.23Å; E253-L257 PolarHBondContact O-N 3.08Å; E253-M627 HydrophobicContact CB-CE 4.2Å; E253-M627 HydrophobicContact CG-CE 3.87Å
254	H	87.8	Confident	85.4	Confident	35 Å²	35	61.3 Å²	61.3	16%	0.162	31%	0.314	C	S	.	.	H	α-helix	trans	-54	-51	170.2	159.4	76.3	0	0	0	111.7	Y88 Q244 I249 K250 L256 L257 Y258	Y88-H254 HydrophobicContact CE1-CB 4.15Å; Y88-H254 AromaticContact CE1-ND1 3.75Å; Y88-H254 AromaticContact CZ-ND1 3.71Å; Y88-H254 PolarHBondContact OH-ND1 2.77Å; Q244-H254 HydrophobicContact CG-CB 4.03Å; I249-H254 HydrophobicContact CG2-CB 4.31Å; K250-H254 PolarHBondContact O-N 2.83Å; H254-L256 VanDerWaalsContact C-N 3.32Å; H254-L256 PolarHBondContact O-N 2.8Å; H254-L257 PolarHBondContact O-N 3.45Å; H254-Y258 AromaticContact CE1-CD2 3.96Å; H254-Y258 WeakPolarHBondContact O-CB 3.44Å; H254-Y258 PolarHBondContact O-N 3.39Å
255	Q	84.9	Confident	84.7	Confident	112 Å²	112	62.6 Å²	62.6	52%	0.523	32%	0.322	S	S	.	.	H	α-helix	trans	-64.4	-35.5	-175.3	-168	173.9	21.6	0	0	112.7	K251 L252 E253 N259	K251-Q255 WeakPolarHBondContact O-CB 3.46Å; K251-Q255 PolarHBondContact O-N 2.89Å; L252-Q255 PolarHBondContact O-N 3.39Å; E253-Q255 PolarHBondContact O-N 2.91Å; Q255-N259 WeakPolarHBondContact O-CB 3.42Å; Q255-N259 PolarHBondContact O-N 3.42Å; Q255-N259 PolarHBondContact O-ND2 2.87Å
256	L	85	Confident	83.9	Confident	28 Å²	28	59.1 Å²	59.1	15%	0.147	32%	0.315	C	S	.	.	H	α-helix	trans	-66.1	-49.8	173.3	-69.7	170.4	0	0	0	111.7	L252 E253 H254 A260 F622 H625 M627	L252-L256 HydrophobicContact CG-CD1 4.48Å; L252-L256 WeakPolarHBondContact O-CG 3.36Å; L252-L256 PolarHBondContact O-N 3.15Å; E253-L256 PolarHBondContact O-N 3.28Å; H254-L256 VanDerWaalsContact C-N 3.32Å; H254-L256 PolarHBondContact O-N 2.8Å; L256-A260 WeakPolarHBondContact O-CB 3.42Å; L256-A260 PolarHBondContact O-N 2.86Å; L256-A260 VanDerWaalsContact O-N 3.16Å; L256-F622 HydrophobicContact CB-CE1 4.12Å; L256-F622 HydrophobicContact CD2-CD1 4.25Å; L256-F622 HydrophobicContact CD2-CE1 3.72Å; L256-F622 HydrophobicContact CD2-CE2 4.05Å; L256-F622 HydrophobicContact CD2-CZ 3.61Å; L256-H625 HydrophobicContact CD1-CB 4.36Å; L256-M627 HydrophobicContact CD1-CG 4.34Å
257	L	85.8	Confident	83.1	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-69.7	-37	-177.9	-64.3	179.6	0	0	0	112.5	L85 Y88 V89 E253 H254 A260 C261 M627 I631	L85-L257 HydrophobicContact CD2-CD1 4.08Å; Y88-L257 HydrophobicContact CD1-CD1 4.13Å; V89-L257 HydrophobicContact CG2-CD1 4.01Å; V89-L257 HydrophobicContact CG2-CD2 3.88Å; V89-L257 HydrophobicContact CG2-CG 4.43Å; E253-L257 WeakPolarHBondContact O-CG 3.23Å; E253-L257 PolarHBondContact O-N 3.08Å; H254-L257 PolarHBondContact O-N 3.45Å; L257-A260 PolarHBondContact O-N 3.46Å; L257-C261 VanDerWaalsContact O-CB 3.29Å; L257-C261 WeakPolarHBondContact O-CB 3.3Å; L257-C261 PolarHBondContact O-N 2.7Å; L257-C261 PolarHBondContact O-SG 2.71Å; L257-M627 HydrophobicContact CD2-CB 4.15Å; L257-M627 HydrophobicContact CD2-CG 4.46Å; L257-M627 HydrophobicContact CD2-SD 4.11Å; L257-M627 HydrophobicContact CG-SD 4.39Å; L257-I631 HydrophobicContact CD2-CD1 3.94Å; L257-I631 HydrophobicContact CD2-CG1 3.88Å
258	Y	85.1	Confident	82.5	Confident	68 Å²	68	61.9 Å²	61.9	27%	0.267	33%	0.328	S	S	.	.	H	α-helix	trans	-59	-55.2	173.2	175	-87.8	0	0	0	110.8	Y240 H254 A260 C261 Q262	Y240-Y258 HydrophobicContact CD1-CD2 4.43Å; Y240-Y258 HydrophobicContact CD2-CD2 4.06Å; Y240-Y258 AromaticContact CD2-CE2 3.7Å; Y240-Y258 HydrophobicContact CD2-CE2 3.7Å; Y240-Y258 HydrophobicContact CE1-CD2 4.35Å; Y240-Y258 HydrophobicContact CE2-CD2 4.02Å; Y240-Y258 AromaticContact CE2-CE2 3.46Å; Y240-Y258 HydrophobicContact CE2-CE2 3.46Å; Y240-Y258 VanDerWaalsContact CE2-CE2 3.46Å; Y240-Y258 HydrophobicContact CG-CD2 4.3Å; Y240-Y258 HydrophobicContact CG-CE2 4.38Å; Y240-Y258 AromaticContact CZ-CE2 3.92Å; H254-Y258 AromaticContact CE1-CD2 3.96Å; H254-Y258 WeakPolarHBondContact O-CB 3.44Å; H254-Y258 PolarHBondContact O-N 3.39Å; Y258-A260 PolarHBondContact O-N 3.49Å; Y258-C261 PolarHBondContact O-N 2.7Å; Y258-C261 VanDerWaalsContact O-N 3.09Å; Y258-Q262 HydrophobicContact CD1-CG 4.18Å; Y258-Q262 HydrophobicContact CE1-CG 3.81Å; Y258-Q262 HydrophobicContact CE2-CG 4.2Å; Y258-Q262 WeakPolarHBondContact O-CG 3.34Å; Y258-Q262 PolarHBondContact O-N 3.3Å
259	N	84	Confident	82.1	Confident	96 Å²	96	61.8 Å²	61.8	51%	0.513	31%	0.314	S	S	.	.	H	α-helix	trans	-61.3	-30.1	-179.2	-74.4	-16.1	0	0	0	112.8	Q255	Q255-N259 WeakPolarHBondContact O-CB 3.42Å; Q255-N259 PolarHBondContact O-N 3.42Å; Q255-N259 PolarHBondContact O-ND2 2.87Å
260	A	80.2	Confident	81.7	Confident	40 Å²	40	61.4 Å²	61.4	33%	0.331	31%	0.313	S	S	.	.	H	α-helix	trans	-83.7	-19.6	177.6	0	0	0	0	0	114.3	L256 L257 Y258 F622 I631	L256-A260 WeakPolarHBondContact O-CB 3.42Å; L256-A260 PolarHBondContact O-N 2.86Å; L256-A260 VanDerWaalsContact O-N 3.16Å; L257-A260 PolarHBondContact O-N 3.46Å; Y258-A260 PolarHBondContact O-N 3.49Å; A260-F622 HydrophobicContact CB-CE1 4.4Å; A260-I631 HydrophobicContact CB-CD1 3.58Å; A260-I631 HydrophobicContact CB-CG1 4.4Å
261	C	82.6	Confident	81.3	Confident	7 Å²	7	55.4 Å²	55.4	5%	0.047	29%	0.287	C	S	.	.	H	α-helix	trans	-104.4	-12.6	-178.6	-65.5	0	0	0	0	114.3	V92 L257 Y258	V92-C261 HydrophobicContact CG1-CB 3.54Å; L257-C261 VanDerWaalsContact O-CB 3.29Å; L257-C261 WeakPolarHBondContact O-CB 3.3Å; L257-C261 PolarHBondContact O-N 2.7Å; L257-C261 PolarHBondContact O-SG 2.71Å; Y258-C261 PolarHBondContact O-N 2.7Å; Y258-C261 VanDerWaalsContact O-N 3.09Å
262	Q	78.2	Confident	81.1	Confident	47 Å²	47	49.3 Å²	49.3	22%	0.22	26%	0.261	C	S	.	.			trans	-68.8	134.4	165.7	-63.2	-40.5	-47.4	0	0	110.1	Y240 Y258	Y240-Q262 PolarHBondContact OH-NE2 3.23Å; Y258-Q262 HydrophobicContact CD1-CG 4.18Å; Y258-Q262 HydrophobicContact CE1-CG 3.81Å; Y258-Q262 HydrophobicContact CE2-CG 4.2Å; Y258-Q262 WeakPolarHBondContact O-CG 3.34Å; Y258-Q262 PolarHBondContact O-N 3.3Å
263	L	78.2	Confident	81.1	Confident	46 Å²	46	44.4 Å²	44.4	24%	0.241	24%	0.236	C	C	.	.			trans	-124.5	110	171.6	-66.1	172.8	0	0	0	106.8	Y97 N265 E268 Q269 Q272	Y97-L263 HydrophobicContact CE1-CD1 4.45Å; L263-N265 PolarHBondContact O-N 2.94Å; L263-E268 HydrophobicContact CB-CB 4.33Å; L263-E268 HydrophobicContact CD1-CB 4.32Å; L263-Q269 HydrophobicContact CB-CG 3.88Å; L263-Q269 PolarHBondContact O-NE2 3.39Å; L263-Q272 HydrophobicContact CD1-CB 4.02Å; L263-Q272 HydrophobicContact CD1-CG 4.44Å
264	D	67.8	Low	81.1	Confident	166 Å²	166	44 Å²	44	89%	0.888	23%	0.234	S	C	*	.	S	Bend	trans	-66	-25.2	-173	-62.5	-44.3	0	0	0	113.1
265	N	76.6	Confident	80.9	Confident	47 Å²	47	45 Å²	45	25%	0.251	24%	0.236	S	C	.	.	S	Bend	trans	-95.3	126.1	179.2	-173.6	4.9	0	0	0	112.1	L263 D267 E268 Q269	L263-N265 PolarHBondContact O-N 2.94Å; N265-D267 PolarHBondContact ND2-OD2 3.49Å; N265-D267 PolarHBondContact O-N 3.12Å; N265-D267 PolarHBondContact OD1-N 3.46Å; N265-E268 HydrophobicContact CB-CB 4.3Å; N265-E268 HydrophobicContact CB-CG 4.08Å; N265-E268 PolarHBondContact O-N 3.05Å; N265-Q269 PolarHBondContact O-N 2.69Å; N265-Q269 VanDerWaalsContact O-N 3.08Å
266	A	74.5	Confident	80.9	Confident	53 Å²	53	40.1 Å²	40.1	44%	0.438	21%	0.213	S	C	.	.	H	α-helix	trans	-56.7	-32.5	172.8	0	0	0	0	0	113	E268 Q269 A270	A266-E268 VanDerWaalsContact C-N 3.27Å; A266-E268 PolarHBondContact O-N 2.8Å; A266-Q269 PolarHBondContact O-N 2.73Å; A266-A270 WeakPolarHBondContact O-CB 3.36Å; A266-A270 PolarHBondContact O-N 2.81Å
267	D	74.8	Confident	81	Confident	21 Å²	21	38.8 Å²	38.8	11%	0.112	21%	0.206	C	C	.	.	H	α-helix	trans	-65.8	-32.6	176.7	-54	-25.1	0	0	0	111.8	N265 A271 K489 Q514	N265-D267 PolarHBondContact ND2-OD2 3.49Å; N265-D267 PolarHBondContact O-N 3.12Å; N265-D267 PolarHBondContact OD1-N 3.46Å; D267-A271 WeakPolarHBondContact O-CB 3.45Å; D267-A271 PolarHBondContact O-N 3.36Å; D267-K489 WeakPolarHBondContact OD1-CE 3.24Å; D267-K489 IonicContact OD1-NZ 2.7Å; D267-K489 PolarHBondContact OD1-NZ 3.15Å; D267-K489 WeakPolarHBondContact OD2-CD 3.48Å; D267-K489 WeakPolarHBondContact OD2-CE 3.18Å; D267-K489 IonicContact OD2-NZ 3.45Å; D267-K489 PolarHBondContact OD2-NZ 2.94Å; D267-Q514 PolarHBondContact OD1-OE1 3.14Å
268	E	78.8	Confident	80.9	Confident	52 Å²	52	41.9 Å²	41.9	24%	0.243	22%	0.223	C	C	.	.	H	α-helix	trans	-80	-36.8	178.8	-67.2	-176.3	130.6	0	0	111.6	L263 N265 A266 A271 Q272 R587	L263-E268 HydrophobicContact CB-CB 4.33Å; L263-E268 HydrophobicContact CD1-CB 4.32Å; N265-E268 HydrophobicContact CB-CB 4.3Å; N265-E268 HydrophobicContact CB-CG 4.08Å; N265-E268 PolarHBondContact O-N 3.05Å; A266-E268 VanDerWaalsContact C-N 3.27Å; A266-E268 PolarHBondContact O-N 2.8Å; E268-A271 PolarHBondContact O-N 2.73Å; E268-Q272 WeakPolarHBondContact O-CB 3.22Å; E268-Q272 PolarHBondContact O-N 2.98Å; E268-R587 VanDerWaalsContact CD-NH2 3.26Å; E268-R587 HydrophobicContact CG-CG 4.02Å; E268-R587 IonicContact OE1-CZ 2.72Å; E268-R587 IonicContact OE1-NE 2.57Å; E268-R587 PolarHBondContact OE1-NE 3.22Å; E268-R587 IonicContact OE1-NH2 2.9Å; E268-R587 PolarHBondContact OE1-NH2 2.88Å; E268-R587 IonicContact OE2-NH2 2.78Å; E268-R587 PolarHBondContact OE2-NH2 3.03Å
269	Q	81.8	Confident	80.9	Confident	49 Å²	49	39.4 Å²	39.4	23%	0.229	22%	0.217	C	C	.	.	H	α-helix	trans	-56.7	-51.7	168.1	-66	176.7	12.8	0	0	110.5	Y97 L263 N265 A266 Q272 I273	Y97-Q269 HydrophobicContact CD1-CG 4.18Å; Y97-Q269 HydrophobicContact CD2-CB 4.45Å; Y97-Q269 HydrophobicContact CG-CB 4.02Å; Y97-Q269 HydrophobicContact CG-CG 4.09Å; L263-Q269 HydrophobicContact CB-CG 3.88Å; L263-Q269 PolarHBondContact O-NE2 3.39Å; N265-Q269 PolarHBondContact O-N 2.69Å; N265-Q269 VanDerWaalsContact O-N 3.08Å; A266-Q269 PolarHBondContact O-N 2.73Å; Q269-Q272 PolarHBondContact O-N 2.9Å; Q269-I273 WeakPolarHBondContact O-CG1 3.43Å; Q269-I273 PolarHBondContact O-N 2.98Å; Q269-I273 VanDerWaalsContact O-N 3.07Å
270	A	81.6	Confident	81	Confident	4 Å²	4	36.1 Å²	36.1	3%	0.033	20%	0.198	C	C	.	.	H	α-helix	trans	-58.6	-50.6	175.4	0	0	0	0	0	111.3	A266 Q272 I273 R274	A266-A270 WeakPolarHBondContact O-CB 3.36Å; A266-A270 PolarHBondContact O-N 2.81Å; A270-Q272 PolarHBondContact O-N 3.47Å; A270-I273 WeakPolarHBondContact O-CB 3.25Å; A270-I273 PolarHBondContact O-N 2.8Å; A270-R274 VanDerWaalsContact O-CG 3.32Å; A270-R274 WeakPolarHBondContact O-CG 3.38Å; A270-R274 PolarHBondContact O-N 2.81Å
271	A	81.6	Confident	81.3	Confident	4 Å²	4	36 Å²	36	3%	0.033	19%	0.192	C	C	.	.	H	α-helix	trans	-64.6	-21.8	179.5	0	0	0	0	0	114.2	D267 E268 R275 R587	D267-A271 WeakPolarHBondContact O-CB 3.45Å; D267-A271 PolarHBondContact O-N 3.36Å; E268-A271 PolarHBondContact O-N 2.73Å; A271-R275 WeakPolarHBondContact O-CG 3.19Å; A271-R275 PolarHBondContact O-N 2.89Å; A271-R275 PolarHBondContact O-NE 3.12Å; A271-R587 WeakPolarHBondContact CB-O 3.36Å
272	Q	82.8	Confident	81.4	Confident	34 Å²	34	41 Å²	41	16%	0.159	21%	0.214	C	C	.	.	H	α-helix	trans	-75.7	-42.1	169.5	-177	61.9	40.8	0	0	111.5	Y97 L263 E268 Q269 A270 R275 E276	Y97-Q272 HydrophobicContact CE2-CB 4.23Å; Y97-Q272 HydrophobicContact CE2-CG 3.96Å; Y97-Q272 WeakPolarHBondContact OH-CG 3.46Å; L263-Q272 HydrophobicContact CD1-CB 4.02Å; L263-Q272 HydrophobicContact CD1-CG 4.44Å; E268-Q272 WeakPolarHBondContact O-CB 3.22Å; E268-Q272 PolarHBondContact O-N 2.98Å; Q269-Q272 PolarHBondContact O-N 2.9Å; A270-Q272 PolarHBondContact O-N 3.47Å; Q272-R275 PolarHBondContact O-N 3.46Å; Q272-R275 VanDerWaalsContact OE1-NH1 3.13Å; Q272-E276 PolarHBondContact NE2-OE1 3.16Å; Q272-E276 PolarHBondContact O-N 3.24Å
273	I	85.5	Confident	81.7	Confident	5 Å²	5	42.3 Å²	42.3	3%	0.026	22%	0.222	C	C	.	.	H	α-helix	trans	-61.2	-45.7	173.3	-61.1	159.3	0	0	0	110.6	Y97 F99 Q269 A270 R275 E276 L277 L320	Y97-I273 HydrophobicContact CD2-CD1 3.91Å; Y97-I273 HydrophobicContact CD2-CG1 3.67Å; Y97-I273 HydrophobicContact CE2-CG1 3.91Å; F99-I273 HydrophobicContact CB-CD1 4.19Å; F99-I273 HydrophobicContact CD1-CD1 3.47Å; F99-I273 VanDerWaalsContact CD1-CD1 3.47Å; F99-I273 HydrophobicContact CD1-CG1 3.97Å; F99-I273 HydrophobicContact CD1-CG2 4.11Å; F99-I273 HydrophobicContact CD2-CG2 4.39Å; F99-I273 HydrophobicContact CE1-CB 4.45Å; F99-I273 HydrophobicContact CE1-CD1 3.99Å; F99-I273 HydrophobicContact CE1-CG1 3.97Å; F99-I273 HydrophobicContact CE1-CG2 3.58Å; F99-I273 HydrophobicContact CE2-CG2 3.89Å; F99-I273 HydrophobicContact CG-CD1 3.88Å; F99-I273 HydrophobicContact CG-CG2 4.49Å; F99-I273 HydrophobicContact CZ-CG2 3.46Å; F99-I273 VanDerWaalsContact CZ-CG2 3.46Å; Q269-I273 WeakPolarHBondContact O-CG1 3.43Å; Q269-I273 PolarHBondContact O-N 2.98Å; Q269-I273 VanDerWaalsContact O-N 3.07Å; A270-I273 WeakPolarHBondContact O-CB 3.25Å; A270-I273 PolarHBondContact O-N 2.8Å; I273-R275 VanDerWaalsContact C-N 3.32Å; I273-R275 PolarHBondContact O-N 2.89Å; I273-E276 PolarHBondContact O-N 2.88Å; I273-E276 VanDerWaalsContact O-N 3.09Å; I273-L277 HydrophobicContact CG2-CD1 4.04Å; I273-L277 HydrophobicContact CG2-CG 4.2Å; I273-L277 PolarHBondContact O-N 3.33Å; I273-L320 HydrophobicContact CB-CD2 4.04Å; I273-L320 HydrophobicContact CD1-CD1 3.77Å; I273-L320 HydrophobicContact CD1-CD2 4.34Å; I273-L320 HydrophobicContact CG2-CD2 3.86Å
274	R	84.8	Confident	82.1	Confident	11 Å²	11	40.3 Å²	40.3	4%	0.042	21%	0.212	C	C	.	.	H	α-helix	trans	-56.7	-43.6	179.7	-60.8	-151.6	-65.6	-71	-6.7	112.3	A270 E276 L277 D278 L320 Q517 Y518 R587 A588	A270-R274 VanDerWaalsContact O-CG 3.32Å; A270-R274 WeakPolarHBondContact O-CG 3.38Å; A270-R274 PolarHBondContact O-N 2.81Å; R274-E276 VanDerWaalsContact C-N 3.35Å; R274-E276 PolarHBondContact O-N 2.84Å; R274-L277 PolarHBondContact O-N 2.82Å; R274-D278 VanDerWaalsContact O-CB 3.28Å; R274-D278 WeakPolarHBondContact O-CB 3.41Å; R274-D278 PolarHBondContact O-N 3.01Å; R274-L320 HydrophobicContact CG-CD2 4.32Å; R274-Q517 WeakPolarHBondContact CD-O 3.34Å; R274-Q517 PolarHBondContact NH1-O 2.97Å; R274-Y518 HydrophobicContact CB-CE1 4.04Å; R274-Y518 HydrophobicContact CG-CD1 4.09Å; R274-Y518 HydrophobicContact CG-CE1 3.57Å; R274-Y518 HydrophobicContact CG-CE2 4.14Å; R274-R587 PolarHBondContact NH2-O 3.39Å; R274-A588 PolarHBondContact NH2-O 2.86Å
275	R	83.8	Confident	83	Confident	54 Å²	54	34.9 Å²	34.9	20%	0.204	18%	0.183	C	C	.	.	H	α-helix	trans	-61.7	-38.1	175.9	-79.4	177.2	-79	152	2.8	113.6	A271 Q272 I273 G279 Y586 G590 Q591	A271-R275 WeakPolarHBondContact O-CG 3.19Å; A271-R275 PolarHBondContact O-N 2.89Å; A271-R275 PolarHBondContact O-NE 3.12Å; Q272-R275 PolarHBondContact O-N 3.46Å; Q272-R275 VanDerWaalsContact OE1-NH1 3.13Å; I273-R275 VanDerWaalsContact C-N 3.32Å; I273-R275 PolarHBondContact O-N 2.89Å; R275-G279 PolarHBondContact O-N 2.89Å; R275-Y586 PolarHBondContact NH1-OH 2.97Å; R275-G590 WeakPolarHBondContact CG-O 3.28Å; R275-Q591 VanDerWaalsContact CD-O 3.3Å; R275-Q591 WeakPolarHBondContact CD-O 3.47Å
276	E	85.8	Confident	83.4	Confident	10 Å²	10	38 Å²	38	5%	0.047	20%	0.195	C	C	.	.	H	α-helix	trans	-76.8	-32	-179.5	-68.1	-180	-166.7	0	0	112	R93 Q272 I273 R274 R280 P635 R680	R93-E276 IonicContact CZ-OE1 3.7Å; R93-E276 IonicContact NH1-OE1 3.17Å; R93-E276 PolarHBondContact NH1-OE1 3.44Å; Q272-E276 PolarHBondContact NE2-OE1 3.16Å; Q272-E276 PolarHBondContact O-N 3.24Å; I273-E276 PolarHBondContact O-N 2.88Å; I273-E276 VanDerWaalsContact O-N 3.09Å; R274-E276 VanDerWaalsContact C-N 3.35Å; R274-E276 PolarHBondContact O-N 2.84Å; E276-R280 PolarHBondContact O-N 3.05Å; E276-P635 HydrophobicContact CG-CG 4.18Å; E276-R680 VanDerWaalsContact CD-NH2 3.26Å; E276-R680 IonicContact OE1-NH2 2.73Å; E276-R680 PolarHBondContact OE1-NH2 2.91Å; E276-R680 IonicContact OE2-CZ 2.88Å; E276-R680 IonicContact OE2-NE 3.2Å; E276-R680 PolarHBondContact OE2-NE 3.38Å; E276-R680 IonicContact OE2-NH2 2.88Å; E276-R680 PolarHBondContact OE2-NH2 2.99Å
277	L	86.5	Confident	83.9	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-76.6	-40.9	173.6	-66.9	-169.4	0	0	0	112.8	F99 I273 R274 G279 R280 L281 V313 L316 M317 Y518	F99-L277 HydrophobicContact CE2-CD1 4.39Å; F99-L277 HydrophobicContact CZ-CD1 4.41Å; I273-L277 HydrophobicContact CG2-CD1 4.04Å; I273-L277 HydrophobicContact CG2-CG 4.2Å; I273-L277 PolarHBondContact O-N 3.33Å; R274-L277 PolarHBondContact O-N 2.82Å; L277-G279 PolarHBondContact O-N 2.63Å; L277-R280 WeakPolarHBondContact O-CB 3.32Å; L277-R280 PolarHBondContact O-N 3.07Å; L277-R280 VanDerWaalsContact O-N 3.12Å; L277-L281 PolarHBondContact O-N 2.85Å; L277-V313 HydrophobicContact CB-CG1 3.8Å; L277-V313 HydrophobicContact CD1-CG1 4.47Å; L277-V313 HydrophobicContact CD2-CG1 4.27Å; L277-V313 HydrophobicContact CG-CG1 4.38Å; L277-L316 HydrophobicContact CD1-CB 3.66Å; L277-L316 HydrophobicContact CD2-CB 4.31Å; L277-L316 HydrophobicContact CD2-CD1 4.13Å; L277-M317 HydrophobicContact CD1-CG 4.23Å; L277-Y518 WeakPolarHBondContact CD1-OH 3.41Å
278	D	83.8	Confident	84.4	Confident	65 Å²	65	38 Å²	38	35%	0.348	19%	0.192	S	C	.	.	H	α-helix	trans	-59.6	-44.2	171.4	176.8	61.9	0	0	0	111.5	R274 R280 L281 Q282	R274-D278 VanDerWaalsContact O-CB 3.28Å; R274-D278 WeakPolarHBondContact O-CB 3.41Å; R274-D278 PolarHBondContact O-N 3.01Å; D278-R280 PolarHBondContact O-N 3.22Å; D278-L281 PolarHBondContact O-N 3.44Å; D278-Q282 WeakPolarHBondContact O-CG 3.49Å; D278-Q282 PolarHBondContact O-N 2.81Å; D278-Q282 PolarHBondContact OD2-NE2 2.87Å
279	G	84.9	Confident	84.8	Confident	15 Å²	15	43.7 Å²	43.7	16%	0.155	22%	0.215	C	C	.	.	H	α-helix	trans	-56.9	-33.5	173.5	0	0	0	0	0	113.8	R275 L277 L283	R275-G279 PolarHBondContact O-N 2.89Å; L277-G279 PolarHBondContact O-N 2.63Å; G279-L283 WeakPolarHBondContact O-CB 3.18Å; G279-L283 PolarHBondContact O-N 2.85Å; G279-L283 VanDerWaalsContact O-N 3.09Å
280	R	86.6	Confident	85	Confident	27 Å²	27	45.5 Å²	45.5	10%	0.102	22%	0.224	C	C	.	.	H	α-helix	trans	-73.6	-37.3	174	-75.5	-179.7	59	-161.8	-8.1	112.7	E276 L277 D278 L283 A284 S312 V313 A679 R680	E276-R280 PolarHBondContact O-N 3.05Å; L277-R280 WeakPolarHBondContact O-CB 3.32Å; L277-R280 PolarHBondContact O-N 3.07Å; L277-R280 VanDerWaalsContact O-N 3.12Å; D278-R280 PolarHBondContact O-N 3.22Å; R280-L283 PolarHBondContact O-N 2.89Å; R280-A284 PolarHBondContact O-N 2.94Å; R280-S312 PolarHBondContact NH2-OG 2.78Å; R280-S312 VanDerWaalsContact NH2-OG 3.12Å; R280-V313 HydrophobicContact CB-CG2 3.97Å; R280-A679 PolarHBondContact NH1-O 2.78Å; R280-R680 WeakPolarHBondContact CD-O 3.4Å; R280-R680 PolarHBondContact NH1-O 3.38Å
281	L	86.8	Confident	85	Confident	39 Å²	39	55.1 Å²	55.1	20%	0.204	26%	0.259	C	S	.	.	H	α-helix	trans	-64.1	-46.5	172.6	-70.3	171.1	0	0	0	111.1	L277 D278 L283 A284 D285 R310 V313 M317	L277-L281 PolarHBondContact O-N 2.85Å; D278-L281 PolarHBondContact O-N 3.44Å; L281-L283 VanDerWaalsContact C-N 3.25Å; L281-L283 PolarHBondContact O-N 2.75Å; L281-A284 PolarHBondContact O-N 3.46Å; L281-A284 VanDerWaalsContact O-N 3.16Å; L281-D285 WeakPolarHBondContact O-CB 3.29Å; L281-D285 PolarHBondContact O-N 2.8Å; L281-R310 HydrophobicContact CD2-CG 4.26Å; L281-V313 HydrophobicContact CD1-CG1 4.09Å; L281-V313 HydrophobicContact CD2-CB 3.98Å; L281-V313 HydrophobicContact CD2-CG1 4.04Å; L281-V313 HydrophobicContact CD2-CG2 4.47Å; L281-V313 HydrophobicContact CG-CB 4.26Å; L281-V313 HydrophobicContact CG-CG1 3.8Å; L281-M317 HydrophobicContact CD1-SD 4.14Å
282	Q	85	Confident	84.8	Confident	110 Å²	110	61.6 Å²	61.6	51%	0.514	29%	0.287	S	S	.	.	H	α-helix	trans	-57.6	-37.8	174.5	-67.3	-176.6	26.4	0	0	112.2	D278 K286	D278-Q282 WeakPolarHBondContact O-CG 3.49Å; D278-Q282 PolarHBondContact O-N 2.81Å; D278-Q282 PolarHBondContact OD2-NE2 2.87Å; Q282-K286 VanDerWaalsContact O-CB 3.25Å; Q282-K286 WeakPolarHBondContact O-CB 3.44Å; Q282-K286 PolarHBondContact O-N 3.25Å
283	L	84.3	Confident	84.6	Confident	76 Å²	76	62 Å²	62	40%	0.398	29%	0.288	S	S	.	.	H	α-helix	trans	-68.1	-43.2	175.9	-177.5	61	0	0	0	112.3	G279 R280 L281 K286 M287	G279-L283 WeakPolarHBondContact O-CB 3.18Å; G279-L283 PolarHBondContact O-N 2.85Å; G279-L283 VanDerWaalsContact O-N 3.09Å; R280-L283 PolarHBondContact O-N 2.89Å; L281-L283 VanDerWaalsContact C-N 3.25Å; L281-L283 PolarHBondContact O-N 2.75Å; L283-K286 PolarHBondContact O-N 2.8Å; L283-M287 WeakPolarHBondContact O-CB 3.43Å; L283-M287 PolarHBondContact O-N 3.1Å
284	A	86.3	Confident	84.3	Confident	3 Å²	3	64.2 Å²	64.2	3%	0.025	30%	0.303	C	S	.	.	H	α-helix	trans	-63.5	-43.7	175.7	0	0	0	0	0	111.7	R280 L281 K286 M287 A288 L309	R280-A284 PolarHBondContact O-N 2.94Å; L281-A284 PolarHBondContact O-N 3.46Å; L281-A284 VanDerWaalsContact O-N 3.16Å; A284-K286 PolarHBondContact O-N 2.93Å; A284-M287 WeakPolarHBondContact O-CB 3.26Å; A284-M287 PolarHBondContact O-N 3.38Å; A284-A288 PolarHBondContact O-N 3.06Å; A284-L309 HydrophobicContact CB-CB 4.26Å; A284-L309 HydrophobicContact CB-CD1 4.24Å
285	D	86.4	Confident	84.4	Confident	52 Å²	52	71.8 Å²	71.8	28%	0.278	34%	0.336	S	S	.	.	H	α-helix	trans	-65	-38.3	175.8	-85.3	10.6	0	0	0	112.5	L281 A288 K289 R310	L281-D285 WeakPolarHBondContact O-CB 3.29Å; L281-D285 PolarHBondContact O-N 2.8Å; D285-A288 PolarHBondContact O-N 3.11Å; D285-K289 WeakPolarHBondContact O-CB 3.34Å; D285-K289 WeakPolarHBondContact O-CD 3.33Å; D285-K289 WeakPolarHBondContact O-CG 2.95Å; D285-K289 PolarHBondContact O-N 3.02Å; D285-R310 IonicContact OD1-CZ 2.68Å; D285-R310 IonicContact OD1-NE 3.22Å; D285-R310 PolarHBondContact OD1-NE 3.39Å; D285-R310 IonicContact OD1-NH2 3.72Å; D285-R310 PolarHBondContact OD1-NH2 3.35Å
286	K	85.8	Confident	84.5	Confident	113 Å²	113	70.2 Å²	70.2	49%	0.491	33%	0.331	S	S	.	.	H	α-helix	trans	-63.4	-42.9	172.1	-176.5	-178.6	177.9	-175.6	0	111.2	Q282 L283 A284 K289 E290	Q282-K286 VanDerWaalsContact O-CB 3.25Å; Q282-K286 WeakPolarHBondContact O-CB 3.44Å; Q282-K286 PolarHBondContact O-N 3.25Å; L283-K286 PolarHBondContact O-N 2.8Å; A284-K286 PolarHBondContact O-N 2.93Å; K286-K289 PolarHBondContact O-N 3.47Å; K286-E290 WeakPolarHBondContact CE-OE1 3.32Å; K286-E290 HydrophobicContact CG-CG 4.38Å; K286-E290 IonicContact NZ-OE1 2.66Å; K286-E290 WeakPolarHBondContact O-CB 3.17Å; K286-E290 PolarHBondContact O-N 3.33Å
287	M	85.1	Confident	84.4	Confident	39 Å²	39	73.8 Å²	73.8	19%	0.192	35%	0.349	C	S	.	.	H	α-helix	trans	-61.7	-44.1	177.6	-169	-177.7	-70.3	0	0	111.6	L283 A284 E290 R291 K292 F293 Y305 I306	L283-M287 WeakPolarHBondContact O-CB 3.43Å; L283-M287 PolarHBondContact O-N 3.1Å; A284-M287 WeakPolarHBondContact O-CB 3.26Å; A284-M287 PolarHBondContact O-N 3.38Å; M287-E290 PolarHBondContact O-N 2.92Å; M287-R291 WeakPolarHBondContact O-CA 3.42Å; M287-R291 PolarHBondContact O-N 2.85Å; M287-K292 VanDerWaalsContact CG-O 3.29Å; M287-K292 WeakPolarHBondContact CG-O 3.27Å; M287-K292 PolarHBondContact O-N 2.85Å; M287-F293 HydrophobicContact CG-CD1 3.83Å; M287-F293 HydrophobicContact CG-CE1 4.12Å; M287-F293 HydrophobicContact SD-CD1 4.08Å; M287-Y305 HydrophobicContact CE-CE1 4.36Å; M287-Y305 HydrophobicContact SD-CD1 4.11Å; M287-Y305 HydrophobicContact SD-CE1 3.69Å; M287-I306 HydrophobicContact CB-CD1 4.07Å; M287-I306 HydrophobicContact CG-CD1 4.11Å; M287-I306 HydrophobicContact SD-CD1 3.94Å
288	A	85.4	Confident	84.3	Confident	36 Å²	36	75.5 Å²	75.5	30%	0.298	36%	0.363	S	S	.	.	H	α-helix	trans	-62.6	-41.3	174.6	0	0	0	0	0	112.9	A284 D285 I306	A284-A288 PolarHBondContact O-N 3.06Å; D285-A288 PolarHBondContact O-N 3.11Å; A288-I306 HydrophobicContact CB-CD1 4.46Å; A288-I306 HydrophobicContact CB-CG1 4.19Å; A288-I306 HydrophobicContact CB-CG2 4.19Å
289	K	85.8	Confident	84.1	Confident	171 Å²	171	80 Å²	80	74%	0.743	38%	0.38	S	S	*	.	H	α-helix	trans	-69.4	-40.3	177.8	-72.4	164.5	-172.8	168.8	0	112.7	D285 K286	D285-K289 WeakPolarHBondContact O-CB 3.34Å; D285-K289 WeakPolarHBondContact O-CD 3.33Å; D285-K289 WeakPolarHBondContact O-CG 2.95Å; D285-K289 PolarHBondContact O-N 3.02Å; K286-K289 PolarHBondContact O-N 3.47Å
290	E	87.1	Confident	83.9	Confident	87 Å²	87	83.9 Å²	83.9	41%	0.407	40%	0.397	S	S	.	.	H	α-helix	trans	-85.5	-11.8	179.8	-68.1	-171.3	-165.8	0	0	114	K286 M287 K292	K286-E290 WeakPolarHBondContact CE-OE1 3.32Å; K286-E290 HydrophobicContact CG-CG 4.38Å; K286-E290 IonicContact NZ-OE1 2.66Å; K286-E290 WeakPolarHBondContact O-CB 3.17Å; K286-E290 PolarHBondContact O-N 3.33Å; M287-E290 PolarHBondContact O-N 2.92Å; E290-K292 VanDerWaalsContact C-N 3.25Å; E290-K292 HydrophobicContact CB-CD 4.15Å; E290-K292 HydrophobicContact CB-CG 4.13Å; E290-K292 PolarHBondContact O-N 2.92Å; E290-K292 WeakPolarHBondContact OE2-CD 3.41Å; E290-K292 VanDerWaalsContact OE2-CE 3.29Å; E290-K292 WeakPolarHBondContact OE2-CE 3.33Å; E290-K292 IonicContact OE2-NZ 3.56Å; E290-K292 PolarHBondContact OE2-NZ 2.84Å
291	R	80.3	Confident	83.8	Confident	205 Å²	205	84.1 Å²	84.1	77%	0.774	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	37.4	-174.5	-61.9	-175.2	174.6	-175.5	-2.7	114.2	M287 F293	M287-R291 WeakPolarHBondContact O-CA 3.42Å; M287-R291 PolarHBondContact O-N 2.85Å; R291-F293 HydrophobicContact CB-CE2 3.95Å; R291-F293 HydrophobicContact CB-CZ 4.33Å; R291-F293 HydrophobicContact CG-CE2 4.25Å; R291-F293 HydrophobicContact CG-CZ 4.38Å
292	K	77.4	Confident	83.7	Confident	140 Å²	140	85.2 Å²	85.2	61%	0.609	40%	0.404	S	S	*	.			trans	-101.6	74.7	179.4	-69.8	178.4	-172.4	163	0	110.8	M287 E290	M287-K292 VanDerWaalsContact CG-O 3.29Å; M287-K292 WeakPolarHBondContact CG-O 3.27Å; M287-K292 PolarHBondContact O-N 2.85Å; E290-K292 VanDerWaalsContact C-N 3.25Å; E290-K292 HydrophobicContact CB-CD 4.15Å; E290-K292 HydrophobicContact CB-CG 4.13Å; E290-K292 PolarHBondContact O-N 2.92Å; E290-K292 WeakPolarHBondContact OE2-CD 3.41Å; E290-K292 VanDerWaalsContact OE2-CE 3.29Å; E290-K292 WeakPolarHBondContact OE2-CE 3.33Å; E290-K292 IonicContact OE2-NZ 3.56Å; E290-K292 PolarHBondContact OE2-NZ 2.84Å
293	F	78.8	Confident	83.6	Confident	42 Å²	42	85.1 Å²	85.1	18%	0.184	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-92.2	156.8	-178.5	-47.8	-62.4	0	0	0	111.8	M287 R291 F296 E302 I306	M287-F293 HydrophobicContact CG-CD1 3.83Å; M287-F293 HydrophobicContact CG-CE1 4.12Å; M287-F293 HydrophobicContact SD-CD1 4.08Å; R291-F293 HydrophobicContact CB-CE2 3.95Å; R291-F293 HydrophobicContact CB-CZ 4.33Å; R291-F293 HydrophobicContact CG-CE2 4.25Å; R291-F293 HydrophobicContact CG-CZ 4.38Å; F293-F296 HydrophobicContact CB-CE2 4.23Å; F293-E302 HydrophobicContact CD2-CB 3.82Å; F293-E302 HydrophobicContact CD2-CG 3.91Å; F293-E302 HydrophobicContact CE2-CB 4.04Å; F293-E302 HydrophobicContact CG-CB 4.28Å; F293-E302 HydrophobicContact CG-CG 4.43Å; F293-I306 HydrophobicContact CD1-CD1 4.32Å; F293-I306 HydrophobicContact CE1-CD1 3.96Å; F293-I306 HydrophobicContact CE1-CG1 3.88Å
294	P	80.4	Confident	83.6	Confident	52 Å²	52	84.4 Å²	84.4	34%	0.338	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-54.6	158.3	157	-21.9	33.5	0	0	0	111.3	F296 Y305	P294-F296 HydrophobicContact CB-CE2 4.05Å; P294-F296 HydrophobicContact CB-CZ 4Å; P294-F296 HydrophobicContact CG-CE2 4.3Å; P294-F296 HydrophobicContact CG-CZ 4.11Å; P294-F296 WeakPolarHBondContact O-CD2 2.99Å; P294-F296 VanDerWaalsContact O-CE2 3.32Å; P294-F296 WeakPolarHBondContact O-CE2 3.45Å; P294-F296 PolarHBondContact O-N 3.23Å; P294-Y305 HydrophobicContact CG-CE1 4.04Å
295	K	85.1	Confident	83.6	Confident	171 Å²	171	85.6 Å²	85.6	74%	0.743	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-74.4	123.3	171.8	-67.5	-180	-178.3	174.9	0	109.5	S734 V735	K295-S734 CarbonylContact O-C 3.51Å; K295-S734 VanDerWaalsContact O-CA 3.27Å; K295-S734 WeakPolarHBondContact O-CA 3.45Å; K295-S734 WeakPolarHBondContact O-CB 3.4Å; K295-V735 HydrophobicContact CB-CB 4.19Å; K295-V735 HydrophobicContact CB-CG2 3.95Å; K295-V735 PolarHBondContact O-N 3Å
296	F	87.6	Confident	83.6	Confident	21 Å²	21	83.5 Å²	83.5	9%	0.092	40%	0.395	C	S	.	.	B	Isolated β-bridge	trans	-106.6	159	175.1	-65.4	-79.1	0	0	0	112.2	F293 P294 A298 M301 E302 Y305 V733	F293-F296 HydrophobicContact CB-CE2 4.23Å; P294-F296 HydrophobicContact CB-CE2 4.05Å; P294-F296 HydrophobicContact CB-CZ 4Å; P294-F296 HydrophobicContact CG-CE2 4.3Å; P294-F296 HydrophobicContact CG-CZ 4.11Å; P294-F296 WeakPolarHBondContact O-CD2 2.99Å; P294-F296 VanDerWaalsContact O-CE2 3.32Å; P294-F296 WeakPolarHBondContact O-CE2 3.45Å; P294-F296 PolarHBondContact O-N 3.23Å; F296-A298 VanDerWaalsContact C-N 3.3Å; F296-A298 PolarHBondContact O-N 2.83Å; F296-M301 HydrophobicContact CB-CB 3.76Å; F296-M301 HydrophobicContact CB-SD 4.24Å; F296-M301 HydrophobicContact CD1-CB 4.15Å; F296-M301 HydrophobicContact CG-CB 3.91Å; F296-E302 HydrophobicContact CD2-CG 4.33Å; F296-Y305 HydrophobicContact CE1-CD2 4.21Å; F296-Y305 HydrophobicContact CE1-CG 4.21Å; F296-Y305 HydrophobicContact CE2-CD1 4.01Å; F296-Y305 AromaticContact CE2-CG 4Å; F296-Y305 HydrophobicContact CE2-CG 4Å; F296-Y305 AromaticContact CZ-CD1 3.66Å; F296-Y305 HydrophobicContact CZ-CD1 3.66Å; F296-Y305 AromaticContact CZ-CD2 3.73Å; F296-Y305 HydrophobicContact CZ-CD2 3.73Å; F296-Y305 HydrophobicContact CZ-CE1 4.23Å; F296-Y305 HydrophobicContact CZ-CE2 4.31Å; F296-Y305 AromaticContact CZ-CG 3.37Å; F296-Y305 HydrophobicContact CZ-CG 3.37Å; F296-V733 WeakPolarHBondContact CD1-O 3.26Å
297	I	83.8	Confident	83.6	Confident	85 Å²	85	83.1 Å²	83.1	44%	0.436	40%	0.395	S	S	.	.	S	Bend	trans	-63.1	-37.4	178.4	-63.9	178.1	0	0	0	111.6	M301 V733 K738	I297-M301 HydrophobicContact CB-SD 4.48Å; I297-V733 HydrophobicContact CD1-CB 3.85Å; I297-V733 HydrophobicContact CD1-CG1 3.58Å; I297-V733 HydrophobicContact CG1-CB 4.43Å; I297-V733 HydrophobicContact CG1-CG1 4.39Å; I297-V733 PolarHBondContact N-O 3.01Å; I297-V733 VanDerWaalsContact N-O 3.11Å; I297-K738 HydrophobicContact CD1-CB 4.09Å; I297-K738 HydrophobicContact CD1-CD 3.73Å; I297-K738 HydrophobicContact CD1-CG 4.49Å
298	A	83.1	Confident	83.7	Confident	36 Å²	36	83 Å²	83	30%	0.298	39%	0.394	S	S	.	.	S	Bend	trans	-131.1	149.5	178.7	0	0	0	0	0	110.8	F296 D300 M301	F296-A298 VanDerWaalsContact C-N 3.3Å; F296-A298 PolarHBondContact O-N 2.83Å; A298-D300 WeakPolarHBondContact CB-OD1 3.08Å; A298-M301 HydrophobicContact CB-CE 4.22Å; A298-M301 HydrophobicContact CB-CG 4.29Å; A298-M301 HydrophobicContact CB-SD 4.36Å; A298-M301 VanDerWaalsContact O-CB 3.25Å; A298-M301 WeakPolarHBondContact O-CB 3.37Å; A298-M301 WeakPolarHBondContact O-CG 3.11Å; A298-M301 PolarHBondContact O-N 2.68Å
299	K	79.9	Confident	83.7	Confident	160 Å²	160	82.8 Å²	82.8	70%	0.696	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-28	-165.9	-171.9	172.4	-176.1	176.3	0	114.1	M301 E302	K299-M301 PolarHBondContact O-N 3.31Å; K299-E302 WeakPolarHBondContact O-CB 3.22Å; K299-E302 WeakPolarHBondContact O-CG 3.2Å; K299-E302 PolarHBondContact O-N 3.42Å
300	D	81.6	Confident	83.8	Confident	96 Å²	96	79.3 Å²	79.3	51%	0.513	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-30.1	168.9	56.8	-37.7	0	0	0	112.6	A298 E302 N303 M304	A298-D300 WeakPolarHBondContact CB-OD1 3.08Å; D300-E302 PolarHBondContact O-N 3.08Å; D300-N303 PolarHBondContact O-N 3.4Å; D300-M304 HydrophobicContact CB-CE 4.34Å; D300-M304 PolarHBondContact O-N 3.32Å
301	M	84.3	Confident	83.8	Confident	33 Å²	33	78.6 Å²	78.6	16%	0.163	37%	0.374	C	S	.	.	H	α-helix	trans	-63	-22.6	175.3	-57.1	-178.3	173.4	0	0	113.5	F296 I297 A298 K299 N303 M304 Y305 T732 V733	F296-M301 HydrophobicContact CB-CB 3.76Å; F296-M301 HydrophobicContact CB-SD 4.24Å; F296-M301 HydrophobicContact CD1-CB 4.15Å; F296-M301 HydrophobicContact CG-CB 3.91Å; I297-M301 HydrophobicContact CB-SD 4.48Å; A298-M301 HydrophobicContact CB-CE 4.22Å; A298-M301 HydrophobicContact CB-CG 4.29Å; A298-M301 HydrophobicContact CB-SD 4.36Å; A298-M301 VanDerWaalsContact O-CB 3.25Å; A298-M301 WeakPolarHBondContact O-CB 3.37Å; A298-M301 WeakPolarHBondContact O-CG 3.11Å; A298-M301 PolarHBondContact O-N 2.68Å; K299-M301 PolarHBondContact O-N 3.31Å; M301-N303 VanDerWaalsContact C-N 3.28Å; M301-N303 PolarHBondContact O-N 3Å; M301-M304 HydrophobicContact CB-CE 4.37Å; M301-M304 HydrophobicContact CG-CE 3.89Å; M301-M304 PolarHBondContact O-N 2.96Å; M301-Y305 WeakPolarHBondContact O-CB 3.5Å; M301-Y305 PolarHBondContact O-N 3.3Å; M301-T732 HydrophobicContact CB-CG2 3.95Å; M301-T732 WeakPolarHBondContact O-CG2 3.45Å; M301-V733 PolarHBondContact SD-N 3.41Å
302	E	84.4	Confident	84.1	Confident	62 Å²	62	70.8 Å²	70.8	29%	0.29	35%	0.351	S	S	.	.	H	α-helix	trans	-57.6	-40.9	176.5	-67.4	175.4	-170.5	0	0	111.8	F293 F296 K299 D300	F293-E302 HydrophobicContact CD2-CB 3.82Å; F293-E302 HydrophobicContact CD2-CG 3.91Å; F293-E302 HydrophobicContact CE2-CB 4.04Å; F293-E302 HydrophobicContact CG-CB 4.28Å; F293-E302 HydrophobicContact CG-CG 4.43Å; F296-E302 HydrophobicContact CD2-CG 4.33Å; K299-E302 WeakPolarHBondContact O-CB 3.22Å; K299-E302 WeakPolarHBondContact O-CG 3.2Å; K299-E302 PolarHBondContact O-N 3.42Å; D300-E302 PolarHBondContact O-N 3.08Å
303	N	82.7	Confident	84.6	Confident	108 Å²	108	64.2 Å²	64.2	58%	0.578	32%	0.323	S	S	*	.	H	α-helix	trans	-78.8	-45.5	177.6	-67.3	-33	0	0	0	111.4	D300 M301 Y305 I306 E307	D300-N303 PolarHBondContact O-N 3.4Å; M301-N303 VanDerWaalsContact C-N 3.28Å; M301-N303 PolarHBondContact O-N 3Å; N303-Y305 PolarHBondContact O-N 3.19Å; N303-Y305 VanDerWaalsContact O-N 3.11Å; N303-I306 PolarHBondContact O-N 3.27Å; N303-E307 PolarHBondContact O-N 3.23Å
304	M	84.9	Confident	84.9	Confident	60 Å²	60	66.4 Å²	66.4	30%	0.296	34%	0.336	S	S	.	.	H	α-helix	trans	-59.3	-24.6	177.9	-66.2	-170.6	-74.5	0	0	112.2	D300 M301 E307 E308 T732	D300-M304 HydrophobicContact CB-CE 4.34Å; D300-M304 PolarHBondContact O-N 3.32Å; M301-M304 HydrophobicContact CB-CE 4.37Å; M301-M304 HydrophobicContact CG-CE 3.89Å; M301-M304 PolarHBondContact O-N 2.96Å; M304-E307 PolarHBondContact O-N 2.66Å; M304-E308 WeakPolarHBondContact O-CB 3.38Å; M304-E308 PolarHBondContact O-N 3.01Å; M304-T732 HydrophobicContact CB-CG2 3.7Å
305	Y	86.1	Confident	85.2	Confident	29 Å²	29	68.8 Å²	68.8	11%	0.114	35%	0.346	C	S	.	.	H	α-helix	trans	-70.6	-38.2	176.4	179.7	-122.1	0	0	0	112.3	M287 P294 F296 M301 N303 E307 E308 L309	M287-Y305 HydrophobicContact CE-CE1 4.36Å; M287-Y305 HydrophobicContact SD-CD1 4.11Å; M287-Y305 HydrophobicContact SD-CE1 3.69Å; P294-Y305 HydrophobicContact CG-CE1 4.04Å; F296-Y305 HydrophobicContact CE1-CD2 4.21Å; F296-Y305 HydrophobicContact CE1-CG 4.21Å; F296-Y305 HydrophobicContact CE2-CD1 4.01Å; F296-Y305 AromaticContact CE2-CG 4Å; F296-Y305 HydrophobicContact CE2-CG 4Å; F296-Y305 AromaticContact CZ-CD1 3.66Å; F296-Y305 HydrophobicContact CZ-CD1 3.66Å; F296-Y305 AromaticContact CZ-CD2 3.73Å; F296-Y305 HydrophobicContact CZ-CD2 3.73Å; F296-Y305 HydrophobicContact CZ-CE1 4.23Å; F296-Y305 HydrophobicContact CZ-CE2 4.31Å; F296-Y305 AromaticContact CZ-CG 3.37Å; F296-Y305 HydrophobicContact CZ-CG 3.37Å; M301-Y305 WeakPolarHBondContact O-CB 3.5Å; M301-Y305 PolarHBondContact O-N 3.3Å; N303-Y305 PolarHBondContact O-N 3.19Å; N303-Y305 VanDerWaalsContact O-N 3.11Å; Y305-E307 VanDerWaalsContact C-N 3.29Å; Y305-E308 PolarHBondContact O-N 2.77Å; Y305-L309 HydrophobicContact CD1-CD1 4.17Å; Y305-L309 HydrophobicContact CD2-CG 4.46Å; Y305-L309 HydrophobicContact CE1-CD1 3.69Å; Y305-L309 HydrophobicContact CE1-CG 4.34Å; Y305-L309 HydrophobicContact CE2-CD1 4.3Å; Y305-L309 HydrophobicContact CE2-CD2 4.3Å; Y305-L309 HydrophobicContact CE2-CG 4.06Å; Y305-L309 WeakPolarHBondContact O-CB 3.41Å; Y305-L309 WeakPolarHBondContact O-CG 3.45Å; Y305-L309 PolarHBondContact O-N 2.94Å
306	I	86.8	Confident	85.2	Confident	7 Å²	7	61 Å²	61	4%	0.036	31%	0.312	C	S	.	.	H	α-helix	trans	-68.2	-34.2	174	-59.8	-55.7	0	0	0	110.5	M287 A288 F293 N303 L309 R310	M287-I306 HydrophobicContact CB-CD1 4.07Å; M287-I306 HydrophobicContact CG-CD1 4.11Å; M287-I306 HydrophobicContact SD-CD1 3.94Å; A288-I306 HydrophobicContact CB-CD1 4.46Å; A288-I306 HydrophobicContact CB-CG1 4.19Å; A288-I306 HydrophobicContact CB-CG2 4.19Å; F293-I306 HydrophobicContact CD1-CD1 4.32Å; F293-I306 HydrophobicContact CE1-CD1 3.96Å; F293-I306 HydrophobicContact CE1-CG1 3.88Å; N303-I306 PolarHBondContact O-N 3.27Å; I306-L309 HydrophobicContact CD1-CD1 4.36Å; I306-R310 WeakPolarHBondContact O-CB 3.5Å; I306-R310 VanDerWaalsContact O-CG 3.26Å; I306-R310 WeakPolarHBondContact O-CG 3.27Å; I306-R310 PolarHBondContact O-N 3.2Å
307	E	85.5	Confident	85.1	Confident	106 Å²	106	61.8 Å²	61.8	50%	0.495	32%	0.317	S	S	.	.	H	α-helix	trans	-69.8	-41.8	172.8	-66.1	172.9	-176.3	0	0	112	N303 M304 Y305 L309 R310 S311	N303-E307 PolarHBondContact O-N 3.23Å; M304-E307 PolarHBondContact O-N 2.66Å; Y305-E307 VanDerWaalsContact C-N 3.29Å; E307-L309 PolarHBondContact O-N 2.98Å; E307-R310 PolarHBondContact O-N 2.89Å; E307-S311 WeakPolarHBondContact O-CB 3.47Å; E307-S311 PolarHBondContact O-N 3.2Å
308	E	85.9	Confident	85	Confident	37 Å²	37	59.1 Å²	59.1	17%	0.173	31%	0.307	C	S	.	.	H	α-helix	trans	-58.2	-46.6	172.2	-173.3	178.9	149.9	0	0	110.5	M304 Y305 S312 R684 T732	M304-E308 WeakPolarHBondContact O-CB 3.38Å; M304-E308 PolarHBondContact O-N 3.01Å; Y305-E308 PolarHBondContact O-N 2.77Å; E308-S312 WeakPolarHBondContact O-CB 3.4Å; E308-S312 PolarHBondContact O-N 2.75Å; E308-R684 IonicContact OE1-CZ 2.63Å; E308-R684 IonicContact OE1-NE 3.74Å; E308-R684 PolarHBondContact OE1-NE 3.01Å; E308-R684 IonicContact OE1-NH2 3.58Å; E308-R684 PolarHBondContact OE1-NH2 3.32Å; E308-R684 IonicContact OE2-NH2 3.18Å; E308-T732 WeakPolarHBondContact OE2-CB 3.36Å; E308-T732 PolarHBondContact OE2-N 3.16Å; E308-T732 VanDerWaalsContact OE2-N 3.09Å; E308-T732 PolarHBondContact OE2-OG1 3.12Å
309	L	86.4	Confident	85	Confident	30 Å²	30	59.7 Å²	59.7	16%	0.157	31%	0.305	C	S	.	.	H	α-helix	trans	-62.3	-52.2	175.9	-74.9	177	0	0	0	112.4	A284 Y305 I306 E307 S312 V313	A284-L309 HydrophobicContact CB-CB 4.26Å; A284-L309 HydrophobicContact CB-CD1 4.24Å; Y305-L309 HydrophobicContact CD1-CD1 4.17Å; Y305-L309 HydrophobicContact CD2-CG 4.46Å; Y305-L309 HydrophobicContact CE1-CD1 3.69Å; Y305-L309 HydrophobicContact CE1-CG 4.34Å; Y305-L309 HydrophobicContact CE2-CD1 4.3Å; Y305-L309 HydrophobicContact CE2-CD2 4.3Å; Y305-L309 HydrophobicContact CE2-CG 4.06Å; Y305-L309 WeakPolarHBondContact O-CB 3.41Å; Y305-L309 WeakPolarHBondContact O-CG 3.45Å; Y305-L309 PolarHBondContact O-N 2.94Å; I306-L309 HydrophobicContact CD1-CD1 4.36Å; E307-L309 PolarHBondContact O-N 2.98Å; L309-S312 PolarHBondContact O-N 2.98Å; L309-S312 PolarHBondContact O-OG 2.92Å; L309-V313 PolarHBondContact O-N 2.75Å; L309-V313 VanDerWaalsContact O-N 3.13Å
310	R	88.6	Confident	85.1	Confident	99 Å²	99	52.3 Å²	52.3	37%	0.374	27%	0.273	S	S	.	.	H	α-helix	trans	-61	-44.7	179	-75.2	169.6	172.1	174.6	-6.6	111.6	L281 D285 I306 E307 S312 V313 N314	L281-R310 HydrophobicContact CD2-CG 4.26Å; D285-R310 IonicContact OD1-CZ 2.68Å; D285-R310 IonicContact OD1-NE 3.22Å; D285-R310 PolarHBondContact OD1-NE 3.39Å; D285-R310 IonicContact OD1-NH2 3.72Å; D285-R310 PolarHBondContact OD1-NH2 3.35Å; I306-R310 WeakPolarHBondContact O-CB 3.5Å; I306-R310 VanDerWaalsContact O-CG 3.26Å; I306-R310 WeakPolarHBondContact O-CG 3.27Å; I306-R310 PolarHBondContact O-N 3.2Å; E307-R310 PolarHBondContact O-N 2.89Å; R310-S312 PolarHBondContact O-N 2.82Å; R310-V313 PolarHBondContact O-N 2.9Å; R310-N314 WeakPolarHBondContact O-CB 3.28Å; R310-N314 PolarHBondContact O-N 2.88Å; R310-N314 PolarHBondContact O-ND2 3.42Å
311	S	86.4	Confident	85	Confident	71 Å²	71	51 Å²	51	50%	0.497	26%	0.264	S	S	.	.	H	α-helix	trans	-59.4	-44.4	175.9	-173.2	0	0	0	0	111.6	E307 V313 N314 L315	E307-S311 WeakPolarHBondContact O-CB 3.47Å; E307-S311 PolarHBondContact O-N 3.2Å; S311-V313 VanDerWaalsContact C-N 3.31Å; S311-V313 PolarHBondContact O-N 3.09Å; S311-N314 PolarHBondContact O-N 3.34Å; S311-L315 WeakPolarHBondContact O-CB 3.34Å; S311-L315 PolarHBondContact O-N 2.91Å
312	S	86.1	Confident	84.5	Confident	41 Å²	41	53.6 Å²	53.6	29%	0.287	29%	0.285	S	S	.	.	H	α-helix	trans	-60	-39.2	176.7	80.2	0	0	0	0	112.7	R280 E308 L309 R310 L316	R280-S312 PolarHBondContact NH2-OG 2.78Å; R280-S312 VanDerWaalsContact NH2-OG 3.12Å; E308-S312 WeakPolarHBondContact O-CB 3.4Å; E308-S312 PolarHBondContact O-N 2.75Å; L309-S312 PolarHBondContact O-N 2.98Å; L309-S312 PolarHBondContact O-OG 2.92Å; R310-S312 PolarHBondContact O-N 2.82Å; S312-L316 WeakPolarHBondContact O-CD1 3.39Å; S312-L316 VanDerWaalsContact O-CG 3.25Å; S312-L316 WeakPolarHBondContact O-CG 3.45Å; S312-L316 PolarHBondContact O-N 2.87Å
313	V	87.6	Confident	84	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.018	29%	0.288	C	S	.	.	H	α-helix	trans	-74	-42.6	177.1	179.7	0	0	0	0	111.1	L277 R280 L281 L309 R310 S311 L315 L316 M317	L277-V313 HydrophobicContact CB-CG1 3.8Å; L277-V313 HydrophobicContact CD1-CG1 4.47Å; L277-V313 HydrophobicContact CD2-CG1 4.27Å; L277-V313 HydrophobicContact CG-CG1 4.38Å; R280-V313 HydrophobicContact CB-CG2 3.97Å; L281-V313 HydrophobicContact CD1-CG1 4.09Å; L281-V313 HydrophobicContact CD2-CB 3.98Å; L281-V313 HydrophobicContact CD2-CG1 4.04Å; L281-V313 HydrophobicContact CD2-CG2 4.47Å; L281-V313 HydrophobicContact CG-CB 4.26Å; L281-V313 HydrophobicContact CG-CG1 3.8Å; L309-V313 PolarHBondContact O-N 2.75Å; L309-V313 VanDerWaalsContact O-N 3.13Å; R310-V313 PolarHBondContact O-N 2.9Å; S311-V313 VanDerWaalsContact C-N 3.31Å; S311-V313 PolarHBondContact O-N 3.09Å; V313-L315 VanDerWaalsContact C-N 3.28Å; V313-L315 PolarHBondContact O-N 2.79Å; V313-L316 CarbonylContact O-C 3.53Å; V313-L316 WeakPolarHBondContact O-CA 3.48Å; V313-L316 WeakPolarHBondContact O-CB 3.32Å; V313-L316 PolarHBondContact O-N 2.9Å; V313-M317 HydrophobicContact CG1-CG 4.26Å; V313-M317 HydrophobicContact CG1-SD 4.14Å; V313-M317 WeakPolarHBondContact O-CG 3.33Å; V313-M317 PolarHBondContact O-N 3.13Å
314	N	86.4	Confident	83.2	Confident	88 Å²	88	53 Å²	53	47%	0.471	29%	0.289	S	S	.	.	H	α-helix	trans	-60.8	-36.2	177.7	-70	-14.7	0	0	0	112.4	R310 S311 M317 A318	R310-N314 WeakPolarHBondContact O-CB 3.28Å; R310-N314 PolarHBondContact O-N 2.88Å; R310-N314 PolarHBondContact O-ND2 3.42Å; S311-N314 PolarHBondContact O-N 3.34Å; N314-M317 PolarHBondContact O-N 3.47Å; N314-A318 WeakPolarHBondContact O-CB 3.42Å; N314-A318 PolarHBondContact O-N 3.23Å
315	L	86.2	Confident	82.1	Confident	102 Å²	102	51.4 Å²	51.4	53%	0.534	28%	0.282	S	S	.	.	H	α-helix	trans	-63.6	-42.2	172.1	179.1	60.3	0	0	0	111.6	S311 V313 A318 N319	S311-L315 WeakPolarHBondContact O-CB 3.34Å; S311-L315 PolarHBondContact O-N 2.91Å; V313-L315 VanDerWaalsContact C-N 3.28Å; V313-L315 PolarHBondContact O-N 2.79Å; L315-A318 PolarHBondContact O-N 2.91Å; L315-N319 WeakPolarHBondContact O-CB 3.06Å; L315-N319 VanDerWaalsContact O-CG 3.26Å; L315-N319 PolarHBondContact O-N 2.82Å
316	L	86	Confident	80.7	Confident	8 Å²	8	52 Å²	52	4%	0.042	29%	0.291	C	S	.	.	H	α-helix	trans	-69.5	-33.7	177.4	-67	164.3	0	0	0	112.5	F99 N100 L277 S312 V313 L320 A679	F99-L316 HydrophobicContact CE2-CB 4.13Å; F99-L316 HydrophobicContact CE2-CD2 4.14Å; F99-L316 HydrophobicContact CZ-CD2 4.44Å; N100-L316 HydrophobicContact CB-CD2 3.81Å; N100-L316 WeakPolarHBondContact OD1-CD2 3.4Å; L277-L316 HydrophobicContact CD1-CB 3.66Å; L277-L316 HydrophobicContact CD2-CB 4.31Å; L277-L316 HydrophobicContact CD2-CD1 4.13Å; S312-L316 WeakPolarHBondContact O-CD1 3.39Å; S312-L316 VanDerWaalsContact O-CG 3.25Å; S312-L316 WeakPolarHBondContact O-CG 3.45Å; S312-L316 PolarHBondContact O-N 2.87Å; V313-L316 CarbonylContact O-C 3.53Å; V313-L316 WeakPolarHBondContact O-CA 3.48Å; V313-L316 WeakPolarHBondContact O-CB 3.32Å; V313-L316 PolarHBondContact O-N 2.9Å; L316-L320 PolarHBondContact O-N 2.55Å; L316-A679 WeakPolarHBondContact CD1-O 3.06Å; L316-A679 HydrophobicContact CD2-CB 3.97Å
317	M	83.7	Confident	78.8	Confident	37 Å²	37	61.6 Å²	61.6	18%	0.182	33%	0.332	C	S	.	.	H	α-helix	trans	-61.2	-52.8	169.7	-65.7	171.1	69.4	0	0	110	L277 L281 V313 N314 N319 L320 E321 Y518	L277-M317 HydrophobicContact CD1-CG 4.23Å; L281-M317 HydrophobicContact CD1-SD 4.14Å; V313-M317 HydrophobicContact CG1-CG 4.26Å; V313-M317 HydrophobicContact CG1-SD 4.14Å; V313-M317 WeakPolarHBondContact O-CG 3.33Å; V313-M317 PolarHBondContact O-N 3.13Å; N314-M317 PolarHBondContact O-N 3.47Å; M317-N319 VanDerWaalsContact C-N 3.32Å; M317-N319 PolarHBondContact O-N 3.36Å; M317-L320 WeakPolarHBondContact O-CB 3.36Å; M317-L320 PolarHBondContact O-N 2.81Å; M317-L320 VanDerWaalsContact O-N 3.11Å; M317-E321 WeakPolarHBondContact O-CG 3.34Å; M317-E321 PolarHBondContact O-N 2.74Å; M317-Y518 HydrophobicContact CB-CD2 4.31Å; M317-Y518 HydrophobicContact CB-CE2 3.81Å; M317-Y518 HydrophobicContact CE-CD1 3.85Å; M317-Y518 HydrophobicContact CE-CE1 3.68Å; M317-Y518 HydrophobicContact CG-CE1 4.02Å; M317-Y518 HydrophobicContact CG-CE2 3.97Å
318	A	82.2	Confident	76.8	Confident	28 Å²	28	60.6 Å²	60.6	23%	0.231	35%	0.35	C	S	.	.	H	α-helix	trans	-61.8	-35.7	178.7	0	0	0	0	0	113.4	N314 L315 E321 S322	N314-A318 WeakPolarHBondContact O-CB 3.42Å; N314-A318 PolarHBondContact O-N 3.23Å; L315-A318 PolarHBondContact O-N 2.91Å; A318-E321 WeakPolarHBondContact O-CB 3.37Å; A318-E321 PolarHBondContact O-N 3.43Å; A318-S322 PolarHBondContact O-N 3.1Å
319	N	83.8	Confident	74.6	Confident	49 Å²	49	61.1 Å²	61.1	26%	0.262	37%	0.366	S	S	.	.	H	α-helix	trans	-66.4	-40.3	174.4	-73.7	-11	0	0	0	111.2	N100 L315 M317 S322	N100-N319 PolarHBondContact OD1-ND2 3.17Å; L315-N319 WeakPolarHBondContact O-CB 3.06Å; L315-N319 VanDerWaalsContact O-CG 3.26Å; L315-N319 PolarHBondContact O-N 2.82Å; M317-N319 VanDerWaalsContact C-N 3.32Å; M317-N319 PolarHBondContact O-N 3.36Å; N319-S322 WeakPolarHBondContact O-CB 3.5Å; N319-S322 PolarHBondContact O-N 3.2Å; N319-S322 PolarHBondContact O-OG 3.46Å
320	L	82.8	Confident	72.2	Confident	4 Å²	4	65.7 Å²	65.7	2%	0.021	40%	0.397	C	S	.	.	H	α-helix	trans	-66.5	-40.1	172	-171.3	65.6	0	0	0	112	F99 I273 R274 L316 M317 S322 L323 Q517 Y518	F99-L320 HydrophobicContact CB-CD1 3.74Å; F99-L320 HydrophobicContact CD2-CB 3.95Å; F99-L320 HydrophobicContact CD2-CD1 4.11Å; F99-L320 HydrophobicContact CE2-CB 4.49Å; F99-L320 HydrophobicContact CG-CD1 4.03Å; I273-L320 HydrophobicContact CB-CD2 4.04Å; I273-L320 HydrophobicContact CD1-CD1 3.77Å; I273-L320 HydrophobicContact CD1-CD2 4.34Å; I273-L320 HydrophobicContact CG2-CD2 3.86Å; R274-L320 HydrophobicContact CG-CD2 4.32Å; L316-L320 PolarHBondContact O-N 2.55Å; M317-L320 WeakPolarHBondContact O-CB 3.36Å; M317-L320 PolarHBondContact O-N 2.81Å; M317-L320 VanDerWaalsContact O-N 3.11Å; L320-S322 PolarHBondContact O-N 3.37Å; L320-L323 HydrophobicContact CD1-CD1 4.04Å; L320-L323 WeakPolarHBondContact O-CB 3.48Å; L320-L323 PolarHBondContact O-N 3.11Å; L320-L323 VanDerWaalsContact O-N 3.11Å; L320-Q517 HydrophobicContact CD2-CB 4.44Å; L320-Q517 HydrophobicContact CG-CB 3.88Å; L320-Q517 WeakPolarHBondContact O-CB 3.45Å; L320-Q517 VanDerWaalsContact O-CG 3.22Å; L320-Q517 WeakPolarHBondContact O-CG 3.34Å; L320-Y518 HydrophobicContact CB-CE2 3.99Å; L320-Y518 HydrophobicContact CD2-CD2 4.25Å; L320-Y518 HydrophobicContact CD2-CE2 3.59Å; L320-Y518 HydrophobicContact CG-CE2 4.22Å
321	E	77.6	Confident	69.7	Low	68 Å²	68	68.5 Å²	68.5	32%	0.318	41%	0.414	S	S	.	.	H	α-helix	trans	-57.3	-31.4	173	-68.4	-172.1	122.7	0	0	112.7	M317 A318 L323 R339 Y518	M317-E321 WeakPolarHBondContact O-CG 3.34Å; M317-E321 PolarHBondContact O-N 2.74Å; A318-E321 WeakPolarHBondContact O-CB 3.37Å; A318-E321 PolarHBondContact O-N 3.43Å; E321-L323 PolarHBondContact O-N 2.81Å; E321-R339 IonicContact OE2-NH1 2.7Å; E321-R339 PolarHBondContact OE2-NH1 3.03Å; E321-R339 VanDerWaalsContact OE2-NH1 3.14Å; E321-Y518 HydrophobicContact CG-CD2 3.95Å; E321-Y518 HydrophobicContact CG-CG 4.48Å
322	S	75.2	Confident	67.5	Low	88 Å²	88	71.1 Å²	71.1	62%	0.615	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-14.6	178.7	84	0	0	0	0	114.3	A318 N319 L320	A318-S322 PolarHBondContact O-N 3.1Å; N319-S322 WeakPolarHBondContact O-CB 3.5Å; N319-S322 PolarHBondContact O-N 3.2Å; N319-S322 PolarHBondContact O-OG 3.46Å; L320-S322 PolarHBondContact O-N 3.37Å
323	L	73.3	Confident	65	Low	65 Å²	65	76.9 Å²	76.9	34%	0.34	44%	0.437	S	S	.	.	S	Bend	trans	-77.9	134.2	178.5	-60.7	-168.1	0	0	0	111.4	F99 L320 E321 V325 Q517	F99-L323 HydrophobicContact CB-CD1 3.82Å; L320-L323 HydrophobicContact CD1-CD1 4.04Å; L320-L323 WeakPolarHBondContact O-CB 3.48Å; L320-L323 PolarHBondContact O-N 3.11Å; L320-L323 VanDerWaalsContact O-N 3.11Å; E321-L323 PolarHBondContact O-N 2.81Å; L323-V325 PolarHBondContact O-N 3.24Å; L323-Q517 HydrophobicContact CB-CG 4.38Å; L323-Q517 WeakPolarHBondContact O-CG 3.33Å; L323-Q517 PolarHBondContact O-NE2 3.27Å
324	P	65.6	Low	62.8	Low	94 Å²	94	81 Å²	81	61%	0.61	46%	0.458	S	S	*	.			trans	-61	134.7	-176.7	25.6	-34.8	0	0	0	112	S326 Q517	P324-S326 PolarHBondContact O-N 3.3Å; P324-Q517 PolarHBondContact O-NE2 3.02Å
325	V	62.6	Low	60.4	Low	25 Å²	25	85.3 Å²	85.3	15%	0.152	48%	0.476	C	S	.	.	S	Bend	trans	-64.4	-17.9	-178.1	169.3	0	0	0	0	113.1	L323 H487 Q514	L323-V325 PolarHBondContact O-N 3.24Å; V325-H487 WeakPolarHBondContact CG1-ND1 3.45Å; V325-Q514 HydrophobicContact CG1-CB 4.32Å; V325-Q514 HydrophobicContact CG1-CG 3.96Å
326	S	56.3	Low	57.9	Low	41 Å²	41	89.6 Å²	89.6	29%	0.287	49%	0.49	S	S	.	.	S	Bend	trans	-146.5	151.3	171.1	67.6	0	0	0	0	112.3	P324	P324-S326 PolarHBondContact O-N 3.3Å
327	K	46.5	Very low	55.6	Low	210 Å²	210	94.7 Å²	94.7	91%	0.913	52%	0.517	S	S	*	.	S	Bend	trans	-94.3	115.5	170.1	-68.3	-176.3	179	179.5	0	109.2
328	G	42.6	Very low	53	Low	85 Å²	85	102.4 Å²	102.4	88%	0.876	55%	0.549	S	S	*	.	S	Bend	trans	100.7	7.1	167	0	0	0	0	0	117.5
329	G	40.5	Very low	50.9	Low	48 Å²	48	109.4 Å²	109.4	50%	0.495	57%	0.57	S	S	.	*			trans	-78.6	149.9	165.3	0	0	0	0	0	111.9
330	P	36.2	Very low	48.2	Very low	126 Å²	126	111.6 Å²	111.6	82%	0.818	59%	0.589	S	S	*	*			trans	-60.6	147.9	168.8	27.7	-34.3	0	0	0	110.5	F332	P330-F332 PolarHBondContact O-N 3.24Å
331	E	35.3	Very low	45.7	Very low	157 Å²	157	120.6 Å²	120.6	73%	0.734	63%	0.631	S	S	*	*			trans	-54.1	98.7	-169.5	-65.8	-171.3	150.7	0	0	113.5	K333	E331-K333 VanDerWaalsContact C-N 3.3Å; E331-K333 HydrophobicContact CB-CG 4.36Å; E331-K333 PolarHBondContact O-N 3.42Å; E331-K333 WeakPolarHBondContact OE2-CE 3.49Å; E331-K333 IonicContact OE2-NZ 3.16Å; E331-K333 PolarHBondContact OE2-NZ 3.33Å
332	F	41	Very low	43.3	Very low	126 Å²	126	123.9 Å²	123.9	55%	0.553	65%	0.651	S	S	*	*			trans	-71.9	92.3	165.2	-150.1	-89.3	0	0	0	107.7	P330 L334	P330-F332 PolarHBondContact O-N 3.24Å; F332-L334 PolarHBondContact O-N 3.12Å
333	K	34.4	Very low	41.1	Very low	163 Å²	163	126.2 Å²	126.2	71%	0.709	67%	0.667	S	S	*	*			trans	-70	76.3	177.2	-72.6	-178.9	-179.2	170.6	0	110.3	E331 Q335	E331-K333 VanDerWaalsContact C-N 3.3Å; E331-K333 HydrophobicContact CB-CG 4.36Å; E331-K333 PolarHBondContact O-N 3.42Å; E331-K333 WeakPolarHBondContact OE2-CE 3.49Å; E331-K333 IonicContact OE2-NZ 3.16Å; E331-K333 PolarHBondContact OE2-NZ 3.33Å; K333-Q335 PolarHBondContact O-N 3.42Å
334	L	40.6	Very low	38.9	Very low	88 Å²	88	127.4 Å²	127.4	46%	0.461	69%	0.686	S	S	.	*			trans	-43.6	107.8	151	-110.5	160.1	0	0	0	106.5	F332 K336	F332-L334 PolarHBondContact O-N 3.12Å; L334-K336 PolarHBondContact O-N 3.12Å
335	Q	36	Very low	37.2	Very low	179 Å²	179	131.9 Å²	131.9	84%	0.836	70%	0.696	S	S	*	*			trans	-57.8	117.9	175.7	-75	-171.7	-9.4	0	0	106.3	K333 L337	K333-Q335 PolarHBondContact O-N 3.42Å; Q335-L337 PolarHBondContact O-N 3.45Å
336	K	34.2	Very low	36.1	Very low	193 Å²	193	136.6 Å²	136.6	84%	0.839	72%	0.72	S	S	*	*			trans	-38	115.5	-171.1	-76.1	-175.8	172.1	-174.2	0	110.2	L334 K338	L334-K336 PolarHBondContact O-N 3.12Å; K336-K338 PolarHBondContact O-N 3.43Å
337	L	36.7	Very low	34.6	Very low	115 Å²	115	142.3 Å²	142.3	60%	0.602	75%	0.747	S	S	*	*			trans	-53.1	108.5	161.2	-119.4	81.9	0	0	0	105.5	Q335 R339 I354	Q335-L337 PolarHBondContact O-N 3.45Å; L337-R339 PolarHBondContact O-N 2.85Å; L337-I354 HydrophobicContact CD2-CG2 4.39Å
338	K	29.8	Very low	34.3	Very low	198 Å²	198	139.6 Å²	139.6	86%	0.861	74%	0.741	S	S	*	*			trans	-76.8	69.2	-175.9	-80	-172.2	173.7	-178	0	109.5	K336 S340	K336-K338 PolarHBondContact O-N 3.43Å; K338-S340 VanDerWaalsContact C-N 3.28Å; K338-S340 PolarHBondContact O-N 3.04Å
339	R	38.8	Very low	33.9	Very low	175 Å²	175	138.9 Å²	138.9	66%	0.66	73%	0.733	S	S	*	*			trans	-55.8	103	148.9	-95.4	-177.5	167.1	141.2	-1.3	105.6	E321 L337 Q341	E321-R339 IonicContact OE2-NH1 2.7Å; E321-R339 PolarHBondContact OE2-NH1 3.03Å; E321-R339 VanDerWaalsContact OE2-NH1 3.14Å; L337-R339 PolarHBondContact O-N 2.85Å; R339-Q341 PolarHBondContact O-N 3.15Å; R339-Q341 VanDerWaalsContact O-N 3.12Å
340	S	25.4	Very low	33.3	Very low	95 Å²	95	143.3 Å²	143.3	66%	0.664	75%	0.746	S	S	*	*			trans	-68.3	108.1	-179.5	-169.6	0	0	0	0	108.3	K338 N342	K338-S340 VanDerWaalsContact C-N 3.28Å; K338-S340 PolarHBondContact O-N 3.04Å; S340-N342 PolarHBondContact O-N 3.21Å
341	Q	31.7	Very low	33.2	Very low	193 Å²	193	146.9 Å²	146.9	90%	0.902	75%	0.752	S	S	*	*			trans	-72.8	83.7	168.9	-74.6	-175.3	-56.8	0	0	109.1	R339	R339-Q341 PolarHBondContact O-N 3.15Å; R339-Q341 VanDerWaalsContact O-N 3.12Å
342	N	25.8	Very low	33	Very low	138 Å²	138	145.2 Å²	145.2	74%	0.738	75%	0.748	S	S	*	*			trans	-124.8	111.8	160.4	-90	-9.8	0	0	0	107.8	S340 A344	S340-N342 PolarHBondContact O-N 3.21Å; N342-A344 PolarHBondContact O-N 3.48Å
343	S	30.6	Very low	33	Very low	136 Å²	136	146 Å²	146	95%	0.951	75%	0.753	S	S	*	*			trans	-74.7	88.2	172.2	51.4	0	0	0	0	109.6
344	A	27	Very low	33.7	Very low	90 Å²	90	144 Å²	144	74%	0.744	75%	0.749	S	S	*	*			trans	-136.6	128.2	172.9	0	0	0	0	0	110.7	N342	N342-A344 PolarHBondContact O-N 3.48Å
345	F	30.2	Very low	34.6	Very low	189 Å²	189	147 Å²	147	83%	0.829	76%	0.76	S	S	*	*			trans	-67.5	142.9	-178.8	177.1	-112.6	0	0	0	112.2
346	L	38.5	Very low	36.2	Very low	124 Å²	124	139.8 Å²	139.8	65%	0.649	73%	0.728	S	S	*	*			trans	59.4	105.1	173.2	-63.1	174.2	0	0	0	118.3
347	D	24.2	Very low	38.1	Very low	161 Å²	161	132.7 Å²	132.7	86%	0.861	70%	0.702	S	S	*	*				-144.5	149.7	114.2	-155.9	-7.9	0	0	0	109.6
348	I	41.4	Very low	40	Very low	153 Å²	153	131.1 Å²	131.1	79%	0.785	69%	0.691	S	S	*	*			trans	-128.1	91.3	-177.2	-58.1	178.2	0	0	0	108.9
349	G	33.6	Very low	42.1	Very low	69 Å²	69	125.5 Å²	125.5	71%	0.711	68%	0.676	S	S	*	*			trans	158.5	77.1	170.4	0	0	0	0	0	116.3
350	D	29.1	Very low	43.7	Very low	142 Å²	142	119.8 Å²	119.8	76%	0.759	66%	0.659	S	S	*	*				-168.2	122.7	126.4	-126.3	5	0	0	0	112.1	N352	D350-N352 VanDerWaalsContact C-N 3.26Å; D350-N352 PolarHBondContact O-N 3.34Å; D350-N352 PolarHBondContact OD2-ND2 3.42Å
351	E	33.1	Very low	46.2	Very low	200 Å²	200	115.3 Å²	115.3	94%	0.935	63%	0.628	S	S	*	*			trans	-80.9	70.9	170	-74.5	-165	160.6	0	0	110.9	E353	E351-E353 PolarHBondContact O-N 2.95Å
352	N	31.4	Very low	48.6	Very low	122 Å²	122	108 Å²	108	65%	0.652	60%	0.596	S	S	*	*			trans	-85.6	96.8	163.6	-78	-77.7	0	0	0	109.4	D350 I354	D350-N352 VanDerWaalsContact C-N 3.26Å; D350-N352 PolarHBondContact O-N 3.34Å; D350-N352 PolarHBondContact OD2-ND2 3.42Å; N352-I354 PolarHBondContact O-N 2.94Å
353	E	41.5	Very low	51.3	Low	142 Å²	142	101.7 Å²	101.7	66%	0.664	56%	0.562	S	S	*	*			trans	-44.6	132.9	165.9	-75.1	-174.1	137.2	0	0	109.8	E351 Q355	E351-E353 PolarHBondContact O-N 2.95Å; E353-Q355 HydrophobicContact CB-CG 4.3Å; E353-Q355 PolarHBondContact O-N 3.49Å
354	I	48.9	Very low	53.9	Low	123 Å²	123	98.1 Å²	98.1	63%	0.631	54%	0.537	S	S	*	.			trans	-73.4	83.9	175.8	-56.6	178.3	0	0	0	108.3	L337 N352 L356	L337-I354 HydrophobicContact CD2-CG2 4.39Å; N352-I354 PolarHBondContact O-N 2.94Å; I354-L356 PolarHBondContact O-N 2.66Å; I354-L356 VanDerWaalsContact O-N 3.11Å
355	Q	59.1	Low	56.8	Low	149 Å²	149	94 Å²	94	70%	0.696	50%	0.502	S	S	*	.			trans	-70.4	108.6	-178.1	-68.3	-170.7	1.8	0	0	110.5	E353 S357	E353-Q355 HydrophobicContact CB-CG 4.3Å; E353-Q355 PolarHBondContact O-N 3.49Å; Q355-S357 PolarHBondContact O-N 3.04Å
356	L	68.8	Low	59.6	Low	29 Å²	29	88.5 Å²	88.5	15%	0.152	48%	0.484	C	S	.	.			trans	-44.8	125.9	172.8	-77.2	-179.8	0	0	0	111.5	I354 D360 V515 T519 A521 Q537	I354-L356 PolarHBondContact O-N 2.66Å; I354-L356 VanDerWaalsContact O-N 3.11Å; L356-D360 HydrophobicContact CD2-CB 4.17Å; L356-V515 HydrophobicContact CD1-CG2 3.97Å; L356-V515 HydrophobicContact CD2-CB 4.45Å; L356-V515 HydrophobicContact CD2-CG1 3.93Å; L356-V515 HydrophobicContact CD2-CG2 4.44Å; L356-T519 HydrophobicContact CD1-CG2 3.67Å; L356-T519 HydrophobicContact CD2-CG2 4.46Å; L356-T519 HydrophobicContact CG-CG2 4.18Å; L356-A521 HydrophobicContact CD1-CB 4.27Å; L356-Q537 HydrophobicContact CD1-CG 4.18Å; L356-Q537 VanDerWaalsContact N-NE2 3.16Å
357	S	74.1	Confident	62	Low	43 Å²	43	82.7 Å²	82.7	30%	0.301	45%	0.454	S	S	.	.			trans	-76.7	161.7	175.8	78.6	0	0	0	0	111	Q355 S359 D360	Q355-S357 PolarHBondContact O-N 3.04Å; S357-S359 PolarHBondContact O-N 3.38Å; S357-S359 PolarHBondContact OG-N 3.37Å; S357-S359 PolarHBondContact OG-OG 3.21Å; S357-D360 WeakPolarHBondContact CA-OD2 3.41Å; S357-D360 VanDerWaalsContact CB-OD2 3.25Å; S357-D360 WeakPolarHBondContact CB-OD2 3.43Å; S357-D360 PolarHBondContact N-OD2 3.11Å; S357-D360 PolarHBondContact O-N 3.43Å; S357-D360 PolarHBondContact OG-N 2.98Å; S357-D360 PolarHBondContact OG-OD1 3.47Å; S357-D360 PolarHBondContact OG-OD2 3.12Å
358	K	76.9	Confident	65.1	Low	82 Å²	82	76.7 Å²	76.7	36%	0.357	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-66.3	-22	175.4	-68	-170.4	168.6	-149.8	0	113.4	V361 E531 P532 Q533 L535	K358-V361 WeakPolarHBondContact O-CG2 3.47Å; K358-E531 HydrophobicContact CB-CB 4.5Å; K358-E531 HydrophobicContact CB-CG 4.31Å; K358-P532 PolarHBondContact NZ-O 2.89Å; K358-Q533 PolarHBondContact NZ-O 2.78Å; K358-L535 HydrophobicContact CG-CD2 4.04Å
359	S	74.2	Confident	67.4	Low	80 Å²	80	69.4 Å²	69.4	56%	0.559	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-70.3	-33.9	173.8	15.1	0	0	0	0	113.1	S357 V361 V362	S357-S359 PolarHBondContact O-N 3.38Å; S357-S359 PolarHBondContact OG-N 3.37Å; S357-S359 PolarHBondContact OG-OG 3.21Å; S359-V361 PolarHBondContact O-N 3.08Å; S359-V361 VanDerWaalsContact O-N 3.11Å; S359-V362 PolarHBondContact O-N 2.99Å
360	D	72.9	Confident	70.1	Confident	56 Å²	56	67.5 Å²	67.5	30%	0.299	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-71.9	-7	-174.6	-54.3	-42.9	0	0	0	113.6	L356 S357 V515	L356-D360 HydrophobicContact CD2-CB 4.17Å; S357-D360 WeakPolarHBondContact CA-OD2 3.41Å; S357-D360 VanDerWaalsContact CB-OD2 3.25Å; S357-D360 WeakPolarHBondContact CB-OD2 3.43Å; S357-D360 PolarHBondContact N-OD2 3.11Å; S357-D360 PolarHBondContact O-N 3.43Å; S357-D360 PolarHBondContact OG-N 2.98Å; S357-D360 PolarHBondContact OG-OD1 3.47Å; S357-D360 PolarHBondContact OG-OD2 3.12Å; D360-V515 HydrophobicContact CB-CG1 4.31Å
361	V	77.4	Confident	73	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.006	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-121.3	15	-178	-70.7	0	0	0	0	112.9	K358 S359 L363 V513 V515 A521 Y525 P532 L535	K358-V361 WeakPolarHBondContact O-CG2 3.47Å; S359-V361 PolarHBondContact O-N 3.08Å; S359-V361 VanDerWaalsContact O-N 3.11Å; V361-L363 PolarHBondContact O-N 2.66Å; V361-V513 HydrophobicContact CB-CG1 4.35Å; V361-V513 HydrophobicContact CG1-CB 4.39Å; V361-V513 HydrophobicContact CG1-CG1 4.15Å; V361-V515 HydrophobicContact CG1-CG2 3.64Å; V361-A521 HydrophobicContact CG1-CB 3.99Å; V361-Y525 PolarHBondContact O-OH 2.95Å; V361-P532 HydrophobicContact CG2-CG 3.66Å; V361-L535 HydrophobicContact CG2-CD2 4.37Å
362	V	81.6	Confident	75.7	Confident	38 Å²	38	55 Å²	55	23%	0.23	30%	0.296	C	S	.	.			trans	-72.5	123.5	170.5	177.6	0	0	0	0	109.6	S359 T418	S359-V362 PolarHBondContact O-N 2.99Å; V362-T418 HydrophobicContact CG1-CG2 4.15Å
363	L	83.6	Confident	78.5	Confident	6 Å²	6	50.8 Å²	50.8	3%	0.031	27%	0.272	C	S	.	.			trans	-95.6	157.3	177.5	-66.4	171.8	0	0	0	110.6	V361 F365 T418 P485 H487 M488 V511 V513	V361-L363 PolarHBondContact O-N 2.66Å; L363-F365 HydrophobicContact CB-CD2 4.31Å; L363-F365 HydrophobicContact CB-CE2 3.47Å; L363-F365 VanDerWaalsContact CB-CE2 3.47Å; L363-F365 HydrophobicContact CB-CZ 3.7Å; L363-F365 HydrophobicContact CD1-CE2 4.34Å; L363-F365 HydrophobicContact CD1-CZ 3.74Å; L363-F365 HydrophobicContact CG-CZ 4.39Å; L363-T418 CarbonylContact O-C 3.6Å; L363-T418 WeakPolarHBondContact O-CA 3.4Å; L363-T418 WeakPolarHBondContact O-CB 3.32Å; L363-P485 HydrophobicContact CD2-CB 4.47Å; L363-H487 HydrophobicContact CD2-CB 3.85Å; L363-M488 HydrophobicContact CD1-CB 4Å; L363-M488 HydrophobicContact CD1-CG 4.18Å; L363-M488 HydrophobicContact CD1-SD 3.84Å; L363-M488 HydrophobicContact CD2-CB 4.3Å; L363-V511 HydrophobicContact CD1-CG1 3.96Å; L363-V513 HydrophobicContact CD1-CG2 4.21Å; L363-V513 HydrophobicContact CD2-CG1 4.22Å
364	S	84.9	Confident	80.8	Confident	61 Å²	61	44.6 Å²	44.6	43%	0.427	24%	0.244	S	C	.	.			trans	-125	133.1	171.4	-175.5	0	0	0	0	109.9	T417 P485	S364-T417 WeakPolarHBondContact CA-O 3.17Å; S364-P485 WeakPolarHBondContact O-CG 3.11Å
365	F	87.7	Confident	82.6	Confident	3 Å²	3	42.3 Å²	42.3	1%	0.013	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	139.2	-171.5	-56.5	-99.3	0	0	0	110.9	L363 L367 T416 T417 P420 M482 P485 M488	L363-F365 HydrophobicContact CB-CD2 4.31Å; L363-F365 HydrophobicContact CB-CE2 3.47Å; L363-F365 VanDerWaalsContact CB-CE2 3.47Å; L363-F365 HydrophobicContact CB-CZ 3.7Å; L363-F365 HydrophobicContact CD1-CE2 4.34Å; L363-F365 HydrophobicContact CD1-CZ 3.74Å; L363-F365 HydrophobicContact CG-CZ 4.39Å; F365-L367 HydrophobicContact CB-CD1 4.22Å; F365-T416 WeakPolarHBondContact O-CA 3.44Å; F365-T417 HydrophobicContact CB-CG2 3.87Å; F365-T417 HydrophobicContact CD2-CG2 4.37Å; F365-T417 HydrophobicContact CG-CG2 4.49Å; F365-T417 PolarHBondContact N-O 3.32Å; F365-T417 PolarHBondContact O-N 3.42Å; F365-P420 HydrophobicContact CE2-CB 4.09Å; F365-P420 HydrophobicContact CE2-CG 3.87Å; F365-P420 HydrophobicContact CZ-CB 3.76Å; F365-P420 HydrophobicContact CZ-CG 3.89Å; F365-M482 HydrophobicContact CB-CE 4.04Å; F365-M482 HydrophobicContact CD1-CE 3.32Å; F365-M482 HydrophobicContact CD1-CG 4.31Å; F365-M482 HydrophobicContact CD2-CE 4.07Å; F365-M482 HydrophobicContact CE1-CE 3.63Å; F365-M482 HydrophobicContact CE2-CE 4.36Å; F365-M482 HydrophobicContact CG-CE 3.57Å; F365-M482 HydrophobicContact CZ-CE 4.16Å; F365-P485 VanDerWaalsContact CD1-CD 3.49Å; F365-P485 HydrophobicContact CD1-CG 3.44Å; F365-P485 VanDerWaalsContact CD1-CG 3.44Å; F365-P485 HydrophobicContact CD2-CG 4.49Å; F365-P485 VanDerWaalsContact CE1-CD 3.44Å; F365-P485 HydrophobicContact CE1-CG 3.55Å; F365-P485 HydrophobicContact CG-CG 3.95Å; F365-P485 HydrophobicContact CZ-CG 4.11Å; F365-M488 HydrophobicContact CE1-CE 4.29Å; F365-M488 HydrophobicContact CE1-SD 3.46Å; F365-M488 WeakPolarHBondContact CE1-SD 3.44Å; F365-M488 HydrophobicContact CZ-SD 3.81Å
366	T	87.9	Confident	83.7	Confident	74 Å²	74	37 Å²	37	45%	0.454	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	138.9	162.9	44	0	0	0	0	110.2	T416 D483	T366-T416 HydrophobicContact CG2-CG2 4.36Å; T366-D483 PolarHBondContact O-N 3.18Å; T366-D483 PolarHBondContact OG1-OD2 3.46Å
367	L	89.1	Confident	84.4	Confident	2 Å²	2	37 Å²	37	1%	0.01	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	126.5	169.7	-78.5	86.9	0	0	0	110.5	F365 D414 F415 T417 P422 V424 P450 V480 R481 M482	F365-L367 HydrophobicContact CB-CD1 4.22Å; L367-D414 CarbonylContact O-C 3.33Å; L367-D414 WeakPolarHBondContact O-CA 3.42Å; L367-F415 HydrophobicContact CB-CB 4.46Å; L367-F415 PolarHBondContact N-O 2.9Å; L367-F415 PolarHBondContact O-N 2.81Å; L367-T417 HydrophobicContact CD1-CG2 3.34Å; L367-P422 HydrophobicContact CD1-CG 4.3Å; L367-P422 HydrophobicContact CD2-CG 3.9Å; L367-V424 HydrophobicContact CD2-CG2 3.97Å; L367-P450 HydrophobicContact CD2-CB 4.45Å; L367-P450 HydrophobicContact CD2-CG 3.59Å; L367-V480 HydrophobicContact CD2-CG1 4.19Å; L367-R481 CarbonylContact C-O 3.58Å; L367-R481 VanDerWaalsContact CA-O 3.25Å; L367-R481 WeakPolarHBondContact CA-O 3.16Å; L367-M482 HydrophobicContact CD1-CG 3.97Å; L367-M482 HydrophobicContact CD1-SD 4.41Å; L367-M482 HydrophobicContact CD2-CB 4.37Å; L367-M482 HydrophobicContact CD2-CG 4.44Å; L367-M482 HydrophobicContact CD2-SD 4.5Å; L367-M482 HydrophobicContact CG-CB 3.97Å; L367-M482 HydrophobicContact CG-CG 3.96Å
368	E	89.5	Confident	84.6	Confident	36 Å²	36	42.6 Å²	42.6	17%	0.168	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	119.9	170.3	177.2	-157.7	157.3	0	0	107.6	V370 Q412 R481	E368-V370 HydrophobicContact CG-CG2 4.06Å; E368-V370 VanDerWaalsContact OE1-CG2 3.3Å; E368-V370 WeakPolarHBondContact OE1-CG2 3.5Å; E368-Q412 HydrophobicContact CG-CG 3.84Å; E368-R481 HydrophobicContact CB-CB 4.27Å; E368-R481 PolarHBondContact N-O 3.25Å; E368-R481 PolarHBondContact O-N 3.39Å; E368-R481 IonicContact OE1-CZ 2.82Å; E368-R481 IonicContact OE1-NH1 3.07Å; E368-R481 PolarHBondContact OE1-NH1 3.33Å; E368-R481 WeakPolarHBondContact OE2-CD 3.43Å; E368-R481 IonicContact OE2-CZ 2.76Å; E368-R481 IonicContact OE2-NE 3.38Å; E368-R481 IonicContact OE2-NH1 2.7Å; E368-R481 PolarHBondContact OE2-NH1 3.27Å
369	I	90.3	Very high	84.5	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	119	175.1	-59.3	166.4	0	0	0	108.5	M390 V392 Q412 G413 F415 V424 A479 V480	I369-M390 HydrophobicContact CB-SD 3.84Å; I369-M390 HydrophobicContact CG2-CG 3.99Å; I369-M390 HydrophobicContact CG2-SD 3.55Å; I369-M390 VanDerWaalsContact CG2-SD 3.55Å; I369-V392 HydrophobicContact CD1-CG2 3.61Å; I369-Q412 CarbonylContact O-C 3.58Å; I369-Q412 WeakPolarHBondContact O-CA 3.39Å; I369-G413 PolarHBondContact N-O 3.5Å; I369-G413 PolarHBondContact O-N 2.93Å; I369-F415 HydrophobicContact CD1-CD2 3.83Å; I369-F415 HydrophobicContact CD1-CE2 3.75Å; I369-F415 HydrophobicContact CG1-CD2 4.45Å; I369-V424 HydrophobicContact CD1-CB 4.36Å; I369-V424 HydrophobicContact CD1-CG1 3.48Å; I369-V424 VanDerWaalsContact CD1-CG1 3.48Å; I369-V424 HydrophobicContact CD1-CG2 3.93Å; I369-V424 HydrophobicContact CG1-CG1 4.4Å; I369-A479 WeakPolarHBondContact CA-O 3.13Å; I369-V480 HydrophobicContact CG1-CG1 4.09Å; I369-V480 HydrophobicContact CG1-CG2 4.3Å; I369-V480 HydrophobicContact CG2-CG2 4.44Å
370	V	89.9	Confident	84.7	Confident	29 Å²	29	37.7 Å²	37.7	18%	0.176	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	115.3	177.9	-176.2	0	0	0	0	109.3	E368 Q412 L478 A479	E368-V370 HydrophobicContact CG-CG2 4.06Å; E368-V370 VanDerWaalsContact OE1-CG2 3.3Å; E368-V370 WeakPolarHBondContact OE1-CG2 3.5Å; V370-Q412 HydrophobicContact CG2-CB 4.12Å; V370-Q412 HydrophobicContact CG2-CG 4.07Å; V370-L478 CarbonylContact O-C 3.59Å; V370-L478 WeakPolarHBondContact O-CA 3.45Å; V370-L478 VanDerWaalsContact O-CB 3.31Å; V370-L478 WeakPolarHBondContact O-CB 3.29Å; V370-A479 PolarHBondContact N-O 3.07Å; V370-A479 PolarHBondContact O-N 2.88Å
371	I	90.3	Very high	84.9	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	125.6	175.2	-64.4	176.2	0	0	0	108.6	C388 M390 T399 W409 T411 V426 I476 L478	I371-C388 HydrophobicContact CD1-CB 3.6Å; I371-M390 HydrophobicContact CD1-CG 3.51Å; I371-M390 HydrophobicContact CD1-SD 3.91Å; I371-M390 HydrophobicContact CG1-CG 4.27Å; I371-M390 HydrophobicContact CG1-SD 4.15Å; I371-T399 HydrophobicContact CB-CG2 4.27Å; I371-T399 HydrophobicContact CD1-CG2 3.81Å; I371-W409 HydrophobicContact CG2-CB 4.43Å; I371-W409 HydrophobicContact CG2-CD2 4.34Å; I371-W409 HydrophobicContact CG2-CE3 3.8Å; I371-W409 HydrophobicContact CG2-CZ3 4.48Å; I371-W409 CarbonylContact O-C 3.53Å; I371-W409 WeakPolarHBondContact O-CB 3.26Å; I371-T411 PolarHBondContact N-O 3.39Å; I371-V426 HydrophobicContact CD1-CG1 3.47Å; I371-V426 VanDerWaalsContact CD1-CG1 3.47Å; I371-V426 HydrophobicContact CD1-CG2 4.33Å; I371-V426 HydrophobicContact CG1-CG1 4.37Å; I371-I476 HydrophobicContact CG2-CD1 4.11Å; I371-I476 HydrophobicContact CG2-CG1 4.45Å; I371-L478 HydrophobicContact CG1-CB 4.27Å
372	M	89.6	Confident	84.9	Confident	78 Å²	78	41.4 Å²	41.4	38%	0.384	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	-50.8	-176.9	-58	-163.3	82.9	0	0	113.3	Q408 W409 A458 K477	M372-Q408 CarbonylContact O-C 3.54Å; M372-Q408 WeakPolarHBondContact O-CA 3.39Å; M372-W409 WeakPolarHBondContact CA-O 3.36Å; M372-W409 PolarHBondContact O-N 2.8Å; M372-W409 VanDerWaalsContact O-O 3.09Å; M372-A458 HydrophobicContact CG-CB 4.23Å; M372-A458 HydrophobicContact SD-CB 3.34Å; M372-A458 WeakPolarHBondContact SD-CB 3.36Å; M372-K477 HydrophobicContact CB-CB 4.36Å; M372-K477 HydrophobicContact CB-CD 4.29Å; M372-K477 HydrophobicContact CB-CG 4.24Å; M372-K477 WeakPolarHBondContact CB-O 3.37Å; M372-K477 PolarHBondContact N-O 3.15Å; M372-K477 HydrophobicContact SD-CD 4.15Å; M372-K477 HydrophobicContact SD-CG 4.32Å
373	E	90.6	Very high	84.8	Confident	35 Å²	35	45.9 Å²	45.9	16%	0.164	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.1	159	-175.7	56.5	179.6	-166.3	0	0	112.8	Q375 P407 Q408 I476 K477	E373-Q375 PolarHBondContact OE1-NE2 2.94Å; E373-P407 CarbonylContact C-O 3.59Å; E373-P407 VanDerWaalsContact CA-O 3.26Å; E373-P407 WeakPolarHBondContact CA-O 3.49Å; E373-Q408 HydrophobicContact CB-CB 4.39Å; E373-Q408 HydrophobicContact CB-CG 3.91Å; E373-Q408 PolarHBondContact OE2-NE2 3.35Å; E373-I476 WeakPolarHBondContact O-CA 3.27Å; E373-K477 HydrophobicContact CG-CB 3.68Å; E373-K477 HydrophobicContact CG-CD 3.96Å; E373-K477 HydrophobicContact CG-CG 4.45Å; E373-K477 PolarHBondContact N-O 3.14Å; E373-K477 PolarHBondContact O-N 3.14Å
374	V	89.9	Confident	84.9	Confident	11 Å²	11	49.9 Å²	49.9	7%	0.067	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	139.1	166.7	161.2	0	0	0	0	109.9	L377 P407 W409 L428 M463 L474 K475 I476	V374-L377 HydrophobicContact CG1-CB 4.25Å; V374-P407 HydrophobicContact CB-CB 4.24Å; V374-P407 HydrophobicContact CB-CG 4.09Å; V374-P407 HydrophobicContact CG1-CG 4.4Å; V374-P407 PolarHBondContact N-O 3.42Å; V374-P407 WeakPolarHBondContact O-CG 3.02Å; V374-W409 HydrophobicContact CB-CZ3 4.13Å; V374-W409 HydrophobicContact CG2-CH2 4.31Å; V374-W409 HydrophobicContact CG2-CZ3 3.85Å; V374-L428 HydrophobicContact CG1-CD2 4.01Å; V374-L428 HydrophobicContact CG2-CD1 4.28Å; V374-L428 HydrophobicContact CG2-CD2 4.23Å; V374-M463 HydrophobicContact CG2-SD 4.45Å; V374-L474 HydrophobicContact CG1-CD1 3.61Å; V374-L474 HydrophobicContact CG1-CG 4.38Å; V374-K475 CarbonylContact C-O 3.54Å; V374-K475 WeakPolarHBondContact CA-O 2.84Å; V374-I476 HydrophobicContact CG2-CB 3.99Å; V374-I476 HydrophobicContact CG2-CD1 4.03Å; V374-I476 HydrophobicContact CG2-CG1 3.81Å
375	Q	86.8	Confident	85	Confident	75 Å²	75	49.4 Å²	49.4	35%	0.35	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	141	178.7	-60.3	-175.5	1.2	0	0	110	E373 L460 K475	E373-Q375 PolarHBondContact OE1-NE2 2.94Å; Q375-L460 HydrophobicContact CG-CD2 4.33Å; Q375-K475 HydrophobicContact CB-CB 4.49Å; Q375-K475 PolarHBondContact N-O 3.23Å; Q375-K475 PolarHBondContact O-N 3.35Å
376	G	81.6	Confident	85.1	Confident	39 Å²	39	49.2 Å²	49.2	40%	0.402	27%	0.27	S	S	.	.			trans	87.4	10.3	174.6	0	0	0	0	0	116.5
377	L	83.3	Confident	85.2	Confident	29 Å²	29	46.7 Å²	46.7	15%	0.152	25%	0.253	C	S	.	.			trans	-68.2	126.9	173.3	-178.1	65.5	0	0	0	111.2	V374 V380 V386 A404 L428 L443 L474	V374-L377 HydrophobicContact CG1-CB 4.25Å; L377-V380 HydrophobicContact CD1-CG2 4.28Å; L377-V386 HydrophobicContact CD2-CG1 4.2Å; L377-A404 HydrophobicContact CD2-CB 3.96Å; L377-L428 HydrophobicContact CD1-CD2 4.45Å; L377-L443 HydrophobicContact CD1-CD1 3.98Å; L377-L474 HydrophobicContact CB-CD1 3.91Å; L377-L474 HydrophobicContact CD1-CD1 4.24Å
378	K	78.8	Confident	85.4	Confident	160 Å²	160	46.6 Å²	46.6	70%	0.696	25%	0.252	S	S	*	.			trans	-141.9	-21.9	-179.3	-61	178.7	-176.2	177	0	114	V380 D471	K378-V380 PolarHBondContact O-N 3.37Å; K378-V380 VanDerWaalsContact O-N 3.1Å; K378-D471 VanDerWaalsContact CA-OD1 3.31Å; K378-D471 WeakPolarHBondContact CA-OD1 3.37Å; K378-D471 WeakPolarHBondContact CB-OD1 3.3Å; K378-D471 PolarHBondContact N-OD1 3.34Å
379	S	73.8	Confident	85.4	Confident	35 Å²	35	45.8 Å²	45.8	25%	0.245	25%	0.25	C	C	.	.	S	Bend	trans	-73.3	4.9	-176.8	71.8	0	0	0	0	115.4	S469 D471	S379-S469 WeakPolarHBondContact CB-OG 3.45Å; S379-S469 PolarHBondContact OG-OG 2.75Å; S379-D471 WeakPolarHBondContact CB-OD2 3.15Å; S379-D471 PolarHBondContact N-OD1 2.79Å; S379-D471 PolarHBondContact N-OD2 3.44Å; S379-D471 PolarHBondContact OG-OD2 3.17Å
380	V	80.2	Confident	85.5	Confident	24 Å²	24	45.9 Å²	45.9	15%	0.145	25%	0.25	C	C	.	.	S	Bend	trans	-134.1	139.3	-172	177.1	0	0	0	0	109.2	L377 K378 R384 A404 T430 L443	L377-V380 HydrophobicContact CD1-CG2 4.28Å; K378-V380 PolarHBondContact O-N 3.37Å; K378-V380 VanDerWaalsContact O-N 3.1Å; V380-R384 HydrophobicContact CG1-CB 3.42Å; V380-R384 VanDerWaalsContact CG1-CB 3.42Å; V380-R384 HydrophobicContact CG1-CG 3.79Å; V380-A404 HydrophobicContact CB-CB 4.44Å; V380-A404 HydrophobicContact CG1-CB 3.83Å; V380-T430 HydrophobicContact CG2-CG2 4.23Å; V380-L443 HydrophobicContact CG2-CD1 3.85Å; V380-L443 HydrophobicContact CG2-CD2 3.64Å; V380-L443 HydrophobicContact CG2-CG 4.41Å
381	A	76.6	Confident	85.5	Confident	47 Å²	47	45.6 Å²	45.6	39%	0.388	25%	0.247	S	C	.	.			trans	-66.6	144	179.8	0	0	0	0	0	111.5	N383 R384	A381-N383 PolarHBondContact O-N 2.69Å; A381-N383 VanDerWaalsContact O-N 3.08Å; A381-R384 HydrophobicContact CB-CG 4.21Å; A381-R384 WeakPolarHBondContact O-CB 3.2Å; A381-R384 PolarHBondContact O-N 2.79Å
382	P	76.6	Confident	85.4	Confident	88 Å²	88	45.8 Å²	45.8	57%	0.571	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-31.6	-170.5	-27.5	35.3	0	0	0	115.3	R384 S405	P382-R384 VanDerWaalsContact C-N 3.31Å; P382-R384 PolarHBondContact O-N 3.42Å; P382-S405 WeakPolarHBondContact O-CB 3.48Å; P382-S405 PolarHBondContact O-N 3.27Å
383	N	81.1	Confident	84.9	Confident	132 Å²	132	45.8 Å²	45.8	71%	0.706	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	12.4	-178.4	69.9	-40.5	0	0	0	114.3	A381	A381-N383 PolarHBondContact O-N 2.69Å; A381-N383 VanDerWaalsContact O-N 3.08Å
384	R	85.7	Confident	84.2	Confident	89 Å²	89	46.8 Å²	46.8	34%	0.336	27%	0.267	S	S	.	.	S	Bend	trans	-86.7	146.5	174.9	-78.2	-85	169.4	170	-11.7	111	V380 A381 P382 A404 E431 T433	V380-R384 HydrophobicContact CG1-CB 3.42Å; V380-R384 VanDerWaalsContact CG1-CB 3.42Å; V380-R384 HydrophobicContact CG1-CG 3.79Å; A381-R384 HydrophobicContact CB-CG 4.21Å; A381-R384 WeakPolarHBondContact O-CB 3.2Å; A381-R384 PolarHBondContact O-N 2.79Å; P382-R384 VanDerWaalsContact C-N 3.31Å; P382-R384 PolarHBondContact O-N 3.42Å; R384-A404 HydrophobicContact CB-CB 4.39Å; R384-A404 WeakPolarHBondContact O-CB 3.49Å; R384-A404 PolarHBondContact O-N 2.87Å; R384-E431 PolarHBondContact NH1-O 2.92Å; R384-T433 VanDerWaalsContact CZ-OG1 3.31Å; R384-T433 PolarHBondContact NH1-OG1 3.32Å; R384-T433 PolarHBondContact NH2-OG1 3.43Å
385	I	85.8	Confident	83.9	Confident	51 Å²	51	50.9 Å²	50.9	26%	0.262	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	137.1	169.3	-69.3	170.8	0	0	0	110.2	Q401 A402 T430 E431	I385-Q401 HydrophobicContact CG2-CB 3.66Å; I385-Q401 HydrophobicContact CG2-CG 3.63Å; I385-A402 WeakPolarHBondContact CA-O 3.31Å; I385-T430 WeakPolarHBondContact O-CA 3.49Å; I385-T430 PolarHBondContact O-OG1 2.99Å; I385-E431 HydrophobicContact CB-CB 4.32Å; I385-E431 PolarHBondContact O-N 3.12Å
386	V	89.8	Confident	83.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	151.4	170.1	-67.8	0	0	0	0	110.3	L377 A402 A404 P407 W409 L428 F429 L443	L377-V386 HydrophobicContact CD2-CG1 4.2Å; V386-A402 WeakPolarHBondContact CG2-O 3.16Å; V386-A402 PolarHBondContact N-O 3.29Å; V386-A402 PolarHBondContact O-N 3.43Å; V386-A404 HydrophobicContact CG1-CB 4.16Å; V386-P407 HydrophobicContact CG2-CB 3.91Å; V386-W409 HydrophobicContact CG2-CH2 4.3Å; V386-W409 HydrophobicContact CG2-CZ2 4.15Å; V386-L428 HydrophobicContact CB-CD1 4.23Å; V386-F429 VanDerWaalsContact CA-O 3.24Å; V386-F429 WeakPolarHBondContact CA-O 3.47Å; V386-F429 WeakPolarHBondContact CB-O 3.42Å; V386-L443 HydrophobicContact CG1-CD1 4.03Å
387	Y	90.8	Very high	84.3	Confident	21 Å²	21	55 Å²	55	8%	0.082	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	160.9	175.1	63.5	-94.9	0	0	0	110.2	T389 Q398 F429 D440	Y387-T389 HydrophobicContact CD2-CG2 4.17Å; Y387-T389 HydrophobicContact CE2-CG2 3.85Å; Y387-Q398 HydrophobicContact CD2-CG 3.74Å; Y387-Q398 VanDerWaalsContact CD2-NE2 3.3Å; Y387-Q398 HydrophobicContact CE2-CG 4.19Å; Y387-Q398 HydrophobicContact CG-CG 4.4Å; Y387-F429 HydrophobicContact CD1-CB 4.45Å; Y387-F429 HydrophobicContact CD2-CB 4.22Å; Y387-F429 HydrophobicContact CD2-CD2 4.48Å; Y387-F429 HydrophobicContact CE1-CB 4.01Å; Y387-F429 HydrophobicContact CE2-CB 3.74Å; Y387-F429 AromaticContact CE2-CD2 3.87Å; Y387-F429 HydrophobicContact CE2-CD2 3.87Å; Y387-F429 HydrophobicContact CE2-CG 4.04Å; Y387-F429 PolarHBondContact N-O 3.35Å; Y387-F429 PolarHBondContact O-N 3.03Å; Y387-D440 VanDerWaalsContact CE1-OD2 3.26Å; Y387-D440 WeakPolarHBondContact CE1-OD2 3.46Å; Y387-D440 WeakPolarHBondContact OH-CB 3.25Å; Y387-D440 PolarHBondContact OH-OD2 3.06Å
388	C	91.6	Very high	84.4	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	151.1	173.2	-71.9	0	0	0	0	111.7	I371 Q398 T399 V426 K427	I371-C388 HydrophobicContact CD1-CB 3.6Å; C388-Q398 WeakPolarHBondContact O-CA 3.44Å; C388-T399 HydrophobicContact CB-CG2 3.76Å; C388-T399 PolarHBondContact N-OG1 3.15Å; C388-T399 PolarHBondContact O-N 3.23Å; C388-T399 PolarHBondContact O-OG1 3.4Å; C388-V426 HydrophobicContact CB-CG1 4.25Å; C388-K427 CarbonylContact C-O 3.59Å; C388-K427 WeakPolarHBondContact CA-O 2.93Å
389	T	90.4	Very high	84.9	Confident	19 Å²	19	51.2 Å²	51.2	12%	0.117	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	129.5	166	68.4	0	0	0	0	110.1	Y387 L397 V426 K427 F429	Y387-T389 HydrophobicContact CD2-CG2 4.17Å; Y387-T389 HydrophobicContact CE2-CG2 3.85Å; T389-L397 CarbonylContact C-O 3.53Å; T389-L397 WeakPolarHBondContact CA-O 3.42Å; T389-V426 WeakPolarHBondContact O-CA 3.47Å; T389-K427 PolarHBondContact N-O 3.46Å; T389-K427 PolarHBondContact O-N 3.39Å; T389-F429 HydrophobicContact CG2-CD2 3.97Å; T389-F429 HydrophobicContact CG2-CE2 3.85Å
390	M	91.9	Very high	85.5	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	114.9	171	-63	170.3	-76.7	0	0	108.2	I369 I371 K396 L397 T399 F415 V426	I369-M390 HydrophobicContact CB-SD 3.84Å; I369-M390 HydrophobicContact CG2-CG 3.99Å; I369-M390 HydrophobicContact CG2-SD 3.55Å; I369-M390 VanDerWaalsContact CG2-SD 3.55Å; I371-M390 HydrophobicContact CD1-CG 3.51Å; I371-M390 HydrophobicContact CD1-SD 3.91Å; I371-M390 HydrophobicContact CG1-CG 4.27Å; I371-M390 HydrophobicContact CG1-SD 4.15Å; M390-K396 WeakPolarHBondContact O-CA 2.95Å; M390-L397 HydrophobicContact CE-CB 4.06Å; M390-L397 PolarHBondContact N-O 2.93Å; M390-L397 PolarHBondContact O-N 3.49Å; M390-T399 HydrophobicContact CE-CG2 4.34Å; M390-F415 HydrophobicContact CB-CE2 3.95Å; M390-F415 HydrophobicContact CB-CZ 3.72Å; M390-V426 HydrophobicContact CG-CG2 4.16Å
391	E	90.3	Very high	85.8	Confident	24 Å²	24	59 Å²	59	11%	0.112	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	118.5	177.1	-176.1	-171.7	125.3	0	0	109.6	E395 K396 K425	E391-E395 WeakPolarHBondContact CA-O 3.34Å; E391-K396 HydrophobicContact CB-CG 4.04Å; E391-K396 HydrophobicContact CG-CD 4.49Å; E391-K396 HydrophobicContact CG-CG 3.84Å; E391-K396 WeakPolarHBondContact OE2-CE 3.29Å; E391-K396 IonicContact OE2-NZ 2.78Å; E391-K425 HydrophobicContact CB-CB 4.3Å; E391-K425 PolarHBondContact N-O 3.05Å; E391-K425 PolarHBondContact O-N 3.49Å; E391-K425 WeakPolarHBondContact OE1-CD 3.34Å; E391-K425 WeakPolarHBondContact OE1-CE 3.47Å; E391-K425 IonicContact OE1-NZ 2.81Å; E391-K425 PolarHBondContact OE1-NZ 3.3Å
392	V	88.3	Confident	86.3	Confident	4 Å²	4	57.4 Å²	57.4	2%	0.024	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	104.4	176.1	-175.9	0	0	0	0	107.6	I369 G394 E395 F415 V424	I369-V392 HydrophobicContact CD1-CG2 3.61Å; V392-G394 PolarHBondContact O-N 3.47Å; V392-E395 PolarHBondContact N-O 2.81Å; V392-E395 PolarHBondContact O-N 2.97Å; V392-F415 HydrophobicContact CB-CB 4.19Å; V392-F415 HydrophobicContact CB-CD1 3.53Å; V392-F415 HydrophobicContact CB-CD2 4.46Å; V392-F415 HydrophobicContact CB-CE1 3.9Å; V392-F415 HydrophobicContact CB-CG 3.83Å; V392-F415 HydrophobicContact CG1-CB 4.2Å; V392-F415 HydrophobicContact CG1-CD1 4.39Å; V392-F415 HydrophobicContact CG1-CG 4.38Å; V392-F415 HydrophobicContact CG2-CB 4.17Å; V392-F415 HydrophobicContact CG2-CD1 3.62Å; V392-F415 HydrophobicContact CG2-CD2 3.7Å; V392-F415 HydrophobicContact CG2-CE1 3.77Å; V392-F415 HydrophobicContact CG2-CE2 3.87Å; V392-F415 HydrophobicContact CG2-CG 3.56Å; V392-F415 HydrophobicContact CG2-CZ 3.89Å; V392-V424 HydrophobicContact CG2-CG2 4.15Å
393	E	78.6	Confident	86.8	Confident	77 Å²	77	58.5 Å²	58.5	36%	0.36	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	0.2	169.7	-46.1	-156.1	128.3	0	0	117.4	T417 H419 P422	E393-T417 WeakPolarHBondContact OE2-CB 3.49Å; E393-T417 PolarHBondContact OE2-OG1 3.08Å; E393-H419 IonicContact OE1-CE1 3.84Å; E393-H419 IonicContact OE1-CG 2.73Å; E393-H419 IonicContact OE1-ND1 3.51Å; E393-H419 PolarHBondContact OE1-ND1 2.93Å; E393-H419 IonicContact OE2-CE1 2.69Å; E393-H419 IonicContact OE2-CG 3.21Å; E393-H419 IonicContact OE2-ND1 3.37Å; E393-H419 PolarHBondContact OE2-ND1 3.43Å; E393-H419 VanDerWaalsContact OE2-ND1 3.16Å; E393-P422 HydrophobicContact CG-CB 4.42Å; E393-P422 VanDerWaalsContact OE1-CA 3.24Å; E393-P422 WeakPolarHBondContact OE1-CA 3.36Å; E393-P422 WeakPolarHBondContact OE1-CB 3.42Å
394	G	77	Confident	86.9	Confident	56 Å²	56	52.8 Å²	52.8	58%	0.577	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	143.4	-31.8	178.1	0	0	0	0	0	111.3	V392	V392-G394 PolarHBondContact O-N 3.47Å
395	E	83.9	Confident	86.6	Confident	98 Å²	98	51.7 Å²	51.7	46%	0.458	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	141.8	170.8	-170.3	166.7	-142.5	0	0	110.4	E391 V392 F415	E391-E395 WeakPolarHBondContact CA-O 3.34Å; V392-E395 PolarHBondContact N-O 2.81Å; V392-E395 PolarHBondContact O-N 2.97Å; E395-F415 HydrophobicContact CB-CD1 4.12Å; E395-F415 HydrophobicContact CB-CE1 4.21Å; E395-F415 HydrophobicContact CG-CD1 3.88Å; E395-F415 HydrophobicContact CG-CE1 3.91Å; E395-F415 WeakPolarHBondContact OE2-CD1 3.31Å
396	K	86.8	Confident	86.5	Confident	135 Å²	135	57.6 Å²	57.6	59%	0.587	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.6	125.7	-175.1	-73.7	179	178	177	0	111.1	M390 E391	M390-K396 WeakPolarHBondContact O-CA 2.95Å; E391-K396 HydrophobicContact CB-CG 4.04Å; E391-K396 HydrophobicContact CG-CD 4.49Å; E391-K396 HydrophobicContact CG-CG 3.84Å; E391-K396 WeakPolarHBondContact OE2-CE 3.29Å; E391-K396 IonicContact OE2-NZ 2.78Å
397	L	88.3	Confident	86.2	Confident	65 Å²	65	58.2 Å²	58.2	34%	0.34	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	148	168.5	-62.2	177.4	0	0	0	109.5	T389 M390 F415	T389-L397 CarbonylContact C-O 3.53Å; T389-L397 WeakPolarHBondContact CA-O 3.42Å; M390-L397 HydrophobicContact CE-CB 4.06Å; M390-L397 PolarHBondContact N-O 2.93Å; M390-L397 PolarHBondContact O-N 3.49Å; L397-F415 HydrophobicContact CB-CE1 4.49Å; L397-F415 HydrophobicContact CB-CZ 3.85Å; L397-F415 HydrophobicContact CD1-CD2 4.48Å; L397-F415 HydrophobicContact CD1-CE1 4.07Å; L397-F415 HydrophobicContact CD1-CE2 3.87Å; L397-F415 HydrophobicContact CD1-CZ 3.65Å; L397-F415 HydrophobicContact CG-CE1 3.94Å; L397-F415 HydrophobicContact CG-CE2 4.39Å; L397-F415 HydrophobicContact CG-CZ 3.68Å
398	Q	87.2	Confident	86	Confident	104 Å²	104	61.3 Å²	61.3	49%	0.486	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	141.7	-177.8	175.9	169.1	-15.1	0	0	109.5	Y387 C388	Y387-Q398 HydrophobicContact CD2-CG 3.74Å; Y387-Q398 VanDerWaalsContact CD2-NE2 3.3Å; Y387-Q398 HydrophobicContact CE2-CG 4.19Å; Y387-Q398 HydrophobicContact CG-CG 4.4Å; C388-Q398 WeakPolarHBondContact O-CA 3.44Å
399	T	88.4	Confident	85.8	Confident	5 Å²	5	62.5 Å²	62.5	3%	0.031	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-79.1	162.2	172.4	68.7	0	0	0	0	111.1	I371 C388 M390 W409	I371-T399 HydrophobicContact CB-CG2 4.27Å; I371-T399 HydrophobicContact CD1-CG2 3.81Å; C388-T399 HydrophobicContact CB-CG2 3.76Å; C388-T399 PolarHBondContact N-OG1 3.15Å; C388-T399 PolarHBondContact O-N 3.23Å; C388-T399 PolarHBondContact O-OG1 3.4Å; M390-T399 HydrophobicContact CE-CG2 4.34Å; T399-W409 HydrophobicContact CG2-CG 4.45Å; T399-W409 PolarHBondContact OG1-NE1 3.47Å
400	D	86.4	Confident	85.4	Confident	108 Å²	108	64.8 Å²	64.8	58%	0.578	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-54.2	157.2	169	-52.2	-83.4	0	0	0	112.1	W409 T411	D400-W409 VanDerWaalsContact O-CD1 3.3Å; D400-W409 PolarHBondContact O-NE1 3.28Å; D400-T411 PolarHBondContact OD2-OG1 3.42Å
401	Q	86.8	Confident	85.1	Confident	114 Å²	114	66 Å²	66	53%	0.533	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-75.3	129.2	175.1	-73.4	-174.4	-24.3	0	0	110.4	I385	I385-Q401 HydrophobicContact CG2-CB 3.66Å; I385-Q401 HydrophobicContact CG2-CG 3.63Å
402	A	86.9	Confident	84.9	Confident	14 Å²	14	69.7 Å²	69.7	12%	0.116	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	156.1	177.2	0	0	0	0	0	111.2	I385 V386 W409	I385-A402 WeakPolarHBondContact CA-O 3.31Å; V386-A402 WeakPolarHBondContact CG2-O 3.16Å; V386-A402 PolarHBondContact N-O 3.29Å; V386-A402 PolarHBondContact O-N 3.43Å; A402-W409 HydrophobicContact CB-CZ2 3.96Å
403	E	86.5	Confident	84.9	Confident	111 Å²	111	69.5 Å²	69.5	52%	0.519	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	142.6	172.4	-70.9	-171.3	-172.4	0	0	111.8	S405 R406 P407	E403-S405 VanDerWaalsContact CB-OG 3.23Å; E403-S405 WeakPolarHBondContact CB-OG 3.36Å; E403-S405 PolarHBondContact O-N 3.26Å; E403-S405 VanDerWaalsContact O-N 3.17Å; E403-S405 PolarHBondContact OE2-OG 3.22Å; E403-R406 CarbonylContact O-C 3.58Å; E403-R406 PolarHBondContact O-N 2.71Å; E403-P407 VanDerWaalsContact O-N 3.15Å
404	A	83.1	Confident	85.4	Confident	13 Å²	13	70.5 Å²	70.5	11%	0.107	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-19.3	170.7	0	0	0	0	0	113.2	L377 V380 R384 V386 R406	L377-A404 HydrophobicContact CD2-CB 3.96Å; V380-A404 HydrophobicContact CB-CB 4.44Å; V380-A404 HydrophobicContact CG1-CB 3.83Å; R384-A404 HydrophobicContact CB-CB 4.39Å; R384-A404 WeakPolarHBondContact O-CB 3.49Å; R384-A404 PolarHBondContact O-N 2.87Å; V386-A404 HydrophobicContact CG1-CB 4.16Å; A404-R406 VanDerWaalsContact C-N 3.29Å
405	S	79.9	Confident	86	Confident	66 Å²	66	68.1 Å²	68.1	46%	0.462	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-33.2	169.9	71.3	0	0	0	0	112.9	P382 E403	P382-S405 WeakPolarHBondContact O-CB 3.48Å; P382-S405 PolarHBondContact O-N 3.27Å; E403-S405 VanDerWaalsContact CB-OG 3.23Å; E403-S405 WeakPolarHBondContact CB-OG 3.36Å; E403-S405 PolarHBondContact O-N 3.26Å; E403-S405 VanDerWaalsContact O-N 3.17Å; E403-S405 PolarHBondContact OE2-OG 3.22Å
406	R	84.6	Confident	86.2	Confident	175 Å²	175	68 Å²	68	66%	0.66	36%	0.355	S	S	*	.	S	Bend	trans	-152.9	70.7	-174.3	-169.4	179.4	175.7	176	-2.4	110.6	E403 A404 Q408	E403-R406 CarbonylContact O-C 3.58Å; E403-R406 PolarHBondContact O-N 2.71Å; A404-R406 VanDerWaalsContact C-N 3.29Å; R406-Q408 VanDerWaalsContact C-N 3.29Å; R406-Q408 HydrophobicContact CG-CG 4.1Å; R406-Q408 PolarHBondContact O-N 3.13Å
407	P	83	Confident	86.2	Confident	13 Å²	13	61.9 Å²	61.9	8%	0.084	33%	0.329	C	S	.	.			trans	-77.1	79.8	-176.9	32.2	-35.9	0	0	0	110.6	E373 V374 V386 E403 W409	E373-P407 CarbonylContact C-O 3.59Å; E373-P407 VanDerWaalsContact CA-O 3.26Å; E373-P407 WeakPolarHBondContact CA-O 3.49Å; V374-P407 HydrophobicContact CB-CB 4.24Å; V374-P407 HydrophobicContact CB-CG 4.09Å; V374-P407 HydrophobicContact CG1-CG 4.4Å; V374-P407 PolarHBondContact N-O 3.42Å; V374-P407 WeakPolarHBondContact O-CG 3.02Å; V386-P407 HydrophobicContact CG2-CB 3.91Å; E403-P407 VanDerWaalsContact O-N 3.15Å; P407-W409 HydrophobicContact CB-CH2 3.64Å; P407-W409 HydrophobicContact CB-CZ2 4.37Å; P407-W409 HydrophobicContact CB-CZ3 3.95Å; P407-W409 WeakPolarHBondContact O-CZ3 3.17Å
408	Q	85.5	Confident	86.1	Confident	85 Å²	85	61.6 Å²	61.6	40%	0.397	33%	0.331	S	S	.	.	B	Isolated β-bridge	trans	-123.2	140.8	178	-57.8	-168.5	-60.5	0	0	109.7	M372 E373 R406	M372-Q408 CarbonylContact O-C 3.54Å; M372-Q408 WeakPolarHBondContact O-CA 3.39Å; E373-Q408 HydrophobicContact CB-CB 4.39Å; E373-Q408 HydrophobicContact CB-CG 3.91Å; E373-Q408 PolarHBondContact OE2-NE2 3.35Å; R406-Q408 VanDerWaalsContact C-N 3.29Å; R406-Q408 HydrophobicContact CG-CG 4.1Å; R406-Q408 PolarHBondContact O-N 3.13Å
409	W	88.6	Confident	86.1	Confident	25 Å²	25	58.2 Å²	58.2	10%	0.095	31%	0.314	C	S	.	.			trans	-135.8	161.7	-176.3	-63.5	-82.5	0	0	0	110.7	I371 M372 V374 V386 T399 D400 A402 P407 L428	I371-W409 HydrophobicContact CG2-CB 4.43Å; I371-W409 HydrophobicContact CG2-CD2 4.34Å; I371-W409 HydrophobicContact CG2-CE3 3.8Å; I371-W409 HydrophobicContact CG2-CZ3 4.48Å; I371-W409 CarbonylContact O-C 3.53Å; I371-W409 WeakPolarHBondContact O-CB 3.26Å; M372-W409 WeakPolarHBondContact CA-O 3.36Å; M372-W409 PolarHBondContact O-N 2.8Å; M372-W409 VanDerWaalsContact O-O 3.09Å; V374-W409 HydrophobicContact CB-CZ3 4.13Å; V374-W409 HydrophobicContact CG2-CH2 4.31Å; V374-W409 HydrophobicContact CG2-CZ3 3.85Å; V386-W409 HydrophobicContact CG2-CH2 4.3Å; V386-W409 HydrophobicContact CG2-CZ2 4.15Å; T399-W409 HydrophobicContact CG2-CG 4.45Å; T399-W409 PolarHBondContact OG1-NE1 3.47Å; D400-W409 VanDerWaalsContact O-CD1 3.3Å; D400-W409 PolarHBondContact O-NE1 3.28Å; A402-W409 HydrophobicContact CB-CZ2 3.96Å; P407-W409 HydrophobicContact CB-CH2 3.64Å; P407-W409 HydrophobicContact CB-CZ2 4.37Å; P407-W409 HydrophobicContact CB-CZ3 3.95Å; P407-W409 WeakPolarHBondContact O-CZ3 3.17Å; W409-L428 HydrophobicContact CH2-CD1 3.77Å; W409-L428 HydrophobicContact CZ2-CD1 4.43Å
410	G	81.6	Confident	85.9	Confident	67 Å²	67	58 Å²	58	69%	0.691	31%	0.313	S	S	*	.			trans	-123.3	9.2	166.3	0	0	0	0	0	112.8	Q412	G410-Q412 PolarHBondContact O-N 3.15Å
411	T	86	Confident	85.8	Confident	27 Å²	27	54 Å²	54	17%	0.166	29%	0.29	C	S	.	.			trans	-71.4	123.1	-169.5	-31.3	0	0	0	0	110.9	I371 D400	I371-T411 PolarHBondContact N-O 3.39Å; D400-T411 PolarHBondContact OD2-OG1 3.42Å
412	Q	86.6	Confident	85.9	Confident	101 Å²	101	48.5 Å²	48.5	47%	0.472	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	133.1	169.9	178.8	178.4	-27.9	0	0	109.1	E368 I369 V370 G410 D414	E368-Q412 HydrophobicContact CG-CG 3.84Å; I369-Q412 CarbonylContact O-C 3.58Å; I369-Q412 WeakPolarHBondContact O-CA 3.39Å; V370-Q412 HydrophobicContact CG2-CB 4.12Å; V370-Q412 HydrophobicContact CG2-CG 4.07Å; G410-Q412 PolarHBondContact O-N 3.15Å; Q412-D414 VanDerWaalsContact NE2-CG 3.33Å; Q412-D414 PolarHBondContact NE2-OD1 2.84Å; Q412-D414 PolarHBondContact NE2-OD2 3.07Å; Q412-D414 VanDerWaalsContact NE2-OD2 3.1Å
413	G	88	Confident	85.9	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	115.9	168.9	0	0	0	0	0	109.9	I369 F415	I369-G413 PolarHBondContact N-O 3.5Å; I369-G413 PolarHBondContact O-N 2.93Å; G413-F415 WeakPolarHBondContact O-CD2 3.48Å
414	D	89.2	Confident	86	Confident	99 Å²	99	42.9 Å²	42.9	53%	0.529	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	130.9	176.1	-63.2	-33	0	0	0	110	L367 Q412	L367-D414 CarbonylContact O-C 3.33Å; L367-D414 WeakPolarHBondContact O-CA 3.42Å; Q412-D414 VanDerWaalsContact NE2-CG 3.33Å; Q412-D414 PolarHBondContact NE2-OD1 2.84Å; Q412-D414 PolarHBondContact NE2-OD2 3.07Å; Q412-D414 VanDerWaalsContact NE2-OD2 3.1Å
415	F	89.9	Confident	86.4	Confident	5 Å²	5	45.5 Å²	45.5	2%	0.022	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	158	-175.8	-63.5	-94.3	0	0	0	110.7	L367 I369 M390 V392 E395 L397 G413	L367-F415 HydrophobicContact CB-CB 4.46Å; L367-F415 PolarHBondContact N-O 2.9Å; L367-F415 PolarHBondContact O-N 2.81Å; I369-F415 HydrophobicContact CD1-CD2 3.83Å; I369-F415 HydrophobicContact CD1-CE2 3.75Å; I369-F415 HydrophobicContact CG1-CD2 4.45Å; M390-F415 HydrophobicContact CB-CE2 3.95Å; M390-F415 HydrophobicContact CB-CZ 3.72Å; V392-F415 HydrophobicContact CB-CB 4.19Å; V392-F415 HydrophobicContact CB-CD1 3.53Å; V392-F415 HydrophobicContact CB-CD2 4.46Å; V392-F415 HydrophobicContact CB-CE1 3.9Å; V392-F415 HydrophobicContact CB-CG 3.83Å; V392-F415 HydrophobicContact CG1-CB 4.2Å; V392-F415 HydrophobicContact CG1-CD1 4.39Å; V392-F415 HydrophobicContact CG1-CG 4.38Å; V392-F415 HydrophobicContact CG2-CB 4.17Å; V392-F415 HydrophobicContact CG2-CD1 3.62Å; V392-F415 HydrophobicContact CG2-CD2 3.7Å; V392-F415 HydrophobicContact CG2-CE1 3.77Å; V392-F415 HydrophobicContact CG2-CE2 3.87Å; V392-F415 HydrophobicContact CG2-CG 3.56Å; V392-F415 HydrophobicContact CG2-CZ 3.89Å; E395-F415 HydrophobicContact CB-CD1 4.12Å; E395-F415 HydrophobicContact CB-CE1 4.21Å; E395-F415 HydrophobicContact CG-CD1 3.88Å; E395-F415 HydrophobicContact CG-CE1 3.91Å; E395-F415 WeakPolarHBondContact OE2-CD1 3.31Å; L397-F415 HydrophobicContact CB-CE1 4.49Å; L397-F415 HydrophobicContact CB-CZ 3.85Å; L397-F415 HydrophobicContact CD1-CD2 4.48Å; L397-F415 HydrophobicContact CD1-CE1 4.07Å; L397-F415 HydrophobicContact CD1-CE2 3.87Å; L397-F415 HydrophobicContact CD1-CZ 3.65Å; L397-F415 HydrophobicContact CG-CE1 3.94Å; L397-F415 HydrophobicContact CG-CE2 4.39Å; L397-F415 HydrophobicContact CG-CZ 3.68Å; G413-F415 WeakPolarHBondContact O-CD2 3.48Å
416	T	86.9	Confident	86.9	Confident	96 Å²	96	42.3 Å²	42.3	59%	0.589	22%	0.223	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-122.3	141.9	169.9	62	0	0	0	0	111.4	F365 T366	F365-T416 WeakPolarHBondContact O-CA 3.44Å; T366-T416 HydrophobicContact CG2-CG2 4.36Å
417	T	87.3	Confident	87.3	Confident	7 Å²	7	36.3 Å²	36.3	4%	0.043	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	154.1	178.7	177.7	0	0	0	0	111.2	S364 F365 L367 E393 H419 P422	S364-T417 WeakPolarHBondContact CA-O 3.17Å; F365-T417 HydrophobicContact CB-CG2 3.87Å; F365-T417 HydrophobicContact CD2-CG2 4.37Å; F365-T417 HydrophobicContact CG-CG2 4.49Å; F365-T417 PolarHBondContact N-O 3.32Å; F365-T417 PolarHBondContact O-N 3.42Å; L367-T417 HydrophobicContact CD1-CG2 3.34Å; E393-T417 WeakPolarHBondContact OE2-CB 3.49Å; E393-T417 PolarHBondContact OE2-OG1 3.08Å; T417-H419 PolarHBondContact OG1-N 3.34Å; T417-P422 HydrophobicContact CG2-CB 4.02Å; T417-P422 HydrophobicContact CG2-CG 4.15Å
418	T	86.1	Confident	87.6	Confident	59 Å²	59	35.7 Å²	35.7	36%	0.362	20%	0.197	S	C	.	.	S	Bend	trans	-100.2	3.4	168.9	54.5	0	0	0	0	113.5	V362 L363 S530	V362-T418 HydrophobicContact CG1-CG2 4.15Å; L363-T418 CarbonylContact O-C 3.6Å; L363-T418 WeakPolarHBondContact O-CA 3.4Å; L363-T418 WeakPolarHBondContact O-CB 3.32Å; T418-S530 WeakPolarHBondContact O-CA 3.48Å
419	H	86.1	Confident	87.8	Confident	32 Å²	32	33 Å²	33	15%	0.148	18%	0.184	C	C	.	.			trans	-95.8	121.3	-176.9	-65.4	170.5	0	0	0	111.2	E393 T417 R421 P422 S530	E393-H419 IonicContact OE1-CE1 3.84Å; E393-H419 IonicContact OE1-CG 2.73Å; E393-H419 IonicContact OE1-ND1 3.51Å; E393-H419 PolarHBondContact OE1-ND1 2.93Å; E393-H419 IonicContact OE2-CE1 2.69Å; E393-H419 IonicContact OE2-CG 3.21Å; E393-H419 IonicContact OE2-ND1 3.37Å; E393-H419 PolarHBondContact OE2-ND1 3.43Å; E393-H419 VanDerWaalsContact OE2-ND1 3.16Å; T417-H419 PolarHBondContact OG1-N 3.34Å; H419-R421 PolarHBondContact O-N 2.84Å; H419-P422 HydrophobicContact CB-CB 4.34Å; H419-P422 WeakPolarHBondContact O-CD 3.25Å; H419-S530 VanDerWaalsContact CD2-CA 3.47Å; H419-S530 WeakPolarHBondContact CD2-CA 3.31Å; H419-S530 PolarHBondContact CD2-N 3.49Å; H419-S530 PolarHBondContact NE2-N 3.2Å
420	P	84.3	Confident	87.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.183	C	C	.	.	S	Bend	trans	-66.4	-8.5	175.4	-23.3	35.2	0	0	0	115.2	F365 Y509 V511 Y525	F365-P420 HydrophobicContact CE2-CB 4.09Å; F365-P420 HydrophobicContact CE2-CG 3.87Å; F365-P420 HydrophobicContact CZ-CB 3.76Å; F365-P420 HydrophobicContact CZ-CG 3.89Å; P420-Y509 HydrophobicContact CB-CE1 4.43Å; P420-V511 HydrophobicContact CB-CG2 4.26Å; P420-Y525 HydrophobicContact CB-CG 4.37Å; P420-Y525 HydrophobicContact CG-CD1 3.72Å; P420-Y525 HydrophobicContact CG-CD2 4.22Å; P420-Y525 HydrophobicContact CG-CE1 3.82Å; P420-Y525 HydrophobicContact CG-CE2 4.3Å; P420-Y525 HydrophobicContact CG-CG 3.93Å
421	R	85.9	Confident	87.7	Confident	24 Å²	24	32.4 Å²	32.4	9%	0.091	17%	0.165	C	C	.	.	S	Bend	trans	-140.7	80	169.7	-71.6	-169.2	60.8	-139.3	-11.1	108.7	H419 T451 Y493 Y509 E527	H419-R421 PolarHBondContact O-N 2.84Å; R421-T451 HydrophobicContact CG-CG2 4.48Å; R421-Y493 PolarHBondContact NE-OH 2.95Å; R421-Y493 PolarHBondContact NH1-OH 2.82Å; R421-Y509 HydrophobicContact CG-CD1 3.83Å; R421-Y509 HydrophobicContact CG-CE1 3.91Å; R421-Y509 HydrophobicContact CG-CG 4.2Å; R421-E527 VanDerWaalsContact CZ-CG 3.44Å; R421-E527 IonicContact CZ-OE1 2.71Å; R421-E527 VanDerWaalsContact NH1-CG 3.32Å; R421-E527 IonicContact NH1-OE1 3.23Å; R421-E527 PolarHBondContact NH1-OE1 3.32Å; R421-E527 IonicContact NH2-OE1 3.9Å; R421-E527 PolarHBondContact NH2-OE1 2.91Å
422	P	87.2	Confident	87.1	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.172	C	C	.	.			trans	-75.7	173.6	-179.8	35.5	-35.3	0	0	0	110.1	L367 E393 T417 H419 P450 M482	L367-P422 HydrophobicContact CD1-CG 4.3Å; L367-P422 HydrophobicContact CD2-CG 3.9Å; E393-P422 HydrophobicContact CG-CB 4.42Å; E393-P422 VanDerWaalsContact OE1-CA 3.24Å; E393-P422 WeakPolarHBondContact OE1-CA 3.36Å; E393-P422 WeakPolarHBondContact OE1-CB 3.42Å; T417-P422 HydrophobicContact CG2-CB 4.02Å; T417-P422 HydrophobicContact CG2-CG 4.15Å; H419-P422 HydrophobicContact CB-CB 4.34Å; H419-P422 WeakPolarHBondContact O-CD 3.25Å; P422-P450 HydrophobicContact CG-CG 3.91Å; P422-M482 HydrophobicContact CG-CE 4.18Å; P422-M482 HydrophobicContact CG-SD 4.1Å
423	V	87.9	Confident	85.8	Confident	7 Å²	7	32.9 Å²	32.9	4%	0.042	18%	0.177	C	C	.	.			trans	-123.3	100.5	178.5	-174.3	0	0	0	0	110.7	K425 I447 Y449 K528	V423-K425 HydrophobicContact CG1-CG 4.35Å; V423-I447 HydrophobicContact CG1-CG2 3.59Å; V423-Y449 HydrophobicContact CB-CE1 4.42Å; V423-Y449 HydrophobicContact CG1-CE1 4.12Å; V423-Y449 HydrophobicContact CG2-CD1 3.8Å; V423-Y449 HydrophobicContact CG2-CE1 3.53Å; V423-K528 HydrophobicContact CG2-CD 4.25Å; V423-K528 HydrophobicContact CG2-CG 3.62Å
424	V	89.2	Confident	84.5	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	126.1	174	177.1	0	0	0	0	108.4	L367 I369 V392 V426 I447 L448 P450 V480	L367-V424 HydrophobicContact CD2-CG2 3.97Å; I369-V424 HydrophobicContact CD1-CB 4.36Å; I369-V424 HydrophobicContact CD1-CG1 3.48Å; I369-V424 VanDerWaalsContact CD1-CG1 3.48Å; I369-V424 HydrophobicContact CD1-CG2 3.93Å; I369-V424 HydrophobicContact CG1-CG1 4.4Å; V392-V424 HydrophobicContact CG2-CG2 4.15Å; V424-V426 HydrophobicContact CG1-CG2 4.19Å; V424-I447 CarbonylContact O-C 3.58Å; V424-I447 WeakPolarHBondContact O-CA 3.3Å; V424-L448 HydrophobicContact CB-CB 4.33Å; V424-L448 PolarHBondContact N-O 3.43Å; V424-L448 PolarHBondContact O-N 3.02Å; V424-P450 HydrophobicContact CG2-CG 3.89Å; V424-V480 HydrophobicContact CG2-CG1 4.37Å
425	K	90.9	Very high	82.9	Confident	67 Å²	67	37.5 Å²	37.5	29%	0.291	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	124	171.3	-46	170.8	-160.9	155.3	0	107.9	E391 V423 V446 I447	E391-K425 HydrophobicContact CB-CB 4.3Å; E391-K425 PolarHBondContact N-O 3.05Å; E391-K425 PolarHBondContact O-N 3.49Å; E391-K425 WeakPolarHBondContact OE1-CD 3.34Å; E391-K425 WeakPolarHBondContact OE1-CE 3.47Å; E391-K425 IonicContact OE1-NZ 2.81Å; E391-K425 PolarHBondContact OE1-NZ 3.3Å; V423-K425 HydrophobicContact CG1-CG 4.35Å; K425-V446 WeakPolarHBondContact CA-O 3.48Å; K425-I447 HydrophobicContact CG-CG1 4.29Å; K425-I447 HydrophobicContact CG-CG2 4.45Å
426	V	91.2	Very high	81.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	123.3	170.7	179	0	0	0	0	108.6	I371 C388 T389 M390 V424 R445 V446 I476 L478	I371-V426 HydrophobicContact CD1-CG1 3.47Å; I371-V426 VanDerWaalsContact CD1-CG1 3.47Å; I371-V426 HydrophobicContact CD1-CG2 4.33Å; I371-V426 HydrophobicContact CG1-CG1 4.37Å; C388-V426 HydrophobicContact CB-CG1 4.25Å; T389-V426 WeakPolarHBondContact O-CA 3.47Å; M390-V426 HydrophobicContact CG-CG2 4.16Å; V424-V426 HydrophobicContact CG1-CG2 4.19Å; V426-R445 CarbonylContact O-C 3.42Å; V426-R445 VanDerWaalsContact O-CA 3.29Å; V426-R445 WeakPolarHBondContact O-CA 3.24Å; V426-V446 HydrophobicContact CB-CG1 3.77Å; V426-V446 PolarHBondContact N-O 2.95Å; V426-V446 PolarHBondContact O-N 3.48Å; V426-I476 HydrophobicContact CG1-CD1 3.66Å; V426-L478 HydrophobicContact CB-CD2 4.25Å; V426-L478 HydrophobicContact CG1-CD2 4.41Å; V426-L478 HydrophobicContact CG2-CD2 4.04Å
427	K	91.8	Very high	80	Confident	48 Å²	48	43.4 Å²	43.4	21%	0.209	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	144.2	177.7	-60.8	-176.3	171.5	-154.6	0	109.9	C388 T389 F429 E442 R445	C388-K427 CarbonylContact C-O 3.59Å; C388-K427 WeakPolarHBondContact CA-O 2.93Å; T389-K427 PolarHBondContact N-O 3.46Å; T389-K427 PolarHBondContact O-N 3.39Å; K427-F429 HydrophobicContact CB-CD2 4.11Å; K427-F429 HydrophobicContact CB-CE2 3.52Å; K427-F429 HydrophobicContact CB-CZ 4.19Å; K427-F429 HydrophobicContact CD-CE2 3.72Å; K427-F429 HydrophobicContact CD-CZ 3.63Å; K427-F429 HydrophobicContact CG-CE2 4.31Å; K427-E442 WeakPolarHBondContact CD-OE2 3.39Å; K427-E442 WeakPolarHBondContact CE-OE2 3.48Å; K427-E442 IonicContact NZ-OE2 3.87Å; K427-E442 PolarHBondContact NZ-OE2 3.43Å; K427-R445 HydrophobicContact CG-CB 4.03Å
428	L	90	Very high	78.7	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	132.9	169.7	177.8	71.7	0	0	0	109.2	V374 L377 V386 W409 L443 G444 M463 L474	V374-L428 HydrophobicContact CG1-CD2 4.01Å; V374-L428 HydrophobicContact CG2-CD1 4.28Å; V374-L428 HydrophobicContact CG2-CD2 4.23Å; L377-L428 HydrophobicContact CD1-CD2 4.45Å; V386-L428 HydrophobicContact CB-CD1 4.23Å; W409-L428 HydrophobicContact CH2-CD1 3.77Å; W409-L428 HydrophobicContact CZ2-CD1 4.43Å; L428-L443 HydrophobicContact CB-CB 4.49Å; L428-L443 HydrophobicContact CD2-CB 4.05Å; L428-L443 HydrophobicContact CD2-CD1 3.96Å; L428-L443 HydrophobicContact CG-CB 4.18Å; L428-L443 HydrophobicContact CG-CD1 4.03Å; L428-L443 PolarHBondContact O-N 3.14Å; L428-G444 PolarHBondContact N-O 3.29Å; L428-M463 HydrophobicContact CB-CE 3.95Å; L428-M463 HydrophobicContact CB-SD 4.37Å; L428-L474 HydrophobicContact CD2-CD2 4.11Å
429	F	89	Confident	78	Confident	28 Å²	28	56.7 Å²	56.7	12%	0.123	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	161.8	178.9	-71.2	-87.6	0	0	0	111.7	V386 Y387 T389 K427 D440 K441 E442	V386-F429 VanDerWaalsContact CA-O 3.24Å; V386-F429 WeakPolarHBondContact CA-O 3.47Å; V386-F429 WeakPolarHBondContact CB-O 3.42Å; Y387-F429 HydrophobicContact CD1-CB 4.45Å; Y387-F429 HydrophobicContact CD2-CB 4.22Å; Y387-F429 HydrophobicContact CD2-CD2 4.48Å; Y387-F429 HydrophobicContact CE1-CB 4.01Å; Y387-F429 HydrophobicContact CE2-CB 3.74Å; Y387-F429 AromaticContact CE2-CD2 3.87Å; Y387-F429 HydrophobicContact CE2-CD2 3.87Å; Y387-F429 HydrophobicContact CE2-CG 4.04Å; Y387-F429 PolarHBondContact N-O 3.35Å; Y387-F429 PolarHBondContact O-N 3.03Å; T389-F429 HydrophobicContact CG2-CD2 3.97Å; T389-F429 HydrophobicContact CG2-CE2 3.85Å; K427-F429 HydrophobicContact CB-CD2 4.11Å; K427-F429 HydrophobicContact CB-CE2 3.52Å; K427-F429 HydrophobicContact CB-CZ 4.19Å; K427-F429 HydrophobicContact CD-CE2 3.72Å; K427-F429 HydrophobicContact CD-CZ 3.63Å; K427-F429 HydrophobicContact CG-CE2 4.31Å; F429-D440 HydrophobicContact CB-CB 4.36Å; F429-D440 HydrophobicContact CD1-CB 4.04Å; F429-K441 WeakPolarHBondContact CA-O 3.29Å; F429-E442 HydrophobicContact CD1-CB 4.24Å; F429-E442 HydrophobicContact CE1-CB 3.85Å; F429-E442 HydrophobicContact CZ-CB 4.42Å
430	T	87.6	Confident	77.8	Confident	10 Å²	10	57.4 Å²	57.4	6%	0.061	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	146.8	164	-171.8	0	0	0	0	110.7	V380 I385 S432 K441 L443	V380-T430 HydrophobicContact CG2-CG2 4.23Å; I385-T430 WeakPolarHBondContact O-CA 3.49Å; I385-T430 PolarHBondContact O-OG1 2.99Å; T430-S432 PolarHBondContact O-N 3.02Å; T430-K441 HydrophobicContact CG2-CB 4.12Å; T430-K441 HydrophobicContact CG2-CD 4.49Å; T430-K441 PolarHBondContact N-O 3.41Å; T430-K441 PolarHBondContact O-N 2.92Å; T430-L443 HydrophobicContact CG2-CD1 4.14Å; T430-L443 HydrophobicContact CG2-CD2 3.86Å; T430-L443 HydrophobicContact CG2-CG 4.11Å
431	E	80.9	Confident	77.8	Confident	70 Å²	70	63.2 Å²	63.2	33%	0.327	34%	0.344	S	S	.	.			trans	-68.5	124.6	-172.9	-171.5	179.9	-129.6	0	0	113.2	R384 I385 T433 D440	R384-E431 PolarHBondContact NH1-O 2.92Å; I385-E431 HydrophobicContact CB-CB 4.32Å; I385-E431 PolarHBondContact O-N 3.12Å; E431-T433 PolarHBondContact O-N 3.42Å; E431-T433 VanDerWaalsContact O-N 3.14Å; E431-D440 WeakPolarHBondContact CA-OD1 3.34Å
432	S	73.1	Confident	77.8	Confident	43 Å²	43	64.1 Å²	64.1	30%	0.301	35%	0.349	S	S	.	.			trans	-79.1	85	179.1	-80.5	0	0	0	0	111.9	T430 G434 E439 D440	T430-S432 PolarHBondContact O-N 3.02Å; S432-G434 PolarHBondContact O-N 2.83Å; S432-E439 PolarHBondContact OG-O 3.14Å; S432-D440 WeakPolarHBondContact CB-OD1 3.44Å; S432-D440 PolarHBondContact N-OD1 3.26Å
433	T	59.2	Low	77.7	Confident	95 Å²	95	64.3 Å²	64.3	58%	0.583	35%	0.35	S	S	*	.			trans	-69.8	36.6	175.8	67.4	0	0	0	0	114.7	R384 E431	R384-T433 VanDerWaalsContact CZ-OG1 3.31Å; R384-T433 PolarHBondContact NH1-OG1 3.32Å; R384-T433 PolarHBondContact NH2-OG1 3.43Å; E431-T433 PolarHBondContact O-N 3.42Å; E431-T433 VanDerWaalsContact O-N 3.14Å
434	G	60.3	Low	77.7	Confident	41 Å²	41	64 Å²	64	42%	0.423	35%	0.348	S	S	.	.			trans	-117.7	125.8	-179.9	0	0	0	0	0	110.6	S432 L436 A437	S432-G434 PolarHBondContact O-N 2.83Å; G434-L436 PolarHBondContact O-N 2.82Å; G434-A437 WeakPolarHBondContact O-CB 3.34Å; G434-A437 PolarHBondContact O-N 2.81Å
435	V	55.2	Low	77.8	Confident	155 Å²	155	69 Å²	69	94%	0.939	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-7.6	-174.7	-171.2	0	0	0	0	114
436	L	58.4	Low	77.8	Confident	173 Å²	173	66.2 Å²	66.2	91%	0.906	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.3	10.1	178	-62.9	173.4	0	0	0	113.3	G434	G434-L436 PolarHBondContact O-N 2.82Å
437	A	58	Low	77.7	Confident	52 Å²	52	69.7 Å²	69.7	43%	0.43	37%	0.374	S	S	.	.			trans	-88.4	117.4	177.8	0	0	0	0	0	110.4	G434	G434-A437 WeakPolarHBondContact O-CB 3.34Å; G434-A437 PolarHBondContact O-N 2.81Å
438	L	59.6	Low	77.5	Confident	175 Å²	175	68.6 Å²	68.6	92%	0.916	37%	0.37	S	S	*	.			trans	-87.4	-14.5	-178.4	-72.7	164.5	0	0	0	113.9
439	E	71.4	Confident	77.3	Confident	170 Å²	170	73.4 Å²	73.4	79%	0.794	39%	0.389	S	S	*	.	S	Bend	trans	-142.2	154.2	179.6	-64.9	-171.7	164.3	0	0	111.2	S432	S432-E439 PolarHBondContact OG-O 3.14Å
440	D	82.1	Confident	77.1	Confident	48 Å²	48	72.3 Å²	72.3	26%	0.257	39%	0.385	S	S	.	.			trans	-80.2	153.7	172.8	-80.8	-26.4	0	0	0	112.6	Y387 F429 E431 S432 E442	Y387-D440 VanDerWaalsContact CE1-OD2 3.26Å; Y387-D440 WeakPolarHBondContact CE1-OD2 3.46Å; Y387-D440 WeakPolarHBondContact OH-CB 3.25Å; Y387-D440 PolarHBondContact OH-OD2 3.06Å; F429-D440 HydrophobicContact CB-CB 4.36Å; F429-D440 HydrophobicContact CD1-CB 4.04Å; E431-D440 WeakPolarHBondContact CA-OD1 3.34Å; S432-D440 WeakPolarHBondContact CB-OD1 3.44Å; S432-D440 PolarHBondContact N-OD1 3.26Å; D440-E442 PolarHBondContact O-N 2.93Å
441	K	84.1	Confident	77	Confident	122 Å²	122	72.9 Å²	72.9	53%	0.53	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	111.6	-171.5	-175.7	-174.4	175.2	-167.5	0	112	F429 T430 L443	F429-K441 WeakPolarHBondContact CA-O 3.29Å; T430-K441 HydrophobicContact CG2-CB 4.12Å; T430-K441 HydrophobicContact CG2-CD 4.49Å; T430-K441 PolarHBondContact N-O 3.41Å; T430-K441 PolarHBondContact O-N 2.92Å; K441-L443 HydrophobicContact CD-CD2 4.45Å; K441-L443 PolarHBondContact O-N 2.82Å
442	E	86.7	Confident	76.9	Confident	43 Å²	43	70.4 Å²	70.4	20%	0.201	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	115	169.5	-175.8	175.9	134.7	0	0	109.8	K427 F429 D440 R445	K427-E442 WeakPolarHBondContact CD-OE2 3.39Å; K427-E442 WeakPolarHBondContact CE-OE2 3.48Å; K427-E442 IonicContact NZ-OE2 3.87Å; K427-E442 PolarHBondContact NZ-OE2 3.43Å; F429-E442 HydrophobicContact CD1-CB 4.24Å; F429-E442 HydrophobicContact CE1-CB 3.85Å; F429-E442 HydrophobicContact CZ-CB 4.42Å; D440-E442 PolarHBondContact O-N 2.93Å; E442-R445 WeakPolarHBondContact OE1-CD 3.42Å; E442-R445 IonicContact OE1-CZ 2.76Å; E442-R445 IonicContact OE1-NH1 3.42Å; E442-R445 PolarHBondContact OE1-NH1 3.43Å
443	L	85.8	Confident	77	Confident	3 Å²	3	72.8 Å²	72.8	2%	0.016	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-33	178.3	-64.7	177	0	0	0	112	L377 V380 V386 L428 T430 K441 P466	L377-L443 HydrophobicContact CD1-CD1 3.98Å; V380-L443 HydrophobicContact CG2-CD1 3.85Å; V380-L443 HydrophobicContact CG2-CD2 3.64Å; V380-L443 HydrophobicContact CG2-CG 4.41Å; V386-L443 HydrophobicContact CG1-CD1 4.03Å; L428-L443 HydrophobicContact CB-CB 4.49Å; L428-L443 HydrophobicContact CD2-CB 4.05Å; L428-L443 HydrophobicContact CD2-CD1 3.96Å; L428-L443 HydrophobicContact CG-CB 4.18Å; L428-L443 HydrophobicContact CG-CD1 4.03Å; L428-L443 PolarHBondContact O-N 3.14Å; T430-L443 HydrophobicContact CG2-CD1 4.14Å; T430-L443 HydrophobicContact CG2-CD2 3.86Å; T430-L443 HydrophobicContact CG2-CG 4.11Å; K441-L443 HydrophobicContact CD-CD2 4.45Å; K441-L443 PolarHBondContact O-N 2.82Å; L443-P466 WeakPolarHBondContact O-CD 3.5Å
444	G	87.3	Confident	77.9	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.1	163.6	177.5	0	0	0	0	0	111.9	L428 M463 V464	L428-G444 PolarHBondContact N-O 3.29Å; G444-M463 WeakPolarHBondContact O-CE 3.41Å; G444-V464 CarbonylContact C-O 3.52Å; G444-V464 VanDerWaalsContact CA-O 3.29Å; G444-V464 WeakPolarHBondContact CA-O 3.31Å
445	R	90.7	Very high	78.4	Confident	106 Å²	106	71 Å²	71	40%	0.4	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	150.4	179.9	64.2	172.9	-178.5	-117.6	8.4	113.2	V426 K427 E442 V464	V426-R445 CarbonylContact O-C 3.42Å; V426-R445 VanDerWaalsContact O-CA 3.29Å; V426-R445 WeakPolarHBondContact O-CA 3.24Å; K427-R445 HydrophobicContact CG-CB 4.03Å; E442-R445 WeakPolarHBondContact OE1-CD 3.42Å; E442-R445 IonicContact OE1-CZ 2.76Å; E442-R445 IonicContact OE1-NH1 3.42Å; E442-R445 PolarHBondContact OE1-NH1 3.43Å; R445-V464 HydrophobicContact CG-CB 4.39Å; R445-V464 PolarHBondContact N-O 3.33Å; R445-V464 PolarHBondContact O-N 2.91Å
446	V	91.3	Very high	79.4	Confident	9 Å²	9	68.7 Å²	68.7	6%	0.055	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	147.1	167.2	64.2	0	0	0	0	109.2	K425 V426 L448 H461 I476 L478	K425-V446 WeakPolarHBondContact CA-O 3.48Å; V426-V446 HydrophobicContact CB-CG1 3.77Å; V426-V446 PolarHBondContact N-O 2.95Å; V426-V446 PolarHBondContact O-N 3.48Å; V446-L448 HydrophobicContact CG2-CD2 3.68Å; V446-L448 HydrophobicContact CG2-CG 4.01Å; V446-H461 HydrophobicContact CG2-CB 3.95Å; V446-I476 HydrophobicContact CB-CG2 4.34Å; V446-I476 HydrophobicContact CG1-CG2 3.79Å; V446-L478 HydrophobicContact CG1-CD2 4.25Å
447	I	89.3	Confident	80.4	Confident	73 Å²	73	63.6 Å²	63.6	37%	0.374	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	124.6	176.3	-56.5	179.6	0	0	0	107.5	V423 V424 K425 Y449	V423-I447 HydrophobicContact CG1-CG2 3.59Å; V424-I447 CarbonylContact O-C 3.58Å; V424-I447 WeakPolarHBondContact O-CA 3.3Å; K425-I447 HydrophobicContact CG-CG1 4.29Å; K425-I447 HydrophobicContact CG-CG2 4.45Å; I447-Y449 HydrophobicContact CG2-CE2 4.1Å
448	L	87.7	Confident	81.6	Confident	25 Å²	25	62.9 Å²	62.9	13%	0.131	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	147.7	-173.4	-56	176.3	0	0	0	110.6	V424 V446 P450 H461 L478 V480	V424-L448 HydrophobicContact CB-CB 4.33Å; V424-L448 PolarHBondContact N-O 3.43Å; V424-L448 PolarHBondContact O-N 3.02Å; V446-L448 HydrophobicContact CG2-CD2 3.68Å; V446-L448 HydrophobicContact CG2-CG 4.01Å; L448-P450 WeakPolarHBondContact O-CD 3.45Å; L448-H461 WeakPolarHBondContact CD2-CD2 3.37Å; L448-L478 HydrophobicContact CD1-CD1 3.7Å; L448-L478 HydrophobicContact CD1-CD2 4.42Å; L448-V480 HydrophobicContact CD1-CG2 3.89Å
449	Y	85.5	Confident	82.9	Confident	100 Å²	100	58.8 Å²	58.8	39%	0.392	30%	0.299	S	S	.	.			trans	-123.1	73.9	-179.7	-59.5	-90.1	0	0	0	108.3	V423 I447 E527	V423-Y449 HydrophobicContact CB-CE1 4.42Å; V423-Y449 HydrophobicContact CG1-CE1 4.12Å; V423-Y449 HydrophobicContact CG2-CD1 3.8Å; V423-Y449 HydrophobicContact CG2-CE1 3.53Å; I447-Y449 HydrophobicContact CG2-CE2 4.1Å; Y449-E527 HydrophobicContact CD1-CG 4.39Å; Y449-E527 HydrophobicContact CE1-CG 4.47Å
450	P	85.9	Confident	83.7	Confident	6 Å²	6	55 Å²	55	4%	0.039	28%	0.284	C	S	.	.			trans	-65.1	161.2	-178.2	31.1	-37.5	0	0	0	111.4	L367 P422 V424 L448 V480 M482	L367-P450 HydrophobicContact CD2-CB 4.45Å; L367-P450 HydrophobicContact CD2-CG 3.59Å; P422-P450 HydrophobicContact CG-CG 3.91Å; V424-P450 HydrophobicContact CG2-CG 3.89Å; L448-P450 WeakPolarHBondContact O-CD 3.45Å; P450-V480 HydrophobicContact CB-CB 4.47Å; P450-V480 HydrophobicContact CB-CG1 3.67Å; P450-V480 HydrophobicContact CG-CG1 3.86Å; P450-M482 HydrophobicContact CB-CB 4.39Å; P450-M482 HydrophobicContact CB-SD 4.3Å; P450-M482 HydrophobicContact CG-SD 4.31Å
451	T	83.5	Confident	83.9	Confident	21 Å²	21	54.9 Å²	54.9	13%	0.129	28%	0.282	C	S	.	.			trans	-142	164.4	175	62.8	0	0	0	0	109	R421 N453 S454 Y509	R421-T451 HydrophobicContact CG-CG2 4.48Å; T451-N453 PolarHBondContact O-N 2.86Å; T451-N453 PolarHBondContact OG1-N 3.11Å; T451-S454 PolarHBondContact N-OG 2.8Å; T451-S454 VanDerWaalsContact O-CB 3.29Å; T451-S454 WeakPolarHBondContact O-CB 3.37Å; T451-S454 PolarHBondContact O-N 3.36Å; T451-S454 PolarHBondContact O-OG 3.33Å; T451-S454 PolarHBondContact OG1-N 2.98Å; T451-S454 PolarHBondContact OG1-OG 3.05Å; T451-Y509 HydrophobicContact CG2-CE2 4.13Å
452	S	79.2	Confident	84.2	Confident	19 Å²	19	56.6 Å²	56.6	13%	0.133	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-17	173.2	55	0	0	0	0	114.7	M488 S491	S452-M488 WeakPolarHBondContact OG-CE 3.48Å; S452-S491 PolarHBondContact OG-OG 2.93Å
453	N	76.9	Confident	84.2	Confident	92 Å²	92	55.1 Å²	55.1	49%	0.492	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	5.2	-178.3	-54.1	11.5	0	0	0	111.8	T451 S491	T451-N453 PolarHBondContact O-N 2.86Å; T451-N453 PolarHBondContact OG1-N 3.11Å; N453-S491 PolarHBondContact ND2-O 2.95Å
454	S	76.2	Confident	84.3	Confident	45 Å²	45	59.6 Å²	59.6	32%	0.315	31%	0.305	S	S	.	.	S	Bend	trans	-71.6	153.5	178.7	-67.6	0	0	0	0	112.2	T451 K456	T451-S454 PolarHBondContact N-OG 2.8Å; T451-S454 VanDerWaalsContact O-CB 3.29Å; T451-S454 WeakPolarHBondContact O-CB 3.37Å; T451-S454 PolarHBondContact O-N 3.36Å; T451-S454 PolarHBondContact O-OG 3.33Å; T451-S454 PolarHBondContact OG1-N 2.98Å; T451-S454 PolarHBondContact OG1-OG 3.05Å; S454-K456 PolarHBondContact O-N 3.07Å
455	S	72	Confident	84.2	Confident	54 Å²	54	61.4 Å²	61.4	38%	0.378	32%	0.316	S	S	.	.			trans	-54.7	124	176.3	178.9	0	0	0	0	111.5	S457 E459	S455-S457 PolarHBondContact O-N 3.02Å; S455-S457 PolarHBondContact OG-N 2.91Å; S455-S457 PolarHBondContact OG-OG 3.21Å; S455-E459 WeakPolarHBondContact CB-OE1 3.3Å; S455-E459 PolarHBondContact OG-OE1 3.01Å
456	K	75.3	Confident	83.6	Confident	106 Å²	106	59.3 Å²	59.3	46%	0.461	32%	0.317	S	S	.	.			trans	-82	5.2	175.4	-67.1	-155.1	168.8	-159.3	0	113.6	S454 R481 D483	S454-K456 PolarHBondContact O-N 3.07Å; K456-R481 HydrophobicContact CB-CG 3.88Å; K456-R481 HydrophobicContact CD-CG 4.17Å; K456-R481 HydrophobicContact CG-CG 3.93Å; K456-R481 PolarHBondContact O-NE 3.03Å; K456-R481 VanDerWaalsContact O-NE 3.09Å; K456-D483 IonicContact NZ-OD1 2.81Å; K456-D483 PolarHBondContact NZ-OD1 2.58Å
457	S	80.9	Confident	82.7	Confident	67 Å²	67	69 Å²	69	47%	0.469	36%	0.358	S	S	.	.	S	Bend	trans	-94.6	165.8	179.3	78.1	0	0	0	0	112.2	S455	S455-S457 PolarHBondContact O-N 3.02Å; S455-S457 PolarHBondContact OG-N 2.91Å; S455-S457 PolarHBondContact OG-OG 3.21Å
458	A	82.9	Confident	81.5	Confident	37 Å²	37	73.3 Å²	73.3	31%	0.306	38%	0.382	S	S	.	.			trans	-89.9	112.2	-178.7	0	0	0	0	0	111.9	M372 K477 L478 A479	M372-A458 HydrophobicContact CG-CB 4.23Å; M372-A458 HydrophobicContact SD-CB 3.34Å; M372-A458 WeakPolarHBondContact SD-CB 3.36Å; A458-K477 HydrophobicContact CB-CG 4.4Å; A458-L478 CarbonylContact C-O 3.56Å; A458-L478 WeakPolarHBondContact CA-O 3.26Å; A458-A479 HydrophobicContact CB-CB 4.14Å
459	E	86.4	Confident	80.6	Confident	88 Å²	88	74.1 Å²	74.1	41%	0.411	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	148.7	-171.3	-69.1	-179.8	-170.3	0	0	112.5	S455 H461 K477 L478	S455-E459 WeakPolarHBondContact CB-OE1 3.3Å; S455-E459 PolarHBondContact OG-OE1 3.01Å; E459-H461 PolarHBondContact O-N 2.87Å; E459-H461 PolarHBondContact O-ND1 3.23Å; E459-K477 WeakPolarHBondContact O-CA 3.1Å; E459-L478 PolarHBondContact N-O 2.95Å; E459-L478 PolarHBondContact O-N 2.97Å; E459-L478 VanDerWaalsContact O-N 3.15Å
460	L	87.3	Confident	79.7	Confident	92 Å²	92	76.8 Å²	76.8	48%	0.482	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	100.4	-179	-89.9	162.6	0	0	0	110.9	Q375 K475 K477	Q375-L460 HydrophobicContact CG-CD2 4.33Å; L460-K475 HydrophobicContact CD2-CB 4.16Å; L460-K477 HydrophobicContact CD2-CB 3.8Å; L460-K477 HydrophobicContact CD2-CG 4.47Å; L460-K477 HydrophobicContact CG-CB 4.13Å; L460-K477 HydrophobicContact CG-CG 4.28Å
461	H	87.8	Confident	79.3	Confident	45 Å²	45	76.7 Å²	76.7	21%	0.208	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	136.9	-179.4	-60.9	83.6	0	0	0	111.2	V446 L448 E459 K475 I476	V446-H461 HydrophobicContact CG2-CB 3.95Å; L448-H461 WeakPolarHBondContact CD2-CD2 3.37Å; E459-H461 PolarHBondContact O-N 2.87Å; E459-H461 PolarHBondContact O-ND1 3.23Å; H461-K475 CarbonylContact O-C 3.48Å; H461-K475 VanDerWaalsContact O-CA 3.26Å; H461-K475 WeakPolarHBondContact O-CA 3.37Å; H461-I476 HydrophobicContact CB-CG2 4.23Å; H461-I476 PolarHBondContact N-O 3.42Å; H461-I476 PolarHBondContact O-N 2.96Å
462	R	88.9	Confident	78.6	Confident	158 Å²	158	80.8 Å²	80.8	60%	0.596	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	130.3	176.4	-157.1	177.1	-158.9	-125.7	-4.2	110.5	S472 D473 K475	R462-S472 PolarHBondContact NH2-O 3.47Å; R462-D473 IonicContact CZ-OD1 2.7Å; R462-D473 VanDerWaalsContact CZ-OD1 3.23Å; R462-D473 IonicContact NE-OD1 3Å; R462-D473 PolarHBondContact NE-OD1 2.81Å; R462-D473 IonicContact NH2-OD1 2.85Å; R462-D473 PolarHBondContact NH2-OD1 2.95Å; R462-K475 HydrophobicContact CB-CG 4.5Å; R462-K475 HydrophobicContact CG-CG 4.34Å
463	M	88.3	Confident	78.6	Confident	12 Å²	12	83 Å²	83	6%	0.059	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-85.8	144.5	179	-56.3	-167.2	90.4	0	0	111.2	V374 L428 G444 L474 I476	V374-M463 HydrophobicContact CG2-SD 4.45Å; L428-M463 HydrophobicContact CB-CE 3.95Å; L428-M463 HydrophobicContact CB-SD 4.37Å; G444-M463 WeakPolarHBondContact O-CE 3.41Å; M463-L474 HydrophobicContact CB-CB 4.29Å; M463-L474 HydrophobicContact CB-CD2 4.07Å; M463-L474 HydrophobicContact CB-CG 4.21Å; M463-L474 HydrophobicContact CG-CD2 4.35Å; M463-L474 HydrophobicContact CG-CG 4.28Å; M463-L474 PolarHBondContact N-O 2.82Å; M463-L474 HydrophobicContact SD-CD2 3.68Å; M463-L474 HydrophobicContact SD-CG 3.89Å; M463-I476 HydrophobicContact CE-CB 4.31Å; M463-I476 HydrophobicContact CE-CD1 4.19Å; M463-I476 HydrophobicContact CE-CG2 4.13Å; M463-I476 HydrophobicContact CG-CB 4.07Å; M463-I476 HydrophobicContact CG-CG2 3.74Å; M463-I476 HydrophobicContact SD-CB 3.87Å; M463-I476 HydrophobicContact SD-CG2 4.05Å
464	V	87.1	Confident	79.1	Confident	96 Å²	96	78.6 Å²	78.6	58%	0.582	42%	0.421	S	S	*	.	B	Isolated β-bridge	trans	-83.2	117.4	167.1	-177.9	0	0	0	0	107.9	G444 R445	G444-V464 CarbonylContact C-O 3.52Å; G444-V464 VanDerWaalsContact CA-O 3.29Å; G444-V464 WeakPolarHBondContact CA-O 3.31Å; R445-V464 HydrophobicContact CG-CB 4.39Å; R445-V464 PolarHBondContact N-O 3.33Å; R445-V464 PolarHBondContact O-N 2.91Å
465	V	84.7	Confident	79.7	Confident	38 Å²	38	79.6 Å²	79.6	23%	0.23	42%	0.42	C	S	.	.			trans	-106.9	145.2	-172.7	175	0	0	0	0	110.3	D471 L474	V465-D471 HydrophobicContact CG1-CB 4.3Å; V465-L474 HydrophobicContact CG2-CB 3.69Å; V465-L474 HydrophobicContact CG2-CD2 3.8Å; V465-L474 HydrophobicContact CG2-CG 4.41Å
466	P	78.9	Confident	80.6	Confident	63 Å²	63	77 Å²	77	41%	0.409	40%	0.402	S	S	.	.			trans	-59	146.5	176.2	-25.1	35.3	0	0	0	113.4	L443 N468 S469	L443-P466 WeakPolarHBondContact O-CD 3.5Å; P466-N468 PolarHBondContact O-N 3.32Å; P466-S469 PolarHBondContact O-N 3.21Å; P466-S469 VanDerWaalsContact O-N 3.13Å
467	K	72.2	Confident	81.3	Confident	211 Å²	211	74.9 Å²	74.9	92%	0.917	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-14.1	-172.1	-67.1	-173.2	177.5	-176.8	0	116.3
468	N	63.9	Low	81.8	Confident	164 Å²	164	71.7 Å²	71.7	88%	0.877	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.9	17.7	-174.9	-60.1	13.5	0	0	0	112.8	P466	P466-N468 PolarHBondContact O-N 3.32Å
469	S	68.9	Low	82.1	Confident	42 Å²	42	70.1 Å²	70.1	29%	0.294	36%	0.357	S	S	.	.			trans	-92.9	159.6	177.1	-169.1	0	0	0	0	112.9	S379 P466 D471	S379-S469 WeakPolarHBondContact CB-OG 3.45Å; S379-S469 PolarHBondContact OG-OG 2.75Å; P466-S469 PolarHBondContact O-N 3.21Å; P466-S469 VanDerWaalsContact O-N 3.13Å; S469-D471 PolarHBondContact OG-N 3.23Å; S469-D471 PolarHBondContact OG-OD2 2.88Å
470	Q	67.4	Low	82.2	Confident	157 Å²	157	66.6 Å²	66.6	73%	0.734	34%	0.342	S	S	*	.	S	Bend	trans	-85.4	-9.1	169.6	-63	-174.8	-3.1	0	0	113	S472	Q470-S472 PolarHBondContact O-N 3.45Å; Q470-S472 VanDerWaalsContact O-N 3.08Å
471	D	76.5	Confident	82.2	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.016	34%	0.335	C	S	.	.			trans	-86.5	72	-172.5	-57	-36.1	0	0	0	112.9	K378 S379 V465 S469 D473 L474	K378-D471 VanDerWaalsContact CA-OD1 3.31Å; K378-D471 WeakPolarHBondContact CA-OD1 3.37Å; K378-D471 WeakPolarHBondContact CB-OD1 3.3Å; K378-D471 PolarHBondContact N-OD1 3.34Å; S379-D471 WeakPolarHBondContact CB-OD2 3.15Å; S379-D471 PolarHBondContact N-OD1 2.79Å; S379-D471 PolarHBondContact N-OD2 3.44Å; S379-D471 PolarHBondContact OG-OD2 3.17Å; V465-D471 HydrophobicContact CG1-CB 4.3Å; S469-D471 PolarHBondContact OG-N 3.23Å; S469-D471 PolarHBondContact OG-OD2 2.88Å; D471-D473 VanDerWaalsContact C-N 3.28Å; D471-D473 PolarHBondContact O-N 3.17Å; D471-L474 HydrophobicContact CB-CB 4.21Å
472	S	68	Low	82.3	Confident	107 Å²	107	64.5 Å²	64.5	75%	0.748	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-6.8	-174.5	60	0	0	0	0	116.1	R462 Q470	R462-S472 PolarHBondContact NH2-O 3.47Å; Q470-S472 PolarHBondContact O-N 3.45Å; Q470-S472 VanDerWaalsContact O-N 3.08Å
473	D	80.3	Confident	82.1	Confident	65 Å²	65	59.9 Å²	59.9	35%	0.348	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.3	35.7	178.7	-162.4	42	0	0	0	113.7	R462 D471 K475	R462-D473 IonicContact CZ-OD1 2.7Å; R462-D473 VanDerWaalsContact CZ-OD1 3.23Å; R462-D473 IonicContact NE-OD1 3Å; R462-D473 PolarHBondContact NE-OD1 2.81Å; R462-D473 IonicContact NH2-OD1 2.85Å; R462-D473 PolarHBondContact NH2-OD1 2.95Å; D471-D473 VanDerWaalsContact C-N 3.28Å; D471-D473 PolarHBondContact O-N 3.17Å; D473-K475 VanDerWaalsContact CG-NZ 3.33Å; D473-K475 PolarHBondContact O-N 2.9Å; D473-K475 WeakPolarHBondContact OD1-CE 3.48Å; D473-K475 IonicContact OD1-NZ 3.82Å; D473-K475 PolarHBondContact OD1-NZ 3.46Å; D473-K475 WeakPolarHBondContact OD2-CE 3.15Å; D473-K475 IonicContact OD2-NZ 3.47Å; D473-K475 PolarHBondContact OD2-NZ 3.42Å
474	L	87.1	Confident	81.9	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.005	33%	0.333	C	S	.	.			trans	-59.5	129.6	175.6	-167.4	69.3	0	0	0	111.3	V374 L377 L428 M463 V465 D471	V374-L474 HydrophobicContact CG1-CD1 3.61Å; V374-L474 HydrophobicContact CG1-CG 4.38Å; L377-L474 HydrophobicContact CB-CD1 3.91Å; L377-L474 HydrophobicContact CD1-CD1 4.24Å; L428-L474 HydrophobicContact CD2-CD2 4.11Å; M463-L474 HydrophobicContact CB-CB 4.29Å; M463-L474 HydrophobicContact CB-CD2 4.07Å; M463-L474 HydrophobicContact CB-CG 4.21Å; M463-L474 HydrophobicContact CG-CD2 4.35Å; M463-L474 HydrophobicContact CG-CG 4.28Å; M463-L474 PolarHBondContact N-O 2.82Å; M463-L474 HydrophobicContact SD-CD2 3.68Å; M463-L474 HydrophobicContact SD-CG 3.89Å; V465-L474 HydrophobicContact CG2-CB 3.69Å; V465-L474 HydrophobicContact CG2-CD2 3.8Å; V465-L474 HydrophobicContact CG2-CG 4.41Å; D471-L474 HydrophobicContact CB-CB 4.21Å
475	K	89.5	Confident	81.8	Confident	65 Å²	65	61 Å²	61	28%	0.283	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	149.2	179.7	-73	155.4	-179.7	160.1	0	110.5	V374 Q375 L460 H461 R462 D473	V374-K475 CarbonylContact C-O 3.54Å; V374-K475 WeakPolarHBondContact CA-O 2.84Å; Q375-K475 HydrophobicContact CB-CB 4.49Å; Q375-K475 PolarHBondContact N-O 3.23Å; Q375-K475 PolarHBondContact O-N 3.35Å; L460-K475 HydrophobicContact CD2-CB 4.16Å; H461-K475 CarbonylContact O-C 3.48Å; H461-K475 VanDerWaalsContact O-CA 3.26Å; H461-K475 WeakPolarHBondContact O-CA 3.37Å; R462-K475 HydrophobicContact CB-CG 4.5Å; R462-K475 HydrophobicContact CG-CG 4.34Å; D473-K475 VanDerWaalsContact CG-NZ 3.33Å; D473-K475 PolarHBondContact O-N 2.9Å; D473-K475 WeakPolarHBondContact OD1-CE 3.48Å; D473-K475 IonicContact OD1-NZ 3.82Å; D473-K475 PolarHBondContact OD1-NZ 3.46Å; D473-K475 WeakPolarHBondContact OD2-CE 3.15Å; D473-K475 IonicContact OD2-NZ 3.47Å; D473-K475 PolarHBondContact OD2-NZ 3.42Å
476	I	90.2	Very high	81.4	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	129	175.2	-172.2	167.2	0	0	0	109.5	I371 E373 V374 V426 V446 H461 M463 L478	I371-I476 HydrophobicContact CG2-CD1 4.11Å; I371-I476 HydrophobicContact CG2-CG1 4.45Å; E373-I476 WeakPolarHBondContact O-CA 3.27Å; V374-I476 HydrophobicContact CG2-CB 3.99Å; V374-I476 HydrophobicContact CG2-CD1 4.03Å; V374-I476 HydrophobicContact CG2-CG1 3.81Å; V426-I476 HydrophobicContact CG1-CD1 3.66Å; V446-I476 HydrophobicContact CB-CG2 4.34Å; V446-I476 HydrophobicContact CG1-CG2 3.79Å; H461-I476 HydrophobicContact CB-CG2 4.23Å; H461-I476 PolarHBondContact N-O 3.42Å; H461-I476 PolarHBondContact O-N 2.96Å; M463-I476 HydrophobicContact CE-CB 4.31Å; M463-I476 HydrophobicContact CE-CD1 4.19Å; M463-I476 HydrophobicContact CE-CG2 4.13Å; M463-I476 HydrophobicContact CG-CB 4.07Å; M463-I476 HydrophobicContact CG-CG2 3.74Å; M463-I476 HydrophobicContact SD-CB 3.87Å; M463-I476 HydrophobicContact SD-CG2 4.05Å; I476-L478 HydrophobicContact CD1-CD2 4.16Å; I476-L478 HydrophobicContact CG1-CD2 4.17Å; I476-L478 HydrophobicContact CG2-CD2 4.04Å
477	K	91.1	Very high	81.5	Confident	61 Å²	61	60.7 Å²	60.7	27%	0.265	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	119.2	174.1	-172.1	-178.8	179.2	-175.8	0	108.8	M372 E373 A458 E459 L460	M372-K477 HydrophobicContact CB-CB 4.36Å; M372-K477 HydrophobicContact CB-CD 4.29Å; M372-K477 HydrophobicContact CB-CG 4.24Å; M372-K477 WeakPolarHBondContact CB-O 3.37Å; M372-K477 PolarHBondContact N-O 3.15Å; M372-K477 HydrophobicContact SD-CD 4.15Å; M372-K477 HydrophobicContact SD-CG 4.32Å; E373-K477 HydrophobicContact CG-CB 3.68Å; E373-K477 HydrophobicContact CG-CD 3.96Å; E373-K477 HydrophobicContact CG-CG 4.45Å; E373-K477 PolarHBondContact N-O 3.14Å; E373-K477 PolarHBondContact O-N 3.14Å; A458-K477 HydrophobicContact CB-CG 4.4Å; E459-K477 WeakPolarHBondContact O-CA 3.1Å; L460-K477 HydrophobicContact CD2-CB 3.8Å; L460-K477 HydrophobicContact CD2-CG 4.47Å; L460-K477 HydrophobicContact CG-CB 4.13Å; L460-K477 HydrophobicContact CG-CG 4.28Å
478	L	91.1	Very high	82.2	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	156.1	179.5	64.8	84.2	0	0	0	110.8	V370 I371 V426 V446 L448 A458 E459 I476 V480	V370-L478 CarbonylContact O-C 3.59Å; V370-L478 WeakPolarHBondContact O-CA 3.45Å; V370-L478 VanDerWaalsContact O-CB 3.31Å; V370-L478 WeakPolarHBondContact O-CB 3.29Å; I371-L478 HydrophobicContact CG1-CB 4.27Å; V426-L478 HydrophobicContact CB-CD2 4.25Å; V426-L478 HydrophobicContact CG1-CD2 4.41Å; V426-L478 HydrophobicContact CG2-CD2 4.04Å; V446-L478 HydrophobicContact CG1-CD2 4.25Å; L448-L478 HydrophobicContact CD1-CD1 3.7Å; L448-L478 HydrophobicContact CD1-CD2 4.42Å; A458-L478 CarbonylContact C-O 3.56Å; A458-L478 WeakPolarHBondContact CA-O 3.26Å; E459-L478 PolarHBondContact N-O 2.95Å; E459-L478 PolarHBondContact O-N 2.97Å; E459-L478 VanDerWaalsContact O-N 3.15Å; I476-L478 HydrophobicContact CD1-CD2 4.16Å; I476-L478 HydrophobicContact CG1-CD2 4.17Å; I476-L478 HydrophobicContact CG2-CD2 4.04Å; L478-V480 HydrophobicContact CD1-CG2 3.47Å; L478-V480 VanDerWaalsContact CD1-CG2 3.47Å
479	A	89.1	Confident	83.3	Confident	5 Å²	5	44.6 Å²	44.6	4%	0.041	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	142.2	165.8	0	0	0	0	0	109.4	I369 V370 A458	I369-A479 WeakPolarHBondContact CA-O 3.13Å; V370-A479 PolarHBondContact N-O 3.07Å; V370-A479 PolarHBondContact O-N 2.88Å; A458-A479 HydrophobicContact CB-CB 4.14Å
480	V	88.7	Confident	84.3	Confident	14 Å²	14	43.6 Å²	43.6	9%	0.085	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	112.9	163.7	-175.1	0	0	0	0	107.6	L367 I369 V424 L448 P450 L478	L367-V480 HydrophobicContact CD2-CG1 4.19Å; I369-V480 HydrophobicContact CG1-CG1 4.09Å; I369-V480 HydrophobicContact CG1-CG2 4.3Å; I369-V480 HydrophobicContact CG2-CG2 4.44Å; V424-V480 HydrophobicContact CG2-CG1 4.37Å; L448-V480 HydrophobicContact CD1-CG2 3.89Å; P450-V480 HydrophobicContact CB-CB 4.47Å; P450-V480 HydrophobicContact CB-CG1 3.67Å; P450-V480 HydrophobicContact CG-CG1 3.86Å; L478-V480 HydrophobicContact CD1-CG2 3.47Å; L478-V480 VanDerWaalsContact CD1-CG2 3.47Å
481	R	87.4	Confident	85.4	Confident	87 Å²	87	36.2 Å²	36.2	33%	0.328	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	134.7	173.3	-63.7	156.5	174.9	174.3	9.5	107.7	L367 E368 K456	L367-R481 CarbonylContact C-O 3.58Å; L367-R481 VanDerWaalsContact CA-O 3.25Å; L367-R481 WeakPolarHBondContact CA-O 3.16Å; E368-R481 HydrophobicContact CB-CB 4.27Å; E368-R481 PolarHBondContact N-O 3.25Å; E368-R481 PolarHBondContact O-N 3.39Å; E368-R481 IonicContact OE1-CZ 2.82Å; E368-R481 IonicContact OE1-NH1 3.07Å; E368-R481 PolarHBondContact OE1-NH1 3.33Å; E368-R481 WeakPolarHBondContact OE2-CD 3.43Å; E368-R481 IonicContact OE2-CZ 2.76Å; E368-R481 IonicContact OE2-NE 3.38Å; E368-R481 IonicContact OE2-NH1 2.7Å; E368-R481 PolarHBondContact OE2-NH1 3.27Å; K456-R481 HydrophobicContact CB-CG 3.88Å; K456-R481 HydrophobicContact CD-CG 4.17Å; K456-R481 HydrophobicContact CG-CG 3.93Å; K456-R481 PolarHBondContact O-NE 3.03Å; K456-R481 VanDerWaalsContact O-NE 3.09Å
482	M	88.1	Confident	86.1	Confident	5 Å²	5	36.4 Å²	36.4	3%	0.025	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	114.8	176.1	179.3	174.4	177.8	0	0	106.4	F365 L367 P422 P450	F365-M482 HydrophobicContact CB-CE 4.04Å; F365-M482 HydrophobicContact CD1-CE 3.32Å; F365-M482 HydrophobicContact CD1-CG 4.31Å; F365-M482 HydrophobicContact CD2-CE 4.07Å; F365-M482 HydrophobicContact CE1-CE 3.63Å; F365-M482 HydrophobicContact CE2-CE 4.36Å; F365-M482 HydrophobicContact CG-CE 3.57Å; F365-M482 HydrophobicContact CZ-CE 4.16Å; L367-M482 HydrophobicContact CD1-CG 3.97Å; L367-M482 HydrophobicContact CD1-SD 4.41Å; L367-M482 HydrophobicContact CD2-CB 4.37Å; L367-M482 HydrophobicContact CD2-CG 4.44Å; L367-M482 HydrophobicContact CD2-SD 4.5Å; L367-M482 HydrophobicContact CG-CB 3.97Å; L367-M482 HydrophobicContact CG-CG 3.96Å; P422-M482 HydrophobicContact CG-CE 4.18Å; P422-M482 HydrophobicContact CG-SD 4.1Å; P450-M482 HydrophobicContact CB-CB 4.39Å; P450-M482 HydrophobicContact CB-SD 4.3Å; P450-M482 HydrophobicContact CG-SD 4.31Å
483	D	85.3	Confident	87.1	Confident	62 Å²	62	35.8 Å²	35.8	33%	0.332	18%	0.175	S	C	.	.			trans	-79.8	146.9	-175.9	-71.5	-48.8	0	0	0	112.1	T366 K456 P485	T366-D483 PolarHBondContact O-N 3.18Å; T366-D483 PolarHBondContact OG1-OD2 3.46Å; K456-D483 IonicContact NZ-OD1 2.81Å; K456-D483 PolarHBondContact NZ-OD1 2.58Å; D483-P485 WeakPolarHBondContact O-CD 3.32Å
484	K	85.4	Confident	87.6	Confident	110 Å²	110	32.7 Å²	32.7	48%	0.478	16%	0.158	S	C	.	.			trans	-82.7	115	-177.8	-177.2	178.9	170.8	-177.6	0	109.2	M488 K489	K484-M488 WeakPolarHBondContact CE-O 3.25Å; K484-M488 HydrophobicContact CG-CB 4.49Å; K484-M488 HydrophobicContact CG-CG 4.39Å; K484-K489 WeakPolarHBondContact CE-O 3.32Å; K484-K489 PolarHBondContact NZ-O 3.03Å
485	P	83.7	Confident	87.8	Confident	20 Å²	20	34.8 Å²	34.8	13%	0.13	17%	0.166	C	C	.	.			trans	-65.4	147.6	179.7	-20.2	34.2	0	0	0	111.1	L363 S364 F365 D483 H487 M488	L363-P485 HydrophobicContact CD2-CB 4.47Å; S364-P485 WeakPolarHBondContact O-CG 3.11Å; F365-P485 VanDerWaalsContact CD1-CD 3.49Å; F365-P485 HydrophobicContact CD1-CG 3.44Å; F365-P485 VanDerWaalsContact CD1-CG 3.44Å; F365-P485 HydrophobicContact CD2-CG 4.49Å; F365-P485 VanDerWaalsContact CE1-CD 3.44Å; F365-P485 HydrophobicContact CE1-CG 3.55Å; F365-P485 HydrophobicContact CG-CG 3.95Å; F365-P485 HydrophobicContact CZ-CG 4.11Å; D483-P485 WeakPolarHBondContact O-CD 3.32Å; P485-H487 PolarHBondContact O-N 2.62Å; P485-H487 VanDerWaalsContact O-N 3.14Å; P485-M488 HydrophobicContact CB-CB 4.37Å; P485-M488 HydrophobicContact CG-CB 4.49Å; P485-M488 VanDerWaalsContact O-CB 3.31Å; P485-M488 WeakPolarHBondContact O-CB 3.33Å; P485-M488 PolarHBondContact O-N 3.05Å
486	A	77.3	Confident	87.9	Confident	53 Å²	53	31.7 Å²	31.7	44%	0.438	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-27.4	-175	0	0	0	0	0	114.4	M488 K489	A486-M488 VanDerWaalsContact C-N 3.29Å; A486-K489 PolarHBondContact O-NZ 2.87Å
487	H	81	Confident	87.9	Confident	42 Å²	42	34.4 Å²	34.4	19%	0.194	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-18.3	174	-65.5	-90.9	0	0	0	113.3	V325 L363 P485 V513 Q514	V325-H487 WeakPolarHBondContact CG1-ND1 3.45Å; L363-H487 HydrophobicContact CD2-CB 3.85Å; P485-H487 PolarHBondContact O-N 2.62Å; P485-H487 VanDerWaalsContact O-N 3.14Å; H487-V513 CarbonylContact O-C 3.47Å; H487-V513 WeakPolarHBondContact O-CA 3.4Å; H487-Q514 PolarHBondContact ND1-O 3.49Å; H487-Q514 PolarHBondContact O-N 3.08Å
488	M	87.1	Confident	87.7	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.01	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	103.6	-177	178	168.1	173	0	0	109.8	L363 F365 S452 K484 P485 A486 S491 V511	L363-M488 HydrophobicContact CD1-CB 4Å; L363-M488 HydrophobicContact CD1-CG 4.18Å; L363-M488 HydrophobicContact CD1-SD 3.84Å; L363-M488 HydrophobicContact CD2-CB 4.3Å; F365-M488 HydrophobicContact CE1-CE 4.29Å; F365-M488 HydrophobicContact CE1-SD 3.46Å; F365-M488 WeakPolarHBondContact CE1-SD 3.44Å; F365-M488 HydrophobicContact CZ-SD 3.81Å; S452-M488 WeakPolarHBondContact OG-CE 3.48Å; K484-M488 WeakPolarHBondContact CE-O 3.25Å; K484-M488 HydrophobicContact CG-CB 4.49Å; K484-M488 HydrophobicContact CG-CG 4.39Å; P485-M488 HydrophobicContact CB-CB 4.37Å; P485-M488 HydrophobicContact CG-CB 4.49Å; P485-M488 VanDerWaalsContact O-CB 3.31Å; P485-M488 WeakPolarHBondContact O-CB 3.33Å; P485-M488 PolarHBondContact O-N 3.05Å; A486-M488 VanDerWaalsContact C-N 3.29Å; M488-S491 WeakPolarHBondContact CE-OG 3.27Å; M488-V511 HydrophobicContact CB-CG1 4.47Å; M488-V511 HydrophobicContact CE-CG1 3.91Å; M488-V511 HydrophobicContact CE-CG2 4.31Å; M488-V511 HydrophobicContact CG-CG1 3.55Å; M488-V511 HydrophobicContact SD-CG1 3.93Å
489	K	87.2	Confident	87.4	Confident	35 Å²	35	37.5 Å²	37.5	15%	0.152	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-42.6	-172.6	-58.5	-53.3	-176.4	174	0	113.1	D267 K484 A486 L512 Q514 F520	D267-K489 WeakPolarHBondContact OD1-CE 3.24Å; D267-K489 IonicContact OD1-NZ 2.7Å; D267-K489 PolarHBondContact OD1-NZ 3.15Å; D267-K489 WeakPolarHBondContact OD2-CD 3.48Å; D267-K489 WeakPolarHBondContact OD2-CE 3.18Å; D267-K489 IonicContact OD2-NZ 3.45Å; D267-K489 PolarHBondContact OD2-NZ 2.94Å; K484-K489 WeakPolarHBondContact CE-O 3.32Å; K484-K489 PolarHBondContact NZ-O 3.03Å; A486-K489 PolarHBondContact O-NZ 2.87Å; K489-L512 HydrophobicContact CB-CD2 4.05Å; K489-L512 HydrophobicContact CB-CG 4.11Å; K489-L512 PolarHBondContact N-O 3.04Å; K489-Q514 HydrophobicContact CG-CB 4.23Å; K489-F520 HydrophobicContact CG-CE1 4.19Å
490	H	89.1	Confident	87.1	Confident	22 Å²	22	43.2 Å²	43.2	10%	0.102	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	156.3	177.1	-166.4	85.8	0	0	0	110.8	V511 L512 D577 W581 A584	H490-V511 WeakPolarHBondContact O-CA 3.22Å; H490-L512 HydrophobicContact CB-CB 4.49Å; H490-L512 PolarHBondContact O-N 3.44Å; H490-D577 IonicContact NE2-OD1 3.35Å; H490-W581 HydrophobicContact CB-CZ3 4.47Å; H490-W581 AromaticContact CD2-CD2 3.36Å; H490-W581 AromaticContact CD2-CE2 3.33Å; H490-W581 AromaticContact CD2-CE3 3.63Å; H490-W581 AromaticContact CD2-CG 3.93Å; H490-W581 AromaticContact CD2-CH2 3.89Å; H490-W581 AromaticContact CD2-CZ2 3.65Å; H490-W581 AromaticContact CD2-CZ3 3.87Å; H490-W581 AromaticContact CD2-NE1 3.75Å; H490-W581 AromaticContact NE2-CD1 3.83Å; H490-W581 AromaticContact NE2-CD2 3.89Å; H490-W581 AromaticContact NE2-CE2 3.66Å; H490-W581 AromaticContact NE2-NE1 3.57Å; H490-A584 HydrophobicContact CB-CB 3.71Å
491	S	90.7	Very high	87	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.007	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	152.4	175.3	60.5	0	0	0	0	112.7	S452 N453 M488 Y509 F510	S452-S491 PolarHBondContact OG-OG 2.93Å; N453-S491 PolarHBondContact ND2-O 2.95Å; M488-S491 WeakPolarHBondContact CE-OG 3.27Å; S491-Y509 PolarHBondContact OG-OH 2.9Å; S491-F510 WeakPolarHBondContact CA-O 3.27Å; S491-F510 VanDerWaalsContact CB-O 3.28Å; S491-F510 WeakPolarHBondContact CB-O 3.47Å
492	G	89.9	Confident	87.1	Confident	8 Å²	8	40 Å²	40	8%	0.082	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.1	-169.1	-176.4	0	0	0	0	0	111.2	Y509 F510	G492-Y509 WeakPolarHBondContact O-CD2 3.36Å; G492-F510 PolarHBondContact N-O 2.93Å; G492-F510 VanDerWaalsContact N-O 3.1Å; G492-F510 PolarHBondContact O-N 2.63Å
493	Y	88.9	Confident	87.1	Confident	93 Å²	93	46.7 Å²	46.7	37%	0.365	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	112.5	174.8	-72.4	-87.7	0	0	0	111.1	R421 K507 R508 Y509	R421-Y493 PolarHBondContact NE-OH 2.95Å; R421-Y493 PolarHBondContact NH1-OH 2.82Å; Y493-K507 HydrophobicContact CD1-CG 4.37Å; Y493-R508 WeakPolarHBondContact CA-O 3.44Å; Y493-Y509 HydrophobicContact CD1-CD2 4.13Å; Y493-Y509 AromaticContact CD2-CD2 3.94Å; Y493-Y509 HydrophobicContact CD2-CD2 3.94Å; Y493-Y509 HydrophobicContact CD2-CE2 4.43Å; Y493-Y509 AromaticContact CE1-CD2 3.96Å; Y493-Y509 HydrophobicContact CE1-CD2 3.96Å; Y493-Y509 HydrophobicContact CE1-CG 4.41Å; Y493-Y509 AromaticContact CE2-CD2 3.76Å; Y493-Y509 HydrophobicContact CE2-CD2 3.76Å; Y493-Y509 HydrophobicContact CE2-CE2 4.22Å; Y493-Y509 HydrophobicContact CG-CD2 4.13Å; Y493-Y509 AromaticContact CZ-CD2 3.77Å
494	L	91	Very high	87.2	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	149.1	172.8	-63.6	172.2	0	0	0	110.9	K507 R508 F510 F559 F570 W581	L494-K507 WeakPolarHBondContact O-CA 3.29Å; L494-R508 PolarHBondContact N-O 3.01Å; L494-R508 PolarHBondContact O-N 2.77Å; L494-F510 HydrophobicContact CB-CD2 3.67Å; L494-F510 HydrophobicContact CB-CE2 3.97Å; L494-F510 HydrophobicContact CB-CG 4.48Å; L494-F510 HydrophobicContact CD1-CB 4.48Å; L494-F510 HydrophobicContact CD1-CD2 4.44Å; L494-F510 HydrophobicContact CD1-CG 4.48Å; L494-F510 HydrophobicContact CG-CD2 4.41Å; L494-F559 HydrophobicContact CD1-CZ 3.8Å; L494-F559 HydrophobicContact CD2-CE1 3.93Å; L494-F559 HydrophobicContact CD2-CZ 3.99Å; L494-F570 HydrophobicContact CB-CD1 4.39Å; L494-F570 HydrophobicContact CD1-CB 4.46Å; L494-F570 HydrophobicContact CD1-CD1 3.82Å; L494-F570 HydrophobicContact CD1-CE1 4.46Å; L494-F570 HydrophobicContact CD1-CG 4.39Å; L494-W581 HydrophobicContact CD1-CD2 3.74Å; L494-W581 HydrophobicContact CD1-CE3 4.11Å; L494-W581 HydrophobicContact CD1-CG 4.19Å; L494-W581 HydrophobicContact CD1-CH2 4.21Å; L494-W581 HydrophobicContact CD1-CZ2 3.82Å; L494-W581 HydrophobicContact CD1-CZ3 4.35Å; L494-W581 HydrophobicContact CD2-CD2 4.49Å; L494-W581 HydrophobicContact CD2-CG 4.24Å; L494-W581 HydrophobicContact CG-CD2 4.33Å; L494-W581 HydrophobicContact CG-CZ2 4.01Å
495	Y	91.3	Very high	87.4	Confident	45 Å²	45	50.6 Å²	50.6	18%	0.176	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	142.9	153.3	-65.8	-104.2	0	0	0	108.4	W505 K507 G555 F570 A571	Y495-W505 HydrophobicContact CD1-CD2 4.42Å; Y495-W505 AromaticContact CD1-CE2 3.83Å; Y495-W505 HydrophobicContact CD1-CZ2 4.27Å; Y495-W505 AromaticContact CD1-NE1 3.51Å; Y495-W505 HydrophobicContact CG-CZ2 4Å; Y495-K507 HydrophobicContact CD1-CB 4.1Å; Y495-K507 HydrophobicContact CD2-CB 4.26Å; Y495-K507 HydrophobicContact CD2-CD 4.41Å; Y495-K507 HydrophobicContact CD2-CG 4.23Å; Y495-K507 HydrophobicContact CE1-CB 3.86Å; Y495-K507 HydrophobicContact CE2-CB 4.01Å; Y495-K507 HydrophobicContact CE2-CD 3.67Å; Y495-K507 HydrophobicContact CE2-CG 3.95Å; Y495-K507 HydrophobicContact CG-CB 4.28Å; Y495-G555 VanDerWaalsContact CE2-N 3.29Å; Y495-F570 CarbonylContact O-C 3.58Å; Y495-F570 VanDerWaalsContact O-CA 3.27Å; Y495-F570 WeakPolarHBondContact O-CA 3.49Å; Y495-A571 PolarHBondContact N-O 3.37Å; Y495-A571 PolarHBondContact O-N 3.34Å
496	A	91.4	Very high	87.7	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	143.4	178.4	0	0	0	0	0	111.9	W502 W505 F510 I569 F570	A496-W502 HydrophobicContact CB-CB 4.31Å; A496-W502 HydrophobicContact CB-CG 4.44Å; A496-W505 VanDerWaalsContact C-CE3 3.48Å; A496-W505 WeakPolarHBondContact O-CA 3.46Å; A496-F510 HydrophobicContact CB-CE2 3.88Å; A496-F510 HydrophobicContact CB-CZ 3.48Å; A496-F510 VanDerWaalsContact CB-CZ 3.48Å; A496-I569 CarbonylContact C-O 3.5Å; A496-I569 VanDerWaalsContact CA-O 3.3Å; A496-I569 WeakPolarHBondContact CA-O 3.03Å; A496-F570 HydrophobicContact CB-CD1 3.71Å; A496-F570 HydrophobicContact CB-CE1 3.81Å
497	L	90.3	Very high	88.2	Confident	57 Å²	57	57.6 Å²	57.6	30%	0.298	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	121.7	169.4	173.1	65.9	0	0	0	109.1	W502 W505 L552 V568 I569	L497-W502 WeakPolarHBondContact CA-O 3.26Å; L497-W505 HydrophobicContact CB-CE3 3.71Å; L497-W505 HydrophobicContact CB-CZ3 4.35Å; L497-L552 HydrophobicContact CD2-CD2 4.34Å; L497-V568 CarbonylContact O-C 3.51Å; L497-V568 WeakPolarHBondContact O-CA 3.25Å; L497-I569 PolarHBondContact N-O 3.03Å; L497-I569 PolarHBondContact O-N 3.26Å
498	G	87.3	Confident	88.8	Confident	7 Å²	7	57.2 Å²	57.2	7%	0.072	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	167.5	176.8	0	0	0	0	0	113.2	V501 W502 T567	G498-V501 CarbonylContact C-O 3.56Å; G498-V501 WeakPolarHBondContact CA-O 3.43Å; G498-V501 PolarHBondContact N-O 2.72Å; G498-W502 PolarHBondContact N-O 2.99Å; G498-T567 WeakPolarHBondContact CA-O 3.43Å
499	Q	84.6	Confident	88.9	Confident	119 Å²	119	57.4 Å²	57.4	56%	0.556	25%	0.251	S	S	*	.	S	Bend	trans	-81.1	-49.8	-176.7	-51.6	-175.3	13.5	0	0	111.9	K503 D566 T567	Q499-K503 WeakPolarHBondContact O-CE 3.48Å; Q499-K503 PolarHBondContact O-NZ 2.86Å; Q499-D566 WeakPolarHBondContact CB-OD1 3.26Å; Q499-T567 PolarHBondContact N-O 2.66Å
500	K	84.2	Confident	89.1	Confident	126 Å²	126	55.8 Å²	55.8	55%	0.548	24%	0.243	S	C	.	.	S	Bend	trans	-83.5	-45.7	176.7	-63	178.2	-154.3	157.6	0	112.1	K503 D566	K500-K503 WeakPolarHBondContact O-CE 3.42Å; K500-D566 VanDerWaalsContact CB-OD2 3.3Å; K500-D566 WeakPolarHBondContact CB-OD2 3.36Å; K500-D566 WeakPolarHBondContact CD-OD2 3.26Å; K500-D566 WeakPolarHBondContact CE-OD2 3.5Å; K500-D566 WeakPolarHBondContact CG-OD2 3.41Å; K500-D566 IonicContact NZ-OD2 2.77Å
501	V	85	Confident	89.3	Confident	33 Å²	33	54.7 Å²	54.7	20%	0.2	24%	0.238	C	C	.	.	S	Bend	trans	-115.1	157.8	-178.4	-69.9	0	0	0	0	112.2	G498 K503 M536 V568	G498-V501 CarbonylContact C-O 3.56Å; G498-V501 WeakPolarHBondContact CA-O 3.43Å; G498-V501 PolarHBondContact N-O 2.72Å; V501-K503 VanDerWaalsContact C-N 3.33Å; V501-K503 PolarHBondContact O-N 2.8Å; V501-M536 HydrophobicContact CG2-CB 4.12Å; V501-M536 HydrophobicContact CG2-CG 4.08Å; V501-M536 HydrophobicContact CG2-SD 3.64Å; V501-V568 HydrophobicContact CG2-CG2 4.29Å
502	W	91.1	Very high	89.3	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	24%	0.238	C	C	.	.			trans	53	43.5	178	-55	-56.8	0	0	0	114.6	A496 L497 G498 R504 R508 F510 M522 S524 E534 M536 V568 F570	A496-W502 HydrophobicContact CB-CB 4.31Å; A496-W502 HydrophobicContact CB-CG 4.44Å; L497-W502 WeakPolarHBondContact CA-O 3.26Å; G498-W502 PolarHBondContact N-O 2.99Å; W502-R504 PolarHBondContact O-N 3.19Å; W502-R508 VanDerWaalsContact CD1-NE 3.3Å; W502-F510 AromaticContact CD2-CE1 3.92Å; W502-F510 HydrophobicContact CD2-CE1 3.92Å; W502-F510 HydrophobicContact CD2-CZ 4.01Å; W502-F510 AromaticContact CE2-CE1 3.49Å; W502-F510 VanDerWaalsContact CE2-CE1 3.49Å; W502-F510 AromaticContact CE2-CZ 3.89Å; W502-F510 HydrophobicContact CE3-CE1 4.23Å; W502-F510 HydrophobicContact CE3-CZ 4.49Å; W502-F510 HydrophobicContact CG-CZ 4.32Å; W502-F510 AromaticContact CH2-CE1 3.85Å; W502-F510 HydrophobicContact CH2-CE1 3.85Å; W502-F510 HydrophobicContact CZ2-CD1 4.32Å; W502-F510 AromaticContact CZ2-CE1 3.5Å; W502-F510 HydrophobicContact CZ2-CE1 3.5Å; W502-F510 VanDerWaalsContact CZ2-CE1 3.5Å; W502-F510 HydrophobicContact CZ2-CZ 4.35Å; W502-F510 HydrophobicContact CZ3-CE1 4.19Å; W502-F510 AromaticContact NE1-CE1 3.89Å; W502-F510 AromaticContact NE1-CZ 3.97Å; W502-M522 HydrophobicContact CH2-CB 4.06Å; W502-M522 HydrophobicContact CH2-CG 3.68Å; W502-M522 WeakPolarHBondContact CH2-O 3.4Å; W502-M522 HydrophobicContact CZ2-CG 4.45Å; W502-M522 HydrophobicContact CZ3-CG 4.22Å; W502-S524 PolarHBondContact NE1-OG 2.85Å; W502-E534 VanDerWaalsContact CA-OE1 3.27Å; W502-E534 WeakPolarHBondContact CA-OE1 3.41Å; W502-E534 VanDerWaalsContact CD1-OE1 3.32Å; W502-E534 HydrophobicContact CZ2-CB 4.49Å; W502-E534 PolarHBondContact N-OE1 3.31Å; W502-E534 VanDerWaalsContact N-OE1 3.09Å; W502-E534 VanDerWaalsContact NE1-CB 3.34Å; W502-M536 HydrophobicContact CH2-CB 3.47Å; W502-M536 VanDerWaalsContact CH2-CB 3.47Å; W502-M536 HydrophobicContact CZ3-CB 3.68Å; W502-M536 HydrophobicContact CZ3-CE 4.27Å; W502-M536 HydrophobicContact CZ3-CG 4.37Å; W502-M536 HydrophobicContact CZ3-SD 3.8Å; W502-V568 HydrophobicContact CE3-CG1 3.97Å; W502-V568 HydrophobicContact CZ3-CG1 4.41Å; W502-F570 HydrophobicContact CE3-CZ 4.45Å; W502-F570 HydrophobicContact CZ3-CE1 4.43Å; W502-F570 HydrophobicContact CZ3-CZ 4.11Å
503	K	87.9	Confident	89.3	Confident	145 Å²	145	54.4 Å²	54.4	63%	0.63	24%	0.235	S	C	*	.			trans	-62.7	17.8	-175.8	-50	-167.6	-175.8	-159.9	0	116.8	Q499 K500 V501	Q499-K503 WeakPolarHBondContact O-CE 3.48Å; Q499-K503 PolarHBondContact O-NZ 2.86Å; K500-K503 WeakPolarHBondContact O-CE 3.42Å; V501-K503 VanDerWaalsContact C-N 3.33Å; V501-K503 PolarHBondContact O-N 2.8Å
504	R	87.4	Confident	89.2	Confident	203 Å²	203	50 Å²	50	77%	0.766	22%	0.218	S	C	*	.	S	Bend	trans	-147.8	126.1	175.5	-64.9	-172.9	-176.9	-178	1.1	109.2	W502 K506 R508	W502-R504 PolarHBondContact O-N 3.19Å; R504-K506 PolarHBondContact O-N 2.82Å; R504-K506 VanDerWaalsContact O-N 3.1Å; R504-R508 PolarHBondContact O-NH1 2.81Å; R504-R508 PolarHBondContact O-NH2 2.85Å
505	W	89.7	Confident	88.7	Confident	51 Å²	51	50.8 Å²	50.8	19%	0.193	22%	0.222	C	C	.	.			trans	-59	111.2	171.7	-170.9	-113.1	0	0	0	109.9	Y495 A496 L497 L552 Q553 G554 F558 I569 A571	Y495-W505 HydrophobicContact CD1-CD2 4.42Å; Y495-W505 AromaticContact CD1-CE2 3.83Å; Y495-W505 HydrophobicContact CD1-CZ2 4.27Å; Y495-W505 AromaticContact CD1-NE1 3.51Å; Y495-W505 HydrophobicContact CG-CZ2 4Å; A496-W505 VanDerWaalsContact C-CE3 3.48Å; A496-W505 WeakPolarHBondContact O-CA 3.46Å; L497-W505 HydrophobicContact CB-CE3 3.71Å; L497-W505 HydrophobicContact CB-CZ3 4.35Å; W505-L552 HydrophobicContact CB-CD2 4.11Å; W505-L552 HydrophobicContact CD2-CB 4.33Å; W505-L552 HydrophobicContact CD2-CD1 4.1Å; W505-L552 HydrophobicContact CD2-CD2 4Å; W505-L552 HydrophobicContact CD2-CG 4.37Å; W505-L552 HydrophobicContact CE3-CD1 4Å; W505-L552 HydrophobicContact CE3-CD2 4.46Å; W505-L552 HydrophobicContact CG-CD2 3.88Å; W505-L552 HydrophobicContact CH2-CD1 3.96Å; W505-L552 HydrophobicContact CZ2-CB 3.99Å; W505-L552 HydrophobicContact CZ2-CD1 4.08Å; W505-L552 HydrophobicContact CZ3-CD1 3.94Å; W505-Q553 PolarHBondContact NE1-O 2.82Å; W505-G554 WeakPolarHBondContact CZ2-O 3.25Å; W505-F558 HydrophobicContact CH2-CD1 4.35Å; W505-F558 AromaticContact CH2-CE1 3.73Å; W505-F558 HydrophobicContact CH2-CE1 3.73Å; W505-F558 HydrophobicContact CH2-CZ 4.49Å; W505-F558 AromaticContact CZ2-CE1 3.9Å; W505-F558 HydrophobicContact CZ2-CE1 3.9Å; W505-F558 HydrophobicContact CZ2-CZ 4.26Å; W505-I569 HydrophobicContact CZ3-CG2 4.3Å; W505-A571 HydrophobicContact CH2-CB 3.66Å; W505-A571 HydrophobicContact CZ2-CB 4.03Å
506	K	88.4	Confident	88.1	Confident	140 Å²	140	49.5 Å²	49.5	61%	0.609	22%	0.22	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-160.5	135.4	179	-175.2	179.5	177	178.1	0	109.9	R504 R508	R504-K506 PolarHBondContact O-N 2.82Å; R504-K506 VanDerWaalsContact O-N 3.1Å; K506-R508 PolarHBondContact O-N 2.83Å; K506-R508 PolarHBondContact O-NH1 2.98Å; K506-R508 VanDerWaalsContact O-NH1 3.11Å
507	K	89.7	Confident	87.3	Confident	80 Å²	80	50.1 Å²	50.1	35%	0.348	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	122.3	168.9	-161.9	169.2	-174.5	167	0	110.4	Y493 L494 Y495 D573	Y493-K507 HydrophobicContact CD1-CG 4.37Å; L494-K507 WeakPolarHBondContact O-CA 3.29Å; Y495-K507 HydrophobicContact CD1-CB 4.1Å; Y495-K507 HydrophobicContact CD2-CB 4.26Å; Y495-K507 HydrophobicContact CD2-CD 4.41Å; Y495-K507 HydrophobicContact CD2-CG 4.23Å; Y495-K507 HydrophobicContact CE1-CB 3.86Å; Y495-K507 HydrophobicContact CE2-CB 4.01Å; Y495-K507 HydrophobicContact CE2-CD 3.67Å; Y495-K507 HydrophobicContact CE2-CG 3.95Å; Y495-K507 HydrophobicContact CG-CB 4.28Å; K507-D573 IonicContact NZ-OD2 2.68Å; K507-D573 PolarHBondContact NZ-OD2 3.11Å
508	R	91.8	Very high	86.6	Confident	34 Å²	34	48.7 Å²	48.7	13%	0.128	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	160.1	176.6	-62.7	168.1	175.2	89.2	-18	108.6	Y493 L494 W502 R504 K506 F510 E534	Y493-R508 WeakPolarHBondContact CA-O 3.44Å; L494-R508 PolarHBondContact N-O 3.01Å; L494-R508 PolarHBondContact O-N 2.77Å; W502-R508 VanDerWaalsContact CD1-NE 3.3Å; R504-R508 PolarHBondContact O-NH1 2.81Å; R504-R508 PolarHBondContact O-NH2 2.85Å; K506-R508 PolarHBondContact O-N 2.83Å; K506-R508 PolarHBondContact O-NH1 2.98Å; K506-R508 VanDerWaalsContact O-NH1 3.11Å; R508-F510 HydrophobicContact CB-CD2 4.02Å; R508-F510 HydrophobicContact CB-CE2 3.64Å; R508-F510 HydrophobicContact CB-CZ 4.31Å; R508-F510 HydrophobicContact CG-CE2 4.43Å; R508-E534 IonicContact CZ-OE2 3.59Å; R508-E534 IonicContact NE-OE2 3.61Å; R508-E534 PolarHBondContact NE-OE2 3.38Å; R508-E534 VanDerWaalsContact NE-OE2 3.12Å; R508-E534 IonicContact NH2-OE1 3.15Å; R508-E534 IonicContact NH2-OE2 3.36Å; R508-E534 PolarHBondContact NH2-OE2 3.17Å
509	Y	90.3	Very high	86.3	Confident	7 Å²	7	49.3 Å²	49.3	3%	0.027	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	121.5	167.6	-168.8	-105.9	0	0	0	108.8	P420 R421 T451 S491 G492 Y493 V511 S524 Y525	P420-Y509 HydrophobicContact CB-CE1 4.43Å; R421-Y509 HydrophobicContact CG-CD1 3.83Å; R421-Y509 HydrophobicContact CG-CE1 3.91Å; R421-Y509 HydrophobicContact CG-CG 4.2Å; T451-Y509 HydrophobicContact CG2-CE2 4.13Å; S491-Y509 PolarHBondContact OG-OH 2.9Å; G492-Y509 WeakPolarHBondContact O-CD2 3.36Å; Y493-Y509 HydrophobicContact CD1-CD2 4.13Å; Y493-Y509 AromaticContact CD2-CD2 3.94Å; Y493-Y509 HydrophobicContact CD2-CD2 3.94Å; Y493-Y509 HydrophobicContact CD2-CE2 4.43Å; Y493-Y509 AromaticContact CE1-CD2 3.96Å; Y493-Y509 HydrophobicContact CE1-CD2 3.96Å; Y493-Y509 HydrophobicContact CE1-CG 4.41Å; Y493-Y509 AromaticContact CE2-CD2 3.76Å; Y493-Y509 HydrophobicContact CE2-CD2 3.76Å; Y493-Y509 HydrophobicContact CE2-CE2 4.22Å; Y493-Y509 HydrophobicContact CG-CD2 4.13Å; Y493-Y509 AromaticContact CZ-CD2 3.77Å; Y509-V511 HydrophobicContact CD1-CG2 4.07Å; Y509-V511 HydrophobicContact CE1-CG2 3.71Å; Y509-S524 WeakPolarHBondContact O-CA 3.44Å; Y509-Y525 PolarHBondContact O-N 2.83Å
510	F	92.1	Very high	86.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	145.7	-177.6	-80	-89.1	0	0	0	110.6	S491 G492 L494 A496 W502 R508 M522 C523 F570 W581	S491-F510 WeakPolarHBondContact CA-O 3.27Å; S491-F510 VanDerWaalsContact CB-O 3.28Å; S491-F510 WeakPolarHBondContact CB-O 3.47Å; G492-F510 PolarHBondContact N-O 2.93Å; G492-F510 VanDerWaalsContact N-O 3.1Å; G492-F510 PolarHBondContact O-N 2.63Å; L494-F510 HydrophobicContact CB-CD2 3.67Å; L494-F510 HydrophobicContact CB-CE2 3.97Å; L494-F510 HydrophobicContact CB-CG 4.48Å; L494-F510 HydrophobicContact CD1-CB 4.48Å; L494-F510 HydrophobicContact CD1-CD2 4.44Å; L494-F510 HydrophobicContact CD1-CG 4.48Å; L494-F510 HydrophobicContact CG-CD2 4.41Å; A496-F510 HydrophobicContact CB-CE2 3.88Å; A496-F510 HydrophobicContact CB-CZ 3.48Å; A496-F510 VanDerWaalsContact CB-CZ 3.48Å; W502-F510 AromaticContact CD2-CE1 3.92Å; W502-F510 HydrophobicContact CD2-CE1 3.92Å; W502-F510 HydrophobicContact CD2-CZ 4.01Å; W502-F510 AromaticContact CE2-CE1 3.49Å; W502-F510 VanDerWaalsContact CE2-CE1 3.49Å; W502-F510 AromaticContact CE2-CZ 3.89Å; W502-F510 HydrophobicContact CE3-CE1 4.23Å; W502-F510 HydrophobicContact CE3-CZ 4.49Å; W502-F510 HydrophobicContact CG-CZ 4.32Å; W502-F510 AromaticContact CH2-CE1 3.85Å; W502-F510 HydrophobicContact CH2-CE1 3.85Å; W502-F510 HydrophobicContact CZ2-CD1 4.32Å; W502-F510 AromaticContact CZ2-CE1 3.5Å; W502-F510 HydrophobicContact CZ2-CE1 3.5Å; W502-F510 VanDerWaalsContact CZ2-CE1 3.5Å; W502-F510 HydrophobicContact CZ2-CZ 4.35Å; W502-F510 HydrophobicContact CZ3-CE1 4.19Å; W502-F510 AromaticContact NE1-CE1 3.89Å; W502-F510 AromaticContact NE1-CZ 3.97Å; R508-F510 HydrophobicContact CB-CD2 4.02Å; R508-F510 HydrophobicContact CB-CE2 3.64Å; R508-F510 HydrophobicContact CB-CZ 4.31Å; R508-F510 HydrophobicContact CG-CE2 4.43Å; F510-M522 HydrophobicContact CB-SD 4.12Å; F510-M522 HydrophobicContact CD1-CG 3.77Å; F510-M522 HydrophobicContact CD1-SD 3.64Å; F510-M522 HydrophobicContact CE1-CG 4.08Å; F510-M522 HydrophobicContact CE1-SD 4.46Å; F510-M522 HydrophobicContact CG-SD 4.27Å; F510-C523 CarbonylContact C-O 3.58Å; F510-C523 WeakPolarHBondContact CA-O 3.4Å; F510-F570 HydrophobicContact CE1-CE1 4Å; F510-F570 HydrophobicContact CZ-CE1 4.11Å; F510-W581 HydrophobicContact CB-CH2 3.62Å; F510-W581 HydrophobicContact CB-CZ2 3.96Å
511	V	91.6	Very high	86.8	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	127.7	173.3	-172.8	0	0	0	0	108.4	L363 P420 M488 H490 Y509 V513 C523 Y525	L363-V511 HydrophobicContact CD1-CG1 3.96Å; P420-V511 HydrophobicContact CB-CG2 4.26Å; M488-V511 HydrophobicContact CB-CG1 4.47Å; M488-V511 HydrophobicContact CE-CG1 3.91Å; M488-V511 HydrophobicContact CE-CG2 4.31Å; M488-V511 HydrophobicContact CG-CG1 3.55Å; M488-V511 HydrophobicContact SD-CG1 3.93Å; H490-V511 WeakPolarHBondContact O-CA 3.22Å; Y509-V511 HydrophobicContact CD1-CG2 4.07Å; Y509-V511 HydrophobicContact CE1-CG2 3.71Å; V511-V513 HydrophobicContact CG1-CG2 4.03Å; V511-C523 PolarHBondContact N-O 3.35Å; V511-C523 PolarHBondContact O-N 3.35Å; V511-Y525 HydrophobicContact CB-CD2 4.14Å; V511-Y525 HydrophobicContact CB-CE2 3.82Å; V511-Y525 HydrophobicContact CG2-CD2 3.73Å; V511-Y525 HydrophobicContact CG2-CE2 3.87Å
512	L	91.3	Very high	87.1	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	113.9	170	177.2	61.1	0	0	0	109	K489 H490 F520 L538 W581 A584 A588	K489-L512 HydrophobicContact CB-CD2 4.05Å; K489-L512 HydrophobicContact CB-CG 4.11Å; K489-L512 PolarHBondContact N-O 3.04Å; H490-L512 HydrophobicContact CB-CB 4.49Å; H490-L512 PolarHBondContact O-N 3.44Å; L512-F520 HydrophobicContact CD1-CB 4.44Å; L512-L538 HydrophobicContact CD1-CD1 3.49Å; L512-L538 VanDerWaalsContact CD1-CD1 3.49Å; L512-W581 HydrophobicContact CB-CZ3 4.21Å; L512-A584 HydrophobicContact CD2-CB 3.78Å; L512-A584 WeakPolarHBondContact CD2-O 3.25Å; L512-A588 HydrophobicContact CD1-CB 4.04Å; L512-A588 HydrophobicContact CD2-CB 4.11Å
513	V	89.1	Confident	87.1	Confident	3 Å²	3	36.3 Å²	36.3	2%	0.018	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	132.5	-177.1	-175.7	0	0	0	0	109.9	V361 L363 H487 V511 V515 F520 A521 C523	V361-V513 HydrophobicContact CB-CG1 4.35Å; V361-V513 HydrophobicContact CG1-CB 4.39Å; V361-V513 HydrophobicContact CG1-CG1 4.15Å; L363-V513 HydrophobicContact CD1-CG2 4.21Å; L363-V513 HydrophobicContact CD2-CG1 4.22Å; H487-V513 CarbonylContact O-C 3.47Å; H487-V513 WeakPolarHBondContact O-CA 3.4Å; V511-V513 HydrophobicContact CG1-CG2 4.03Å; V513-V515 HydrophobicContact CG1-CG2 4.42Å; V513-F520 WeakPolarHBondContact O-CA 3.36Å; V513-A521 PolarHBondContact N-O 3.37Å; V513-A521 PolarHBondContact O-N 3.03Å; V513-C523 HydrophobicContact CG2-CB 4.35Å
514	Q	87	Confident	87.3	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	119.2	166.6	-174.3	179.5	13.1	0	0	109.6	D267 V325 H487 K489 S516 F520	D267-Q514 PolarHBondContact OD1-OE1 3.14Å; V325-Q514 HydrophobicContact CG1-CB 4.32Å; V325-Q514 HydrophobicContact CG1-CG 3.96Å; H487-Q514 PolarHBondContact ND1-O 3.49Å; H487-Q514 PolarHBondContact O-N 3.08Å; K489-Q514 HydrophobicContact CG-CB 4.23Å; Q514-S516 WeakPolarHBondContact CG-O 3.04Å; Q514-S516 PolarHBondContact NE2-O 2.96Å; Q514-F520 HydrophobicContact CB-CD1 3.83Å; Q514-F520 HydrophobicContact CB-CE1 3.59Å; Q514-F520 HydrophobicContact CB-CZ 4.21Å; Q514-F520 HydrophobicContact CG-CD1 4.03Å; Q514-F520 HydrophobicContact CG-CE1 3.55Å; Q514-F520 HydrophobicContact CG-CE2 4.18Å; Q514-F520 HydrophobicContact CG-CZ 3.63Å
515	V	81.6	Confident	87.3	Confident	16 Å²	16	20.3 Å²	20.3	10%	0.097	9%	0.091	C	C	.	.			trans	-95.1	-44.3	177.7	-172.7	0	0	0	0	110.6	L356 D360 V361 V513 T519	L356-V515 HydrophobicContact CD1-CG2 3.97Å; L356-V515 HydrophobicContact CD2-CB 4.45Å; L356-V515 HydrophobicContact CD2-CG1 3.93Å; L356-V515 HydrophobicContact CD2-CG2 4.44Å; D360-V515 HydrophobicContact CB-CG1 4.31Å; V361-V515 HydrophobicContact CG1-CG2 3.64Å; V513-V515 HydrophobicContact CG1-CG2 4.42Å; V515-T519 PolarHBondContact N-O 2.96Å
516	S	78.1	Confident	87.1	Confident	18 Å²	18	24.7 Å²	24.7	13%	0.126	11%	0.107	C	C	.	.	S	Bend	trans	-135.5	-178.1	173.8	86.4	0	0	0	0	111	Q514 Y518 T519	Q514-S516 WeakPolarHBondContact CG-O 3.04Å; Q514-S516 PolarHBondContact NE2-O 2.96Å; S516-Y518 PolarHBondContact O-N 3.09Å; S516-Y518 PolarHBondContact OG-N 3.02Å; S516-Y518 VanDerWaalsContact OG-N 3.07Å; S516-T519 PolarHBondContact N-O 2.9Å; S516-T519 PolarHBondContact OG-N 3.46Å; S516-T519 PolarHBondContact OG-OG1 2.67Å
517	Q	75	Confident	86.8	Confident	13 Å²	13	22.3 Å²	22.3	6%	0.061	10%	0.098	C	C	.	.	S	Bend	trans	-69	-14.9	172.6	-60.6	-65.1	1.8	0	0	113.9	R274 L320 L323 P324	R274-Q517 WeakPolarHBondContact CD-O 3.34Å; R274-Q517 PolarHBondContact NH1-O 2.97Å; L320-Q517 HydrophobicContact CD2-CB 4.44Å; L320-Q517 HydrophobicContact CG-CB 3.88Å; L320-Q517 WeakPolarHBondContact O-CB 3.45Å; L320-Q517 VanDerWaalsContact O-CG 3.22Å; L320-Q517 WeakPolarHBondContact O-CG 3.34Å; L323-Q517 HydrophobicContact CB-CG 4.38Å; L323-Q517 WeakPolarHBondContact O-CG 3.33Å; L323-Q517 PolarHBondContact O-NE2 3.27Å; P324-Q517 PolarHBondContact O-NE2 3.02Å
518	Y	75.4	Confident	86.2	Confident	28 Å²	28	24.6 Å²	24.6	11%	0.11	11%	0.109	C	C	.	.	S	Bend	trans	-102.8	-43.3	171.1	-92.6	-89.7	0	0	0	113.2	R274 L277 M317 L320 E321 S516	R274-Y518 HydrophobicContact CB-CE1 4.04Å; R274-Y518 HydrophobicContact CG-CD1 4.09Å; R274-Y518 HydrophobicContact CG-CE1 3.57Å; R274-Y518 HydrophobicContact CG-CE2 4.14Å; L277-Y518 WeakPolarHBondContact CD1-OH 3.41Å; M317-Y518 HydrophobicContact CB-CD2 4.31Å; M317-Y518 HydrophobicContact CB-CE2 3.81Å; M317-Y518 HydrophobicContact CE-CD1 3.85Å; M317-Y518 HydrophobicContact CE-CE1 3.68Å; M317-Y518 HydrophobicContact CG-CE1 4.02Å; M317-Y518 HydrophobicContact CG-CE2 3.97Å; L320-Y518 HydrophobicContact CB-CE2 3.99Å; L320-Y518 HydrophobicContact CD2-CD2 4.25Å; L320-Y518 HydrophobicContact CD2-CE2 3.59Å; L320-Y518 HydrophobicContact CG-CE2 4.22Å; E321-Y518 HydrophobicContact CG-CD2 3.95Å; E321-Y518 HydrophobicContact CG-CG 4.48Å; S516-Y518 PolarHBondContact O-N 3.09Å; S516-Y518 PolarHBondContact OG-N 3.02Å; S516-Y518 VanDerWaalsContact OG-N 3.07Å
519	T	81.5	Confident	85.8	Confident	19 Å²	19	28.5 Å²	28.5	12%	0.117	13%	0.127	C	C	.	.			trans	-94.8	117.1	-166	-30	0	0	0	0	112.3	L356 V515 S516	L356-T519 HydrophobicContact CD1-CG2 3.67Å; L356-T519 HydrophobicContact CD2-CG2 4.46Å; L356-T519 HydrophobicContact CG-CG2 4.18Å; V515-T519 PolarHBondContact N-O 2.96Å; S516-T519 PolarHBondContact N-O 2.9Å; S516-T519 PolarHBondContact OG-N 3.46Å; S516-T519 PolarHBondContact OG-OG1 2.67Å
520	F	88.6	Confident	85.3	Confident	6 Å²	6	29.9 Å²	29.9	3%	0.026	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	141.2	173.9	-69	-104.3	0	0	0	110.5	K489 L512 V513 Q514 L538 A588	K489-F520 HydrophobicContact CG-CE1 4.19Å; L512-F520 HydrophobicContact CD1-CB 4.44Å; V513-F520 WeakPolarHBondContact O-CA 3.36Å; Q514-F520 HydrophobicContact CB-CD1 3.83Å; Q514-F520 HydrophobicContact CB-CE1 3.59Å; Q514-F520 HydrophobicContact CB-CZ 4.21Å; Q514-F520 HydrophobicContact CG-CD1 4.03Å; Q514-F520 HydrophobicContact CG-CE1 3.55Å; Q514-F520 HydrophobicContact CG-CE2 4.18Å; Q514-F520 HydrophobicContact CG-CZ 3.63Å; F520-L538 HydrophobicContact CB-CB 4.45Å; F520-L538 HydrophobicContact CB-CD1 4.46Å; F520-L538 PolarHBondContact O-N 3.05Å; F520-A588 HydrophobicContact CB-CB 3.74Å; F520-A588 HydrophobicContact CD1-CB 3.52Å; F520-A588 HydrophobicContact CD2-CB 4.2Å; F520-A588 WeakPolarHBondContact CD2-O 3.3Å; F520-A588 HydrophobicContact CE1-CB 4.13Å; F520-A588 HydrophobicContact CG-CB 3.56Å
521	A	89.6	Confident	84.8	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	129.3	179.6	0	0	0	0	0	111.5	L356 V361 V513 M536	L356-A521 HydrophobicContact CD1-CB 4.27Å; V361-A521 HydrophobicContact CG1-CB 3.99Å; V513-A521 PolarHBondContact N-O 3.37Å; V513-A521 PolarHBondContact O-N 3.03Å; A521-M536 CarbonylContact C-O 3.6Å; A521-M536 WeakPolarHBondContact CA-O 3.34Å
522	M	91.8	Very high	84.6	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	111.8	164.4	-180	66.2	84.6	0	0	108.2	W502 F510 L535 M536 L538 F570 W581 M585	W502-M522 HydrophobicContact CH2-CB 4.06Å; W502-M522 HydrophobicContact CH2-CG 3.68Å; W502-M522 WeakPolarHBondContact CH2-O 3.4Å; W502-M522 HydrophobicContact CZ2-CG 4.45Å; W502-M522 HydrophobicContact CZ3-CG 4.22Å; F510-M522 HydrophobicContact CB-SD 4.12Å; F510-M522 HydrophobicContact CD1-CG 3.77Å; F510-M522 HydrophobicContact CD1-SD 3.64Å; F510-M522 HydrophobicContact CE1-CG 4.08Å; F510-M522 HydrophobicContact CE1-SD 4.46Å; F510-M522 HydrophobicContact CG-SD 4.27Å; M522-L535 CarbonylContact O-C 3.11Å; M522-L535 WeakPolarHBondContact O-CA 3.11Å; M522-M536 PolarHBondContact N-O 3.37Å; M522-M536 PolarHBondContact O-N 3.36Å; M522-L538 HydrophobicContact CB-CD2 4.1Å; M522-L538 HydrophobicContact CB-CG 4.42Å; M522-F570 HydrophobicContact CE-CE1 4.45Å; M522-F570 HydrophobicContact CE-CZ 4.34Å; M522-F570 HydrophobicContact CG-CE1 4.47Å; M522-F570 HydrophobicContact CG-CZ 4.3Å; M522-W581 HydrophobicContact CE-CE3 3.99Å; M522-W581 HydrophobicContact CE-CH2 4.5Å; M522-W581 HydrophobicContact CE-CZ3 3.64Å; M522-W581 HydrophobicContact SD-CH2 4.24Å; M522-W581 HydrophobicContact SD-CZ3 3.84Å; M522-M585 HydrophobicContact CE-CE 4.05Å; M522-M585 HydrophobicContact CE-CG 4Å; M522-M585 HydrophobicContact CE-SD 3.35Å; M522-M585 WeakPolarHBondContact CE-SD 3.33Å
523	C	91.7	Very high	84.3	Confident	0 Å²	0	38 Å²	38	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	136.9	-171.5	-72.3	0	0	0	0	111.1	F510 V511 V513 Y525 P532	F510-C523 CarbonylContact C-O 3.58Å; F510-C523 WeakPolarHBondContact CA-O 3.4Å; V511-C523 PolarHBondContact N-O 3.35Å; V511-C523 PolarHBondContact O-N 3.35Å; V513-C523 HydrophobicContact CG2-CB 4.35Å; C523-Y525 HydrophobicContact CB-CD2 4.32Å; C523-Y525 HydrophobicContact CB-CE2 3.39Å; C523-P532 HydrophobicContact CB-CB 3.98Å; C523-P532 HydrophobicContact CB-CG 4.41Å
524	S	91.3	Very high	84.2	Confident	2 Å²	2	40 Å²	40	1%	0.014	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	126.6	179.4	65	0	0	0	0	112.1	W502 Y509 P532 Q533 E534	W502-S524 PolarHBondContact NE1-OG 2.85Å; Y509-S524 WeakPolarHBondContact O-CA 3.44Å; S524-P532 CarbonylContact O-C 3.19Å; S524-P532 WeakPolarHBondContact O-CA 3.41Å; S524-Q533 PolarHBondContact O-N 2.89Å; S524-E534 PolarHBondContact N-O 3.31Å; S524-E534 WeakPolarHBondContact OG-CB 3.34Å; S524-E534 PolarHBondContact OG-N 3.46Å; S524-E534 PolarHBondContact OG-O 3.15Å
525	Y	88.1	Confident	84.3	Confident	10 Å²	10	41.6 Å²	41.6	4%	0.039	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	156.8	-169.1	-67.4	-91.7	0	0	0	113	V361 P420 Y509 V511 C523 S530 P532	V361-Y525 PolarHBondContact O-OH 2.95Å; P420-Y525 HydrophobicContact CB-CG 4.37Å; P420-Y525 HydrophobicContact CG-CD1 3.72Å; P420-Y525 HydrophobicContact CG-CD2 4.22Å; P420-Y525 HydrophobicContact CG-CE1 3.82Å; P420-Y525 HydrophobicContact CG-CE2 4.3Å; P420-Y525 HydrophobicContact CG-CG 3.93Å; Y509-Y525 PolarHBondContact O-N 2.83Å; V511-Y525 HydrophobicContact CB-CD2 4.14Å; V511-Y525 HydrophobicContact CB-CE2 3.82Å; V511-Y525 HydrophobicContact CG2-CD2 3.73Å; V511-Y525 HydrophobicContact CG2-CE2 3.87Å; C523-Y525 HydrophobicContact CB-CD2 4.32Å; C523-Y525 HydrophobicContact CB-CE2 3.39Å; Y525-S530 WeakPolarHBondContact CE1-O 3.5Å; Y525-P532 HydrophobicContact CD1-CB 4.24Å; Y525-P532 HydrophobicContact CE1-CB 3.84Å; Y525-P532 HydrophobicContact CE1-CG 4.27Å; Y525-P532 HydrophobicContact CE2-CB 4.27Å
526	R	84.7	Confident	84.7	Confident	142 Å²	142	41.2 Å²	41.2	54%	0.536	19%	0.19	S	C	.	.			trans	-110.2	160.8	167.5	-68.4	-166.7	-176.5	-175.1	5.9	110	Q533	R526-Q533 VanDerWaalsContact CZ-OE1 3.23Å
527	E	81.8	Confident	85.2	Confident	90 Å²	90	42.7 Å²	42.7	42%	0.421	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	142	168.6	-70.9	151.9	-152.4	0	0	110.9	R421 Y449 K529	R421-E527 VanDerWaalsContact CZ-CG 3.44Å; R421-E527 IonicContact CZ-OE1 2.71Å; R421-E527 VanDerWaalsContact NH1-CG 3.32Å; R421-E527 IonicContact NH1-OE1 3.23Å; R421-E527 PolarHBondContact NH1-OE1 3.32Å; R421-E527 IonicContact NH2-OE1 3.9Å; R421-E527 PolarHBondContact NH2-OE1 2.91Å; Y449-E527 HydrophobicContact CD1-CG 4.39Å; Y449-E527 HydrophobicContact CE1-CG 4.47Å; E527-K529 VanDerWaalsContact C-N 3.31Å; E527-K529 PolarHBondContact O-N 3.4Å
528	K	78.3	Confident	85.7	Confident	129 Å²	129	42.2 Å²	42.2	56%	0.561	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.3	37.3	176.8	-50.5	169.5	-173.1	170.9	0	113.6	V423	V423-K528 HydrophobicContact CG2-CD 4.25Å; V423-K528 HydrophobicContact CG2-CG 3.62Å
529	K	82.6	Confident	86.1	Confident	116 Å²	116	45.5 Å²	45.5	50%	0.504	21%	0.209	S	C	.	.			trans	-140.3	137.3	173	-75.5	-164.6	165.6	-111.8	0	111.9	E527	E527-K529 VanDerWaalsContact C-N 3.31Å; E527-K529 PolarHBondContact O-N 3.4Å
530	S	80.1	Confident	85.9	Confident	35 Å²	35	47.1 Å²	47.1	25%	0.245	23%	0.23	C	C	.	.	S	Bend	trans	-80.9	-39.7	173.6	47	0	0	0	0	112.2	T418 H419 Y525	T418-S530 WeakPolarHBondContact O-CA 3.48Å; H419-S530 VanDerWaalsContact CD2-CA 3.47Å; H419-S530 WeakPolarHBondContact CD2-CA 3.31Å; H419-S530 PolarHBondContact CD2-N 3.49Å; H419-S530 PolarHBondContact NE2-N 3.2Å; Y525-S530 WeakPolarHBondContact CE1-O 3.5Å
531	E	82.8	Confident	85.8	Confident	93 Å²	93	47.8 Å²	47.8	44%	0.435	23%	0.232	S	C	.	.	S	Bend	trans	-82.6	145.8	178.4	-67.8	179.8	-171.2	0	0	113.3	K358	K358-E531 HydrophobicContact CB-CB 4.5Å; K358-E531 HydrophobicContact CB-CG 4.31Å
532	P	86.1	Confident	85.7	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.013	24%	0.244	C	C	.	.			trans	-70.7	145.3	170.6	28.8	-33.5	0	0	0	112.2	K358 V361 C523 S524 Y525 L535	K358-P532 PolarHBondContact NZ-O 2.89Å; V361-P532 HydrophobicContact CG2-CG 3.66Å; C523-P532 HydrophobicContact CB-CB 3.98Å; C523-P532 HydrophobicContact CB-CG 4.41Å; S524-P532 CarbonylContact O-C 3.19Å; S524-P532 WeakPolarHBondContact O-CA 3.41Å; Y525-P532 HydrophobicContact CD1-CB 4.24Å; Y525-P532 HydrophobicContact CE1-CB 3.84Å; Y525-P532 HydrophobicContact CE1-CG 4.27Å; Y525-P532 HydrophobicContact CE2-CB 4.27Å; P532-L535 HydrophobicContact CG-CB 4.37Å; P532-L535 HydrophobicContact CG-CD2 4.17Å
533	Q	85.6	Confident	85.6	Confident	75 Å²	75	49.8 Å²	49.8	35%	0.35	24%	0.244	S	C	.	.	S	Bend	trans	-70.7	-51.4	175.1	-170	-152.7	-62.7	0	0	110.8	K358 S524 R526	K358-Q533 PolarHBondContact NZ-O 2.78Å; S524-Q533 PolarHBondContact O-N 2.89Å; R526-Q533 VanDerWaalsContact CZ-OE1 3.23Å
534	E	87.4	Confident	85.5	Confident	45 Å²	45	51.9 Å²	51.9	21%	0.21	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	136.3	179.8	-56.4	168.4	82.2	0	0	106.5	W502 R508 S524	W502-E534 VanDerWaalsContact CA-OE1 3.27Å; W502-E534 WeakPolarHBondContact CA-OE1 3.41Å; W502-E534 VanDerWaalsContact CD1-OE1 3.32Å; W502-E534 HydrophobicContact CZ2-CB 4.49Å; W502-E534 PolarHBondContact N-OE1 3.31Å; W502-E534 VanDerWaalsContact N-OE1 3.09Å; W502-E534 VanDerWaalsContact NE1-CB 3.34Å; R508-E534 IonicContact CZ-OE2 3.59Å; R508-E534 IonicContact NE-OE2 3.61Å; R508-E534 PolarHBondContact NE-OE2 3.38Å; R508-E534 VanDerWaalsContact NE-OE2 3.12Å; R508-E534 IonicContact NH2-OE1 3.15Å; R508-E534 IonicContact NH2-OE2 3.36Å; R508-E534 PolarHBondContact NH2-OE2 3.17Å; S524-E534 PolarHBondContact N-O 3.31Å; S524-E534 WeakPolarHBondContact OG-CB 3.34Å; S524-E534 PolarHBondContact OG-N 3.46Å; S524-E534 PolarHBondContact OG-O 3.15Å
535	L	89	Confident	85.4	Confident	34 Å²	34	53.4 Å²	53.4	18%	0.178	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	155.2	178.8	73.6	88.6	0	0	0	110.7	K358 V361 M522 P532	K358-L535 HydrophobicContact CG-CD2 4.04Å; V361-L535 HydrophobicContact CG2-CD2 4.37Å; M522-L535 CarbonylContact O-C 3.11Å; M522-L535 WeakPolarHBondContact O-CA 3.11Å; P532-L535 HydrophobicContact CG-CB 4.37Å; P532-L535 HydrophobicContact CG-CD2 4.17Å
536	M	89.8	Confident	85.3	Confident	9 Å²	9	54.5 Å²	54.5	4%	0.044	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	127	176.7	-171.9	175.9	86.2	0	0	109.8	V501 W502 A521 M522 L538 Y541 A561 V568	V501-M536 HydrophobicContact CG2-CB 4.12Å; V501-M536 HydrophobicContact CG2-CG 4.08Å; V501-M536 HydrophobicContact CG2-SD 3.64Å; W502-M536 HydrophobicContact CH2-CB 3.47Å; W502-M536 VanDerWaalsContact CH2-CB 3.47Å; W502-M536 HydrophobicContact CZ3-CB 3.68Å; W502-M536 HydrophobicContact CZ3-CE 4.27Å; W502-M536 HydrophobicContact CZ3-CG 4.37Å; W502-M536 HydrophobicContact CZ3-SD 3.8Å; A521-M536 CarbonylContact C-O 3.6Å; A521-M536 WeakPolarHBondContact CA-O 3.34Å; M522-M536 PolarHBondContact N-O 3.37Å; M522-M536 PolarHBondContact O-N 3.36Å; M536-L538 HydrophobicContact CE-CD2 3.52Å; M536-Y541 HydrophobicContact CE-CD1 4.39Å; M536-Y541 HydrophobicContact CE-CE1 4.15Å; M536-Y541 HydrophobicContact CG-CE2 4.38Å; M536-Y541 HydrophobicContact SD-CE1 4.21Å; M536-Y541 HydrophobicContact SD-CE2 4.48Å; M536-A561 HydrophobicContact CE-CB 4.42Å; M536-V568 HydrophobicContact CE-CG2 4.21Å; M536-V568 HydrophobicContact SD-CB 4.47Å; M536-V568 HydrophobicContact SD-CG2 3.56Å; M536-V568 VanDerWaalsContact SD-CG2 3.56Å
537	Q	87.5	Confident	85.1	Confident	49 Å²	49	53.8 Å²	53.8	23%	0.229	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	139.2	169	-48.3	-164	18.1	0	0	109.4	L356 Y541	L356-Q537 HydrophobicContact CD1-CG 4.18Å; L356-Q537 VanDerWaalsContact N-NE2 3.16Å; Q537-Y541 WeakPolarHBondContact O-CD2 3.14Å; Q537-Y541 VanDerWaalsContact O-CE2 3.23Å; Q537-Y541 WeakPolarHBondContact O-CE2 3.25Å
538	L	87	Confident	84.8	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.01	28%	0.283	C	S	.	.			trans	-92.7	5	-179.9	-64.2	-175.6	0	0	0	113.9	L512 F520 M522 M536 G540 Y541 M585 A588 T589	L512-L538 HydrophobicContact CD1-CD1 3.49Å; L512-L538 VanDerWaalsContact CD1-CD1 3.49Å; F520-L538 HydrophobicContact CB-CB 4.45Å; F520-L538 HydrophobicContact CB-CD1 4.46Å; F520-L538 PolarHBondContact O-N 3.05Å; M522-L538 HydrophobicContact CB-CD2 4.1Å; M522-L538 HydrophobicContact CB-CG 4.42Å; M536-L538 HydrophobicContact CE-CD2 3.52Å; L538-G540 PolarHBondContact O-N 3.21Å; L538-Y541 PolarHBondContact O-N 2.9Å; L538-M585 HydrophobicContact CD1-CE 4.41Å; L538-M585 HydrophobicContact CD1-CG 4.45Å; L538-M585 HydrophobicContact CD2-CE 4.04Å; L538-A588 HydrophobicContact CD1-CB 3.84Å; L538-T589 HydrophobicContact CB-CG2 4.36Å
539	E	82	Confident	84.6	Confident	97 Å²	97	52 Å²	52	45%	0.453	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	124.4	-179	-171.5	167.2	169.6	0	0	111.8	Y541 K563	E539-Y541 VanDerWaalsContact C-N 3.28Å; E539-Y541 PolarHBondContact O-N 2.93Å; E539-K563 WeakPolarHBondContact O-CD 3.43Å; E539-K563 WeakPolarHBondContact O-CE 3.38Å; E539-K563 PolarHBondContact O-NZ 3.39Å
540	G	77.4	Confident	83.7	Confident	54 Å²	54	52.5 Å²	52.5	56%	0.557	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	12.1	-174.7	0	0	0	0	0	115.1	L538 K563	L538-G540 PolarHBondContact O-N 3.21Å; G540-K563 WeakPolarHBondContact O-CB 3.4Å; G540-K563 VanDerWaalsContact O-CG 3.28Å; G540-K563 WeakPolarHBondContact O-CG 3.08Å
541	Y	86.6	Confident	83.3	Confident	20 Å²	20	54.5 Å²	54.5	8%	0.078	32%	0.318	C	S	.	.			trans	-91.6	146.6	168.4	-75.8	-96.8	0	0	0	111.1	M536 Q537 L538 E539 A561 V562 K563 D566 T589	M536-Y541 HydrophobicContact CE-CD1 4.39Å; M536-Y541 HydrophobicContact CE-CE1 4.15Å; M536-Y541 HydrophobicContact CG-CE2 4.38Å; M536-Y541 HydrophobicContact SD-CE1 4.21Å; M536-Y541 HydrophobicContact SD-CE2 4.48Å; Q537-Y541 WeakPolarHBondContact O-CD2 3.14Å; Q537-Y541 VanDerWaalsContact O-CE2 3.23Å; Q537-Y541 WeakPolarHBondContact O-CE2 3.25Å; L538-Y541 PolarHBondContact O-N 2.9Å; E539-Y541 VanDerWaalsContact C-N 3.28Å; E539-Y541 PolarHBondContact O-N 2.93Å; Y541-A561 HydrophobicContact CD1-CB 3.99Å; Y541-V562 CarbonylContact C-O 3.53Å; Y541-V562 VanDerWaalsContact CA-O 3.24Å; Y541-V562 WeakPolarHBondContact CA-O 3.23Å; Y541-K563 HydrophobicContact CD1-CB 3.69Å; Y541-K563 HydrophobicContact CD2-CB 4.03Å; Y541-K563 HydrophobicContact CD2-CD 3.92Å; Y541-K563 HydrophobicContact CE1-CB 3.67Å; Y541-K563 HydrophobicContact CE2-CB 4.03Å; Y541-K563 HydrophobicContact CE2-CD 3.77Å; Y541-K563 HydrophobicContact CG-CB 3.87Å; Y541-D566 HydrophobicContact CE1-CB 4.46Å; Y541-D566 PolarHBondContact OH-OD2 2.88Å; Y541-T589 WeakPolarHBondContact O-CB 3.24Å; Y541-T589 WeakPolarHBondContact O-CG2 3.36Å
542	T	87.3	Confident	83.1	Confident	41 Å²	41	52.2 Å²	52.2	25%	0.252	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	154	156.8	68.8	0	0	0	0	109.8	A561 V562 Q591 Y593	T542-A561 CarbonylContact O-C 3.58Å; T542-A561 WeakPolarHBondContact O-CA 3.41Å; T542-V562 PolarHBondContact N-O 3.05Å; T542-V562 PolarHBondContact O-N 3.29Å; T542-Q591 HydrophobicContact CG2-CB 3.85Å; T542-Y593 WeakPolarHBondContact CB-OH 3.32Å; T542-Y593 HydrophobicContact CG2-CE1 4.19Å; T542-Y593 PolarHBondContact OG1-OH 2.72Å
543	V	91.3	Very high	82.3	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	137.8	171.4	58.5	0	0	0	0	109.8	F559 N560 V582 M585 Q591 P595	V543-F559 HydrophobicContact CG2-CD2 4.02Å; V543-N560 VanDerWaalsContact CA-O 3.27Å; V543-N560 WeakPolarHBondContact CA-O 3.49Å; V543-N560 WeakPolarHBondContact CG2-O 3.36Å; V543-V582 HydrophobicContact CG2-CG1 4.23Å; V543-V582 HydrophobicContact CG2-CG2 4.28Å; V543-M585 HydrophobicContact CB-CB 4.09Å; V543-M585 HydrophobicContact CB-CE 4.41Å; V543-M585 HydrophobicContact CG1-CB 3.8Å; V543-M585 HydrophobicContact CG2-CB 4.07Å; V543-M585 HydrophobicContact CG2-CE 4.32Å; V543-M585 HydrophobicContact CG2-SD 4.4Å; V543-Q591 VanDerWaalsContact CG1-OE1 3.28Å; V543-Q591 PolarHBondContact O-NE2 3.33Å; V543-Q591 PolarHBondContact O-OE1 3.14Å; V543-P595 HydrophobicContact CG1-CG 4.31Å; V543-P595 WeakPolarHBondContact O-CG 3.42Å
544	D	89.3	Confident	81.5	Confident	44 Å²	44	58.2 Å²	58.2	24%	0.235	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	157.9	176.7	-92	-55.9	0	0	0	113.2	F559 N560 Y593	D544-F559 CarbonylContact O-C 3.54Å; D544-F559 VanDerWaalsContact O-CA 3.24Å; D544-F559 WeakPolarHBondContact O-CA 3.45Å; D544-F559 VanDerWaalsContact O-CB 3.24Å; D544-F559 WeakPolarHBondContact O-CB 3.47Å; D544-N560 PolarHBondContact N-O 3.14Å; D544-N560 VanDerWaalsContact N-O 3.1Å; D544-N560 PolarHBondContact O-N 2.97Å; D544-N560 PolarHBondContact O-OD1 3.28Å; D544-Y593 WeakPolarHBondContact OD2-CE2 3.3Å; D544-Y593 VanDerWaalsContact OD2-CZ 3.3Å; D544-Y593 PolarHBondContact OD2-OH 2.68Å
545	Y	89.6	Confident	80.8	Confident	34 Å²	34	56.6 Å²	56.6	13%	0.133	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	136.9	172.3	-65.8	-86.5	0	0	0	110.1	R578 V582 P595 V596 P597	Y545-R578 HydrophobicContact CD1-CG 4.28Å; Y545-R578 HydrophobicContact CE1-CG 4.03Å; Y545-V582 HydrophobicContact CD1-CG2 4.3Å; Y545-V582 HydrophobicContact CD2-CG1 4.29Å; Y545-V582 HydrophobicContact CE1-CB 4.23Å; Y545-V582 HydrophobicContact CE1-CG1 4.36Å; Y545-V582 HydrophobicContact CE1-CG2 3.94Å; Y545-V582 HydrophobicContact CE2-CB 4.39Å; Y545-V582 HydrophobicContact CE2-CG1 3.69Å; Y545-P595 HydrophobicContact CD2-CB 3.89Å; Y545-P595 HydrophobicContact CE2-CB 3.75Å; Y545-V596 VanDerWaalsContact CD2-O 3.32Å; Y545-V596 WeakPolarHBondContact CD2-O 3.35Å; Y545-P597 HydrophobicContact CD1-CB 4.49Å; Y545-P597 HydrophobicContact CD2-CG 4.43Å; Y545-P597 HydrophobicContact CE1-CB 4.32Å; Y545-P597 HydrophobicContact CE1-CG 4.17Å; Y545-P597 HydrophobicContact CE2-CB 4.34Å; Y545-P597 HydrophobicContact CE2-CG 3.82Å
546	T	85.2	Confident	80.3	Confident	34 Å²	34	58.7 Å²	58.7	21%	0.209	36%	0.357	C	S	.	.			trans	-130.1	155	-179	52.3	0	0	0	0	112.7	F558 F559 N560	T546-F558 PolarHBondContact N-O 2.92Å; T546-F559 VanDerWaalsContact OG1-CA 3.27Å; T546-F559 WeakPolarHBondContact OG1-CA 3.11Å; T546-F559 PolarHBondContact OG1-N 2.86Å; T546-N560 HydrophobicContact CG2-CB 3.88Å; T546-N560 VanDerWaalsContact CG2-CG 3.4Å; T546-N560 WeakPolarHBondContact CG2-OD1 3.5Å
547	D	80	Confident	80.1	Confident	127 Å²	127	61.5 Å²	61.5	68%	0.679	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-71.3	151.2	174	-71.9	-53.3	0	0	0	112	H549	D547-H549 PolarHBondContact O-N 3.33Å
548	P	76.6	Confident	80.2	Confident	88 Å²	88	59.6 Å²	59.6	57%	0.571	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-57	124.9	-179.6	-25.6	35.1	0	0	0	113.3	P550 F558	P548-P550 WeakPolarHBondContact O-CD 3.35Å; P548-F558 HydrophobicContact CB-CD2 3.96Å; P548-F558 HydrophobicContact CB-CE2 3.99Å; P548-F558 HydrophobicContact CG-CD2 4.31Å
549	H	74.7	Confident	80.4	Confident	94 Å²	94	59.5 Å²	59.5	44%	0.435	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-80.6	117.1	-175.1	-113	58.7	0	0	0	112.3	D547 G551 L552 F558	D547-H549 PolarHBondContact O-N 3.33Å; H549-G551 PolarHBondContact O-N 2.79Å; H549-L552 HydrophobicContact CB-CD1 3.89Å; H549-L552 HydrophobicContact CB-CG 4.32Å; H549-L552 PolarHBondContact O-N 3.11Å; H549-F558 HydrophobicContact CB-CE1 4.26Å
550	P	63.6	Low	80.9	Confident	126 Å²	126	56.2 Å²	56.2	82%	0.818	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	120	-178.4	27.1	-33.8	0	0	0	111	P548	P548-P550 WeakPolarHBondContact O-CD 3.35Å
551	G	70.3	Confident	81.6	Confident	77 Å²	77	53.7 Å²	53.7	79%	0.794	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	114	-11.5	180	0	0	0	0	0	114.9	H549	H549-G551 PolarHBondContact O-N 2.79Å
552	L	79.4	Confident	81.7	Confident	44 Å²	44	55.1 Å²	55.1	23%	0.23	33%	0.331	C	S	.	.			trans	-92.4	131.9	171.9	-61.2	-179	0	0	0	110.3	L497 W505 H549 F558	L497-L552 HydrophobicContact CD2-CD2 4.34Å; W505-L552 HydrophobicContact CB-CD2 4.11Å; W505-L552 HydrophobicContact CD2-CB 4.33Å; W505-L552 HydrophobicContact CD2-CD1 4.1Å; W505-L552 HydrophobicContact CD2-CD2 4Å; W505-L552 HydrophobicContact CD2-CG 4.37Å; W505-L552 HydrophobicContact CE3-CD1 4Å; W505-L552 HydrophobicContact CE3-CD2 4.46Å; W505-L552 HydrophobicContact CG-CD2 3.88Å; W505-L552 HydrophobicContact CH2-CD1 3.96Å; W505-L552 HydrophobicContact CZ2-CB 3.99Å; W505-L552 HydrophobicContact CZ2-CD1 4.08Å; W505-L552 HydrophobicContact CZ3-CD1 3.94Å; H549-L552 HydrophobicContact CB-CD1 3.89Å; H549-L552 HydrophobicContact CB-CG 4.32Å; H549-L552 PolarHBondContact O-N 3.11Å; L552-F558 HydrophobicContact CB-CE1 4.41Å; L552-F558 HydrophobicContact CD1-CE1 4.12Å
553	Q	69.6	Low	81.6	Confident	173 Å²	173	56.6 Å²	56.6	81%	0.808	33%	0.334	S	S	*	.			trans	-110.9	133.8	178.9	-68.9	-174	-7.4	0	0	111.4	W505	W505-Q553 PolarHBondContact NE1-O 2.82Å
554	G	67.3	Low	81	Confident	31 Å²	31	65.8 Å²	65.8	32%	0.32	38%	0.377	S	S	.	.	S	Bend	trans	84.2	143.8	-173.5	0	0	0	0	0	112.3	W505	W505-G554 WeakPolarHBondContact CZ2-O 3.25Å
555	G	73.4	Confident	80.4	Confident	11 Å²	11	66.8 Å²	66.8	11%	0.113	40%	0.398	C	S	.	.			trans	78.7	128.3	-159.8	0	0	0	0	0	111.2	Y495 S572 D573	Y495-G555 VanDerWaalsContact CE2-N 3.29Å; G555-S572 CarbonylContact C-O 3.57Å; G555-S572 WeakPolarHBondContact CA-O 3.48Å; G555-D573 WeakPolarHBondContact CA-OD1 3.29Å; G555-D573 PolarHBondContact N-OD1 3.26Å; G555-D573 VanDerWaalsContact N-OD1 3.12Å
556	C	78.1	Confident	80.3	Confident	78 Å²	78	65.3 Å²	65.3	53%	0.527	39%	0.392	S	S	.	.	S	Bend	trans	-103.6	-33.7	177.6	-65.4	0	0	0	0	111.9	S572	C556-S572 PolarHBondContact N-O 2.82Å
557	M	85.9	Confident	80.4	Confident	68 Å²	68	65.8 Å²	65.8	34%	0.335	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	114.7	-170	-56.9	-52.5	-173.8	0	0	109.9	A571 S572 E575 R578	M557-A571 VanDerWaalsContact O-CA 3.26Å; M557-A571 WeakPolarHBondContact O-CA 3.3Å; M557-S572 PolarHBondContact N-O 3.24Å; M557-S572 VanDerWaalsContact N-O 3.09Å; M557-S572 PolarHBondContact O-N 3.09Å; M557-E575 WeakPolarHBondContact CB-OE2 3.4Å; M557-E575 HydrophobicContact CE-CB 4.26Å; M557-E575 HydrophobicContact CG-CB 4.16Å; M557-E575 VanDerWaalsContact CG-OE2 3.3Å; M557-E575 WeakPolarHBondContact CG-OE2 3.42Å; M557-R578 HydrophobicContact CB-CB 4.11Å
558	F	89.5	Confident	81	Confident	8 Å²	8	59.7 Å²	59.7	4%	0.035	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	148.7	-168.2	-71.7	-105.4	0	0	0	112.7	W505 T546 P548 H549 L552 I569 F570 A571 R578	W505-F558 HydrophobicContact CH2-CD1 4.35Å; W505-F558 AromaticContact CH2-CE1 3.73Å; W505-F558 HydrophobicContact CH2-CE1 3.73Å; W505-F558 HydrophobicContact CH2-CZ 4.49Å; W505-F558 AromaticContact CZ2-CE1 3.9Å; W505-F558 HydrophobicContact CZ2-CE1 3.9Å; W505-F558 HydrophobicContact CZ2-CZ 4.26Å; T546-F558 PolarHBondContact N-O 2.92Å; P548-F558 HydrophobicContact CB-CD2 3.96Å; P548-F558 HydrophobicContact CB-CE2 3.99Å; P548-F558 HydrophobicContact CG-CD2 4.31Å; H549-F558 HydrophobicContact CB-CE1 4.26Å; L552-F558 HydrophobicContact CB-CE1 4.41Å; L552-F558 HydrophobicContact CD1-CE1 4.12Å; F558-I569 HydrophobicContact CD1-CG2 4.02Å; F558-F570 WeakPolarHBondContact CA-O 3.42Å; F558-A571 HydrophobicContact CD1-CB 3.82Å; F558-A571 HydrophobicContact CD2-CB 4.21Å; F558-A571 HydrophobicContact CE1-CB 3.87Å; F558-A571 HydrophobicContact CE2-CB 4.26Å; F558-A571 HydrophobicContact CG-CB 4Å; F558-A571 HydrophobicContact CZ-CB 4.09Å; F558-R578 VanDerWaalsContact O-CD 3.27Å; F558-R578 WeakPolarHBondContact O-CD 3.48Å; F558-R578 PolarHBondContact O-NH1 3.21Å
559	F	92.6	Very high	81.6	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	162.9	169.2	62.3	-82.7	0	0	0	109.3	L494 V543 D544 T546 F570 R578 W581 V582 M585	L494-F559 HydrophobicContact CD1-CZ 3.8Å; L494-F559 HydrophobicContact CD2-CE1 3.93Å; L494-F559 HydrophobicContact CD2-CZ 3.99Å; V543-F559 HydrophobicContact CG2-CD2 4.02Å; D544-F559 CarbonylContact O-C 3.54Å; D544-F559 VanDerWaalsContact O-CA 3.24Å; D544-F559 WeakPolarHBondContact O-CA 3.45Å; D544-F559 VanDerWaalsContact O-CB 3.24Å; D544-F559 WeakPolarHBondContact O-CB 3.47Å; T546-F559 VanDerWaalsContact OG1-CA 3.27Å; T546-F559 WeakPolarHBondContact OG1-CA 3.11Å; T546-F559 PolarHBondContact OG1-N 2.86Å; F559-F570 HydrophobicContact CD1-CB 4.08Å; F559-F570 HydrophobicContact CD2-CB 3.89Å; F559-F570 HydrophobicContact CD2-CD2 4.19Å; F559-F570 HydrophobicContact CD2-CG 4.39Å; F559-F570 HydrophobicContact CE1-CB 3.73Å; F559-F570 HydrophobicContact CE2-CB 3.5Å; F559-F570 AromaticContact CE2-CD2 3.82Å; F559-F570 HydrophobicContact CE2-CD2 3.82Å; F559-F570 AromaticContact CE2-CG 3.8Å; F559-F570 HydrophobicContact CE2-CG 3.8Å; F559-F570 HydrophobicContact CG-CB 4.17Å; F559-F570 HydrophobicContact CZ-CB 3.43Å; F559-F570 VanDerWaalsContact CZ-CB 3.43Å; F559-F570 HydrophobicContact CZ-CG 4.03Å; F559-F570 PolarHBondContact N-O 3.25Å; F559-F570 PolarHBondContact O-N 3.35Å; F559-R578 HydrophobicContact CD1-CG 3.85Å; F559-R578 HydrophobicContact CE1-CG 4.44Å; F559-W581 HydrophobicContact CE1-CB 4.18Å; F559-W581 HydrophobicContact CE2-CB 4.37Å; F559-W581 HydrophobicContact CZ-CB 3.72Å; F559-W581 HydrophobicContact CZ-CG 4.15Å; F559-V582 HydrophobicContact CB-CG2 3.77Å; F559-V582 HydrophobicContact CD1-CG2 4.29Å; F559-V582 HydrophobicContact CD2-CG2 3.96Å; F559-V582 HydrophobicContact CG-CG2 3.78Å; F559-M585 HydrophobicContact CE2-SD 3.75Å
560	N	91.7	Very high	82.5	Confident	29 Å²	29	52.3 Å²	52.3	16%	0.155	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	163.2	176.8	67.7	-10.7	0	0	0	112.2	V543 D544 T546 V562 V568	V543-N560 VanDerWaalsContact CA-O 3.27Å; V543-N560 WeakPolarHBondContact CA-O 3.49Å; V543-N560 WeakPolarHBondContact CG2-O 3.36Å; D544-N560 PolarHBondContact N-O 3.14Å; D544-N560 VanDerWaalsContact N-O 3.1Å; D544-N560 PolarHBondContact O-N 2.97Å; D544-N560 PolarHBondContact O-OD1 3.28Å; T546-N560 HydrophobicContact CG2-CB 3.88Å; T546-N560 VanDerWaalsContact CG2-CG 3.4Å; T546-N560 WeakPolarHBondContact CG2-OD1 3.5Å; N560-V562 VanDerWaalsContact ND2-CG2 3.34Å; N560-V562 WeakPolarHBondContact ND2-CG2 3.41Å; N560-V568 CarbonylContact C-O 3.57Å; N560-V568 WeakPolarHBondContact CA-O 3.36Å
561	A	91.8	Very high	83.8	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	131.7	161.9	0	0	0	0	0	109.3	M536 Y541 T542 T567 V568 F570 M585	M536-A561 HydrophobicContact CE-CB 4.42Å; Y541-A561 HydrophobicContact CD1-CB 3.99Å; T542-A561 CarbonylContact O-C 3.58Å; T542-A561 WeakPolarHBondContact O-CA 3.41Å; A561-T567 WeakPolarHBondContact O-CA 3.38Å; A561-V568 PolarHBondContact N-O 2.8Å; A561-V568 PolarHBondContact O-N 3.41Å; A561-F570 HydrophobicContact CB-CE2 4.09Å; A561-M585 HydrophobicContact CB-CE 3.91Å
562	V	88.4	Confident	84.7	Confident	50 Å²	50	42.6 Å²	42.6	30%	0.303	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	133.8	-173.4	-174.8	0	0	0	0	110.5	Y541 T542 N560 T567	Y541-V562 CarbonylContact C-O 3.53Å; Y541-V562 VanDerWaalsContact CA-O 3.24Å; Y541-V562 WeakPolarHBondContact CA-O 3.23Å; T542-V562 PolarHBondContact N-O 3.05Å; T542-V562 PolarHBondContact O-N 3.29Å; N560-V562 VanDerWaalsContact ND2-CG2 3.34Å; N560-V562 WeakPolarHBondContact ND2-CG2 3.41Å; V562-T567 HydrophobicContact CG2-CG2 4.21Å
563	K	86.1	Confident	85	Confident	72 Å²	72	44 Å²	44	31%	0.313	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	161.7	168	179.3	164.1	-173.6	175.5	0	107.8	E539 G540 Y541 G565 D566	E539-K563 WeakPolarHBondContact O-CD 3.43Å; E539-K563 WeakPolarHBondContact O-CE 3.38Å; E539-K563 PolarHBondContact O-NZ 3.39Å; G540-K563 WeakPolarHBondContact O-CB 3.4Å; G540-K563 VanDerWaalsContact O-CG 3.28Å; G540-K563 WeakPolarHBondContact O-CG 3.08Å; Y541-K563 HydrophobicContact CD1-CB 3.69Å; Y541-K563 HydrophobicContact CD2-CB 4.03Å; Y541-K563 HydrophobicContact CD2-CD 3.92Å; Y541-K563 HydrophobicContact CE1-CB 3.67Å; Y541-K563 HydrophobicContact CE2-CB 4.03Å; Y541-K563 HydrophobicContact CE2-CD 3.77Å; Y541-K563 HydrophobicContact CG-CB 3.87Å; K563-G565 PolarHBondContact O-N 3.11Å; K563-D566 PolarHBondContact N-O 2.83Å; K563-D566 VanDerWaalsContact N-O 3.1Å; K563-D566 PolarHBondContact O-N 2.71Å
564	E	78.3	Confident	85.8	Confident	193 Å²	193	40 Å²	40	90%	0.902	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.4	117.8	175.3	-64.2	-166.6	160.7	0	0	110.8	D566	E564-D566 PolarHBondContact O-N 2.68Å
565	G	76.9	Confident	86.6	Confident	66 Å²	66	41 Å²	41	68%	0.68	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	71	18.7	-176.9	0	0	0	0	0	116.4	K563	K563-G565 PolarHBondContact O-N 3.11Å
566	D	86.9	Confident	87.1	Confident	2 Å²	2	46 Å²	46	1%	0.011	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	152.7	167.6	-151.2	-19.1	0	0	0	112.4	Q499 K500 Y541 K563 E564	Q499-D566 WeakPolarHBondContact CB-OD1 3.26Å; K500-D566 VanDerWaalsContact CB-OD2 3.3Å; K500-D566 WeakPolarHBondContact CB-OD2 3.36Å; K500-D566 WeakPolarHBondContact CD-OD2 3.26Å; K500-D566 WeakPolarHBondContact CE-OD2 3.5Å; K500-D566 WeakPolarHBondContact CG-OD2 3.41Å; K500-D566 IonicContact NZ-OD2 2.77Å; Y541-D566 HydrophobicContact CE1-CB 4.46Å; Y541-D566 PolarHBondContact OH-OD2 2.88Å; K563-D566 PolarHBondContact N-O 2.83Å; K563-D566 VanDerWaalsContact N-O 3.1Å; K563-D566 PolarHBondContact O-N 2.71Å; E564-D566 PolarHBondContact O-N 2.68Å
567	T	88.2	Confident	87.5	Confident	44 Å²	44	44.1 Å²	44.1	27%	0.27	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	131.2	175.8	-63	0	0	0	0	109.7	G498 Q499 A561 V562	G498-T567 WeakPolarHBondContact CA-O 3.43Å; Q499-T567 PolarHBondContact N-O 2.66Å; A561-T567 WeakPolarHBondContact O-CA 3.38Å; V562-T567 HydrophobicContact CG2-CG2 4.21Å
568	V	91.1	Very high	87.7	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	118.6	175.7	-171.6	0	0	0	0	109.2	L497 V501 W502 M536 N560 A561 F570	L497-V568 CarbonylContact O-C 3.51Å; L497-V568 WeakPolarHBondContact O-CA 3.25Å; V501-V568 HydrophobicContact CG2-CG2 4.29Å; W502-V568 HydrophobicContact CE3-CG1 3.97Å; W502-V568 HydrophobicContact CZ3-CG1 4.41Å; M536-V568 HydrophobicContact CE-CG2 4.21Å; M536-V568 HydrophobicContact SD-CB 4.47Å; M536-V568 HydrophobicContact SD-CG2 3.56Å; M536-V568 VanDerWaalsContact SD-CG2 3.56Å; N560-V568 CarbonylContact C-O 3.57Å; N560-V568 WeakPolarHBondContact CA-O 3.36Å; A561-V568 PolarHBondContact N-O 2.8Å; A561-V568 PolarHBondContact O-N 3.41Å; V568-F570 HydrophobicContact CB-CE2 3.93Å; V568-F570 HydrophobicContact CB-CZ 4.27Å; V568-F570 HydrophobicContact CG1-CD2 4.21Å; V568-F570 HydrophobicContact CG1-CE1 4.13Å; V568-F570 HydrophobicContact CG1-CE2 3.59Å; V568-F570 HydrophobicContact CG1-CZ 3.54Å
569	I	90.8	Very high	87.6	Confident	26 Å²	26	43.6 Å²	43.6	13%	0.133	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	133.3	174.6	-63	164.9	0	0	0	108.2	A496 L497 W505 F558	A496-I569 CarbonylContact C-O 3.5Å; A496-I569 VanDerWaalsContact CA-O 3.3Å; A496-I569 WeakPolarHBondContact CA-O 3.03Å; L497-I569 PolarHBondContact N-O 3.03Å; L497-I569 PolarHBondContact O-N 3.26Å; W505-I569 HydrophobicContact CZ3-CG2 4.3Å; F558-I569 HydrophobicContact CD1-CG2 4.02Å
570	F	92.3	Very high	87.4	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	154.3	174.6	-63.9	-85.7	0	0	0	110.7	L494 Y495 A496 W502 F510 M522 F558 F559 A561 V568 M585	L494-F570 HydrophobicContact CB-CD1 4.39Å; L494-F570 HydrophobicContact CD1-CB 4.46Å; L494-F570 HydrophobicContact CD1-CD1 3.82Å; L494-F570 HydrophobicContact CD1-CE1 4.46Å; L494-F570 HydrophobicContact CD1-CG 4.39Å; Y495-F570 CarbonylContact O-C 3.58Å; Y495-F570 VanDerWaalsContact O-CA 3.27Å; Y495-F570 WeakPolarHBondContact O-CA 3.49Å; A496-F570 HydrophobicContact CB-CD1 3.71Å; A496-F570 HydrophobicContact CB-CE1 3.81Å; W502-F570 HydrophobicContact CE3-CZ 4.45Å; W502-F570 HydrophobicContact CZ3-CE1 4.43Å; W502-F570 HydrophobicContact CZ3-CZ 4.11Å; F510-F570 HydrophobicContact CE1-CE1 4Å; F510-F570 HydrophobicContact CZ-CE1 4.11Å; M522-F570 HydrophobicContact CE-CE1 4.45Å; M522-F570 HydrophobicContact CE-CZ 4.34Å; M522-F570 HydrophobicContact CG-CE1 4.47Å; M522-F570 HydrophobicContact CG-CZ 4.3Å; F558-F570 WeakPolarHBondContact CA-O 3.42Å; F559-F570 HydrophobicContact CD1-CB 4.08Å; F559-F570 HydrophobicContact CD2-CB 3.89Å; F559-F570 HydrophobicContact CD2-CD2 4.19Å; F559-F570 HydrophobicContact CD2-CG 4.39Å; F559-F570 HydrophobicContact CE1-CB 3.73Å; F559-F570 HydrophobicContact CE2-CB 3.5Å; F559-F570 AromaticContact CE2-CD2 3.82Å; F559-F570 HydrophobicContact CE2-CD2 3.82Å; F559-F570 AromaticContact CE2-CG 3.8Å; F559-F570 HydrophobicContact CE2-CG 3.8Å; F559-F570 HydrophobicContact CG-CB 4.17Å; F559-F570 HydrophobicContact CZ-CB 3.43Å; F559-F570 VanDerWaalsContact CZ-CB 3.43Å; F559-F570 HydrophobicContact CZ-CG 4.03Å; F559-F570 PolarHBondContact N-O 3.25Å; F559-F570 PolarHBondContact O-N 3.35Å; A561-F570 HydrophobicContact CB-CE2 4.09Å; V568-F570 HydrophobicContact CB-CE2 3.93Å; V568-F570 HydrophobicContact CB-CZ 4.27Å; V568-F570 HydrophobicContact CG1-CD2 4.21Å; V568-F570 HydrophobicContact CG1-CE1 4.13Å; V568-F570 HydrophobicContact CG1-CE2 3.59Å; V568-F570 HydrophobicContact CG1-CZ 3.54Å; F570-M585 HydrophobicContact CE2-CE 4.22Å
571	A	91.3	Very high	87.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	141.5	165.1	0	0	0	0	0	112.4	Y495 W505 M557 F558	Y495-A571 PolarHBondContact N-O 3.37Å; Y495-A571 PolarHBondContact O-N 3.34Å; W505-A571 HydrophobicContact CH2-CB 3.66Å; W505-A571 HydrophobicContact CZ2-CB 4.03Å; M557-A571 VanDerWaalsContact O-CA 3.26Å; M557-A571 WeakPolarHBondContact O-CA 3.3Å; F558-A571 HydrophobicContact CD1-CB 3.82Å; F558-A571 HydrophobicContact CD2-CB 4.21Å; F558-A571 HydrophobicContact CE1-CB 3.87Å; F558-A571 HydrophobicContact CE2-CB 4.26Å; F558-A571 HydrophobicContact CG-CB 4Å; F558-A571 HydrophobicContact CZ-CB 4.09Å
572	S	89.6	Confident	87.3	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	161.8	167.8	57.6	0	0	0	0	110.3	G555 C556 M557 D574 D577 R578	G555-S572 CarbonylContact C-O 3.57Å; G555-S572 WeakPolarHBondContact CA-O 3.48Å; C556-S572 PolarHBondContact N-O 2.82Å; M557-S572 PolarHBondContact N-O 3.24Å; M557-S572 VanDerWaalsContact N-O 3.09Å; M557-S572 PolarHBondContact O-N 3.09Å; S572-D574 VanDerWaalsContact C-N 3.34Å; S572-D574 WeakPolarHBondContact CB-O 3.28Å; S572-D574 PolarHBondContact OG-O 2.59Å; S572-D577 WeakPolarHBondContact CB-OD2 3.36Å; S572-R578 WeakPolarHBondContact OG-CB 3.28Å
573	D	85.9	Confident	87.3	Confident	74 Å²	74	47.4 Å²	47.4	40%	0.396	25%	0.25	S	S	.	.	S	Bend	trans	-83.6	-12.6	172.2	-61.6	-47.5	0	0	0	112.7	K507 G555	K507-D573 IonicContact NZ-OD2 2.68Å; K507-D573 PolarHBondContact NZ-OD2 3.11Å; G555-D573 WeakPolarHBondContact CA-OD1 3.29Å; G555-D573 PolarHBondContact N-OD1 3.26Å; G555-D573 VanDerWaalsContact N-OD1 3.12Å
574	D	85.5	Confident	87.4	Confident	88 Å²	88	44.5 Å²	44.5	47%	0.471	24%	0.24	S	C	.	.	S	Bend	trans	-131.5	150.8	-176.7	174.3	66.5	0	0	0	112.3	S572 Q576 D577 R578	S572-D574 VanDerWaalsContact C-N 3.34Å; S572-D574 WeakPolarHBondContact CB-O 3.28Å; S572-D574 PolarHBondContact OG-O 2.59Å; D574-Q576 WeakPolarHBondContact OD2-CA 3.48Å; D574-Q576 VanDerWaalsContact OD2-CB 3.31Å; D574-Q576 WeakPolarHBondContact OD2-CB 3.19Å; D574-Q576 PolarHBondContact OD2-N 3.41Å; D574-D577 HydrophobicContact CB-CB 4.21Å; D574-D577 PolarHBondContact OD2-N 3.44Å; D574-R578 PolarHBondContact O-N 3.29Å; D574-R578 VanDerWaalsContact O-N 3.17Å
575	E	83.8	Confident	88	Confident	51 Å²	51	35.3 Å²	35.3	24%	0.238	20%	0.197	C	C	.	.	H	α-helix	trans	-80	-36.2	-176.9	-178.8	59	-175	0	0	113.6	M557 D577 R578 I579	M557-E575 WeakPolarHBondContact CB-OE2 3.4Å; M557-E575 HydrophobicContact CE-CB 4.26Å; M557-E575 HydrophobicContact CG-CB 4.16Å; M557-E575 VanDerWaalsContact CG-OE2 3.3Å; M557-E575 WeakPolarHBondContact CG-OE2 3.42Å; E575-D577 VanDerWaalsContact C-N 3.32Å; E575-R578 WeakPolarHBondContact O-CB 3.45Å; E575-R578 PolarHBondContact O-N 3.22Å; E575-R578 IonicContact OE1-CZ 3.95Å; E575-R578 IonicContact OE1-NE 2.72Å; E575-R578 PolarHBondContact OE1-NE 3.47Å; E575-R578 IonicContact OE1-NH2 3.56Å; E575-R578 PolarHBondContact OE1-NH2 3.2Å; E575-R578 IonicContact OE2-CZ 3.03Å; E575-R578 IonicContact OE2-NE 3.17Å; E575-R578 PolarHBondContact OE2-NE 3.07Å; E575-R578 IonicContact OE2-NH2 3.48Å; E575-R578 PolarHBondContact OE2-NH2 2.88Å; E575-I579 HydrophobicContact CG-CD1 4.06Å; E575-I579 WeakPolarHBondContact O-CG1 3.45Å; E575-I579 PolarHBondContact O-N 2.83Å
576	Q	85.4	Confident	88.5	Confident	118 Å²	118	34 Å²	34	55%	0.551	17%	0.171	S	C	*	.	H	α-helix	trans	-68.2	-37.9	177.1	-169.3	68.1	9.3	0	0	110.1	D574 I579 L580	D574-Q576 WeakPolarHBondContact OD2-CA 3.48Å; D574-Q576 VanDerWaalsContact OD2-CB 3.31Å; D574-Q576 WeakPolarHBondContact OD2-CB 3.19Å; D574-Q576 PolarHBondContact OD2-N 3.41Å; Q576-I579 PolarHBondContact O-N 3.14Å; Q576-L580 VanDerWaalsContact O-CG 3.28Å; Q576-L580 WeakPolarHBondContact O-CG 3.49Å; Q576-L580 PolarHBondContact O-N 3.28Å
577	D	86.2	Confident	88.4	Confident	37 Å²	37	37.6 Å²	37.6	20%	0.198	19%	0.185	C	C	.	.	H	α-helix	trans	-60.2	-44.6	169.4	-164	62.9	0	0	0	111.3	H490 S572 D574 E575 I579 L580 W581	H490-D577 IonicContact NE2-OD1 3.35Å; S572-D577 WeakPolarHBondContact CB-OD2 3.36Å; D574-D577 HydrophobicContact CB-CB 4.21Å; D574-D577 PolarHBondContact OD2-N 3.44Å; E575-D577 VanDerWaalsContact C-N 3.32Å; D577-I579 PolarHBondContact O-N 2.75Å; D577-L580 PolarHBondContact O-N 3.4Å; D577-W581 PolarHBondContact O-N 2.93Å; D577-W581 VanDerWaalsContact OD2-CD1 3.31Å; D577-W581 PolarHBondContact OD2-NE1 3.19Å
578	R	88.9	Confident	88.3	Confident	28 Å²	28	35.7 Å²	35.7	11%	0.106	17%	0.173	C	C	.	.	H	α-helix	trans	-56.5	-49.9	174.6	-178.7	167.9	67.6	155.6	2.4	111.7	Y545 M557 F558 F559 S572 D574 E575 L580 W581 V582	Y545-R578 HydrophobicContact CD1-CG 4.28Å; Y545-R578 HydrophobicContact CE1-CG 4.03Å; M557-R578 HydrophobicContact CB-CB 4.11Å; F558-R578 VanDerWaalsContact O-CD 3.27Å; F558-R578 WeakPolarHBondContact O-CD 3.48Å; F558-R578 PolarHBondContact O-NH1 3.21Å; F559-R578 HydrophobicContact CD1-CG 3.85Å; F559-R578 HydrophobicContact CE1-CG 4.44Å; S572-R578 WeakPolarHBondContact OG-CB 3.28Å; D574-R578 PolarHBondContact O-N 3.29Å; D574-R578 VanDerWaalsContact O-N 3.17Å; E575-R578 WeakPolarHBondContact O-CB 3.45Å; E575-R578 PolarHBondContact O-N 3.22Å; E575-R578 IonicContact OE1-CZ 3.95Å; E575-R578 IonicContact OE1-NE 2.72Å; E575-R578 PolarHBondContact OE1-NE 3.47Å; E575-R578 IonicContact OE1-NH2 3.56Å; E575-R578 PolarHBondContact OE1-NH2 3.2Å; E575-R578 IonicContact OE2-CZ 3.03Å; E575-R578 IonicContact OE2-NE 3.17Å; E575-R578 PolarHBondContact OE2-NE 3.07Å; E575-R578 IonicContact OE2-NH2 3.48Å; E575-R578 PolarHBondContact OE2-NH2 2.88Å; R578-L580 VanDerWaalsContact C-N 3.3Å; R578-L580 PolarHBondContact O-N 3.44Å; R578-W581 PolarHBondContact O-N 2.97Å; R578-V582 HydrophobicContact CG-CG2 4.17Å; R578-V582 WeakPolarHBondContact O-CG2 3.45Å; R578-V582 PolarHBondContact O-N 3.3Å
579	I	88.1	Confident	88	Confident	38 Å²	38	36.7 Å²	36.7	20%	0.195	18%	0.179	C	C	.	.	H	α-helix	trans	-61	-41.7	-178.2	-68.7	165.4	0	0	0	110.5	E575 Q576 D577 Q583	E575-I579 HydrophobicContact CG-CD1 4.06Å; E575-I579 WeakPolarHBondContact O-CG1 3.45Å; E575-I579 PolarHBondContact O-N 2.83Å; Q576-I579 PolarHBondContact O-N 3.14Å; D577-I579 PolarHBondContact O-N 2.75Å; I579-Q583 HydrophobicContact CG2-CG 4.49Å; I579-Q583 VanDerWaalsContact CG2-NE2 3.31Å; I579-Q583 WeakPolarHBondContact O-CB 3.46Å; I579-Q583 WeakPolarHBondContact O-CG 3.43Å; I579-Q583 PolarHBondContact O-N 3.11Å
580	L	88.8	Confident	87.3	Confident	75 Å²	75	35.8 Å²	35.8	39%	0.393	18%	0.176	S	C	.	.	H	α-helix	trans	-66.5	-41.3	176.5	-69.6	170.5	0	0	0	112.5	Q576 D577 R578 A584	Q576-L580 VanDerWaalsContact O-CG 3.28Å; Q576-L580 WeakPolarHBondContact O-CG 3.49Å; Q576-L580 PolarHBondContact O-N 3.28Å; D577-L580 PolarHBondContact O-N 3.4Å; R578-L580 VanDerWaalsContact C-N 3.3Å; R578-L580 PolarHBondContact O-N 3.44Å; L580-A584 VanDerWaalsContact O-CB 3.25Å; L580-A584 WeakPolarHBondContact O-CB 3.47Å; L580-A584 PolarHBondContact O-N 3.37Å
581	W	91.3	Very high	86.7	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.9	-49.6	174.6	-86	110.5	0	0	0	112.5	H490 L494 F510 L512 M522 F559 D577 R578 Q583 A584 M585	H490-W581 HydrophobicContact CB-CZ3 4.47Å; H490-W581 AromaticContact CD2-CD2 3.36Å; H490-W581 AromaticContact CD2-CE2 3.33Å; H490-W581 AromaticContact CD2-CE3 3.63Å; H490-W581 AromaticContact CD2-CG 3.93Å; H490-W581 AromaticContact CD2-CH2 3.89Å; H490-W581 AromaticContact CD2-CZ2 3.65Å; H490-W581 AromaticContact CD2-CZ3 3.87Å; H490-W581 AromaticContact CD2-NE1 3.75Å; H490-W581 AromaticContact NE2-CD1 3.83Å; H490-W581 AromaticContact NE2-CD2 3.89Å; H490-W581 AromaticContact NE2-CE2 3.66Å; H490-W581 AromaticContact NE2-NE1 3.57Å; L494-W581 HydrophobicContact CD1-CD2 3.74Å; L494-W581 HydrophobicContact CD1-CE3 4.11Å; L494-W581 HydrophobicContact CD1-CG 4.19Å; L494-W581 HydrophobicContact CD1-CH2 4.21Å; L494-W581 HydrophobicContact CD1-CZ2 3.82Å; L494-W581 HydrophobicContact CD1-CZ3 4.35Å; L494-W581 HydrophobicContact CD2-CD2 4.49Å; L494-W581 HydrophobicContact CD2-CG 4.24Å; L494-W581 HydrophobicContact CG-CD2 4.33Å; L494-W581 HydrophobicContact CG-CZ2 4.01Å; F510-W581 HydrophobicContact CB-CH2 3.62Å; F510-W581 HydrophobicContact CB-CZ2 3.96Å; L512-W581 HydrophobicContact CB-CZ3 4.21Å; M522-W581 HydrophobicContact CE-CE3 3.99Å; M522-W581 HydrophobicContact CE-CH2 4.5Å; M522-W581 HydrophobicContact CE-CZ3 3.64Å; M522-W581 HydrophobicContact SD-CH2 4.24Å; M522-W581 HydrophobicContact SD-CZ3 3.84Å; F559-W581 HydrophobicContact CE1-CB 4.18Å; F559-W581 HydrophobicContact CE2-CB 4.37Å; F559-W581 HydrophobicContact CZ-CB 3.72Å; F559-W581 HydrophobicContact CZ-CG 4.15Å; D577-W581 PolarHBondContact O-N 2.93Å; D577-W581 VanDerWaalsContact OD2-CD1 3.31Å; D577-W581 PolarHBondContact OD2-NE1 3.19Å; R578-W581 PolarHBondContact O-N 2.97Å; W581-Q583 PolarHBondContact O-N 3.4Å; W581-A584 PolarHBondContact O-N 3.04Å; W581-M585 WeakPolarHBondContact O-CB 3.42Å; W581-M585 WeakPolarHBondContact O-CG 3.22Å; W581-M585 PolarHBondContact O-N 2.88Å
582	V	90.5	Very high	85.6	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.012	21%	0.206	C	C	.	.	H	α-helix	trans	-64.1	-40.7	179.9	175.2	0	0	0	0	110.8	V543 Y545 F559 R578 M585 Y586 P595	V543-V582 HydrophobicContact CG2-CG1 4.23Å; V543-V582 HydrophobicContact CG2-CG2 4.28Å; Y545-V582 HydrophobicContact CD1-CG2 4.3Å; Y545-V582 HydrophobicContact CD2-CG1 4.29Å; Y545-V582 HydrophobicContact CE1-CB 4.23Å; Y545-V582 HydrophobicContact CE1-CG1 4.36Å; Y545-V582 HydrophobicContact CE1-CG2 3.94Å; Y545-V582 HydrophobicContact CE2-CB 4.39Å; Y545-V582 HydrophobicContact CE2-CG1 3.69Å; F559-V582 HydrophobicContact CB-CG2 3.77Å; F559-V582 HydrophobicContact CD1-CG2 4.29Å; F559-V582 HydrophobicContact CD2-CG2 3.96Å; F559-V582 HydrophobicContact CG-CG2 3.78Å; R578-V582 HydrophobicContact CG-CG2 4.17Å; R578-V582 WeakPolarHBondContact O-CG2 3.45Å; R578-V582 PolarHBondContact O-N 3.3Å; V582-M585 PolarHBondContact O-N 3.02Å; V582-Y586 WeakPolarHBondContact O-CB 3.49Å; V582-Y586 PolarHBondContact O-N 3.02Å; V582-P595 HydrophobicContact CG1-CB 3.7Å; V582-P595 HydrophobicContact CG1-CG 3.96Å
583	Q	87.7	Confident	84.9	Confident	82 Å²	82	45 Å²	45	38%	0.383	23%	0.225	S	C	.	.	H	α-helix	trans	-64	-41.1	173.8	-73.9	178.4	17.7	0	0	112.7	I579 W581 R587	I579-Q583 HydrophobicContact CG2-CG 4.49Å; I579-Q583 VanDerWaalsContact CG2-NE2 3.31Å; I579-Q583 WeakPolarHBondContact O-CB 3.46Å; I579-Q583 WeakPolarHBondContact O-CG 3.43Å; I579-Q583 PolarHBondContact O-N 3.11Å; W581-Q583 PolarHBondContact O-N 3.4Å; Q583-R587 WeakPolarHBondContact O-CG 3.41Å; Q583-R587 PolarHBondContact O-N 3.28Å; Q583-R587 VanDerWaalsContact O-N 3.12Å
584	A	88.4	Confident	84.6	Confident	11 Å²	11	48.6 Å²	48.6	9%	0.091	24%	0.237	C	C	.	.	H	α-helix	trans	-68.2	-40.3	178.1	0	0	0	0	0	111.9	H490 L512 L580 W581 R587 A588	H490-A584 HydrophobicContact CB-CB 3.71Å; L512-A584 HydrophobicContact CD2-CB 3.78Å; L512-A584 WeakPolarHBondContact CD2-O 3.25Å; L580-A584 VanDerWaalsContact O-CB 3.25Å; L580-A584 WeakPolarHBondContact O-CB 3.47Å; L580-A584 PolarHBondContact O-N 3.37Å; W581-A584 PolarHBondContact O-N 3.04Å; A584-R587 PolarHBondContact O-N 2.91Å; A584-A588 WeakPolarHBondContact O-CB 3.35Å; A584-A588 PolarHBondContact O-N 3.3Å; A584-A588 VanDerWaalsContact O-N 3.08Å
585	M	89.9	Confident	84.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-70.7	-34.5	175.1	-73.3	-175.3	66.5	0	0	112.8	M522 L538 V543 F559 A561 F570 W581 V582 A588 T589	M522-M585 HydrophobicContact CE-CE 4.05Å; M522-M585 HydrophobicContact CE-CG 4Å; M522-M585 HydrophobicContact CE-SD 3.35Å; M522-M585 WeakPolarHBondContact CE-SD 3.33Å; L538-M585 HydrophobicContact CD1-CE 4.41Å; L538-M585 HydrophobicContact CD1-CG 4.45Å; L538-M585 HydrophobicContact CD2-CE 4.04Å; V543-M585 HydrophobicContact CB-CB 4.09Å; V543-M585 HydrophobicContact CB-CE 4.41Å; V543-M585 HydrophobicContact CG1-CB 3.8Å; V543-M585 HydrophobicContact CG2-CB 4.07Å; V543-M585 HydrophobicContact CG2-CE 4.32Å; V543-M585 HydrophobicContact CG2-SD 4.4Å; F559-M585 HydrophobicContact CE2-SD 3.75Å; A561-M585 HydrophobicContact CB-CE 3.91Å; F570-M585 HydrophobicContact CE2-CE 4.22Å; W581-M585 WeakPolarHBondContact O-CB 3.42Å; W581-M585 WeakPolarHBondContact O-CG 3.22Å; W581-M585 PolarHBondContact O-N 2.88Å; V582-M585 PolarHBondContact O-N 3.02Å; M585-A588 PolarHBondContact O-N 3.37Å; M585-T589 WeakPolarHBondContact O-CB 3.37Å; M585-T589 WeakPolarHBondContact O-CG2 3.45Å; M585-T589 PolarHBondContact O-N 3.33Å; M585-T589 PolarHBondContact O-OG1 3.13Å
586	Y	87.6	Confident	84.2	Confident	38 Å²	38	47.6 Å²	47.6	15%	0.149	24%	0.237	C	C	.	.	H	α-helix	trans	-60.9	-44.5	172.3	170.5	-108.4	0	0	0	111.5	R275 V582 A588 T589 G590 Q591 Y593 K594 P595	R275-Y586 PolarHBondContact NH1-OH 2.97Å; V582-Y586 WeakPolarHBondContact O-CB 3.49Å; V582-Y586 PolarHBondContact O-N 3.02Å; Y586-A588 VanDerWaalsContact C-N 3.29Å; Y586-A588 PolarHBondContact O-N 3.46Å; Y586-T589 PolarHBondContact O-OG1 3.24Å; Y586-G590 PolarHBondContact O-N 3.23Å; Y586-Q591 HydrophobicContact CD2-CG 3.64Å; Y586-Q591 HydrophobicContact CE2-CG 3.81Å; Y586-Q591 WeakPolarHBondContact CE2-O 3.45Å; Y586-Y593 WeakPolarHBondContact CE2-O 3.03Å; Y586-K594 HydrophobicContact CE1-CG 4.4Å; Y586-K594 HydrophobicContact CE2-CB 4.34Å; Y586-P595 HydrophobicContact CD2-CG 4.18Å
587	R	85.6	Confident	83.6	Confident	78 Å²	78	44.4 Å²	44.4	29%	0.294	23%	0.227	S	C	.	.	H	α-helix	trans	-65.9	-28.1	173.6	-70.1	173.5	177.3	156.9	-6.8	113.6	E268 A271 R274 Q583 A584	E268-R587 VanDerWaalsContact CD-NH2 3.26Å; E268-R587 HydrophobicContact CG-CG 4.02Å; E268-R587 IonicContact OE1-CZ 2.72Å; E268-R587 IonicContact OE1-NE 2.57Å; E268-R587 PolarHBondContact OE1-NE 3.22Å; E268-R587 IonicContact OE1-NH2 2.9Å; E268-R587 PolarHBondContact OE1-NH2 2.88Å; E268-R587 IonicContact OE2-NH2 2.78Å; E268-R587 PolarHBondContact OE2-NH2 3.03Å; A271-R587 WeakPolarHBondContact CB-O 3.36Å; R274-R587 PolarHBondContact NH2-O 3.39Å; Q583-R587 WeakPolarHBondContact O-CG 3.41Å; Q583-R587 PolarHBondContact O-N 3.28Å; Q583-R587 VanDerWaalsContact O-N 3.12Å; A584-R587 PolarHBondContact O-N 2.91Å
588	A	86.3	Confident	82.4	Confident	4 Å²	4	46.1 Å²	46.1	3%	0.033	25%	0.246	C	C	.	.	H	α-helix	trans	-81.4	-51	178.9	0	0	0	0	0	112.6	R274 L512 F520 L538 A584 M585 Y586 G590	R274-A588 PolarHBondContact NH2-O 2.86Å; L512-A588 HydrophobicContact CD1-CB 4.04Å; L512-A588 HydrophobicContact CD2-CB 4.11Å; F520-A588 HydrophobicContact CB-CB 3.74Å; F520-A588 HydrophobicContact CD1-CB 3.52Å; F520-A588 HydrophobicContact CD2-CB 4.2Å; F520-A588 WeakPolarHBondContact CD2-O 3.3Å; F520-A588 HydrophobicContact CE1-CB 4.13Å; F520-A588 HydrophobicContact CG-CB 3.56Å; L538-A588 HydrophobicContact CD1-CB 3.84Å; A584-A588 WeakPolarHBondContact O-CB 3.35Å; A584-A588 PolarHBondContact O-N 3.3Å; A584-A588 VanDerWaalsContact O-N 3.08Å; M585-A588 PolarHBondContact O-N 3.37Å; Y586-A588 VanDerWaalsContact C-N 3.29Å; Y586-A588 PolarHBondContact O-N 3.46Å; A588-G590 PolarHBondContact O-N 3Å
589	T	85.1	Confident	80.5	Confident	20 Å²	20	51.9 Å²	51.9	12%	0.123	28%	0.278	C	S	.	.	H	α-helix	trans	-60.4	-43.9	176	51	0	0	0	0	111.8	L538 Y541 M585 Y586 Q591	L538-T589 HydrophobicContact CB-CG2 4.36Å; Y541-T589 WeakPolarHBondContact O-CB 3.24Å; Y541-T589 WeakPolarHBondContact O-CG2 3.36Å; M585-T589 WeakPolarHBondContact O-CB 3.37Å; M585-T589 WeakPolarHBondContact O-CG2 3.45Å; M585-T589 PolarHBondContact O-N 3.33Å; M585-T589 PolarHBondContact O-OG1 3.13Å; Y586-T589 PolarHBondContact O-OG1 3.24Å; T589-Q591 VanDerWaalsContact C-N 3.29Å; T589-Q591 PolarHBondContact OG1-OE1 3.34Å
590	G	75.6	Confident	78.3	Confident	7 Å²	7	57.4 Å²	57.4	7%	0.072	30%	0.303	C	S	.	.			trans	69	27.7	-172.1	0	0	0	0	0	112.8	R275 Y586 A588	R275-G590 WeakPolarHBondContact CG-O 3.28Å; Y586-G590 PolarHBondContact O-N 3.23Å; A588-G590 PolarHBondContact O-N 3Å
591	Q	78.6	Confident	75.7	Confident	12 Å²	12	60.5 Å²	60.5	6%	0.056	33%	0.325	C	S	.	.			trans	-60.2	146.7	174.6	75.2	-163.9	64.4	0	0	111.6	R275 T542 V543 Y586 T589 Y593	R275-Q591 VanDerWaalsContact CD-O 3.3Å; R275-Q591 WeakPolarHBondContact CD-O 3.47Å; T542-Q591 HydrophobicContact CG2-CB 3.85Å; V543-Q591 VanDerWaalsContact CG1-OE1 3.28Å; V543-Q591 PolarHBondContact O-NE2 3.33Å; V543-Q591 PolarHBondContact O-OE1 3.14Å; Y586-Q591 HydrophobicContact CD2-CG 3.64Å; Y586-Q591 HydrophobicContact CE2-CG 3.81Å; Y586-Q591 WeakPolarHBondContact CE2-O 3.45Å; T589-Q591 VanDerWaalsContact C-N 3.29Å; T589-Q591 PolarHBondContact OG1-OE1 3.34Å; Q591-Y593 WeakPolarHBondContact CG-O 3.43Å; Q591-Y593 PolarHBondContact NE2-O 2.88Å; Q591-Y593 PolarHBondContact O-N 3.17Å
592	S	68.3	Low	73	Confident	81 Å²	81	68.4 Å²	68.4	57%	0.566	36%	0.362	S	S	*	.	S	Bend	trans	-64.2	-33.8	-171.7	57.6	0	0	0	0	115.3
593	Y	75.9	Confident	70.3	Confident	100 Å²	100	77.9 Å²	77.9	39%	0.392	40%	0.403	S	S	.	.	S	Bend	trans	-105.6	138.4	-176.1	65.9	-85.3	0	0	0	112.2	T542 D544 Y586 Q591 P595	T542-Y593 WeakPolarHBondContact CB-OH 3.32Å; T542-Y593 HydrophobicContact CG2-CE1 4.19Å; T542-Y593 PolarHBondContact OG1-OH 2.72Å; D544-Y593 WeakPolarHBondContact OD2-CE2 3.3Å; D544-Y593 VanDerWaalsContact OD2-CZ 3.3Å; D544-Y593 PolarHBondContact OD2-OH 2.68Å; Y586-Y593 WeakPolarHBondContact CE2-O 3.03Å; Q591-Y593 WeakPolarHBondContact CG-O 3.43Å; Q591-Y593 PolarHBondContact NE2-O 2.88Å; Q591-Y593 PolarHBondContact O-N 3.17Å; Y593-P595 WeakPolarHBondContact O-CD 3.2Å
594	K	78.8	Confident	67.7	Low	151 Å²	151	82.1 Å²	82.1	66%	0.657	43%	0.427	S	S	*	.			trans	-76.9	126.5	179.4	-174.2	178.2	179.7	178.5	0	110.9	Y586 V596	Y586-K594 HydrophobicContact CE1-CG 4.4Å; Y586-K594 HydrophobicContact CE2-CB 4.34Å; K594-V596 PolarHBondContact O-N 2.86Å
595	P	83.6	Confident	64.8	Low	10 Å²	10	89.2 Å²	89.2	7%	0.065	46%	0.463	C	S	.	.			trans	-60.5	132.2	173.7	-25.7	35.7	0	0	0	111.6	V543 Y545 V582 Y586 Y593	V543-P595 HydrophobicContact CG1-CG 4.31Å; V543-P595 WeakPolarHBondContact O-CG 3.42Å; Y545-P595 HydrophobicContact CD2-CB 3.89Å; Y545-P595 HydrophobicContact CE2-CB 3.75Å; V582-P595 HydrophobicContact CG1-CB 3.7Å; V582-P595 HydrophobicContact CG1-CG 3.96Å; Y586-P595 HydrophobicContact CD2-CG 4.18Å; Y593-P595 WeakPolarHBondContact O-CD 3.2Å
596	V	77.6	Confident	62.6	Low	107 Å²	107	94.3 Å²	94.3	65%	0.648	50%	0.497	S	S	*	.			trans	-111.8	126.9	177.8	-176.2	0	0	0	0	108.7	Y545 K594 A598	Y545-V596 VanDerWaalsContact CD2-O 3.32Å; Y545-V596 WeakPolarHBondContact CD2-O 3.35Å; K594-V596 PolarHBondContact O-N 2.86Å; V596-A598 PolarHBondContact O-N 3.17Å
597	P	73.8	Confident	60	Low	51 Å²	51	102.4 Å²	102.4	33%	0.331	53%	0.533	S	S	.	.			trans	-59.3	132.7	172.8	-18.7	29	0	0	0	110.3	Y545 I599	Y545-P597 HydrophobicContact CD1-CB 4.49Å; Y545-P597 HydrophobicContact CD2-CG 4.43Å; Y545-P597 HydrophobicContact CE1-CB 4.32Å; Y545-P597 HydrophobicContact CE1-CG 4.17Å; Y545-P597 HydrophobicContact CE2-CB 4.34Å; Y545-P597 HydrophobicContact CE2-CG 3.82Å; P597-I599 PolarHBondContact O-N 2.96Å
598	A	60.5	Low	57.4	Low	73 Å²	73	102.9 Å²	102.9	60%	0.603	56%	0.562	S	S	*	*			trans	-62.3	104.8	173.4	0	0	0	0	0	109.7	V596 Q600	V596-A598 PolarHBondContact O-N 3.17Å; A598-Q600 PolarHBondContact O-N 2.71Å
599	I	48.2	Very low	54.6	Low	149 Å²	149	106.5 Å²	106.5	76%	0.764	60%	0.6	S	S	*	*			trans	-67	108.3	179.7	-59.2	176.7	0	0	0	108	P597 T601	P597-I599 PolarHBondContact O-N 2.96Å; I599-T601 PolarHBondContact O-N 3.16Å; I599-T601 VanDerWaalsContact O-N 3.15Å
600	Q	42.5	Very low	52.6	Low	155 Å²	155	112.2 Å²	112.2	72%	0.724	63%	0.634	S	S	*	*			trans	-59.4	120	169.2	-69.3	-172.5	5.2	0	0	109	A598 Q602	A598-Q600 PolarHBondContact O-N 2.71Å; Q600-Q602 PolarHBondContact O-N 3.41Å
601	T	34.5	Very low	50.7	Low	140 Å²	140	119.6 Å²	119.6	86%	0.859	67%	0.672	S	S	*	*			trans	-71.3	75.2	-180	34.8	0	0	0	0	111.5	I599	I599-T601 PolarHBondContact O-N 3.16Å; I599-T601 VanDerWaalsContact O-N 3.15Å
602	Q	35.2	Very low	48.6	Very low	165 Å²	165	127.3 Å²	127.3	77%	0.771	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-78.9	143.2	170	-66	-154.9	9.5	0	0	111.7	Q600	Q600-Q602 PolarHBondContact O-N 3.41Å
603	K	33.7	Very low	47	Very low	202 Å²	202	126 Å²	126	88%	0.878	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-65.2	152.6	-167.9	-63.8	165.1	-179.9	172.1	0	112.2	N605	K603-N605 PolarHBondContact O-N 3.04Å
604	L	31.6	Very low	45	Very low	171 Å²	171	127.1 Å²	127.1	90%	0.895	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-55.7	124	166.4	-67.8	98.6	0	0	0	111
605	N	28.6	Very low	43.1	Very low	159 Å²	159	123.8 Å²	123.8	85%	0.85	72%	0.715	S	S	*	*			trans	-159.5	128.5	133.3	-124.6	-17.1	0	0	0	110.8	K603	K603-N605 PolarHBondContact O-N 3.04Å
606	P	42.9	Very low	41	Very low	108 Å²	108	129.6 Å²	129.6	70%	0.701	74%	0.741	S	S	*	*			trans	-92.8	127.2	-174.8	33.5	-32.2	0	0	0	113
607	K	33.8	Very low	39.1	Very low	208 Å²	208	128.6 Å²	128.6	90%	0.904	73%	0.732	S	S	*	*			trans	-176.3	121.9	148	-106.7	156.8	-173.6	177.3	0	113.7
608	G	30.8	Very low	37.6	Very low	87 Å²	87	133.6 Å²	133.6	90%	0.897	75%	0.745	S	S	*	*			trans	76	118.4	156	0	0	0	0	0	117
609	G	28	Very low	36.5	Very low	81 Å²	81	132.6 Å²	132.6	84%	0.835	74%	0.737	S	S	*	*			trans	158.9	57.1	175.6	0	0	0	0	0	115	L611	G609-L611 PolarHBondContact O-N 2.88Å
610	T	42.3	Very low	35.9	Very low	139 Å²	139	129.3 Å²	129.3	85%	0.853	72%	0.721	S	S	*	*			trans	-67.8	112.4	172.4	42.6	0	0	0	0	111.1
611	L	35.8	Very low	36	Very low	163 Å²	163	129.8 Å²	129.8	85%	0.853	72%	0.716	S	S	*	*	S	Bend	trans	-169.8	21.8	149.5	-107	166.9	0	0	0	115.6	G609	G609-L611 PolarHBondContact O-N 2.88Å
612	H	34.9	Very low	36.5	Very low	174 Å²	174	125.6 Å²	125.6	81%	0.806	69%	0.686	S	S	*	*			trans	-139.3	110.9	163.9	-89.1	-87.4	0	0	0	108.4
613	A	33	Very low	37.1	Very low	54 Å²	54	124.3 Å²	124.3	45%	0.446	68%	0.68	S	S	.	*			trans	-147	-48.9	-178.8	0	0	0	0	0	113.2	A615 Q616 L617	A613-A615 PolarHBondContact O-N 3.09Å; A613-Q616 PolarHBondContact O-N 3.1Å; A613-Q616 VanDerWaalsContact O-N 3.11Å; A613-L617 HydrophobicContact CB-CD1 4.37Å; A613-L617 PolarHBondContact O-N 2.99Å
614	D	35.3	Very low	37.9	Very low	122 Å²	122	121.5 Å²	121.5	65%	0.652	67%	0.668	S	S	*	*	H	α-helix	trans	-61.2	-43	-169.5	-63.3	-49.8	0	0	0	113.6	Q616 L617 Y618	D614-Q616 PolarHBondContact O-N 3.43Å; D614-L617 PolarHBondContact O-N 2.84Å; D614-Y618 WeakPolarHBondContact O-CD2 3.49Å; D614-Y618 PolarHBondContact O-N 2.56Å; D614-Y618 VanDerWaalsContact O-N 3.17Å
615	A	38.8	Very low	39.1	Very low	81 Å²	81	118.2 Å²	118.2	67%	0.669	65%	0.648	S	S	*	*	H	α-helix	trans	-60.6	-32.6	178.5	0	0	0	0	0	113.3	A613	A613-A615 PolarHBondContact O-N 3.09Å
616	Q	38.8	Very low	40.8	Very low	132 Å²	132	112.8 Å²	112.8	62%	0.617	63%	0.629	S	S	*	*	H	α-helix	trans	-85.3	-30.5	178.2	-75.4	161.7	-59.3	0	0	111.8	A613 D614 Y618 A619 D620	A613-Q616 PolarHBondContact O-N 3.1Å; A613-Q616 VanDerWaalsContact O-N 3.11Å; D614-Q616 PolarHBondContact O-N 3.43Å; Q616-Y618 VanDerWaalsContact C-N 3.26Å; Q616-Y618 PolarHBondContact O-N 2.94Å; Q616-A619 PolarHBondContact O-N 3.36Å; Q616-D620 WeakPolarHBondContact O-CB 3.46Å; Q616-D620 PolarHBondContact O-N 3.02Å
617	L	38.4	Very low	42.3	Very low	87 Å²	87	108.1 Å²	108.1	46%	0.455	60%	0.598	S	S	.	*	H	α-helix	trans	-67.9	-21.2	173.8	-76.4	169.6	0	0	0	113.9	A613 D614 R621	A613-L617 HydrophobicContact CB-CD1 4.37Å; A613-L617 PolarHBondContact O-N 2.99Å; D614-L617 PolarHBondContact O-N 2.84Å; L617-R621 WeakPolarHBondContact O-CG 3.47Å
618	Y	41.8	Very low	44.2	Very low	155 Å²	155	102.5 Å²	102.5	61%	0.608	58%	0.578	S	S	*	*	H	α-helix	trans	-76.4	-50.4	165.7	-81.2	-77.5	0	0	0	111.5	D614 Q616 D620 R621 F622	D614-Y618 WeakPolarHBondContact O-CD2 3.49Å; D614-Y618 PolarHBondContact O-N 2.56Å; D614-Y618 VanDerWaalsContact O-N 3.17Å; Q616-Y618 VanDerWaalsContact C-N 3.26Å; Q616-Y618 PolarHBondContact O-N 2.94Å; Y618-D620 PolarHBondContact O-N 3.3Å; Y618-R621 PolarHBondContact O-N 3.48Å; Y618-F622 WeakPolarHBondContact O-CD2 3.45Å; Y618-F622 PolarHBondContact O-N 3.35Å
619	A	37.3	Very low	46.6	Very low	53 Å²	53	104.3 Å²	104.3	44%	0.438	56%	0.563	S	S	.	*	H	α-helix	trans	-55.9	-45.4	-179.9	0	0	0	0	0	113	Q616 R621 F622 Q623	Q616-A619 PolarHBondContact O-N 3.36Å; A619-R621 PolarHBondContact O-N 2.76Å; A619-F622 PolarHBondContact O-N 3.15Å; A619-F622 VanDerWaalsContact O-N 3.13Å; A619-Q623 PolarHBondContact O-N 2.97Å
620	D	36.4	Very low	49.1	Very low	80 Å²	80	101.6 Å²	101.6	43%	0.428	53%	0.529	S	S	.	.	H	α-helix	trans	-71.1	-10.4	179.4	-174.4	59.8	0	0	0	114.1	Q616 Y618 K624	Q616-D620 WeakPolarHBondContact O-CB 3.46Å; Q616-D620 PolarHBondContact O-N 3.02Å; Y618-D620 PolarHBondContact O-N 3.3Å; D620-K624 VanDerWaalsContact CG-NZ 3.33Å; D620-K624 WeakPolarHBondContact O-CD 3.45Å; D620-K624 WeakPolarHBondContact O-CE 3.45Å; D620-K624 PolarHBondContact O-NZ 3.01Å; D620-K624 VanDerWaalsContact O-NZ 3.08Å; D620-K624 IonicContact OD1-NZ 3.57Å; D620-K624 PolarHBondContact OD1-NZ 2.89Å; D620-K624 IonicContact OD2-NZ 3.95Å; D620-K624 PolarHBondContact OD2-NZ 2.93Å
621	R	44.9	Very low	51	Low	164 Å²	164	96.6 Å²	96.6	62%	0.619	50%	0.496	S	S	*	.	H	α-helix	trans	-90.5	-38.7	165.9	-69.6	-178.7	-162.2	-161.1	7.4	112.1	L617 Y618 A619 K624 H625	L617-R621 WeakPolarHBondContact O-CG 3.47Å; Y618-R621 PolarHBondContact O-N 3.48Å; A619-R621 PolarHBondContact O-N 2.76Å; R621-K624 PolarHBondContact O-N 2.9Å; R621-H625 PolarHBondContact O-ND1 2.82Å
622	F	44.8	Very low	52.9	Low	52 Å²	52	93.1 Å²	93.1	23%	0.228	49%	0.485	C	S	.	.	H	α-helix	trans	-65.5	-42.5	179.2	-92.6	-100.5	0	0	0	112	L256 A260 Y618 A619 K624 H625	L256-F622 HydrophobicContact CB-CE1 4.12Å; L256-F622 HydrophobicContact CD2-CD1 4.25Å; L256-F622 HydrophobicContact CD2-CE1 3.72Å; L256-F622 HydrophobicContact CD2-CE2 4.05Å; L256-F622 HydrophobicContact CD2-CZ 3.61Å; A260-F622 HydrophobicContact CB-CE1 4.4Å; Y618-F622 WeakPolarHBondContact O-CD2 3.45Å; Y618-F622 PolarHBondContact O-N 3.35Å; A619-F622 PolarHBondContact O-N 3.15Å; A619-F622 VanDerWaalsContact O-N 3.13Å; F622-K624 PolarHBondContact O-N 3.48Å; F622-K624 VanDerWaalsContact O-N 3.15Å; F622-H625 PolarHBondContact O-N 2.62Å; F622-H625 VanDerWaalsContact O-N 3.11Å
623	Q	46.9	Very low	55.1	Low	138 Å²	138	85.9 Å²	85.9	65%	0.645	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-58.9	-28.2	178	-75.1	-172.4	-27.8	0	0	113.7	A619 H625	A619-Q623 PolarHBondContact O-N 2.97Å; Q623-H625 PolarHBondContact O-N 3.35Å
624	K	49.6	Very low	57.3	Low	143 Å²	143	87.1 Å²	87.1	62%	0.622	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-75.3	-2.5	179.5	-70	172.3	-175.6	136	0	114.7	D620 R621 F622	D620-K624 VanDerWaalsContact CG-NZ 3.33Å; D620-K624 WeakPolarHBondContact O-CD 3.45Å; D620-K624 WeakPolarHBondContact O-CE 3.45Å; D620-K624 PolarHBondContact O-NZ 3.01Å; D620-K624 VanDerWaalsContact O-NZ 3.08Å; D620-K624 IonicContact OD1-NZ 3.57Å; D620-K624 PolarHBondContact OD1-NZ 2.89Å; D620-K624 IonicContact OD2-NZ 3.95Å; D620-K624 PolarHBondContact OD2-NZ 2.93Å; R621-K624 PolarHBondContact O-N 2.9Å; F622-K624 PolarHBondContact O-N 3.48Å; F622-K624 VanDerWaalsContact O-N 3.15Å
625	H	57	Low	59.6	Low	102 Å²	102	81.9 Å²	81.9	47%	0.472	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-118.1	2	-175	-66.9	87	0	0	0	114.6	L256 R621 F622 Q623 M627	L256-H625 HydrophobicContact CD1-CB 4.36Å; R621-H625 PolarHBondContact O-ND1 2.82Å; F622-H625 PolarHBondContact O-N 2.62Å; F622-H625 VanDerWaalsContact O-N 3.11Å; Q623-H625 PolarHBondContact O-N 3.35Å; H625-M627 PolarHBondContact O-N 2.83Å
626	G	65.9	Low	61.6	Low	45 Å²	45	79.4 Å²	79.4	46%	0.464	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	-0.6	175.8	0	0	0	0	0	116.4	D628	G626-D628 VanDerWaalsContact C-N 3.28Å; G626-D628 PolarHBondContact O-N 2.85Å
627	M	73.1	Confident	63.7	Low	10 Å²	10	81.4 Å²	81.4	5%	0.049	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-18.3	-173.8	-67.2	-65.8	165.5	0	0	114.5	L85 E253 L256 L257 H625 E629 F630 I631	L85-M627 HydrophobicContact CD1-CE 4.14Å; L85-M627 HydrophobicContact CD2-CE 4.18Å; L85-M627 HydrophobicContact CD2-SD 4.31Å; E253-M627 HydrophobicContact CB-CE 4.2Å; E253-M627 HydrophobicContact CG-CE 3.87Å; L256-M627 HydrophobicContact CD1-CG 4.34Å; L257-M627 HydrophobicContact CD2-CB 4.15Å; L257-M627 HydrophobicContact CD2-CG 4.46Å; L257-M627 HydrophobicContact CD2-SD 4.11Å; L257-M627 HydrophobicContact CG-SD 4.39Å; H625-M627 PolarHBondContact O-N 2.83Å; M627-E629 PolarHBondContact O-N 2.93Å; M627-F630 PolarHBondContact O-N 3.1Å; M627-F630 HydrophobicContact SD-CD2 4.06Å; M627-F630 HydrophobicContact SD-CE2 4.24Å; M627-I631 WeakPolarHBondContact O-CD1 3.18Å; M627-I631 WeakPolarHBondContact O-CG1 2.83Å; M627-I631 PolarHBondContact O-N 2.87Å
628	D	73.9	Confident	65.9	Low	90 Å²	90	80.5 Å²	80.5	48%	0.481	41%	0.407	S	S	.	.	H	α-helix	trans	-65.2	-27.5	-176.8	-157.5	32	0	0	0	112.5	G626 I631 S632	G626-D628 VanDerWaalsContact C-N 3.28Å; G626-D628 PolarHBondContact O-N 2.85Å; D628-I631 PolarHBondContact O-N 2.87Å; D628-S632 VanDerWaalsContact O-CB 3.29Å; D628-S632 WeakPolarHBondContact O-CB 3.47Å; D628-S632 PolarHBondContact O-N 2.86Å; D628-S632 PolarHBondContact O-OG 3.39Å
629	E	80.6	Confident	68.1	Low	126 Å²	126	77.8 Å²	77.8	59%	0.589	40%	0.403	S	S	*	.	H	α-helix	trans	-61.1	-50.8	174.4	-172.3	176.6	176.3	0	0	111.4	M627 I631 S632 A633	M627-E629 PolarHBondContact O-N 2.93Å; E629-I631 VanDerWaalsContact C-N 3.28Å; E629-I631 PolarHBondContact O-N 2.79Å; E629-S632 PolarHBondContact O-N 2.68Å; E629-S632 PolarHBondContact O-OG 3.21Å; E629-A633 PolarHBondContact O-N 3.36Å
630	F	82.3	Confident	70.7	Confident	24 Å²	24	76 Å²	76	11%	0.105	39%	0.386	C	S	.	.	H	α-helix	trans	-67.7	-27.6	-179	-51	-68.3	0	0	0	113.3	R82 L85 Q86 V89 M627	R82-F630 HydrophobicContact CB-CE1 4.2Å; R82-F630 HydrophobicContact CB-CZ 4.33Å; R82-F630 HydrophobicContact CG-CE1 4.5Å; R82-F630 HydrophobicContact CG-CZ 4.2Å; L85-F630 HydrophobicContact CB-CD2 4.4Å; L85-F630 HydrophobicContact CB-CE1 4.47Å; L85-F630 HydrophobicContact CB-CE2 4.33Å; L85-F630 HydrophobicContact CB-CZ 4.36Å; L85-F630 HydrophobicContact CD1-CE2 4.1Å; L85-F630 HydrophobicContact CD1-CZ 4.28Å; Q86-F630 HydrophobicContact CB-CD1 3.99Å; Q86-F630 PolarHBondContact NE2-O 3.31Å; V89-F630 HydrophobicContact CG2-CB 3.93Å; M627-F630 PolarHBondContact O-N 3.1Å; M627-F630 HydrophobicContact SD-CD2 4.06Å; M627-F630 HydrophobicContact SD-CE2 4.24Å
631	I	81.2	Confident	73.2	Confident	34 Å²	34	73.9 Å²	73.9	17%	0.174	38%	0.379	C	S	.	.	H	α-helix	trans	-80.6	-42	178.9	-61.6	158.3	0	0	0	110.6	R93 L257 A260 M627 D628 E629 A633	R93-I631 PolarHBondContact NH2-O 3.4Å; L257-I631 HydrophobicContact CD2-CD1 3.94Å; L257-I631 HydrophobicContact CD2-CG1 3.88Å; A260-I631 HydrophobicContact CB-CD1 3.58Å; A260-I631 HydrophobicContact CB-CG1 4.4Å; M627-I631 WeakPolarHBondContact O-CD1 3.18Å; M627-I631 WeakPolarHBondContact O-CG1 2.83Å; M627-I631 PolarHBondContact O-N 2.87Å; D628-I631 PolarHBondContact O-N 2.87Å; E629-I631 VanDerWaalsContact C-N 3.28Å; E629-I631 PolarHBondContact O-N 2.79Å; I631-A633 VanDerWaalsContact C-N 3.32Å
632	S	76.4	Confident	75.4	Confident	89 Å²	89	71.3 Å²	71.3	62%	0.622	37%	0.372	S	S	*	.	H	α-helix	trans	-79.4	-12.2	179	61.3	0	0	0	0	114.1	D628 E629 N634	D628-S632 VanDerWaalsContact O-CB 3.29Å; D628-S632 WeakPolarHBondContact O-CB 3.47Å; D628-S632 PolarHBondContact O-N 2.86Å; D628-S632 PolarHBondContact O-OG 3.39Å; E629-S632 PolarHBondContact O-N 2.68Å; E629-S632 PolarHBondContact O-OG 3.21Å; S632-N634 PolarHBondContact O-N 2.72Å
633	A	81.5	Confident	77.7	Confident	23 Å²	23	69.4 Å²	69.4	19%	0.19	37%	0.365	C	S	.	.			trans	-50.6	128.9	174.4	0	0	0	0	0	112.8	Q86 E629 I631 P635	Q86-A633 VanDerWaalsContact OE1-CB 3.25Å; E629-A633 PolarHBondContact O-N 3.36Å; I631-A633 VanDerWaalsContact C-N 3.32Å; A633-P635 WeakPolarHBondContact O-CD 3.49Å
634	N	78.5	Confident	79.9	Confident	80 Å²	80	62.9 Å²	62.9	43%	0.428	33%	0.334	S	S	.	.			trans	-80.8	118.1	175.4	-178.2	-28.2	0	0	0	109.4	S632 C636 K637	S632-N634 PolarHBondContact O-N 2.72Å; N634-C636 VanDerWaalsContact C-N 3.25Å; N634-C636 PolarHBondContact O-N 2.77Å; N634-C636 WeakPolarHBondContact OD1-CB 3.42Å; N634-C636 PolarHBondContact OD1-N 3.2Å; N634-K637 HydrophobicContact CB-CD 4.31Å; N634-K637 HydrophobicContact CB-CG 4.28Å; N634-K637 PolarHBondContact O-N 2.89Å
635	P	82.7	Confident	82	Confident	12 Å²	12	61.3 Å²	61.3	8%	0.078	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-57	-38.4	-178.4	-21.6	30.8	0	0	0	112.8	F90 E276 A633 K637 L638 H640 Y681	F90-P635 HydrophobicContact CE1-CB 4.16Å; F90-P635 HydrophobicContact CE1-CG 3.9Å; F90-P635 HydrophobicContact CZ-CB 4.48Å; E276-P635 HydrophobicContact CG-CG 4.18Å; A633-P635 WeakPolarHBondContact O-CD 3.49Å; P635-K637 PolarHBondContact O-N 3.18Å; P635-L638 PolarHBondContact O-N 2.93Å; P635-H640 PolarHBondContact O-NE2 2.94Å; P635-H640 VanDerWaalsContact O-NE2 3.17Å; P635-Y681 HydrophobicContact CB-CD1 4.03Å; P635-Y681 HydrophobicContact CB-CE1 4.02Å; P635-Y681 HydrophobicContact CG-CE1 4.24Å
636	C	81.4	Confident	83.7	Confident	29 Å²	29	58 Å²	58	20%	0.196	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-71.5	8.8	-175.4	-56.2	0	0	0	0	114.2	N634	N634-C636 VanDerWaalsContact C-N 3.25Å; N634-C636 PolarHBondContact O-N 2.77Å; N634-C636 WeakPolarHBondContact OD1-CB 3.42Å; N634-C636 PolarHBondContact OD1-N 3.2Å
637	K	82.2	Confident	85.1	Confident	174 Å²	174	55.9 Å²	55.9	76%	0.757	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-111.8	-4	172.5	-65.1	-172.2	178.8	-178.1	0	113.7	N634 P635	N634-K637 HydrophobicContact CB-CD 4.31Å; N634-K637 HydrophobicContact CB-CG 4.28Å; N634-K637 PolarHBondContact O-N 2.89Å; P635-K637 PolarHBondContact O-N 3.18Å
638	L	86.1	Confident	86.1	Confident	67 Å²	67	55.5 Å²	55.5	35%	0.351	29%	0.286	S	S	.	.	S	Bend	trans	-109.3	148.6	-174.8	-61	175.5	0	0	0	111.4	Q86 F90 P635 H640 L643	Q86-L638 HydrophobicContact CG-CD1 3.94Å; F90-L638 HydrophobicContact CE2-CD1 3.59Å; F90-L638 HydrophobicContact CZ-CD1 3.58Å; P635-L638 PolarHBondContact O-N 2.93Å; L638-H640 PolarHBondContact O-N 2.82Å; L638-L643 HydrophobicContact CB-CD1 4.07Å; L638-L643 HydrophobicContact CD1-CD1 4.38Å
639	D	87.8	Confident	87	Confident	98 Å²	98	55.2 Å²	55.2	52%	0.524	28%	0.278	S	S	.	.			trans	-76.6	91.4	173.2	-176.8	-5.2	0	0	0	110.7	A641 F642 L643	D639-A641 PolarHBondContact O-N 3.37Å; D639-A641 WeakPolarHBondContact OD1-CA 3.46Å; D639-A641 WeakPolarHBondContact OD1-CB 3.49Å; D639-A641 PolarHBondContact OD1-N 2.93Å; D639-F642 HydrophobicContact CB-CB 4.13Å; D639-F642 PolarHBondContact O-N 3.39Å; D639-F642 PolarHBondContact OD1-N 2.92Å; D639-F642 VanDerWaalsContact OD2-CB 3.31Å; D639-F642 WeakPolarHBondContact OD2-CB 3.37Å; D639-L643 WeakPolarHBondContact O-CB 3.5Å; D639-L643 VanDerWaalsContact O-CG 3.23Å; D639-L643 WeakPolarHBondContact O-CG 3.45Å; D639-L643 PolarHBondContact O-N 3.16Å
640	H	90.7	Very high	87.6	Confident	16 Å²	16	50.5 Å²	50.5	7%	0.074	26%	0.256	C	S	.	.	H	α-helix	trans	-68.1	-17.1	174.7	-75.4	-76.1	0	0	0	114	F90 P635 L638 F644 Y677 Y681 V683	F90-H640 AromaticContact CD2-CE1 3.92Å; F90-H640 AromaticContact CE2-CE1 3.91Å; P635-H640 PolarHBondContact O-NE2 2.94Å; P635-H640 VanDerWaalsContact O-NE2 3.17Å; L638-H640 PolarHBondContact O-N 2.82Å; H640-F644 WeakPolarHBondContact O-CB 3.42Å; H640-F644 PolarHBondContact O-N 3Å; H640-Y677 AromaticContact ND1-CE1 3.87Å; H640-Y677 AromaticContact ND1-CZ 3.6Å; H640-Y677 PolarHBondContact ND1-OH 2.79Å; H640-Y681 AromaticContact CE1-CD1 3.52Å; H640-Y681 AromaticContact CE1-CG 3.51Å; H640-Y681 AromaticContact ND1-CG 3.72Å; H640-Y681 AromaticContact NE2-CD1 3.68Å; H640-Y681 AromaticContact NE2-CG 3.95Å; H640-V683 HydrophobicContact CB-CG2 4.27Å
641	A	89.3	Confident	88.1	Confident	35 Å²	35	49.3 Å²	49.3	29%	0.289	25%	0.251	S	S	.	.	H	α-helix	trans	-76.9	-40.4	175.2	0	0	0	0	0	111.5	D639 R645 H687	D639-A641 PolarHBondContact O-N 3.37Å; D639-A641 WeakPolarHBondContact OD1-CA 3.46Å; D639-A641 WeakPolarHBondContact OD1-CB 3.49Å; D639-A641 PolarHBondContact OD1-N 2.93Å; A641-R645 PolarHBondContact O-N 3.4Å; A641-H687 PolarHBondContact O-NE2 3.05Å
642	F	91.6	Very high	88.6	Confident	110 Å²	110	47.8 Å²	47.8	48%	0.482	24%	0.243	S	C	.	.	H	α-helix	trans	-66.7	-50.9	169.8	174.3	-102.3	0	0	0	111.8	D639 F644 R645 I646	D639-F642 HydrophobicContact CB-CB 4.13Å; D639-F642 PolarHBondContact O-N 3.39Å; D639-F642 PolarHBondContact OD1-N 2.92Å; D639-F642 VanDerWaalsContact OD2-CB 3.31Å; D639-F642 WeakPolarHBondContact OD2-CB 3.37Å; F642-F644 VanDerWaalsContact C-N 3.31Å; F642-F644 PolarHBondContact O-N 3.16Å; F642-R645 PolarHBondContact O-N 3.46Å; F642-R645 VanDerWaalsContact O-N 3.13Å; F642-I646 HydrophobicContact CD1-CD1 4.27Å; F642-I646 HydrophobicContact CE1-CD1 3.62Å; F642-I646 HydrophobicContact CE2-CD1 4.34Å; F642-I646 HydrophobicContact CZ-CD1 3.66Å; F642-I646 PolarHBondContact O-N 3.36Å
643	L	92.9	Very high	89.3	Confident	13 Å²	13	45.7 Å²	45.7	7%	0.068	23%	0.225	C	C	.	.	H	α-helix	trans	-59.9	-40.5	-179.6	-68.6	174.1	0	0	0	111.9	I83 L87 F90 L638 D639 R645 I646 L647	I83-L643 HydrophobicContact CG2-CD2 3.82Å; L87-L643 HydrophobicContact CD2-CB 3.92Å; L87-L643 HydrophobicContact CG-CB 4.35Å; L87-L643 HydrophobicContact CG-CD2 4.25Å; F90-L643 HydrophobicContact CE2-CD1 4.44Å; L638-L643 HydrophobicContact CB-CD1 4.07Å; L638-L643 HydrophobicContact CD1-CD1 4.38Å; D639-L643 WeakPolarHBondContact O-CB 3.5Å; D639-L643 VanDerWaalsContact O-CG 3.23Å; D639-L643 WeakPolarHBondContact O-CG 3.45Å; D639-L643 PolarHBondContact O-N 3.16Å; L643-R645 PolarHBondContact O-N 2.92Å; L643-I646 PolarHBondContact O-N 2.86Å; L643-L647 PolarHBondContact O-N 3.47Å; L643-L647 VanDerWaalsContact O-N 3.11Å
644	F	94.3	Very high	89.7	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64.9	-35.7	177.1	-177.9	-93.5	0	0	0	113	H640 F642 I646 L647 Q648 L674 Y677 C678 V683 R688	H640-F644 WeakPolarHBondContact O-CB 3.42Å; H640-F644 PolarHBondContact O-N 3Å; F642-F644 VanDerWaalsContact C-N 3.31Å; F642-F644 PolarHBondContact O-N 3.16Å; F644-I646 VanDerWaalsContact C-N 3.34Å; F644-I646 PolarHBondContact O-N 3.11Å; F644-L647 HydrophobicContact CD2-CD2 4.44Å; F644-L647 PolarHBondContact O-N 3.3Å; F644-Q648 HydrophobicContact CD1-CB 4.38Å; F644-Q648 HydrophobicContact CE1-CB 3.97Å; F644-Q648 HydrophobicContact CE1-CG 4.24Å; F644-Q648 HydrophobicContact CZ-CB 4.3Å; F644-Q648 VanDerWaalsContact O-CB 3.28Å; F644-Q648 WeakPolarHBondContact O-CB 3.27Å; F644-Q648 PolarHBondContact O-N 3.32Å; F644-L674 HydrophobicContact CD2-CD2 4.49Å; F644-L674 HydrophobicContact CE2-CB 4.13Å; F644-L674 HydrophobicContact CE2-CD2 3.6Å; F644-L674 HydrophobicContact CE2-CG 4.43Å; F644-L674 HydrophobicContact CZ-CB 4.36Å; F644-L674 HydrophobicContact CZ-CD2 4.03Å; F644-Y677 HydrophobicContact CB-CE1 4.07Å; F644-Y677 AromaticContact CD2-CD1 3.69Å; F644-Y677 HydrophobicContact CD2-CD1 3.69Å; F644-Y677 HydrophobicContact CD2-CE1 4.07Å; F644-Y677 HydrophobicContact CD2-CG 4.41Å; F644-Y677 HydrophobicContact CE2-CD1 4.49Å; F644-C678 WeakPolarHBondContact CE2-SG 3.33Å; F644-C678 WeakPolarHBondContact CZ-SG 3.26Å; F644-V683 HydrophobicContact CB-CG1 4.13Å; F644-V683 HydrophobicContact CB-CG2 3.89Å; F644-V683 HydrophobicContact CD1-CG1 3.94Å; F644-V683 HydrophobicContact CD2-CG2 4.42Å; F644-V683 HydrophobicContact CG-CG1 3.99Å; F644-V683 HydrophobicContact CG-CG2 4.16Å; F644-R688 HydrophobicContact CE1-CB 3.98Å; F644-R688 HydrophobicContact CE1-CG 3.79Å; F644-R688 HydrophobicContact CZ-CG 4.07Å
645	R	93.3	Very high	90	Very high	111 Å²	111	44.3 Å²	44.3	42%	0.419	21%	0.211	S	C	.	.	H	α-helix	trans	-59.1	-45.5	175.7	-177.2	-179.7	174.1	-169.1	-2.6	111.2	A641 F642 L643 Q648 R649 C691 E695	A641-R645 PolarHBondContact O-N 3.4Å; F642-R645 PolarHBondContact O-N 3.46Å; F642-R645 VanDerWaalsContact O-N 3.13Å; L643-R645 PolarHBondContact O-N 2.92Å; R645-Q648 PolarHBondContact O-N 2.89Å; R645-R649 WeakPolarHBondContact O-CB 3.43Å; R645-R649 PolarHBondContact O-N 2.93Å; R645-C691 HydrophobicContact CG-CB 4.3Å; R645-E695 IonicContact CZ-OE1 2.87Å; R645-E695 IonicContact NE-OE1 3.26Å; R645-E695 PolarHBondContact NE-OE1 3.02Å; R645-E695 IonicContact NH2-OE1 3.62Å; R645-E695 PolarHBondContact NH2-OE1 3.42Å
646	I	92.8	Very high	90.1	Very high	32 Å²	32	44.8 Å²	44.8	16%	0.164	21%	0.213	C	C	.	.	H	α-helix	trans	-61.8	-46.8	177.1	-62.7	173.7	0	0	0	110.7	I83 L87 F642 L643 F644 Q648 R649 Q650	I83-I646 HydrophobicContact CG2-CD1 3.88Å; L87-I646 HydrophobicContact CD1-CB 4.13Å; L87-I646 HydrophobicContact CD1-CG2 3.94Å; F642-I646 HydrophobicContact CD1-CD1 4.27Å; F642-I646 HydrophobicContact CE1-CD1 3.62Å; F642-I646 HydrophobicContact CE2-CD1 4.34Å; F642-I646 HydrophobicContact CZ-CD1 3.66Å; F642-I646 PolarHBondContact O-N 3.36Å; L643-I646 PolarHBondContact O-N 2.86Å; F644-I646 VanDerWaalsContact C-N 3.34Å; F644-I646 PolarHBondContact O-N 3.11Å; I646-Q648 VanDerWaalsContact C-N 3.33Å; I646-Q648 PolarHBondContact O-N 2.73Å; I646-R649 PolarHBondContact O-N 2.94Å; I646-Q650 WeakPolarHBondContact O-CG 3.47Å; I646-Q650 PolarHBondContact O-N 3.28Å
647	L	94.2	Very high	90.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.5	-42.8	177.2	178.9	62.4	0	0	0	112	L87 V91 F243 L247 L643 F644 T651 L674 Y677	L87-L647 HydrophobicContact CD1-CB 4.33Å; L87-L647 HydrophobicContact CD2-CB 3.99Å; L87-L647 HydrophobicContact CD2-CD2 4.36Å; V91-L647 HydrophobicContact CG2-CD1 3.88Å; V91-L647 HydrophobicContact CG2-CD2 3.85Å; F243-L647 HydrophobicContact CD1-CD1 4.22Å; F243-L647 HydrophobicContact CE1-CD1 4.05Å; L247-L647 HydrophobicContact CD1-CD1 4.34Å; L247-L647 HydrophobicContact CD2-CD1 3.93Å; L247-L647 HydrophobicContact CG-CD1 4.44Å; L643-L647 PolarHBondContact O-N 3.47Å; L643-L647 VanDerWaalsContact O-N 3.11Å; F644-L647 HydrophobicContact CD2-CD2 4.44Å; F644-L647 PolarHBondContact O-N 3.3Å; L647-T651 VanDerWaalsContact O-CB 3.27Å; L647-T651 WeakPolarHBondContact O-CB 3.45Å; L647-T651 PolarHBondContact O-N 2.94Å; L647-T651 PolarHBondContact O-OG1 2.67Å; L647-L674 HydrophobicContact CD2-CD2 3.96Å; L647-L674 HydrophobicContact CG-CD2 3.89Å; L647-Y677 HydrophobicContact CD2-CD2 3.85Å; L647-Y677 HydrophobicContact CD2-CE2 4.05Å; L647-Y677 HydrophobicContact CD2-CG 4.19Å
648	Q	94.1	Very high	90.2	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.009	21%	0.211	C	C	.	.	H	α-helix	trans	-67.2	-45.5	179.7	-173.6	176	30	0	0	111.8	F644 R645 I646 T651 L652 F666 R688 C691 Y692	F644-Q648 HydrophobicContact CD1-CB 4.38Å; F644-Q648 HydrophobicContact CE1-CB 3.97Å; F644-Q648 HydrophobicContact CE1-CG 4.24Å; F644-Q648 HydrophobicContact CZ-CB 4.3Å; F644-Q648 VanDerWaalsContact O-CB 3.28Å; F644-Q648 WeakPolarHBondContact O-CB 3.27Å; F644-Q648 PolarHBondContact O-N 3.32Å; R645-Q648 PolarHBondContact O-N 2.89Å; I646-Q648 VanDerWaalsContact C-N 3.33Å; I646-Q648 PolarHBondContact O-N 2.73Å; Q648-T651 PolarHBondContact O-N 3.33Å; Q648-L652 WeakPolarHBondContact O-CB 3.44Å; Q648-L652 PolarHBondContact O-N 3.33Å; Q648-F666 HydrophobicContact CG-CE2 4.48Å; Q648-F666 HydrophobicContact CG-CZ 4.05Å; Q648-R688 PolarHBondContact NE2-O 2.91Å; Q648-R688 PolarHBondContact OE1-O 2.85Å; Q648-C691 VanDerWaalsContact OE1-CB 3.31Å; Q648-Y692 VanDerWaalsContact NE2-CB 3.34Å
649	R	93.3	Very high	89.6	Confident	85 Å²	85	43.3 Å²	43.3	32%	0.321	22%	0.217	S	C	.	.	H	α-helix	trans	-57.9	-57.6	174.5	-177.4	178.3	-178.1	115.1	-2.1	110.9	R645 I646 T651 L652 D653 E695 E698	R645-R649 WeakPolarHBondContact O-CB 3.43Å; R645-R649 PolarHBondContact O-N 2.93Å; I646-R649 PolarHBondContact O-N 2.94Å; R649-T651 PolarHBondContact O-N 2.94Å; R649-T651 VanDerWaalsContact O-N 3.16Å; R649-L652 CarbonylContact O-C 3.59Å; R649-L652 WeakPolarHBondContact O-CA 3.44Å; R649-L652 WeakPolarHBondContact O-CB 3.04Å; R649-L652 PolarHBondContact O-N 3.26Å; R649-D653 PolarHBondContact O-N 2.88Å; R649-E695 WeakPolarHBondContact CD-OE2 3.46Å; R649-E695 VanDerWaalsContact CG-OE2 3.22Å; R649-E695 WeakPolarHBondContact CG-OE2 3.47Å; R649-E695 IonicContact CZ-OE2 3.98Å; R649-E695 IonicContact NE-OE2 3.16Å; R649-E695 IonicContact NH1-OE1 2.71Å; R649-E695 IonicContact NH1-OE2 2.94Å; R649-E695 PolarHBondContact NH1-OE2 3.35Å; R649-E698 IonicContact CZ-OE1 3.88Å; R649-E698 VanDerWaalsContact CZ-OE1 3.28Å; R649-E698 IonicContact NH1-OE1 3.45Å; R649-E698 PolarHBondContact NH1-OE1 3.27Å; R649-E698 IonicContact NH1-OE2 2.88Å; R649-E698 PolarHBondContact NH1-OE2 3.39Å; R649-E698 VanDerWaalsContact NH1-OE2 3.15Å; R649-E698 IonicContact NH2-OE1 2.82Å; R649-E698 PolarHBondContact NH2-OE1 2.9Å
650	Q	92.9	Very high	89.1	Confident	26 Å²	26	43.8 Å²	43.8	12%	0.121	21%	0.212	C	C	.	.	H	α-helix	trans	-60.6	-32.3	-179.3	-68.2	-179.7	-4.2	0	0	112.6	E80 I246 L247 I646 H654	E80-Q650 PolarHBondContact OE1-NE2 3.48Å; E80-Q650 VanDerWaalsContact OE1-NE2 3.13Å; I246-Q650 HydrophobicContact CG2-CB 4.04Å; L247-Q650 HydrophobicContact CD2-CB 4.45Å; I646-Q650 WeakPolarHBondContact O-CG 3.47Å; I646-Q650 PolarHBondContact O-N 3.28Å; Q650-H654 WeakPolarHBondContact O-CB 3.34Å; Q650-H654 PolarHBondContact O-N 3.06Å; Q650-H654 VanDerWaalsContact O-N 3.1Å
651	T	92.9	Very high	88.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-66.8	-37.9	172.6	-57.3	0	0	0	0	112	I246 L647 Q648 R649 R655 F666 Q670 L674	I246-T651 HydrophobicContact CD1-CG2 4.2Å; L647-T651 VanDerWaalsContact O-CB 3.27Å; L647-T651 WeakPolarHBondContact O-CB 3.45Å; L647-T651 PolarHBondContact O-N 2.94Å; L647-T651 PolarHBondContact O-OG1 2.67Å; Q648-T651 PolarHBondContact O-N 3.33Å; R649-T651 PolarHBondContact O-N 2.94Å; R649-T651 VanDerWaalsContact O-N 3.16Å; T651-R655 VanDerWaalsContact O-CB 3.25Å; T651-R655 WeakPolarHBondContact O-CB 3.2Å; T651-R655 PolarHBondContact O-N 2.95Å; T651-F666 HydrophobicContact CG2-CD1 3.7Å; T651-F666 HydrophobicContact CG2-CE1 3.62Å; T651-Q670 HydrophobicContact CG2-CB 3.95Å; T651-Q670 HydrophobicContact CG2-CG 3.69Å; T651-Q670 PolarHBondContact O-NE2 3.49Å; T651-L674 HydrophobicContact CG2-CD1 4.24Å
652	L	91.6	Very high	87.8	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-72.7	-44.6	177.6	178.7	60.1	0	0	0	111.3	Q648 R649 H654 R655 L656 F666 Y692 E695 L696	Q648-L652 WeakPolarHBondContact O-CB 3.44Å; Q648-L652 PolarHBondContact O-N 3.33Å; R649-L652 CarbonylContact O-C 3.59Å; R649-L652 WeakPolarHBondContact O-CA 3.44Å; R649-L652 WeakPolarHBondContact O-CB 3.04Å; R649-L652 PolarHBondContact O-N 3.26Å; L652-H654 VanDerWaalsContact C-N 3.31Å; L652-H654 PolarHBondContact O-N 3.35Å; L652-R655 CarbonylContact O-C 3.58Å; L652-R655 WeakPolarHBondContact O-CA 3.4Å; L652-R655 WeakPolarHBondContact O-CB 3.37Å; L652-R655 PolarHBondContact O-N 3.25Å; L652-L656 HydrophobicContact CD1-CD1 3.91Å; L652-L656 HydrophobicContact CD1-CG 3.98Å; L652-L656 HydrophobicContact CG-CD1 3.91Å; L652-L656 HydrophobicContact CG-CG 4.41Å; L652-L656 WeakPolarHBondContact O-CG 3.36Å; L652-L656 PolarHBondContact O-N 3.49Å; L652-F666 HydrophobicContact CB-CE1 3.98Å; L652-F666 HydrophobicContact CB-CZ 4.27Å; L652-Y692 HydrophobicContact CD1-CE2 4.43Å; L652-Y692 HydrophobicContact CD2-CE2 4.46Å; L652-E695 HydrophobicContact CD2-CB 4.09Å; L652-L696 HydrophobicContact CD1-CD2 3.93Å; L652-L696 HydrophobicContact CD2-CD2 3.87Å; L652-L696 HydrophobicContact CD2-CG 4.18Å
653	D	91	Very high	87.4	Confident	46 Å²	46	38.9 Å²	38.9	25%	0.246	19%	0.189	C	C	.	.	H	α-helix	trans	-55.5	-47.5	175.7	-56.1	-16.1	0	0	0	110.3	R649 N657 H699	R649-D653 PolarHBondContact O-N 2.88Å; D653-N657 WeakPolarHBondContact O-CB 3.32Å; D653-N657 PolarHBondContact O-N 3.39Å; D653-N657 PolarHBondContact O-ND2 2.82Å; D653-H699 IonicContact OD1-CE1 3.48Å; D653-H699 PolarHBondContact OD1-CE1 3.49Å; D653-H699 VanDerWaalsContact OD1-CE1 3.24Å; D653-H699 IonicContact OD1-NE2 2.9Å
654	H	89.3	Confident	87.1	Confident	57 Å²	57	38.2 Å²	38.2	26%	0.264	19%	0.185	S	C	.	.	H	α-helix	trans	-62.7	-41.2	173	-176.5	113.2	0	0	0	111.9	I246 Q650 L652 N657 D658	I246-H654 HydrophobicContact CG1-CB 3.83Å; Q650-H654 WeakPolarHBondContact O-CB 3.34Å; Q650-H654 PolarHBondContact O-N 3.06Å; Q650-H654 VanDerWaalsContact O-N 3.1Å; L652-H654 VanDerWaalsContact C-N 3.31Å; L652-H654 PolarHBondContact O-N 3.35Å; H654-N657 PolarHBondContact O-N 3.05Å; H654-D658 PolarHBondContact O-N 3.01Å
655	R	86.1	Confident	86.7	Confident	16 Å²	16	42.1 Å²	42.1	6%	0.06	20%	0.2	C	C	.	.	H	α-helix	trans	-66.2	-36.4	-178.3	-173.5	68.6	-130.7	136.9	12.3	112.8	T651 L652 D658 C662 W665	T651-R655 VanDerWaalsContact O-CB 3.25Å; T651-R655 WeakPolarHBondContact O-CB 3.2Å; T651-R655 PolarHBondContact O-N 2.95Å; L652-R655 CarbonylContact O-C 3.58Å; L652-R655 WeakPolarHBondContact O-CA 3.4Å; L652-R655 WeakPolarHBondContact O-CB 3.37Å; L652-R655 PolarHBondContact O-N 3.25Å; R655-D658 IonicContact CZ-OD2 2.94Å; R655-D658 IonicContact NH1-OD2 2.73Å; R655-D658 PolarHBondContact NH1-OD2 2.75Å; R655-D658 IonicContact NH2-OD2 3.28Å; R655-D658 PolarHBondContact NH2-OD2 3.44Å; R655-D658 WeakPolarHBondContact O-CB 3.47Å; R655-C662 HydrophobicContact CG-CB 4.05Å; R655-C662 VanDerWaalsContact NE-CB 3.31Å; R655-C662 PolarHBondContact O-SG 3.11Å; R655-W665 VanDerWaalsContact CD-O 3.32Å; R655-W665 WeakPolarHBondContact CD-O 3.39Å; R655-W665 PolarHBondContact NE-O 2.86Å
656	L	85.3	Confident	86.5	Confident	23 Å²	23	37.3 Å²	37.3	12%	0.12	18%	0.182	C	C	.	.	H	α-helix	trans	-76.8	-28.6	178.6	-69.3	168.2	0	0	0	112.7	K113 L652 H699 I706	K113-L656 PolarHBondContact NZ-O 3.41Å; L652-L656 HydrophobicContact CD1-CD1 3.91Å; L652-L656 HydrophobicContact CD1-CG 3.98Å; L652-L656 HydrophobicContact CG-CD1 3.91Å; L652-L656 HydrophobicContact CG-CG 4.41Å; L652-L656 WeakPolarHBondContact O-CG 3.36Å; L652-L656 PolarHBondContact O-N 3.49Å; L656-H699 HydrophobicContact CD1-CB 4.04Å; L656-H699 WeakPolarHBondContact CD1-CD2 3.26Å; L656-I706 HydrophobicContact CD1-CD1 4.49Å; L656-I706 HydrophobicContact CD2-CD1 3.86Å
657	N	84.6	Confident	86	Confident	132 Å²	132	36.5 Å²	36.5	71%	0.706	18%	0.179	S	C	*	.	S	Bend	trans	-84.9	-2.6	175.3	-74.3	-68.8	0	0	0	114.3	D653 H654	D653-N657 WeakPolarHBondContact O-CB 3.32Å; D653-N657 PolarHBondContact O-N 3.39Å; D653-N657 PolarHBondContact O-ND2 2.82Å; H654-N657 PolarHBondContact O-N 3.05Å
658	D	80.6	Confident	85.5	Confident	38 Å²	38	37 Å²	37	20%	0.203	18%	0.183	C	C	.	.	S	Bend	trans	-63.4	159.9	176.5	-174.1	24.7	0	0	0	113.3	H654 R655 Y660	H654-D658 PolarHBondContact O-N 3.01Å; R655-D658 IonicContact CZ-OD2 2.94Å; R655-D658 IonicContact NH1-OD2 2.73Å; R655-D658 PolarHBondContact NH1-OD2 2.75Å; R655-D658 IonicContact NH2-OD2 3.28Å; R655-D658 PolarHBondContact NH2-OD2 3.44Å; R655-D658 WeakPolarHBondContact O-CB 3.47Å; D658-Y660 PolarHBondContact O-N 2.87Å; D658-Y660 WeakPolarHBondContact OD2-CD2 3.35Å
659	S	73.9	Confident	85.1	Confident	68 Å²	68	36.9 Å²	36.9	48%	0.476	18%	0.182	S	C	.	.	S	Bend	trans	-70.4	-6.7	177.1	-58.7	0	0	0	0	114.2	Q112 K113	Q112-S659 WeakPolarHBondContact CG-O 3.14Å; K113-S659 PolarHBondContact N-O 3.26Å
660	Y	76.8	Confident	84.9	Confident	108 Å²	108	32.9 Å²	32.9	42%	0.424	17%	0.167	S	C	.	.	B	Isolated β-bridge	trans	-118.5	134.9	-176.1	-63.4	-88.8	0	0	0	110.7	R110 Q111 D658 C662	R110-Y660 HydrophobicContact CB-CD1 4.44Å; Q111-Y660 CarbonylContact O-C 3.57Å; Q111-Y660 WeakPolarHBondContact O-CA 3.39Å; D658-Y660 PolarHBondContact O-N 2.87Å; D658-Y660 WeakPolarHBondContact OD2-CD2 3.35Å; Y660-C662 PolarHBondContact O-N 2.94Å
661	S	77.5	Confident	84.8	Confident	18 Å²	18	32.9 Å²	32.9	13%	0.126	17%	0.169	C	C	.	.			trans	-60.7	123.4	174.6	-175.2	0	0	0	0	108.9	Q111	Q111-S661 PolarHBondContact O-N 3.18Å
662	C	75.7	Confident	84.6	Confident	11 Å²	11	33.5 Å²	33.5	7%	0.074	17%	0.172	C	C	.	.			trans	-120.4	-26.4	-174.4	65.6	0	0	0	0	113	R655 Y660 G664 W665	R655-C662 HydrophobicContact CG-CB 4.05Å; R655-C662 VanDerWaalsContact NE-CB 3.31Å; R655-C662 PolarHBondContact O-SG 3.11Å; Y660-C662 PolarHBondContact O-N 2.94Å; C662-G664 PolarHBondContact O-N 3.41Å; C662-G664 VanDerWaalsContact O-N 3.07Å; C662-W665 WeakPolarHBondContact O-CB 3.24Å; C662-W665 VanDerWaalsContact O-CD1 3.28Å; C662-W665 PolarHBondContact O-N 3.12Å
663	L	82.8	Confident	84.6	Confident	29 Å²	29	33.5 Å²	33.5	15%	0.152	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	31.3	-176.4	-46.4	-178.8	0	0	0	113.3	V705 D707 P768	L663-V705 HydrophobicContact CD2-CG1 4.06Å; L663-D707 HydrophobicContact CB-CB 3.73Å; L663-D707 HydrophobicContact CD1-CB 4.37Å; L663-D707 PolarHBondContact O-N 3.49Å; L663-P768 HydrophobicContact CD1-CB 3.95Å; L663-P768 HydrophobicContact CD1-CG 3.84Å; L663-P768 HydrophobicContact CD2-CG 4.15Å
664	G	85.6	Confident	84.7	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.8	-22.4	-173.7	0	0	0	0	0	115.6	C662 F666 Y692 L710	C662-G664 PolarHBondContact O-N 3.41Å; C662-G664 VanDerWaalsContact O-N 3.07Å; G664-F666 PolarHBondContact O-N 3.43Å; G664-F666 VanDerWaalsContact O-N 3.14Å; G664-Y692 PolarHBondContact O-OH 3.04Å; G664-Y692 VanDerWaalsContact O-OH 3.11Å; G664-L710 VanDerWaalsContact C-CD2 3.47Å
665	W	86.8	Confident	84.8	Confident	82 Å²	82	30.8 Å²	30.8	31%	0.311	16%	0.159	S	C	.	.			trans	-65.6	112.3	-173.3	-68.1	96.4	0	0	0	113.8	M107 R110 R655 C662 D707 L710	M107-W665 HydrophobicContact CE-CE3 4.46Å; R110-W665 PolarHBondContact NH1-O 3.29Å; R655-W665 VanDerWaalsContact CD-O 3.32Å; R655-W665 WeakPolarHBondContact CD-O 3.39Å; R655-W665 PolarHBondContact NE-O 2.86Å; C662-W665 WeakPolarHBondContact O-CB 3.24Å; C662-W665 VanDerWaalsContact O-CD1 3.28Å; C662-W665 PolarHBondContact O-N 3.12Å; W665-D707 PolarHBondContact NE1-OD2 2.84Å; W665-L710 HydrophobicContact CD2-CB 4.44Å; W665-L710 HydrophobicContact CD2-CD1 3.91Å; W665-L710 HydrophobicContact CD2-CD2 4.32Å; W665-L710 HydrophobicContact CD2-CG 4.46Å; W665-L710 HydrophobicContact CE3-CD1 3.75Å; W665-L710 HydrophobicContact CG-CD2 4.26Å; W665-L710 HydrophobicContact CH2-CB 4.48Å; W665-L710 HydrophobicContact CH2-CD1 3.96Å; W665-L710 HydrophobicContact CZ2-CB 3.89Å; W665-L710 HydrophobicContact CZ2-CD1 4.11Å; W665-L710 HydrophobicContact CZ3-CD1 3.78Å
666	F	87.8	Confident	84.9	Confident	9 Å²	9	30.1 Å²	30.1	4%	0.039	16%	0.156	C	C	.	.			trans	-50.1	149.4	167.4	-65.3	-50	0	0	0	112.9	R110 Q648 T651 L652 G664 Q670 V671 L674 Y692	R110-F666 PolarHBondContact NH1-O 3.43Å; R110-F666 PolarHBondContact NH2-O 2.95Å; Q648-F666 HydrophobicContact CG-CE2 4.48Å; Q648-F666 HydrophobicContact CG-CZ 4.05Å; T651-F666 HydrophobicContact CG2-CD1 3.7Å; T651-F666 HydrophobicContact CG2-CE1 3.62Å; L652-F666 HydrophobicContact CB-CE1 3.98Å; L652-F666 HydrophobicContact CB-CZ 4.27Å; G664-F666 PolarHBondContact O-N 3.43Å; G664-F666 VanDerWaalsContact O-N 3.14Å; F666-Q670 HydrophobicContact CB-CB 4.05Å; F666-V671 HydrophobicContact CB-CG2 3.69Å; F666-L674 HydrophobicContact CD2-CD1 4.07Å; F666-L674 HydrophobicContact CE1-CD1 4.42Å; F666-L674 HydrophobicContact CE2-CD1 3.95Å; F666-L674 HydrophobicContact CG-CD1 4.36Å; F666-L674 HydrophobicContact CZ-CD1 4.14Å; F666-Y692 HydrophobicContact CD2-CE1 4.36Å; F666-Y692 HydrophobicContact CD2-CE2 4.1Å; F666-Y692 AromaticContact CD2-CZ 3.71Å; F666-Y692 WeakPolarHBondContact CD2-OH 3.31Å; F666-Y692 HydrophobicContact CE1-CE2 4.4Å; F666-Y692 AromaticContact CE2-CD2 3.95Å; F666-Y692 HydrophobicContact CE2-CD2 3.95Å; F666-Y692 HydrophobicContact CE2-CE1 4.03Å; F666-Y692 AromaticContact CE2-CE2 3.28Å; F666-Y692 HydrophobicContact CE2-CE2 3.28Å; F666-Y692 AromaticContact CE2-CZ 3.33Å; F666-Y692 WeakPolarHBondContact CE2-OH 3.41Å; F666-Y692 HydrophobicContact CZ-CD2 4.09Å; F666-Y692 AromaticContact CZ-CE2 3.47Å; F666-Y692 HydrophobicContact CZ-CE2 3.47Å; F666-Y692 VanDerWaalsContact CZ-CE2 3.47Å; F666-Y692 AromaticContact CZ-CZ 3.97Å
667	S	83.3	Confident	85.3	Confident	15 Å²	15	29 Å²	29	11%	0.105	15%	0.151	C	C	.	.			trans	-75	160.2	175.1	76.9	0	0	0	0	112.2	G669 Q670 V671	S667-G669 PolarHBondContact O-N 3.24Å; S667-Q670 PolarHBondContact O-N 3.46Å; S667-Q670 WeakPolarHBondContact OG-CG 2.96Å; S667-Q670 PolarHBondContact OG-N 3.13Å; S667-Q670 VanDerWaalsContact OG-N 3.15Å; S667-V671 WeakPolarHBondContact O-CG2 3.29Å; S667-V671 PolarHBondContact O-N 2.88Å
668	P	83.3	Confident	85.6	Confident	11 Å²	11	23.2 Å²	23.2	7%	0.071	12%	0.12	C	C	.	.	H	α-helix	trans	-50.6	-41.3	174.6	-28.4	34.1	0	0	0	113.6	P104 M107 L232 F672	P104-P668 WeakPolarHBondContact CD-O 3.4Å; P104-P668 WeakPolarHBondContact O-CB 3.45Å; M107-P668 HydrophobicContact CB-CG 4.29Å; M107-P668 HydrophobicContact CG-CG 4.23Å; M107-P668 HydrophobicContact SD-CB 4.28Å; M107-P668 HydrophobicContact SD-CG 3.72Å; L232-P668 HydrophobicContact CD2-CG 4.41Å; P668-F672 WeakPolarHBondContact O-CB 3.42Å; P668-F672 PolarHBondContact O-N 3.45Å
669	G	85.8	Confident	85.9	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-71.2	-34.3	177	0	0	0	0	0	114.3	S667 V673	S667-G669 PolarHBondContact O-N 3.24Å; G669-V673 WeakPolarHBondContact O-CG2 3.33Å; G669-V673 PolarHBondContact O-N 2.95Å
670	Q	89.8	Confident	86.6	Confident	1 Å²	1	19.5 Å²	19.5	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-67.6	-48.4	172.7	-74.2	174.3	-34.5	0	0	110.6	M242 F243 I246 T651 F666 S667 F672 V673 L674	M242-Q670 HydrophobicContact CE-CB 4.49Å; M242-Q670 HydrophobicContact CE-CG 3.64Å; M242-Q670 HydrophobicContact SD-CG 3.87Å; F243-Q670 HydrophobicContact CZ-CG 4.5Å; I246-Q670 HydrophobicContact CD1-CG 4.46Å; T651-Q670 HydrophobicContact CG2-CB 3.95Å; T651-Q670 HydrophobicContact CG2-CG 3.69Å; T651-Q670 PolarHBondContact O-NE2 3.49Å; F666-Q670 HydrophobicContact CB-CB 4.05Å; S667-Q670 PolarHBondContact O-N 3.46Å; S667-Q670 WeakPolarHBondContact OG-CG 2.96Å; S667-Q670 PolarHBondContact OG-N 3.13Å; S667-Q670 VanDerWaalsContact OG-N 3.15Å; Q670-F672 PolarHBondContact O-N 3.19Å; Q670-V673 PolarHBondContact O-N 3.48Å; Q670-L674 WeakPolarHBondContact O-CB 3.47Å; Q670-L674 VanDerWaalsContact O-CG 3.26Å; Q670-L674 WeakPolarHBondContact O-CG 3.35Å; Q670-L674 PolarHBondContact O-N 3.3Å
671	V	89.4	Confident	87.2	Confident	26 Å²	26	15.1 Å²	15.1	16%	0.158	8%	0.081	C	C	.	.	H	α-helix	trans	-56.2	-51.2	176.1	174.1	0	0	0	0	110.3	P104 F666 S667 V673 L674 D675	P104-V671 HydrophobicContact CG-CG1 4.17Å; F666-V671 HydrophobicContact CB-CG2 3.69Å; S667-V671 WeakPolarHBondContact O-CG2 3.29Å; S667-V671 PolarHBondContact O-N 2.88Å; V671-V673 PolarHBondContact O-N 3.45Å; V671-L674 PolarHBondContact O-N 3.41Å; V671-D675 WeakPolarHBondContact CG1-OD2 3.26Å; V671-D675 VanDerWaalsContact O-CB 3.3Å; V671-D675 WeakPolarHBondContact O-CB 3.24Å; V671-D675 PolarHBondContact O-N 3.2Å
672	F	90.3	Very high	87.6	Confident	13 Å²	13	15.6 Å²	15.6	6%	0.057	9%	0.089	C	C	.	.	H	α-helix	trans	-52.1	-47.2	177.6	166	-109.9	0	0	0	113.9	P98 A101 Q103 L239 P668 Q670 E676	P98-F672 HydrophobicContact CB-CE2 4.16Å; P98-F672 HydrophobicContact CB-CZ 3.66Å; P98-F672 HydrophobicContact CG-CZ 3.98Å; A101-F672 HydrophobicContact CB-CD2 3.68Å; A101-F672 HydrophobicContact CB-CE2 4Å; Q103-F672 HydrophobicContact CG-CB 3.89Å; Q103-F672 HydrophobicContact CG-CD1 3.81Å; Q103-F672 HydrophobicContact CG-CD2 3.89Å; Q103-F672 HydrophobicContact CG-CE1 4.31Å; Q103-F672 HydrophobicContact CG-CE2 4.38Å; Q103-F672 HydrophobicContact CG-CG 3.58Å; L239-F672 HydrophobicContact CD1-CD1 3.88Å; L239-F672 HydrophobicContact CD1-CE1 3.72Å; P668-F672 WeakPolarHBondContact O-CB 3.42Å; P668-F672 PolarHBondContact O-N 3.45Å; Q670-F672 PolarHBondContact O-N 3.19Å; F672-E676 WeakPolarHBondContact O-CB 3.49Å; F672-E676 PolarHBondContact O-N 2.98Å
673	V	91.3	Very high	88.2	Confident	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-73.8	-38.1	-179.7	172.6	0	0	0	0	112	V91 I95 L239 F243 G669 Q670 V671 Y677	V91-V673 HydrophobicContact CG1-CG1 3.93Å; I95-V673 HydrophobicContact CD1-CG2 4.28Å; I95-V673 HydrophobicContact CG1-CG1 4.48Å; I95-V673 HydrophobicContact CG1-CG2 3.72Å; L239-V673 HydrophobicContact CD1-CG2 4.47Å; L239-V673 HydrophobicContact CD2-CG2 4.3Å; F243-V673 HydrophobicContact CD2-CB 4.3Å; F243-V673 HydrophobicContact CD2-CG1 4.08Å; F243-V673 HydrophobicContact CD2-CG2 4.17Å; F243-V673 HydrophobicContact CE1-CG1 4.18Å; F243-V673 HydrophobicContact CE2-CB 3.44Å; F243-V673 VanDerWaalsContact CE2-CB 3.44Å; F243-V673 HydrophobicContact CE2-CG1 3.55Å; F243-V673 HydrophobicContact CE2-CG2 3.61Å; F243-V673 HydrophobicContact CZ-CB 3.67Å; F243-V673 HydrophobicContact CZ-CG1 3.61Å; F243-V673 HydrophobicContact CZ-CG2 4.36Å; G669-V673 WeakPolarHBondContact O-CG2 3.33Å; G669-V673 PolarHBondContact O-N 2.95Å; Q670-V673 PolarHBondContact O-N 3.48Å; V671-V673 PolarHBondContact O-N 3.45Å; V673-Y677 WeakPolarHBondContact O-CB 3.3Å; V673-Y677 PolarHBondContact O-N 3.28Å
674	L	92.3	Very high	88.4	Confident	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-66.3	-39.5	175.6	-68.5	173.3	0	0	0	111.6	F644 L647 T651 F666 Q670 V671 Y677 C678	F644-L674 HydrophobicContact CD2-CD2 4.49Å; F644-L674 HydrophobicContact CE2-CB 4.13Å; F644-L674 HydrophobicContact CE2-CD2 3.6Å; F644-L674 HydrophobicContact CE2-CG 4.43Å; F644-L674 HydrophobicContact CZ-CB 4.36Å; F644-L674 HydrophobicContact CZ-CD2 4.03Å; L647-L674 HydrophobicContact CD2-CD2 3.96Å; L647-L674 HydrophobicContact CG-CD2 3.89Å; T651-L674 HydrophobicContact CG2-CD1 4.24Å; F666-L674 HydrophobicContact CD2-CD1 4.07Å; F666-L674 HydrophobicContact CE1-CD1 4.42Å; F666-L674 HydrophobicContact CE2-CD1 3.95Å; F666-L674 HydrophobicContact CG-CD1 4.36Å; F666-L674 HydrophobicContact CZ-CD1 4.14Å; Q670-L674 WeakPolarHBondContact O-CB 3.47Å; Q670-L674 VanDerWaalsContact O-CG 3.26Å; Q670-L674 WeakPolarHBondContact O-CG 3.35Å; Q670-L674 PolarHBondContact O-N 3.3Å; V671-L674 PolarHBondContact O-N 3.41Å; L674-Y677 PolarHBondContact O-N 2.86Å; L674-C678 WeakPolarHBondContact O-CB 3.34Å; L674-C678 PolarHBondContact O-N 2.92Å; L674-C678 PolarHBondContact O-SG 2.9Å
675	D	91.1	Very high	88.5	Confident	47 Å²	47	17.5 Å²	17.5	25%	0.251	10%	0.102	S	C	.	.	H	α-helix	trans	-64.5	-48.4	175.6	-70.8	-7.4	0	0	0	111.1	A101 V671 Y677 C678 A679 R688	A101-D675 HydrophobicContact CB-CB 4.09Å; V671-D675 WeakPolarHBondContact CG1-OD2 3.26Å; V671-D675 VanDerWaalsContact O-CB 3.3Å; V671-D675 WeakPolarHBondContact O-CB 3.24Å; V671-D675 PolarHBondContact O-N 3.2Å; D675-Y677 VanDerWaalsContact C-N 3.31Å; D675-Y677 PolarHBondContact O-N 2.9Å; D675-C678 PolarHBondContact O-N 3.41Å; D675-A679 VanDerWaalsContact O-CB 3.26Å; D675-A679 WeakPolarHBondContact O-CB 3.4Å; D675-A679 PolarHBondContact O-N 3.22Å; D675-R688 IonicContact OD1-CZ 2.71Å; D675-R688 IonicContact OD1-NH1 3.15Å; D675-R688 PolarHBondContact OD1-NH1 2.97Å; D675-R688 IonicContact OD1-NH2 3.3Å; D675-R688 PolarHBondContact OD1-NH2 3.31Å
676	E	90.2	Very high	88.5	Confident	1 Å²	1	13.6 Å²	13.6	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-61.8	-39.3	177.3	-168.5	70.7	176.3	0	0	111.4	C94 P98 F99 N100 A101 F672 R680	C94-E676 HydrophobicContact CB-CB 4.2Å; C94-E676 HydrophobicContact CB-CG 3.84Å; P98-E676 VanDerWaalsContact CA-OE1 3.27Å; P98-E676 WeakPolarHBondContact CA-OE1 3.29Å; F99-E676 VanDerWaalsContact CD1-OE1 3.26Å; F99-E676 WeakPolarHBondContact CD1-OE1 3.27Å; F99-E676 PolarHBondContact N-OE1 3.11Å; N100-E676 WeakPolarHBondContact CB-OE2 3.27Å; N100-E676 PolarHBondContact N-OE1 3.12Å; N100-E676 PolarHBondContact N-OE2 2.92Å; A101-E676 HydrophobicContact CB-CB 4.15Å; A101-E676 WeakPolarHBondContact CB-OE2 3.47Å; A101-E676 PolarHBondContact N-OE2 3.43Å; F672-E676 WeakPolarHBondContact O-CB 3.49Å; F672-E676 PolarHBondContact O-N 2.98Å; E676-R680 WeakPolarHBondContact O-CB 3.29Å; E676-R680 PolarHBondContact O-N 3.36Å
677	Y	92.6	Very high	88.6	Confident	0 Å²	0	14.5 Å²	14.5	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-63.3	-51.4	173.7	-172	-71	0	0	0	111.4	L87 F90 V91 H640 F644 L647 V673 L674 D675 A679 R680 Y681 V683	L87-Y677 HydrophobicContact CD2-CE2 4.15Å; F90-Y677 HydrophobicContact CB-CD2 4.32Å; F90-Y677 HydrophobicContact CB-CE2 3.7Å; V91-Y677 HydrophobicContact CG2-CD2 4.41Å; H640-Y677 AromaticContact ND1-CE1 3.87Å; H640-Y677 AromaticContact ND1-CZ 3.6Å; H640-Y677 PolarHBondContact ND1-OH 2.79Å; F644-Y677 HydrophobicContact CB-CE1 4.07Å; F644-Y677 AromaticContact CD2-CD1 3.69Å; F644-Y677 HydrophobicContact CD2-CD1 3.69Å; F644-Y677 HydrophobicContact CD2-CE1 4.07Å; F644-Y677 HydrophobicContact CD2-CG 4.41Å; F644-Y677 HydrophobicContact CE2-CD1 4.49Å; L647-Y677 HydrophobicContact CD2-CD2 3.85Å; L647-Y677 HydrophobicContact CD2-CE2 4.05Å; L647-Y677 HydrophobicContact CD2-CG 4.19Å; V673-Y677 WeakPolarHBondContact O-CB 3.3Å; V673-Y677 PolarHBondContact O-N 3.28Å; L674-Y677 PolarHBondContact O-N 2.86Å; D675-Y677 VanDerWaalsContact C-N 3.31Å; D675-Y677 PolarHBondContact O-N 2.9Å; Y677-A679 VanDerWaalsContact C-N 3.34Å; Y677-A679 PolarHBondContact O-N 3.31Å; Y677-R680 PolarHBondContact O-N 3.49Å; Y677-Y681 AromaticContact CD1-CD2 3.84Å; Y677-Y681 HydrophobicContact CD1-CD2 3.84Å; Y677-Y681 AromaticContact CD2-CD2 3.79Å; Y677-Y681 HydrophobicContact CD2-CD2 3.79Å; Y677-Y681 AromaticContact CD2-CE2 3.83Å; Y677-Y681 HydrophobicContact CD2-CE2 3.83Å; Y677-Y681 AromaticContact CE1-CD2 3.93Å; Y677-Y681 HydrophobicContact CE1-CD2 3.93Å; Y677-Y681 AromaticContact CE2-CD2 3.92Å; Y677-Y681 HydrophobicContact CE2-CD2 3.92Å; Y677-Y681 HydrophobicContact CE2-CE2 4.03Å; Y677-Y681 AromaticContact CG-CD2 3.75Å; Y677-Y681 HydrophobicContact CG-CD2 3.75Å; Y677-Y681 HydrophobicContact CG-CE2 4.17Å; Y677-Y681 AromaticContact CZ-CD2 3.97Å; Y677-Y681 WeakPolarHBondContact O-CD2 3.41Å; Y677-Y681 PolarHBondContact O-N 3.19Å; Y677-V683 HydrophobicContact CD1-CG2 4.16Å; Y677-V683 HydrophobicContact CE1-CG2 4.06Å
678	C	91	Very high	89	Confident	11 Å²	11	15.7 Å²	15.7	7%	0.074	9%	0.094	C	C	.	.	H	α-helix	trans	-57.8	-48.7	-179	-71.8	0	0	0	0	111.3	F644 L674 D675 G682 V683	F644-C678 WeakPolarHBondContact CE2-SG 3.33Å; F644-C678 WeakPolarHBondContact CZ-SG 3.26Å; L674-C678 WeakPolarHBondContact O-CB 3.34Å; L674-C678 PolarHBondContact O-N 2.92Å; L674-C678 PolarHBondContact O-SG 2.9Å; D675-C678 PolarHBondContact O-N 3.41Å; C678-G682 CarbonylContact O-C 3.43Å; C678-G682 WeakPolarHBondContact O-CA 3.45Å; C678-G682 PolarHBondContact O-N 3.14Å; C678-V683 HydrophobicContact CB-CB 4.14Å; C678-V683 PolarHBondContact O-N 2.92Å
679	A	87.6	Confident	89.5	Confident	24 Å²	24	16 Å²	16	20%	0.198	9%	0.094	C	C	.	.	H	α-helix	trans	-60.4	-56.1	179	0	0	0	0	0	111.3	N100 R280 L316 D675 Y677 Y681	N100-A679 WeakPolarHBondContact ND2-CB 3.21Å; R280-A679 PolarHBondContact NH1-O 2.78Å; L316-A679 WeakPolarHBondContact CD1-O 3.06Å; L316-A679 HydrophobicContact CD2-CB 3.97Å; D675-A679 VanDerWaalsContact O-CB 3.26Å; D675-A679 WeakPolarHBondContact O-CB 3.4Å; D675-A679 PolarHBondContact O-N 3.22Å; Y677-A679 VanDerWaalsContact C-N 3.34Å; Y677-A679 PolarHBondContact O-N 3.31Å; A679-Y681 PolarHBondContact O-N 3.07Å
680	R	88.3	Confident	89.8	Confident	3 Å²	3	16.1 Å²	16.1	1%	0.011	10%	0.095	C	C	.	.	H	α-helix	trans	-62.6	-43.7	-174.7	-177.3	174.5	174.1	162	-9.2	113.4	R93 Y97 F99 E276 R280 E676 Y677	R93-R680 PolarHBondContact O-NH1 2.96Å; Y97-R680 PolarHBondContact OH-NH2 2.81Å; F99-R680 HydrophobicContact CE1-CG 4.46Å; E276-R680 VanDerWaalsContact CD-NH2 3.26Å; E276-R680 IonicContact OE1-NH2 2.73Å; E276-R680 PolarHBondContact OE1-NH2 2.91Å; E276-R680 IonicContact OE2-CZ 2.88Å; E276-R680 IonicContact OE2-NE 3.2Å; E276-R680 PolarHBondContact OE2-NE 3.38Å; E276-R680 IonicContact OE2-NH2 2.88Å; E276-R680 PolarHBondContact OE2-NH2 2.99Å; R280-R680 WeakPolarHBondContact CD-O 3.4Å; R280-R680 PolarHBondContact NH1-O 3.38Å; E676-R680 WeakPolarHBondContact O-CB 3.29Å; E676-R680 PolarHBondContact O-N 3.36Å; Y677-R680 PolarHBondContact O-N 3.49Å
681	Y	89.2	Confident	90	Very high	16 Å²	16	16.6 Å²	16.6	6%	0.063	10%	0.098	C	C	.	.	H	α-helix	trans	-98.4	-4.6	-175.4	-55.4	-65.8	0	0	0	114.4	F90 P635 H640 Y677 A679	F90-Y681 HydrophobicContact CB-CE2 3.8Å; F90-Y681 HydrophobicContact CD1-CE1 4.06Å; F90-Y681 AromaticContact CD1-CZ 3.86Å; F90-Y681 HydrophobicContact CG-CE2 4.38Å; F90-Y681 PolarHBondContact O-OH 2.96Å; P635-Y681 HydrophobicContact CB-CD1 4.03Å; P635-Y681 HydrophobicContact CB-CE1 4.02Å; P635-Y681 HydrophobicContact CG-CE1 4.24Å; H640-Y681 AromaticContact CE1-CD1 3.52Å; H640-Y681 AromaticContact CE1-CG 3.51Å; H640-Y681 AromaticContact ND1-CG 3.72Å; H640-Y681 AromaticContact NE2-CD1 3.68Å; H640-Y681 AromaticContact NE2-CG 3.95Å; Y677-Y681 AromaticContact CD1-CD2 3.84Å; Y677-Y681 HydrophobicContact CD1-CD2 3.84Å; Y677-Y681 AromaticContact CD2-CD2 3.79Å; Y677-Y681 HydrophobicContact CD2-CD2 3.79Å; Y677-Y681 AromaticContact CD2-CE2 3.83Å; Y677-Y681 HydrophobicContact CD2-CE2 3.83Å; Y677-Y681 AromaticContact CE1-CD2 3.93Å; Y677-Y681 HydrophobicContact CE1-CD2 3.93Å; Y677-Y681 AromaticContact CE2-CD2 3.92Å; Y677-Y681 HydrophobicContact CE2-CD2 3.92Å; Y677-Y681 HydrophobicContact CE2-CE2 4.03Å; Y677-Y681 AromaticContact CG-CD2 3.75Å; Y677-Y681 HydrophobicContact CG-CD2 3.75Å; Y677-Y681 HydrophobicContact CG-CE2 4.17Å; Y677-Y681 AromaticContact CZ-CD2 3.97Å; Y677-Y681 WeakPolarHBondContact O-CD2 3.41Å; Y677-Y681 PolarHBondContact O-N 3.19Å; A679-Y681 PolarHBondContact O-N 3.07Å
682	G	85.4	Confident	90.2	Very high	28 Å²	28	16 Å²	16	29%	0.289	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.6	28.6	170.1	0	0	0	0	0	115.5	C678 R684	C678-G682 CarbonylContact O-C 3.43Å; C678-G682 WeakPolarHBondContact O-CA 3.45Å; C678-G682 PolarHBondContact O-N 3.14Å; G682-R684 PolarHBondContact O-N 3Å
683	V	88.8	Confident	90.4	Very high	14 Å²	14	15.4 Å²	15.4	9%	0.085	9%	0.09	C	C	.	.			trans	-71.7	121.7	175.9	-172.8	0	0	0	0	109.3	H640 F644 Y677 C678	H640-V683 HydrophobicContact CB-CG2 4.27Å; F644-V683 HydrophobicContact CB-CG1 4.13Å; F644-V683 HydrophobicContact CB-CG2 3.89Å; F644-V683 HydrophobicContact CD1-CG1 3.94Å; F644-V683 HydrophobicContact CD2-CG2 4.42Å; F644-V683 HydrophobicContact CG-CG1 3.99Å; F644-V683 HydrophobicContact CG-CG2 4.16Å; Y677-V683 HydrophobicContact CD1-CG2 4.16Å; Y677-V683 HydrophobicContact CE1-CG2 4.06Å; C678-V683 HydrophobicContact CB-CB 4.14Å; C678-V683 PolarHBondContact O-N 2.92Å
684	R	86.4	Confident	90.5	Very high	41 Å²	41	16.2 Å²	16.2	16%	0.155	10%	0.097	C	C	.	.			trans	-70.9	137.9	-176.2	-62.8	-177.3	72.4	-133.7	-15.9	111.2	E308 G682 C686 H687 R688 T732 E737	E308-R684 IonicContact OE1-CZ 2.63Å; E308-R684 IonicContact OE1-NE 3.74Å; E308-R684 PolarHBondContact OE1-NE 3.01Å; E308-R684 IonicContact OE1-NH2 3.58Å; E308-R684 PolarHBondContact OE1-NH2 3.32Å; E308-R684 IonicContact OE2-NH2 3.18Å; G682-R684 PolarHBondContact O-N 3Å; R684-C686 VanDerWaalsContact C-N 3.3Å; R684-C686 PolarHBondContact O-N 2.76Å; R684-H687 PolarHBondContact O-N 2.99Å; R684-R688 PolarHBondContact O-N 3.31Å; R684-R688 VanDerWaalsContact O-N 3.15Å; R684-T732 PolarHBondContact NH2-O 3.12Å; R684-T732 PolarHBondContact NH2-OG1 2.6Å; R684-E737 IonicContact CZ-OE1 3.83Å; R684-E737 IonicContact CZ-OE2 2.94Å; R684-E737 IonicContact NH1-OE1 3.98Å; R684-E737 PolarHBondContact NH1-OE1 3.38Å; R684-E737 IonicContact NH1-OE2 2.67Å; R684-E737 PolarHBondContact NH1-OE2 2.82Å; R684-E737 IonicContact NH2-OE1 3.2Å; R684-E737 IonicContact NH2-OE2 2.7Å
685	G	87.3	Confident	90.6	Very high	26 Å²	26	16.3 Å²	16.3	27%	0.268	10%	0.098	S	C	.	.	H	α-helix	trans	-59.6	-35	-174.5	0	0	0	0	0	114.2	R688 H689	G685-R688 PolarHBondContact O-N 3.29Å; G685-H689 PolarHBondContact O-CD2 2.95Å; G685-H689 PolarHBondContact O-N 2.73Å; G685-H689 VanDerWaalsContact O-N 3.14Å
686	C	88.6	Confident	90.7	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-67.1	-50.9	178.4	-166.6	0	0	0	0	111.1	R684 R688 H689 L690 H721	R684-C686 VanDerWaalsContact C-N 3.3Å; R684-C686 PolarHBondContact O-N 2.76Å; C686-R688 VanDerWaalsContact C-N 3.26Å; C686-R688 PolarHBondContact O-N 2.72Å; C686-H689 PolarHBondContact O-N 2.77Å; C686-L690 WeakPolarHBondContact O-CG 3.26Å; C686-L690 PolarHBondContact O-N 3.45Å; C686-H721 HydrophobicContact CB-CB 4.31Å; C686-H721 WeakPolarHBondContact CB-CD2 3.41Å; C686-H721 PolarHBondContact SG-CD2 3.13Å
687	H	89.6	Confident	90.9	Very high	27 Å²	27	14 Å²	14	13%	0.125	9%	0.086	C	C	.	.	H	α-helix	trans	-50.3	-43.5	173.1	-179.2	75.7	0	0	0	113	A641 R684 H689 L690 C691	A641-H687 PolarHBondContact O-NE2 3.05Å; R684-H687 PolarHBondContact O-N 2.99Å; H687-H689 PolarHBondContact O-N 3.48Å; H687-L690 PolarHBondContact O-N 2.81Å; H687-C691 VanDerWaalsContact CE1-SG 3.51Å; H687-C691 WeakPolarHBondContact O-CB 3.4Å; H687-C691 PolarHBondContact O-N 3.32Å; H687-C691 PolarHBondContact O-SG 2.85Å
688	R	91.8	Very high	90.9	Very high	41 Å²	41	16.5 Å²	16.5	16%	0.155	10%	0.097	C	C	.	.	H	α-helix	trans	-57.9	-45.1	173.9	167.4	-179.2	-176.3	-176.9	7.1	113	F644 Q648 D675 R684 G685 C686 Y692	F644-R688 HydrophobicContact CE1-CB 3.98Å; F644-R688 HydrophobicContact CE1-CG 3.79Å; F644-R688 HydrophobicContact CZ-CG 4.07Å; Q648-R688 PolarHBondContact NE2-O 2.91Å; Q648-R688 PolarHBondContact OE1-O 2.85Å; D675-R688 IonicContact OD1-CZ 2.71Å; D675-R688 IonicContact OD1-NH1 3.15Å; D675-R688 PolarHBondContact OD1-NH1 2.97Å; D675-R688 IonicContact OD1-NH2 3.3Å; D675-R688 PolarHBondContact OD1-NH2 3.31Å; R684-R688 PolarHBondContact O-N 3.31Å; R684-R688 VanDerWaalsContact O-N 3.15Å; G685-R688 PolarHBondContact O-N 3.29Å; C686-R688 VanDerWaalsContact C-N 3.26Å; C686-R688 PolarHBondContact O-N 2.72Å; R688-Y692 WeakPolarHBondContact O-CB 3.35Å; R688-Y692 PolarHBondContact O-N 2.89Å
689	H	93	Very high	90.8	Very high	16 Å²	16	17.7 Å²	17.7	7%	0.074	10%	0.101	C	C	.	.	H	α-helix	trans	-79	-32.8	-178.8	-79.1	-79.2	0	0	0	112.8	G685 C686 H687 Y692 L693 Y713 S714 F717 C718	G685-H689 PolarHBondContact O-CD2 2.95Å; G685-H689 PolarHBondContact O-N 2.73Å; G685-H689 VanDerWaalsContact O-N 3.14Å; C686-H689 PolarHBondContact O-N 2.77Å; H687-H689 PolarHBondContact O-N 3.48Å; H689-Y692 PolarHBondContact O-N 3.35Å; H689-L693 WeakPolarHBondContact O-CB 3.39Å; H689-L693 VanDerWaalsContact O-CG 3.28Å; H689-L693 WeakPolarHBondContact O-CG 3.24Å; H689-L693 PolarHBondContact O-N 3.28Å; H689-Y713 AromaticContact CE1-CE1 3.81Å; H689-S714 WeakPolarHBondContact ND1-CB 3.2Å; H689-S714 PolarHBondContact ND1-OG 3.44Å; H689-S714 VanDerWaalsContact ND1-OG 3.09Å; H689-F717 HydrophobicContact CB-CD1 4.21Å; H689-F717 AromaticContact CD2-CD1 3.45Å; H689-F717 VanDerWaalsContact CD2-CD1 3.45Å; H689-F717 WeakPolarHBondContact CD2-CD1 3.34Å; H689-F717 AromaticContact CD2-CE1 3.85Å; H689-F717 AromaticContact CD2-CG 3.79Å; H689-F717 AromaticContact CG-CD1 3.96Å; H689-C718 WeakPolarHBondContact CB-SG 3.42Å
690	L	92.8	Very high	90.9	Very high	3 Å²	3	17.4 Å²	17.4	2%	0.016	10%	0.098	C	C	.	.	H	α-helix	trans	-63.2	-47.9	171.7	-67.4	172.4	0	0	0	110.9	C686 H687 Y692 L693 A694 C718 E737 R740 F741 I744	C686-L690 WeakPolarHBondContact O-CG 3.26Å; C686-L690 PolarHBondContact O-N 3.45Å; H687-L690 PolarHBondContact O-N 2.81Å; L690-Y692 VanDerWaalsContact C-N 3.33Å; L690-Y692 PolarHBondContact O-N 2.68Å; L690-L693 PolarHBondContact O-N 2.87Å; L690-A694 PolarHBondContact O-N 2.98Å; L690-C718 HydrophobicContact CD2-CB 4.08Å; L690-E737 HydrophobicContact CD1-CB 4.32Å; L690-E737 HydrophobicContact CD1-CG 4.41Å; L690-R740 HydrophobicContact CD1-CB 4.25Å; L690-F741 HydrophobicContact CD2-CB 3.96Å; L690-F741 HydrophobicContact CD2-CD2 4.14Å; L690-I744 HydrophobicContact CB-CD1 4.04Å; L690-I744 HydrophobicContact CD2-CD1 3.96Å; L690-I744 VanDerWaalsContact O-CD1 3.3Å; L690-I744 WeakPolarHBondContact O-CD1 3.26Å
691	C	92.9	Very high	90.9	Very high	11 Å²	11	21.7 Å²	21.7	7%	0.074	12%	0.118	C	C	.	.	H	α-helix	trans	-58.7	-46.1	172.2	-68.2	0	0	0	0	110.7	R645 Q648 H687 L693 A694 E695	R645-C691 HydrophobicContact CG-CB 4.3Å; Q648-C691 VanDerWaalsContact OE1-CB 3.31Å; H687-C691 VanDerWaalsContact CE1-SG 3.51Å; H687-C691 WeakPolarHBondContact O-CB 3.4Å; H687-C691 PolarHBondContact O-N 3.32Å; H687-C691 PolarHBondContact O-SG 2.85Å; C691-L693 PolarHBondContact O-N 3.29Å; C691-A694 PolarHBondContact O-N 2.88Å; C691-E695 WeakPolarHBondContact O-CG 3.43Å; C691-E695 PolarHBondContact O-N 3.49Å
692	Y	93.9	Very high	90.8	Very high	14 Å²	14	27.1 Å²	27.1	6%	0.055	15%	0.148	C	C	.	.	H	α-helix	trans	-59.6	-45.3	-179.9	-158.5	-161.4	0	0	0	112.9	Q648 L652 G664 F666 R688 H689 L690 E695 L696 L710	Q648-Y692 VanDerWaalsContact NE2-CB 3.34Å; L652-Y692 HydrophobicContact CD1-CE2 4.43Å; L652-Y692 HydrophobicContact CD2-CE2 4.46Å; G664-Y692 PolarHBondContact O-OH 3.04Å; G664-Y692 VanDerWaalsContact O-OH 3.11Å; F666-Y692 HydrophobicContact CD2-CE1 4.36Å; F666-Y692 HydrophobicContact CD2-CE2 4.1Å; F666-Y692 AromaticContact CD2-CZ 3.71Å; F666-Y692 WeakPolarHBondContact CD2-OH 3.31Å; F666-Y692 HydrophobicContact CE1-CE2 4.4Å; F666-Y692 AromaticContact CE2-CD2 3.95Å; F666-Y692 HydrophobicContact CE2-CD2 3.95Å; F666-Y692 HydrophobicContact CE2-CE1 4.03Å; F666-Y692 AromaticContact CE2-CE2 3.28Å; F666-Y692 HydrophobicContact CE2-CE2 3.28Å; F666-Y692 AromaticContact CE2-CZ 3.33Å; F666-Y692 WeakPolarHBondContact CE2-OH 3.41Å; F666-Y692 HydrophobicContact CZ-CD2 4.09Å; F666-Y692 AromaticContact CZ-CE2 3.47Å; F666-Y692 HydrophobicContact CZ-CE2 3.47Å; F666-Y692 VanDerWaalsContact CZ-CE2 3.47Å; F666-Y692 AromaticContact CZ-CZ 3.97Å; R688-Y692 WeakPolarHBondContact O-CB 3.35Å; R688-Y692 PolarHBondContact O-N 2.89Å; H689-Y692 PolarHBondContact O-N 3.35Å; L690-Y692 VanDerWaalsContact C-N 3.33Å; L690-Y692 PolarHBondContact O-N 2.68Å; Y692-E695 PolarHBondContact O-N 3.35Å; Y692-L696 HydrophobicContact CD1-CD1 4.09Å; Y692-L696 HydrophobicContact CD2-CD1 3.71Å; Y692-L696 HydrophobicContact CD2-CD2 4.45Å; Y692-L696 HydrophobicContact CD2-CG 3.82Å; Y692-L696 HydrophobicContact CE1-CD1 4.12Å; Y692-L696 HydrophobicContact CE2-CD1 3.74Å; Y692-L696 HydrophobicContact CE2-CD2 4Å; Y692-L696 HydrophobicContact CE2-CG 3.86Å; Y692-L696 HydrophobicContact CG-CD1 3.9Å; Y692-L696 HydrophobicContact CG-CG 4.44Å; Y692-L696 VanDerWaalsContact O-CB 3.27Å; Y692-L696 WeakPolarHBondContact O-CB 3.36Å; Y692-L696 WeakPolarHBondContact O-CD1 3.5Å; Y692-L696 WeakPolarHBondContact O-CG 3.24Å; Y692-L696 PolarHBondContact O-N 2.98Å; Y692-L710 HydrophobicContact CE1-CD1 3.78Å; Y692-L710 HydrophobicContact CE1-CG 4.32Å
693	L	94.5	Very high	90.6	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-59.9	-49.3	177.3	-75.1	165.8	0	0	0	111.1	H689 L690 C691 E695 L696 M697 L711 F715 I744	H689-L693 WeakPolarHBondContact O-CB 3.39Å; H689-L693 VanDerWaalsContact O-CG 3.28Å; H689-L693 WeakPolarHBondContact O-CG 3.24Å; H689-L693 PolarHBondContact O-N 3.28Å; L690-L693 PolarHBondContact O-N 2.87Å; C691-L693 PolarHBondContact O-N 3.29Å; L693-E695 PolarHBondContact O-N 2.91Å; L693-L696 PolarHBondContact O-N 3.46Å; L693-M697 HydrophobicContact CB-SD 4.29Å; L693-M697 VanDerWaalsContact O-CB 3.3Å; L693-M697 WeakPolarHBondContact O-CB 3.33Å; L693-M697 WeakPolarHBondContact O-CG 3.36Å; L693-M697 PolarHBondContact O-N 2.82Å; L693-M697 VanDerWaalsContact O-SD 3.38Å; L693-L711 HydrophobicContact CD2-CB 4.5Å; L693-L711 HydrophobicContact CD2-CD2 3.97Å; L693-F715 HydrophobicContact CD1-CB 4.37Å; L693-F715 HydrophobicContact CD2-CB 4.37Å; L693-I744 HydrophobicContact CB-CG2 3.95Å; L693-I744 HydrophobicContact CD1-CG2 4.08Å
694	A	94.1	Very high	90.5	Very high	18 Å²	18	28.3 Å²	28.3	15%	0.149	16%	0.162	C	C	.	.	H	α-helix	trans	-59	-46	-179.9	0	0	0	0	0	112.6	L690 C691 M697 E698 I744	L690-A694 PolarHBondContact O-N 2.98Å; C691-A694 PolarHBondContact O-N 2.88Å; A694-M697 PolarHBondContact O-N 2.77Å; A694-E698 WeakPolarHBondContact O-CB 3.33Å; A694-E698 PolarHBondContact O-N 3.44Å; A694-I744 HydrophobicContact CB-CD1 4.23Å
695	E	93.6	Very high	90.3	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.009	16%	0.162	C	C	.	.	H	α-helix	trans	-72.9	-33.1	-179.5	-52.5	-74.5	154.5	0	0	111.8	R645 R649 L652 C691 Y692 L693 H699	R645-E695 IonicContact CZ-OE1 2.87Å; R645-E695 IonicContact NE-OE1 3.26Å; R645-E695 PolarHBondContact NE-OE1 3.02Å; R645-E695 IonicContact NH2-OE1 3.62Å; R645-E695 PolarHBondContact NH2-OE1 3.42Å; R649-E695 WeakPolarHBondContact CD-OE2 3.46Å; R649-E695 VanDerWaalsContact CG-OE2 3.22Å; R649-E695 WeakPolarHBondContact CG-OE2 3.47Å; R649-E695 IonicContact CZ-OE2 3.98Å; R649-E695 IonicContact NE-OE2 3.16Å; R649-E695 IonicContact NH1-OE1 2.71Å; R649-E695 IonicContact NH1-OE2 2.94Å; R649-E695 PolarHBondContact NH1-OE2 3.35Å; L652-E695 HydrophobicContact CD2-CB 4.09Å; C691-E695 WeakPolarHBondContact O-CG 3.43Å; C691-E695 PolarHBondContact O-N 3.49Å; Y692-E695 PolarHBondContact O-N 3.35Å; L693-E695 PolarHBondContact O-N 2.91Å; E695-H699 PolarHBondContact O-N 2.99Å; E695-H699 VanDerWaalsContact O-N 3.14Å; E695-H699 PolarHBondContact O-ND1 2.8Å
696	L	93.8	Very high	90.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-68.8	-38.3	172.1	-73.6	169.6	0	0	0	112	L652 Y692 L693 H699 S700 I706 L710 L711	L652-L696 HydrophobicContact CD1-CD2 3.93Å; L652-L696 HydrophobicContact CD2-CD2 3.87Å; L652-L696 HydrophobicContact CD2-CG 4.18Å; Y692-L696 HydrophobicContact CD1-CD1 4.09Å; Y692-L696 HydrophobicContact CD2-CD1 3.71Å; Y692-L696 HydrophobicContact CD2-CD2 4.45Å; Y692-L696 HydrophobicContact CD2-CG 3.82Å; Y692-L696 HydrophobicContact CE1-CD1 4.12Å; Y692-L696 HydrophobicContact CE2-CD1 3.74Å; Y692-L696 HydrophobicContact CE2-CD2 4Å; Y692-L696 HydrophobicContact CE2-CG 3.86Å; Y692-L696 HydrophobicContact CG-CD1 3.9Å; Y692-L696 HydrophobicContact CG-CG 4.44Å; Y692-L696 VanDerWaalsContact O-CB 3.27Å; Y692-L696 WeakPolarHBondContact O-CB 3.36Å; Y692-L696 WeakPolarHBondContact O-CD1 3.5Å; Y692-L696 WeakPolarHBondContact O-CG 3.24Å; Y692-L696 PolarHBondContact O-N 2.98Å; L693-L696 PolarHBondContact O-N 3.46Å; L696-H699 PolarHBondContact O-N 3.09Å; L696-S700 PolarHBondContact O-N 3.26Å; L696-I706 HydrophobicContact CB-CG2 4.41Å; L696-I706 HydrophobicContact CD2-CD1 3.95Å; L696-I706 HydrophobicContact CD2-CG1 4.42Å; L696-I706 HydrophobicContact CD2-CG2 3.92Å; L696-L710 HydrophobicContact CD1-CD2 4.08Å; L696-L710 HydrophobicContact CD1-CG 4.05Å; L696-L710 HydrophobicContact CD2-CD2 4.17Å; L696-L711 HydrophobicContact CB-CD2 3.8Å; L696-L711 HydrophobicContact CD1-CD2 4.04Å
697	M	93.4	Very high	90.3	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-68.5	-44.2	176.2	-72.7	158.9	54.3	0	0	111.2	L693 A694 H699 S700 E701 L711 I744 R747 L748 L751	L693-M697 HydrophobicContact CB-SD 4.29Å; L693-M697 VanDerWaalsContact O-CB 3.3Å; L693-M697 WeakPolarHBondContact O-CB 3.33Å; L693-M697 WeakPolarHBondContact O-CG 3.36Å; L693-M697 PolarHBondContact O-N 2.82Å; L693-M697 VanDerWaalsContact O-SD 3.38Å; A694-M697 PolarHBondContact O-N 2.77Å; M697-H699 VanDerWaalsContact C-N 3.27Å; M697-H699 PolarHBondContact O-N 2.75Å; M697-S700 PolarHBondContact O-N 3.43Å; M697-S700 VanDerWaalsContact O-N 3.08Å; M697-E701 WeakPolarHBondContact O-CB 3.34Å; M697-E701 VanDerWaalsContact O-CG 3.31Å; M697-E701 WeakPolarHBondContact O-CG 3.43Å; M697-E701 PolarHBondContact O-N 3.14Å; M697-L711 HydrophobicContact CG-CD2 4.49Å; M697-I744 HydrophobicContact CE-CG2 4.38Å; M697-I744 HydrophobicContact SD-CG2 3.95Å; M697-R747 HydrophobicContact CE-CB 3.69Å; M697-R747 HydrophobicContact CE-CG 3.51Å; M697-L748 HydrophobicContact CE-CB 3.95Å; M697-L748 HydrophobicContact CG-CD1 4.32Å; M697-L748 HydrophobicContact SD-CB 4.02Å; M697-L748 HydrophobicContact SD-CD1 4.19Å; M697-L751 HydrophobicContact CB-CD2 4.19Å; M697-L751 HydrophobicContact CG-CD2 3.9Å
698	E	92.6	Very high	90.3	Very high	52 Å²	52	26.9 Å²	26.9	24%	0.243	15%	0.153	C	C	.	.	H	α-helix	trans	-55.6	-42.5	172.2	-174.5	179.6	144	0	0	111.2	R649 A694 N702	R649-E698 IonicContact CZ-OE1 3.88Å; R649-E698 VanDerWaalsContact CZ-OE1 3.28Å; R649-E698 IonicContact NH1-OE1 3.45Å; R649-E698 PolarHBondContact NH1-OE1 3.27Å; R649-E698 IonicContact NH1-OE2 2.88Å; R649-E698 PolarHBondContact NH1-OE2 3.39Å; R649-E698 VanDerWaalsContact NH1-OE2 3.15Å; R649-E698 IonicContact NH2-OE1 2.82Å; R649-E698 PolarHBondContact NH2-OE1 2.9Å; A694-E698 WeakPolarHBondContact O-CB 3.33Å; A694-E698 PolarHBondContact O-N 3.44Å; E698-N702 WeakPolarHBondContact O-CB 3.04Å; E698-N702 PolarHBondContact O-N 2.66Å; E698-N702 PolarHBondContact O-ND2 2.59Å
699	H	90.2	Very high	90.2	Very high	35 Å²	35	28.1 Å²	28.1	16%	0.162	17%	0.165	C	C	.	.	H	α-helix	trans	-67.4	-39.5	173.9	-80.7	92.5	0	0	0	113.4	D653 L656 E695 L696 M697 N702 G703 A704 I706	D653-H699 IonicContact OD1-CE1 3.48Å; D653-H699 PolarHBondContact OD1-CE1 3.49Å; D653-H699 VanDerWaalsContact OD1-CE1 3.24Å; D653-H699 IonicContact OD1-NE2 2.9Å; L656-H699 HydrophobicContact CD1-CB 4.04Å; L656-H699 WeakPolarHBondContact CD1-CD2 3.26Å; E695-H699 PolarHBondContact O-N 2.99Å; E695-H699 VanDerWaalsContact O-N 3.14Å; E695-H699 PolarHBondContact O-ND1 2.8Å; L696-H699 PolarHBondContact O-N 3.09Å; M697-H699 VanDerWaalsContact C-N 3.27Å; M697-H699 PolarHBondContact O-N 2.75Å; H699-N702 CarbonylContact O-C 3.47Å; H699-N702 PolarHBondContact O-N 2.84Å; H699-G703 PolarHBondContact O-N 2.91Å; H699-A704 HydrophobicContact CB-CB 4.18Å; H699-A704 VanDerWaalsContact O-CB 3.27Å; H699-A704 WeakPolarHBondContact O-CB 3.41Å; H699-A704 PolarHBondContact O-N 3.37Å; H699-I706 HydrophobicContact CB-CD1 4.43Å
700	S	89	Confident	90	Very high	18 Å²	18	27.5 Å²	27.5	13%	0.126	16%	0.162	C	C	.	.	H	α-helix	trans	-68.8	-35.7	178.1	-173.8	0	0	0	0	113	L696 M697 G703 A704 Q755	L696-S700 PolarHBondContact O-N 3.26Å; M697-S700 PolarHBondContact O-N 3.43Å; M697-S700 VanDerWaalsContact O-N 3.08Å; S700-G703 PolarHBondContact O-N 2.73Å; S700-G703 VanDerWaalsContact O-N 3.14Å; S700-A704 WeakPolarHBondContact CA-O 3.32Å; S700-Q755 PolarHBondContact OG-NE2 2.94Å
701	E	88.6	Confident	90	Very high	94 Å²	94	27.4 Å²	27.4	44%	0.439	16%	0.162	S	C	.	.	H	α-helix	trans	-68.5	-38.4	174.5	-71.4	162.9	-169.4	0	0	111.1	M697 G703 R747 L751	M697-E701 WeakPolarHBondContact O-CB 3.34Å; M697-E701 VanDerWaalsContact O-CG 3.31Å; M697-E701 WeakPolarHBondContact O-CG 3.43Å; M697-E701 PolarHBondContact O-N 3.14Å; E701-G703 PolarHBondContact O-N 3.03Å; E701-G703 VanDerWaalsContact O-N 3.15Å; E701-R747 VanDerWaalsContact CD-NH2 3.35Å; E701-R747 IonicContact OE1-CZ 3.19Å; E701-R747 IonicContact OE1-NE 3.91Å; E701-R747 PolarHBondContact OE1-NE 3.09Å; E701-R747 IonicContact OE1-NH2 2.7Å; E701-R747 PolarHBondContact OE1-NH2 3.05Å; E701-R747 IonicContact OE2-CZ 2.8Å; E701-R747 IonicContact OE2-NE 3.14Å; E701-R747 PolarHBondContact OE2-NE 3.18Å; E701-R747 IonicContact OE2-NH2 3.21Å; E701-R747 PolarHBondContact OE2-NH2 3.44Å; E701-L751 HydrophobicContact CG-CD1 4.04Å
702	N	86.9	Confident	89.9	Confident	130 Å²	130	28.7 Å²	28.7	70%	0.695	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.8	5.6	169.4	-73.4	-53.3	0	0	0	114	E698 H699	E698-N702 WeakPolarHBondContact O-CB 3.04Å; E698-N702 PolarHBondContact O-N 2.66Å; E698-N702 PolarHBondContact O-ND2 2.59Å; H699-N702 CarbonylContact O-C 3.47Å; H699-N702 PolarHBondContact O-N 2.84Å
703	G	81.6	Confident	89.7	Confident	47 Å²	47	34.5 Å²	34.5	49%	0.485	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.5	9.8	171.1	0	0	0	0	0	116.2	S165 H699 S700 E701	S165-G703 WeakPolarHBondContact CB-O 3.3Å; H699-G703 PolarHBondContact O-N 2.91Å; S700-G703 PolarHBondContact O-N 2.73Å; S700-G703 VanDerWaalsContact O-N 3.14Å; E701-G703 PolarHBondContact O-N 3.03Å; E701-G703 VanDerWaalsContact O-N 3.15Å
704	A	85.2	Confident	89.6	Confident	20 Å²	20	34.5 Å²	34.5	17%	0.165	19%	0.189	C	C	.	.			trans	-71.7	146	167.5	0	0	0	0	0	110.8	H699 S700	H699-A704 HydrophobicContact CB-CB 4.18Å; H699-A704 VanDerWaalsContact O-CB 3.27Å; H699-A704 WeakPolarHBondContact O-CB 3.41Å; H699-A704 PolarHBondContact O-N 3.37Å; S700-A704 WeakPolarHBondContact CA-O 3.32Å
705	V	83.6	Confident	89.5	Confident	25 Å²	25	34 Å²	34	15%	0.152	18%	0.184	C	C	.	.			trans	-89.6	114.4	176.4	176.5	0	0	0	0	109.4	S165 L663 P768	S165-V705 VanDerWaalsContact OG-CG2 3.3Å; S165-V705 WeakPolarHBondContact OG-CG2 3.3Å; L663-V705 HydrophobicContact CD2-CG1 4.06Å; V705-P768 HydrophobicContact CG1-CG 3.78Å
706	I	88.9	Confident	89.3	Confident	8 Å²	8	35.3 Å²	35.3	4%	0.041	20%	0.195	C	C	.	.			trans	-106.6	144.3	176	-56.3	-56.1	0	0	0	109.2	L656 L696 H699 P708 L711	L656-I706 HydrophobicContact CD1-CD1 4.49Å; L656-I706 HydrophobicContact CD2-CD1 3.86Å; L696-I706 HydrophobicContact CB-CG2 4.41Å; L696-I706 HydrophobicContact CD2-CD1 3.95Å; L696-I706 HydrophobicContact CD2-CG1 4.42Å; L696-I706 HydrophobicContact CD2-CG2 3.92Å; H699-I706 HydrophobicContact CB-CD1 4.43Å; I706-P708 WeakPolarHBondContact O-CD 3.46Å; I706-L711 HydrophobicContact CG2-CD1 4.35Å; I706-L711 HydrophobicContact CG2-CD2 4.41Å; I706-L711 HydrophobicContact CG2-CG 4.11Å
707	D	87.1	Confident	89.1	Confident	28 Å²	28	38.2 Å²	38.2	15%	0.15	21%	0.208	C	C	.	.			trans	-70.6	119.2	174.8	-178.7	-3.8	0	0	0	110.5	L663 W665 T709 L710 L711	L663-D707 HydrophobicContact CB-CB 3.73Å; L663-D707 HydrophobicContact CD1-CB 4.37Å; L663-D707 PolarHBondContact O-N 3.49Å; W665-D707 PolarHBondContact NE1-OD2 2.84Å; D707-T709 PolarHBondContact O-N 3.44Å; D707-T709 VanDerWaalsContact O-N 3.14Å; D707-T709 WeakPolarHBondContact OD1-CA 3.1Å; D707-T709 WeakPolarHBondContact OD1-CB 3.49Å; D707-T709 PolarHBondContact OD1-N 3.02Å; D707-T709 PolarHBondContact OD1-OG1 3.25Å; D707-L710 HydrophobicContact CB-CB 4.18Å; D707-L710 WeakPolarHBondContact O-CB 3.46Å; D707-L710 PolarHBondContact O-N 2.75Å; D707-L711 PolarHBondContact O-N 3.44Å
708	P	88.9	Confident	88.9	Confident	3 Å²	3	38.2 Å²	38.2	2%	0.019	21%	0.208	C	C	.	.	H	α-helix	trans	-60.6	-23.9	176.9	-23.3	35.8	0	0	0	113.1	I706 L710 L711 H712 F763 A771 A774 T775	I706-P708 WeakPolarHBondContact O-CD 3.46Å; P708-L710 VanDerWaalsContact C-N 3.32Å; P708-L710 PolarHBondContact O-N 3.18Å; P708-L711 PolarHBondContact O-N 3.31Å; P708-H712 VanDerWaalsContact O-CB 3.24Å; P708-H712 WeakPolarHBondContact O-CB 3.47Å; P708-H712 PolarHBondContact O-N 3.12Å; P708-F763 HydrophobicContact CG-CE1 4.33Å; P708-A771 HydrophobicContact CG-CB 4.16Å; P708-A774 HydrophobicContact CB-CB 3.92Å; P708-T775 VanDerWaalsContact CG-OG1 3.28Å; P708-T775 WeakPolarHBondContact CG-OG1 2.89Å
709	T	89.3	Confident	88.7	Confident	67 Å²	67	36 Å²	36	41%	0.411	20%	0.198	S	C	.	.	H	α-helix	trans	-65.2	-34.3	174.1	-37.6	0	0	0	0	112.1	D707 H712 Y713	D707-T709 PolarHBondContact O-N 3.44Å; D707-T709 VanDerWaalsContact O-N 3.14Å; D707-T709 WeakPolarHBondContact OD1-CA 3.1Å; D707-T709 WeakPolarHBondContact OD1-CB 3.49Å; D707-T709 PolarHBondContact OD1-N 3.02Å; D707-T709 PolarHBondContact OD1-OG1 3.25Å; T709-H712 PolarHBondContact O-N 3.05Å; T709-Y713 WeakPolarHBondContact O-CB 3.37Å; T709-Y713 PolarHBondContact O-N 2.85Å
710	L	90.1	Very high	88.5	Confident	3 Å²	3	35.6 Å²	35.6	2%	0.016	20%	0.199	C	C	.	.	H	α-helix	trans	-72.6	-40.8	178.1	178.7	59.5	0	0	0	111.8	G664 W665 Y692 L696 D707 P708 S714	G664-L710 VanDerWaalsContact C-CD2 3.47Å; W665-L710 HydrophobicContact CD2-CB 4.44Å; W665-L710 HydrophobicContact CD2-CD1 3.91Å; W665-L710 HydrophobicContact CD2-CD2 4.32Å; W665-L710 HydrophobicContact CD2-CG 4.46Å; W665-L710 HydrophobicContact CE3-CD1 3.75Å; W665-L710 HydrophobicContact CG-CD2 4.26Å; W665-L710 HydrophobicContact CH2-CB 4.48Å; W665-L710 HydrophobicContact CH2-CD1 3.96Å; W665-L710 HydrophobicContact CZ2-CB 3.89Å; W665-L710 HydrophobicContact CZ2-CD1 4.11Å; W665-L710 HydrophobicContact CZ3-CD1 3.78Å; Y692-L710 HydrophobicContact CE1-CD1 3.78Å; Y692-L710 HydrophobicContact CE1-CG 4.32Å; L696-L710 HydrophobicContact CD1-CD2 4.08Å; L696-L710 HydrophobicContact CD1-CG 4.05Å; L696-L710 HydrophobicContact CD2-CD2 4.17Å; D707-L710 HydrophobicContact CB-CB 4.18Å; D707-L710 WeakPolarHBondContact O-CB 3.46Å; D707-L710 PolarHBondContact O-N 2.75Å; P708-L710 VanDerWaalsContact C-N 3.32Å; P708-L710 PolarHBondContact O-N 3.18Å; L710-S714 PolarHBondContact O-N 3.26Å; L710-S714 PolarHBondContact O-OG 2.93Å
711	L	92.1	Very high	88.4	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-45.1	170.3	-66	173.5	0	0	0	110.3	L693 L696 M697 I706 D707 P708 S714 F715 L748 L778	L693-L711 HydrophobicContact CD2-CB 4.5Å; L693-L711 HydrophobicContact CD2-CD2 3.97Å; L696-L711 HydrophobicContact CB-CD2 3.8Å; L696-L711 HydrophobicContact CD1-CD2 4.04Å; M697-L711 HydrophobicContact CG-CD2 4.49Å; I706-L711 HydrophobicContact CG2-CD1 4.35Å; I706-L711 HydrophobicContact CG2-CD2 4.41Å; I706-L711 HydrophobicContact CG2-CG 4.11Å; D707-L711 PolarHBondContact O-N 3.44Å; P708-L711 PolarHBondContact O-N 3.31Å; L711-S714 PolarHBondContact O-N 3.22Å; L711-F715 VanDerWaalsContact O-CB 3.26Å; L711-F715 WeakPolarHBondContact O-CB 3.46Å; L711-F715 PolarHBondContact O-N 3.23Å; L711-L748 HydrophobicContact CD1-CD1 4.45Å; L711-L778 HydrophobicContact CB-CD2 3.6Å
712	H	91	Very high	88.3	Confident	38 Å²	38	31.1 Å²	31.1	18%	0.176	18%	0.177	C	C	.	.	H	α-helix	trans	-62.1	-43.7	179.7	-179.7	-98.7	0	0	0	113.4	P708 T709 A716 L778 R781	P708-H712 VanDerWaalsContact O-CB 3.24Å; P708-H712 WeakPolarHBondContact O-CB 3.47Å; P708-H712 PolarHBondContact O-N 3.12Å; T709-H712 PolarHBondContact O-N 3.05Å; H712-A716 WeakPolarHBondContact O-CB 3.42Å; H712-A716 PolarHBondContact O-N 2.99Å; H712-L778 HydrophobicContact CB-CB 4.42Å; H712-L778 HydrophobicContact CB-CD1 3.97Å; H712-L778 HydrophobicContact CB-CD2 4.3Å; H712-L778 HydrophobicContact CB-CG 4.46Å; H712-R781 PolarHBondContact CE1-NH1 3.08Å; H712-R781 PolarHBondContact NE2-NH1 3.39Å
713	Y	90.4	Very high	88	Confident	136 Å²	136	27.3 Å²	27.3	53%	0.533	16%	0.155	S	C	.	.	H	α-helix	trans	-60.1	-48.7	173.8	176.2	-106.3	0	0	0	112	H689 T709 A716 F717	H689-Y713 AromaticContact CE1-CE1 3.81Å; T709-Y713 WeakPolarHBondContact O-CB 3.37Å; T709-Y713 PolarHBondContact O-N 2.85Å; Y713-A716 PolarHBondContact O-N 3.19Å; Y713-F717 PolarHBondContact O-N 2.86Å; Y713-F717 VanDerWaalsContact O-N 3.11Å
714	S	91.5	Very high	87.4	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-69.6	-39.8	-178	-61.5	0	0	0	0	112.6	H689 L710 L711 F717 C718	H689-S714 WeakPolarHBondContact ND1-CB 3.2Å; H689-S714 PolarHBondContact ND1-OG 3.44Å; H689-S714 VanDerWaalsContact ND1-OG 3.09Å; L710-S714 PolarHBondContact O-N 3.26Å; L710-S714 PolarHBondContact O-OG 2.93Å; L711-S714 PolarHBondContact O-N 3.22Å; S714-F717 PolarHBondContact O-N 3.32Å; S714-C718 PolarHBondContact O-N 3.15Å
715	F	92.3	Very high	86.3	Confident	6 Å²	6	30.9 Å²	30.9	3%	0.026	17%	0.174	C	C	.	.	H	α-helix	trans	-64.8	-43.6	176	-177.7	-95.9	0	0	0	111.5	L693 L711 F717 C718 A719 F741 K745 L748 L778 V782	L693-F715 HydrophobicContact CD1-CB 4.37Å; L693-F715 HydrophobicContact CD2-CB 4.37Å; L711-F715 VanDerWaalsContact O-CB 3.26Å; L711-F715 WeakPolarHBondContact O-CB 3.46Å; L711-F715 PolarHBondContact O-N 3.23Å; F715-F717 VanDerWaalsContact C-N 3.3Å; F715-F717 PolarHBondContact O-N 3.47Å; F715-C718 PolarHBondContact O-N 3.03Å; F715-A719 HydrophobicContact CE1-CB 4.43Å; F715-A719 WeakPolarHBondContact O-CB 3.29Å; F715-A719 PolarHBondContact O-N 3.05Å; F715-F741 AromaticContact CD2-CE2 4Å; F715-F741 HydrophobicContact CD2-CE2 4Å; F715-F741 AromaticContact CE2-CE2 3.54Å; F715-F741 HydrophobicContact CE2-CE2 3.54Å; F715-F741 AromaticContact CE2-CZ 3.8Å; F715-F741 HydrophobicContact CE2-CZ 3.8Å; F715-F741 HydrophobicContact CZ-CE2 4.01Å; F715-F741 AromaticContact CZ-CZ 3.81Å; F715-F741 HydrophobicContact CZ-CZ 3.81Å; F715-K745 HydrophobicContact CE2-CB 4.21Å; F715-K745 HydrophobicContact CE2-CG 4.13Å; F715-K745 HydrophobicContact CZ-CG 4.12Å; F715-L748 HydrophobicContact CB-CD2 4.36Å; F715-L748 HydrophobicContact CD2-CD2 3.72Å; F715-L748 HydrophobicContact CE2-CD2 4.33Å; F715-L748 HydrophobicContact CG-CD2 4.13Å; F715-L778 HydrophobicContact CB-CD1 4.24Å; F715-L778 HydrophobicContact CD1-CD1 4.21Å; F715-L778 HydrophobicContact CG-CD1 4.38Å; F715-V782 HydrophobicContact CD1-CG2 4.1Å; F715-V782 HydrophobicContact CD2-CG2 4.33Å; F715-V782 HydrophobicContact CE1-CB 4.45Å; F715-V782 HydrophobicContact CE1-CG2 3.82Å; F715-V782 HydrophobicContact CE2-CG2 4.07Å; F715-V782 HydrophobicContact CG-CG2 4.35Å; F715-V782 HydrophobicContact CZ-CB 4.31Å; F715-V782 HydrophobicContact CZ-CG2 3.82Å
716	A	89.3	Confident	85.3	Confident	30 Å²	30	32.1 Å²	32.1	25%	0.248	18%	0.176	C	C	.	.	H	α-helix	trans	-61.7	-37.1	176.1	0	0	0	0	0	112.3	H712 Y713 S720	H712-A716 WeakPolarHBondContact O-CB 3.42Å; H712-A716 PolarHBondContact O-N 2.99Å; Y713-A716 PolarHBondContact O-N 3.19Å; A716-S720 VanDerWaalsContact O-CB 3.24Å; A716-S720 WeakPolarHBondContact O-CB 3.23Å; A716-S720 PolarHBondContact O-N 3.05Å
717	F	89	Confident	83.5	Confident	62 Å²	62	37.4 Å²	37.4	27%	0.272	21%	0.211	S	C	.	.	H	α-helix	trans	-64.6	-46.7	173.8	-173.1	-82.8	0	0	0	112.1	H689 Y713 S714 F715 S720 H721	H689-F717 HydrophobicContact CB-CD1 4.21Å; H689-F717 AromaticContact CD2-CD1 3.45Å; H689-F717 VanDerWaalsContact CD2-CD1 3.45Å; H689-F717 WeakPolarHBondContact CD2-CD1 3.34Å; H689-F717 AromaticContact CD2-CE1 3.85Å; H689-F717 AromaticContact CD2-CG 3.79Å; H689-F717 AromaticContact CG-CD1 3.96Å; Y713-F717 PolarHBondContact O-N 2.86Å; Y713-F717 VanDerWaalsContact O-N 3.11Å; S714-F717 PolarHBondContact O-N 3.32Å; F715-F717 VanDerWaalsContact C-N 3.3Å; F715-F717 PolarHBondContact O-N 3.47Å; F717-S720 PolarHBondContact O-N 2.69Å; F717-H721 PolarHBondContact O-N 3.3Å; F717-H721 VanDerWaalsContact O-N 3.11Å
718	C	89.9	Confident	81.9	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.8	-45.2	176.9	-71.9	0	0	0	0	112.2	H689 L690 S714 F715 S720 H721 V722 F741	H689-C718 WeakPolarHBondContact CB-SG 3.42Å; L690-C718 HydrophobicContact CD2-CB 4.08Å; S714-C718 PolarHBondContact O-N 3.15Å; F715-C718 PolarHBondContact O-N 3.03Å; C718-S720 PolarHBondContact O-N 3.37Å; C718-H721 WeakPolarHBondContact O-CB 3.32Å; C718-H721 PolarHBondContact O-N 3.44Å; C718-V722 WeakPolarHBondContact O-CG2 3.42Å; C718-V722 PolarHBondContact O-N 3.43Å; C718-F741 HydrophobicContact CB-CD2 3.69Å; C718-F741 HydrophobicContact CB-CE2 3.83Å
719	A	88.8	Confident	80.2	Confident	5 Å²	5	45.2 Å²	45.2	4%	0.041	27%	0.269	C	S	.	.	H	α-helix	trans	-63.1	-41.1	176.6	0	0	0	0	0	112.1	F715 H721 V722 H723 F741 I787	F715-A719 HydrophobicContact CE1-CB 4.43Å; F715-A719 WeakPolarHBondContact O-CB 3.29Å; F715-A719 PolarHBondContact O-N 3.05Å; A719-H721 PolarHBondContact O-N 3.4Å; A719-V722 PolarHBondContact O-N 2.85Å; A719-H723 VanDerWaalsContact O-CB 3.29Å; A719-H723 WeakPolarHBondContact O-CB 3.43Å; A719-H723 PolarHBondContact O-N 3.49Å; A719-H723 PolarHBondContact O-ND1 3.45Å; A719-F741 HydrophobicContact CB-CE2 4.12Å; A719-F741 HydrophobicContact CB-CZ 3.71Å; A719-I787 HydrophobicContact CB-CD1 3.74Å; A719-I787 HydrophobicContact CB-CG1 4.34Å; A719-I787 WeakPolarHBondContact O-CD1 3.33Å
720	S	86.3	Confident	78.5	Confident	26 Å²	26	45.6 Å²	45.6	18%	0.182	27%	0.268	C	S	.	.	H	α-helix	trans	-59.7	-36.8	175.1	165.3	0	0	0	0	111.8	A716 F717 C718 G724 N725 I787	A716-S720 VanDerWaalsContact O-CB 3.24Å; A716-S720 WeakPolarHBondContact O-CB 3.23Å; A716-S720 PolarHBondContact O-N 3.05Å; F717-S720 PolarHBondContact O-N 2.69Å; C718-S720 PolarHBondContact O-N 3.37Å; S720-G724 PolarHBondContact O-N 3.37Å; S720-N725 CarbonylContact O-C 3.59Å; S720-N725 PolarHBondContact O-N 3.44Å; S720-N725 PolarHBondContact OG-O 3.23Å; S720-I787 VanDerWaalsContact CA-CD1 3.45Å
721	H	85.8	Confident	77.3	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.009	28%	0.281	C	S	.	.	H	α-helix	trans	-69.4	-56.2	173.8	-174.5	53.1	0	0	0	112.8	C686 F717 C718 A719 H723 G724 R726 T732 V733 E737	C686-H721 HydrophobicContact CB-CB 4.31Å; C686-H721 WeakPolarHBondContact CB-CD2 3.41Å; C686-H721 PolarHBondContact SG-CD2 3.13Å; F717-H721 PolarHBondContact O-N 3.3Å; F717-H721 VanDerWaalsContact O-N 3.11Å; C718-H721 WeakPolarHBondContact O-CB 3.32Å; C718-H721 PolarHBondContact O-N 3.44Å; A719-H721 PolarHBondContact O-N 3.4Å; H721-H723 VanDerWaalsContact C-N 3.33Å; H721-H723 PolarHBondContact O-N 3.18Å; H721-G724 PolarHBondContact O-N 2.87Å; H721-G724 VanDerWaalsContact O-N 3.16Å; H721-R726 PolarHBondContact ND1-NE 3.09Å; H721-R726 PolarHBondContact ND1-NH2 3.18Å; H721-R726 VanDerWaalsContact ND1-NH2 3.15Å; H721-T732 PolarHBondContact CE1-O 2.92Å; H721-T732 PolarHBondContact NE2-O 2.95Å; H721-V733 WeakPolarHBondContact O-CG2 3.37Å; H721-E737 IonicContact NE2-OE1 2.82Å; H721-E737 IonicContact NE2-OE2 3.68Å
722	V	85.7	Confident	76.9	Confident	16 Å²	16	46.8 Å²	46.8	10%	0.097	28%	0.281	C	S	.	.	H	α-helix	trans	-69	-30.5	-171.8	176.3	0	0	0	0	112.3	C718 A719 V733 K738 F741	C718-V722 WeakPolarHBondContact O-CG2 3.42Å; C718-V722 PolarHBondContact O-N 3.43Å; A719-V722 PolarHBondContact O-N 2.85Å; V722-V733 HydrophobicContact CG2-CG1 4.27Å; V722-K738 HydrophobicContact CG1-CB 4.22Å; V722-K738 HydrophobicContact CG1-CD 4.17Å; V722-K738 HydrophobicContact CG1-CG 3.94Å; V722-F741 HydrophobicContact CB-CD1 4.03Å; V722-F741 HydrophobicContact CB-CE1 4.42Å; V722-F741 HydrophobicContact CB-CG 4.4Å; V722-F741 HydrophobicContact CG1-CD1 3.9Å; V722-F741 HydrophobicContact CG1-CE1 4.43Å; V722-F741 HydrophobicContact CG2-CB 3.95Å; V722-F741 HydrophobicContact CG2-CD1 4.08Å; V722-F741 HydrophobicContact CG2-CG 3.95Å
723	H	82.2	Confident	76.7	Confident	51 Å²	51	45.2 Å²	45.2	24%	0.236	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	7.2	176.1	-53.3	150.2	0	0	0	113.9	A719 H721 N725 F741	A719-H723 VanDerWaalsContact O-CB 3.29Å; A719-H723 WeakPolarHBondContact O-CB 3.43Å; A719-H723 PolarHBondContact O-N 3.49Å; A719-H723 PolarHBondContact O-ND1 3.45Å; H721-H723 VanDerWaalsContact C-N 3.33Å; H721-H723 PolarHBondContact O-N 3.18Å; H723-N725 VanDerWaalsContact C-N 3.25Å; H723-N725 PolarHBondContact O-N 2.88Å; H723-N725 VanDerWaalsContact O-N 3.16Å; H723-F741 AromaticContact NE2-CE1 3.87Å
724	G	69	Low	76.5	Confident	56 Å²	56	39 Å²	39	58%	0.577	25%	0.251	S	S	*	.	S	Bend	trans	76.6	-8	172.8	0	0	0	0	0	116.9	S720 H721 R726	S720-G724 PolarHBondContact O-N 3.37Å; H721-G724 PolarHBondContact O-N 2.87Å; H721-G724 VanDerWaalsContact O-N 3.16Å; G724-R726 VanDerWaalsContact C-N 3.25Å; G724-R726 PolarHBondContact O-N 3.28Å
725	N	62.3	Low	76.3	Confident	86 Å²	86	41 Å²	41	46%	0.46	26%	0.263	S	S	.	.			trans	-79.6	64.2	179.2	-75.3	-23.6	0	0	0	112.1	S720 H723 I787	S720-N725 CarbonylContact O-C 3.59Å; S720-N725 PolarHBondContact O-N 3.44Å; S720-N725 PolarHBondContact OG-O 3.23Å; H723-N725 VanDerWaalsContact C-N 3.25Å; H723-N725 PolarHBondContact O-N 2.88Å; H723-N725 VanDerWaalsContact O-N 3.16Å; N725-I787 HydrophobicContact CB-CG2 4.17Å; N725-I787 WeakPolarHBondContact ND2-CG2 3.26Å
726	R	62.4	Low	76.1	Confident	50 Å²	50	45.5 Å²	45.5	19%	0.189	28%	0.284	C	S	.	.			trans	-94.7	135.8	172.1	-91.5	-169.2	171.9	175.6	-1	112.1	H721 G724 D728 I730	H721-R726 PolarHBondContact ND1-NE 3.09Å; H721-R726 PolarHBondContact ND1-NH2 3.18Å; H721-R726 VanDerWaalsContact ND1-NH2 3.15Å; G724-R726 VanDerWaalsContact C-N 3.25Å; G724-R726 PolarHBondContact O-N 3.28Å; R726-D728 PolarHBondContact O-N 3.36Å; R726-I730 PolarHBondContact NH1-O 2.91Å
727	P	50.1	Low	76.1	Confident	119 Å²	119	44.5 Å²	44.5	77%	0.773	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-22.1	171.2	30.3	-34.9	0	0	0	112.9	G729	P727-G729 PolarHBondContact O-N 2.86Å
728	D	53.8	Low	76.1	Confident	124 Å²	124	45.6 Å²	45.6	66%	0.663	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	3.4	-174.6	-47.9	-54.7	0	0	0	114.3	R726 I730	R726-D728 PolarHBondContact O-N 3.36Å; D728-I730 PolarHBondContact O-N 3.45Å
729	G	52.4	Low	76.2	Confident	71 Å²	71	51.7 Å²	51.7	73%	0.732	31%	0.307	S	S	*	.	S	Bend	trans	74.2	-21.8	169	0	0	0	0	0	117.5	P727	P727-G729 PolarHBondContact O-N 2.86Å
730	I	53.6	Low	76.3	Confident	75 Å²	75	55.8 Å²	55.8	39%	0.385	32%	0.322	S	S	.	.			trans	-128.9	133.6	174.4	-54.4	179	0	0	0	109.9	R726 D728	R726-I730 PolarHBondContact NH1-O 2.91Å; D728-I730 PolarHBondContact O-N 3.45Å
731	G	65.5	Low	76.6	Confident	29 Å²	29	54.5 Å²	54.5	30%	0.299	31%	0.313	S	S	.	.			trans	-159.2	95	178.2	0	0	0	0	0	111.6
732	T	82.9	Confident	76.9	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	33%	0.326	C	S	.	.			trans	-72.6	134.4	169.2	59.7	0	0	0	0	109.8	M301 M304 E308 R684 H721	M301-T732 HydrophobicContact CB-CG2 3.95Å; M301-T732 WeakPolarHBondContact O-CG2 3.45Å; M304-T732 HydrophobicContact CB-CG2 3.7Å; E308-T732 WeakPolarHBondContact OE2-CB 3.36Å; E308-T732 PolarHBondContact OE2-N 3.16Å; E308-T732 VanDerWaalsContact OE2-N 3.09Å; E308-T732 PolarHBondContact OE2-OG1 3.12Å; R684-T732 PolarHBondContact NH2-O 3.12Å; R684-T732 PolarHBondContact NH2-OG1 2.6Å; H721-T732 PolarHBondContact CE1-O 2.92Å; H721-T732 PolarHBondContact NE2-O 2.95Å
733	V	86.7	Confident	77.3	Confident	5 Å²	5	62.6 Å²	62.6	3%	0.03	35%	0.35	C	S	.	.			trans	-118	118.7	-178.9	-173.7	0	0	0	0	108.7	F296 I297 M301 H721 V722	F296-V733 WeakPolarHBondContact CD1-O 3.26Å; I297-V733 HydrophobicContact CD1-CB 3.85Å; I297-V733 HydrophobicContact CD1-CG1 3.58Å; I297-V733 HydrophobicContact CG1-CB 4.43Å; I297-V733 HydrophobicContact CG1-CG1 4.39Å; I297-V733 PolarHBondContact N-O 3.01Å; I297-V733 VanDerWaalsContact N-O 3.11Å; M301-V733 PolarHBondContact SD-N 3.41Å; H721-V733 WeakPolarHBondContact O-CG2 3.37Å; V722-V733 HydrophobicContact CG2-CG1 4.27Å
734	S	86.9	Confident	77.8	Confident	7 Å²	7	60.7 Å²	60.7	5%	0.049	34%	0.341	C	S	.	.	B	Isolated β-bridge	trans	-76	154.8	177.6	92.9	0	0	0	0	111	K295 E736 E737 K738	K295-S734 CarbonylContact O-C 3.51Å; K295-S734 VanDerWaalsContact O-CA 3.27Å; K295-S734 WeakPolarHBondContact O-CA 3.45Å; K295-S734 WeakPolarHBondContact O-CB 3.4Å; S734-E736 VanDerWaalsContact C-N 3.26Å; S734-E736 PolarHBondContact O-N 3.41Å; S734-E736 PolarHBondContact OG-N 3.27Å; S734-E737 WeakPolarHBondContact CB-OE2 3.47Å; S734-E737 PolarHBondContact N-OE2 2.94Å; S734-E737 PolarHBondContact O-N 3.02Å; S734-E737 WeakPolarHBondContact OG-CG 3.46Å; S734-E737 PolarHBondContact OG-N 3.44Å; S734-E737 PolarHBondContact OG-OE2 3.02Å; S734-K738 PolarHBondContact O-N 2.8Å; S734-K738 VanDerWaalsContact O-N 3.15Å
735	V	87.9	Confident	78.9	Confident	42 Å²	42	59.5 Å²	59.5	26%	0.255	32%	0.32	S	S	.	.	H	α-helix	trans	-61	-41.2	174.2	177.4	0	0	0	0	110.1	K295 E737 K738 E739	K295-V735 HydrophobicContact CB-CB 4.19Å; K295-V735 HydrophobicContact CB-CG2 3.95Å; K295-V735 PolarHBondContact O-N 3Å; V735-E737 PolarHBondContact O-N 2.97Å; V735-K738 PolarHBondContact O-N 2.86Å; V735-E739 HydrophobicContact CG1-CG 4.22Å; V735-E739 WeakPolarHBondContact CG1-OE1 3.49Å; V735-E739 WeakPolarHBondContact O-CB 3.39Å; V735-E739 WeakPolarHBondContact O-CG 3.29Å; V735-E739 PolarHBondContact O-N 2.97Å
736	E	87.7	Confident	80.4	Confident	99 Å²	99	62.4 Å²	62.4	46%	0.463	33%	0.331	S	S	.	.	H	α-helix	trans	-63.8	-37.5	177.4	-177.9	-173.8	170	0	0	113.1	S734 R740	S734-E736 VanDerWaalsContact C-N 3.26Å; S734-E736 PolarHBondContact O-N 3.41Å; S734-E736 PolarHBondContact OG-N 3.27Å; E736-R740 WeakPolarHBondContact O-CB 3.32Å; E736-R740 WeakPolarHBondContact O-CG 3.47Å; E736-R740 PolarHBondContact O-N 3.43Å; E736-R740 VanDerWaalsContact O-N 3.12Å; E736-R740 IonicContact OE1-CZ 3.5Å; E736-R740 IonicContact OE1-NH1 3.61Å; E736-R740 PolarHBondContact OE1-NH1 2.75Å; E736-R740 IonicContact OE1-NH2 2.69Å; E736-R740 PolarHBondContact OE1-NH2 2.86Å
737	E	89.9	Confident	81.9	Confident	10 Å²	10	63.8 Å²	63.8	5%	0.047	34%	0.336	C	S	.	.	H	α-helix	trans	-67.5	-37.9	174.3	-77.5	170.6	140.1	0	0	111.6	R684 L690 H721 S734 V735 F741	R684-E737 IonicContact CZ-OE1 3.83Å; R684-E737 IonicContact CZ-OE2 2.94Å; R684-E737 IonicContact NH1-OE1 3.98Å; R684-E737 PolarHBondContact NH1-OE1 3.38Å; R684-E737 IonicContact NH1-OE2 2.67Å; R684-E737 PolarHBondContact NH1-OE2 2.82Å; R684-E737 IonicContact NH2-OE1 3.2Å; R684-E737 IonicContact NH2-OE2 2.7Å; L690-E737 HydrophobicContact CD1-CB 4.32Å; L690-E737 HydrophobicContact CD1-CG 4.41Å; H721-E737 IonicContact NE2-OE1 2.82Å; H721-E737 IonicContact NE2-OE2 3.68Å; S734-E737 WeakPolarHBondContact CB-OE2 3.47Å; S734-E737 PolarHBondContact N-OE2 2.94Å; S734-E737 PolarHBondContact O-N 3.02Å; S734-E737 WeakPolarHBondContact OG-CG 3.46Å; S734-E737 PolarHBondContact OG-N 3.44Å; S734-E737 PolarHBondContact OG-OE2 3.02Å; V735-E737 PolarHBondContact O-N 2.97Å; E737-F741 VanDerWaalsContact O-CB 3.3Å; E737-F741 WeakPolarHBondContact O-CB 3.36Å; E737-F741 PolarHBondContact O-N 3.25Å; E737-F741 VanDerWaalsContact O-N 3.08Å
738	K	88.8	Confident	84	Confident	84 Å²	84	58.1 Å²	58.1	37%	0.365	30%	0.299	S	S	.	.	H	α-helix	trans	-71.9	-46.6	176	178.6	167.7	179.4	173.6	0	112.2	I297 V722 S734 V735 R740 F741 E742	I297-K738 HydrophobicContact CD1-CB 4.09Å; I297-K738 HydrophobicContact CD1-CD 3.73Å; I297-K738 HydrophobicContact CD1-CG 4.49Å; V722-K738 HydrophobicContact CG1-CB 4.22Å; V722-K738 HydrophobicContact CG1-CD 4.17Å; V722-K738 HydrophobicContact CG1-CG 3.94Å; S734-K738 PolarHBondContact O-N 2.8Å; S734-K738 VanDerWaalsContact O-N 3.15Å; V735-K738 PolarHBondContact O-N 2.86Å; K738-R740 VanDerWaalsContact C-N 3.34Å; K738-R740 PolarHBondContact O-N 3.47Å; K738-F741 WeakPolarHBondContact O-CB 3.45Å; K738-F741 PolarHBondContact O-N 2.95Å; K738-E742 WeakPolarHBondContact CE-OE1 3.46Å; K738-E742 HydrophobicContact CG-CG 4.43Å; K738-E742 PolarHBondContact O-N 3.19Å
739	E	91.5	Very high	85.9	Confident	129 Å²	129	53.1 Å²	53.1	60%	0.603	27%	0.274	S	S	*	.	H	α-helix	trans	-57.5	-46.9	179.1	-74.2	169.4	166.6	0	0	110.8	V735 F741 E742 E743	V735-E739 HydrophobicContact CG1-CG 4.22Å; V735-E739 WeakPolarHBondContact CG1-OE1 3.49Å; V735-E739 WeakPolarHBondContact O-CB 3.39Å; V735-E739 WeakPolarHBondContact O-CG 3.29Å; V735-E739 PolarHBondContact O-N 2.97Å; E739-F741 VanDerWaalsContact C-N 3.33Å; E739-F741 PolarHBondContact O-N 3.28Å; E739-E742 PolarHBondContact O-N 2.96Å; E739-E743 PolarHBondContact O-N 2.69Å; E739-E743 VanDerWaalsContact O-N 3.12Å
740	R	91.6	Very high	87.9	Confident	90 Å²	90	53.5 Å²	53.5	34%	0.34	27%	0.265	S	S	.	.	H	α-helix	trans	-64.3	-33.1	173	-74.3	-174.9	-177.9	128.4	17.6	113.8	L690 E736 K738 I744	L690-R740 HydrophobicContact CD1-CB 4.25Å; E736-R740 WeakPolarHBondContact O-CB 3.32Å; E736-R740 WeakPolarHBondContact O-CG 3.47Å; E736-R740 PolarHBondContact O-N 3.43Å; E736-R740 VanDerWaalsContact O-N 3.12Å; E736-R740 IonicContact OE1-CZ 3.5Å; E736-R740 IonicContact OE1-NH1 3.61Å; E736-R740 PolarHBondContact OE1-NH1 2.75Å; E736-R740 IonicContact OE1-NH2 2.69Å; E736-R740 PolarHBondContact OE1-NH2 2.86Å; K738-R740 VanDerWaalsContact C-N 3.34Å; K738-R740 PolarHBondContact O-N 3.47Å; R740-I744 VanDerWaalsContact O-CB 3.29Å; R740-I744 WeakPolarHBondContact O-CB 3.13Å; R740-I744 WeakPolarHBondContact O-CD1 3.39Å; R740-I744 VanDerWaalsContact O-CG1 3.24Å; R740-I744 WeakPolarHBondContact O-CG1 3.49Å; R740-I744 PolarHBondContact O-N 3.33Å
741	F	92.4	Very high	89.8	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-67.1	-44.5	178.3	174.6	-108.1	0	0	0	111.9	L690 F715 C718 A719 V722 H723 E737 K738 E739 I744 K745	L690-F741 HydrophobicContact CD2-CB 3.96Å; L690-F741 HydrophobicContact CD2-CD2 4.14Å; F715-F741 AromaticContact CD2-CE2 4Å; F715-F741 HydrophobicContact CD2-CE2 4Å; F715-F741 AromaticContact CE2-CE2 3.54Å; F715-F741 HydrophobicContact CE2-CE2 3.54Å; F715-F741 AromaticContact CE2-CZ 3.8Å; F715-F741 HydrophobicContact CE2-CZ 3.8Å; F715-F741 HydrophobicContact CZ-CE2 4.01Å; F715-F741 AromaticContact CZ-CZ 3.81Å; F715-F741 HydrophobicContact CZ-CZ 3.81Å; C718-F741 HydrophobicContact CB-CD2 3.69Å; C718-F741 HydrophobicContact CB-CE2 3.83Å; A719-F741 HydrophobicContact CB-CE2 4.12Å; A719-F741 HydrophobicContact CB-CZ 3.71Å; V722-F741 HydrophobicContact CB-CD1 4.03Å; V722-F741 HydrophobicContact CB-CE1 4.42Å; V722-F741 HydrophobicContact CB-CG 4.4Å; V722-F741 HydrophobicContact CG1-CD1 3.9Å; V722-F741 HydrophobicContact CG1-CE1 4.43Å; V722-F741 HydrophobicContact CG2-CB 3.95Å; V722-F741 HydrophobicContact CG2-CD1 4.08Å; V722-F741 HydrophobicContact CG2-CG 3.95Å; H723-F741 AromaticContact NE2-CE1 3.87Å; E737-F741 VanDerWaalsContact O-CB 3.3Å; E737-F741 WeakPolarHBondContact O-CB 3.36Å; E737-F741 PolarHBondContact O-N 3.25Å; E737-F741 VanDerWaalsContact O-N 3.08Å; K738-F741 WeakPolarHBondContact O-CB 3.45Å; K738-F741 PolarHBondContact O-N 2.95Å; E739-F741 VanDerWaalsContact C-N 3.33Å; E739-F741 PolarHBondContact O-N 3.28Å; F741-I744 PolarHBondContact O-N 2.93Å; F741-K745 HydrophobicContact CE1-CD 4.37Å; F741-K745 VanDerWaalsContact O-CB 3.25Å; F741-K745 WeakPolarHBondContact O-CB 3.45Å; F741-K745 PolarHBondContact O-N 3.26Å
742	E	91.7	Very high	91.2	Very high	62 Å²	62	49.1 Å²	49.1	29%	0.29	24%	0.235	S	C	.	.	H	α-helix	trans	-68.8	-39.3	177.8	-52.6	-68.2	-175.9	0	0	111.1	K738 E739 I744 K745 E746	K738-E742 WeakPolarHBondContact CE-OE1 3.46Å; K738-E742 HydrophobicContact CG-CG 4.43Å; K738-E742 PolarHBondContact O-N 3.19Å; E739-E742 PolarHBondContact O-N 2.96Å; E742-I744 PolarHBondContact O-N 3.31Å; E742-K745 WeakPolarHBondContact O-CB 3.45Å; E742-K745 PolarHBondContact O-N 3.12Å; E742-K745 VanDerWaalsContact O-N 3.14Å; E742-K745 WeakPolarHBondContact OE2-CD 3.3Å; E742-K745 IonicContact OE2-NZ 2.83Å; E742-E746 PolarHBondContact O-N 3.2Å
743	E	93.1	Very high	91.7	Very high	126 Å²	126	51.1 Å²	51.1	59%	0.589	25%	0.245	S	C	*	.	H	α-helix	trans	-56.5	-48.7	172.2	-175.4	-167.2	169.9	0	0	111.7	E739 K745 R747	E739-E743 PolarHBondContact O-N 2.69Å; E739-E743 VanDerWaalsContact O-N 3.12Å; E743-K745 VanDerWaalsContact C-N 3.32Å; E743-K745 PolarHBondContact O-N 2.83Å; E743-R747 WeakPolarHBondContact O-CB 3.15Å; E743-R747 PolarHBondContact O-N 3.03Å; E743-R747 VanDerWaalsContact O-N 3.12Å
744	I	93.8	Very high	92	Very high	10 Å²	10	54.8 Å²	54.8	5%	0.051	26%	0.264	C	S	.	.	H	α-helix	trans	-65.1	-36.1	176.4	-74.1	169.6	0	0	0	111	L690 L693 A694 M697 R740 F741 E742 L748	L690-I744 HydrophobicContact CB-CD1 4.04Å; L690-I744 HydrophobicContact CD2-CD1 3.96Å; L690-I744 VanDerWaalsContact O-CD1 3.3Å; L690-I744 WeakPolarHBondContact O-CD1 3.26Å; L693-I744 HydrophobicContact CB-CG2 3.95Å; L693-I744 HydrophobicContact CD1-CG2 4.08Å; A694-I744 HydrophobicContact CB-CD1 4.23Å; M697-I744 HydrophobicContact CE-CG2 4.38Å; M697-I744 HydrophobicContact SD-CG2 3.95Å; R740-I744 VanDerWaalsContact O-CB 3.29Å; R740-I744 WeakPolarHBondContact O-CB 3.13Å; R740-I744 WeakPolarHBondContact O-CD1 3.39Å; R740-I744 VanDerWaalsContact O-CG1 3.24Å; R740-I744 WeakPolarHBondContact O-CG1 3.49Å; R740-I744 PolarHBondContact O-N 3.33Å; F741-I744 PolarHBondContact O-N 2.93Å; E742-I744 PolarHBondContact O-N 3.31Å; I744-L748 WeakPolarHBondContact O-CB 3.45Å; I744-L748 PolarHBondContact O-N 3Å
745	K	92.8	Very high	92.3	Very high	32 Å²	32	55.1 Å²	55.1	14%	0.139	27%	0.265	C	S	.	.	H	α-helix	trans	-64.5	-46.6	178.3	-174.2	-176.1	-174.2	178.7	0	111.9	F715 F741 E742 E743 S749 V782 M784	F715-K745 HydrophobicContact CE2-CB 4.21Å; F715-K745 HydrophobicContact CE2-CG 4.13Å; F715-K745 HydrophobicContact CZ-CG 4.12Å; F741-K745 HydrophobicContact CE1-CD 4.37Å; F741-K745 VanDerWaalsContact O-CB 3.25Å; F741-K745 WeakPolarHBondContact O-CB 3.45Å; F741-K745 PolarHBondContact O-N 3.26Å; E742-K745 WeakPolarHBondContact O-CB 3.45Å; E742-K745 PolarHBondContact O-N 3.12Å; E742-K745 VanDerWaalsContact O-N 3.14Å; E742-K745 WeakPolarHBondContact OE2-CD 3.3Å; E742-K745 IonicContact OE2-NZ 2.83Å; E743-K745 VanDerWaalsContact C-N 3.32Å; E743-K745 PolarHBondContact O-N 2.83Å; K745-S749 WeakPolarHBondContact O-CB 3.41Å; K745-S749 PolarHBondContact O-N 2.64Å; K745-V782 WeakPolarHBondContact CE-O 3.34Å; K745-V782 HydrophobicContact CG-CG1 4.11Å; K745-M784 PolarHBondContact NZ-O 3.43Å
746	E	92.4	Very high	92.5	Very high	146 Å²	146	53.1 Å²	53.1	68%	0.682	25%	0.253	S	S	*	.	H	α-helix	trans	-66.7	-45.1	178	-69	-170.4	161	0	0	112.1	E742 S749 S750	E742-E746 PolarHBondContact O-N 3.2Å; E746-S749 PolarHBondContact O-N 2.83Å; E746-S750 PolarHBondContact O-N 3.34Å; E746-S750 PolarHBondContact O-OG 2.98Å
747	R	94.6	Very high	92.8	Very high	80 Å²	80	48.6 Å²	48.6	30%	0.302	23%	0.232	S	C	.	.	H	α-helix	trans	-64	-40.9	176.1	-175.7	179.9	165.1	-162.2	-0.1	111.7	M697 E701 E743 S750 L751	M697-R747 HydrophobicContact CE-CB 3.69Å; M697-R747 HydrophobicContact CE-CG 3.51Å; E701-R747 VanDerWaalsContact CD-NH2 3.35Å; E701-R747 IonicContact OE1-CZ 3.19Å; E701-R747 IonicContact OE1-NE 3.91Å; E701-R747 PolarHBondContact OE1-NE 3.09Å; E701-R747 IonicContact OE1-NH2 2.7Å; E701-R747 PolarHBondContact OE1-NH2 3.05Å; E701-R747 IonicContact OE2-CZ 2.8Å; E701-R747 IonicContact OE2-NE 3.14Å; E701-R747 PolarHBondContact OE2-NE 3.18Å; E701-R747 IonicContact OE2-NH2 3.21Å; E701-R747 PolarHBondContact OE2-NH2 3.44Å; E743-R747 WeakPolarHBondContact O-CB 3.15Å; E743-R747 PolarHBondContact O-N 3.03Å; E743-R747 VanDerWaalsContact O-N 3.12Å; R747-S750 PolarHBondContact O-N 3.33Å; R747-L751 WeakPolarHBondContact O-CB 3.29Å; R747-L751 PolarHBondContact O-N 3.1Å
748	L	94.3	Very high	93	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66.1	-42.5	175.6	-179.1	59.1	0	0	0	111.4	M697 L711 F715 I744 S750 L751 L752 V782	M697-L748 HydrophobicContact CE-CB 3.95Å; M697-L748 HydrophobicContact CG-CD1 4.32Å; M697-L748 HydrophobicContact SD-CB 4.02Å; M697-L748 HydrophobicContact SD-CD1 4.19Å; L711-L748 HydrophobicContact CD1-CD1 4.45Å; F715-L748 HydrophobicContact CB-CD2 4.36Å; F715-L748 HydrophobicContact CD2-CD2 3.72Å; F715-L748 HydrophobicContact CE2-CD2 4.33Å; F715-L748 HydrophobicContact CG-CD2 4.13Å; I744-L748 WeakPolarHBondContact O-CB 3.45Å; I744-L748 PolarHBondContact O-N 3Å; L748-S750 VanDerWaalsContact C-N 3.28Å; L748-S750 PolarHBondContact O-N 2.65Å; L748-L751 HydrophobicContact CD1-CD2 4.45Å; L748-L751 PolarHBondContact O-N 2.89Å; L748-L752 HydrophobicContact CD1-CD1 4.12Å; L748-L752 HydrophobicContact CD1-CD2 4.46Å; L748-L752 HydrophobicContact CD1-CG 4.08Å; L748-L752 HydrophobicContact CG-CD1 3.9Å; L748-L752 HydrophobicContact CG-CG 4.34Å; L748-L752 WeakPolarHBondContact O-CB 3.4Å; L748-L752 WeakPolarHBondContact O-CG 3.49Å; L748-L752 PolarHBondContact O-N 2.95Å; L748-V782 HydrophobicContact CD2-CG2 3.72Å; L748-V782 HydrophobicContact CG-CG2 4.07Å
749	S	93.7	Very high	93.1	Very high	19 Å²	19	46.3 Å²	46.3	13%	0.133	22%	0.223	C	C	.	.	H	α-helix	trans	-57	-44.2	174	-164.8	0	0	0	0	111.5	K745 E746 L752 E753	K745-S749 WeakPolarHBondContact O-CB 3.41Å; K745-S749 PolarHBondContact O-N 2.64Å; E746-S749 PolarHBondContact O-N 2.83Å; S749-L752 PolarHBondContact O-N 3.48Å; S749-E753 PolarHBondContact O-N 3.21Å
750	S	93.8	Very high	93	Very high	78 Å²	78	40.8 Å²	40.8	55%	0.545	20%	0.196	S	C	.	.	H	α-helix	trans	-63.9	-41.5	176.9	-54.2	0	0	0	0	112.5	E746 R747 L748 N754	E746-S750 PolarHBondContact O-N 3.34Å; E746-S750 PolarHBondContact O-OG 2.98Å; R747-S750 PolarHBondContact O-N 3.33Å; L748-S750 VanDerWaalsContact C-N 3.28Å; L748-S750 PolarHBondContact O-N 2.65Å; S750-N754 WeakPolarHBondContact O-CB 3.46Å; S750-N754 PolarHBondContact O-N 3.48Å
751	L	93.6	Very high	92.8	Very high	12 Å²	12	39.4 Å²	39.4	6%	0.063	19%	0.191	C	C	.	.	H	α-helix	trans	-63.3	-41.8	175.2	178.6	60.8	0	0	0	111.8	M697 E701 R747 L748 N754 Q755	M697-L751 HydrophobicContact CB-CD2 4.19Å; M697-L751 HydrophobicContact CG-CD2 3.9Å; E701-L751 HydrophobicContact CG-CD1 4.04Å; R747-L751 WeakPolarHBondContact O-CB 3.29Å; R747-L751 PolarHBondContact O-N 3.1Å; L748-L751 HydrophobicContact CD1-CD2 4.45Å; L748-L751 PolarHBondContact O-N 2.89Å; L751-N754 WeakPolarHBondContact O-CB 3.5Å; L751-N754 PolarHBondContact O-N 3.13Å; L751-Q755 HydrophobicContact CD1-CG 4.43Å; L751-Q755 WeakPolarHBondContact O-CG 3.28Å; L751-Q755 PolarHBondContact O-N 3Å
752	L	94.4	Very high	92.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-69.7	-44.1	179.1	-65.3	167.4	0	0	0	112.1	L748 S749 N754 Q755 I756 T775 L778 L779 V782	L748-L752 HydrophobicContact CD1-CD1 4.12Å; L748-L752 HydrophobicContact CD1-CD2 4.46Å; L748-L752 HydrophobicContact CD1-CG 4.08Å; L748-L752 HydrophobicContact CG-CD1 3.9Å; L748-L752 HydrophobicContact CG-CG 4.34Å; L748-L752 WeakPolarHBondContact O-CB 3.4Å; L748-L752 WeakPolarHBondContact O-CG 3.49Å; L748-L752 PolarHBondContact O-N 2.95Å; S749-L752 PolarHBondContact O-N 3.48Å; L752-N754 PolarHBondContact O-N 2.94Å; L752-Q755 PolarHBondContact O-N 3.4Å; L752-I756 WeakPolarHBondContact O-CD1 3.35Å; L752-I756 VanDerWaalsContact O-CG1 3.3Å; L752-I756 WeakPolarHBondContact O-CG1 3.41Å; L752-I756 PolarHBondContact O-N 3.38Å; L752-T775 HydrophobicContact CD2-CG2 3.6Å; L752-L778 HydrophobicContact CD1-CB 4.46Å; L752-L778 HydrophobicContact CD1-CD2 4.36Å; L752-L778 HydrophobicContact CD1-CG 3.88Å; L752-L778 HydrophobicContact CD2-CD2 4.1Å; L752-L778 HydrophobicContact CD2-CG 4.3Å; L752-L779 HydrophobicContact CB-CD1 4.27Å; L752-L779 HydrophobicContact CD1-CB 4.39Å; L752-V782 HydrophobicContact CD1-CB 4.38Å; L752-V782 HydrophobicContact CD1-CG2 3.92Å
753	E	94.2	Very high	92.4	Very high	42 Å²	42	38.9 Å²	38.9	20%	0.196	19%	0.193	C	C	.	.	H	α-helix	trans	-55	-42	170.7	-84.1	-157.4	-143.6	0	0	111.1	S749 S757 V799 K806	S749-E753 PolarHBondContact O-N 3.21Å; E753-S757 VanDerWaalsContact O-CB 3.29Å; E753-S757 WeakPolarHBondContact O-CB 3.39Å; E753-S757 PolarHBondContact O-N 3.43Å; E753-S757 PolarHBondContact O-OG 2.9Å; E753-V799 HydrophobicContact CG-CG1 3.99Å; E753-K806 IonicContact OE2-NZ 3.6Å; E753-K806 PolarHBondContact OE2-NZ 3.02Å
754	N	93.1	Very high	92.2	Very high	82 Å²	82	33 Å²	33	44%	0.439	17%	0.166	S	C	.	.	H	α-helix	trans	-67.4	-44.8	178.8	-171	26.8	0	0	0	112.2	S750 L751 L752 I756 S757 H758	S750-N754 WeakPolarHBondContact O-CB 3.46Å; S750-N754 PolarHBondContact O-N 3.48Å; L751-N754 WeakPolarHBondContact O-CB 3.5Å; L751-N754 PolarHBondContact O-N 3.13Å; L752-N754 PolarHBondContact O-N 2.94Å; N754-I756 VanDerWaalsContact C-N 3.34Å; N754-I756 PolarHBondContact O-N 3.37Å; N754-S757 PolarHBondContact O-N 3.2Å; N754-H758 WeakPolarHBondContact O-CB 3.38Å; N754-H758 PolarHBondContact O-N 3.12Å; N754-H758 PolarHBondContact O-ND1 2.9Å; N754-H758 PolarHBondContact OD1-CE1 3.1Å; N754-H758 VanDerWaalsContact OD1-CE1 3.26Å; N754-H758 PolarHBondContact OD1-ND1 3.11Å
755	Q	92.3	Very high	91.8	Very high	15 Å²	15	33 Å²	33	7%	0.07	17%	0.166	C	C	.	.	H	α-helix	trans	-62.6	-37.9	176.8	-75.3	179	6.1	0	0	112.7	S700 L751 L752 H758 F759 C762 F763 T775	S700-Q755 PolarHBondContact OG-NE2 2.94Å; L751-Q755 HydrophobicContact CD1-CG 4.43Å; L751-Q755 WeakPolarHBondContact O-CG 3.28Å; L751-Q755 PolarHBondContact O-N 3Å; L752-Q755 PolarHBondContact O-N 3.4Å; Q755-H758 CarbonylContact O-C 3.08Å; Q755-F759 WeakPolarHBondContact O-CA 3.49Å; Q755-F759 PolarHBondContact O-N 3.46Å; Q755-F759 VanDerWaalsContact O-N 3.13Å; Q755-C762 HydrophobicContact CB-CB 4.45Å; Q755-C762 HydrophobicContact CG-CB 4.49Å; Q755-F763 HydrophobicContact CB-CE2 4.22Å; Q755-F763 HydrophobicContact CB-CZ 4.3Å; Q755-T775 HydrophobicContact CB-CG2 4.3Å
756	I	93.7	Very high	91.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-72.7	-42.3	175.8	-63.6	160.9	0	0	0	110.2	L752 N754 H758 F759 L772 T775 L776 L779 C803	L752-I756 WeakPolarHBondContact O-CD1 3.35Å; L752-I756 VanDerWaalsContact O-CG1 3.3Å; L752-I756 WeakPolarHBondContact O-CG1 3.41Å; L752-I756 PolarHBondContact O-N 3.38Å; N754-I756 VanDerWaalsContact C-N 3.34Å; N754-I756 PolarHBondContact O-N 3.37Å; I756-H758 PolarHBondContact O-N 3.13Å; I756-F759 WeakPolarHBondContact O-CB 3.21Å; I756-F759 WeakPolarHBondContact O-CD1 3.35Å; I756-F759 PolarHBondContact O-N 3.4Å; I756-L772 HydrophobicContact CG1-CD1 4.48Å; I756-T775 HydrophobicContact CD1-CG2 4.29Å; I756-T775 HydrophobicContact CG1-CG2 3.95Å; I756-L776 HydrophobicContact CD1-CD2 3.83Å; I756-L776 HydrophobicContact CG1-CD2 4.27Å; I756-L779 HydrophobicContact CD1-CB 4.45Å; I756-L779 HydrophobicContact CD1-CD2 3.65Å; I756-C803 HydrophobicContact CB-CB 4.09Å; I756-C803 HydrophobicContact CG2-CB 3.61Å
757	S	94.3	Very high	91	Very high	3 Å²	3	25.7 Å²	25.7	2%	0.021	14%	0.136	C	C	.	.	H	α-helix	trans	-61.9	-27.3	175.4	-55.5	0	0	0	0	112.6	E753 N754 K806 A807	E753-S757 VanDerWaalsContact O-CB 3.29Å; E753-S757 WeakPolarHBondContact O-CB 3.39Å; E753-S757 PolarHBondContact O-N 3.43Å; E753-S757 PolarHBondContact O-OG 2.9Å; N754-S757 PolarHBondContact O-N 3.2Å; S757-K806 WeakPolarHBondContact OG-CD 3.45Å; S757-A807 WeakPolarHBondContact O-CA 3.49Å; S757-A807 VanDerWaalsContact O-CB 3.26Å; S757-A807 WeakPolarHBondContact O-CB 3.25Å
758	H	92.1	Very high	90.5	Very high	46 Å²	46	22.7 Å²	22.7	21%	0.213	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.5	27.3	179	-70.4	102.1	0	0	0	113.6	N754 Q755 I756 R760 Y761 C762	N754-H758 WeakPolarHBondContact O-CB 3.38Å; N754-H758 PolarHBondContact O-N 3.12Å; N754-H758 PolarHBondContact O-ND1 2.9Å; N754-H758 PolarHBondContact OD1-CE1 3.1Å; N754-H758 VanDerWaalsContact OD1-CE1 3.26Å; N754-H758 PolarHBondContact OD1-ND1 3.11Å; Q755-H758 CarbonylContact O-C 3.08Å; I756-H758 PolarHBondContact O-N 3.13Å; H758-R760 VanDerWaalsContact C-N 3.29Å; H758-R760 PolarHBondContact O-N 3.24Å; H758-Y761 WeakPolarHBondContact O-CA 3.11Å; H758-Y761 PolarHBondContact O-N 3.18Å; H758-C762 PolarHBondContact O-N 3.19Å
759	F	91.9	Very high	89.9	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-52.8	-38.3	-168	72.9	-91.2	0	0	0	115.1	Q755 I756 Y761 F763 L772 L804 A807 N851 H855	Q755-F759 WeakPolarHBondContact O-CA 3.49Å; Q755-F759 PolarHBondContact O-N 3.46Å; Q755-F759 VanDerWaalsContact O-N 3.13Å; I756-F759 WeakPolarHBondContact O-CB 3.21Å; I756-F759 WeakPolarHBondContact O-CD1 3.35Å; I756-F759 PolarHBondContact O-N 3.4Å; F759-Y761 PolarHBondContact O-N 3.4Å; F759-F763 PolarHBondContact O-N 3.36Å; F759-L772 HydrophobicContact CB-CD1 4.08Å; F759-L772 HydrophobicContact CB-CD2 4.09Å; F759-L772 HydrophobicContact CD2-CD2 4.32Å; F759-L772 HydrophobicContact CG-CD2 4.47Å; F759-L804 HydrophobicContact CD1-CD2 4.47Å; F759-L804 HydrophobicContact CE1-CD2 4.16Å; F759-A807 HydrophobicContact CD1-CB 4.04Å; F759-A807 HydrophobicContact CE1-CB 3.86Å; F759-N851 WeakPolarHBondContact CE2-OD1 3.41Å; F759-H855 HydrophobicContact CD2-CB 4.31Å; F759-H855 AromaticContact CD2-CD2 3.88Å; F759-H855 AromaticContact CD2-CE1 3.75Å; F759-H855 AromaticContact CD2-CG 3.7Å; F759-H855 AromaticContact CD2-ND1 3.63Å; F759-H855 AromaticContact CD2-NE2 3.92Å; F759-H855 HydrophobicContact CE2-CB 4.14Å; F759-H855 AromaticContact CE2-CD2 3.71Å; F759-H855 AromaticContact CE2-CG 3.75Å
760	R	89.7	Confident	89.4	Confident	13 Å²	13	29 Å²	29	5%	0.049	17%	0.166	C	C	.	.	H	α-helix	trans	-62.4	-19.7	175.7	-74.8	-179.6	72.3	90.5	-10.1	114.2	R158 H758 N811 V847 N851	R158-R760 VanDerWaalsContact CD-O 3.26Å; R158-R760 WeakPolarHBondContact CD-O 3.43Å; H758-R760 VanDerWaalsContact C-N 3.29Å; H758-R760 PolarHBondContact O-N 3.24Å; R760-N811 WeakPolarHBondContact CD-OD1 3.48Å; R760-V847 PolarHBondContact NH1-O 2.88Å; R760-N851 WeakPolarHBondContact CD-OD1 3.16Å; R760-N851 WeakPolarHBondContact CG-OD1 3.22Å; R760-N851 PolarHBondContact NH1-OD1 3.37Å
761	Y	86.8	Confident	89.2	Confident	61 Å²	61	25.5 Å²	25.5	24%	0.239	14%	0.142	C	C	.	.	H	α-helix	trans	-108.8	-35.5	-178.1	-64.4	-84.4	0	0	0	112.8	R158 H758 F759 P764 R814	R158-Y761 HydrophobicContact CG-CD1 3.9Å; R158-Y761 HydrophobicContact CG-CE1 3.89Å; H758-Y761 WeakPolarHBondContact O-CA 3.11Å; H758-Y761 PolarHBondContact O-N 3.18Å; F759-Y761 PolarHBondContact O-N 3.4Å; Y761-P764 WeakPolarHBondContact O-CD 3.33Å; Y761-P764 WeakPolarHBondContact O-CG 3.5Å; Y761-R814 VanDerWaalsContact CE2-NH1 3.33Å; Y761-R814 VanDerWaalsContact OH-CD 3.24Å; Y761-R814 WeakPolarHBondContact OH-CD 3.46Å
762	C	87.3	Confident	89	Confident	43 Å²	43	25.3 Å²	25.3	29%	0.291	14%	0.141	S	C	.	.	H	α-helix	trans	-75.3	-30.1	174.9	-65.9	0	0	0	0	112.5	Q755 H758	Q755-C762 HydrophobicContact CB-CB 4.45Å; Q755-C762 HydrophobicContact CG-CB 4.49Å; H758-C762 PolarHBondContact O-N 3.19Å
763	F	89	Confident	88.9	Confident	8 Å²	8	28 Å²	28	4%	0.035	15%	0.153	C	C	.	.	S	Bend	trans	-129.9	59.5	179.4	-48.4	-69.8	0	0	0	112.7	P708 Q755 F759 F765 G766 R767 A771 L772 T775 H855	P708-F763 HydrophobicContact CG-CE1 4.33Å; Q755-F763 HydrophobicContact CB-CE2 4.22Å; Q755-F763 HydrophobicContact CB-CZ 4.3Å; F759-F763 PolarHBondContact O-N 3.36Å; F763-F765 PolarHBondContact O-N 2.87Å; F763-G766 PolarHBondContact O-N 3.38Å; F763-R767 CarbonylContact C-O 3.51Å; F763-R767 VanDerWaalsContact CA-O 3.22Å; F763-R767 WeakPolarHBondContact CA-O 3.42Å; F763-A771 HydrophobicContact CD1-CB 3.61Å; F763-A771 HydrophobicContact CE1-CB 3.72Å; F763-L772 HydrophobicContact CD2-CB 3.92Å; F763-L772 HydrophobicContact CD2-CD1 3.88Å; F763-L772 HydrophobicContact CD2-CG 4.39Å; F763-L772 HydrophobicContact CE2-CB 4.33Å; F763-L772 HydrophobicContact CE2-CD1 3.87Å; F763-L772 HydrophobicContact CG-CB 4.26Å; F763-T775 HydrophobicContact CZ-CG2 4.4Å; F763-T775 VanDerWaalsContact CZ-OG1 3.29Å; F763-T775 WeakPolarHBondContact CZ-OG1 3.46Å; F763-H855 PolarHBondContact O-CE1 3.04Å; F763-H855 VanDerWaalsContact O-CE1 3.25Å
764	P	87.7	Confident	88.7	Confident	3 Å²	3	27 Å²	27	2%	0.019	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-53.7	128.1	-172.1	-27.2	37.9	0	0	0	113	R158 M162 Y761 G766 R767	R158-P764 HydrophobicContact CB-CB 4Å; R158-P764 HydrophobicContact CB-CG 4.12Å; M162-P764 HydrophobicContact CB-CG 4.35Å; M162-P764 HydrophobicContact SD-CB 4.21Å; M162-P764 HydrophobicContact SD-CG 4.25Å; Y761-P764 WeakPolarHBondContact O-CD 3.33Å; Y761-P764 WeakPolarHBondContact O-CG 3.5Å; P764-G766 PolarHBondContact O-N 3.4Å; P764-R767 WeakPolarHBondContact O-CB 3.35Å; P764-R767 PolarHBondContact O-N 3.2Å; P764-R767 VanDerWaalsContact O-N 3.09Å
765	F	86.7	Confident	88.7	Confident	9 Å²	9	23 Å²	23	4%	0.039	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	55.9	31	179.4	-54	-95.2	0	0	0	113.5	V152 F153 V159 V176 F763 H854	V152-F765 HydrophobicContact CG1-CE1 4.32Å; V152-F765 WeakPolarHBondContact O-CZ 3.43Å; F153-F765 HydrophobicContact CB-CE1 4.49Å; F153-F765 HydrophobicContact CB-CZ 4.45Å; F153-F765 HydrophobicContact CD2-CB 4.33Å; F153-F765 AromaticContact CD2-CD1 3.88Å; F153-F765 HydrophobicContact CD2-CD1 3.88Å; F153-F765 AromaticContact CD2-CD2 3.49Å; F153-F765 HydrophobicContact CD2-CD2 3.49Å; F153-F765 VanDerWaalsContact CD2-CD2 3.49Å; F153-F765 HydrophobicContact CD2-CE1 4.03Å; F153-F765 AromaticContact CD2-CE2 3.66Å; F153-F765 HydrophobicContact CD2-CE2 3.66Å; F153-F765 AromaticContact CD2-CG 3.62Å; F153-F765 HydrophobicContact CD2-CG 3.62Å; F153-F765 AromaticContact CD2-CZ 3.93Å; F153-F765 HydrophobicContact CD2-CZ 3.93Å; F153-F765 HydrophobicContact CE2-CB 4.16Å; F153-F765 AromaticContact CE2-CD2 3.65Å; F153-F765 HydrophobicContact CE2-CD2 3.65Å; F153-F765 HydrophobicContact CE2-CE2 4.19Å; F153-F765 AromaticContact CE2-CG 3.87Å; F153-F765 HydrophobicContact CE2-CG 3.87Å; V159-F765 HydrophobicContact CG2-CD2 4Å; V159-F765 HydrophobicContact CG2-CE2 3.69Å; V176-F765 HydrophobicContact CG1-CB 4.31Å; V176-F765 HydrophobicContact CG2-CB 4.23Å; F763-F765 PolarHBondContact O-N 2.87Å; F765-H854 AromaticContact CD1-CD2 3.74Å; F765-H854 AromaticContact CD1-NE2 3.5Å
766	G	83.6	Confident	88.7	Confident	17 Å²	17	23 Å²	23	18%	0.175	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	72.2	25.5	-179.5	0	0	0	0	0	113.8	F763 P764 P768	F763-G766 PolarHBondContact O-N 3.38Å; P764-G766 PolarHBondContact O-N 3.4Å; G766-P768 CarbonylContact O-C 3.6Å
767	R	85.3	Confident	88.6	Confident	8 Å²	8	24.8 Å²	24.8	3%	0.03	14%	0.143	C	C	.	.			trans	-113.7	137.3	-179.1	-61.4	-70.5	167	-168.9	-20.4	111.6	M162 D172 V176 F763 P764 E769	M162-R767 HydrophobicContact SD-CB 3.97Å; D172-R767 HydrophobicContact CB-CG 4.44Å; D172-R767 WeakPolarHBondContact OD1-CD 3.4Å; D172-R767 IonicContact OD1-NH1 2.96Å; D172-R767 PolarHBondContact OD1-NH1 3.28Å; V176-R767 HydrophobicContact CG2-CG 3.85Å; F763-R767 CarbonylContact C-O 3.51Å; F763-R767 VanDerWaalsContact CA-O 3.22Å; F763-R767 WeakPolarHBondContact CA-O 3.42Å; P764-R767 WeakPolarHBondContact O-CB 3.35Å; P764-R767 PolarHBondContact O-N 3.2Å; P764-R767 VanDerWaalsContact O-N 3.09Å; R767-E769 IonicContact CZ-OE2 2.72Å; R767-E769 IonicContact NH1-OE2 3.38Å; R767-E769 PolarHBondContact NH1-OE2 3.21Å; R767-E769 IonicContact NH2-OE1 2.86Å; R767-E769 IonicContact NH2-OE2 3.8Å; R767-E769 PolarHBondContact NH2-OE2 3.27Å
768	P	82.8	Confident	88.5	Confident	17 Å²	17	24.7 Å²	24.7	11%	0.11	14%	0.142	C	C	.	.	S	Bend	cis	-62.8	151.8	-5.2	-20.5	33.6	0	0	0	113.2	L663 V705 G766 G770 A771	L663-P768 HydrophobicContact CD1-CB 3.95Å; L663-P768 HydrophobicContact CD1-CG 3.84Å; L663-P768 HydrophobicContact CD2-CG 4.15Å; V705-P768 HydrophobicContact CG1-CG 3.78Å; G766-P768 CarbonylContact O-C 3.6Å; P768-G770 PolarHBondContact O-N 3.17Å; P768-A771 HydrophobicContact CB-CB 4.24Å; P768-A771 WeakPolarHBondContact O-CB 3.41Å; P768-A771 PolarHBondContact O-N 3.22Å; P768-A771 VanDerWaalsContact O-N 3.12Å
769	E	81.5	Confident	88.5	Confident	108 Å²	108	22.5 Å²	22.5	51%	0.505	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	132	-171.3	-167.3	143.3	-155.3	0	0	111.6	K179 R767 A771	K179-E769 IonicContact NZ-OE1 2.65Å; K179-E769 PolarHBondContact NZ-OE1 3.33Å; R767-E769 IonicContact CZ-OE2 2.72Å; R767-E769 IonicContact NH1-OE2 3.38Å; R767-E769 PolarHBondContact NH1-OE2 3.21Å; R767-E769 IonicContact NH2-OE1 2.86Å; R767-E769 IonicContact NH2-OE2 3.8Å; R767-E769 PolarHBondContact NH2-OE2 3.27Å; E769-A771 PolarHBondContact O-N 3.31Å
770	G	84.6	Confident	88.3	Confident	44 Å²	44	26.6 Å²	26.6	45%	0.454	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.4	-6.7	-175	0	0	0	0	0	115.7	P768 L772 K773 A774	P768-G770 PolarHBondContact O-N 3.17Å; G770-L772 PolarHBondContact O-N 3.49Å; G770-K773 WeakPolarHBondContact O-CB 3.31Å; G770-K773 PolarHBondContact O-N 3.04Å; G770-A774 PolarHBondContact O-N 3.36Å
771	A	87.8	Confident	88.3	Confident	4 Å²	4	31.1 Å²	31.1	3%	0.033	17%	0.168	C	C	.	.	H	α-helix	trans	-56.7	-47.5	-172.5	0	0	0	0	0	113.1	P708 F763 P768 E769 K773 A774 T775	P708-A771 HydrophobicContact CG-CB 4.16Å; F763-A771 HydrophobicContact CD1-CB 3.61Å; F763-A771 HydrophobicContact CE1-CB 3.72Å; P768-A771 HydrophobicContact CB-CB 4.24Å; P768-A771 WeakPolarHBondContact O-CB 3.41Å; P768-A771 PolarHBondContact O-N 3.22Å; P768-A771 VanDerWaalsContact O-N 3.12Å; E769-A771 PolarHBondContact O-N 3.31Å; A771-K773 VanDerWaalsContact C-N 3.26Å; A771-K773 PolarHBondContact O-N 3.25Å; A771-A774 CarbonylContact O-C 3.41Å; A771-A774 WeakPolarHBondContact O-CB 3.41Å; A771-A774 PolarHBondContact O-N 3.36Å; A771-A774 VanDerWaalsContact O-N 3.1Å; A771-T775 PolarHBondContact O-N 2.91Å; A771-T775 PolarHBondContact O-OG1 3.1Å
772	L	91.2	Very high	88.4	Confident	9 Å²	9	28.3 Å²	28.3	5%	0.047	16%	0.158	C	C	.	.	H	α-helix	trans	-59.6	-34.6	177.7	-179.9	58.8	0	0	0	113	I756 F759 F763 G770 T775 L776 H855 A858 F859	I756-L772 HydrophobicContact CG1-CD1 4.48Å; F759-L772 HydrophobicContact CB-CD1 4.08Å; F759-L772 HydrophobicContact CB-CD2 4.09Å; F759-L772 HydrophobicContact CD2-CD2 4.32Å; F759-L772 HydrophobicContact CG-CD2 4.47Å; F763-L772 HydrophobicContact CD2-CB 3.92Å; F763-L772 HydrophobicContact CD2-CD1 3.88Å; F763-L772 HydrophobicContact CD2-CG 4.39Å; F763-L772 HydrophobicContact CE2-CB 4.33Å; F763-L772 HydrophobicContact CE2-CD1 3.87Å; F763-L772 HydrophobicContact CG-CB 4.26Å; G770-L772 PolarHBondContact O-N 3.49Å; L772-T775 WeakPolarHBondContact O-CB 3.36Å; L772-T775 PolarHBondContact O-N 2.98Å; L772-L776 WeakPolarHBondContact O-CG 3.28Å; L772-L776 PolarHBondContact O-N 2.96Å; L772-H855 HydrophobicContact CD2-CB 4.16Å; L772-H855 WeakPolarHBondContact CD2-ND1 3.48Å; L772-A858 HydrophobicContact CB-CB 4.19Å; L772-A858 HydrophobicContact CD2-CB 4Å; L772-A858 HydrophobicContact CG-CB 3.91Å; L772-F859 HydrophobicContact CD2-CE2 3.83Å; L772-F859 HydrophobicContact CD2-CZ 4.22Å
773	K	91.4	Very high	88.4	Confident	55 Å²	55	28.5 Å²	28.5	24%	0.239	16%	0.156	C	C	.	.	H	α-helix	trans	-71	-38.6	176.9	-168.6	171.2	-174.8	155.5	0	111.3	G770 A771 L776 S777 E857 A858	G770-K773 WeakPolarHBondContact O-CB 3.31Å; G770-K773 PolarHBondContact O-N 3.04Å; A771-K773 VanDerWaalsContact C-N 3.26Å; A771-K773 PolarHBondContact O-N 3.25Å; K773-L776 PolarHBondContact O-N 2.99Å; K773-S777 PolarHBondContact O-N 2.78Å; K773-S777 VanDerWaalsContact O-N 3.09Å; K773-E857 PolarHBondContact NZ-O 2.89Å; K773-E857 IonicContact NZ-OE1 3.36Å; K773-E857 PolarHBondContact NZ-OE1 3.36Å; K773-A858 HydrophobicContact CB-CB 4.11Å
774	A	90.8	Very high	88.2	Confident	21 Å²	21	29.7 Å²	29.7	17%	0.174	16%	0.162	C	C	.	.	H	α-helix	trans	-66.8	-37.5	170.9	0	0	0	0	0	112.1	P708 G770 A771 S777 L778	P708-A774 HydrophobicContact CB-CB 3.92Å; G770-A774 PolarHBondContact O-N 3.36Å; A771-A774 CarbonylContact O-C 3.41Å; A771-A774 WeakPolarHBondContact O-CB 3.41Å; A771-A774 PolarHBondContact O-N 3.36Å; A771-A774 VanDerWaalsContact O-N 3.1Å; A774-S777 PolarHBondContact O-N 3.26Å; A774-L778 VanDerWaalsContact O-CB 3.3Å; A774-L778 WeakPolarHBondContact O-CB 3.33Å; A774-L778 PolarHBondContact O-N 3.35Å
775	T	92.8	Very high	87.6	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.9	-44	172.5	-55.1	0	0	0	0	111.7	P708 L752 Q755 I756 F763 A771 L772 L778 L779	P708-T775 VanDerWaalsContact CG-OG1 3.28Å; P708-T775 WeakPolarHBondContact CG-OG1 2.89Å; L752-T775 HydrophobicContact CD2-CG2 3.6Å; Q755-T775 HydrophobicContact CB-CG2 4.3Å; I756-T775 HydrophobicContact CD1-CG2 4.29Å; I756-T775 HydrophobicContact CG1-CG2 3.95Å; F763-T775 HydrophobicContact CZ-CG2 4.4Å; F763-T775 VanDerWaalsContact CZ-OG1 3.29Å; F763-T775 WeakPolarHBondContact CZ-OG1 3.46Å; A771-T775 PolarHBondContact O-N 2.91Å; A771-T775 PolarHBondContact O-OG1 3.1Å; L772-T775 WeakPolarHBondContact O-CB 3.36Å; L772-T775 PolarHBondContact O-N 2.98Å; T775-L778 PolarHBondContact O-N 2.84Å; T775-L779 PolarHBondContact O-N 2.95Å
776	L	91.9	Very high	86.7	Confident	15 Å²	15	39.9 Å²	39.9	8%	0.079	21%	0.208	C	C	.	.	H	α-helix	trans	-65.4	-44.2	176.8	-70.5	165.6	0	0	0	112.2	I756 L772 K773 L778 L779 E780 V800 A858 F859	I756-L776 HydrophobicContact CD1-CD2 3.83Å; I756-L776 HydrophobicContact CG1-CD2 4.27Å; L772-L776 WeakPolarHBondContact O-CG 3.28Å; L772-L776 PolarHBondContact O-N 2.96Å; K773-L776 PolarHBondContact O-N 2.99Å; L776-L778 VanDerWaalsContact C-N 3.29Å; L776-L778 PolarHBondContact O-N 2.93Å; L776-L779 PolarHBondContact O-N 2.88Å; L776-E780 PolarHBondContact O-N 3.26Å; L776-V800 HydrophobicContact CD2-CG1 3.9Å; L776-V800 HydrophobicContact CD2-CG2 3.68Å; L776-A858 HydrophobicContact CD1-CB 4.33Å; L776-A858 WeakPolarHBondContact CD1-O 3.46Å; L776-F859 HydrophobicContact CD1-CD1 4.12Å; L776-F859 HydrophobicContact CD1-CE1 3.87Å; L776-F859 HydrophobicContact CD1-CZ 4.31Å; L776-F859 HydrophobicContact CD2-CE1 4.32Å
777	S	90.6	Very high	86	Confident	37 Å²	37	42.2 Å²	42.2	26%	0.259	22%	0.216	S	C	.	.	H	α-helix	trans	-70.1	-24.8	175.9	-172.4	0	0	0	0	113.2	K773 A774 R781	K773-S777 PolarHBondContact O-N 2.78Å; K773-S777 VanDerWaalsContact O-N 3.09Å; A774-S777 PolarHBondContact O-N 3.26Å; S777-R781 PolarHBondContact O-N 3.34Å
778	L	92.1	Very high	84.9	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-73.8	-41.5	169.9	-177.7	51.4	0	0	0	111.7	L711 H712 F715 L752 A774 T775 L776 E780 R781 V782	L711-L778 HydrophobicContact CB-CD2 3.6Å; H712-L778 HydrophobicContact CB-CB 4.42Å; H712-L778 HydrophobicContact CB-CD1 3.97Å; H712-L778 HydrophobicContact CB-CD2 4.3Å; H712-L778 HydrophobicContact CB-CG 4.46Å; F715-L778 HydrophobicContact CB-CD1 4.24Å; F715-L778 HydrophobicContact CD1-CD1 4.21Å; F715-L778 HydrophobicContact CG-CD1 4.38Å; L752-L778 HydrophobicContact CD1-CB 4.46Å; L752-L778 HydrophobicContact CD1-CD2 4.36Å; L752-L778 HydrophobicContact CD1-CG 3.88Å; L752-L778 HydrophobicContact CD2-CD2 4.1Å; L752-L778 HydrophobicContact CD2-CG 4.3Å; A774-L778 VanDerWaalsContact O-CB 3.3Å; A774-L778 WeakPolarHBondContact O-CB 3.33Å; A774-L778 PolarHBondContact O-N 3.35Å; T775-L778 PolarHBondContact O-N 2.84Å; L776-L778 VanDerWaalsContact C-N 3.29Å; L776-L778 PolarHBondContact O-N 2.93Å; L778-E780 VanDerWaalsContact C-N 3.33Å; L778-E780 PolarHBondContact O-N 2.95Å; L778-R781 PolarHBondContact O-N 2.9Å; L778-R781 VanDerWaalsContact O-N 3.15Å; L778-V782 HydrophobicContact CD1-CG2 3.99Å; L778-V782 HydrophobicContact CG-CG2 4.29Å; L778-V782 WeakPolarHBondContact O-CG2 3.39Å; L778-V782 PolarHBondContact O-N 2.64Å
779	L	92.3	Very high	84.4	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-58.3	-45.6	173.8	179.5	65.9	0	0	0	111.3	L752 I756 T775 L776 R781 V782 L783 V799 V800	L752-L779 HydrophobicContact CB-CD1 4.27Å; L752-L779 HydrophobicContact CD1-CB 4.39Å; I756-L779 HydrophobicContact CD1-CB 4.45Å; I756-L779 HydrophobicContact CD1-CD2 3.65Å; T775-L779 PolarHBondContact O-N 2.95Å; L776-L779 PolarHBondContact O-N 2.88Å; L779-R781 VanDerWaalsContact C-N 3.3Å; L779-R781 PolarHBondContact O-N 3.41Å; L779-V782 PolarHBondContact O-N 3.35Å; L779-L783 HydrophobicContact CD1-CD1 4.02Å; L779-L783 HydrophobicContact CD1-CG 4.07Å; L779-L783 HydrophobicContact CG-CD1 3.88Å; L779-L783 HydrophobicContact CG-CG 4.35Å; L779-L783 VanDerWaalsContact O-CG 3.29Å; L779-L783 WeakPolarHBondContact O-CG 3.36Å; L779-L783 PolarHBondContact O-N 2.7Å; L779-V799 HydrophobicContact CD2-CG1 4Å; L779-V800 HydrophobicContact CD2-CG2 3.97Å
780	E	89.3	Confident	84.1	Confident	86 Å²	86	48.2 Å²	48.2	40%	0.402	27%	0.27	S	S	.	.	H	α-helix	trans	-49.6	-49.1	172.8	176.5	-176.1	-159.6	0	0	111.8	L776 L778 M784 I791 V796	L776-E780 PolarHBondContact O-N 3.26Å; L778-E780 VanDerWaalsContact C-N 3.33Å; L778-E780 PolarHBondContact O-N 2.95Å; E780-M784 WeakPolarHBondContact O-CG 3.43Å; E780-M784 PolarHBondContact O-N 2.83Å; E780-I791 HydrophobicContact CG-CG2 4.19Å; E780-V796 HydrophobicContact CB-CG1 4.34Å; E780-V796 HydrophobicContact CB-CG2 4.36Å; E780-V796 HydrophobicContact CG-CG2 4.3Å
781	R	88.3	Confident	83.9	Confident	108 Å²	108	47.3 Å²	47.3	41%	0.408	26%	0.255	S	S	.	.	H	α-helix	trans	-73.1	-31.7	179.5	-71.3	-169.3	178.2	-178.1	-4.9	114.6	H712 S777 L778 L779 L783 M784	H712-R781 PolarHBondContact CE1-NH1 3.08Å; H712-R781 PolarHBondContact NE2-NH1 3.39Å; S777-R781 PolarHBondContact O-N 3.34Å; L778-R781 PolarHBondContact O-N 2.9Å; L778-R781 VanDerWaalsContact O-N 3.15Å; L779-R781 VanDerWaalsContact C-N 3.3Å; L779-R781 PolarHBondContact O-N 3.41Å; R781-L783 VanDerWaalsContact C-N 3.32Å; R781-M784 HydrophobicContact CB-SD 4.45Å; R781-M784 HydrophobicContact CG-SD 4.18Å; R781-M784 WeakPolarHBondContact O-CB 3.5Å; R781-M784 PolarHBondContact O-N 3.27Å
782	V	90	Very high	83.7	Confident	3 Å²	3	50.7 Å²	50.7	2%	0.018	28%	0.276	C	S	.	.	H	α-helix	trans	-68.9	-34.5	176.3	168.9	0	0	0	0	111	F715 K745 L748 L752 L778 L779 M784	F715-V782 HydrophobicContact CD1-CG2 4.1Å; F715-V782 HydrophobicContact CD2-CG2 4.33Å; F715-V782 HydrophobicContact CE1-CB 4.45Å; F715-V782 HydrophobicContact CE1-CG2 3.82Å; F715-V782 HydrophobicContact CE2-CG2 4.07Å; F715-V782 HydrophobicContact CG-CG2 4.35Å; F715-V782 HydrophobicContact CZ-CB 4.31Å; F715-V782 HydrophobicContact CZ-CG2 3.82Å; K745-V782 WeakPolarHBondContact CE-O 3.34Å; K745-V782 HydrophobicContact CG-CG1 4.11Å; L748-V782 HydrophobicContact CD2-CG2 3.72Å; L748-V782 HydrophobicContact CG-CG2 4.07Å; L752-V782 HydrophobicContact CD1-CB 4.38Å; L752-V782 HydrophobicContact CD1-CG2 3.92Å; L778-V782 HydrophobicContact CD1-CG2 3.99Å; L778-V782 HydrophobicContact CG-CG2 4.29Å; L778-V782 WeakPolarHBondContact O-CG2 3.39Å; L778-V782 PolarHBondContact O-N 2.64Å; L779-V782 PolarHBondContact O-N 3.35Å; V782-M784 VanDerWaalsContact C-N 3.29Å; V782-M784 PolarHBondContact O-N 2.85Å
783	L	87.8	Confident	83.4	Confident	46 Å²	46	53 Å²	53	24%	0.241	30%	0.297	C	S	.	.	S	Bend	trans	-75.3	-12.6	176.6	-64.8	171.2	0	0	0	113.8	L779 R781 I791 V796 V799	L779-L783 HydrophobicContact CD1-CD1 4.02Å; L779-L783 HydrophobicContact CD1-CG 4.07Å; L779-L783 HydrophobicContact CG-CD1 3.88Å; L779-L783 HydrophobicContact CG-CG 4.35Å; L779-L783 VanDerWaalsContact O-CG 3.29Å; L779-L783 WeakPolarHBondContact O-CG 3.36Å; L779-L783 PolarHBondContact O-N 2.7Å; R781-L783 VanDerWaalsContact C-N 3.32Å; L783-I791 HydrophobicContact CB-CD1 3.53Å; L783-I791 HydrophobicContact CD1-CD1 4.46Å; L783-V796 HydrophobicContact CD1-CG1 4.47Å; L783-V796 HydrophobicContact CD1-CG2 4.26Å; L783-V799 HydrophobicContact CD1-CB 4.34Å; L783-V799 HydrophobicContact CD1-CG2 4.01Å
784	M	84.5	Confident	83.1	Confident	34 Å²	34	55.7 Å²	55.7	17%	0.167	31%	0.31	C	S	.	.			trans	-64.2	140.3	176.1	-68.4	173.7	76.1	0	0	112.1	K745 E780 R781 V782 D786 I791	K745-M784 PolarHBondContact NZ-O 3.43Å; E780-M784 WeakPolarHBondContact O-CG 3.43Å; E780-M784 PolarHBondContact O-N 2.83Å; R781-M784 HydrophobicContact CB-SD 4.45Å; R781-M784 HydrophobicContact CG-SD 4.18Å; R781-M784 WeakPolarHBondContact O-CB 3.5Å; R781-M784 PolarHBondContact O-N 3.27Å; V782-M784 VanDerWaalsContact C-N 3.29Å; V782-M784 PolarHBondContact O-N 2.85Å; M784-D786 WeakPolarHBondContact CE-O 3.44Å; M784-I791 HydrophobicContact CG-CB 4.42Å; M784-I791 HydrophobicContact CG-CG2 4.15Å
785	K	74.8	Confident	83	Confident	174 Å²	174	59.3 Å²	59.3	76%	0.757	32%	0.324	S	S	*	.	S	Bend	trans	-80	-37.3	177.6	-68.7	178.5	-177.8	168.4	0	112.4
786	D	68.1	Low	82.9	Confident	51 Å²	51	59.5 Å²	59.5	27%	0.273	33%	0.325	S	S	.	.	S	Bend	trans	-146.5	177.3	173.6	70.3	77.1	0	0	0	108.8	M784 A788 T789	M784-D786 WeakPolarHBondContact CE-O 3.44Å; D786-A788 WeakPolarHBondContact OD1-CA 3.38Å; D786-A788 WeakPolarHBondContact OD1-CB 3.43Å; D786-A788 PolarHBondContact OD1-N 2.84Å; D786-T789 PolarHBondContact OD1-N 3.4Å; D786-T789 PolarHBondContact OD1-OG1 3Å; D786-T789 VanDerWaalsContact OD2-CB 3.26Å; D786-T789 WeakPolarHBondContact OD2-CB 3.39Å; D786-T789 PolarHBondContact OD2-OG1 2.85Å
787	I	68.2	Low	82.8	Confident	67 Å²	67	59.8 Å²	59.8	34%	0.344	33%	0.325	S	S	.	.	S	Bend	trans	-84.5	-21	-177.2	-84.8	169.8	0	0	0	114.5	A719 S720 N725	A719-I787 HydrophobicContact CB-CD1 3.74Å; A719-I787 HydrophobicContact CB-CG1 4.34Å; A719-I787 WeakPolarHBondContact O-CD1 3.33Å; S720-I787 VanDerWaalsContact CA-CD1 3.45Å; N725-I787 HydrophobicContact CB-CG2 4.17Å; N725-I787 WeakPolarHBondContact ND2-CG2 3.26Å
788	A	63.1	Low	82.8	Confident	76 Å²	76	65.2 Å²	65.2	63%	0.628	34%	0.344	S	S	*	.	S	Bend	trans	-85.9	-27.6	-179	0	0	0	0	0	112.6	D786 P790	D786-A788 WeakPolarHBondContact OD1-CA 3.38Å; D786-A788 WeakPolarHBondContact OD1-CB 3.43Å; D786-A788 PolarHBondContact OD1-N 2.84Å; A788-P790 WeakPolarHBondContact O-CD 3.45Å
789	T	72.6	Confident	82.9	Confident	81 Å²	81	66.6 Å²	66.6	50%	0.497	35%	0.353	S	S	.	.	S	Bend	trans	-97	99	-178.9	-47.8	0	0	0	0	111	D786	D786-T789 PolarHBondContact OD1-N 3.4Å; D786-T789 PolarHBondContact OD1-OG1 3Å; D786-T789 VanDerWaalsContact OD2-CB 3.26Å; D786-T789 WeakPolarHBondContact OD2-CB 3.39Å; D786-T789 PolarHBondContact OD2-OG1 2.85Å
790	P	73.6	Confident	82.9	Confident	101 Å²	101	66.6 Å²	66.6	66%	0.656	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-63	137.8	172	27.6	-34.7	0	0	0	110.8	A788	A788-P790 WeakPolarHBondContact O-CD 3.45Å
791	I	80.8	Confident	83.2	Confident	25 Å²	25	65.7 Å²	65.7	13%	0.128	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-69.2	140.2	174.9	-174.4	169.6	0	0	0	110.1	E780 L783 M784 A793 E795 V796	E780-I791 HydrophobicContact CG-CG2 4.19Å; L783-I791 HydrophobicContact CB-CD1 3.53Å; L783-I791 HydrophobicContact CD1-CD1 4.46Å; M784-I791 HydrophobicContact CG-CB 4.42Å; M784-I791 HydrophobicContact CG-CG2 4.15Å; I791-A793 PolarHBondContact O-N 3.26Å; I791-E795 HydrophobicContact CD1-CB 3.86Å; I791-E795 HydrophobicContact CG1-CB 3.91Å; I791-V796 HydrophobicContact CD1-CG2 4.08Å; I791-V796 HydrophobicContact CG1-CG2 4.29Å; I791-V796 HydrophobicContact CG2-CG2 3.53Å
792	P	84.3	Confident	83.5	Confident	75 Å²	75	66 Å²	66	49%	0.487	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-59.7	133	173.7	-23.8	34.6	0	0	0	111.2	E794 E795	P792-E794 PolarHBondContact O-N 3.1Å; P792-E794 VanDerWaalsContact O-N 3.08Å; P792-E795 HydrophobicContact CB-CG 4.39Å; P792-E795 WeakPolarHBondContact O-CB 3.49Å; P792-E795 PolarHBondContact O-N 3.25Å
793	A	83.8	Confident	83.7	Confident	58 Å²	58	65.8 Å²	65.8	48%	0.479	35%	0.349	S	S	.	.	H	α-helix	trans	-53.6	-34.7	-177.4	0	0	0	0	0	113.3	I791 E795 V796 K797 W862	I791-A793 PolarHBondContact O-N 3.26Å; A793-E795 VanDerWaalsContact C-N 3.32Å; A793-E795 PolarHBondContact O-N 2.79Å; A793-V796 PolarHBondContact O-N 3.29Å; A793-K797 VanDerWaalsContact O-CB 3.25Å; A793-K797 WeakPolarHBondContact O-CB 3.49Å; A793-K797 PolarHBondContact O-N 3.24Å; A793-W862 HydrophobicContact CB-CZ2 4.3Å
794	E	86.7	Confident	84	Confident	111 Å²	111	63.8 Å²	63.8	52%	0.519	34%	0.338	S	S	.	.	H	α-helix	trans	-66.4	-26.4	177	-72.8	-61	133.8	0	0	114.1	P792 K797 K798	P792-E794 PolarHBondContact O-N 3.1Å; P792-E794 VanDerWaalsContact O-N 3.08Å; E794-K797 VanDerWaalsContact OE1-CD 3.27Å; E794-K797 WeakPolarHBondContact OE1-CD 3.43Å; E794-K797 IonicContact OE1-NZ 3.58Å; E794-K798 VanDerWaalsContact O-CB 3.27Å; E794-K798 WeakPolarHBondContact O-CB 3.18Å; E794-K798 PolarHBondContact O-N 2.85Å
795	E	88.2	Confident	84.5	Confident	98 Å²	98	65.8 Å²	65.8	46%	0.458	35%	0.347	S	S	.	.	H	α-helix	trans	-71.5	-43.8	174	-67.5	-174.3	-165.7	0	0	110.8	I791 P792 A793 K798 V799	I791-E795 HydrophobicContact CD1-CB 3.86Å; I791-E795 HydrophobicContact CG1-CB 3.91Å; P792-E795 HydrophobicContact CB-CG 4.39Å; P792-E795 WeakPolarHBondContact O-CB 3.49Å; P792-E795 PolarHBondContact O-N 3.25Å; A793-E795 VanDerWaalsContact C-N 3.32Å; A793-E795 PolarHBondContact O-N 2.79Å; E795-K798 WeakPolarHBondContact O-CB 3.26Å; E795-K798 PolarHBondContact O-N 3.42Å; E795-V799 PolarHBondContact O-N 2.84Å
796	V	89.3	Confident	85.4	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.024	33%	0.328	C	S	.	.	H	α-helix	trans	-63.9	-47	173.6	-173.8	0	0	0	0	110.2	E780 L783 I791 A793 K798 V799 V800 W862	E780-V796 HydrophobicContact CB-CG1 4.34Å; E780-V796 HydrophobicContact CB-CG2 4.36Å; E780-V796 HydrophobicContact CG-CG2 4.3Å; L783-V796 HydrophobicContact CD1-CG1 4.47Å; L783-V796 HydrophobicContact CD1-CG2 4.26Å; I791-V796 HydrophobicContact CD1-CG2 4.08Å; I791-V796 HydrophobicContact CG1-CG2 4.29Å; I791-V796 HydrophobicContact CG2-CG2 3.53Å; A793-V796 PolarHBondContact O-N 3.29Å; V796-K798 VanDerWaalsContact C-N 3.26Å; V796-K798 PolarHBondContact O-N 3.41Å; V796-V799 PolarHBondContact O-N 2.88Å; V796-V800 HydrophobicContact CG1-CG2 4.3Å; V796-V800 WeakPolarHBondContact O-CG2 3.27Å; V796-V800 PolarHBondContact O-N 2.92Å; V796-W862 HydrophobicContact CB-CH2 4.13Å; V796-W862 HydrophobicContact CG1-CH2 3.88Å; V796-W862 HydrophobicContact CG1-CZ3 4.36Å
797	K	90.4	Very high	86.7	Confident	20 Å²	20	58.9 Å²	58.9	9%	0.087	32%	0.315	C	S	.	.	H	α-helix	trans	-55.6	-38.9	176.5	-167.2	-179.6	-175.7	177	0	112	A793 E794 V800 R801 W862 D864 L865	A793-K797 VanDerWaalsContact O-CB 3.25Å; A793-K797 WeakPolarHBondContact O-CB 3.49Å; A793-K797 PolarHBondContact O-N 3.24Å; E794-K797 VanDerWaalsContact OE1-CD 3.27Å; E794-K797 WeakPolarHBondContact OE1-CD 3.43Å; E794-K797 IonicContact OE1-NZ 3.58Å; K797-V800 PolarHBondContact O-N 3.42Å; K797-R801 VanDerWaalsContact O-CB 3.23Å; K797-R801 WeakPolarHBondContact O-CB 3.41Å; K797-R801 PolarHBondContact O-N 3.34Å; K797-W862 HydrophobicContact CB-CZ2 4.42Å; K797-W862 HydrophobicContact CD-CG 4.49Å; K797-W862 HydrophobicContact CG-CD2 4.34Å; K797-W862 HydrophobicContact CG-CG 4.5Å; K797-D864 WeakPolarHBondContact CE-OD2 3.4Å; K797-D864 IonicContact NZ-OD1 3.92Å; K797-D864 IonicContact NZ-OD2 3.91Å; K797-D864 PolarHBondContact NZ-OD2 3.19Å; K797-L865 HydrophobicContact CG-CD1 3.98Å; K797-L865 HydrophobicContact CG-CD2 3.99Å; K797-L865 HydrophobicContact CG-CG 4.19Å
798	K	91.9	Very high	87.9	Confident	151 Å²	151	55.8 Å²	55.8	66%	0.657	30%	0.299	S	S	*	.	H	α-helix	trans	-64.6	-38.4	175	-177.3	-179.2	178.6	-177.6	0	113	E794 E795 V796 K802	E794-K798 VanDerWaalsContact O-CB 3.27Å; E794-K798 WeakPolarHBondContact O-CB 3.18Å; E794-K798 PolarHBondContact O-N 2.85Å; E795-K798 WeakPolarHBondContact O-CB 3.26Å; E795-K798 PolarHBondContact O-N 3.42Å; V796-K798 VanDerWaalsContact C-N 3.26Å; V796-K798 PolarHBondContact O-N 3.41Å; K798-K802 PolarHBondContact O-N 3.4Å
799	V	92.8	Very high	89.3	Confident	30 Å²	30	56.4 Å²	56.4	18%	0.182	29%	0.291	C	S	.	.	H	α-helix	trans	-69.9	-45.5	174.4	-179.5	0	0	0	0	110.8	E753 L779 L783 E795 V796 R801 K802 C803	E753-V799 HydrophobicContact CG-CG1 3.99Å; L779-V799 HydrophobicContact CD2-CG1 4Å; L783-V799 HydrophobicContact CD1-CB 4.34Å; L783-V799 HydrophobicContact CD1-CG2 4.01Å; E795-V799 PolarHBondContact O-N 2.84Å; V796-V799 PolarHBondContact O-N 2.88Å; V799-R801 PolarHBondContact O-N 3.19Å; V799-K802 PolarHBondContact O-N 3.09Å; V799-C803 PolarHBondContact O-N 2.93Å; V799-C803 PolarHBondContact O-SG 3.19Å
800	V	93.5	Very high	90.3	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.3	-42.1	179	-179.7	0	0	0	0	111.3	L776 L779 V796 K797 K802 C803 L804 F859 W862 L865	L776-V800 HydrophobicContact CD2-CG1 3.9Å; L776-V800 HydrophobicContact CD2-CG2 3.68Å; L779-V800 HydrophobicContact CD2-CG2 3.97Å; V796-V800 HydrophobicContact CG1-CG2 4.3Å; V796-V800 WeakPolarHBondContact O-CG2 3.27Å; V796-V800 PolarHBondContact O-N 2.92Å; K797-V800 PolarHBondContact O-N 3.42Å; V800-K802 PolarHBondContact O-N 3.05Å; V800-C803 WeakPolarHBondContact O-CB 3.43Å; V800-C803 PolarHBondContact O-N 2.8Å; V800-C803 VanDerWaalsContact O-N 3.12Å; V800-L804 HydrophobicContact CG1-CD1 3.98Å; V800-L804 HydrophobicContact CG1-CG 4.39Å; V800-L804 WeakPolarHBondContact O-CG 3.12Å; V800-L804 PolarHBondContact O-N 2.91Å; V800-F859 HydrophobicContact CG1-CE1 3.96Å; V800-W862 HydrophobicContact CG2-CZ3 4.33Å; V800-L865 HydrophobicContact CB-CD1 4.11Å; V800-L865 HydrophobicContact CG1-CD1 3.77Å
801	R	94.3	Very high	91.1	Very high	66 Å²	66	49.9 Å²	49.9	25%	0.249	25%	0.248	C	C	.	.	H	α-helix	trans	-51.5	-52.9	170.8	175.2	-179.2	-76.6	129.8	-4.7	111.5	K797 V799 C803 L804 E805 L865 E868	K797-R801 VanDerWaalsContact O-CB 3.23Å; K797-R801 WeakPolarHBondContact O-CB 3.41Å; K797-R801 PolarHBondContact O-N 3.34Å; V799-R801 PolarHBondContact O-N 3.19Å; R801-C803 VanDerWaalsContact C-N 3.27Å; R801-C803 PolarHBondContact O-N 3.06Å; R801-L804 CarbonylContact O-C 3.57Å; R801-L804 PolarHBondContact O-N 2.99Å; R801-E805 WeakPolarHBondContact O-CG 3.49Å; R801-E805 PolarHBondContact O-N 3.45Å; R801-L865 HydrophobicContact CB-CD2 3.87Å; R801-E868 WeakPolarHBondContact CD-OE2 3.23Å; R801-E868 WeakPolarHBondContact CG-OE2 3.48Å; R801-E868 IonicContact CZ-OE1 2.66Å; R801-E868 IonicContact CZ-OE2 2.62Å; R801-E868 IonicContact NE-OE1 2.75Å; R801-E868 PolarHBondContact NE-OE1 3.35Å; R801-E868 IonicContact NE-OE2 3.63Å; R801-E868 PolarHBondContact NE-OE2 2.98Å; R801-E868 IonicContact NH2-OE1 2.66Å; R801-E868 PolarHBondContact NH2-OE1 3.31Å; R801-E868 IonicContact NH2-OE2 2.74Å
802	K	94.5	Very high	91.6	Very high	114 Å²	114	49.3 Å²	49.3	50%	0.496	24%	0.244	S	C	.	.	H	α-helix	trans	-60.7	-34.6	178.6	-173.4	-171.7	177.2	-164	0	112.6	K798 V799 V800 K806	K798-K802 PolarHBondContact O-N 3.4Å; V799-K802 PolarHBondContact O-N 3.09Å; V800-K802 PolarHBondContact O-N 3.05Å; K802-K806 WeakPolarHBondContact O-CG 3.25Å; K802-K806 PolarHBondContact O-N 3.23Å
803	C	95.1	Very high	91.9	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-70.9	-36.6	174.2	-61.4	0	0	0	0	112.2	I756 V799 V800 R801 K806 A807	I756-C803 HydrophobicContact CB-CB 4.09Å; I756-C803 HydrophobicContact CG2-CB 3.61Å; V799-C803 PolarHBondContact O-N 2.93Å; V799-C803 PolarHBondContact O-SG 3.19Å; V800-C803 WeakPolarHBondContact O-CB 3.43Å; V800-C803 PolarHBondContact O-N 2.8Å; V800-C803 VanDerWaalsContact O-N 3.12Å; R801-C803 VanDerWaalsContact C-N 3.27Å; R801-C803 PolarHBondContact O-N 3.06Å; C803-K806 WeakPolarHBondContact O-CB 3.41Å; C803-K806 PolarHBondContact O-N 2.83Å; C803-A807 WeakPolarHBondContact O-CB 3.45Å; C803-A807 PolarHBondContact O-N 3.25Å
804	L	94.6	Very high	92	Very high	3 Å²	3	49.5 Å²	49.5	2%	0.016	23%	0.228	C	C	.	.	H	α-helix	trans	-73.4	-33.7	176.3	-72.4	171.2	0	0	0	112.7	F759 V800 R801 A807 A808 F859 L865 H869	F759-L804 HydrophobicContact CD1-CD2 4.47Å; F759-L804 HydrophobicContact CE1-CD2 4.16Å; V800-L804 HydrophobicContact CG1-CD1 3.98Å; V800-L804 HydrophobicContact CG1-CG 4.39Å; V800-L804 WeakPolarHBondContact O-CG 3.12Å; V800-L804 PolarHBondContact O-N 2.91Å; R801-L804 CarbonylContact O-C 3.57Å; R801-L804 PolarHBondContact O-N 2.99Å; L804-A807 PolarHBondContact O-N 2.87Å; L804-A808 PolarHBondContact O-N 3.07Å; L804-F859 HydrophobicContact CD1-CD1 4.41Å; L804-F859 HydrophobicContact CD1-CE1 3.95Å; L804-F859 HydrophobicContact CD1-CZ 4.47Å; L804-F859 HydrophobicContact CD2-CE1 4.28Å; L804-F859 HydrophobicContact CD2-CZ 3.99Å; L804-L865 HydrophobicContact CD1-CB 3.75Å; L804-L865 HydrophobicContact CD1-CD1 4.39Å; L804-H869 HydrophobicContact CB-CB 4.28Å; L804-H869 PolarHBondContact O-CD2 3.24Å
805	E	93.8	Very high	92.1	Very high	76 Å²	76	45 Å²	45	36%	0.355	21%	0.207	S	C	.	.	H	α-helix	trans	-61	-43.9	169.6	-70.8	-179	119.3	0	0	111.4	R801 L809 K872	R801-E805 WeakPolarHBondContact O-CG 3.49Å; R801-E805 PolarHBondContact O-N 3.45Å; E805-L809 PolarHBondContact O-N 3.37Å; E805-K872 HydrophobicContact CG-CD 4.25Å; E805-K872 HydrophobicContact CG-CG 4.36Å; E805-K872 VanDerWaalsContact OE1-CE 3.26Å; E805-K872 WeakPolarHBondContact OE1-CE 3.15Å; E805-K872 IonicContact OE1-NZ 2.77Å; E805-K872 PolarHBondContact OE1-NZ 2.86Å
806	K	94.2	Very high	92	Very high	81 Å²	81	40.6 Å²	40.6	35%	0.352	19%	0.188	S	C	.	.	H	α-helix	trans	-61	-44.2	170.3	-67.8	167.8	-179.7	172.8	0	111.3	E753 S757 K802 C803 A808 L809 I810	E753-K806 IonicContact OE2-NZ 3.6Å; E753-K806 PolarHBondContact OE2-NZ 3.02Å; S757-K806 WeakPolarHBondContact OG-CD 3.45Å; K802-K806 WeakPolarHBondContact O-CG 3.25Å; K802-K806 PolarHBondContact O-N 3.23Å; C803-K806 WeakPolarHBondContact O-CB 3.41Å; C803-K806 PolarHBondContact O-N 2.83Å; K806-A808 PolarHBondContact O-N 2.92Å; K806-L809 PolarHBondContact O-N 3.03Å; K806-I810 HydrophobicContact CB-CD1 4.32Å; K806-I810 WeakPolarHBondContact O-CD1 3.31Å; K806-I810 VanDerWaalsContact O-CG1 3.26Å; K806-I810 WeakPolarHBondContact O-CG1 3.19Å; K806-I810 PolarHBondContact O-N 3.1Å
807	A	94.5	Very high	91.7	Very high	0 Å²	0	46 Å²	46	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64	-38.1	-178.2	0	0	0	0	0	112.4	S757 F759 C803 L804 I810 N811	S757-A807 WeakPolarHBondContact O-CA 3.49Å; S757-A807 VanDerWaalsContact O-CB 3.26Å; S757-A807 WeakPolarHBondContact O-CB 3.25Å; F759-A807 HydrophobicContact CD1-CB 4.04Å; F759-A807 HydrophobicContact CE1-CB 3.86Å; C803-A807 WeakPolarHBondContact O-CB 3.45Å; C803-A807 PolarHBondContact O-N 3.25Å; L804-A807 PolarHBondContact O-N 2.87Å; A807-I810 PolarHBondContact O-N 3.37Å; A807-N811 WeakPolarHBondContact O-CB 3.25Å; A807-N811 PolarHBondContact O-N 3.49Å; A807-N811 PolarHBondContact O-ND2 3.31Å
808	A	93.9	Very high	91.2	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.008	24%	0.242	C	C	.	.	H	α-helix	trans	-58.3	-48.9	174.8	0	0	0	0	0	110.8	L804 K806 N811 Y812 H869 K872 F873	L804-A808 PolarHBondContact O-N 3.07Å; K806-A808 PolarHBondContact O-N 2.92Å; A808-N811 PolarHBondContact O-N 3.16Å; A808-Y812 WeakPolarHBondContact O-CB 3.37Å; A808-Y812 PolarHBondContact O-N 3.22Å; A808-H869 PolarHBondContact N-NE2 3.42Å; A808-K872 HydrophobicContact CB-CB 3.9Å; A808-F873 HydrophobicContact CB-CB 4.19Å
809	L	93.4	Very high	90.5	Very high	90 Å²	90	47.8 Å²	47.8	47%	0.471	22%	0.222	S	C	.	.	H	α-helix	trans	-60.8	-51.9	175.8	-178.5	62.8	0	0	0	112.3	E805 K806 N811 Y812 T813 L876	E805-L809 PolarHBondContact O-N 3.37Å; K806-L809 PolarHBondContact O-N 3.03Å; L809-N811 VanDerWaalsContact C-N 3.26Å; L809-N811 PolarHBondContact O-N 3.28Å; L809-Y812 PolarHBondContact O-N 2.86Å; L809-Y812 VanDerWaalsContact O-N 3.12Å; L809-T813 PolarHBondContact O-N 3.43Å; L809-T813 PolarHBondContact O-OG1 3.48Å; L809-L876 HydrophobicContact CB-CD1 4.29Å; L809-L876 HydrophobicContact CD1-CD1 3.97Å; L809-L876 HydrophobicContact CD1-CD2 4.22Å
810	I	92.3	Very high	89.5	Confident	39 Å²	39	52.9 Å²	52.9	20%	0.2	24%	0.242	C	C	.	.	H	α-helix	trans	-59.9	-37.5	-179.6	-66.6	159.4	0	0	0	111.7	K806 A807 R814	K806-I810 HydrophobicContact CB-CD1 4.32Å; K806-I810 WeakPolarHBondContact O-CD1 3.31Å; K806-I810 VanDerWaalsContact O-CG1 3.26Å; K806-I810 WeakPolarHBondContact O-CG1 3.19Å; K806-I810 PolarHBondContact O-N 3.1Å; A807-I810 PolarHBondContact O-N 3.37Å; I810-R814 WeakPolarHBondContact O-CB 3.26Å; I810-R814 WeakPolarHBondContact O-CG 3.27Å; I810-R814 PolarHBondContact O-N 2.88Å
811	N	91.3	Very high	88	Confident	6 Å²	6	53.2 Å²	53.2	3%	0.032	24%	0.244	C	C	.	.	H	α-helix	trans	-72.8	-36.1	177.7	-69.1	-27	0	0	0	111.8	R760 A807 A808 L809 L815 H869 F873	R760-N811 WeakPolarHBondContact CD-OD1 3.48Å; A807-N811 WeakPolarHBondContact O-CB 3.25Å; A807-N811 PolarHBondContact O-N 3.49Å; A807-N811 PolarHBondContact O-ND2 3.31Å; A808-N811 PolarHBondContact O-N 3.16Å; L809-N811 VanDerWaalsContact C-N 3.26Å; L809-N811 PolarHBondContact O-N 3.28Å; N811-L815 WeakPolarHBondContact O-CB 3.39Å; N811-L815 PolarHBondContact O-N 3.27Å; N811-H869 PolarHBondContact ND2-NE2 2.95Å; N811-F873 HydrophobicContact CB-CD2 4.31Å; N811-F873 HydrophobicContact CB-CE2 3.99Å
812	Y	91.9	Very high	86.3	Confident	12 Å²	12	56.4 Å²	56.4	5%	0.047	26%	0.261	C	S	.	.	H	α-helix	trans	-73	-52.4	-179.8	-172.9	-99.7	0	0	0	111.8	A808 L809 R814 L815 T816 L840 F873 L876 F877 D880	A808-Y812 WeakPolarHBondContact O-CB 3.37Å; A808-Y812 PolarHBondContact O-N 3.22Å; L809-Y812 PolarHBondContact O-N 2.86Å; L809-Y812 VanDerWaalsContact O-N 3.12Å; Y812-R814 VanDerWaalsContact C-N 3.28Å; Y812-R814 PolarHBondContact O-N 3.28Å; Y812-L815 WeakPolarHBondContact O-CA 3.37Å; Y812-L815 VanDerWaalsContact O-CB 3.29Å; Y812-L815 WeakPolarHBondContact O-CB 3.48Å; Y812-L815 PolarHBondContact O-N 3.36Å; Y812-T816 HydrophobicContact CD1-CG2 4.23Å; Y812-T816 HydrophobicContact CE1-CG2 3.65Å; Y812-T816 HydrophobicContact CE2-CG2 4.3Å; Y812-T816 PolarHBondContact O-N 2.79Å; Y812-T816 PolarHBondContact O-OG1 3.03Å; Y812-L840 HydrophobicContact CE2-CD2 4.45Å; Y812-L840 WeakPolarHBondContact OH-CD2 3.47Å; Y812-F873 HydrophobicContact CD2-CD2 4.42Å; Y812-F873 HydrophobicContact CD2-CE1 4.47Å; Y812-F873 HydrophobicContact CD2-CE2 4.1Å; Y812-F873 HydrophobicContact CD2-CZ 4.12Å; Y812-L876 HydrophobicContact CD1-CB 3.66Å; Y812-L876 HydrophobicContact CD1-CD1 4.18Å; Y812-L876 HydrophobicContact CD1-CG 4.48Å; Y812-L876 HydrophobicContact CD2-CB 4.2Å; Y812-L876 HydrophobicContact CE1-CB 3.93Å; Y812-L876 HydrophobicContact CE2-CB 4.46Å; Y812-L876 HydrophobicContact CG-CB 3.81Å; Y812-L876 HydrophobicContact CG-CD1 4.05Å; Y812-F877 HydrophobicContact CE2-CB 3.83Å; Y812-F877 HydrophobicContact CE2-CD2 4.44Å; Y812-F877 WeakPolarHBondContact OH-CA 3.36Å; Y812-D880 PolarHBondContact OH-OD2 3.07Å
813	T	90.1	Very high	84.5	Confident	52 Å²	52	58.4 Å²	58.4	32%	0.319	27%	0.272	S	S	.	.	H	α-helix	trans	-56.6	-41.2	178.6	-54.3	0	0	0	0	111.8	L809 L815 T816 E817	L809-T813 PolarHBondContact O-N 3.43Å; L809-T813 PolarHBondContact O-OG1 3.48Å; T813-L815 PolarHBondContact O-N 3.24Å; T813-T816 PolarHBondContact O-N 2.98Å; T813-T816 PolarHBondContact O-OG1 3.16Å; T813-T816 VanDerWaalsContact O-OG1 3.05Å; T813-E817 WeakPolarHBondContact O-CB 3.49Å; T813-E817 VanDerWaalsContact O-CG 3.22Å; T813-E817 WeakPolarHBondContact O-CG 3.47Å; T813-E817 PolarHBondContact O-N 3.04Å
814	R	86.5	Confident	82.7	Confident	86 Å²	86	60.2 Å²	60.2	33%	0.325	28%	0.284	S	S	.	.	H	α-helix	trans	-71.8	-15.1	176.3	-71.1	-173.6	176.6	160.3	8.1	114.4	Y761 I810 Y812 Y818	Y761-R814 VanDerWaalsContact CE2-NH1 3.33Å; Y761-R814 VanDerWaalsContact OH-CD 3.24Å; Y761-R814 WeakPolarHBondContact OH-CD 3.46Å; I810-R814 WeakPolarHBondContact O-CB 3.26Å; I810-R814 WeakPolarHBondContact O-CG 3.27Å; I810-R814 PolarHBondContact O-N 2.88Å; Y812-R814 VanDerWaalsContact C-N 3.28Å; Y812-R814 PolarHBondContact O-N 3.28Å; R814-Y818 WeakPolarHBondContact O-CB 3.39Å; R814-Y818 PolarHBondContact O-N 3.03Å
815	L	87.7	Confident	81	Confident	15 Å²	15	60.9 Å²	60.9	8%	0.079	29%	0.287	C	S	.	.	H	α-helix	trans	-84.3	-43.5	173.3	-164.6	64.8	0	0	0	110.9	N811 Y812 T813 Y818 A819 L840 L843 V847 F873	N811-L815 WeakPolarHBondContact O-CB 3.39Å; N811-L815 PolarHBondContact O-N 3.27Å; Y812-L815 WeakPolarHBondContact O-CA 3.37Å; Y812-L815 VanDerWaalsContact O-CB 3.29Å; Y812-L815 WeakPolarHBondContact O-CB 3.48Å; Y812-L815 PolarHBondContact O-N 3.36Å; T813-L815 PolarHBondContact O-N 3.24Å; L815-Y818 PolarHBondContact O-N 3.34Å; L815-A819 WeakPolarHBondContact O-CB 3.29Å; L815-A819 PolarHBondContact O-N 3.1Å; L815-L840 HydrophobicContact CD2-CD1 4.09Å; L815-L840 HydrophobicContact CG-CD1 4.22Å; L815-L843 HydrophobicContact CD1-CB 4.07Å; L815-L843 HydrophobicContact CD2-CB 4.07Å; L815-L843 HydrophobicContact CG-CB 4.24Å; L815-V847 HydrophobicContact CD1-CG2 3.73Å; L815-V847 HydrophobicContact CD2-CG2 4Å; L815-V847 HydrophobicContact CG-CG2 4.48Å; L815-F873 HydrophobicContact CD2-CZ 4.02Å
816	T	86.1	Confident	79.4	Confident	7 Å²	7	63.6 Å²	63.6	4%	0.043	30%	0.304	C	S	.	.	H	α-helix	trans	-68.3	-36.1	175.1	56.2	0	0	0	0	112	Y812 T813 A819 K820 I821 L840	Y812-T816 HydrophobicContact CD1-CG2 4.23Å; Y812-T816 HydrophobicContact CE1-CG2 3.65Å; Y812-T816 HydrophobicContact CE2-CG2 4.3Å; Y812-T816 PolarHBondContact O-N 2.79Å; Y812-T816 PolarHBondContact O-OG1 3.03Å; T813-T816 PolarHBondContact O-N 2.98Å; T813-T816 PolarHBondContact O-OG1 3.16Å; T813-T816 VanDerWaalsContact O-OG1 3.05Å; T816-A819 PolarHBondContact O-N 2.92Å; T816-K820 PolarHBondContact O-N 3.41Å; T816-I821 PolarHBondContact O-N 3.07Å; T816-L840 HydrophobicContact CG2-CD1 4.24Å; T816-L840 HydrophobicContact CG2-CD2 4.22Å
817	E	84	Confident	77.8	Confident	118 Å²	118	68.4 Å²	68.4	55%	0.551	33%	0.327	S	S	*	.	H	α-helix	trans	-55.1	-49.8	166.1	-79.9	171.8	-169.2	0	0	111.5	T813 K820	T813-E817 WeakPolarHBondContact O-CB 3.49Å; T813-E817 VanDerWaalsContact O-CG 3.22Å; T813-E817 WeakPolarHBondContact O-CG 3.47Å; T813-E817 PolarHBondContact O-N 3.04Å; E817-K820 PolarHBondContact O-N 3.02Å
818	Y	78.9	Confident	76.6	Confident	179 Å²	179	69.2 Å²	69.2	70%	0.702	33%	0.334	S	S	*	.	H	α-helix	trans	-66.3	-40.3	-178	176	-97.7	0	0	0	112.2	R814 L815 K820	R814-Y818 WeakPolarHBondContact O-CB 3.39Å; R814-Y818 PolarHBondContact O-N 3.03Å; L815-Y818 PolarHBondContact O-N 3.34Å; Y818-K820 VanDerWaalsContact C-N 3.31Å
819	A	76.6	Confident	76	Confident	29 Å²	29	72.6 Å²	72.6	24%	0.24	36%	0.358	C	S	.	.	H	α-helix	trans	-79.3	-9.1	177.1	0	0	0	0	0	114	L815 T816 I821 L843	L815-A819 WeakPolarHBondContact O-CB 3.29Å; L815-A819 PolarHBondContact O-N 3.1Å; T816-A819 PolarHBondContact O-N 2.92Å; A819-I821 VanDerWaalsContact C-N 3.34Å; A819-I821 HydrophobicContact CB-CD1 3.63Å; A819-I821 HydrophobicContact CB-CG1 3.69Å; A819-I821 PolarHBondContact O-N 3.39Å; A819-L843 HydrophobicContact CB-CD1 3.99Å
820	K	72.1	Confident	75.5	Confident	136 Å²	136	70.9 Å²	70.9	59%	0.591	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	38.1	178.4	-54.5	-172.1	177	-168.9	0	115.2	T816 E817 Y818 T824	T816-K820 PolarHBondContact O-N 3.41Å; E817-K820 PolarHBondContact O-N 3.02Å; Y818-K820 VanDerWaalsContact C-N 3.31Å; K820-T824 PolarHBondContact O-OG1 3.47Å
821	I	63.2	Low	75.1	Confident	8 Å²	8	72.1 Å²	72.1	4%	0.041	37%	0.368	C	S	.	.	H	α-helix	trans	-74	-38.6	-168.8	-68.8	178	0	0	0	111.6	T816 A819 E823 T824 M825 L840	T816-I821 PolarHBondContact O-N 3.07Å; A819-I821 VanDerWaalsContact C-N 3.34Å; A819-I821 HydrophobicContact CB-CD1 3.63Å; A819-I821 HydrophobicContact CB-CG1 3.69Å; A819-I821 PolarHBondContact O-N 3.39Å; I821-E823 PolarHBondContact O-N 3.09Å; I821-T824 PolarHBondContact O-N 2.92Å; I821-M825 HydrophobicContact CG2-CG 3.63Å; I821-M825 HydrophobicContact CG2-SD 3.26Å; I821-M825 WeakPolarHBondContact CG2-SD 3.42Å; I821-M825 PolarHBondContact O-N 3.37Å; I821-L840 HydrophobicContact CD1-CB 3.66Å; I821-L840 HydrophobicContact CD1-CD1 3.74Å; I821-L840 HydrophobicContact CD1-CD2 3.68Å; I821-L840 HydrophobicContact CD1-CG 3.87Å
822	E	57.4	Low	74.7	Confident	133 Å²	133	77.7 Å²	77.7	62%	0.621	39%	0.389	S	S	*	.	H	α-helix	trans	-61.3	-39.9	-177.9	-61.9	-177.9	179.1	0	0	113.9	T824 N826	E822-T824 VanDerWaalsContact C-N 3.26Å; E822-T824 PolarHBondContact O-N 2.93Å; E822-N826 PolarHBondContact O-ND2 3.3Å
823	E	56.5	Low	74.4	Confident	156 Å²	156	79.2 Å²	79.2	73%	0.729	40%	0.396	S	S	*	.	H	α-helix	trans	-68.6	-26.5	176.3	-68.8	-168.4	133.7	0	0	112.1	I821	I821-E823 PolarHBondContact O-N 3.09Å
824	T	57.4	Low	74.3	Confident	38 Å²	38	77.2 Å²	77.2	23%	0.233	38%	0.383	C	S	.	.	H	α-helix	trans	-102.4	-43.9	-164.6	-38.5	0	0	0	0	112.7	K820 I821 E822 N826 Q827 A828 E836	K820-T824 PolarHBondContact O-OG1 3.47Å; I821-T824 PolarHBondContact O-N 2.92Å; E822-T824 VanDerWaalsContact C-N 3.26Å; E822-T824 PolarHBondContact O-N 2.93Å; T824-N826 PolarHBondContact O-N 3.47Å; T824-N826 VanDerWaalsContact O-N 3.12Å; T824-Q827 PolarHBondContact O-N 3.24Å; T824-Q827 VanDerWaalsContact O-N 3.11Å; T824-A828 VanDerWaalsContact O-CB 3.31Å; T824-A828 WeakPolarHBondContact O-CB 3.44Å; T824-A828 PolarHBondContact O-N 2.88Å; T824-E836 WeakPolarHBondContact CG2-OE1 3.36Å
825	M	59.3	Low	74.4	Confident	16 Å²	16	79.6 Å²	79.6	8%	0.079	40%	0.398	C	S	.	.	H	α-helix	trans	-61.6	-23.4	178.7	-73.6	-171.1	83.2	0	0	113.9	I821 Q827 K833 I837 A884	I821-M825 HydrophobicContact CG2-CG 3.63Å; I821-M825 HydrophobicContact CG2-SD 3.26Å; I821-M825 WeakPolarHBondContact CG2-SD 3.42Å; I821-M825 PolarHBondContact O-N 3.37Å; M825-Q827 VanDerWaalsContact C-N 3.29Å; M825-Q827 PolarHBondContact O-N 2.94Å; M825-K833 HydrophobicContact CE-CB 4.37Å; M825-K833 WeakPolarHBondContact O-CE 3.4Å; M825-K833 PolarHBondContact O-NZ 3.29Å; M825-I837 HydrophobicContact CE-CD1 3.94Å; M825-I837 HydrophobicContact CE-CG1 3.86Å; M825-I837 HydrophobicContact SD-CD1 3.99Å; M825-I837 HydrophobicContact SD-CG1 4.4Å; M825-A884 HydrophobicContact CE-CB 3.88Å
826	N	60.2	Low	74.3	Confident	134 Å²	134	80.2 Å²	80.2	72%	0.717	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-15.7	178.8	-80.8	-63.3	0	0	0	114	E822 T824	E822-N826 PolarHBondContact O-ND2 3.3Å; T824-N826 PolarHBondContact O-N 3.47Å; T824-N826 VanDerWaalsContact O-N 3.12Å
827	Q	60.8	Low	74.6	Confident	181 Å²	181	79.9 Å²	79.9	85%	0.846	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.6	-6.2	-179.7	-58.8	-174.8	22.8	0	0	114.2	T824 M825	T824-Q827 PolarHBondContact O-N 3.24Å; T824-Q827 VanDerWaalsContact O-N 3.11Å; M825-Q827 VanDerWaalsContact C-N 3.29Å; M825-Q827 PolarHBondContact O-N 2.94Å
828	A	70.1	Confident	74.9	Confident	17 Å²	17	76.8 Å²	76.8	14%	0.14	39%	0.385	C	S	.	.			trans	-70.9	151.8	179.3	0	0	0	0	0	114.3	T824 R832 K833	T824-A828 VanDerWaalsContact O-CB 3.31Å; T824-A828 WeakPolarHBondContact O-CB 3.44Å; T824-A828 PolarHBondContact O-N 2.88Å; A828-R832 HydrophobicContact CB-CB 4.17Å; A828-R832 HydrophobicContact CB-CG 3.97Å; A828-K833 HydrophobicContact CB-CG 3.84Å; A828-K833 WeakPolarHBondContact O-CE 3.25Å
829	S	81.4	Confident	75.4	Confident	72 Å²	72	72.7 Å²	72.7	50%	0.503	37%	0.372	S	S	.	.			trans	-70.7	157.1	168.7	56.3	0	0	0	0	111.7	A831 R832 K833	S829-A831 PolarHBondContact O-N 2.88Å; S829-R832 WeakPolarHBondContact O-CA 3.34Å; S829-R832 WeakPolarHBondContact O-CB 3.37Å; S829-R832 PolarHBondContact O-N 2.73Å; S829-K833 PolarHBondContact O-N 3.39Å
830	P	82.3	Confident	76.2	Confident	54 Å²	54	71.3 Å²	71.3	35%	0.351	36%	0.361	S	S	.	.	H	α-helix	trans	-51.3	-49.3	-176.6	-31	37.2	0	0	0	114.6	R832 K833 L834 A887 Q888	P830-R832 VanDerWaalsContact C-N 3.26Å; P830-R832 PolarHBondContact O-N 2.88Å; P830-K833 PolarHBondContact O-N 2.93Å; P830-L834 PolarHBondContact O-N 3.16Å; P830-A887 WeakPolarHBondContact CB-O 3.31Å; P830-A887 WeakPolarHBondContact CG-O 3.37Å; P830-Q888 VanDerWaalsContact CB-OE1 3.31Å; P830-Q888 PolarHBondContact O-NE2 3.28Å
831	A	83	Confident	77.2	Confident	66 Å²	66	64.8 Å²	64.8	55%	0.545	33%	0.333	S	S	.	.	H	α-helix	trans	-59.5	-35.4	177.8	0	0	0	0	0	113	S829 L834 E835	S829-A831 PolarHBondContact O-N 2.88Å; A831-L834 PolarHBondContact O-N 3.09Å; A831-E835 PolarHBondContact O-N 3.35Å
832	R	83.8	Confident	78.5	Confident	123 Å²	123	68.8 Å²	68.8	46%	0.464	35%	0.351	S	S	.	.	H	α-helix	trans	-75.5	-36.5	177.9	179.3	175.9	170.3	127.4	17.8	112.4	A828 S829 P830 L834 E835 E836	A828-R832 HydrophobicContact CB-CB 4.17Å; A828-R832 HydrophobicContact CB-CG 3.97Å; S829-R832 WeakPolarHBondContact O-CA 3.34Å; S829-R832 WeakPolarHBondContact O-CB 3.37Å; S829-R832 PolarHBondContact O-N 2.73Å; P830-R832 VanDerWaalsContact C-N 3.26Å; P830-R832 PolarHBondContact O-N 2.88Å; R832-L834 PolarHBondContact O-N 2.74Å; R832-E835 PolarHBondContact O-N 2.95Å; R832-E836 WeakPolarHBondContact CG-OE1 3.33Å; R832-E836 IonicContact CZ-OE1 3.12Å; R832-E836 VanDerWaalsContact CZ-OE1 3.28Å; R832-E836 IonicContact NE-OE1 3.24Å; R832-E836 PolarHBondContact NE-OE1 2.94Å; R832-E836 IonicContact NH2-OE1 3.56Å; R832-E836 PolarHBondContact NH2-OE1 3.48Å; R832-E836 WeakPolarHBondContact O-CB 3.4Å; R832-E836 WeakPolarHBondContact O-CG 3.32Å; R832-E836 PolarHBondContact O-N 3.47Å
833	K	85.2	Confident	80.1	Confident	43 Å²	43	63.5 Å²	63.5	19%	0.187	33%	0.327	C	S	.	.	H	α-helix	trans	-59.5	-37.2	170.5	-63	-171.3	-170	-145.8	0	111.2	M825 A828 S829 P830 E836 I837 A884 A887	M825-K833 HydrophobicContact CE-CB 4.37Å; M825-K833 WeakPolarHBondContact O-CE 3.4Å; M825-K833 PolarHBondContact O-NZ 3.29Å; A828-K833 HydrophobicContact CB-CG 3.84Å; A828-K833 WeakPolarHBondContact O-CE 3.25Å; S829-K833 PolarHBondContact O-N 3.39Å; P830-K833 PolarHBondContact O-N 2.93Å; K833-E836 PolarHBondContact O-N 3.38Å; K833-I837 WeakPolarHBondContact O-CG1 3.28Å; K833-I837 PolarHBondContact O-N 2.91Å; K833-A884 HydrophobicContact CB-CB 4.38Å; K833-A887 HydrophobicContact CD-CB 4.38Å
834	L	88.1	Confident	81.8	Confident	11 Å²	11	56.1 Å²	56.1	6%	0.058	29%	0.292	C	S	.	.	H	α-helix	trans	-71.2	-40	178.5	-173	58.3	0	0	0	112.4	P830 A831 R832 I837 L838 L885 Q888 D894 L898	P830-L834 PolarHBondContact O-N 3.16Å; A831-L834 PolarHBondContact O-N 3.09Å; R832-L834 PolarHBondContact O-N 2.74Å; L834-I837 PolarHBondContact O-N 2.85Å; L834-L838 WeakPolarHBondContact O-CB 3.5Å; L834-L838 PolarHBondContact O-N 2.82Å; L834-L885 HydrophobicContact CD1-CD2 4.24Å; L834-Q888 HydrophobicContact CD2-CG 4.47Å; L834-D894 HydrophobicContact CD2-CB 3.93Å; L834-D894 WeakPolarHBondContact CD2-O 3.41Å; L834-L898 HydrophobicContact CD1-CD2 4.13Å
835	E	87.4	Confident	83.5	Confident	136 Å²	136	55 Å²	55	64%	0.636	29%	0.285	S	S	*	.	H	α-helix	trans	-60.6	-43.2	170.4	-173.7	179.1	-163.3	0	0	111.6	A831 R832 L838 H839	A831-E835 PolarHBondContact O-N 3.35Å; R832-E835 PolarHBondContact O-N 2.95Å; E835-L838 PolarHBondContact O-N 3.16Å; E835-H839 PolarHBondContact O-N 3.37Å
836	E	86.9	Confident	84.8	Confident	27 Å²	27	58.9 Å²	58.9	13%	0.126	30%	0.303	C	S	.	.	H	α-helix	trans	-66.7	-37.1	177.8	-73.3	166.8	-174.8	0	0	112.4	T824 R832 K833 L840	T824-E836 WeakPolarHBondContact CG2-OE1 3.36Å; R832-E836 WeakPolarHBondContact CG-OE1 3.33Å; R832-E836 IonicContact CZ-OE1 3.12Å; R832-E836 VanDerWaalsContact CZ-OE1 3.28Å; R832-E836 IonicContact NE-OE1 3.24Å; R832-E836 PolarHBondContact NE-OE1 2.94Å; R832-E836 IonicContact NH2-OE1 3.56Å; R832-E836 PolarHBondContact NH2-OE1 3.48Å; R832-E836 WeakPolarHBondContact O-CB 3.4Å; R832-E836 WeakPolarHBondContact O-CG 3.32Å; R832-E836 PolarHBondContact O-N 3.47Å; K833-E836 PolarHBondContact O-N 3.38Å; E836-L840 PolarHBondContact O-N 3.04Å
837	I	91.4	Very high	86.3	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-74.6	-33.8	173.1	-70.9	-60.3	0	0	0	113	M825 K833 L834 H839 L840 A841 F877 D880 M881 A884 L898	M825-I837 HydrophobicContact CE-CD1 3.94Å; M825-I837 HydrophobicContact CE-CG1 3.86Å; M825-I837 HydrophobicContact SD-CD1 3.99Å; M825-I837 HydrophobicContact SD-CG1 4.4Å; K833-I837 WeakPolarHBondContact O-CG1 3.28Å; K833-I837 PolarHBondContact O-N 2.91Å; L834-I837 PolarHBondContact O-N 2.85Å; I837-H839 VanDerWaalsContact C-N 3.34Å; I837-L840 HydrophobicContact CD1-CD2 4.06Å; I837-L840 PolarHBondContact O-N 3.42Å; I837-A841 PolarHBondContact O-N 3.27Å; I837-F877 HydrophobicContact CG2-CE2 4.19Å; I837-F877 HydrophobicContact CG2-CZ 3.86Å; I837-D880 HydrophobicContact CD1-CB 3.78Å; I837-M881 HydrophobicContact CG2-CB 4.46Å; I837-M881 HydrophobicContact CG2-CG 4.46Å; I837-A884 HydrophobicContact CB-CB 4.33Å; I837-A884 HydrophobicContact CG1-CB 3.59Å; I837-L898 HydrophobicContact CG2-CD1 4.28Å; I837-L898 HydrophobicContact CG2-CD2 3.79Å
838	L	91.3	Very high	87.7	Confident	53 Å²	53	45.1 Å²	45.1	28%	0.277	24%	0.235	S	C	.	.	H	α-helix	trans	-61	-46.6	172.2	-172.2	73.6	0	0	0	110.3	L834 E835 L840 A841 E842 L898 L901	L834-L838 WeakPolarHBondContact O-CB 3.5Å; L834-L838 PolarHBondContact O-N 2.82Å; E835-L838 PolarHBondContact O-N 3.16Å; L838-L840 VanDerWaalsContact C-N 3.34Å; L838-L840 PolarHBondContact O-N 3.46Å; L838-A841 WeakPolarHBondContact O-CB 3.38Å; L838-A841 PolarHBondContact O-N 2.93Å; L838-A841 VanDerWaalsContact O-N 3.16Å; L838-E842 PolarHBondContact O-N 2.87Å; L838-E842 VanDerWaalsContact O-N 3.09Å; L838-L898 HydrophobicContact CD1-CB 4.05Å; L838-L898 HydrophobicContact CD1-CD1 4.1Å; L838-L901 HydrophobicContact CD1-CD2 3.82Å; L838-L901 HydrophobicContact CG-CD2 4.44Å
839	H	90	Very high	88.6	Confident	93 Å²	93	48.5 Å²	48.5	43%	0.431	25%	0.248	S	C	.	.	H	α-helix	trans	-65.8	-36.1	176.2	-171	46.8	0	0	0	112.6	E835 I837 A841 E842 L843	E835-H839 PolarHBondContact O-N 3.37Å; I837-H839 VanDerWaalsContact C-N 3.34Å; H839-A841 VanDerWaalsContact C-N 3.34Å; H839-A841 PolarHBondContact O-N 3.01Å; H839-E842 IonicContact CE1-OE2 3.18Å; H839-E842 IonicContact CG-OE2 2.66Å; H839-E842 IonicContact ND1-OE2 2.74Å; H839-E842 PolarHBondContact ND1-OE2 3.18Å; H839-E842 PolarHBondContact O-N 3.13Å; H839-L843 WeakPolarHBondContact O-CG 3.22Å; H839-L843 PolarHBondContact O-N 3.11Å; H839-L843 VanDerWaalsContact O-N 3.07Å
840	L	91.5	Very high	88.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61.7	-41.5	171	-176.5	58.3	0	0	0	111.9	Y812 L815 T816 I821 E836 I837 L838 E842 L843 C844 F877	Y812-L840 HydrophobicContact CE2-CD2 4.45Å; Y812-L840 WeakPolarHBondContact OH-CD2 3.47Å; L815-L840 HydrophobicContact CD2-CD1 4.09Å; L815-L840 HydrophobicContact CG-CD1 4.22Å; T816-L840 HydrophobicContact CG2-CD1 4.24Å; T816-L840 HydrophobicContact CG2-CD2 4.22Å; I821-L840 HydrophobicContact CD1-CB 3.66Å; I821-L840 HydrophobicContact CD1-CD1 3.74Å; I821-L840 HydrophobicContact CD1-CD2 3.68Å; I821-L840 HydrophobicContact CD1-CG 3.87Å; E836-L840 PolarHBondContact O-N 3.04Å; I837-L840 HydrophobicContact CD1-CD2 4.06Å; I837-L840 PolarHBondContact O-N 3.42Å; L838-L840 VanDerWaalsContact C-N 3.34Å; L838-L840 PolarHBondContact O-N 3.46Å; L840-E842 PolarHBondContact O-N 2.88Å; L840-L843 PolarHBondContact O-N 3.49Å; L840-C844 VanDerWaalsContact O-CB 3.32Å; L840-C844 WeakPolarHBondContact O-CB 3.35Å; L840-C844 PolarHBondContact O-N 3.26Å; L840-C844 PolarHBondContact O-SG 3.39Å; L840-F877 HydrophobicContact CB-CE2 4.14Å; L840-F877 HydrophobicContact CD2-CD2 3.73Å; L840-F877 HydrophobicContact CD2-CE2 3.88Å; L840-F877 HydrophobicContact CG-CD2 3.89Å; L840-F877 HydrophobicContact CG-CE2 3.84Å
841	A	92.9	Very high	89.1	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.4	-42.3	177.3	0	0	0	0	0	112	I837 L838 H839 C844 I845 F877 L898 L901 L902	I837-A841 PolarHBondContact O-N 3.27Å; L838-A841 WeakPolarHBondContact O-CB 3.38Å; L838-A841 PolarHBondContact O-N 2.93Å; L838-A841 VanDerWaalsContact O-N 3.16Å; H839-A841 VanDerWaalsContact C-N 3.34Å; H839-A841 PolarHBondContact O-N 3.01Å; A841-C844 PolarHBondContact O-N 2.7Å; A841-I845 WeakPolarHBondContact O-CB 3.45Å; A841-I845 VanDerWaalsContact O-CG1 3.25Å; A841-I845 WeakPolarHBondContact O-CG1 3.49Å; A841-I845 PolarHBondContact O-N 2.86Å; A841-F877 HydrophobicContact CB-CE2 4.15Å; A841-F877 HydrophobicContact CB-CZ 3.83Å; A841-L898 HydrophobicContact CB-CD1 3.73Å; A841-L901 HydrophobicContact CB-CD2 3.85Å; A841-L902 HydrophobicContact CB-CD2 3.94Å; A841-L902 HydrophobicContact CB-CG 4.44Å
842	E	91.9	Very high	89.3	Confident	92 Å²	92	46.7 Å²	46.7	43%	0.43	22%	0.216	S	C	.	.	H	α-helix	trans	-56.6	-51.3	172	-63.9	175.7	143.9	0	0	111.3	L838 H839 L840 C844 I845 E846 L901	L838-E842 PolarHBondContact O-N 2.87Å; L838-E842 VanDerWaalsContact O-N 3.09Å; H839-E842 IonicContact CE1-OE2 3.18Å; H839-E842 IonicContact CG-OE2 2.66Å; H839-E842 IonicContact ND1-OE2 2.74Å; H839-E842 PolarHBondContact ND1-OE2 3.18Å; H839-E842 PolarHBondContact O-N 3.13Å; L840-E842 PolarHBondContact O-N 2.88Å; E842-C844 VanDerWaalsContact C-N 3.34Å; E842-C844 PolarHBondContact O-N 2.67Å; E842-I845 PolarHBondContact O-N 2.86Å; E842-E846 PolarHBondContact O-N 3.45Å; E842-L901 HydrophobicContact CG-CD2 3.87Å
843	L	90.4	Very high	89.3	Confident	22 Å²	22	43.8 Å²	43.8	12%	0.115	21%	0.208	C	C	.	.	H	α-helix	trans	-63.5	-37.5	179.6	-70.1	174.4	0	0	0	112.4	L815 A819 H839 L840 E846 V847	L815-L843 HydrophobicContact CD1-CB 4.07Å; L815-L843 HydrophobicContact CD2-CB 4.07Å; L815-L843 HydrophobicContact CG-CB 4.24Å; A819-L843 HydrophobicContact CB-CD1 3.99Å; H839-L843 WeakPolarHBondContact O-CG 3.22Å; H839-L843 PolarHBondContact O-N 3.11Å; H839-L843 VanDerWaalsContact O-N 3.07Å; L840-L843 PolarHBondContact O-N 3.49Å; L843-E846 PolarHBondContact O-N 3.21Å; L843-V847 WeakPolarHBondContact O-CB 3.43Å; L843-V847 VanDerWaalsContact O-CG2 3.25Å; L843-V847 WeakPolarHBondContact O-CG2 3.43Å; L843-V847 PolarHBondContact O-N 3.23Å
844	C	92.9	Very high	89.3	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.5	-45.2	173.9	-79.3	0	0	0	0	111.2	L840 A841 E842 V847 L848 F873 W874	L840-C844 VanDerWaalsContact O-CB 3.32Å; L840-C844 WeakPolarHBondContact O-CB 3.35Å; L840-C844 PolarHBondContact O-N 3.26Å; L840-C844 PolarHBondContact O-SG 3.39Å; A841-C844 PolarHBondContact O-N 2.7Å; E842-C844 VanDerWaalsContact C-N 3.34Å; E842-C844 PolarHBondContact O-N 2.67Å; C844-V847 PolarHBondContact O-N 3.03Å; C844-L848 WeakPolarHBondContact O-CG 3.44Å; C844-L848 PolarHBondContact O-N 3.12Å; C844-F873 HydrophobicContact CB-CE1 3.76Å; C844-F873 HydrophobicContact CB-CZ 4.43Å; C844-W874 HydrophobicContact CB-CH2 3.68Å; C844-W874 HydrophobicContact CB-CZ3 3.78Å
845	I	92.1	Very high	89.4	Confident	14 Å²	14	43 Å²	43	7%	0.072	21%	0.205	C	C	.	.	H	α-helix	trans	-61.4	-49	175.4	-70.4	165.3	0	0	0	110.4	A841 E842 V847 L848 Q849 W874 L901 F905	A841-I845 WeakPolarHBondContact O-CB 3.45Å; A841-I845 VanDerWaalsContact O-CG1 3.25Å; A841-I845 WeakPolarHBondContact O-CG1 3.49Å; A841-I845 PolarHBondContact O-N 2.86Å; E842-I845 PolarHBondContact O-N 2.86Å; I845-V847 VanDerWaalsContact C-N 3.32Å; I845-V847 PolarHBondContact O-N 3.5Å; I845-L848 PolarHBondContact O-N 3.3Å; I845-Q849 HydrophobicContact CG2-CG 4.3Å; I845-Q849 VanDerWaalsContact CG2-NE2 3.28Å; I845-Q849 WeakPolarHBondContact O-CB 3.41Å; I845-Q849 WeakPolarHBondContact O-CG 3.45Å; I845-Q849 PolarHBondContact O-N 2.83Å; I845-W874 HydrophobicContact CG1-CH2 4Å; I845-W874 HydrophobicContact CG1-CZ2 4.22Å; I845-L901 HydrophobicContact CD1-CD1 3.82Å; I845-L901 HydrophobicContact CD1-CD2 4.47Å; I845-L901 HydrophobicContact CD1-CG 3.83Å; I845-F905 HydrophobicContact CD1-CB 3.85Å; I845-F905 HydrophobicContact CD1-CG 4.19Å; I845-F905 HydrophobicContact CG1-CB 4.07Å; I845-F905 HydrophobicContact CG1-CD1 3.97Å; I845-F905 HydrophobicContact CG1-CD2 4.27Å; I845-F905 HydrophobicContact CG1-CG 3.83Å; I845-F905 HydrophobicContact CG2-CD2 3.72Å; I845-F905 HydrophobicContact CG2-CE2 4.06Å; I845-F905 HydrophobicContact CG2-CG 4.14Å
846	E	88.1	Confident	89.3	Confident	98 Å²	98	38 Å²	38	46%	0.458	19%	0.187	S	C	.	.	H	α-helix	trans	-58.5	-41.9	176.1	-74.2	-159.2	167.6	0	0	112.4	E842 L843 Q850	E842-E846 PolarHBondContact O-N 3.45Å; L843-E846 PolarHBondContact O-N 3.21Å; E846-Q850 WeakPolarHBondContact O-CB 3.36Å; E846-Q850 WeakPolarHBondContact O-CG 3.5Å; E846-Q850 PolarHBondContact O-N 3.39Å
847	V	90.1	Very high	89.3	Confident	13 Å²	13	42.8 Å²	42.8	8%	0.079	21%	0.209	C	C	.	.	H	α-helix	trans	-62.7	-43	179.2	161.2	0	0	0	0	111.4	R760 L815 L843 C844 I845 N851 F873	R760-V847 PolarHBondContact NH1-O 2.88Å; L815-V847 HydrophobicContact CD1-CG2 3.73Å; L815-V847 HydrophobicContact CD2-CG2 4Å; L815-V847 HydrophobicContact CG-CG2 4.48Å; L843-V847 WeakPolarHBondContact O-CB 3.43Å; L843-V847 VanDerWaalsContact O-CG2 3.25Å; L843-V847 WeakPolarHBondContact O-CG2 3.43Å; L843-V847 PolarHBondContact O-N 3.23Å; C844-V847 PolarHBondContact O-N 3.03Å; I845-V847 VanDerWaalsContact C-N 3.32Å; I845-V847 PolarHBondContact O-N 3.5Å; V847-N851 PolarHBondContact O-N 2.99Å; V847-N851 VanDerWaalsContact O-N 3.1Å; V847-F873 HydrophobicContact CB-CZ 4.38Å; V847-F873 HydrophobicContact CG1-CE2 4.13Å; V847-F873 HydrophobicContact CG1-CZ 3.84Å
848	L	91.2	Very high	89.1	Confident	14 Å²	14	43.5 Å²	43.5	7%	0.073	22%	0.215	C	C	.	.	H	α-helix	trans	-71.8	-42.8	178.3	-67.8	177.4	0	0	0	112.2	C844 I845 Q850 N851 E852 A870 F873 W874 F905	C844-L848 WeakPolarHBondContact O-CG 3.44Å; C844-L848 PolarHBondContact O-N 3.12Å; I845-L848 PolarHBondContact O-N 3.3Å; L848-Q850 VanDerWaalsContact C-N 3.3Å; L848-Q850 PolarHBondContact O-N 3.04Å; L848-N851 WeakPolarHBondContact O-CA 3.41Å; L848-N851 WeakPolarHBondContact O-CB 3.46Å; L848-N851 PolarHBondContact O-N 2.97Å; L848-E852 PolarHBondContact O-N 3.21Å; L848-A870 HydrophobicContact CD1-CB 4.3Å; L848-A870 HydrophobicContact CD2-CB 4.09Å; L848-F873 HydrophobicContact CD1-CD1 4.04Å; L848-F873 HydrophobicContact CD1-CE1 4.38Å; L848-F873 HydrophobicContact CD2-CD1 4.04Å; L848-F873 HydrophobicContact CD2-CE1 4.44Å; L848-F873 HydrophobicContact CD2-CG 4.3Å; L848-F873 HydrophobicContact CG-CD1 4.1Å; L848-F873 HydrophobicContact CG-CE1 4.19Å; L848-W874 HydrophobicContact CD1-CD2 4.45Å; L848-W874 HydrophobicContact CD1-CZ2 3.67Å; L848-W874 VanDerWaalsContact CD1-NE1 3.34Å; L848-F905 HydrophobicContact CB-CZ 4.3Å; L848-F905 HydrophobicContact CD1-CE1 4.25Å
849	Q	88.1	Confident	89	Confident	87 Å²	87	41.2 Å²	41.2	41%	0.407	20%	0.202	S	C	.	.	H	α-helix	trans	-61	-36.9	174.2	-70.8	179.5	6.2	0	0	112.4	I845 N851 E852 E853 F905	I845-Q849 HydrophobicContact CG2-CG 4.3Å; I845-Q849 VanDerWaalsContact CG2-NE2 3.28Å; I845-Q849 WeakPolarHBondContact O-CB 3.41Å; I845-Q849 WeakPolarHBondContact O-CG 3.45Å; I845-Q849 PolarHBondContact O-N 2.83Å; Q849-N851 VanDerWaalsContact C-N 3.35Å; Q849-E852 PolarHBondContact O-N 2.96Å; Q849-E853 WeakPolarHBondContact O-CB 3.36Å; Q849-E853 PolarHBondContact O-N 2.97Å; Q849-F905 HydrophobicContact CG-CE2 3.92Å
850	Q	85.4	Confident	88.8	Confident	29 Å²	29	39.7 Å²	39.7	14%	0.136	21%	0.206	C	C	.	.	H	α-helix	trans	-66.9	-32.4	171.1	-75.3	171.7	31.6	0	0	112.9	E846 L848 H854	E846-Q850 WeakPolarHBondContact O-CB 3.36Å; E846-Q850 WeakPolarHBondContact O-CG 3.5Å; E846-Q850 PolarHBondContact O-N 3.39Å; L848-Q850 VanDerWaalsContact C-N 3.3Å; L848-Q850 PolarHBondContact O-N 3.04Å; Q850-H854 WeakPolarHBondContact O-CB 3.28Å; Q850-H854 PolarHBondContact O-CD2 3.08Å; Q850-H854 VanDerWaalsContact O-CD2 3.3Å; Q850-H854 PolarHBondContact O-N 3.5Å
851	N	89.8	Confident	88.3	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	-67	-46.2	173.9	-73.8	-22.7	0	0	0	110.4	F759 R760 V847 L848 Q849 H855 A856	F759-N851 WeakPolarHBondContact CE2-OD1 3.41Å; R760-N851 WeakPolarHBondContact CD-OD1 3.16Å; R760-N851 WeakPolarHBondContact CG-OD1 3.22Å; R760-N851 PolarHBondContact NH1-OD1 3.37Å; V847-N851 PolarHBondContact O-N 2.99Å; V847-N851 VanDerWaalsContact O-N 3.1Å; L848-N851 WeakPolarHBondContact O-CA 3.41Å; L848-N851 WeakPolarHBondContact O-CB 3.46Å; L848-N851 PolarHBondContact O-N 2.97Å; Q849-N851 VanDerWaalsContact C-N 3.35Å; N851-H855 WeakPolarHBondContact O-CA 3.27Å; N851-H855 VanDerWaalsContact O-CB 3.28Å; N851-H855 WeakPolarHBondContact O-CB 3.44Å; N851-H855 PolarHBondContact O-N 3.09Å; N851-A856 PolarHBondContact O-N 2.95Å
852	E	86.3	Confident	88	Confident	121 Å²	121	51.4 Å²	51.4	57%	0.565	25%	0.25	S	S	*	.	H	α-helix	trans	-59.6	-53.8	177.1	-164	-163.5	175.3	0	0	111.1	L848 Q849 H854 A856	L848-E852 PolarHBondContact O-N 3.21Å; Q849-E852 PolarHBondContact O-N 2.96Å; E852-H854 VanDerWaalsContact C-N 3.34Å; E852-H854 PolarHBondContact O-N 3.18Å; E852-A856 HydrophobicContact CG-CB 4.26Å; E852-A856 WeakPolarHBondContact O-CB 3.48Å; E852-A856 PolarHBondContact O-N 2.6Å; E852-A856 VanDerWaalsContact O-N 3.14Å
853	E	84.4	Confident	87.6	Confident	63 Å²	63	50.3 Å²	50.3	29%	0.294	25%	0.251	S	S	.	.	H	α-helix	trans	-61.4	-37.4	-175.4	-172.5	174	142.3	0	0	114.3	K183 Q849	K183-E853 VanDerWaalsContact CD-OE2 3.26Å; K183-E853 WeakPolarHBondContact CD-OE2 3.41Å; K183-E853 WeakPolarHBondContact CE-OE2 3.12Å; K183-E853 IonicContact NZ-OE2 3.45Å; K183-E853 PolarHBondContact NZ-OE2 3Å; Q849-E853 WeakPolarHBondContact O-CB 3.36Å; Q849-E853 PolarHBondContact O-N 2.97Å
854	H	85.3	Confident	87.4	Confident	33 Å²	33	52 Å²	52	15%	0.153	26%	0.261	C	S	.	.	H	α-helix	trans	-105.7	-15.4	-170.5	-57.4	-35.5	0	0	0	114.1	F765 Q850 E852	F765-H854 AromaticContact CD1-CD2 3.74Å; F765-H854 AromaticContact CD1-NE2 3.5Å; Q850-H854 WeakPolarHBondContact O-CB 3.28Å; Q850-H854 PolarHBondContact O-CD2 3.08Å; Q850-H854 VanDerWaalsContact O-CD2 3.3Å; Q850-H854 PolarHBondContact O-N 3.5Å; E852-H854 VanDerWaalsContact C-N 3.34Å; E852-H854 PolarHBondContact O-N 3.18Å
855	H	89.5	Confident	87.3	Confident	5 Å²	5	52 Å²	52	2%	0.023	26%	0.261	C	S	.	.	H	α-helix	trans	-132.4	-15.7	-172.2	-55.9	-83.6	0	0	0	115.2	F759 F763 L772 N851 E857 A858 F859	F759-H855 HydrophobicContact CD2-CB 4.31Å; F759-H855 AromaticContact CD2-CD2 3.88Å; F759-H855 AromaticContact CD2-CE1 3.75Å; F759-H855 AromaticContact CD2-CG 3.7Å; F759-H855 AromaticContact CD2-ND1 3.63Å; F759-H855 AromaticContact CD2-NE2 3.92Å; F759-H855 HydrophobicContact CE2-CB 4.14Å; F759-H855 AromaticContact CE2-CD2 3.71Å; F759-H855 AromaticContact CE2-CG 3.75Å; F763-H855 PolarHBondContact O-CE1 3.04Å; F763-H855 VanDerWaalsContact O-CE1 3.25Å; L772-H855 HydrophobicContact CD2-CB 4.16Å; L772-H855 WeakPolarHBondContact CD2-ND1 3.48Å; N851-H855 WeakPolarHBondContact O-CA 3.27Å; N851-H855 VanDerWaalsContact O-CB 3.28Å; N851-H855 WeakPolarHBondContact O-CB 3.44Å; N851-H855 PolarHBondContact O-N 3.09Å; H855-E857 PolarHBondContact O-N 3.33Å; H855-E857 VanDerWaalsContact O-N 3.16Å; H855-A858 WeakPolarHBondContact O-CB 3.41Å; H855-A858 PolarHBondContact O-N 3.37Å; H855-F859 WeakPolarHBondContact O-CD2 3.32Å
856	A	86.3	Confident	87.2	Confident	31 Å²	31	52.8 Å²	52.8	26%	0.256	27%	0.265	S	S	.	.	H	α-helix	trans	-56.9	-34.7	-178.6	0	0	0	0	0	113.8	N851 E852 A858 F859 A860 L866	N851-A856 PolarHBondContact O-N 2.95Å; E852-A856 HydrophobicContact CG-CB 4.26Å; E852-A856 WeakPolarHBondContact O-CB 3.48Å; E852-A856 PolarHBondContact O-N 2.6Å; E852-A856 VanDerWaalsContact O-N 3.14Å; A856-A858 PolarHBondContact O-N 3.44Å; A856-F859 CarbonylContact O-C 3.34Å; A856-F859 PolarHBondContact O-N 2.96Å; A856-A860 PolarHBondContact O-N 3.14Å; A856-L866 HydrophobicContact CB-CD1 4.14Å
857	E	87.3	Confident	87.3	Confident	127 Å²	127	48.9 Å²	48.9	59%	0.593	25%	0.249	S	C	*	.	H	α-helix	trans	-63.4	-22.8	178.9	-155.7	-139.4	122.4	0	0	114	K773 H855	K773-E857 PolarHBondContact NZ-O 2.89Å; K773-E857 IonicContact NZ-OE1 3.36Å; K773-E857 PolarHBondContact NZ-OE1 3.36Å; H855-E857 PolarHBondContact O-N 3.33Å; H855-E857 VanDerWaalsContact O-N 3.16Å
858	A	87.1	Confident	87.3	Confident	15 Å²	15	51.2 Å²	51.2	12%	0.124	26%	0.259	C	S	.	.	H	α-helix	trans	-78.6	-25.4	173.8	0	0	0	0	0	112.4	L772 K773 L776 H855 A856	L772-A858 HydrophobicContact CB-CB 4.19Å; L772-A858 HydrophobicContact CD2-CB 4Å; L772-A858 HydrophobicContact CG-CB 3.91Å; K773-A858 HydrophobicContact CB-CB 4.11Å; L776-A858 HydrophobicContact CD1-CB 4.33Å; L776-A858 WeakPolarHBondContact CD1-O 3.46Å; H855-A858 WeakPolarHBondContact O-CB 3.41Å; H855-A858 PolarHBondContact O-N 3.37Å; A856-A858 PolarHBondContact O-N 3.44Å
859	F	88.2	Confident	87.4	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.018	26%	0.256	C	S	.	.	H	α-helix	trans	-106.1	8.7	179.6	-60.5	-79.5	0	0	0	113.3	L772 L776 V800 L804 H855 A856 W861 W862 L866	L772-F859 HydrophobicContact CD2-CE2 3.83Å; L772-F859 HydrophobicContact CD2-CZ 4.22Å; L776-F859 HydrophobicContact CD1-CD1 4.12Å; L776-F859 HydrophobicContact CD1-CE1 3.87Å; L776-F859 HydrophobicContact CD1-CZ 4.31Å; L776-F859 HydrophobicContact CD2-CE1 4.32Å; V800-F859 HydrophobicContact CG1-CE1 3.96Å; L804-F859 HydrophobicContact CD1-CD1 4.41Å; L804-F859 HydrophobicContact CD1-CE1 3.95Å; L804-F859 HydrophobicContact CD1-CZ 4.47Å; L804-F859 HydrophobicContact CD2-CE1 4.28Å; L804-F859 HydrophobicContact CD2-CZ 3.99Å; H855-F859 WeakPolarHBondContact O-CD2 3.32Å; A856-F859 CarbonylContact O-C 3.34Å; A856-F859 PolarHBondContact O-N 2.96Å; F859-W861 PolarHBondContact O-N 3.29Å; F859-W862 CarbonylContact O-C 3.47Å; F859-W862 WeakPolarHBondContact O-CA 3.47Å; F859-W862 PolarHBondContact O-N 3.43Å; F859-L866 HydrophobicContact CB-CD1 3.82Å; F859-L866 HydrophobicContact CB-CG 3.88Å; F859-L866 HydrophobicContact CD2-CD1 3.79Å; F859-L866 HydrophobicContact CD2-CD2 3.81Å; F859-L866 HydrophobicContact CD2-CG 3.85Å; F859-L866 HydrophobicContact CE2-CD2 4.07Å; F859-L866 HydrophobicContact CG-CD1 4.1Å; F859-L866 HydrophobicContact CG-CD2 4.24Å; F859-L866 HydrophobicContact CG-CG 3.91Å
860	A	85.5	Confident	87.6	Confident	62 Å²	62	46.9 Å²	46.9	51%	0.512	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-15.1	-175.2	0	0	0	0	0	115.3	A856	A856-A860 PolarHBondContact O-N 3.14Å
861	W	81.1	Confident	87.9	Confident	185 Å²	185	47.3 Å²	47.3	70%	0.701	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-18	173	-57.8	-40.6	0	0	0	113.8	F859	F859-W861 PolarHBondContact O-N 3.29Å
862	W	86.1	Confident	88.1	Confident	60 Å²	60	51.5 Å²	51.5	23%	0.227	26%	0.26	C	S	.	.			trans	-138.8	63.9	177.4	-59.9	-41.7	0	0	0	110.3	A793 V796 K797 V800 F859 D864 L865	A793-W862 HydrophobicContact CB-CZ2 4.3Å; V796-W862 HydrophobicContact CB-CH2 4.13Å; V796-W862 HydrophobicContact CG1-CH2 3.88Å; V796-W862 HydrophobicContact CG1-CZ3 4.36Å; K797-W862 HydrophobicContact CB-CZ2 4.42Å; K797-W862 HydrophobicContact CD-CG 4.49Å; K797-W862 HydrophobicContact CG-CD2 4.34Å; K797-W862 HydrophobicContact CG-CG 4.5Å; V800-W862 HydrophobicContact CG2-CZ3 4.33Å; F859-W862 CarbonylContact O-C 3.47Å; F859-W862 WeakPolarHBondContact O-CA 3.47Å; F859-W862 PolarHBondContact O-N 3.43Å; W862-D864 WeakPolarHBondContact CA-OD1 3.43Å; W862-D864 PolarHBondContact O-N 2.94Å; W862-L865 HydrophobicContact CB-CB 4.39Å; W862-L865 HydrophobicContact CB-CD1 3.81Å; W862-L865 HydrophobicContact CB-CG 3.91Å; W862-L865 HydrophobicContact CD2-CD1 4.19Å; W862-L865 HydrophobicContact CE3-CD1 3.79Å; W862-L865 HydrophobicContact CG-CD1 4.25Å; W862-L865 WeakPolarHBondContact O-CB 3.45Å; W862-L865 PolarHBondContact O-N 2.95Å
863	P	83.6	Confident	88.5	Confident	69 Å²	69	45.8 Å²	45.8	45%	0.448	23%	0.233	S	C	.	.	H	α-helix	trans	-62.7	-25.3	-178.1	27.5	-35.6	0	0	0	112.4	L865 L866 A867 L911	P863-L865 PolarHBondContact O-N 2.7Å; P863-L866 PolarHBondContact O-N 3.36Å; P863-L866 VanDerWaalsContact O-N 3.12Å; P863-A867 PolarHBondContact O-N 2.85Å; P863-L911 HydrophobicContact CB-CD1 4.22Å
864	D	88.1	Confident	88.9	Confident	58 Å²	58	42.8 Å²	42.8	31%	0.31	22%	0.219	S	C	.	.	H	α-helix	trans	-58.7	-30.5	172.6	61.2	-43.2	0	0	0	113	K797 W862 L866 A867 E868	K797-D864 WeakPolarHBondContact CE-OD2 3.4Å; K797-D864 IonicContact NZ-OD1 3.92Å; K797-D864 IonicContact NZ-OD2 3.91Å; K797-D864 PolarHBondContact NZ-OD2 3.19Å; W862-D864 WeakPolarHBondContact CA-OD1 3.43Å; W862-D864 PolarHBondContact O-N 2.94Å; D864-L866 PolarHBondContact O-N 3.5Å; D864-A867 PolarHBondContact O-N 2.87Å; D864-E868 WeakPolarHBondContact O-CB 3.47Å; D864-E868 WeakPolarHBondContact O-CG 3.37Å; D864-E868 PolarHBondContact O-N 3.23Å
865	L	90	Very high	89.3	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-69	-30.9	175.2	-71.7	-176.6	0	0	0	113.6	K797 V800 R801 L804 W862 P863 H869	K797-L865 HydrophobicContact CG-CD1 3.98Å; K797-L865 HydrophobicContact CG-CD2 3.99Å; K797-L865 HydrophobicContact CG-CG 4.19Å; V800-L865 HydrophobicContact CB-CD1 4.11Å; V800-L865 HydrophobicContact CG1-CD1 3.77Å; R801-L865 HydrophobicContact CB-CD2 3.87Å; L804-L865 HydrophobicContact CD1-CB 3.75Å; L804-L865 HydrophobicContact CD1-CD1 4.39Å; W862-L865 HydrophobicContact CB-CB 4.39Å; W862-L865 HydrophobicContact CB-CD1 3.81Å; W862-L865 HydrophobicContact CB-CG 3.91Å; W862-L865 HydrophobicContact CD2-CD1 4.19Å; W862-L865 HydrophobicContact CE3-CD1 3.79Å; W862-L865 HydrophobicContact CG-CD1 4.25Å; W862-L865 WeakPolarHBondContact O-CB 3.45Å; W862-L865 PolarHBondContact O-N 2.95Å; P863-L865 PolarHBondContact O-N 2.7Å; L865-H869 PolarHBondContact O-N 3.4Å
866	L	89.6	Confident	89.5	Confident	30 Å²	30	46 Å²	46	16%	0.157	25%	0.245	C	C	.	.	H	α-helix	trans	-77.8	-33.5	174.3	-79.4	-177.3	0	0	0	111.9	A856 F859 P863 D864 H869 A870	A856-L866 HydrophobicContact CB-CD1 4.14Å; F859-L866 HydrophobicContact CB-CD1 3.82Å; F859-L866 HydrophobicContact CB-CG 3.88Å; F859-L866 HydrophobicContact CD2-CD1 3.79Å; F859-L866 HydrophobicContact CD2-CD2 3.81Å; F859-L866 HydrophobicContact CD2-CG 3.85Å; F859-L866 HydrophobicContact CE2-CD2 4.07Å; F859-L866 HydrophobicContact CG-CD1 4.1Å; F859-L866 HydrophobicContact CG-CD2 4.24Å; F859-L866 HydrophobicContact CG-CG 3.91Å; P863-L866 PolarHBondContact O-N 3.36Å; P863-L866 VanDerWaalsContact O-N 3.12Å; D864-L866 PolarHBondContact O-N 3.5Å; L866-H869 WeakPolarHBondContact O-CB 3.34Å; L866-H869 PolarHBondContact O-N 2.82Å; L866-A870 WeakPolarHBondContact O-CB 3.1Å; L866-A870 PolarHBondContact O-N 2.98Å
867	A	89.7	Confident	89.9	Confident	16 Å²	16	44.5 Å²	44.5	13%	0.132	23%	0.233	C	C	.	.	H	α-helix	trans	-63.4	-44.3	169.1	0	0	0	0	0	111.2	P863 D864 H869 A870 E871 L911 L912	P863-A867 PolarHBondContact O-N 2.85Å; D864-A867 PolarHBondContact O-N 2.87Å; A867-H869 PolarHBondContact O-N 3.41Å; A867-A870 PolarHBondContact O-N 3.02Å; A867-E871 WeakPolarHBondContact O-CB 3.33Å; A867-E871 WeakPolarHBondContact O-CG 3.34Å; A867-E871 PolarHBondContact O-N 3.2Å; A867-L911 HydrophobicContact CB-CB 3.76Å; A867-L911 HydrophobicContact CB-CD1 4.08Å; A867-L912 HydrophobicContact CB-CD2 4.42Å
868	E	90.3	Very high	90.2	Very high	61 Å²	61	39.4 Å²	39.4	29%	0.285	21%	0.21	S	C	.	.	H	α-helix	trans	-60	-41.4	172.2	-77.4	-175.2	-151.1	0	0	112.6	R801 D864 K872	R801-E868 WeakPolarHBondContact CD-OE2 3.23Å; R801-E868 WeakPolarHBondContact CG-OE2 3.48Å; R801-E868 IonicContact CZ-OE1 2.66Å; R801-E868 IonicContact CZ-OE2 2.62Å; R801-E868 IonicContact NE-OE1 2.75Å; R801-E868 PolarHBondContact NE-OE1 3.35Å; R801-E868 IonicContact NE-OE2 3.63Å; R801-E868 PolarHBondContact NE-OE2 2.98Å; R801-E868 IonicContact NH2-OE1 2.66Å; R801-E868 PolarHBondContact NH2-OE1 3.31Å; R801-E868 IonicContact NH2-OE2 2.74Å; D864-E868 WeakPolarHBondContact O-CB 3.47Å; D864-E868 WeakPolarHBondContact O-CG 3.37Å; D864-E868 PolarHBondContact O-N 3.23Å; E868-K872 WeakPolarHBondContact O-CB 3.46Å; E868-K872 WeakPolarHBondContact O-CG 3.43Å; E868-K872 PolarHBondContact O-N 3.47Å
869	H	93.4	Very high	90.3	Very high	3 Å²	3	42.9 Å²	42.9	1%	0.014	23%	0.23	C	C	.	.	H	α-helix	trans	-59.4	-47.1	173	170.5	-75.9	0	0	0	111.5	L804 A808 N811 L865 L866 A867 K872 F873	L804-H869 HydrophobicContact CB-CB 4.28Å; L804-H869 PolarHBondContact O-CD2 3.24Å; A808-H869 PolarHBondContact N-NE2 3.42Å; N811-H869 PolarHBondContact ND2-NE2 2.95Å; L865-H869 PolarHBondContact O-N 3.4Å; L866-H869 WeakPolarHBondContact O-CB 3.34Å; L866-H869 PolarHBondContact O-N 2.82Å; A867-H869 PolarHBondContact O-N 3.41Å; H869-K872 PolarHBondContact O-N 2.96Å; H869-F873 WeakPolarHBondContact O-CB 3.46Å; H869-F873 PolarHBondContact O-N 3.39Å
870	A	92.8	Very high	90.4	Very high	8 Å²	8	44.9 Å²	44.9	7%	0.066	24%	0.241	C	C	.	.	H	α-helix	trans	-67.5	-42.3	-178.6	0	0	0	0	0	112.1	L848 L866 A867 K872 F873 W874 L912	L848-A870 HydrophobicContact CD1-CB 4.3Å; L848-A870 HydrophobicContact CD2-CB 4.09Å; L866-A870 WeakPolarHBondContact O-CB 3.1Å; L866-A870 PolarHBondContact O-N 2.98Å; A867-A870 PolarHBondContact O-N 3.02Å; A870-K872 VanDerWaalsContact C-N 3.31Å; A870-K872 PolarHBondContact O-N 3.33Å; A870-F873 WeakPolarHBondContact O-CB 3.26Å; A870-F873 PolarHBondContact O-N 3.24Å; A870-W874 WeakPolarHBondContact O-CB 3.38Å; A870-W874 PolarHBondContact O-N 2.99Å; A870-L912 HydrophobicContact CB-CD1 3.85Å; A870-L912 HydrophobicContact CB-CD2 4.02Å
871	E	92.5	Very high	90.7	Very high	37 Å²	37	41.9 Å²	41.9	17%	0.173	22%	0.216	C	C	.	.	H	α-helix	trans	-60.1	-38.9	172	-75.7	-93.7	-129.8	0	0	112	A867 A875 L912 G915 K916 F917	A867-E871 WeakPolarHBondContact O-CB 3.33Å; A867-E871 WeakPolarHBondContact O-CG 3.34Å; A867-E871 PolarHBondContact O-N 3.2Å; E871-A875 VanDerWaalsContact O-CB 3.25Å; E871-A875 WeakPolarHBondContact O-CB 3.28Å; E871-A875 PolarHBondContact O-N 2.87Å; E871-L912 HydrophobicContact CG-CD2 3.87Å; E871-G915 WeakPolarHBondContact OE1-CA 3.44Å; E871-K916 PolarHBondContact OE1-N 2.97Å; E871-K916 PolarHBondContact OE2-N 3.46Å; E871-F917 PolarHBondContact OE2-N 2.76Å
872	K	93.1	Very high	91.3	Very high	93 Å²	93	34.9 Å²	34.9	40%	0.404	19%	0.193	S	C	.	.	H	α-helix	trans	-67.8	-36.8	174.7	-71.4	-83.6	175.1	157.7	0	112.5	E805 A808 E868 H869 A870 L876	E805-K872 HydrophobicContact CG-CD 4.25Å; E805-K872 HydrophobicContact CG-CG 4.36Å; E805-K872 VanDerWaalsContact OE1-CE 3.26Å; E805-K872 WeakPolarHBondContact OE1-CE 3.15Å; E805-K872 IonicContact OE1-NZ 2.77Å; E805-K872 PolarHBondContact OE1-NZ 2.86Å; A808-K872 HydrophobicContact CB-CB 3.9Å; E868-K872 WeakPolarHBondContact O-CB 3.46Å; E868-K872 WeakPolarHBondContact O-CG 3.43Å; E868-K872 PolarHBondContact O-N 3.47Å; H869-K872 PolarHBondContact O-N 2.96Å; A870-K872 VanDerWaalsContact C-N 3.31Å; A870-K872 PolarHBondContact O-N 3.33Å; K872-L876 PolarHBondContact O-N 3.31Å
873	F	93.9	Very high	91.5	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-69.3	-43.2	176.2	-176.5	-91.4	0	0	0	111.2	A808 N811 Y812 L815 C844 V847 L848 H869 A870 L876 F877	A808-F873 HydrophobicContact CB-CB 4.19Å; N811-F873 HydrophobicContact CB-CD2 4.31Å; N811-F873 HydrophobicContact CB-CE2 3.99Å; Y812-F873 HydrophobicContact CD2-CD2 4.42Å; Y812-F873 HydrophobicContact CD2-CE1 4.47Å; Y812-F873 HydrophobicContact CD2-CE2 4.1Å; Y812-F873 HydrophobicContact CD2-CZ 4.12Å; L815-F873 HydrophobicContact CD2-CZ 4.02Å; C844-F873 HydrophobicContact CB-CE1 3.76Å; C844-F873 HydrophobicContact CB-CZ 4.43Å; V847-F873 HydrophobicContact CB-CZ 4.38Å; V847-F873 HydrophobicContact CG1-CE2 4.13Å; V847-F873 HydrophobicContact CG1-CZ 3.84Å; L848-F873 HydrophobicContact CD1-CD1 4.04Å; L848-F873 HydrophobicContact CD1-CE1 4.38Å; L848-F873 HydrophobicContact CD2-CD1 4.04Å; L848-F873 HydrophobicContact CD2-CE1 4.44Å; L848-F873 HydrophobicContact CD2-CG 4.3Å; L848-F873 HydrophobicContact CG-CD1 4.1Å; L848-F873 HydrophobicContact CG-CE1 4.19Å; H869-F873 WeakPolarHBondContact O-CB 3.46Å; H869-F873 PolarHBondContact O-N 3.39Å; A870-F873 WeakPolarHBondContact O-CB 3.26Å; A870-F873 PolarHBondContact O-N 3.24Å; F873-L876 WeakPolarHBondContact O-CB 3.43Å; F873-L876 PolarHBondContact O-N 3.37Å; F873-F877 PolarHBondContact O-N 3.44Å
874	W	94.5	Very high	91.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-67	-34.5	173.9	-74.4	127.2	0	0	0	113.4	C844 I845 L848 A870 L876 F877 T878 L902 F905 F917	C844-W874 HydrophobicContact CB-CH2 3.68Å; C844-W874 HydrophobicContact CB-CZ3 3.78Å; I845-W874 HydrophobicContact CG1-CH2 4Å; I845-W874 HydrophobicContact CG1-CZ2 4.22Å; L848-W874 HydrophobicContact CD1-CD2 4.45Å; L848-W874 HydrophobicContact CD1-CZ2 3.67Å; L848-W874 VanDerWaalsContact CD1-NE1 3.34Å; A870-W874 WeakPolarHBondContact O-CB 3.38Å; A870-W874 PolarHBondContact O-N 2.99Å; W874-L876 PolarHBondContact O-N 2.95Å; W874-F877 HydrophobicContact CE3-CB 3.96Å; W874-F877 AromaticContact CE3-CD1 3.71Å; W874-F877 HydrophobicContact CE3-CD1 3.71Å; W874-F877 HydrophobicContact CE3-CE1 4.45Å; W874-F877 AromaticContact CE3-CG 3.91Å; W874-F877 HydrophobicContact CE3-CG 3.91Å; W874-F877 HydrophobicContact CZ3-CB 4.41Å; W874-F877 AromaticContact CZ3-CD1 3.79Å; W874-F877 HydrophobicContact CZ3-CD1 3.79Å; W874-F877 HydrophobicContact CZ3-CD2 4.46Å; W874-F877 HydrophobicContact CZ3-CE1 4.16Å; W874-F877 AromaticContact CZ3-CG 3.96Å; W874-F877 HydrophobicContact CZ3-CG 3.96Å; W874-F877 WeakPolarHBondContact O-CB 3.47Å; W874-F877 PolarHBondContact O-N 3.2Å; W874-T878 PolarHBondContact O-N 3.48Å; W874-T878 PolarHBondContact O-OG1 2.98Å; W874-L902 HydrophobicContact CH2-CD2 3.65Å; W874-L902 HydrophobicContact CZ3-CD2 3.65Å; W874-F905 AromaticContact CZ2-CD1 3.84Å; W874-F905 HydrophobicContact CZ2-CD1 3.84Å; W874-F905 AromaticContact CZ2-CE1 3.79Å; W874-F905 HydrophobicContact CZ2-CE1 3.79Å; W874-F917 HydrophobicContact CB-CB 3.76Å; W874-F917 HydrophobicContact CB-CD1 3.64Å; W874-F917 HydrophobicContact CB-CD2 4.04Å; W874-F917 HydrophobicContact CB-CE1 4.22Å; W874-F917 HydrophobicContact CB-CG 3.53Å; W874-F917 AromaticContact CD2-CD1 3.79Å; W874-F917 HydrophobicContact CD2-CD1 3.79Å; W874-F917 AromaticContact CD2-CE1 3.69Å; W874-F917 HydrophobicContact CD2-CE1 3.69Å; W874-F917 HydrophobicContact CD2-CZ 4.4Å; W874-F917 HydrophobicContact CE3-CD1 4.12Å; W874-F917 AromaticContact CE3-CE1 3.56Å; W874-F917 HydrophobicContact CE3-CE1 3.56Å; W874-F917 AromaticContact CE3-CZ 3.87Å; W874-F917 HydrophobicContact CE3-CZ 3.87Å; W874-F917 HydrophobicContact CG-CB 4.41Å; W874-F917 AromaticContact CG-CD1 3.58Å; W874-F917 HydrophobicContact CG-CD1 3.58Å; W874-F917 AromaticContact CG-CE1 3.99Å; W874-F917 HydrophobicContact CG-CE1 3.99Å; W874-F917 HydrophobicContact CG-CG 4.03Å; W874-F917 HydrophobicContact CZ3-CE1 4.19Å; W874-F917 HydrophobicContact CZ3-CZ 4.47Å
875	A	93.3	Very high	91.8	Very high	55 Å²	55	30.6 Å²	30.6	46%	0.455	17%	0.173	S	C	.	.	H	α-helix	trans	-65.6	-20.6	174	0	0	0	0	0	113.6	E871	E871-A875 VanDerWaalsContact O-CB 3.25Å; E871-A875 WeakPolarHBondContact O-CB 3.28Å; E871-A875 PolarHBondContact O-N 2.87Å
876	L	93	Very high	91.7	Very high	51 Å²	51	38.7 Å²	38.7	27%	0.267	21%	0.21	S	C	.	.	H	α-helix	trans	-78.9	-48.2	168.7	-64.4	168.4	0	0	0	110.4	L809 Y812 K872 F873 W874 T878 V879	L809-L876 HydrophobicContact CB-CD1 4.29Å; L809-L876 HydrophobicContact CD1-CD1 3.97Å; L809-L876 HydrophobicContact CD1-CD2 4.22Å; Y812-L876 HydrophobicContact CD1-CB 3.66Å; Y812-L876 HydrophobicContact CD1-CD1 4.18Å; Y812-L876 HydrophobicContact CD1-CG 4.48Å; Y812-L876 HydrophobicContact CD2-CB 4.2Å; Y812-L876 HydrophobicContact CE1-CB 3.93Å; Y812-L876 HydrophobicContact CE2-CB 4.46Å; Y812-L876 HydrophobicContact CG-CB 3.81Å; Y812-L876 HydrophobicContact CG-CD1 4.05Å; K872-L876 PolarHBondContact O-N 3.31Å; F873-L876 WeakPolarHBondContact O-CB 3.43Å; F873-L876 PolarHBondContact O-N 3.37Å; W874-L876 PolarHBondContact O-N 2.95Å; L876-T878 PolarHBondContact O-N 3.15Å; L876-V879 PolarHBondContact O-N 2.97Å; L876-V879 VanDerWaalsContact O-N 3.09Å
877	F	94.1	Very high	91.6	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-54.7	-33.4	174	176.8	-95.5	0	0	0	113.5	Y812 I837 L840 A841 F873 W874 V879 D880 M881 L898 L902 F917	Y812-F877 HydrophobicContact CE2-CB 3.83Å; Y812-F877 HydrophobicContact CE2-CD2 4.44Å; Y812-F877 WeakPolarHBondContact OH-CA 3.36Å; I837-F877 HydrophobicContact CG2-CE2 4.19Å; I837-F877 HydrophobicContact CG2-CZ 3.86Å; L840-F877 HydrophobicContact CB-CE2 4.14Å; L840-F877 HydrophobicContact CD2-CD2 3.73Å; L840-F877 HydrophobicContact CD2-CE2 3.88Å; L840-F877 HydrophobicContact CG-CD2 3.89Å; L840-F877 HydrophobicContact CG-CE2 3.84Å; A841-F877 HydrophobicContact CB-CE2 4.15Å; A841-F877 HydrophobicContact CB-CZ 3.83Å; F873-F877 PolarHBondContact O-N 3.44Å; W874-F877 HydrophobicContact CE3-CB 3.96Å; W874-F877 AromaticContact CE3-CD1 3.71Å; W874-F877 HydrophobicContact CE3-CD1 3.71Å; W874-F877 HydrophobicContact CE3-CE1 4.45Å; W874-F877 AromaticContact CE3-CG 3.91Å; W874-F877 HydrophobicContact CE3-CG 3.91Å; W874-F877 HydrophobicContact CZ3-CB 4.41Å; W874-F877 AromaticContact CZ3-CD1 3.79Å; W874-F877 HydrophobicContact CZ3-CD1 3.79Å; W874-F877 HydrophobicContact CZ3-CD2 4.46Å; W874-F877 HydrophobicContact CZ3-CE1 4.16Å; W874-F877 AromaticContact CZ3-CG 3.96Å; W874-F877 HydrophobicContact CZ3-CG 3.96Å; W874-F877 WeakPolarHBondContact O-CB 3.47Å; W874-F877 PolarHBondContact O-N 3.2Å; F877-V879 PolarHBondContact O-N 2.81Å; F877-D880 PolarHBondContact O-N 3.33Å; F877-M881 HydrophobicContact CD1-CB 4.11Å; F877-M881 HydrophobicContact CD1-SD 4.4Å; F877-M881 HydrophobicContact CE1-CB 3.74Å; F877-M881 HydrophobicContact CE1-CG 3.94Å; F877-M881 HydrophobicContact CE1-SD 3.74Å; F877-M881 HydrophobicContact CZ-CB 4.16Å; F877-M881 HydrophobicContact CZ-CG 4.38Å; F877-M881 VanDerWaalsContact O-CB 3.29Å; F877-M881 WeakPolarHBondContact O-CB 3.33Å; F877-M881 PolarHBondContact O-N 3.31Å; F877-L898 HydrophobicContact CZ-CD1 4.47Å; F877-L902 HydrophobicContact CE1-CD1 3.96Å; F877-L902 HydrophobicContact CE1-CD2 4.3Å; F877-L902 HydrophobicContact CZ-CD1 4.49Å; F877-F917 HydrophobicContact CD1-CE2 4.08Å; F877-F917 AromaticContact CD1-CZ 3.71Å; F877-F917 HydrophobicContact CD1-CZ 3.71Å; F877-F917 AromaticContact CE1-CZ 3.97Å; F877-F917 HydrophobicContact CE1-CZ 3.97Å
878	T	93.6	Very high	91.5	Very high	19 Å²	19	39.6 Å²	39.6	12%	0.117	22%	0.218	C	C	.	.	H	α-helix	trans	-53.3	-40.1	176.5	-57.4	0	0	0	0	112.3	W874 L876 M881 D882 F917 H920	W874-T878 PolarHBondContact O-N 3.48Å; W874-T878 PolarHBondContact O-OG1 2.98Å; L876-T878 PolarHBondContact O-N 3.15Å; T878-M881 PolarHBondContact O-N 2.92Å; T878-D882 WeakPolarHBondContact CG2-OD2 3.48Å; T878-D882 VanDerWaalsContact O-CB 3.31Å; T878-D882 WeakPolarHBondContact O-CB 3.36Å; T878-D882 PolarHBondContact O-N 3.25Å; T878-F917 VanDerWaalsContact OG1-CD2 3.26Å; T878-F917 WeakPolarHBondContact OG1-CD2 3.02Å; T878-F917 WeakPolarHBondContact OG1-CE2 3.41Å; T878-H920 VanDerWaalsContact CG2-NE2 3.27Å; T878-H920 WeakPolarHBondContact CG2-NE2 3.23Å
879	V	90.8	Very high	91.2	Very high	88 Å²	88	40.8 Å²	40.8	53%	0.533	23%	0.231	S	C	.	.	H	α-helix	trans	-65.3	-45.1	-176.4	-177.1	0	0	0	0	111.3	L876 F877 T883	L876-V879 PolarHBondContact O-N 2.97Å; L876-V879 VanDerWaalsContact O-N 3.09Å; F877-V879 PolarHBondContact O-N 2.81Å; V879-T883 WeakPolarHBondContact O-CB 3.28Å; V879-T883 PolarHBondContact O-N 2.83Å; V879-T883 PolarHBondContact O-OG1 3Å
880	D	90.2	Very high	90.3	Very high	46 Å²	46	47.2 Å²	47.2	25%	0.246	26%	0.261	C	S	.	.	H	α-helix	trans	-75.6	-33.9	179.6	-62.2	-47.4	0	0	0	111.6	Y812 I837 F877 A884	Y812-D880 PolarHBondContact OH-OD2 3.07Å; I837-D880 HydrophobicContact CD1-CB 3.78Å; F877-D880 PolarHBondContact O-N 3.33Å; D880-A884 WeakPolarHBondContact O-CB 3.46Å; D880-A884 PolarHBondContact O-N 3.17Å; D880-A884 VanDerWaalsContact O-N 3.12Å
881	M	92.3	Very high	89.6	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.1	-55.1	173.8	-175.6	-170.2	75.7	0	0	111.8	I837 F877 T878 T883 A884 L885 L898 L902 F917 L921 I924	I837-M881 HydrophobicContact CG2-CB 4.46Å; I837-M881 HydrophobicContact CG2-CG 4.46Å; F877-M881 HydrophobicContact CD1-CB 4.11Å; F877-M881 HydrophobicContact CD1-SD 4.4Å; F877-M881 HydrophobicContact CE1-CB 3.74Å; F877-M881 HydrophobicContact CE1-CG 3.94Å; F877-M881 HydrophobicContact CE1-SD 3.74Å; F877-M881 HydrophobicContact CZ-CB 4.16Å; F877-M881 HydrophobicContact CZ-CG 4.38Å; F877-M881 VanDerWaalsContact O-CB 3.29Å; F877-M881 WeakPolarHBondContact O-CB 3.33Å; F877-M881 PolarHBondContact O-N 3.31Å; T878-M881 PolarHBondContact O-N 2.92Å; M881-T883 VanDerWaalsContact C-N 3.31Å; M881-T883 PolarHBondContact O-N 3.41Å; M881-A884 PolarHBondContact O-N 3.27Å; M881-L885 HydrophobicContact CE-CD1 4.32Å; M881-L885 HydrophobicContact CG-CD1 3.88Å; M881-L885 HydrophobicContact CG-CG 4.43Å; M881-L885 WeakPolarHBondContact O-CG 3.27Å; M881-L885 PolarHBondContact O-N 2.92Å; M881-L885 HydrophobicContact SD-CD1 4.39Å; M881-L898 HydrophobicContact CG-CD2 4.15Å; M881-L902 HydrophobicContact SD-CD1 3.99Å; M881-F917 HydrophobicContact CE-CE2 4.12Å; M881-F917 HydrophobicContact SD-CE2 4.22Å; M881-F917 HydrophobicContact SD-CZ 4.15Å; M881-L921 HydrophobicContact SD-CD1 4.19Å; M881-I924 HydrophobicContact CE-CD1 4.2Å
882	D	92.6	Very high	89.2	Confident	38 Å²	38	49.5 Å²	49.5	20%	0.203	27%	0.274	C	S	.	.	H	α-helix	trans	-60.2	-44.3	-178.1	-68.3	-1.5	0	0	0	109.9	T878 A884 L885 E886 H920 I924	T878-D882 WeakPolarHBondContact CG2-OD2 3.48Å; T878-D882 VanDerWaalsContact O-CB 3.31Å; T878-D882 WeakPolarHBondContact O-CB 3.36Å; T878-D882 PolarHBondContact O-N 3.25Å; D882-A884 VanDerWaalsContact C-N 3.26Å; D882-A884 PolarHBondContact O-N 3.06Å; D882-L885 PolarHBondContact O-N 3.32Å; D882-L885 VanDerWaalsContact O-N 3.1Å; D882-E886 WeakPolarHBondContact O-CB 3.39Å; D882-E886 WeakPolarHBondContact O-CG 3.37Å; D882-E886 PolarHBondContact O-N 3.33Å; D882-H920 VanDerWaalsContact CG-NE2 3.32Å; D882-H920 IonicContact OD1-CD2 2.73Å; D882-H920 IonicContact OD1-NE2 2.7Å; D882-H920 PolarHBondContact OD1-NE2 2.83Å; D882-H920 IonicContact OD2-CE1 2.99Å; D882-H920 PolarHBondContact OD2-CE1 3.05Å; D882-H920 VanDerWaalsContact OD2-CE1 3.26Å; D882-H920 IonicContact OD2-NE2 2.69Å; D882-H920 PolarHBondContact OD2-NE2 2.89Å; D882-I924 WeakPolarHBondContact OD1-CD1 3.43Å
883	T	89.6	Confident	88.9	Confident	72 Å²	72	48.1 Å²	48.1	44%	0.442	27%	0.266	S	S	.	.	H	α-helix	trans	-58.1	-35.3	175.2	-59.3	0	0	0	0	112.8	V879 M881	V879-T883 WeakPolarHBondContact O-CB 3.28Å; V879-T883 PolarHBondContact O-N 2.83Å; V879-T883 PolarHBondContact O-OG1 3Å; M881-T883 VanDerWaalsContact C-N 3.31Å; M881-T883 PolarHBondContact O-N 3.41Å
884	A	89	Confident	88.5	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-79.6	-29.9	176.5	0	0	0	0	0	113.2	M825 K833 I837 D880 M881 D882 Q888	M825-A884 HydrophobicContact CE-CB 3.88Å; K833-A884 HydrophobicContact CB-CB 4.38Å; I837-A884 HydrophobicContact CB-CB 4.33Å; I837-A884 HydrophobicContact CG1-CB 3.59Å; D880-A884 WeakPolarHBondContact O-CB 3.46Å; D880-A884 PolarHBondContact O-N 3.17Å; D880-A884 VanDerWaalsContact O-N 3.12Å; M881-A884 PolarHBondContact O-N 3.27Å; D882-A884 VanDerWaalsContact C-N 3.26Å; D882-A884 PolarHBondContact O-N 3.06Å; A884-Q888 WeakPolarHBondContact O-CG 3.37Å; A884-Q888 PolarHBondContact O-NE2 3.33Å
885	L	89.8	Confident	88.3	Confident	24 Å²	24	53.6 Å²	53.6	13%	0.126	30%	0.296	C	S	.	.	H	α-helix	trans	-76.4	-42.2	176.8	-67.9	174.2	0	0	0	111.8	L834 M881 D882 A887 Q888 L898 I924 F925	L834-L885 HydrophobicContact CD1-CD2 4.24Å; M881-L885 HydrophobicContact CE-CD1 4.32Å; M881-L885 HydrophobicContact CG-CD1 3.88Å; M881-L885 HydrophobicContact CG-CG 4.43Å; M881-L885 WeakPolarHBondContact O-CG 3.27Å; M881-L885 PolarHBondContact O-N 2.92Å; M881-L885 HydrophobicContact SD-CD1 4.39Å; D882-L885 PolarHBondContact O-N 3.32Å; D882-L885 VanDerWaalsContact O-N 3.1Å; L885-A887 PolarHBondContact O-N 2.98Å; L885-Q888 WeakPolarHBondContact O-CB 3.35Å; L885-Q888 PolarHBondContact O-N 3.34Å; L885-L898 HydrophobicContact CD2-CD2 4.43Å; L885-I924 HydrophobicContact CD1-CG2 4Å; L885-F925 HydrophobicContact CD1-CE2 3.91Å; L885-F925 HydrophobicContact CD1-CZ 4.2Å; L885-F925 HydrophobicContact CD2-CZ 4.13Å
886	E	88.5	Confident	88.2	Confident	171 Å²	171	51.3 Å²	51.3	80%	0.799	28%	0.275	S	S	*	.	H	α-helix	trans	-59.8	-27.6	172.3	-73.5	-170.1	167.3	0	0	112.8	D882 Q888	D882-E886 WeakPolarHBondContact O-CB 3.39Å; D882-E886 WeakPolarHBondContact O-CG 3.37Å; D882-E886 PolarHBondContact O-N 3.33Å; E886-Q888 VanDerWaalsContact C-N 3.28Å; E886-Q888 PolarHBondContact O-N 3.05Å
887	A	87.4	Confident	88.2	Confident	38 Å²	38	51.8 Å²	51.8	31%	0.314	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-9.6	176.8	0	0	0	0	0	114.2	P830 K833 L885	P830-A887 WeakPolarHBondContact CB-O 3.31Å; P830-A887 WeakPolarHBondContact CG-O 3.37Å; K833-A887 HydrophobicContact CD-CB 4.38Å; L885-A887 PolarHBondContact O-N 2.98Å
888	Q	87.4	Confident	88.1	Confident	28 Å²	28	51.9 Å²	51.9	13%	0.131	28%	0.282	C	S	.	.	S	Bend	trans	-83	152.3	-178.8	-55	-49.2	-42.4	0	0	112.9	P830 L834 A884 L885 E886	P830-Q888 VanDerWaalsContact CB-OE1 3.31Å; P830-Q888 PolarHBondContact O-NE2 3.28Å; L834-Q888 HydrophobicContact CD2-CG 4.47Å; A884-Q888 WeakPolarHBondContact O-CG 3.37Å; A884-Q888 PolarHBondContact O-NE2 3.33Å; L885-Q888 WeakPolarHBondContact O-CB 3.35Å; L885-Q888 PolarHBondContact O-N 3.34Å; E886-Q888 VanDerWaalsContact C-N 3.28Å; E886-Q888 PolarHBondContact O-N 3.05Å
889	P	84.6	Confident	88	Confident	85 Å²	85	51 Å²	51	55%	0.552	28%	0.277	S	S	*	.			trans	-59.6	144.3	167.3	-21.3	33	0	0	0	112	D891 S892	P889-D891 PolarHBondContact O-N 3.44Å; P889-S892 WeakPolarHBondContact O-CB 3.47Å; P889-S892 PolarHBondContact O-N 3Å
890	Q	74	Confident	88	Confident	139 Å²	139	49.3 Å²	49.3	65%	0.65	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-14	-177.4	-66.8	-166.3	-1.6	0	0	116.1	R931	Q890-R931 PolarHBondContact O-NE 2.89Å
891	D	78.3	Confident	88.2	Confident	80 Å²	80	49.6 Å²	49.6	43%	0.428	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124	27.4	178.5	-58	-72.9	0	0	0	111.3	P889 W893 R931 L935	P889-D891 PolarHBondContact O-N 3.44Å; D891-W893 HydrophobicContact CB-CZ2 4.12Å; D891-W893 PolarHBondContact O-NE1 3.36Å; D891-R931 IonicContact OD1-CZ 3.32Å; D891-R931 IonicContact OD1-NE 3.49Å; D891-R931 PolarHBondContact OD1-NE 3.39Å; D891-R931 IonicContact OD1-NH2 3.42Å; D891-R931 PolarHBondContact OD1-NH2 2.85Å; D891-R931 IonicContact OD2-CZ 3.82Å; D891-R931 IonicContact OD2-NH2 3.94Å; D891-R931 PolarHBondContact OD2-NH2 2.89Å; D891-L935 WeakPolarHBondContact OD1-CD1 3.45Å
892	S	82.8	Confident	88.2	Confident	12 Å²	12	49.6 Å²	49.6	8%	0.084	27%	0.265	C	S	.	.			trans	-86	132.3	165.4	166.9	0	0	0	0	109.7	P889 D894	P889-S892 WeakPolarHBondContact O-CB 3.47Å; P889-S892 PolarHBondContact O-N 3Å; S892-D894 PolarHBondContact OG-N 2.74Å; S892-D894 PolarHBondContact OG-OD2 2.94Å
893	W	86.8	Confident	88.2	Confident	64 Å²	64	47.8 Å²	47.8	24%	0.242	26%	0.255	C	S	.	.			trans	-109.2	2.3	179.8	-47.5	116.4	0	0	0	111.9	D891 S895 F896 L928 R931 Y932 L935	D891-W893 HydrophobicContact CB-CZ2 4.12Å; D891-W893 PolarHBondContact O-NE1 3.36Å; W893-S895 PolarHBondContact O-N 3.25Å; W893-S895 VanDerWaalsContact O-N 3.08Å; W893-F896 HydrophobicContact CB-CD2 3.87Å; W893-F896 HydrophobicContact CB-CE2 3.77Å; W893-F896 HydrophobicContact CD2-CE2 4.1Å; W893-F896 AromaticContact CE3-CE2 3.54Å; W893-F896 HydrophobicContact CE3-CE2 3.54Å; W893-F896 AromaticContact CE3-CZ 3.73Å; W893-F896 HydrophobicContact CE3-CZ 3.73Å; W893-F896 HydrophobicContact CG-CE2 4.22Å; W893-F896 HydrophobicContact CZ3-CE2 4.5Å; W893-F896 HydrophobicContact CZ3-CZ 4.3Å; W893-F896 VanDerWaalsContact O-CD2 3.25Å; W893-F896 WeakPolarHBondContact O-CD2 3.43Å; W893-F896 PolarHBondContact O-N 2.78Å; W893-L928 WeakPolarHBondContact CZ3-O 3.35Å; W893-R931 HydrophobicContact CH2-CB 4.29Å; W893-R931 HydrophobicContact CH2-CG 4.03Å; W893-Y932 AromaticContact CD2-CD2 3.57Å; W893-Y932 HydrophobicContact CD2-CD2 3.57Å; W893-Y932 HydrophobicContact CD2-CE2 4.29Å; W893-Y932 HydrophobicContact CD2-CG 4.38Å; W893-Y932 AromaticContact CE2-CD2 3.7Å; W893-Y932 AromaticContact CE3-CD2 3.97Å; W893-Y932 HydrophobicContact CE3-CD2 3.97Å; W893-Y932 HydrophobicContact CE3-CG 4.35Å; W893-Y932 AromaticContact CG-CD2 3.88Å; W893-Y932 HydrophobicContact CG-CD2 3.88Å; W893-Y932 HydrophobicContact CG-CE2 4.11Å; W893-Y932 HydrophobicContact CZ2-CD2 4.21Å; W893-Y932 HydrophobicContact CZ3-CD2 4.43Å; W893-L935 HydrophobicContact CH2-CD1 4.11Å; W893-L935 HydrophobicContact CZ2-CD1 3.74Å
894	D	86.1	Confident	88.2	Confident	111 Å²	111	46.9 Å²	46.9	59%	0.594	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-9.7	-175	-49.3	-75	0	0	0	112.5	L834 S892 P897	L834-D894 HydrophobicContact CD2-CB 3.93Å; L834-D894 WeakPolarHBondContact CD2-O 3.41Å; S892-D894 PolarHBondContact OG-N 2.74Å; S892-D894 PolarHBondContact OG-OD2 2.94Å; D894-P897 WeakPolarHBondContact O-CD 3.37Å
895	S	90	Very high	88.3	Confident	4 Å²	4	48.4 Å²	48.4	3%	0.028	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-14.6	179.3	57.9	0	0	0	0	114.4	W893 P897 L898 F899 F925	W893-S895 PolarHBondContact O-N 3.25Å; W893-S895 VanDerWaalsContact O-N 3.08Å; S895-P897 VanDerWaalsContact C-CD 3.46Å; S895-L898 WeakPolarHBondContact O-CB 3.4Å; S895-L898 PolarHBondContact O-N 2.78Å; S895-L898 VanDerWaalsContact O-N 3.09Å; S895-F899 PolarHBondContact O-N 3.29Å; S895-F925 WeakPolarHBondContact O-CE1 3.49Å
896	F	91.5	Very high	88.3	Confident	7 Å²	7	47.3 Å²	47.3	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-60.1	-34.4	177.9	-66.9	-51.5	0	0	0	114.6	W893 L898 F899 Q900 F925 L928 V929 Y932 F976 L980	W893-F896 HydrophobicContact CB-CD2 3.87Å; W893-F896 HydrophobicContact CB-CE2 3.77Å; W893-F896 HydrophobicContact CD2-CE2 4.1Å; W893-F896 AromaticContact CE3-CE2 3.54Å; W893-F896 HydrophobicContact CE3-CE2 3.54Å; W893-F896 AromaticContact CE3-CZ 3.73Å; W893-F896 HydrophobicContact CE3-CZ 3.73Å; W893-F896 HydrophobicContact CG-CE2 4.22Å; W893-F896 HydrophobicContact CZ3-CE2 4.5Å; W893-F896 HydrophobicContact CZ3-CZ 4.3Å; W893-F896 VanDerWaalsContact O-CD2 3.25Å; W893-F896 WeakPolarHBondContact O-CD2 3.43Å; W893-F896 PolarHBondContact O-N 2.78Å; F896-L898 VanDerWaalsContact C-N 3.27Å; F896-L898 PolarHBondContact O-N 3.3Å; F896-F899 WeakPolarHBondContact O-CB 3.49Å; F896-F899 PolarHBondContact O-N 2.89Å; F896-Q900 WeakPolarHBondContact O-CG 3.39Å; F896-Q900 PolarHBondContact O-N 3.29Å; F896-F925 AromaticContact CD1-CD1 3.93Å; F896-F925 HydrophobicContact CD1-CD1 3.93Å; F896-F925 HydrophobicContact CD1-CE1 4.15Å; F896-F925 HydrophobicContact CE1-CD1 4.13Å; F896-L928 HydrophobicContact CE1-CB 4.1Å; F896-L928 HydrophobicContact CZ-CB 4.3Å; F896-V929 HydrophobicContact CD1-CG2 4.44Å; F896-V929 HydrophobicContact CE1-CG2 3.68Å; F896-V929 HydrophobicContact CZ-CG2 4.34Å; F896-Y932 HydrophobicContact CE2-CD2 4.4Å; F896-Y932 HydrophobicContact CE2-CG 4.18Å; F896-Y932 HydrophobicContact CZ-CG 4.47Å; F896-F976 HydrophobicContact CB-CE2 4.09Å; F896-F976 HydrophobicContact CB-CZ 4.48Å; F896-F976 HydrophobicContact CD1-CE2 4.5Å; F896-F976 HydrophobicContact CD1-CZ 4.05Å; F896-F976 AromaticContact CD2-CE2 3.53Å; F896-F976 HydrophobicContact CD2-CE2 3.53Å; F896-F976 AromaticContact CD2-CZ 3.47Å; F896-F976 HydrophobicContact CD2-CZ 3.47Å; F896-F976 VanDerWaalsContact CD2-CZ 3.47Å; F896-F976 HydrophobicContact CE1-CZ 4.1Å; F896-F976 HydrophobicContact CE2-CE1 4.45Å; F896-F976 HydrophobicContact CE2-CE2 4.01Å; F896-F976 AromaticContact CE2-CZ 3.49Å; F896-F976 HydrophobicContact CE2-CZ 3.49Å; F896-F976 VanDerWaalsContact CE2-CZ 3.49Å; F896-F976 AromaticContact CG-CE2 3.82Å; F896-F976 HydrophobicContact CG-CE2 3.82Å; F896-F976 AromaticContact CG-CZ 3.76Å; F896-F976 HydrophobicContact CG-CZ 3.76Å; F896-F976 AromaticContact CZ-CZ 3.83Å; F896-F976 HydrophobicContact CZ-CZ 3.83Å; F896-L980 HydrophobicContact CD1-CD2 4.28Å
897	P	92.1	Very high	88.2	Confident	62 Å²	62	44 Å²	44	40%	0.403	23%	0.228	S	C	.	.	H	α-helix	trans	-58.5	-33.8	171.6	-27.1	36.6	0	0	0	114.1	D894 S895 Q900 L901	D894-P897 WeakPolarHBondContact O-CD 3.37Å; S895-P897 VanDerWaalsContact C-CD 3.46Å; P897-Q900 PolarHBondContact O-N 3.43Å; P897-L901 WeakPolarHBondContact O-CB 3.25Å; P897-L901 PolarHBondContact O-N 2.91Å
898	L	92.3	Very high	87.9	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-67.7	-43.7	175.6	178.1	63.9	0	0	0	111	L834 I837 L838 A841 F877 M881 L885 S895 F896 L901 L902	L834-L898 HydrophobicContact CD1-CD2 4.13Å; I837-L898 HydrophobicContact CG2-CD1 4.28Å; I837-L898 HydrophobicContact CG2-CD2 3.79Å; L838-L898 HydrophobicContact CD1-CB 4.05Å; L838-L898 HydrophobicContact CD1-CD1 4.1Å; A841-L898 HydrophobicContact CB-CD1 3.73Å; F877-L898 HydrophobicContact CZ-CD1 4.47Å; M881-L898 HydrophobicContact CG-CD2 4.15Å; L885-L898 HydrophobicContact CD2-CD2 4.43Å; S895-L898 WeakPolarHBondContact O-CB 3.4Å; S895-L898 PolarHBondContact O-N 2.78Å; S895-L898 VanDerWaalsContact O-N 3.09Å; F896-L898 VanDerWaalsContact C-N 3.27Å; F896-L898 PolarHBondContact O-N 3.3Å; L898-L901 PolarHBondContact O-N 3.25Å; L898-L902 HydrophobicContact CD1-CD1 3.85Å; L898-L902 HydrophobicContact CD1-CG 4.22Å; L898-L902 HydrophobicContact CG-CD1 3.99Å; L898-L902 WeakPolarHBondContact O-CB 3.5Å; L898-L902 WeakPolarHBondContact O-CG 3.44Å; L898-L902 PolarHBondContact O-N 3.2Å
899	F	92.7	Very high	87.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-60.4	-46.3	172.1	176.9	-92.2	0	0	0	111.5	S895 F896 L901 L902 N903 L921 F925 L980 W982	S895-F899 PolarHBondContact O-N 3.29Å; F896-F899 WeakPolarHBondContact O-CB 3.49Å; F896-F899 PolarHBondContact O-N 2.89Å; F899-L901 PolarHBondContact O-N 2.81Å; F899-L902 PolarHBondContact O-N 3.42Å; F899-N903 HydrophobicContact CD1-CB 4.43Å; F899-N903 HydrophobicContact CE1-CB 4.12Å; F899-N903 HydrophobicContact CZ-CB 4.23Å; F899-N903 WeakPolarHBondContact O-CB 3.5Å; F899-N903 PolarHBondContact O-N 3.46Å; F899-L921 HydrophobicContact CD2-CD1 4.06Å; F899-L921 HydrophobicContact CD2-CD2 4.22Å; F899-L921 HydrophobicContact CD2-CG 3.81Å; F899-L921 HydrophobicContact CE2-CD2 4.44Å; F899-L921 HydrophobicContact CE2-CG 4.09Å; F899-F925 HydrophobicContact CB-CD1 3.75Å; F899-F925 HydrophobicContact CB-CD2 4.1Å; F899-F925 HydrophobicContact CB-CE1 3.73Å; F899-F925 HydrophobicContact CB-CE2 4.07Å; F899-F925 HydrophobicContact CB-CG 3.94Å; F899-F925 HydrophobicContact CB-CZ 3.88Å; F899-F925 HydrophobicContact CD2-CB 3.65Å; F899-F925 HydrophobicContact CD2-CD1 4.21Å; F899-F925 AromaticContact CD2-CD2 3.69Å; F899-F925 HydrophobicContact CD2-CD2 3.69Å; F899-F925 HydrophobicContact CD2-CE2 4.39Å; F899-F925 AromaticContact CD2-CG 3.57Å; F899-F925 HydrophobicContact CD2-CG 3.57Å; F899-F925 HydrophobicContact CE2-CB 3.99Å; F899-F925 HydrophobicContact CE2-CG 4.4Å; F899-F925 HydrophobicContact CG-CB 4.28Å; F899-F925 HydrophobicContact CG-CD1 4.14Å; F899-F925 HydrophobicContact CG-CD2 4.3Å; F899-F925 AromaticContact CG-CG 3.97Å; F899-F925 HydrophobicContact CG-CG 3.97Å; F899-L980 HydrophobicContact CD1-CD2 3.84Å; F899-L980 HydrophobicContact CE1-CB 4.34Å; F899-L980 HydrophobicContact CE1-CD2 4.2Å; F899-L980 WeakPolarHBondContact CE1-O 3.26Å; F899-W982 AromaticContact CE1-CE3 3.92Å; F899-W982 HydrophobicContact CE1-CE3 3.92Å; F899-W982 AromaticContact CE1-CZ3 3.9Å; F899-W982 HydrophobicContact CE1-CZ3 3.9Å; F899-W982 HydrophobicContact CE2-CE3 4.4Å; F899-W982 AromaticContact CE2-CH2 3.98Å; F899-W982 HydrophobicContact CE2-CH2 3.98Å; F899-W982 AromaticContact CE2-CZ3 3.76Å; F899-W982 HydrophobicContact CE2-CZ3 3.76Å; F899-W982 HydrophobicContact CZ-CD2 4.29Å; F899-W982 AromaticContact CZ-CE3 3.53Å; F899-W982 HydrophobicContact CZ-CE3 3.53Å; F899-W982 AromaticContact CZ-CH2 3.9Å; F899-W982 HydrophobicContact CZ-CH2 3.9Å; F899-W982 AromaticContact CZ-CZ3 3.31Å; F899-W982 HydrophobicContact CZ-CZ3 3.31Å
900	Q	91.1	Very high	87.4	Confident	52 Å²	52	51.4 Å²	51.4	24%	0.243	26%	0.264	C	S	.	.	H	α-helix	trans	-61.2	-42.6	178.7	-74.4	177.2	-35.5	0	0	112.3	F896 P897 N904 D979 L980	F896-Q900 WeakPolarHBondContact O-CG 3.39Å; F896-Q900 PolarHBondContact O-N 3.29Å; P897-Q900 PolarHBondContact O-N 3.43Å; Q900-N904 WeakPolarHBondContact O-CB 3.47Å; Q900-N904 PolarHBondContact O-N 2.87Å; Q900-N904 PolarHBondContact O-ND2 3.01Å; Q900-D979 PolarHBondContact NE2-O 3.35Å; Q900-L980 HydrophobicContact CG-CD2 4.18Å
901	L	92.9	Very high	87.7	Confident	53 Å²	53	49.2 Å²	49.2	28%	0.277	26%	0.256	S	S	.	.	H	α-helix	trans	-61.6	-52.4	176.8	176.2	62.3	0	0	0	111.5	L838 A841 E842 I845 P897 L898 F899 F905	L838-L901 HydrophobicContact CD1-CD2 3.82Å; L838-L901 HydrophobicContact CG-CD2 4.44Å; A841-L901 HydrophobicContact CB-CD2 3.85Å; E842-L901 HydrophobicContact CG-CD2 3.87Å; I845-L901 HydrophobicContact CD1-CD1 3.82Å; I845-L901 HydrophobicContact CD1-CD2 4.47Å; I845-L901 HydrophobicContact CD1-CG 3.83Å; P897-L901 WeakPolarHBondContact O-CB 3.25Å; P897-L901 PolarHBondContact O-N 2.91Å; L898-L901 PolarHBondContact O-N 3.25Å; F899-L901 PolarHBondContact O-N 2.81Å; L901-F905 PolarHBondContact O-N 3.18Å
902	L	93.1	Very high	88.1	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-67.9	-44.8	-177.7	-67.7	170.6	0	0	0	111.9	A841 W874 F877 M881 L898 F899 F905 L906 F917 L921	A841-L902 HydrophobicContact CB-CD2 3.94Å; A841-L902 HydrophobicContact CB-CG 4.44Å; W874-L902 HydrophobicContact CH2-CD2 3.65Å; W874-L902 HydrophobicContact CZ3-CD2 3.65Å; F877-L902 HydrophobicContact CE1-CD1 3.96Å; F877-L902 HydrophobicContact CE1-CD2 4.3Å; F877-L902 HydrophobicContact CZ-CD1 4.49Å; M881-L902 HydrophobicContact SD-CD1 3.99Å; L898-L902 HydrophobicContact CD1-CD1 3.85Å; L898-L902 HydrophobicContact CD1-CG 4.22Å; L898-L902 HydrophobicContact CG-CD1 3.99Å; L898-L902 WeakPolarHBondContact O-CB 3.5Å; L898-L902 WeakPolarHBondContact O-CG 3.44Å; L898-L902 PolarHBondContact O-N 3.2Å; F899-L902 PolarHBondContact O-N 3.42Å; L902-F905 PolarHBondContact O-N 3.28Å; L902-L906 WeakPolarHBondContact O-CB 3.22Å; L902-L906 VanDerWaalsContact O-CG 3.26Å; L902-L906 WeakPolarHBondContact O-CG 3.1Å; L902-L906 PolarHBondContact O-N 2.9Å; L902-F917 HydrophobicContact CD1-CE1 4.48Å; L902-F917 HydrophobicContact CD1-CZ 4.13Å; L902-F917 HydrophobicContact CD2-CE1 4.3Å; L902-L921 HydrophobicContact CB-CD2 3.6Å; L902-L921 HydrophobicContact CD1-CD1 3.96Å; L902-L921 HydrophobicContact CD1-CD2 4.32Å
903	N	92.3	Very high	88.2	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-61.9	-46.2	177.5	-176.8	26.7	0	0	0	111.3	F899 F905 L906 R907 H918 L980 H981 P983	F899-N903 HydrophobicContact CD1-CB 4.43Å; F899-N903 HydrophobicContact CE1-CB 4.12Å; F899-N903 HydrophobicContact CZ-CB 4.23Å; F899-N903 WeakPolarHBondContact O-CB 3.5Å; F899-N903 PolarHBondContact O-N 3.46Å; N903-F905 PolarHBondContact O-N 2.76Å; N903-L906 PolarHBondContact O-N 2.75Å; N903-R907 VanDerWaalsContact O-CB 3.32Å; N903-R907 WeakPolarHBondContact O-CB 3.46Å; N903-R907 WeakPolarHBondContact O-CD 3.19Å; N903-R907 WeakPolarHBondContact O-CG 3.48Å; N903-R907 PolarHBondContact O-N 3.25Å; N903-H918 PolarHBondContact OD1-NE2 3.24Å; N903-L980 PolarHBondContact ND2-O 3.17Å; N903-H981 PolarHBondContact ND2-O 2.91Å; N903-P983 WeakPolarHBondContact OD1-CG 3.3Å
904	N	90.3	Very high	88.1	Confident	53 Å²	53	47.6 Å²	47.6	28%	0.283	25%	0.254	S	S	.	.	H	α-helix	trans	-66.6	-22.4	178.7	-76.3	-53	0	0	0	113.7	Q900 R907 N908	Q900-N904 WeakPolarHBondContact O-CB 3.47Å; Q900-N904 PolarHBondContact O-N 2.87Å; Q900-N904 PolarHBondContact O-ND2 3.01Å; N904-R907 PolarHBondContact OD1-NH1 3.32Å; N904-R907 VanDerWaalsContact OD1-NH1 3.17Å; N904-N908 PolarHBondContact O-ND2 3.25Å
905	F	89.7	Confident	88.1	Confident	31 Å²	31	42.9 Å²	42.9	14%	0.136	23%	0.232	C	C	.	.	H	α-helix	trans	-74.4	-58.4	165.4	177.4	-112	0	0	0	111.4	I845 L848 Q849 W874 L901 L902 N903 R907 N908 L912	I845-F905 HydrophobicContact CD1-CB 3.85Å; I845-F905 HydrophobicContact CD1-CG 4.19Å; I845-F905 HydrophobicContact CG1-CB 4.07Å; I845-F905 HydrophobicContact CG1-CD1 3.97Å; I845-F905 HydrophobicContact CG1-CD2 4.27Å; I845-F905 HydrophobicContact CG1-CG 3.83Å; I845-F905 HydrophobicContact CG2-CD2 3.72Å; I845-F905 HydrophobicContact CG2-CE2 4.06Å; I845-F905 HydrophobicContact CG2-CG 4.14Å; L848-F905 HydrophobicContact CB-CZ 4.3Å; L848-F905 HydrophobicContact CD1-CE1 4.25Å; Q849-F905 HydrophobicContact CG-CE2 3.92Å; W874-F905 AromaticContact CZ2-CD1 3.84Å; W874-F905 HydrophobicContact CZ2-CD1 3.84Å; W874-F905 AromaticContact CZ2-CE1 3.79Å; W874-F905 HydrophobicContact CZ2-CE1 3.79Å; L901-F905 PolarHBondContact O-N 3.18Å; L902-F905 PolarHBondContact O-N 3.28Å; N903-F905 PolarHBondContact O-N 2.76Å; F905-R907 PolarHBondContact O-N 3.21Å; F905-N908 PolarHBondContact O-N 3.34Å; F905-L912 HydrophobicContact CE1-CD1 4.44Å
906	L	89.9	Confident	88.1	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-63.9	-35.4	-170.3	-65.9	165.5	0	0	0	113.8	L902 N903 N908 D909 L912 C913 F917 H918 L921	L902-L906 WeakPolarHBondContact O-CB 3.22Å; L902-L906 VanDerWaalsContact O-CG 3.26Å; L902-L906 WeakPolarHBondContact O-CG 3.1Å; L902-L906 PolarHBondContact O-N 2.9Å; N903-L906 PolarHBondContact O-N 2.75Å; L906-N908 PolarHBondContact O-N 2.75Å; L906-D909 PolarHBondContact O-N 3.2Å; L906-L912 HydrophobicContact CD2-CB 3.94Å; L906-L912 HydrophobicContact CD2-CD1 4.27Å; L906-C913 WeakPolarHBondContact O-CA 3.45Å; L906-C913 WeakPolarHBondContact O-CB 3.4Å; L906-C913 PolarHBondContact O-N 3.45Å; L906-F917 HydrophobicContact CD1-CD1 3.77Å; L906-F917 HydrophobicContact CD1-CE1 3.92Å; L906-F917 HydrophobicContact CD2-CD1 4.38Å; L906-H918 HydrophobicContact CB-CB 4.49Å; L906-H918 HydrophobicContact CD1-CB 3.99Å; L906-L921 HydrophobicContact CD1-CD2 4.09Å
907	R	86.3	Confident	88.2	Confident	101 Å²	101	50.9 Å²	50.9	38%	0.381	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-19.1	179.7	74.7	-167.1	-74.7	-124.7	-4	114.4	N903 N904 F905 H918 H981	N903-R907 VanDerWaalsContact O-CB 3.32Å; N903-R907 WeakPolarHBondContact O-CB 3.46Å; N903-R907 WeakPolarHBondContact O-CD 3.19Å; N903-R907 WeakPolarHBondContact O-CG 3.48Å; N903-R907 PolarHBondContact O-N 3.25Å; N904-R907 PolarHBondContact OD1-NH1 3.32Å; N904-R907 VanDerWaalsContact OD1-NH1 3.17Å; F905-R907 PolarHBondContact O-N 3.21Å; R907-H918 WeakPolarHBondContact CA-CE1 3.31Å; R907-H918 PolarHBondContact N-CE1 3.11Å; R907-H981 PolarHBondContact NH1-CD2 3.39Å; R907-H981 VanDerWaalsContact NH1-CG 3.28Å
908	N	82.3	Confident	88.2	Confident	128 Å²	128	48 Å²	48	68%	0.684	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-15.2	179	-75.7	-46.4	0	0	0	112.7	N904 F905 L906	N904-N908 PolarHBondContact O-ND2 3.25Å; F905-N908 PolarHBondContact O-N 3.34Å; L906-N908 PolarHBondContact O-N 2.75Å
909	D	82.3	Confident	88.1	Confident	47 Å²	47	52.4 Å²	52.4	25%	0.251	27%	0.267	S	S	.	.			trans	-92.4	124.2	177.6	-176.3	-45.6	0	0	0	110.2	L906 L911 L912 C913	L906-D909 PolarHBondContact O-N 3.2Å; D909-L911 VanDerWaalsContact C-N 3.26Å; D909-L911 PolarHBondContact O-N 2.86Å; D909-L911 WeakPolarHBondContact OD1-CA 3.33Å; D909-L911 PolarHBondContact OD1-N 3.24Å; D909-L912 HydrophobicContact CB-CB 4.02Å; D909-L912 HydrophobicContact CB-CG 4.4Å; D909-L912 PolarHBondContact OD1-N 3.18Å; D909-L912 WeakPolarHBondContact OD2-CD1 3.43Å; D909-C913 WeakPolarHBondContact O-CB 3.32Å; D909-C913 PolarHBondContact O-N 3.08Å
910	T	78.1	Confident	88.1	Confident	133 Å²	133	55.1 Å²	55.1	82%	0.816	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-9.8	-175.2	55.7	0	0	0	0	114.7
911	L	81.7	Confident	88.2	Confident	93 Å²	93	52.6 Å²	52.6	49%	0.487	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-25.4	179.2	-59.3	177.1	0	0	0	112.5	P863 A867 D909	P863-L911 HydrophobicContact CB-CD1 4.22Å; A867-L911 HydrophobicContact CB-CB 3.76Å; A867-L911 HydrophobicContact CB-CD1 4.08Å; D909-L911 VanDerWaalsContact C-N 3.26Å; D909-L911 PolarHBondContact O-N 2.86Å; D909-L911 WeakPolarHBondContact OD1-CA 3.33Å; D909-L911 PolarHBondContact OD1-N 3.24Å
912	L	85.4	Confident	88.1	Confident	5 Å²	5	50.3 Å²	50.3	3%	0.026	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-20.4	176.9	-58	-179.4	0	0	0	114	A867 A870 E871 F905 L906 D909 N914 G915	A867-L912 HydrophobicContact CB-CD2 4.42Å; A870-L912 HydrophobicContact CB-CD1 3.85Å; A870-L912 HydrophobicContact CB-CD2 4.02Å; E871-L912 HydrophobicContact CG-CD2 3.87Å; F905-L912 HydrophobicContact CE1-CD1 4.44Å; L906-L912 HydrophobicContact CD2-CB 3.94Å; L906-L912 HydrophobicContact CD2-CD1 4.27Å; D909-L912 HydrophobicContact CB-CB 4.02Å; D909-L912 HydrophobicContact CB-CG 4.4Å; D909-L912 PolarHBondContact OD1-N 3.18Å; D909-L912 WeakPolarHBondContact OD2-CD1 3.43Å; L912-N914 PolarHBondContact O-N 3.13Å; L912-G915 PolarHBondContact O-N 3.42Å
913	C	86	Confident	88	Confident	47 Å²	47	57 Å²	57	32%	0.318	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	125.3	173.8	-175.6	0	0	0	0	110.8	L906 D909 G915	L906-C913 WeakPolarHBondContact O-CA 3.45Å; L906-C913 WeakPolarHBondContact O-CB 3.4Å; L906-C913 PolarHBondContact O-N 3.45Å; D909-C913 WeakPolarHBondContact O-CB 3.32Å; D909-C913 PolarHBondContact O-N 3.08Å; C913-G915 PolarHBondContact O-N 2.92Å
914	N	84.4	Confident	88	Confident	69 Å²	69	59.1 Å²	59.1	37%	0.369	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	21.4	-171.4	-59.7	-50.3	0	0	0	115.1	L912 H918 K919	L912-N914 PolarHBondContact O-N 3.13Å; N914-H918 PolarHBondContact N-ND1 3.4Å; N914-K919 VanDerWaalsContact O-CE 3.31Å; N914-K919 WeakPolarHBondContact O-CE 3.38Å
915	G	86.9	Confident	88	Confident	12 Å²	12	56.6 Å²	56.6	12%	0.124	28%	0.284	C	S	.	.			trans	-65.8	-178.6	166.2	0	0	0	0	0	113.1	E871 L912 C913 H918 K919	E871-G915 WeakPolarHBondContact OE1-CA 3.44Å; L912-G915 PolarHBondContact O-N 3.42Å; C913-G915 PolarHBondContact O-N 2.92Å; G915-H918 PolarHBondContact O-N 2.96Å; G915-K919 WeakPolarHBondContact O-CG 3.25Å; G915-K919 PolarHBondContact O-N 2.98Å
916	K	89.9	Confident	88.1	Confident	173 Å²	173	57.1 Å²	57.1	75%	0.752	29%	0.29	S	S	*	.	H	α-helix	trans	-63.7	-51	-175.8	-64.2	178.2	-178.9	175.6	0	111.7	E871 H918 K919 H920	E871-K916 PolarHBondContact OE1-N 2.97Å; E871-K916 PolarHBondContact OE2-N 3.46Å; K916-H918 VanDerWaalsContact C-N 3.31Å; K916-H918 PolarHBondContact O-N 3.23Å; K916-K919 PolarHBondContact O-N 3Å; K916-H920 PolarHBondContact O-N 3.32Å
917	F	92.9	Very high	88.1	Confident	7 Å²	7	60.7 Å²	60.7	3%	0.031	31%	0.313	C	S	.	.	H	α-helix	trans	-62.1	-39.9	176.6	177.5	-116.5	0	0	0	112.1	E871 W874 F877 T878 M881 L902 L906 K919 H920 L921	E871-F917 PolarHBondContact OE2-N 2.76Å; W874-F917 HydrophobicContact CB-CB 3.76Å; W874-F917 HydrophobicContact CB-CD1 3.64Å; W874-F917 HydrophobicContact CB-CD2 4.04Å; W874-F917 HydrophobicContact CB-CE1 4.22Å; W874-F917 HydrophobicContact CB-CG 3.53Å; W874-F917 AromaticContact CD2-CD1 3.79Å; W874-F917 HydrophobicContact CD2-CD1 3.79Å; W874-F917 AromaticContact CD2-CE1 3.69Å; W874-F917 HydrophobicContact CD2-CE1 3.69Å; W874-F917 HydrophobicContact CD2-CZ 4.4Å; W874-F917 HydrophobicContact CE3-CD1 4.12Å; W874-F917 AromaticContact CE3-CE1 3.56Å; W874-F917 HydrophobicContact CE3-CE1 3.56Å; W874-F917 AromaticContact CE3-CZ 3.87Å; W874-F917 HydrophobicContact CE3-CZ 3.87Å; W874-F917 HydrophobicContact CG-CB 4.41Å; W874-F917 AromaticContact CG-CD1 3.58Å; W874-F917 HydrophobicContact CG-CD1 3.58Å; W874-F917 AromaticContact CG-CE1 3.99Å; W874-F917 HydrophobicContact CG-CE1 3.99Å; W874-F917 HydrophobicContact CG-CG 4.03Å; W874-F917 HydrophobicContact CZ3-CE1 4.19Å; W874-F917 HydrophobicContact CZ3-CZ 4.47Å; F877-F917 HydrophobicContact CD1-CE2 4.08Å; F877-F917 AromaticContact CD1-CZ 3.71Å; F877-F917 HydrophobicContact CD1-CZ 3.71Å; F877-F917 AromaticContact CE1-CZ 3.97Å; F877-F917 HydrophobicContact CE1-CZ 3.97Å; T878-F917 VanDerWaalsContact OG1-CD2 3.26Å; T878-F917 WeakPolarHBondContact OG1-CD2 3.02Å; T878-F917 WeakPolarHBondContact OG1-CE2 3.41Å; M881-F917 HydrophobicContact CE-CE2 4.12Å; M881-F917 HydrophobicContact SD-CE2 4.22Å; M881-F917 HydrophobicContact SD-CZ 4.15Å; L902-F917 HydrophobicContact CD1-CE1 4.48Å; L902-F917 HydrophobicContact CD1-CZ 4.13Å; L902-F917 HydrophobicContact CD2-CE1 4.3Å; L906-F917 HydrophobicContact CD1-CD1 3.77Å; L906-F917 HydrophobicContact CD1-CE1 3.92Å; L906-F917 HydrophobicContact CD2-CD1 4.38Å; F917-K919 VanDerWaalsContact C-N 3.27Å; F917-K919 PolarHBondContact O-N 3.44Å; F917-H920 PolarHBondContact O-N 3.05Å; F917-L921 WeakPolarHBondContact O-CB 3.46Å; F917-L921 PolarHBondContact O-N 3.38Å
918	H	92.3	Very high	88.3	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-67	-28.1	180	-161.7	-175.4	0	0	0	112.7	N903 L906 R907 N914 G915 K916 Q922 P983	N903-H918 PolarHBondContact OD1-NE2 3.24Å; L906-H918 HydrophobicContact CB-CB 4.49Å; L906-H918 HydrophobicContact CD1-CB 3.99Å; R907-H918 WeakPolarHBondContact CA-CE1 3.31Å; R907-H918 PolarHBondContact N-CE1 3.11Å; N914-H918 PolarHBondContact N-ND1 3.4Å; G915-H918 PolarHBondContact O-N 2.96Å; K916-H918 VanDerWaalsContact C-N 3.31Å; K916-H918 PolarHBondContact O-N 3.23Å; H918-Q922 WeakPolarHBondContact O-CG 3.31Å; H918-Q922 PolarHBondContact O-N 3.5Å; H918-Q922 PolarHBondContact O-NE2 2.92Å; H918-P983 WeakPolarHBondContact NE2-CG 3.28Å
919	K	90.7	Very high	88.7	Confident	95 Å²	95	51.8 Å²	51.8	41%	0.413	27%	0.272	S	S	.	.	H	α-helix	trans	-76.5	-45.1	172.2	-74.4	-177.8	174.6	-171.1	0	112.6	N914 G915 K916 F917 L921 Q922 E923	N914-K919 VanDerWaalsContact O-CE 3.31Å; N914-K919 WeakPolarHBondContact O-CE 3.38Å; G915-K919 WeakPolarHBondContact O-CG 3.25Å; G915-K919 PolarHBondContact O-N 2.98Å; K916-K919 PolarHBondContact O-N 3Å; F917-K919 VanDerWaalsContact C-N 3.27Å; F917-K919 PolarHBondContact O-N 3.44Å; K919-L921 VanDerWaalsContact C-N 3.28Å; K919-L921 PolarHBondContact O-N 3.4Å; K919-Q922 CarbonylContact O-C 3.59Å; K919-Q922 WeakPolarHBondContact O-CA 3.4Å; K919-Q922 WeakPolarHBondContact O-CB 3.43Å; K919-Q922 PolarHBondContact O-N 3.17Å; K919-E923 WeakPolarHBondContact O-CG 3.4Å; K919-E923 PolarHBondContact O-N 3.41Å
920	H	92.8	Very high	89.1	Confident	56 Å²	56	51.6 Å²	51.6	26%	0.259	27%	0.273	S	S	.	.	H	α-helix	trans	-54.9	-44.3	172.7	-176.6	85.2	0	0	0	112.1	T878 D882 K916 F917 Q922 E923 I924	T878-H920 VanDerWaalsContact CG2-NE2 3.27Å; T878-H920 WeakPolarHBondContact CG2-NE2 3.23Å; D882-H920 VanDerWaalsContact CG-NE2 3.32Å; D882-H920 IonicContact OD1-CD2 2.73Å; D882-H920 IonicContact OD1-NE2 2.7Å; D882-H920 PolarHBondContact OD1-NE2 2.83Å; D882-H920 IonicContact OD2-CE1 2.99Å; D882-H920 PolarHBondContact OD2-CE1 3.05Å; D882-H920 VanDerWaalsContact OD2-CE1 3.26Å; D882-H920 IonicContact OD2-NE2 2.69Å; D882-H920 PolarHBondContact OD2-NE2 2.89Å; K916-H920 PolarHBondContact O-N 3.32Å; F917-H920 PolarHBondContact O-N 3.05Å; H920-Q922 VanDerWaalsContact C-N 3.33Å; H920-Q922 PolarHBondContact O-N 3.04Å; H920-E923 PolarHBondContact O-N 2.93Å; H920-I924 VanDerWaalsContact NE2-CD1 3.28Å; H920-I924 WeakPolarHBondContact NE2-CD1 3.39Å; H920-I924 PolarHBondContact O-N 3.44Å
921	L	92.4	Very high	89.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.9	-39.5	174	-178.5	67.1	0	0	0	112.6	M881 F899 L902 L906 F917 K919 F925	M881-L921 HydrophobicContact SD-CD1 4.19Å; F899-L921 HydrophobicContact CD2-CD1 4.06Å; F899-L921 HydrophobicContact CD2-CD2 4.22Å; F899-L921 HydrophobicContact CD2-CG 3.81Å; F899-L921 HydrophobicContact CE2-CD2 4.44Å; F899-L921 HydrophobicContact CE2-CG 4.09Å; L902-L921 HydrophobicContact CB-CD2 3.6Å; L902-L921 HydrophobicContact CD1-CD1 3.96Å; L902-L921 HydrophobicContact CD1-CD2 4.32Å; L906-L921 HydrophobicContact CD1-CD2 4.09Å; F917-L921 WeakPolarHBondContact O-CB 3.46Å; F917-L921 PolarHBondContact O-N 3.38Å; K919-L921 VanDerWaalsContact C-N 3.28Å; K919-L921 PolarHBondContact O-N 3.4Å; L921-F925 HydrophobicContact CD1-CD2 3.89Å; L921-F925 HydrophobicContact CD1-CE2 3.84Å; L921-F925 WeakPolarHBondContact O-CD2 3.27Å; L921-F925 PolarHBondContact O-N 2.93Å
922	Q	90.8	Very high	90	Very high	4 Å²	4	46.8 Å²	46.8	2%	0.019	23%	0.234	C	C	.	.	H	α-helix	trans	-69	-48.2	175.1	-76.8	173.2	94	0	0	111.3	H918 K919 H920 I924 F925 V926 W982 P983	H918-Q922 WeakPolarHBondContact O-CG 3.31Å; H918-Q922 PolarHBondContact O-N 3.5Å; H918-Q922 PolarHBondContact O-NE2 2.92Å; K919-Q922 CarbonylContact O-C 3.59Å; K919-Q922 WeakPolarHBondContact O-CA 3.4Å; K919-Q922 WeakPolarHBondContact O-CB 3.43Å; K919-Q922 PolarHBondContact O-N 3.17Å; H920-Q922 VanDerWaalsContact C-N 3.33Å; H920-Q922 PolarHBondContact O-N 3.04Å; Q922-I924 VanDerWaalsContact C-N 3.27Å; Q922-I924 PolarHBondContact O-N 2.87Å; Q922-F925 PolarHBondContact O-N 2.19Å; Q922-V926 WeakPolarHBondContact O-CG2 3.39Å; Q922-V926 PolarHBondContact O-N 3.36Å; Q922-W982 HydrophobicContact CB-CH2 4.3Å; Q922-W982 HydrophobicContact CB-CZ2 3.74Å; Q922-W982 HydrophobicContact CG-CH2 4.31Å; Q922-W982 HydrophobicContact CG-CZ2 3.72Å; Q922-P983 HydrophobicContact CG-CG 4.2Å
923	E	91.3	Very high	90.3	Very high	140 Å²	140	46.6 Å²	46.6	65%	0.654	23%	0.233	S	C	*	.	H	α-helix	trans	-56.2	-37.6	-179.9	-72.5	171.6	-148.8	0	0	112.6	K919 H920 P927	K919-E923 WeakPolarHBondContact O-CG 3.4Å; K919-E923 PolarHBondContact O-N 3.41Å; H920-E923 PolarHBondContact O-N 2.93Å; E923-P927 VanDerWaalsContact O-CD 3.31Å; E923-P927 WeakPolarHBondContact O-CD 3.08Å
924	I	91.4	Very high	90.4	Very high	45 Å²	45	47.5 Å²	47.5	23%	0.231	23%	0.234	C	C	.	.	H	α-helix	trans	-70.3	-43.3	174.1	-72	177.3	0	0	0	112.6	M881 D882 L885 H920 Q922 P927	M881-I924 HydrophobicContact CE-CD1 4.2Å; D882-I924 WeakPolarHBondContact OD1-CD1 3.43Å; L885-I924 HydrophobicContact CD1-CG2 4Å; H920-I924 VanDerWaalsContact NE2-CD1 3.28Å; H920-I924 WeakPolarHBondContact NE2-CD1 3.39Å; H920-I924 PolarHBondContact O-N 3.44Å; Q922-I924 VanDerWaalsContact C-N 3.27Å; Q922-I924 PolarHBondContact O-N 2.87Å; I924-P927 WeakPolarHBondContact O-CD 3.45Å; I924-P927 WeakPolarHBondContact O-CG 3.4Å
925	F	91.5	Very high	90.7	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-86.9	-20.8	-172.2	-82.2	-91.6	0	0	0	114.6	L885 S895 F896 F899 L921 Q922 L928 V929 W982	L885-F925 HydrophobicContact CD1-CE2 3.91Å; L885-F925 HydrophobicContact CD1-CZ 4.2Å; L885-F925 HydrophobicContact CD2-CZ 4.13Å; S895-F925 WeakPolarHBondContact O-CE1 3.49Å; F896-F925 AromaticContact CD1-CD1 3.93Å; F896-F925 HydrophobicContact CD1-CD1 3.93Å; F896-F925 HydrophobicContact CD1-CE1 4.15Å; F896-F925 HydrophobicContact CE1-CD1 4.13Å; F899-F925 HydrophobicContact CB-CD1 3.75Å; F899-F925 HydrophobicContact CB-CD2 4.1Å; F899-F925 HydrophobicContact CB-CE1 3.73Å; F899-F925 HydrophobicContact CB-CE2 4.07Å; F899-F925 HydrophobicContact CB-CG 3.94Å; F899-F925 HydrophobicContact CB-CZ 3.88Å; F899-F925 HydrophobicContact CD2-CB 3.65Å; F899-F925 HydrophobicContact CD2-CD1 4.21Å; F899-F925 AromaticContact CD2-CD2 3.69Å; F899-F925 HydrophobicContact CD2-CD2 3.69Å; F899-F925 HydrophobicContact CD2-CE2 4.39Å; F899-F925 AromaticContact CD2-CG 3.57Å; F899-F925 HydrophobicContact CD2-CG 3.57Å; F899-F925 HydrophobicContact CE2-CB 3.99Å; F899-F925 HydrophobicContact CE2-CG 4.4Å; F899-F925 HydrophobicContact CG-CB 4.28Å; F899-F925 HydrophobicContact CG-CD1 4.14Å; F899-F925 HydrophobicContact CG-CD2 4.3Å; F899-F925 AromaticContact CG-CG 3.97Å; F899-F925 HydrophobicContact CG-CG 3.97Å; L921-F925 HydrophobicContact CD1-CD2 3.89Å; L921-F925 HydrophobicContact CD1-CE2 3.84Å; L921-F925 WeakPolarHBondContact O-CD2 3.27Å; L921-F925 PolarHBondContact O-N 2.93Å; Q922-F925 PolarHBondContact O-N 2.19Å; F925-L928 HydrophobicContact CD1-CD1 3.91Å; F925-L928 HydrophobicContact CE1-CD1 4.04Å; F925-L928 HydrophobicContact CG-CD1 4.45Å; F925-L928 PolarHBondContact O-N 3.33Å; F925-L928 VanDerWaalsContact O-N 3.17Å; F925-V929 WeakPolarHBondContact O-CG2 3.37Å; F925-V929 PolarHBondContact O-N 3.29Å; F925-W982 HydrophobicContact CB-CH2 4.18Å; F925-W982 HydrophobicContact CB-CZ3 4.31Å
926	V	91.4	Very high	90.8	Very high	43 Å²	43	49.1 Å²	49.1	26%	0.261	24%	0.239	S	C	.	.	H	α-helix	trans	-48.1	-56.9	172.2	163.7	0	0	0	0	112.6	Q922 L928 V929 V930 W982 F987	Q922-V926 WeakPolarHBondContact O-CG2 3.39Å; Q922-V926 PolarHBondContact O-N 3.36Å; V926-L928 VanDerWaalsContact C-N 3.28Å; V926-L928 PolarHBondContact O-N 3.28Å; V926-V929 PolarHBondContact O-N 3.42Å; V926-V930 WeakPolarHBondContact O-CG2 3.36Å; V926-V930 PolarHBondContact O-N 3.03Å; V926-W982 HydrophobicContact CG2-CH2 3.72Å; V926-W982 HydrophobicContact CG2-CZ2 3.4Å; V926-W982 VanDerWaalsContact CG2-CZ2 3.4Å; V926-F987 HydrophobicContact CB-CZ 4.34Å; V926-F987 HydrophobicContact CG1-CE2 4Å; V926-F987 HydrophobicContact CG1-CZ 3.9Å; V926-F987 HydrophobicContact CG2-CD1 4.49Å; V926-F987 HydrophobicContact CG2-CE1 4.07Å; V926-F987 HydrophobicContact CG2-CE2 4.49Å; V926-F987 HydrophobicContact CG2-CZ 4.09Å
927	P	90.4	Very high	90.7	Very high	75 Å²	75	44 Å²	44	49%	0.487	22%	0.218	S	C	.	.	H	α-helix	trans	-65.7	-29.7	-178	25.3	-35.3	0	0	0	113.1	E923 I924 R931	E923-P927 VanDerWaalsContact O-CD 3.31Å; E923-P927 WeakPolarHBondContact O-CD 3.08Å; I924-P927 WeakPolarHBondContact O-CD 3.45Å; I924-P927 WeakPolarHBondContact O-CG 3.4Å; P927-R931 VanDerWaalsContact O-CB 3.25Å; P927-R931 WeakPolarHBondContact O-CB 2.92Å; P927-R931 PolarHBondContact O-N 3.4Å
928	L	90	Very high	90.5	Very high	42 Å²	42	46.6 Å²	46.6	22%	0.22	24%	0.237	C	C	.	.	H	α-helix	trans	-69.4	-45.2	176.1	-62.8	177.4	0	0	0	111.4	W893 F896 F925 V926 R931 Y932	W893-L928 WeakPolarHBondContact CZ3-O 3.35Å; F896-L928 HydrophobicContact CE1-CB 4.1Å; F896-L928 HydrophobicContact CZ-CB 4.3Å; F925-L928 HydrophobicContact CD1-CD1 3.91Å; F925-L928 HydrophobicContact CE1-CD1 4.04Å; F925-L928 HydrophobicContact CG-CD1 4.45Å; F925-L928 PolarHBondContact O-N 3.33Å; F925-L928 VanDerWaalsContact O-N 3.17Å; V926-L928 VanDerWaalsContact C-N 3.28Å; V926-L928 PolarHBondContact O-N 3.28Å; L928-R931 PolarHBondContact O-N 3.27Å; L928-Y932 WeakPolarHBondContact O-CB 3.47Å; L928-Y932 PolarHBondContact O-N 3.28Å
929	V	90.8	Very high	90.3	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64.7	-42.6	177.1	176.4	0	0	0	0	111	F896 F925 V926 Y932 V933 L980 W982 L991	F896-V929 HydrophobicContact CD1-CG2 4.44Å; F896-V929 HydrophobicContact CE1-CG2 3.68Å; F896-V929 HydrophobicContact CZ-CG2 4.34Å; F925-V929 WeakPolarHBondContact O-CG2 3.37Å; F925-V929 PolarHBondContact O-N 3.29Å; V926-V929 PolarHBondContact O-N 3.42Å; V929-Y932 PolarHBondContact O-N 2.86Å; V929-V933 WeakPolarHBondContact O-CG2 3.31Å; V929-V933 PolarHBondContact O-N 2.94Å; V929-L980 HydrophobicContact CB-CD1 4.49Å; V929-L980 HydrophobicContact CG1-CD1 3.92Å; V929-L980 HydrophobicContact CG2-CD1 3.65Å; V929-W982 HydrophobicContact CG2-CZ3 4.11Å; V929-L991 HydrophobicContact CG1-CD1 3.73Å; V929-L991 HydrophobicContact CG1-CD2 4.31Å
930	V	89.9	Confident	90.1	Very high	43 Å²	43	44.7 Å²	44.7	26%	0.261	24%	0.235	S	C	.	.	H	α-helix	trans	-62.1	-49.1	175.7	175	0	0	0	0	111.1	V926 Y932 V933 D934 F987	V926-V930 WeakPolarHBondContact O-CG2 3.36Å; V926-V930 PolarHBondContact O-N 3.03Å; V930-Y932 VanDerWaalsContact C-N 3.31Å; V930-Y932 PolarHBondContact O-N 3.42Å; V930-V933 PolarHBondContact O-N 3.2Å; V930-V933 VanDerWaalsContact O-N 3.17Å; V930-D934 PolarHBondContact O-N 2.9Å; V930-F987 HydrophobicContact CG2-CE2 4.15Å; V930-F987 HydrophobicContact CG2-CZ 3.92Å
931	R	90.1	Very high	89.8	Confident	82 Å²	82	43.5 Å²	43.5	31%	0.309	24%	0.236	S	C	.	.	H	α-helix	trans	-60.6	-38.4	178.5	-173.3	-177.9	176.1	141.1	-6.3	112.2	Q890 D891 W893 P927 L928 D934 L935	Q890-R931 PolarHBondContact O-NE 2.89Å; D891-R931 IonicContact OD1-CZ 3.32Å; D891-R931 IonicContact OD1-NE 3.49Å; D891-R931 PolarHBondContact OD1-NE 3.39Å; D891-R931 IonicContact OD1-NH2 3.42Å; D891-R931 PolarHBondContact OD1-NH2 2.85Å; D891-R931 IonicContact OD2-CZ 3.82Å; D891-R931 IonicContact OD2-NH2 3.94Å; D891-R931 PolarHBondContact OD2-NH2 2.89Å; W893-R931 HydrophobicContact CH2-CB 4.29Å; W893-R931 HydrophobicContact CH2-CG 4.03Å; P927-R931 VanDerWaalsContact O-CB 3.25Å; P927-R931 WeakPolarHBondContact O-CB 2.92Å; P927-R931 PolarHBondContact O-N 3.4Å; L928-R931 PolarHBondContact O-N 3.27Å; R931-D934 PolarHBondContact O-N 3.1Å; R931-L935 HydrophobicContact CG-CD1 3.98Å; R931-L935 WeakPolarHBondContact O-CB 3.16Å; R931-L935 VanDerWaalsContact O-CG 3.27Å; R931-L935 WeakPolarHBondContact O-CG 3.32Å; R931-L935 PolarHBondContact O-N 2.91Å
932	Y	90	Very high	89.5	Confident	44 Å²	44	48.3 Å²	48.3	17%	0.173	26%	0.258	C	S	.	.	H	α-helix	trans	-62.6	-46.8	174.6	-178.6	-109.3	0	0	0	111.8	W893 F896 L928 V929 V930 L935 M936 L973 F976	W893-Y932 AromaticContact CD2-CD2 3.57Å; W893-Y932 HydrophobicContact CD2-CD2 3.57Å; W893-Y932 HydrophobicContact CD2-CE2 4.29Å; W893-Y932 HydrophobicContact CD2-CG 4.38Å; W893-Y932 AromaticContact CE2-CD2 3.7Å; W893-Y932 AromaticContact CE3-CD2 3.97Å; W893-Y932 HydrophobicContact CE3-CD2 3.97Å; W893-Y932 HydrophobicContact CE3-CG 4.35Å; W893-Y932 AromaticContact CG-CD2 3.88Å; W893-Y932 HydrophobicContact CG-CD2 3.88Å; W893-Y932 HydrophobicContact CG-CE2 4.11Å; W893-Y932 HydrophobicContact CZ2-CD2 4.21Å; W893-Y932 HydrophobicContact CZ3-CD2 4.43Å; F896-Y932 HydrophobicContact CE2-CD2 4.4Å; F896-Y932 HydrophobicContact CE2-CG 4.18Å; F896-Y932 HydrophobicContact CZ-CG 4.47Å; L928-Y932 WeakPolarHBondContact O-CB 3.47Å; L928-Y932 PolarHBondContact O-N 3.28Å; V929-Y932 PolarHBondContact O-N 2.86Å; V930-Y932 VanDerWaalsContact C-N 3.31Å; V930-Y932 PolarHBondContact O-N 3.42Å; Y932-L935 PolarHBondContact O-N 2.77Å; Y932-M936 HydrophobicContact CD1-CG 4.39Å; Y932-M936 HydrophobicContact CD2-CG 4.27Å; Y932-M936 HydrophobicContact CE1-CG 4.04Å; Y932-M936 HydrophobicContact CE2-CG 3.91Å; Y932-M936 HydrophobicContact CE2-SD 4.39Å; Y932-M936 WeakPolarHBondContact O-CB 3.45Å; Y932-M936 VanDerWaalsContact O-CG 3.31Å; Y932-M936 WeakPolarHBondContact O-CG 3.43Å; Y932-M936 PolarHBondContact O-N 3.43Å; Y932-L973 HydrophobicContact CD1-CD1 4.02Å; Y932-L973 HydrophobicContact CE1-CD1 3.54Å; Y932-F976 AromaticContact CD1-CD1 3.79Å; Y932-F976 HydrophobicContact CD1-CD1 3.79Å; Y932-F976 AromaticContact CD1-CE1 3.41Å; Y932-F976 HydrophobicContact CD1-CE1 3.41Å; Y932-F976 VanDerWaalsContact CD1-CE1 3.41Å; Y932-F976 HydrophobicContact CD1-CZ 4Å; Y932-F976 AromaticContact CE1-CD1 3.5Å; Y932-F976 HydrophobicContact CE1-CD1 3.5Å; Y932-F976 VanDerWaalsContact CE1-CD1 3.5Å; Y932-F976 HydrophobicContact CE1-CD2 4.49Å; Y932-F976 AromaticContact CE1-CE1 3.58Å; Y932-F976 HydrophobicContact CE1-CE1 3.58Å; Y932-F976 AromaticContact CE1-CG 4Å; Y932-F976 HydrophobicContact CE1-CG 4Å; Y932-F976 HydrophobicContact CE1-CZ 4.13Å; Y932-F976 HydrophobicContact CG-CE1 4.43Å
933	V	89.8	Confident	89.2	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-63.6	-44	176.7	173.9	0	0	0	0	111.3	V929 V930 L935 M936 E937 L973 V977 L995	V929-V933 WeakPolarHBondContact O-CG2 3.31Å; V929-V933 PolarHBondContact O-N 2.94Å; V930-V933 PolarHBondContact O-N 3.2Å; V930-V933 VanDerWaalsContact O-N 3.17Å; V933-L935 VanDerWaalsContact C-N 3.33Å; V933-L935 PolarHBondContact O-N 2.69Å; V933-M936 PolarHBondContact O-N 3.48Å; V933-E937 VanDerWaalsContact O-CB 3.28Å; V933-E937 WeakPolarHBondContact O-CB 3.34Å; V933-E937 PolarHBondContact O-N 3.25Å; V933-L973 HydrophobicContact CG2-CD1 4.49Å; V933-V977 HydrophobicContact CG2-CG2 4.46Å; V933-L995 HydrophobicContact CG1-CD2 4.17Å; V933-L995 HydrophobicContact CG2-CD2 4.48Å
934	D	89.5	Confident	88.9	Confident	65 Å²	65	43 Å²	43	35%	0.348	24%	0.237	S	C	.	.	H	α-helix	trans	-57.5	-43.5	176.8	-66.3	-18.9	0	0	0	112.4	V930 R931 S938 R994	V930-D934 PolarHBondContact O-N 2.9Å; R931-D934 PolarHBondContact O-N 3.1Å; D934-S938 WeakPolarHBondContact O-CB 3.37Å; D934-S938 PolarHBondContact O-N 2.73Å; D934-S938 VanDerWaalsContact O-N 3.09Å; D934-S938 PolarHBondContact O-OG 2.9Å; D934-R994 IonicContact OD1-CZ 2.69Å; D934-R994 IonicContact OD1-NH1 3.87Å; D934-R994 PolarHBondContact OD1-NH1 2.94Å; D934-R994 IonicContact OD1-NH2 3.42Å; D934-R994 PolarHBondContact OD1-NH2 2.92Å
935	L	89.3	Confident	88.4	Confident	77 Å²	77	45.8 Å²	45.8	40%	0.403	25%	0.249	S	C	.	.	H	α-helix	trans	-73.9	-37	179.9	-72	169.9	0	0	0	112	D891 W893 R931 Y932 V933 S938 S939	D891-L935 WeakPolarHBondContact OD1-CD1 3.45Å; W893-L935 HydrophobicContact CH2-CD1 4.11Å; W893-L935 HydrophobicContact CZ2-CD1 3.74Å; R931-L935 HydrophobicContact CG-CD1 3.98Å; R931-L935 WeakPolarHBondContact O-CB 3.16Å; R931-L935 VanDerWaalsContact O-CG 3.27Å; R931-L935 WeakPolarHBondContact O-CG 3.32Å; R931-L935 PolarHBondContact O-N 2.91Å; Y932-L935 PolarHBondContact O-N 2.77Å; V933-L935 VanDerWaalsContact C-N 3.33Å; V933-L935 PolarHBondContact O-N 2.69Å; L935-S938 PolarHBondContact O-N 3.28Å; L935-S939 WeakPolarHBondContact O-CB 3.35Å; L935-S939 PolarHBondContact O-N 3.41Å
936	M	89.3	Confident	88	Confident	38 Å²	38	53.4 Å²	53.4	19%	0.187	28%	0.277	C	S	.	.	H	α-helix	trans	-69.3	-42	174.8	-74.5	-66.3	-72	0	0	112	Y932 V933 S938 S939 I940 L973	Y932-M936 HydrophobicContact CD1-CG 4.39Å; Y932-M936 HydrophobicContact CD2-CG 4.27Å; Y932-M936 HydrophobicContact CE1-CG 4.04Å; Y932-M936 HydrophobicContact CE2-CG 3.91Å; Y932-M936 HydrophobicContact CE2-SD 4.39Å; Y932-M936 WeakPolarHBondContact O-CB 3.45Å; Y932-M936 VanDerWaalsContact O-CG 3.31Å; Y932-M936 WeakPolarHBondContact O-CG 3.43Å; Y932-M936 PolarHBondContact O-N 3.43Å; V933-M936 PolarHBondContact O-N 3.48Å; M936-S938 VanDerWaalsContact C-N 3.32Å; M936-S938 PolarHBondContact O-N 3.22Å; M936-S939 PolarHBondContact O-N 2.78Å; M936-I940 WeakPolarHBondContact O-CB 3.39Å; M936-I940 WeakPolarHBondContact O-CG1 3.25Å; M936-I940 PolarHBondContact O-N 2.82Å; M936-L973 HydrophobicContact CB-CD1 4.32Å; M936-L973 HydrophobicContact CB-CD2 3.75Å; M936-L973 HydrophobicContact CG-CD1 4.31Å
937	E	88.7	Confident	87.5	Confident	66 Å²	66	52.2 Å²	52.2	31%	0.308	27%	0.274	S	S	.	.	H	α-helix	trans	-54.3	-49.9	170.9	-177	175.3	159.1	0	0	110.7	V933 S939 I940 A941 R994 M998 M1002	V933-E937 VanDerWaalsContact O-CB 3.28Å; V933-E937 WeakPolarHBondContact O-CB 3.34Å; V933-E937 PolarHBondContact O-N 3.25Å; E937-S939 VanDerWaalsContact C-N 3.34Å; E937-S939 PolarHBondContact O-N 3.09Å; E937-I940 PolarHBondContact O-N 3.3Å; E937-A941 WeakPolarHBondContact O-CB 3.5Å; E937-A941 PolarHBondContact O-N 3.3Å; E937-R994 IonicContact OE2-CZ 2.79Å; E937-R994 IonicContact OE2-NE 3.53Å; E937-R994 PolarHBondContact OE2-NE 2.7Å; E937-R994 IonicContact OE2-NH2 2.62Å; E937-R994 PolarHBondContact OE2-NH2 3.15Å; E937-M998 HydrophobicContact CB-CG 4.47Å; E937-M998 HydrophobicContact CB-SD 3.52Å; E937-M998 VanDerWaalsContact CB-SD 3.52Å; E937-M998 HydrophobicContact CG-CG 3.98Å; E937-M998 HydrophobicContact CG-SD 3.7Å; E937-M1002 HydrophobicContact CG-CE 4.06Å; E937-M1002 WeakPolarHBondContact O-CE 3.46Å
938	S	88.9	Confident	87.1	Confident	62 Å²	62	49.6 Å²	49.6	43%	0.434	26%	0.255	S	S	.	.	H	α-helix	trans	-63.2	-36.6	177.2	-61.3	0	0	0	0	113.5	D934 L935 M936 Q942	D934-S938 WeakPolarHBondContact O-CB 3.37Å; D934-S938 PolarHBondContact O-N 2.73Å; D934-S938 VanDerWaalsContact O-N 3.09Å; D934-S938 PolarHBondContact O-OG 2.9Å; L935-S938 PolarHBondContact O-N 3.28Å; M936-S938 VanDerWaalsContact C-N 3.32Å; M936-S938 PolarHBondContact O-N 3.22Å; S938-Q942 WeakPolarHBondContact O-CB 3.2Å; S938-Q942 WeakPolarHBondContact O-CG 3.41Å; S938-Q942 PolarHBondContact O-N 3.2Å; S938-Q942 VanDerWaalsContact O-N 3.16Å; S938-Q942 PolarHBondContact O-NE2 2.86Å
939	S	87.6	Confident	86.5	Confident	54 Å²	54	54.9 Å²	54.9	38%	0.378	28%	0.278	S	S	.	.	H	α-helix	trans	-71.1	-45.7	178.9	-177.3	0	0	0	0	111.6	L935 M936 E937 Q942 S943	L935-S939 WeakPolarHBondContact O-CB 3.35Å; L935-S939 PolarHBondContact O-N 3.41Å; M936-S939 PolarHBondContact O-N 2.78Å; E937-S939 VanDerWaalsContact C-N 3.34Å; E937-S939 PolarHBondContact O-N 3.09Å; S939-Q942 PolarHBondContact O-N 3.43Å; S939-S943 PolarHBondContact O-N 3.47Å
940	I	87.6	Confident	85.9	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-64.5	-45.5	177.2	-65.3	167.1	0	0	0	109.9	M936 E937 Q942 S943 I944 L966 K969 L970 L973 M1002	M936-I940 WeakPolarHBondContact O-CB 3.39Å; M936-I940 WeakPolarHBondContact O-CG1 3.25Å; M936-I940 PolarHBondContact O-N 2.82Å; E937-I940 PolarHBondContact O-N 3.3Å; I940-Q942 VanDerWaalsContact C-N 3.32Å; I940-Q942 PolarHBondContact O-N 3.42Å; I940-S943 WeakPolarHBondContact O-CB 3.28Å; I940-S943 PolarHBondContact O-N 3.46Å; I940-S943 VanDerWaalsContact O-N 3.11Å; I940-I944 HydrophobicContact CG2-CD1 4.4Å; I940-I944 WeakPolarHBondContact O-CG1 3.33Å; I940-I944 PolarHBondContact O-N 2.84Å; I940-L966 HydrophobicContact CG2-CD1 3.36Å; I940-K969 HydrophobicContact CD1-CB 4Å; I940-K969 HydrophobicContact CG1-CB 3.93Å; I940-K969 HydrophobicContact CG1-CD 4.25Å; I940-L970 HydrophobicContact CD1-CD2 4.06Å; I940-L973 HydrophobicContact CD1-CD2 4.32Å; I940-M1002 HydrophobicContact CB-CE 4.42Å; I940-M1002 HydrophobicContact CB-SD 4.46Å; I940-M1002 HydrophobicContact CG2-CE 4.31Å; I940-M1002 HydrophobicContact CG2-CG 3.96Å; I940-M1002 HydrophobicContact CG2-SD 3.78Å
941	A	86.3	Confident	85.6	Confident	32 Å²	32	61.4 Å²	61.4	26%	0.264	31%	0.306	S	S	.	.	H	α-helix	trans	-53.6	-47.8	173.5	0	0	0	0	0	112.1	E937 I944 H945 M1002	E937-A941 WeakPolarHBondContact O-CB 3.5Å; E937-A941 PolarHBondContact O-N 3.3Å; A941-I944 PolarHBondContact O-N 2.89Å; A941-H945 PolarHBondContact O-CD2 2.97Å; A941-H945 VanDerWaalsContact O-CD2 3.32Å; A941-H945 PolarHBondContact O-N 3.19Å; A941-M1002 HydrophobicContact CB-CE 4.01Å; A941-M1002 HydrophobicContact CB-SD 4.38Å
942	Q	85.8	Confident	85.1	Confident	100 Å²	100	61.8 Å²	61.8	47%	0.467	32%	0.317	S	S	.	.	H	α-helix	trans	-67.2	-34.9	178.3	-75.1	-180	63.9	0	0	112.9	S938 S939 I940 H945 R946	S938-Q942 WeakPolarHBondContact O-CB 3.2Å; S938-Q942 WeakPolarHBondContact O-CG 3.41Å; S938-Q942 PolarHBondContact O-N 3.2Å; S938-Q942 VanDerWaalsContact O-N 3.16Å; S938-Q942 PolarHBondContact O-NE2 2.86Å; S939-Q942 PolarHBondContact O-N 3.43Å; I940-Q942 VanDerWaalsContact C-N 3.32Å; I940-Q942 PolarHBondContact O-N 3.42Å; Q942-H945 PolarHBondContact O-N 3.39Å; Q942-R946 PolarHBondContact O-N 3.18Å
943	S	84.3	Confident	84.9	Confident	32 Å²	32	60.6 Å²	60.6	22%	0.224	31%	0.313	C	S	.	.	H	α-helix	trans	-61.6	-48.5	174	-145	0	0	0	0	110.8	S939 I940 H945 G947 D965 K969	S939-S943 PolarHBondContact O-N 3.47Å; I940-S943 WeakPolarHBondContact O-CB 3.28Å; I940-S943 PolarHBondContact O-N 3.46Å; I940-S943 VanDerWaalsContact O-N 3.11Å; S943-H945 PolarHBondContact O-N 3.43Å; S943-G947 VanDerWaalsContact O-CA 3.32Å; S943-G947 WeakPolarHBondContact O-CA 3.07Å; S943-G947 PolarHBondContact O-N 3.4Å; S943-D965 PolarHBondContact OG-OD2 3.16Å; S943-K969 PolarHBondContact OG-NZ 3.39Å
944	I	83.9	Confident	84.6	Confident	2 Å²	2	66.8 Å²	66.8	1%	0.01	34%	0.341	C	S	.	.	H	α-helix	trans	-60.3	-48.6	175.6	-62.6	177.1	0	0	0	110.9	I940 A941 F948 L966 M1002 A1005	I940-I944 HydrophobicContact CG2-CD1 4.4Å; I940-I944 WeakPolarHBondContact O-CG1 3.33Å; I940-I944 PolarHBondContact O-N 2.84Å; A941-I944 PolarHBondContact O-N 2.89Å; I944-F948 HydrophobicContact CB-CD2 4.48Å; I944-F948 HydrophobicContact CG2-CD2 3.79Å; I944-F948 HydrophobicContact CG2-CE2 4.13Å; I944-F948 WeakPolarHBondContact O-CD2 3.21Å; I944-F948 PolarHBondContact O-N 3.17Å; I944-L966 HydrophobicContact CD1-CD1 3.71Å; I944-L966 HydrophobicContact CD1-CD2 3.84Å; I944-L966 HydrophobicContact CD1-CG 4.4Å; I944-L966 HydrophobicContact CG1-CD1 3.96Å; I944-L966 HydrophobicContact CG1-CD2 4.03Å; I944-L966 HydrophobicContact CG1-CG 4.47Å; I944-M1002 HydrophobicContact CD1-CB 3.77Å; I944-M1002 HydrophobicContact CD1-CG 4.17Å; I944-M1002 HydrophobicContact CD1-SD 3.56Å; I944-M1002 VanDerWaalsContact CD1-SD 3.56Å; I944-A1005 HydrophobicContact CD1-CB 4.49Å; I944-A1005 HydrophobicContact CG2-CB 4.38Å
945	H	81.9	Confident	84.2	Confident	103 Å²	103	68.2 Å²	68.2	48%	0.477	36%	0.355	S	S	.	.	H	α-helix	trans	-61.4	-51.7	-176.9	-93	-93.6	0	0	0	112.4	A941 Q942 S943 E949 R1009	A941-H945 PolarHBondContact O-CD2 2.97Å; A941-H945 VanDerWaalsContact O-CD2 3.32Å; A941-H945 PolarHBondContact O-N 3.19Å; Q942-H945 PolarHBondContact O-N 3.39Å; S943-H945 PolarHBondContact O-N 3.43Å; H945-E949 WeakPolarHBondContact O-CG 3.27Å; H945-R1009 PolarHBondContact CD2-NH2 3.46Å; H945-R1009 PolarHBondContact CE1-NH2 2.96Å; H945-R1009 PolarHBondContact ND1-NH2 3.24Å; H945-R1009 PolarHBondContact NE2-NH2 3.43Å
946	R	82.1	Confident	83.7	Confident	159 Å²	159	67.2 Å²	67.2	60%	0.6	35%	0.352	S	S	*	.	H	α-helix	trans	-79.1	-36.3	-177	-66.3	-178.4	-179.3	154.4	6.4	113	Q942 E949 Q950	Q942-R946 PolarHBondContact O-N 3.18Å; R946-E949 PolarHBondContact O-N 3Å; R946-Q950 PolarHBondContact O-N 3.32Å
947	G	81.6	Confident	83.2	Confident	18 Å²	18	71.7 Å²	71.7	19%	0.186	38%	0.376	C	S	.	.	H	α-helix	trans	-62.6	-54.8	-178.8	0	0	0	0	0	111.6	S943 E949 Q950 E951	S943-G947 VanDerWaalsContact O-CA 3.32Å; S943-G947 WeakPolarHBondContact O-CA 3.07Å; S943-G947 PolarHBondContact O-N 3.4Å; G947-E949 PolarHBondContact O-N 3.1Å; G947-Q950 CarbonylContact O-C 3.57Å; G947-Q950 PolarHBondContact O-N 2.98Å; G947-E951 WeakPolarHBondContact O-CA 3.37Å; G947-E951 WeakPolarHBondContact O-CB 3.49Å; G947-E951 PolarHBondContact O-N 2.74Å
948	F	81.7	Confident	82.6	Confident	20 Å²	20	71.7 Å²	71.7	9%	0.088	38%	0.378	C	S	.	.	H	α-helix	trans	-67.8	-19.4	-178.9	-77.3	-69.4	0	0	0	114.4	I944 W953 T962 C1006 R1009	I944-F948 HydrophobicContact CB-CD2 4.48Å; I944-F948 HydrophobicContact CG2-CD2 3.79Å; I944-F948 HydrophobicContact CG2-CE2 4.13Å; I944-F948 WeakPolarHBondContact O-CD2 3.21Å; I944-F948 PolarHBondContact O-N 3.17Å; F948-W953 AromaticContact CD1-CH2 3.58Å; F948-W953 HydrophobicContact CD1-CH2 3.58Å; F948-W953 AromaticContact CD1-CZ2 3.8Å; F948-W953 HydrophobicContact CD1-CZ2 3.8Å; F948-W953 AromaticContact CE1-CH2 3.56Å; F948-W953 HydrophobicContact CE1-CH2 3.56Å; F948-W953 HydrophobicContact CE1-CZ2 4.25Å; F948-W953 HydrophobicContact CE1-CZ3 4.14Å; F948-T962 HydrophobicContact CD1-CG2 4.46Å; F948-T962 HydrophobicContact CD2-CG2 3.65Å; F948-T962 HydrophobicContact CE1-CG2 4.43Å; F948-T962 HydrophobicContact CE2-CG2 3.6Å; F948-T962 HydrophobicContact CG-CG2 4.09Å; F948-T962 HydrophobicContact CZ-CG2 4.01Å; F948-C1006 HydrophobicContact CE2-CB 4.28Å; F948-C1006 HydrophobicContact CZ-CB 4.44Å; F948-C1006 VanDerWaalsContact CZ-SG 3.52Å; F948-R1009 HydrophobicContact CB-CB 4.27Å; F948-R1009 HydrophobicContact CG-CB 4.25Å
949	E	77.3	Confident	82.4	Confident	154 Å²	154	68.8 Å²	68.8	72%	0.72	36%	0.358	S	S	*	.	H	α-helix	trans	-74.3	-29.5	170.1	-77.1	178.2	-178.4	0	0	113	H945 R946 G947	H945-E949 WeakPolarHBondContact O-CG 3.27Å; R946-E949 PolarHBondContact O-N 3Å; G947-E949 PolarHBondContact O-N 3.1Å
950	Q	78.8	Confident	82.3	Confident	154 Å²	154	66.2 Å²	66.2	72%	0.72	34%	0.34	S	S	*	.	H	α-helix	trans	-106.7	-1.6	-178.2	-59.5	-175	17.1	0	0	113.2	R946 G947 T952	R946-Q950 PolarHBondContact O-N 3.32Å; G947-Q950 CarbonylContact O-C 3.57Å; G947-Q950 PolarHBondContact O-N 2.98Å; Q950-T952 PolarHBondContact O-N 3.46Å
951	E	82.5	Confident	82.2	Confident	25 Å²	25	68.9 Å²	68.9	12%	0.117	36%	0.362	C	S	.	.			trans	-60.2	126.9	-172.4	-178	54.7	-89.3	0	0	111.9	G947 W953 S960 T962	G947-E951 WeakPolarHBondContact O-CA 3.37Å; G947-E951 WeakPolarHBondContact O-CB 3.49Å; G947-E951 PolarHBondContact O-N 2.74Å; E951-W953 HydrophobicContact CB-CZ2 4.3Å; E951-W953 HydrophobicContact CG-CD2 3.59Å; E951-W953 HydrophobicContact CG-CE3 4.1Å; E951-W953 HydrophobicContact CG-CG 3.83Å; E951-W953 HydrophobicContact CG-CH2 4.46Å; E951-W953 HydrophobicContact CG-CZ2 3.99Å; E951-W953 PolarHBondContact O-NE1 3.18Å; E951-W953 PolarHBondContact OE1-N 2.72Å; E951-S960 WeakPolarHBondContact OE2-CB 3.3Å; E951-S960 PolarHBondContact OE2-OG 2.73Å; E951-T962 VanDerWaalsContact OE2-CB 3.3Å; E951-T962 WeakPolarHBondContact OE2-CB 3.49Å; E951-T962 PolarHBondContact OE2-N 2.85Å; E951-T962 VanDerWaalsContact OE2-N 3.08Å; E951-T962 PolarHBondContact OE2-OG1 3.06Å
952	T	80.4	Confident	82.2	Confident	90 Å²	90	68 Å²	68	55%	0.552	35%	0.354	S	S	*	.			trans	-85.6	-18.2	179.8	65.2	0	0	0	0	112.1	Q950 Q954	Q950-T952 PolarHBondContact O-N 3.46Å; T952-Q954 VanDerWaalsContact C-N 3.32Å
953	W	86.8	Confident	82.3	Confident	19 Å²	19	63.2 Å²	63.2	7%	0.072	33%	0.332	C	S	.	.			trans	59.2	42.2	-178.4	-53.9	87.2	0	0	0	112.2	F948 E951 T1010 A1013 S1032 M1036 V1039	F948-W953 AromaticContact CD1-CH2 3.58Å; F948-W953 HydrophobicContact CD1-CH2 3.58Å; F948-W953 AromaticContact CD1-CZ2 3.8Å; F948-W953 HydrophobicContact CD1-CZ2 3.8Å; F948-W953 AromaticContact CE1-CH2 3.56Å; F948-W953 HydrophobicContact CE1-CH2 3.56Å; F948-W953 HydrophobicContact CE1-CZ2 4.25Å; F948-W953 HydrophobicContact CE1-CZ3 4.14Å; E951-W953 HydrophobicContact CB-CZ2 4.3Å; E951-W953 HydrophobicContact CG-CD2 3.59Å; E951-W953 HydrophobicContact CG-CE3 4.1Å; E951-W953 HydrophobicContact CG-CG 3.83Å; E951-W953 HydrophobicContact CG-CH2 4.46Å; E951-W953 HydrophobicContact CG-CZ2 3.99Å; E951-W953 PolarHBondContact O-NE1 3.18Å; E951-W953 PolarHBondContact OE1-N 2.72Å; W953-T1010 HydrophobicContact CH2-CG2 4.02Å; W953-T1010 HydrophobicContact CZ3-CG2 3.92Å; W953-A1013 HydrophobicContact CH2-CB 4.21Å; W953-A1013 HydrophobicContact CZ2-CB 3.52Å; W953-S1032 WeakPolarHBondContact O-CA 3.37Å; W953-S1032 WeakPolarHBondContact O-CB 3.4Å; W953-M1036 HydrophobicContact CB-CE 4.4Å; W953-M1036 HydrophobicContact CD2-CE 3.47Å; W953-M1036 VanDerWaalsContact CD2-CE 3.47Å; W953-M1036 HydrophobicContact CD2-CG 3.74Å; W953-M1036 HydrophobicContact CD2-SD 4.49Å; W953-M1036 HydrophobicContact CE3-CB 4.32Å; W953-M1036 HydrophobicContact CE3-CE 4.08Å; W953-M1036 HydrophobicContact CE3-CG 3.31Å; W953-M1036 HydrophobicContact CG-CE 3.6Å; W953-M1036 HydrophobicContact CG-CG 4.45Å; W953-M1036 HydrophobicContact CH2-CG 4.21Å; W953-M1036 HydrophobicContact CZ2-CE 4.18Å; W953-M1036 HydrophobicContact CZ3-CB 4.35Å; W953-M1036 HydrophobicContact CZ3-CG 3.58Å; W953-V1039 HydrophobicContact CZ3-CG2 4.4Å
954	Q	83.3	Confident	82.5	Confident	131 Å²	131	63.7 Å²	63.7	61%	0.612	33%	0.33	S	S	*	.			trans	-80.3	142.6	162.5	-64.3	-176.9	25.6	0	0	109	T952 V956	T952-Q954 VanDerWaalsContact C-N 3.32Å; Q954-V956 PolarHBondContact O-N 3.36Å
955	P	80	Confident	82.6	Confident	96 Å²	96	66 Å²	66	62%	0.623	34%	0.342	S	S	*	.			trans	-68.3	128.1	178.3	28.3	-34	0	0	0	110.8
956	V	78.8	Confident	82.9	Confident	56 Å²	56	61.1 Å²	61.1	34%	0.339	32%	0.32	S	S	.	.	B	Isolated β-bridge	trans	-132.5	118.7	172.3	-178.8	0	0	0	0	106.8	Q954 N958 G959 A961 E964	Q954-V956 PolarHBondContact O-N 3.36Å; V956-N958 PolarHBondContact O-N 3.35Å; V956-G959 PolarHBondContact N-O 2.92Å; V956-G959 CarbonylContact O-C 3.35Å; V956-G959 PolarHBondContact O-N 3.48Å; V956-G959 VanDerWaalsContact O-O 3.13Å; V956-A961 HydrophobicContact CG2-CB 4.29Å; V956-E964 HydrophobicContact CB-CG 4.48Å; V956-E964 HydrophobicContact CG1-CG 4.31Å; V956-E964 WeakPolarHBondContact O-CG 3.26Å
957	N	79.1	Confident	83.2	Confident	131 Å²	131	54.1 Å²	54.1	70%	0.701	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.3	-108.5	-171.3	-49.3	-29.3	0	0	0	112.8	E964	N957-E964 WeakPolarHBondContact CB-OE2 3.45Å; N957-E964 PolarHBondContact ND2-OE2 2.94Å
958	N	76.8	Confident	83.6	Confident	66 Å²	66	61.7 Å²	61.7	35%	0.353	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-11.8	-179.3	-72.3	-11	0	0	0	113.4	V956 E964 N1038 D1042	V956-N958 PolarHBondContact O-N 3.35Å; N958-E964 PolarHBondContact N-OE1 2.91Å; N958-N1038 CarbonylContact O-C 3.59Å; N958-N1038 WeakPolarHBondContact O-CB 3.13Å; N958-D1042 HydrophobicContact CB-CB 4.04Å; N958-D1042 WeakPolarHBondContact CB-OD1 3.47Å; N958-D1042 PolarHBondContact ND2-OD1 3.08Å
959	G	83.7	Confident	83.9	Confident	2 Å²	2	62.6 Å²	62.6	2%	0.021	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-142.2	-132.8	-174.4	0	0	0	0	0	113.7	V956 E964 T1035	V956-G959 PolarHBondContact N-O 2.92Å; V956-G959 CarbonylContact O-C 3.35Å; V956-G959 PolarHBondContact O-N 3.48Å; V956-G959 VanDerWaalsContact O-O 3.13Å; G959-E964 PolarHBondContact N-OE1 2.94Å; G959-E964 VanDerWaalsContact N-OE1 3.1Å; G959-T1035 WeakPolarHBondContact O-CG2 3.36Å
960	S	86.6	Confident	84.5	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.287	C	S	.	.			trans	-116.3	168.1	172.3	81	0	0	0	0	110.4	E951 T962 S963 E964	E951-S960 WeakPolarHBondContact OE2-CB 3.3Å; E951-S960 PolarHBondContact OE2-OG 2.73Å; S960-T962 PolarHBondContact O-N 2.92Å; S960-T962 VanDerWaalsContact O-N 3.17Å; S960-S963 PolarHBondContact N-OG 3.34Å; S960-S963 PolarHBondContact O-N 3.23Å; S960-S963 VanDerWaalsContact O-N 3.1Å; S960-S963 PolarHBondContact O-OG 2.98Å; S960-E964 VanDerWaalsContact O-CG 3.29Å; S960-E964 WeakPolarHBondContact O-CG 3.32Å; S960-E964 PolarHBondContact O-N 3.5Å
961	A	85.6	Confident	84.8	Confident	56 Å²	56	50.2 Å²	50.2	46%	0.463	27%	0.265	S	S	.	.	H	α-helix	trans	-53.5	-38.7	178.9	0	0	0	0	0	112.7	V956 D965	V956-A961 HydrophobicContact CG2-CB 4.29Å; A961-D965 VanDerWaalsContact O-CB 3.3Å; A961-D965 WeakPolarHBondContact O-CB 3.2Å; A961-D965 PolarHBondContact O-N 3.38Å
962	T	86.1	Confident	85	Confident	14 Å²	14	51 Å²	51	9%	0.086	28%	0.275	C	S	.	.	H	α-helix	trans	-71.1	-37.3	178.6	-46.7	0	0	0	0	113.3	F948 E951 S960 L966	F948-T962 HydrophobicContact CD1-CG2 4.46Å; F948-T962 HydrophobicContact CD2-CG2 3.65Å; F948-T962 HydrophobicContact CE1-CG2 4.43Å; F948-T962 HydrophobicContact CE2-CG2 3.6Å; F948-T962 HydrophobicContact CG-CG2 4.09Å; F948-T962 HydrophobicContact CZ-CG2 4.01Å; E951-T962 VanDerWaalsContact OE2-CB 3.3Å; E951-T962 WeakPolarHBondContact OE2-CB 3.49Å; E951-T962 PolarHBondContact OE2-N 2.85Å; E951-T962 VanDerWaalsContact OE2-N 3.08Å; E951-T962 PolarHBondContact OE2-OG1 3.06Å; S960-T962 PolarHBondContact O-N 2.92Å; S960-T962 VanDerWaalsContact O-N 3.17Å; T962-L966 WeakPolarHBondContact O-CB 3.37Å; T962-L966 PolarHBondContact O-N 2.84Å
963	S	88	Confident	85.4	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-74.6	-38.7	-180	64.8	0	0	0	0	112.2	S960 L966 F967	S960-S963 PolarHBondContact N-OG 3.34Å; S960-S963 PolarHBondContact O-N 3.23Å; S960-S963 VanDerWaalsContact O-N 3.1Å; S960-S963 PolarHBondContact O-OG 2.98Å; S963-L966 WeakPolarHBondContact O-CB 3.32Å; S963-L966 PolarHBondContact O-N 2.9Å; S963-F967 VanDerWaalsContact O-CD2 3.23Å; S963-F967 WeakPolarHBondContact O-CD2 3.5Å; S963-F967 WeakPolarHBondContact O-CG 3.36Å; S963-F967 PolarHBondContact O-N 3.33Å
964	E	87.6	Confident	85.3	Confident	42 Å²	42	47.8 Å²	47.8	20%	0.196	26%	0.255	C	S	.	.	H	α-helix	trans	-66.2	-44.1	177.9	-63.5	-80.8	148.9	0	0	111	V956 N957 N958 G959 S960 L966 F967 W968	V956-E964 HydrophobicContact CB-CG 4.48Å; V956-E964 HydrophobicContact CG1-CG 4.31Å; V956-E964 WeakPolarHBondContact O-CG 3.26Å; N957-E964 WeakPolarHBondContact CB-OE2 3.45Å; N957-E964 PolarHBondContact ND2-OE2 2.94Å; N958-E964 PolarHBondContact N-OE1 2.91Å; G959-E964 PolarHBondContact N-OE1 2.94Å; G959-E964 VanDerWaalsContact N-OE1 3.1Å; S960-E964 VanDerWaalsContact O-CG 3.29Å; S960-E964 WeakPolarHBondContact O-CG 3.32Å; S960-E964 PolarHBondContact O-N 3.5Å; E964-L966 VanDerWaalsContact C-N 3.33Å; E964-L966 PolarHBondContact O-N 3.36Å; E964-F967 PolarHBondContact O-N 2.96Å; E964-W968 VanDerWaalsContact O-CB 3.28Å; E964-W968 WeakPolarHBondContact O-CB 3.47Å; E964-W968 PolarHBondContact O-N 3.5Å
965	D	86.3	Confident	85.5	Confident	49 Å²	49	45.9 Å²	45.9	26%	0.262	25%	0.247	S	C	.	.	H	α-helix	trans	-57.7	-43	172.4	174.7	75.1	0	0	0	112.3	S943 A961 K969	S943-D965 PolarHBondContact OG-OD2 3.16Å; A961-D965 VanDerWaalsContact O-CB 3.3Å; A961-D965 WeakPolarHBondContact O-CB 3.2Å; A961-D965 PolarHBondContact O-N 3.38Å; D965-K969 WeakPolarHBondContact O-CB 3.23Å; D965-K969 WeakPolarHBondContact O-CD 3.44Å; D965-K969 VanDerWaalsContact O-CG 3.27Å; D965-K969 WeakPolarHBondContact O-CG 3.36Å; D965-K969 PolarHBondContact O-N 3.32Å; D965-K969 WeakPolarHBondContact OD1-CE 3.43Å; D965-K969 IonicContact OD1-NZ 2.77Å; D965-K969 PolarHBondContact OD1-NZ 2.82Å; D965-K969 IonicContact OD2-NZ 2.95Å; D965-K969 PolarHBondContact OD2-NZ 3.36Å
966	L	88.8	Confident	85.9	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-61.3	-54.7	176.2	169	59.9	0	0	0	111.9	I940 I944 T962 S963 E964 W968 K969 L970 M1002 C1006	I940-L966 HydrophobicContact CG2-CD1 3.36Å; I944-L966 HydrophobicContact CD1-CD1 3.71Å; I944-L966 HydrophobicContact CD1-CD2 3.84Å; I944-L966 HydrophobicContact CD1-CG 4.4Å; I944-L966 HydrophobicContact CG1-CD1 3.96Å; I944-L966 HydrophobicContact CG1-CD2 4.03Å; I944-L966 HydrophobicContact CG1-CG 4.47Å; T962-L966 WeakPolarHBondContact O-CB 3.37Å; T962-L966 PolarHBondContact O-N 2.84Å; S963-L966 WeakPolarHBondContact O-CB 3.32Å; S963-L966 PolarHBondContact O-N 2.9Å; E964-L966 VanDerWaalsContact C-N 3.33Å; E964-L966 PolarHBondContact O-N 3.36Å; L966-W968 VanDerWaalsContact C-N 3.35Å; L966-W968 PolarHBondContact O-N 3.4Å; L966-K969 PolarHBondContact O-N 2.88Å; L966-L970 HydrophobicContact CD1-CD1 3.78Å; L966-L970 HydrophobicContact CD1-CG 4.08Å; L966-L970 HydrophobicContact CG-CD1 4.19Å; L966-L970 WeakPolarHBondContact O-CG 3.36Å; L966-L970 PolarHBondContact O-N 3.32Å; L966-M1002 HydrophobicContact CD1-CB 4.13Å; L966-C1006 HydrophobicContact CD2-CB 3.71Å
967	F	88.6	Confident	86.3	Confident	11 Å²	11	41.1 Å²	41.1	5%	0.048	21%	0.213	C	C	.	.	H	α-helix	trans	-65.8	-39.9	-175.2	-57.7	-28.9	0	0	0	111.3	S963 E964 K969 L970 D971 L1003 D1042 A1043 Q1046	S963-F967 VanDerWaalsContact O-CD2 3.23Å; S963-F967 WeakPolarHBondContact O-CD2 3.5Å; S963-F967 WeakPolarHBondContact O-CG 3.36Å; S963-F967 PolarHBondContact O-N 3.33Å; E964-F967 PolarHBondContact O-N 2.96Å; F967-K969 PolarHBondContact O-N 2.98Å; F967-L970 PolarHBondContact O-N 3.32Å; F967-D971 WeakPolarHBondContact O-CB 3.32Å; F967-D971 PolarHBondContact O-N 2.98Å; F967-L1003 HydrophobicContact CD1-CD2 4.38Å; F967-L1003 HydrophobicContact CE1-CD2 3.62Å; F967-L1003 HydrophobicContact CZ-CD2 4.31Å; F967-D1042 HydrophobicContact CE2-CB 4.36Å; F967-A1043 HydrophobicContact CZ-CB 3.94Å; F967-Q1046 HydrophobicContact CB-CG 4.19Å; F967-Q1046 HydrophobicContact CD1-CB 4.37Å; F967-Q1046 HydrophobicContact CD1-CG 4.18Å; F967-Q1046 HydrophobicContact CD2-CG 3.64Å; F967-Q1046 HydrophobicContact CE2-CG 3.99Å; F967-Q1046 HydrophobicContact CG-CB 4.41Å; F967-Q1046 HydrophobicContact CG-CG 3.75Å; F967-Q1046 HydrophobicContact CZ-CG 4.42Å
968	W	88.9	Confident	86.6	Confident	177 Å²	177	41.4 Å²	41.4	67%	0.67	21%	0.209	S	C	*	.	H	α-helix	trans	-61.7	-42.3	174.3	178.5	74.4	0	0	0	112.7	E964 L966 D971 A972	E964-W968 VanDerWaalsContact O-CB 3.28Å; E964-W968 WeakPolarHBondContact O-CB 3.47Å; E964-W968 PolarHBondContact O-N 3.5Å; L966-W968 VanDerWaalsContact C-N 3.35Å; L966-W968 PolarHBondContact O-N 3.4Å; W968-D971 PolarHBondContact O-N 3.49Å; W968-A972 VanDerWaalsContact O-CB 3.26Å; W968-A972 WeakPolarHBondContact O-CB 3.45Å; W968-A972 PolarHBondContact O-N 3.35Å
969	K	88.8	Confident	87	Confident	39 Å²	39	41.4 Å²	41.4	17%	0.17	21%	0.209	C	C	.	.	H	α-helix	trans	-66.4	-38.3	177.2	-78.1	169.4	177.8	160.7	0	113.2	I940 S943 D965 L966 F967 L973	I940-K969 HydrophobicContact CD1-CB 4Å; I940-K969 HydrophobicContact CG1-CB 3.93Å; I940-K969 HydrophobicContact CG1-CD 4.25Å; S943-K969 PolarHBondContact OG-NZ 3.39Å; D965-K969 WeakPolarHBondContact O-CB 3.23Å; D965-K969 WeakPolarHBondContact O-CD 3.44Å; D965-K969 VanDerWaalsContact O-CG 3.27Å; D965-K969 WeakPolarHBondContact O-CG 3.36Å; D965-K969 PolarHBondContact O-N 3.32Å; D965-K969 WeakPolarHBondContact OD1-CE 3.43Å; D965-K969 IonicContact OD1-NZ 2.77Å; D965-K969 PolarHBondContact OD1-NZ 2.82Å; D965-K969 IonicContact OD2-NZ 2.95Å; D965-K969 PolarHBondContact OD2-NZ 3.36Å; L966-K969 PolarHBondContact O-N 2.88Å; F967-K969 PolarHBondContact O-N 2.98Å; K969-L973 VanDerWaalsContact O-CB 3.3Å; K969-L973 WeakPolarHBondContact O-CB 3.49Å; K969-L973 PolarHBondContact O-N 2.94Å
970	L	88.3	Confident	87.2	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-66.7	-44.8	175.2	-71.3	172.6	0	0	0	111.2	I940 L966 F967 L973 Q974 M998 A999 M1002 L1050	I940-L970 HydrophobicContact CD1-CD2 4.06Å; L966-L970 HydrophobicContact CD1-CD1 3.78Å; L966-L970 HydrophobicContact CD1-CG 4.08Å; L966-L970 HydrophobicContact CG-CD1 4.19Å; L966-L970 WeakPolarHBondContact O-CG 3.36Å; L966-L970 PolarHBondContact O-N 3.32Å; F967-L970 PolarHBondContact O-N 3.32Å; L970-L973 PolarHBondContact O-N 2.97Å; L970-Q974 WeakPolarHBondContact O-CG 3.43Å; L970-Q974 PolarHBondContact O-N 3.19Å; L970-M998 HydrophobicContact CD2-CE 4.01Å; L970-A999 HydrophobicContact CD1-CB 4.31Å; L970-A999 HydrophobicContact CD2-CB 4.17Å; L970-M1002 HydrophobicContact CD1-CB 4.27Å; L970-L1050 HydrophobicContact CB-CD1 3.98Å; L970-L1050 HydrophobicContact CD1-CD1 4.2Å
971	D	85.3	Confident	87.1	Confident	47 Å²	47	44.1 Å²	44.1	25%	0.251	22%	0.22	S	C	.	.	H	α-helix	trans	-63.8	-46.6	179.4	-154.6	50.2	0	0	0	111.9	F967 W968 L973 Q974 M975 K1049 L1050	F967-D971 WeakPolarHBondContact O-CB 3.32Å; F967-D971 PolarHBondContact O-N 2.98Å; W968-D971 PolarHBondContact O-N 3.49Å; D971-L973 VanDerWaalsContact C-N 3.29Å; D971-L973 PolarHBondContact O-N 3.11Å; D971-Q974 PolarHBondContact O-N 3.48Å; D971-M975 WeakPolarHBondContact O-CG 3.38Å; D971-M975 PolarHBondContact O-N 3.3Å; D971-K1049 WeakPolarHBondContact OD1-CE 3.38Å; D971-K1049 IonicContact OD1-NZ 2.81Å; D971-K1049 PolarHBondContact OD1-NZ 3.44Å; D971-K1049 IonicContact OD2-NZ 3.34Å; D971-K1049 PolarHBondContact OD2-NZ 3.42Å; D971-L1050 HydrophobicContact CB-CD2 4.34Å
972	A	87.6	Confident	87.2	Confident	40 Å²	40	42.5 Å²	42.5	33%	0.331	20%	0.202	S	C	.	.	H	α-helix	trans	-61.7	-35.6	177.5	0	0	0	0	0	112.7	W968 F976	W968-A972 VanDerWaalsContact O-CB 3.26Å; W968-A972 WeakPolarHBondContact O-CB 3.45Å; W968-A972 PolarHBondContact O-N 3.35Å; A972-F976 WeakPolarHBondContact O-CB 3.42Å; A972-F976 PolarHBondContact O-N 3.24Å
973	L	88.6	Confident	87.1	Confident	1 Å²	1	43 Å²	43	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-75.5	-35	178.1	-177.6	59.1	0	0	0	112.8	Y932 V933 M936 I940 K969 L970 D971 F976 V977 L995 M998	Y932-L973 HydrophobicContact CD1-CD1 4.02Å; Y932-L973 HydrophobicContact CE1-CD1 3.54Å; V933-L973 HydrophobicContact CG2-CD1 4.49Å; M936-L973 HydrophobicContact CB-CD1 4.32Å; M936-L973 HydrophobicContact CB-CD2 3.75Å; M936-L973 HydrophobicContact CG-CD1 4.31Å; I940-L973 HydrophobicContact CD1-CD2 4.32Å; K969-L973 VanDerWaalsContact O-CB 3.3Å; K969-L973 WeakPolarHBondContact O-CB 3.49Å; K969-L973 PolarHBondContact O-N 2.94Å; L970-L973 PolarHBondContact O-N 2.97Å; D971-L973 VanDerWaalsContact C-N 3.29Å; D971-L973 PolarHBondContact O-N 3.11Å; L973-F976 HydrophobicContact CD1-CD1 4.29Å; L973-V977 PolarHBondContact O-N 3.47Å; L973-L995 HydrophobicContact CD2-CD2 3.84Å; L973-L995 HydrophobicContact CG-CD2 3.79Å; L973-M998 HydrophobicContact CD2-CE 3.51Å; L973-M998 HydrophobicContact CD2-SD 4.47Å
974	Q	85.5	Confident	86.9	Confident	42 Å²	42	47.2 Å²	47.2	20%	0.196	23%	0.226	C	C	.	.	H	α-helix	trans	-66.3	-44.8	171.1	-72.8	-171.7	-3.2	0	0	111.5	L970 D971 F976 V977 F978 L995 L1050	L970-Q974 WeakPolarHBondContact O-CG 3.43Å; L970-Q974 PolarHBondContact O-N 3.19Å; D971-Q974 PolarHBondContact O-N 3.48Å; Q974-F976 PolarHBondContact O-N 2.82Å; Q974-V977 PolarHBondContact O-N 3.03Å; Q974-F978 WeakPolarHBondContact O-CB 3.47Å; Q974-F978 PolarHBondContact O-N 3.44Å; Q974-L995 HydrophobicContact CG-CB 4.46Å; Q974-L995 HydrophobicContact CG-CD1 4.22Å; Q974-L1050 PolarHBondContact NE2-O 3.44Å
975	M	86.3	Confident	86.7	Confident	90 Å²	90	53.4 Å²	53.4	44%	0.443	26%	0.255	S	S	.	.	H	α-helix	trans	-60	-44.1	173.8	-72	-55.5	-47.1	0	0	112	D971 V977 F978 D979	D971-M975 WeakPolarHBondContact O-CG 3.38Å; D971-M975 PolarHBondContact O-N 3.3Å; M975-V977 PolarHBondContact O-N 2.96Å; M975-F978 HydrophobicContact CE-CD1 4.44Å; M975-F978 WeakPolarHBondContact O-CB 3.47Å; M975-F978 PolarHBondContact O-N 3.01Å; M975-D979 WeakPolarHBondContact O-CB 3.38Å; M975-D979 VanDerWaalsContact O-CG 3.26Å; M975-D979 PolarHBondContact O-N 2.81Å
976	F	88.8	Confident	86.6	Confident	33 Å²	33	59.5 Å²	59.5	15%	0.145	28%	0.281	C	S	.	.	H	α-helix	trans	-55.2	-51	176.2	168.3	-99.5	0	0	0	112.6	F896 Y932 A972 L973 Q974 F978 D979 L980	F896-F976 HydrophobicContact CB-CE2 4.09Å; F896-F976 HydrophobicContact CB-CZ 4.48Å; F896-F976 HydrophobicContact CD1-CE2 4.5Å; F896-F976 HydrophobicContact CD1-CZ 4.05Å; F896-F976 AromaticContact CD2-CE2 3.53Å; F896-F976 HydrophobicContact CD2-CE2 3.53Å; F896-F976 AromaticContact CD2-CZ 3.47Å; F896-F976 HydrophobicContact CD2-CZ 3.47Å; F896-F976 VanDerWaalsContact CD2-CZ 3.47Å; F896-F976 HydrophobicContact CE1-CZ 4.1Å; F896-F976 HydrophobicContact CE2-CE1 4.45Å; F896-F976 HydrophobicContact CE2-CE2 4.01Å; F896-F976 AromaticContact CE2-CZ 3.49Å; F896-F976 HydrophobicContact CE2-CZ 3.49Å; F896-F976 VanDerWaalsContact CE2-CZ 3.49Å; F896-F976 AromaticContact CG-CE2 3.82Å; F896-F976 HydrophobicContact CG-CE2 3.82Å; F896-F976 AromaticContact CG-CZ 3.76Å; F896-F976 HydrophobicContact CG-CZ 3.76Å; F896-F976 AromaticContact CZ-CZ 3.83Å; F896-F976 HydrophobicContact CZ-CZ 3.83Å; Y932-F976 AromaticContact CD1-CD1 3.79Å; Y932-F976 HydrophobicContact CD1-CD1 3.79Å; Y932-F976 AromaticContact CD1-CE1 3.41Å; Y932-F976 HydrophobicContact CD1-CE1 3.41Å; Y932-F976 VanDerWaalsContact CD1-CE1 3.41Å; Y932-F976 HydrophobicContact CD1-CZ 4Å; Y932-F976 AromaticContact CE1-CD1 3.5Å; Y932-F976 HydrophobicContact CE1-CD1 3.5Å; Y932-F976 VanDerWaalsContact CE1-CD1 3.5Å; Y932-F976 HydrophobicContact CE1-CD2 4.49Å; Y932-F976 AromaticContact CE1-CE1 3.58Å; Y932-F976 HydrophobicContact CE1-CE1 3.58Å; Y932-F976 AromaticContact CE1-CG 4Å; Y932-F976 HydrophobicContact CE1-CG 4Å; Y932-F976 HydrophobicContact CE1-CZ 4.13Å; Y932-F976 HydrophobicContact CG-CE1 4.43Å; A972-F976 WeakPolarHBondContact O-CB 3.42Å; A972-F976 PolarHBondContact O-N 3.24Å; L973-F976 HydrophobicContact CD1-CD1 4.29Å; Q974-F976 PolarHBondContact O-N 2.82Å; F976-F978 VanDerWaalsContact C-N 3.33Å; F976-F978 PolarHBondContact O-N 3.39Å; F976-D979 PolarHBondContact O-N 3.27Å; F976-L980 HydrophobicContact CD1-CD1 4.42Å; F976-L980 HydrophobicContact CE1-CD1 3.73Å; F976-L980 HydrophobicContact CE1-CG 4.29Å; F976-L980 HydrophobicContact CE2-CD2 4.19Å; F976-L980 HydrophobicContact CE2-CG 4.37Å; F976-L980 HydrophobicContact CZ-CD1 3.81Å; F976-L980 HydrophobicContact CZ-CD2 4.05Å; F976-L980 HydrophobicContact CZ-CG 4.08Å; F976-L980 WeakPolarHBondContact O-CG 3.3Å; F976-L980 PolarHBondContact O-N 2.69Å; F976-L980 VanDerWaalsContact O-N 3.1Å
977	V	86.6	Confident	86.5	Confident	19 Å²	19	61 Å²	61	12%	0.115	29%	0.288	C	S	.	.	H	α-helix	trans	-68.9	-32.2	-179.5	170.8	0	0	0	0	112.2	V933 L973 Q974 M975 L991 L995	V933-V977 HydrophobicContact CG2-CG2 4.46Å; L973-V977 PolarHBondContact O-N 3.47Å; Q974-V977 PolarHBondContact O-N 3.03Å; M975-V977 PolarHBondContact O-N 2.96Å; V977-L991 HydrophobicContact CG1-CB 3.98Å; V977-L991 HydrophobicContact CG1-CD1 4.09Å; V977-L995 HydrophobicContact CB-CD1 3.7Å; V977-L995 HydrophobicContact CG1-CD1 4.08Å; V977-L995 HydrophobicContact CG2-CD1 3.7Å
978	F	85.2	Confident	86.4	Confident	138 Å²	138	61.9 Å²	61.9	61%	0.605	30%	0.298	S	S	*	.	H	α-helix	trans	-63.3	-48.9	171.7	-175.8	-93.8	0	0	0	111.4	Q974 M975 F976 L980 H981	Q974-F978 WeakPolarHBondContact O-CB 3.47Å; Q974-F978 PolarHBondContact O-N 3.44Å; M975-F978 HydrophobicContact CE-CD1 4.44Å; M975-F978 WeakPolarHBondContact O-CB 3.47Å; M975-F978 PolarHBondContact O-N 3.01Å; F976-F978 VanDerWaalsContact C-N 3.33Å; F976-F978 PolarHBondContact O-N 3.39Å; F978-L980 VanDerWaalsContact C-N 3.26Å; F978-L980 PolarHBondContact O-N 3.08Å; F978-H981 PolarHBondContact O-N 3.29Å
979	D	86.2	Confident	86.1	Confident	66 Å²	66	57.9 Å²	57.9	35%	0.353	29%	0.286	S	S	.	.	H	α-helix	trans	-68.3	-20.2	-177.8	-69.4	-23.8	0	0	0	113.3	Q900 M975 F976 H981	Q900-D979 PolarHBondContact NE2-O 3.35Å; M975-D979 WeakPolarHBondContact O-CB 3.38Å; M975-D979 VanDerWaalsContact O-CG 3.26Å; M975-D979 PolarHBondContact O-N 2.81Å; F976-D979 PolarHBondContact O-N 3.27Å; D979-H981 PolarHBondContact O-N 3.03Å; D979-H981 PolarHBondContact O-ND1 3Å
980	L	86.8	Confident	86	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.005	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-25.9	168.1	-72.2	178.1	0	0	0	112.9	F896 F899 Q900 N903 V929 F976 F978 W982	F896-L980 HydrophobicContact CD1-CD2 4.28Å; F899-L980 HydrophobicContact CD1-CD2 3.84Å; F899-L980 HydrophobicContact CE1-CB 4.34Å; F899-L980 HydrophobicContact CE1-CD2 4.2Å; F899-L980 WeakPolarHBondContact CE1-O 3.26Å; Q900-L980 HydrophobicContact CG-CD2 4.18Å; N903-L980 PolarHBondContact ND2-O 3.17Å; V929-L980 HydrophobicContact CB-CD1 4.49Å; V929-L980 HydrophobicContact CG1-CD1 3.92Å; V929-L980 HydrophobicContact CG2-CD1 3.65Å; F976-L980 HydrophobicContact CD1-CD1 4.42Å; F976-L980 HydrophobicContact CE1-CD1 3.73Å; F976-L980 HydrophobicContact CE1-CG 4.29Å; F976-L980 HydrophobicContact CE2-CD2 4.19Å; F976-L980 HydrophobicContact CE2-CG 4.37Å; F976-L980 HydrophobicContact CZ-CD1 3.81Å; F976-L980 HydrophobicContact CZ-CD2 4.05Å; F976-L980 HydrophobicContact CZ-CG 4.08Å; F976-L980 WeakPolarHBondContact O-CG 3.3Å; F976-L980 PolarHBondContact O-N 2.69Å; F976-L980 VanDerWaalsContact O-N 3.1Å; F978-L980 VanDerWaalsContact C-N 3.26Å; F978-L980 PolarHBondContact O-N 3.08Å; L980-W982 PolarHBondContact O-N 3.18Å
981	H	85.3	Confident	85.9	Confident	57 Å²	57	60.5 Å²	60.5	26%	0.264	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	49.2	178	-67.1	97.9	0	0	0	114.4	N903 R907 F978 D979	N903-H981 PolarHBondContact ND2-O 2.91Å; R907-H981 PolarHBondContact NH1-CD2 3.39Å; R907-H981 VanDerWaalsContact NH1-CG 3.28Å; F978-H981 PolarHBondContact O-N 3.29Å; D979-H981 PolarHBondContact O-N 3.03Å; D979-H981 PolarHBondContact O-ND1 3Å
982	W	88.1	Confident	85.9	Confident	22 Å²	22	62.3 Å²	62.3	8%	0.083	31%	0.306	C	S	.	.			trans	-57.2	131.9	-167.3	-162.5	-86.2	0	0	0	113.9	F899 Q922 F925 V926 V929 L980 F987 A988	F899-W982 AromaticContact CE1-CE3 3.92Å; F899-W982 HydrophobicContact CE1-CE3 3.92Å; F899-W982 AromaticContact CE1-CZ3 3.9Å; F899-W982 HydrophobicContact CE1-CZ3 3.9Å; F899-W982 HydrophobicContact CE2-CE3 4.4Å; F899-W982 AromaticContact CE2-CH2 3.98Å; F899-W982 HydrophobicContact CE2-CH2 3.98Å; F899-W982 AromaticContact CE2-CZ3 3.76Å; F899-W982 HydrophobicContact CE2-CZ3 3.76Å; F899-W982 HydrophobicContact CZ-CD2 4.29Å; F899-W982 AromaticContact CZ-CE3 3.53Å; F899-W982 HydrophobicContact CZ-CE3 3.53Å; F899-W982 AromaticContact CZ-CH2 3.9Å; F899-W982 HydrophobicContact CZ-CH2 3.9Å; F899-W982 AromaticContact CZ-CZ3 3.31Å; F899-W982 HydrophobicContact CZ-CZ3 3.31Å; Q922-W982 HydrophobicContact CB-CH2 4.3Å; Q922-W982 HydrophobicContact CB-CZ2 3.74Å; Q922-W982 HydrophobicContact CG-CH2 4.31Å; Q922-W982 HydrophobicContact CG-CZ2 3.72Å; F925-W982 HydrophobicContact CB-CH2 4.18Å; F925-W982 HydrophobicContact CB-CZ3 4.31Å; V926-W982 HydrophobicContact CG2-CH2 3.72Å; V926-W982 HydrophobicContact CG2-CZ2 3.4Å; V926-W982 VanDerWaalsContact CG2-CZ2 3.4Å; V929-W982 HydrophobicContact CG2-CZ3 4.11Å; L980-W982 PolarHBondContact O-N 3.18Å; W982-F987 AromaticContact CD1-CD1 3.7Å; W982-F987 AromaticContact CD2-CD1 3.76Å; W982-F987 HydrophobicContact CD2-CD1 3.76Å; W982-F987 HydrophobicContact CD2-CE1 4.04Å; W982-F987 AromaticContact CE2-CD1 3.52Å; W982-F987 AromaticContact CE2-CE1 3.92Å; W982-F987 HydrophobicContact CE3-CD1 4.47Å; W982-F987 HydrophobicContact CE3-CE1 4.31Å; W982-F987 AromaticContact CG-CD1 3.92Å; W982-F987 HydrophobicContact CG-CD1 3.92Å; W982-F987 HydrophobicContact CH2-CE1 4.41Å; W982-F987 HydrophobicContact CZ2-CD1 4.09Å; W982-F987 HydrophobicContact CZ2-CE1 4.13Å; W982-F987 HydrophobicContact CZ3-CE1 4.49Å; W982-F987 AromaticContact NE1-CD1 3.45Å; W982-A988 HydrophobicContact CB-CB 4.04Å
983	P	83.3	Confident	85.7	Confident	25 Å²	25	63.2 Å²	63.2	16%	0.162	30%	0.303	C	S	.	.	S	Bend	trans	-70.1	-43.6	-173.2	-19.8	32	0	0	0	114.9	N903 H918 Q922 Q985	N903-P983 WeakPolarHBondContact OD1-CG 3.3Å; H918-P983 WeakPolarHBondContact NE2-CG 3.28Å; Q922-P983 HydrophobicContact CG-CG 4.2Å; P983-Q985 PolarHBondContact O-N 2.95Å
984	E	84.6	Confident	85.6	Confident	89 Å²	89	66.1 Å²	66.1	42%	0.416	31%	0.314	S	S	.	.			trans	-75.7	110	-179.9	-76.1	178	163.6	0	0	111.3	E986 F987 A988	E984-E986 PolarHBondContact O-N 3.17Å; E984-F987 HydrophobicContact CB-CB 4.4Å; E984-F987 PolarHBondContact O-N 3.06Å; E984-A988 WeakPolarHBondContact O-CB 3.37Å; E984-A988 PolarHBondContact O-N 3.49Å
985	Q	81.9	Confident	85.7	Confident	171 Å²	171	64.4 Å²	64.4	80%	0.799	31%	0.306	S	S	*	.	H	α-helix	trans	-57.6	-34.5	-177.4	-67.2	-177.2	-12.9	0	0	113.3	P983 H989	P983-Q985 PolarHBondContact O-N 2.95Å; Q985-H989 WeakPolarHBondContact O-CB 3.36Å; Q985-H989 PolarHBondContact O-N 3.41Å
986	E	85	Confident	85.5	Confident	177 Å²	177	61.6 Å²	61.6	83%	0.827	29%	0.291	S	S	*	.	H	α-helix	trans	-65.3	-46.7	178.4	-62.4	-173.6	177.5	0	0	111.8	E984 H990	E984-E986 PolarHBondContact O-N 3.17Å; E986-H990 VanDerWaalsContact O-CB 3.32Å; E986-H990 WeakPolarHBondContact O-CB 3.47Å; E986-H990 PolarHBondContact O-N 2.86Å
987	F	86.9	Confident	85.3	Confident	34 Å²	34	63.3 Å²	63.3	15%	0.149	30%	0.302	C	S	.	.	H	α-helix	trans	-73.3	-37.8	178.1	-173.8	-104.4	0	0	0	112.2	V926 V930 W982 E984 H989 H990 L991	V926-F987 HydrophobicContact CB-CZ 4.34Å; V926-F987 HydrophobicContact CG1-CE2 4Å; V926-F987 HydrophobicContact CG1-CZ 3.9Å; V926-F987 HydrophobicContact CG2-CD1 4.49Å; V926-F987 HydrophobicContact CG2-CE1 4.07Å; V926-F987 HydrophobicContact CG2-CE2 4.49Å; V926-F987 HydrophobicContact CG2-CZ 4.09Å; V930-F987 HydrophobicContact CG2-CE2 4.15Å; V930-F987 HydrophobicContact CG2-CZ 3.92Å; W982-F987 AromaticContact CD1-CD1 3.7Å; W982-F987 AromaticContact CD2-CD1 3.76Å; W982-F987 HydrophobicContact CD2-CD1 3.76Å; W982-F987 HydrophobicContact CD2-CE1 4.04Å; W982-F987 AromaticContact CE2-CD1 3.52Å; W982-F987 AromaticContact CE2-CE1 3.92Å; W982-F987 HydrophobicContact CE3-CD1 4.47Å; W982-F987 HydrophobicContact CE3-CE1 4.31Å; W982-F987 AromaticContact CG-CD1 3.92Å; W982-F987 HydrophobicContact CG-CD1 3.92Å; W982-F987 HydrophobicContact CH2-CE1 4.41Å; W982-F987 HydrophobicContact CZ2-CD1 4.09Å; W982-F987 HydrophobicContact CZ2-CE1 4.13Å; W982-F987 HydrophobicContact CZ3-CE1 4.49Å; W982-F987 AromaticContact NE1-CD1 3.45Å; E984-F987 HydrophobicContact CB-CB 4.4Å; E984-F987 PolarHBondContact O-N 3.06Å; F987-H989 PolarHBondContact O-N 2.96Å; F987-H990 PolarHBondContact O-N 2.65Å; F987-L991 HydrophobicContact CD1-CD1 3.89Å; F987-L991 HydrophobicContact CD1-CG 4.22Å; F987-L991 HydrophobicContact CE1-CD1 3.46Å; F987-L991 VanDerWaalsContact CE1-CD1 3.46Å; F987-L991 HydrophobicContact CE1-CD2 4.39Å; F987-L991 HydrophobicContact CE1-CG 3.91Å; F987-L991 HydrophobicContact CZ-CD1 4.03Å; F987-L991 HydrophobicContact CZ-CD2 4.11Å; F987-L991 HydrophobicContact CZ-CG 4.08Å; F987-L991 WeakPolarHBondContact O-CG 3.22Å; F987-L991 PolarHBondContact O-N 3.44Å
988	A	85.4	Confident	85.3	Confident	30 Å²	30	62.9 Å²	62.9	25%	0.248	30%	0.298	C	S	.	.	H	α-helix	trans	-57.8	-48.6	173.7	0	0	0	0	0	111.4	W982 E984 L991 E992	W982-A988 HydrophobicContact CB-CB 4.04Å; E984-A988 WeakPolarHBondContact O-CB 3.37Å; E984-A988 PolarHBondContact O-N 3.49Å; A988-L991 PolarHBondContact O-N 2.64Å; A988-E992 WeakPolarHBondContact O-CB 3.18Å; A988-E992 PolarHBondContact O-N 2.92Å
989	H	84.2	Confident	85.4	Confident	93 Å²	93	56.3 Å²	56.3	43%	0.431	27%	0.27	S	S	.	.	H	α-helix	trans	-68.4	-38.2	178.3	-174.9	54.7	0	0	0	112.3	Q985 F987 E992 Q993	Q985-H989 WeakPolarHBondContact O-CB 3.36Å; Q985-H989 PolarHBondContact O-N 3.41Å; F987-H989 PolarHBondContact O-N 2.96Å; H989-E992 IonicContact ND1-OE2 3.46Å; H989-E992 PolarHBondContact O-N 2.81Å; H989-Q993 VanDerWaalsContact O-CB 3.23Å; H989-Q993 WeakPolarHBondContact O-CB 3.29Å; H989-Q993 PolarHBondContact O-N 3.36Å
990	H	86.9	Confident	85.4	Confident	94 Å²	94	53.7 Å²	53.7	44%	0.435	26%	0.256	S	S	.	.	H	α-helix	trans	-61.3	-42.4	173.3	171.6	-102.5	0	0	0	112.6	E986 F987 R994	E986-H990 VanDerWaalsContact O-CB 3.32Å; E986-H990 WeakPolarHBondContact O-CB 3.47Å; E986-H990 PolarHBondContact O-N 2.86Å; F987-H990 PolarHBondContact O-N 2.65Å; H990-R994 WeakPolarHBondContact O-CB 3.1Å; H990-R994 PolarHBondContact O-N 2.96Å
991	L	86.4	Confident	85.3	Confident	2 Å²	2	58.3 Å²	58.3	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-63.6	-46.4	173.4	-73.5	179.8	0	0	0	111.6	V929 V977 F987 A988 R994 L995	V929-L991 HydrophobicContact CG1-CD1 3.73Å; V929-L991 HydrophobicContact CG1-CD2 4.31Å; V977-L991 HydrophobicContact CG1-CB 3.98Å; V977-L991 HydrophobicContact CG1-CD1 4.09Å; F987-L991 HydrophobicContact CD1-CD1 3.89Å; F987-L991 HydrophobicContact CD1-CG 4.22Å; F987-L991 HydrophobicContact CE1-CD1 3.46Å; F987-L991 VanDerWaalsContact CE1-CD1 3.46Å; F987-L991 HydrophobicContact CE1-CD2 4.39Å; F987-L991 HydrophobicContact CE1-CG 3.91Å; F987-L991 HydrophobicContact CZ-CD1 4.03Å; F987-L991 HydrophobicContact CZ-CD2 4.11Å; F987-L991 HydrophobicContact CZ-CG 4.08Å; F987-L991 WeakPolarHBondContact O-CG 3.22Å; F987-L991 PolarHBondContact O-N 3.44Å; A988-L991 PolarHBondContact O-N 2.64Å; L991-R994 PolarHBondContact O-N 3.32Å; L991-L995 WeakPolarHBondContact O-CB 3.32Å; L991-L995 WeakPolarHBondContact O-CG 3.38Å; L991-L995 PolarHBondContact O-N 2.97Å
992	E	84.3	Confident	85.5	Confident	85 Å²	85	56.3 Å²	56.3	40%	0.397	27%	0.272	S	S	.	.	H	α-helix	trans	-58.7	-48.7	177.5	-175.8	-171.6	-164.8	0	0	111.8	A988 H989 R994 L995 K996	A988-E992 WeakPolarHBondContact O-CB 3.18Å; A988-E992 PolarHBondContact O-N 2.92Å; H989-E992 IonicContact ND1-OE2 3.46Å; H989-E992 PolarHBondContact O-N 2.81Å; E992-R994 PolarHBondContact O-N 3.02Å; E992-L995 PolarHBondContact O-N 3.34Å; E992-K996 HydrophobicContact CG-CD 4.19Å; E992-K996 WeakPolarHBondContact O-CG 3.34Å; E992-K996 PolarHBondContact O-N 2.74Å; E992-K996 WeakPolarHBondContact OE1-CE 3.4Å; E992-K996 IonicContact OE1-NZ 3.9Å; E992-K996 PolarHBondContact OE1-NZ 3.22Å
993	Q	83.6	Confident	85.6	Confident	59 Å²	59	55.3 Å²	55.3	28%	0.276	27%	0.268	S	S	.	.	H	α-helix	trans	-59.9	-45.9	177.3	-170.3	-169.1	38.7	0	0	110.8	H989 K996 L997 E1058	H989-Q993 VanDerWaalsContact O-CB 3.23Å; H989-Q993 WeakPolarHBondContact O-CB 3.29Å; H989-Q993 PolarHBondContact O-N 3.36Å; Q993-K996 PolarHBondContact O-N 3.29Å; Q993-L997 HydrophobicContact CG-CD1 4.36Å; Q993-L997 WeakPolarHBondContact O-CG 3.48Å; Q993-L997 PolarHBondContact O-N 2.91Å; Q993-E1058 PolarHBondContact NE2-OE1 2.97Å
994	R	86.8	Confident	85.8	Confident	62 Å²	62	57 Å²	57	23%	0.234	27%	0.274	C	S	.	.	H	α-helix	trans	-61.4	-45.6	176.2	-177.2	177.5	176.7	-174.3	-0.3	112	D934 E937 H990 L991 E992 K996 L997 M998	D934-R994 IonicContact OD1-CZ 2.69Å; D934-R994 IonicContact OD1-NH1 3.87Å; D934-R994 PolarHBondContact OD1-NH1 2.94Å; D934-R994 IonicContact OD1-NH2 3.42Å; D934-R994 PolarHBondContact OD1-NH2 2.92Å; E937-R994 IonicContact OE2-CZ 2.79Å; E937-R994 IonicContact OE2-NE 3.53Å; E937-R994 PolarHBondContact OE2-NE 2.7Å; E937-R994 IonicContact OE2-NH2 2.62Å; E937-R994 PolarHBondContact OE2-NH2 3.15Å; H990-R994 WeakPolarHBondContact O-CB 3.1Å; H990-R994 PolarHBondContact O-N 2.96Å; L991-R994 PolarHBondContact O-N 3.32Å; E992-R994 PolarHBondContact O-N 3.02Å; R994-K996 VanDerWaalsContact C-N 3.3Å; R994-K996 PolarHBondContact O-N 2.95Å; R994-L997 PolarHBondContact O-N 3.11Å; R994-M998 WeakPolarHBondContact O-CB 3.29Å; R994-M998 PolarHBondContact O-N 2.84Å
995	L	86.2	Confident	86	Confident	6 Å²	6	53.8 Å²	53.8	3%	0.031	26%	0.263	C	S	.	.	H	α-helix	trans	-62.1	-37.1	178.4	-74.3	-174.3	0	0	0	112.3	V933 L973 Q974 V977 L991 E992 M998 A999	V933-L995 HydrophobicContact CG1-CD2 4.17Å; V933-L995 HydrophobicContact CG2-CD2 4.48Å; L973-L995 HydrophobicContact CD2-CD2 3.84Å; L973-L995 HydrophobicContact CG-CD2 3.79Å; Q974-L995 HydrophobicContact CG-CB 4.46Å; Q974-L995 HydrophobicContact CG-CD1 4.22Å; V977-L995 HydrophobicContact CB-CD1 3.7Å; V977-L995 HydrophobicContact CG1-CD1 4.08Å; V977-L995 HydrophobicContact CG2-CD1 3.7Å; L991-L995 WeakPolarHBondContact O-CB 3.32Å; L991-L995 WeakPolarHBondContact O-CG 3.38Å; L991-L995 PolarHBondContact O-N 2.97Å; E992-L995 PolarHBondContact O-N 3.34Å; L995-M998 HydrophobicContact CD2-CE 3.56Å; L995-A999 VanDerWaalsContact O-CB 3.29Å; L995-A999 WeakPolarHBondContact O-CB 3.29Å; L995-A999 PolarHBondContact O-N 2.77Å
996	K	82.5	Confident	86.4	Confident	31 Å²	31	45.7 Å²	45.7	14%	0.135	23%	0.225	C	C	.	.	H	α-helix	trans	-72.8	-39.4	177.8	-69.1	175.3	-174.3	179.2	0	112.3	E992 Q993 R994 A999 S1000 A1052 L1053	E992-K996 HydrophobicContact CG-CD 4.19Å; E992-K996 WeakPolarHBondContact O-CG 3.34Å; E992-K996 PolarHBondContact O-N 2.74Å; E992-K996 WeakPolarHBondContact OE1-CE 3.4Å; E992-K996 IonicContact OE1-NZ 3.9Å; E992-K996 PolarHBondContact OE1-NZ 3.22Å; Q993-K996 PolarHBondContact O-N 3.29Å; R994-K996 VanDerWaalsContact C-N 3.3Å; R994-K996 PolarHBondContact O-N 2.95Å; K996-A999 PolarHBondContact O-N 3.21Å; K996-S1000 VanDerWaalsContact O-CB 3.29Å; K996-S1000 WeakPolarHBondContact O-CB 3.12Å; K996-S1000 PolarHBondContact O-N 2.96Å; K996-A1052 VanDerWaalsContact CE-O 3.3Å; K996-A1052 WeakPolarHBondContact CE-O 3.35Å; K996-A1052 PolarHBondContact NZ-O 3.33Å; K996-L1053 HydrophobicContact CD-CD2 3.58Å; K996-L1053 HydrophobicContact CD-CG 3.87Å
997	L	84.1	Confident	86.6	Confident	68 Å²	68	37.2 Å²	37.2	36%	0.356	19%	0.186	S	C	.	.	H	α-helix	trans	-62.7	-44.9	171.9	-72.2	171.2	0	0	0	111.7	Q993 R994 S1000 D1001 Y1061	Q993-L997 HydrophobicContact CG-CD1 4.36Å; Q993-L997 WeakPolarHBondContact O-CG 3.48Å; Q993-L997 PolarHBondContact O-N 2.91Å; R994-L997 PolarHBondContact O-N 3.11Å; L997-S1000 WeakPolarHBondContact O-CB 3.31Å; L997-S1000 PolarHBondContact O-N 3.44Å; L997-D1001 PolarHBondContact O-N 2.88Å; L997-Y1061 HydrophobicContact CD2-CD1 4.49Å; L997-Y1061 HydrophobicContact CD2-CD2 4.41Å; L997-Y1061 HydrophobicContact CD2-CE2 4.45Å; L997-Y1061 HydrophobicContact CD2-CG 4.42Å
998	M	87.3	Confident	86.8	Confident	10 Å²	10	40.4 Å²	40.4	5%	0.049	20%	0.199	C	C	.	.	H	α-helix	trans	-62.5	-47.2	174.3	174.7	-170.1	70.7	0	0	111.6	E937 L970 L973 R994 L995 S1000 D1001 M1002	E937-M998 HydrophobicContact CB-CG 4.47Å; E937-M998 HydrophobicContact CB-SD 3.52Å; E937-M998 VanDerWaalsContact CB-SD 3.52Å; E937-M998 HydrophobicContact CG-CG 3.98Å; E937-M998 HydrophobicContact CG-SD 3.7Å; L970-M998 HydrophobicContact CD2-CE 4.01Å; L973-M998 HydrophobicContact CD2-CE 3.51Å; L973-M998 HydrophobicContact CD2-SD 4.47Å; R994-M998 WeakPolarHBondContact O-CB 3.29Å; R994-M998 PolarHBondContact O-N 2.84Å; L995-M998 HydrophobicContact CD2-CE 3.56Å; M998-S1000 PolarHBondContact O-N 2.62Å; M998-D1001 PolarHBondContact O-N 2.84Å; M998-M1002 HydrophobicContact CG-CE 3.93Å; M998-M1002 HydrophobicContact CG-CG 4.21Å; M998-M1002 WeakPolarHBondContact O-CB 3.4Å; M998-M1002 WeakPolarHBondContact O-CG 3.37Å; M998-M1002 PolarHBondContact O-N 2.82Å
999	A	87.2	Confident	87	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-57.8	-40.5	176	0	0	0	0	0	111.6	L970 L995 K996 L1003 L1050	L970-A999 HydrophobicContact CD1-CB 4.31Å; L970-A999 HydrophobicContact CD2-CB 4.17Å; L995-A999 VanDerWaalsContact O-CB 3.29Å; L995-A999 WeakPolarHBondContact O-CB 3.29Å; L995-A999 PolarHBondContact O-N 2.77Å; K996-A999 PolarHBondContact O-N 3.21Å; A999-L1003 VanDerWaalsContact O-CB 3.31Å; A999-L1003 WeakPolarHBondContact O-CB 3.3Å; A999-L1003 WeakPolarHBondContact O-CD1 3.38Å; A999-L1003 WeakPolarHBondContact O-CG 3.41Å; A999-L1003 PolarHBondContact O-N 3.04Å; A999-L1050 HydrophobicContact CB-CB 4.32Å
1000	S	85.8	Confident	87.2	Confident	11 Å²	11	37.6 Å²	37.6	8%	0.077	18%	0.179	C	C	.	.	H	α-helix	trans	-53.6	-58.4	171.2	145.6	0	0	0	0	112.1	K996 L997 M998 M1002 L1003 E1004 I1065	K996-S1000 VanDerWaalsContact O-CB 3.29Å; K996-S1000 WeakPolarHBondContact O-CB 3.12Å; K996-S1000 PolarHBondContact O-N 2.96Å; L997-S1000 WeakPolarHBondContact O-CB 3.31Å; L997-S1000 PolarHBondContact O-N 3.44Å; M998-S1000 PolarHBondContact O-N 2.62Å; S1000-M1002 VanDerWaalsContact C-N 3.3Å; S1000-M1002 PolarHBondContact O-N 3.33Å; S1000-L1003 WeakPolarHBondContact O-CB 3.38Å; S1000-L1003 PolarHBondContact O-N 2.96Å; S1000-L1003 VanDerWaalsContact O-N 3.15Å; S1000-E1004 PolarHBondContact O-N 2.94Å; S1000-I1065 VanDerWaalsContact C-CD1 3.49Å; S1000-I1065 VanDerWaalsContact CB-CD1 3.41Å; S1000-I1065 WeakPolarHBondContact O-CD1 3.28Å; S1000-I1065 VanDerWaalsContact OG-CD1 3.27Å; S1000-I1065 WeakPolarHBondContact OG-CD1 3.41Å
1001	D	86.5	Confident	87.4	Confident	98 Å²	98	36.1 Å²	36.1	52%	0.524	17%	0.169	S	C	.	.	H	α-helix	trans	-65.5	-36.2	-174.3	-72.4	11.4	0	0	0	111.6	L997 M998 A1005	L997-D1001 PolarHBondContact O-N 2.88Å; M998-D1001 PolarHBondContact O-N 2.84Å; D1001-A1005 WeakPolarHBondContact O-CB 3.42Å; D1001-A1005 PolarHBondContact O-N 3.41Å
1002	M	89.1	Confident	87.5	Confident	16 Å²	16	40.2 Å²	40.2	8%	0.079	19%	0.194	C	C	.	.	H	α-helix	trans	-68.3	-38.2	175	-62.9	-63.6	173.3	0	0	112.5	E937 I940 A941 I944 L966 L970 M998 S1000 C1006	E937-M1002 HydrophobicContact CG-CE 4.06Å; E937-M1002 WeakPolarHBondContact O-CE 3.46Å; I940-M1002 HydrophobicContact CB-CE 4.42Å; I940-M1002 HydrophobicContact CB-SD 4.46Å; I940-M1002 HydrophobicContact CG2-CE 4.31Å; I940-M1002 HydrophobicContact CG2-CG 3.96Å; I940-M1002 HydrophobicContact CG2-SD 3.78Å; A941-M1002 HydrophobicContact CB-CE 4.01Å; A941-M1002 HydrophobicContact CB-SD 4.38Å; I944-M1002 HydrophobicContact CD1-CB 3.77Å; I944-M1002 HydrophobicContact CD1-CG 4.17Å; I944-M1002 HydrophobicContact CD1-SD 3.56Å; I944-M1002 VanDerWaalsContact CD1-SD 3.56Å; L966-M1002 HydrophobicContact CD1-CB 4.13Å; L970-M1002 HydrophobicContact CD1-CB 4.27Å; M998-M1002 HydrophobicContact CG-CE 3.93Å; M998-M1002 HydrophobicContact CG-CG 4.21Å; M998-M1002 WeakPolarHBondContact O-CB 3.4Å; M998-M1002 WeakPolarHBondContact O-CG 3.37Å; M998-M1002 PolarHBondContact O-N 2.82Å; S1000-M1002 VanDerWaalsContact C-N 3.3Å; S1000-M1002 PolarHBondContact O-N 3.33Å; M1002-C1006 WeakPolarHBondContact O-CB 3.34Å; M1002-C1006 PolarHBondContact O-N 3.1Å
1003	L	88.6	Confident	87.7	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.5	-47.2	173.1	-84.2	162.4	0	0	0	111.4	F967 A999 S1000 A1005 C1006 V1007 A1043	F967-L1003 HydrophobicContact CD1-CD2 4.38Å; F967-L1003 HydrophobicContact CE1-CD2 3.62Å; F967-L1003 HydrophobicContact CZ-CD2 4.31Å; A999-L1003 VanDerWaalsContact O-CB 3.31Å; A999-L1003 WeakPolarHBondContact O-CB 3.3Å; A999-L1003 WeakPolarHBondContact O-CD1 3.38Å; A999-L1003 WeakPolarHBondContact O-CG 3.41Å; A999-L1003 PolarHBondContact O-N 3.04Å; S1000-L1003 WeakPolarHBondContact O-CB 3.38Å; S1000-L1003 PolarHBondContact O-N 2.96Å; S1000-L1003 VanDerWaalsContact O-N 3.15Å; L1003-A1005 VanDerWaalsContact C-N 3.29Å; L1003-A1005 PolarHBondContact O-N 3.43Å; L1003-C1006 WeakPolarHBondContact O-CB 3.46Å; L1003-C1006 PolarHBondContact O-N 3.07Å; L1003-V1007 VanDerWaalsContact O-CG2 3.29Å; L1003-V1007 WeakPolarHBondContact O-CG2 3.38Å; L1003-V1007 PolarHBondContact O-N 3Å; L1003-A1043 HydrophobicContact CD2-CB 4.07Å
1004	E	88.3	Confident	87.9	Confident	61 Å²	61	34.6 Å²	34.6	29%	0.285	17%	0.173	S	C	.	.	H	α-helix	trans	-60.5	-41.5	176.8	-157.3	-159.2	-169.1	0	0	111.2	S1000 C1006 V1007 K1008 L1068	S1000-E1004 PolarHBondContact O-N 2.94Å; E1004-C1006 PolarHBondContact O-N 2.93Å; E1004-V1007 PolarHBondContact O-N 3.1Å; E1004-K1008 VanDerWaalsContact CD-CE 3.43Å; E1004-K1008 HydrophobicContact CG-CD 4.18Å; E1004-K1008 WeakPolarHBondContact O-CB 3.32Å; E1004-K1008 WeakPolarHBondContact O-CG 3.23Å; E1004-K1008 PolarHBondContact O-N 2.83Å; E1004-K1008 WeakPolarHBondContact OE1-CE 3.17Å; E1004-K1008 IonicContact OE1-NZ 3.14Å; E1004-K1008 PolarHBondContact OE1-NZ 2.91Å; E1004-K1008 IonicContact OE2-NZ 3.59Å; E1004-K1008 PolarHBondContact OE2-NZ 2.96Å; E1004-L1068 HydrophobicContact CG-CD1 3.71Å; E1004-L1068 HydrophobicContact CG-CD2 3.88Å; E1004-L1068 HydrophobicContact CG-CG 4.45Å; E1004-L1068 WeakPolarHBondContact OE1-CD1 3.42Å
1005	A	88.9	Confident	88	Confident	22 Å²	22	34.3 Å²	34.3	18%	0.182	17%	0.174	C	C	.	.	H	α-helix	trans	-62.5	-37.3	175.2	0	0	0	0	0	113.4	I944 D1001 L1003 R1009	I944-A1005 HydrophobicContact CD1-CB 4.49Å; I944-A1005 HydrophobicContact CG2-CB 4.38Å; D1001-A1005 WeakPolarHBondContact O-CB 3.42Å; D1001-A1005 PolarHBondContact O-N 3.41Å; L1003-A1005 VanDerWaalsContact C-N 3.29Å; L1003-A1005 PolarHBondContact O-N 3.43Å; A1005-R1009 WeakPolarHBondContact O-CG 3.49Å; A1005-R1009 PolarHBondContact O-N 3.19Å; A1005-R1009 PolarHBondContact O-NH1 3.33Å
1006	C	90.1	Very high	88	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-68.1	-49.4	173.8	176.7	0	0	0	0	111.6	F948 L966 M1002 L1003 E1004 R1009 T1010	F948-C1006 HydrophobicContact CE2-CB 4.28Å; F948-C1006 HydrophobicContact CZ-CB 4.44Å; F948-C1006 VanDerWaalsContact CZ-SG 3.52Å; L966-C1006 HydrophobicContact CD2-CB 3.71Å; M1002-C1006 WeakPolarHBondContact O-CB 3.34Å; M1002-C1006 PolarHBondContact O-N 3.1Å; L1003-C1006 WeakPolarHBondContact O-CB 3.46Å; L1003-C1006 PolarHBondContact O-N 3.07Å; E1004-C1006 PolarHBondContact O-N 2.93Å; C1006-R1009 PolarHBondContact O-N 3.43Å; C1006-T1010 WeakPolarHBondContact O-CB 3.34Å; C1006-T1010 PolarHBondContact O-N 3.24Å; C1006-T1010 PolarHBondContact O-OG1 2.74Å
1007	V	90.7	Very high	88.1	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.4	-48.1	-177.8	169.7	0	0	0	0	111.4	L1003 E1004 R1009 T1010 R1011 L1040 A1043 L1068 I1069	L1003-V1007 VanDerWaalsContact O-CG2 3.29Å; L1003-V1007 WeakPolarHBondContact O-CG2 3.38Å; L1003-V1007 PolarHBondContact O-N 3Å; E1004-V1007 PolarHBondContact O-N 3.1Å; V1007-R1009 PolarHBondContact O-N 3.36Å; V1007-T1010 PolarHBondContact O-N 3.43Å; V1007-R1011 WeakPolarHBondContact O-CB 3.27Å; V1007-R1011 PolarHBondContact O-N 3.39Å; V1007-L1040 HydrophobicContact CB-CD2 3.97Å; V1007-L1040 HydrophobicContact CG1-CD2 3.75Å; V1007-L1040 HydrophobicContact CG2-CD2 3.89Å; V1007-A1043 HydrophobicContact CG2-CB 4.11Å; V1007-L1068 HydrophobicContact CB-CD2 3.95Å; V1007-L1068 HydrophobicContact CG1-CD2 3.51Å; V1007-I1069 HydrophobicContact CG1-CG1 4.42Å; V1007-I1069 HydrophobicContact CG2-CD1 4.32Å; V1007-I1069 HydrophobicContact CG2-CG1 3.73Å
1008	K	89.8	Confident	88.2	Confident	100 Å²	100	38.4 Å²	38.4	44%	0.435	19%	0.193	S	C	.	.	H	α-helix	trans	-57	-47.7	177.7	-76.8	169.3	174.1	167.6	0	112	E1004 R1011 T1012	E1004-K1008 VanDerWaalsContact CD-CE 3.43Å; E1004-K1008 HydrophobicContact CG-CD 4.18Å; E1004-K1008 WeakPolarHBondContact O-CB 3.32Å; E1004-K1008 WeakPolarHBondContact O-CG 3.23Å; E1004-K1008 PolarHBondContact O-N 2.83Å; E1004-K1008 WeakPolarHBondContact OE1-CE 3.17Å; E1004-K1008 IonicContact OE1-NZ 3.14Å; E1004-K1008 PolarHBondContact OE1-NZ 2.91Å; E1004-K1008 IonicContact OE2-NZ 3.59Å; E1004-K1008 PolarHBondContact OE2-NZ 2.96Å; K1008-R1011 PolarHBondContact O-N 2.97Å; K1008-T1012 PolarHBondContact O-N 3.42Å; K1008-T1012 VanDerWaalsContact O-N 3.08Å; K1008-T1012 PolarHBondContact O-OG1 3.5Å
1009	R	89.1	Confident	87.9	Confident	65 Å²	65	45.1 Å²	45.1	25%	0.245	22%	0.224	C	C	.	.	H	α-helix	trans	-65.7	-44	178.9	-73.7	179	-177.3	75.7	-8.8	112.2	H945 F948 A1005 C1006 V1007 R1011 T1012 A1013	H945-R1009 PolarHBondContact CD2-NH2 3.46Å; H945-R1009 PolarHBondContact CE1-NH2 2.96Å; H945-R1009 PolarHBondContact ND1-NH2 3.24Å; H945-R1009 PolarHBondContact NE2-NH2 3.43Å; F948-R1009 HydrophobicContact CB-CB 4.27Å; F948-R1009 HydrophobicContact CG-CB 4.25Å; A1005-R1009 WeakPolarHBondContact O-CG 3.49Å; A1005-R1009 PolarHBondContact O-N 3.19Å; A1005-R1009 PolarHBondContact O-NH1 3.33Å; C1006-R1009 PolarHBondContact O-N 3.43Å; V1007-R1009 PolarHBondContact O-N 3.36Å; R1009-R1011 VanDerWaalsContact C-N 3.32Å; R1009-R1011 PolarHBondContact O-N 3.42Å; R1009-T1012 PolarHBondContact O-N 2.92Å; R1009-A1013 WeakPolarHBondContact O-CB 3.15Å; R1009-A1013 PolarHBondContact O-N 3.47Å
1010	T	90.1	Very high	87.5	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.9	-42.9	178.1	-60.3	0	0	0	0	111.6	W953 C1006 V1007 A1013 F1014 M1036 V1039 L1040	W953-T1010 HydrophobicContact CH2-CG2 4.02Å; W953-T1010 HydrophobicContact CZ3-CG2 3.92Å; C1006-T1010 WeakPolarHBondContact O-CB 3.34Å; C1006-T1010 PolarHBondContact O-N 3.24Å; C1006-T1010 PolarHBondContact O-OG1 2.74Å; V1007-T1010 PolarHBondContact O-N 3.43Å; T1010-A1013 PolarHBondContact O-N 3.16Å; T1010-F1014 WeakPolarHBondContact O-CB 3.33Å; T1010-F1014 PolarHBondContact O-N 3.44Å; T1010-M1036 HydrophobicContact CG2-CB 4.12Å; T1010-M1036 HydrophobicContact CG2-CG 4.49Å; T1010-M1036 VanDerWaalsContact CG2-O 3.28Å; T1010-M1036 WeakPolarHBondContact CG2-O 3.43Å; T1010-V1039 HydrophobicContact CG2-CB 4.14Å; T1010-V1039 HydrophobicContact CG2-CG1 3.99Å; T1010-L1040 HydrophobicContact CG2-CD1 4.38Å; T1010-L1040 HydrophobicContact CG2-CD2 3.92Å; T1010-L1040 HydrophobicContact CG2-CG 3.86Å
1011	R	89.4	Confident	87.2	Confident	62 Å²	62	53.6 Å²	53.6	23%	0.234	26%	0.264	C	S	.	.	H	α-helix	trans	-59.6	-51.3	172.6	177.2	-171.9	170.1	145	10.1	112.5	V1007 K1008 R1009 A1013 F1014 E1015 E1075	V1007-R1011 WeakPolarHBondContact O-CB 3.27Å; V1007-R1011 PolarHBondContact O-N 3.39Å; K1008-R1011 PolarHBondContact O-N 2.97Å; R1009-R1011 VanDerWaalsContact C-N 3.32Å; R1009-R1011 PolarHBondContact O-N 3.42Å; R1011-A1013 VanDerWaalsContact C-N 3.28Å; R1011-A1013 PolarHBondContact O-N 3.08Å; R1011-F1014 WeakPolarHBondContact O-CB 3.39Å; R1011-F1014 PolarHBondContact O-N 2.93Å; R1011-E1015 WeakPolarHBondContact CG-OE1 3.43Å; R1011-E1015 IonicContact CZ-OE1 3.3Å; R1011-E1015 IonicContact NE-OE1 2.74Å; R1011-E1015 PolarHBondContact NE-OE1 3.24Å; R1011-E1015 IonicContact NH2-OE1 2.68Å; R1011-E1015 PolarHBondContact NH2-OE1 2.66Å; R1011-E1015 WeakPolarHBondContact O-CG 3.28Å; R1011-E1015 PolarHBondContact O-N 3.17Å; R1011-E1075 IonicContact CZ-OE1 3.36Å; R1011-E1075 IonicContact CZ-OE2 3.77Å; R1011-E1075 VanDerWaalsContact NH1-CD 3.26Å; R1011-E1075 IonicContact NH1-OE1 3.23Å; R1011-E1075 PolarHBondContact NH1-OE1 2.91Å; R1011-E1075 IonicContact NH1-OE2 3.97Å; R1011-E1075 PolarHBondContact NH1-OE2 2.74Å; R1011-E1075 VanDerWaalsContact NH2-CD 3.33Å; R1011-E1075 IonicContact NH2-OE1 3.35Å; R1011-E1075 PolarHBondContact NH2-OE1 2.68Å; R1011-E1075 IonicContact NH2-OE2 2.68Å
1012	T	88.8	Confident	86.7	Confident	88 Å²	88	51.4 Å²	51.4	54%	0.54	26%	0.257	S	S	.	.	H	α-helix	trans	-61.2	-38.4	179.6	-56.2	0	0	0	0	111.9	K1008 R1009 L1016	K1008-T1012 PolarHBondContact O-N 3.42Å; K1008-T1012 VanDerWaalsContact O-N 3.08Å; K1008-T1012 PolarHBondContact O-OG1 3.5Å; R1009-T1012 PolarHBondContact O-N 2.92Å; T1012-L1016 WeakPolarHBondContact O-CB 3.29Å; T1012-L1016 PolarHBondContact O-N 3.39Å; T1012-L1016 VanDerWaalsContact O-N 3.09Å
1013	A	87.9	Confident	86.1	Confident	26 Å²	26	57.2 Å²	57.2	22%	0.215	28%	0.282	C	S	.	.	H	α-helix	trans	-65.8	-41.7	175.1	0	0	0	0	0	112.1	W953 R1009 T1010 R1011 K1017 M1036	W953-A1013 HydrophobicContact CH2-CB 4.21Å; W953-A1013 HydrophobicContact CZ2-CB 3.52Å; R1009-A1013 WeakPolarHBondContact O-CB 3.15Å; R1009-A1013 PolarHBondContact O-N 3.47Å; T1010-A1013 PolarHBondContact O-N 3.16Å; R1011-A1013 VanDerWaalsContact C-N 3.28Å; R1011-A1013 PolarHBondContact O-N 3.08Å; A1013-K1017 WeakPolarHBondContact O-CB 3.38Å; A1013-K1017 PolarHBondContact O-N 2.95Å; A1013-M1036 HydrophobicContact CB-CE 3.8Å
1014	F	89.4	Confident	85.7	Confident	1 Å²	1	60 Å²	60	0%	0.004	30%	0.299	C	S	.	.	H	α-helix	trans	-59.9	-51.6	174	179.1	-77.8	0	0	0	111.8	T1010 R1011 L1016 K1017 L1018 V1033 M1036 I1076 L1079 L1080	T1010-F1014 WeakPolarHBondContact O-CB 3.33Å; T1010-F1014 PolarHBondContact O-N 3.44Å; R1011-F1014 WeakPolarHBondContact O-CB 3.39Å; R1011-F1014 PolarHBondContact O-N 2.93Å; F1014-L1016 VanDerWaalsContact C-N 3.33Å; F1014-L1016 PolarHBondContact O-N 3.37Å; F1014-K1017 PolarHBondContact O-N 3.12Å; F1014-K1017 VanDerWaalsContact O-N 3.17Å; F1014-L1018 HydrophobicContact CD1-CD2 4.48Å; F1014-L1018 HydrophobicContact CE1-CB 4.26Å; F1014-L1018 HydrophobicContact CE1-CD2 3.55Å; F1014-L1018 HydrophobicContact CZ-CD2 3.97Å; F1014-L1018 WeakPolarHBondContact O-CB 3.47Å; F1014-L1018 PolarHBondContact O-N 2.88Å; F1014-V1033 HydrophobicContact CD2-CG1 3.84Å; F1014-V1033 HydrophobicContact CE2-CG1 3.33Å; F1014-V1033 HydrophobicContact CZ-CG1 4.01Å; F1014-M1036 VanDerWaalsContact CA-SD 3.55Å; F1014-M1036 HydrophobicContact CB-CB 4.35Å; F1014-M1036 HydrophobicContact CB-SD 4.01Å; F1014-M1036 HydrophobicContact CD2-CB 4.07Å; F1014-M1036 HydrophobicContact CD2-SD 4.43Å; F1014-I1076 HydrophobicContact CB-CD1 4.25Å; F1014-I1076 HydrophobicContact CD1-CD1 4.22Å; F1014-I1076 HydrophobicContact CD1-CG1 3.68Å; F1014-I1076 HydrophobicContact CD2-CD1 4.31Å; F1014-I1076 HydrophobicContact CD2-CG1 4.34Å; F1014-I1076 HydrophobicContact CD2-CG2 4.15Å; F1014-I1076 HydrophobicContact CE1-CB 4.22Å; F1014-I1076 HydrophobicContact CE1-CG1 3.83Å; F1014-I1076 HydrophobicContact CE1-CG2 4.04Å; F1014-I1076 HydrophobicContact CE2-CG1 4.46Å; F1014-I1076 HydrophobicContact CE2-CG2 3.61Å; F1014-I1076 HydrophobicContact CG-CD1 4.02Å; F1014-I1076 HydrophobicContact CG-CG1 3.97Å; F1014-I1076 HydrophobicContact CZ-CB 4.25Å; F1014-I1076 HydrophobicContact CZ-CG1 4.25Å; F1014-I1076 HydrophobicContact CZ-CG2 3.58Å; F1014-L1079 HydrophobicContact CE1-CB 4.32Å; F1014-L1080 HydrophobicContact CZ-CD1 4.04Å
1015	E	87.6	Confident	85.2	Confident	55 Å²	55	57.5 Å²	57.5	26%	0.257	29%	0.288	S	S	.	.	H	α-helix	trans	-56.8	-47.4	179.7	-73.3	176.1	-167	0	0	110.9	R1011 K1017 L1018 Q1019 L1079	R1011-E1015 WeakPolarHBondContact CG-OE1 3.43Å; R1011-E1015 IonicContact CZ-OE1 3.3Å; R1011-E1015 IonicContact NE-OE1 2.74Å; R1011-E1015 PolarHBondContact NE-OE1 3.24Å; R1011-E1015 IonicContact NH2-OE1 2.68Å; R1011-E1015 PolarHBondContact NH2-OE1 2.66Å; R1011-E1015 WeakPolarHBondContact O-CG 3.28Å; R1011-E1015 PolarHBondContact O-N 3.17Å; E1015-K1017 PolarHBondContact O-N 3.31Å; E1015-L1018 PolarHBondContact O-N 3.41Å; E1015-Q1019 WeakPolarHBondContact O-CB 3.3Å; E1015-Q1019 VanDerWaalsContact O-CG 3.26Å; E1015-Q1019 WeakPolarHBondContact O-CG 3.33Å; E1015-Q1019 PolarHBondContact O-N 3.41Å; E1015-L1079 HydrophobicContact CG-CD1 3.85Å
1016	L	86.6	Confident	84.8	Confident	92 Å²	92	61.7 Å²	61.7	48%	0.482	31%	0.307	S	S	.	.	H	α-helix	trans	-68.8	-29.2	179.5	-174.9	138.3	0	0	0	113.5	T1012 F1014 K1020	T1012-L1016 WeakPolarHBondContact O-CB 3.29Å; T1012-L1016 PolarHBondContact O-N 3.39Å; T1012-L1016 VanDerWaalsContact O-N 3.09Å; F1014-L1016 VanDerWaalsContact C-N 3.33Å; F1014-L1016 PolarHBondContact O-N 3.37Å; L1016-K1020 WeakPolarHBondContact O-CD 3.36Å; L1016-K1020 WeakPolarHBondContact O-CG 3.22Å
1017	K	85.6	Confident	84.6	Confident	82 Å²	82	62 Å²	62	36%	0.357	31%	0.309	S	S	.	.	H	α-helix	trans	-74.1	-45.1	173	-160.1	86	174.4	-145.5	0	111.1	A1013 F1014 E1015 K1020 S1032 V1033 M1036	A1013-K1017 WeakPolarHBondContact O-CB 3.38Å; A1013-K1017 PolarHBondContact O-N 2.95Å; F1014-K1017 PolarHBondContact O-N 3.12Å; F1014-K1017 VanDerWaalsContact O-N 3.17Å; E1015-K1017 PolarHBondContact O-N 3.31Å; K1017-K1020 PolarHBondContact O-N 2.88Å; K1017-S1032 VanDerWaalsContact CE-OG 3.23Å; K1017-S1032 WeakPolarHBondContact CE-OG 3.41Å; K1017-S1032 PolarHBondContact NZ-OG 3.01Å; K1017-V1033 HydrophobicContact CB-CG2 4.41Å; K1017-V1033 HydrophobicContact CG-CG2 3.87Å; K1017-M1036 HydrophobicContact CB-CE 4.31Å; K1017-M1036 HydrophobicContact CB-SD 4.38Å
1018	L	85	Confident	84.4	Confident	18 Å²	18	65.8 Å²	65.8	9%	0.094	32%	0.323	C	S	.	.	H	α-helix	trans	-72.2	-33.8	-176.8	-173.8	62.5	0	0	0	112.6	F1014 E1015 K1020 A1021 L1079 L1080 K1083	F1014-L1018 HydrophobicContact CD1-CD2 4.48Å; F1014-L1018 HydrophobicContact CE1-CB 4.26Å; F1014-L1018 HydrophobicContact CE1-CD2 3.55Å; F1014-L1018 HydrophobicContact CZ-CD2 3.97Å; F1014-L1018 WeakPolarHBondContact O-CB 3.47Å; F1014-L1018 PolarHBondContact O-N 2.88Å; E1015-L1018 PolarHBondContact O-N 3.41Å; L1018-K1020 VanDerWaalsContact C-N 3.28Å; L1018-K1020 PolarHBondContact O-N 3.08Å; L1018-A1021 WeakPolarHBondContact O-CB 3.4Å; L1018-A1021 PolarHBondContact O-N 3.42Å; L1018-L1079 HydrophobicContact CD2-CB 3.93Å; L1018-L1080 HydrophobicContact CD1-CD1 4.11Å; L1018-L1080 HydrophobicContact CD2-CD1 4.37Å; L1018-K1083 HydrophobicContact CD1-CB 4.07Å; L1018-K1083 HydrophobicContact CD1-CD 4.18Å; L1018-K1083 HydrophobicContact CD1-CG 3.86Å; L1018-K1083 HydrophobicContact CD2-CB 4.47Å; L1018-K1083 HydrophobicContact CG-CB 4.44Å; L1018-K1083 HydrophobicContact CG-CD 4.34Å; L1018-K1083 HydrophobicContact CG-CG 4.44Å; L1018-K1083 PolarHBondContact O-NZ 3.2Å
1019	Q	81.2	Confident	84.3	Confident	150 Å²	150	61.5 Å²	61.5	70%	0.701	31%	0.305	S	S	*	.	H	α-helix	trans	-55.2	-44.5	171.1	-78.9	176.7	21.7	0	0	111.6	E1015 A1021 K1083	E1015-Q1019 WeakPolarHBondContact O-CB 3.3Å; E1015-Q1019 VanDerWaalsContact O-CG 3.26Å; E1015-Q1019 WeakPolarHBondContact O-CG 3.33Å; E1015-Q1019 PolarHBondContact O-N 3.41Å; Q1019-A1021 VanDerWaalsContact C-N 3.3Å; Q1019-A1021 PolarHBondContact O-N 2.95Å; Q1019-K1083 PolarHBondContact O-NZ 3.45Å
1020	K	79.7	Confident	84.1	Confident	164 Å²	164	61.1 Å²	61.1	71%	0.713	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-13.6	-177.8	-66.5	173.8	-176.3	178.8	0	114.8	L1016 K1017 L1018	L1016-K1020 WeakPolarHBondContact O-CD 3.36Å; L1016-K1020 WeakPolarHBondContact O-CG 3.22Å; K1017-K1020 PolarHBondContact O-N 2.88Å; L1018-K1020 VanDerWaalsContact C-N 3.28Å; L1018-K1020 PolarHBondContact O-N 3.08Å
1021	A	79.4	Confident	83.8	Confident	25 Å²	25	63.3 Å²	63.3	21%	0.207	33%	0.329	C	S	.	.	S	Bend	trans	-69.4	156.6	178.3	0	0	0	0	0	112.5	L1018 Q1019 L1027 K1083	L1018-A1021 WeakPolarHBondContact O-CB 3.4Å; L1018-A1021 PolarHBondContact O-N 3.42Å; Q1019-A1021 VanDerWaalsContact C-N 3.3Å; Q1019-A1021 PolarHBondContact O-N 2.95Å; A1021-L1027 HydrophobicContact CB-CD1 3.82Å; A1021-K1083 WeakPolarHBondContact O-CE 3.23Å; A1021-K1083 PolarHBondContact O-NZ 2.92Å
1022	S	74.5	Confident	83.7	Confident	52 Å²	52	61 Å²	61	36%	0.364	32%	0.322	S	S	.	.			trans	-67.8	167	179.1	63.1	0	0	0	0	113.1	K1083	S1022-K1083 WeakPolarHBondContact O-CE 3.46Å
1023	K	77.8	Confident	83.6	Confident	138 Å²	138	57 Å²	57	60%	0.6	30%	0.298	S	S	*	.	S	Bend	trans	-117.3	33.8	170.7	-65	-168.6	175.7	-168.4	0	111.7
1024	T	79.8	Confident	83.6	Confident	58 Å²	58	56 Å²	56	36%	0.356	29%	0.289	S	S	.	.	S	Bend	trans	-116.4	167.2	179.6	62.6	0	0	0	0	110.7	D1026 L1027	T1024-D1026 WeakPolarHBondContact CB-OD2 3.16Å; T1024-D1026 PolarHBondContact O-N 3.2Å; T1024-D1026 PolarHBondContact OG1-OD2 3.29Å; T1024-L1027 WeakPolarHBondContact O-CB 3.35Å; T1024-L1027 PolarHBondContact O-N 2.94Å
1025	T	78.4	Confident	83.6	Confident	10 Å²	10	56.1 Å²	56.1	6%	0.061	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-9.5	174.1	41.5	0	0	0	0	113.5	L1027 R1028 V1087 V1091 Y1132 F1135	T1025-L1027 VanDerWaalsContact C-N 3.3Å; T1025-R1028 PolarHBondContact O-NH1 3.32Å; T1025-V1087 HydrophobicContact CG2-CG1 3.91Å; T1025-V1091 HydrophobicContact CG2-CG2 3.88Å; T1025-Y1132 HydrophobicContact CG2-CD2 4.37Å; T1025-F1135 HydrophobicContact CG2-CB 4.44Å; T1025-F1135 WeakPolarHBondContact O-CB 3.42Å
1026	D	80.7	Confident	83.8	Confident	109 Å²	109	53.6 Å²	53.6	58%	0.583	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-6.5	175.1	-29.7	-70.9	0	0	0	111.9	T1024 R1028	T1024-D1026 WeakPolarHBondContact CB-OD2 3.16Å; T1024-D1026 PolarHBondContact O-N 3.2Å; T1024-D1026 PolarHBondContact OG1-OD2 3.29Å; D1026-R1028 PolarHBondContact O-N 3.18Å
1027	L	84.9	Confident	83.9	Confident	8 Å²	8	49.6 Å²	49.6	4%	0.042	26%	0.257	C	S	.	.			trans	-57.2	119.8	174.5	174.6	62.2	0	0	0	110.6	A1021 T1024 T1025 K1083 F1084 V1087 F1135 N1139	A1021-L1027 HydrophobicContact CB-CD1 3.82Å; T1024-L1027 WeakPolarHBondContact O-CB 3.35Å; T1024-L1027 PolarHBondContact O-N 2.94Å; T1025-L1027 VanDerWaalsContact C-N 3.3Å; L1027-K1083 HydrophobicContact CD2-CG 3.95Å; L1027-F1084 HydrophobicContact CD2-CD1 4.4Å; L1027-V1087 HydrophobicContact CD2-CG2 3.94Å; L1027-F1135 HydrophobicContact CB-CD2 4.38Å; L1027-F1135 HydrophobicContact CB-CE2 3.93Å; L1027-F1135 HydrophobicContact CD2-CE2 4.14Å; L1027-F1135 HydrophobicContact CG-CE2 4.19Å; L1027-F1135 WeakPolarHBondContact O-CD2 3.14Å; L1027-N1139 PolarHBondContact O-ND2 3.1Å
1028	R	87.6	Confident	84.1	Confident	78 Å²	78	46.2 Å²	46.2	29%	0.294	24%	0.243	S	C	.	.			trans	-121.1	136.5	165.1	-59.7	-62.7	173.3	-83.4	0.4	108	T1025 D1026 P1030 N1139 I1142	T1025-R1028 PolarHBondContact O-NH1 3.32Å; D1026-R1028 PolarHBondContact O-N 3.18Å; R1028-P1030 WeakPolarHBondContact O-CD 3.09Å; R1028-N1139 WeakPolarHBondContact CA-OD1 3.35Å; R1028-I1142 HydrophobicContact CB-CD1 4.19Å
1029	I	86.1	Confident	84.4	Confident	11 Å²	11	45.3 Å²	45.3	6%	0.056	24%	0.238	C	C	.	.			trans	-61.5	123.5	176.2	-73.9	178.5	0	0	0	109.5	V1033 L1080 F1084 N1139 I1142 L1143	I1029-V1033 HydrophobicContact CG2-CB 3.93Å; I1029-V1033 HydrophobicContact CG2-CG1 4.17Å; I1029-L1080 HydrophobicContact CD1-CD1 3.78Å; I1029-L1080 HydrophobicContact CD1-CD2 3.77Å; I1029-L1080 HydrophobicContact CD1-CG 4.09Å; I1029-L1080 HydrophobicContact CG1-CD1 4.38Å; I1029-F1084 HydrophobicContact CD1-CE1 3.82Å; I1029-F1084 HydrophobicContact CD1-CE2 4.38Å; I1029-F1084 HydrophobicContact CD1-CZ 3.39Å; I1029-F1084 HydrophobicContact CG1-CE1 4.09Å; I1029-F1084 HydrophobicContact CG1-CZ 4.16Å; I1029-N1139 PolarHBondContact N-OD1 2.86Å; I1029-I1142 HydrophobicContact CB-CG2 4.21Å; I1029-I1142 HydrophobicContact CG2-CG2 4.46Å; I1029-L1143 HydrophobicContact CD1-CD1 3.97Å; I1029-L1143 HydrophobicContact CD1-CD2 3.88Å; I1029-L1143 HydrophobicContact CD1-CG 3.94Å
1030	P	85.9	Confident	84.8	Confident	56 Å²	56	38.2 Å²	38.2	36%	0.364	21%	0.205	S	C	.	.			trans	-66.3	137.7	171.8	-17.1	30.6	0	0	0	110.1	R1028 S1032 V1033	R1028-P1030 WeakPolarHBondContact O-CD 3.09Å; P1030-S1032 PolarHBondContact O-N 3.38Å; P1030-V1033 HydrophobicContact CB-CG2 4.31Å; P1030-V1033 HydrophobicContact CG-CG2 4.22Å; P1030-V1033 WeakPolarHBondContact O-CB 3.43Å; P1030-V1033 PolarHBondContact O-N 2.76Å
1031	A	83.9	Confident	85.2	Confident	47 Å²	47	30.7 Å²	30.7	39%	0.388	17%	0.173	S	C	.	.	H	α-helix	trans	-51.4	-35.4	-178.9	0	0	0	0	0	113.6	V1033 C1034 T1035 K1146	A1031-V1033 PolarHBondContact O-N 3.4Å; A1031-V1033 VanDerWaalsContact O-N 3.11Å; A1031-C1034 WeakPolarHBondContact O-CA 3.42Å; A1031-C1034 WeakPolarHBondContact O-CB 3.49Å; A1031-C1034 PolarHBondContact O-N 2.86Å; A1031-T1035 PolarHBondContact O-N 3.3Å; A1031-T1035 PolarHBondContact O-OG1 3.49Å; A1031-K1146 HydrophobicContact CB-CD 4.31Å
1032	S	85.9	Confident	85.5	Confident	12 Å²	12	29.8 Å²	29.8	8%	0.084	16%	0.164	C	C	.	.	H	α-helix	trans	-55.2	-28.4	174.8	60.5	0	0	0	0	114.6	W953 K1017 P1030 M1036	W953-S1032 WeakPolarHBondContact O-CA 3.37Å; W953-S1032 WeakPolarHBondContact O-CB 3.4Å; K1017-S1032 VanDerWaalsContact CE-OG 3.23Å; K1017-S1032 WeakPolarHBondContact CE-OG 3.41Å; K1017-S1032 PolarHBondContact NZ-OG 3.01Å; P1030-S1032 PolarHBondContact O-N 3.38Å; S1032-M1036 WeakPolarHBondContact O-CG 3.14Å; S1032-M1036 PolarHBondContact O-N 2.96Å
1033	V	87.6	Confident	86.2	Confident	6 Å²	6	27.3 Å²	27.3	4%	0.036	15%	0.147	C	C	.	.	H	α-helix	trans	-76.7	-34.7	178.9	178.7	0	0	0	0	110.4	F1014 K1017 I1029 P1030 A1031 F1037 L1080	F1014-V1033 HydrophobicContact CD2-CG1 3.84Å; F1014-V1033 HydrophobicContact CE2-CG1 3.33Å; F1014-V1033 HydrophobicContact CZ-CG1 4.01Å; K1017-V1033 HydrophobicContact CB-CG2 4.41Å; K1017-V1033 HydrophobicContact CG-CG2 3.87Å; I1029-V1033 HydrophobicContact CG2-CB 3.93Å; I1029-V1033 HydrophobicContact CG2-CG1 4.17Å; P1030-V1033 HydrophobicContact CB-CG2 4.31Å; P1030-V1033 HydrophobicContact CG-CG2 4.22Å; P1030-V1033 WeakPolarHBondContact O-CB 3.43Å; P1030-V1033 PolarHBondContact O-N 2.76Å; A1031-V1033 PolarHBondContact O-N 3.4Å; A1031-V1033 VanDerWaalsContact O-N 3.11Å; V1033-F1037 PolarHBondContact O-N 3.12Å; V1033-F1037 VanDerWaalsContact O-N 3.11Å; V1033-L1080 HydrophobicContact CG1-CD1 4.23Å
1034	C	88.3	Confident	86.6	Confident	3 Å²	3	23.1 Å²	23.1	2%	0.02	13%	0.129	C	C	.	.	H	α-helix	trans	-68.3	-40.4	168.3	-52.2	0	0	0	0	110.8	A1031 M1036 F1037 N1038 K1146 V1147	A1031-C1034 WeakPolarHBondContact O-CA 3.42Å; A1031-C1034 WeakPolarHBondContact O-CB 3.49Å; A1031-C1034 PolarHBondContact O-N 2.86Å; C1034-M1036 PolarHBondContact O-N 3.45Å; C1034-F1037 WeakPolarHBondContact O-CA 3.19Å; C1034-F1037 VanDerWaalsContact O-CB 3.3Å; C1034-F1037 WeakPolarHBondContact O-CB 3.23Å; C1034-F1037 PolarHBondContact O-N 2.8Å; C1034-F1037 VanDerWaalsContact O-N 3.1Å; C1034-N1038 PolarHBondContact O-N 2.89Å; C1034-K1146 HydrophobicContact CB-CB 3.82Å; C1034-K1146 WeakPolarHBondContact CB-O 3.39Å; C1034-V1147 HydrophobicContact CB-CG2 4.16Å
1035	T	89.6	Confident	86.8	Confident	5 Å²	5	24.3 Å²	24.3	3%	0.031	13%	0.129	C	C	.	.	H	α-helix	trans	-58.5	-48.1	173.2	-54.3	0	0	0	0	111.8	G959 A1031 F1037 N1038 V1039	G959-T1035 WeakPolarHBondContact O-CG2 3.36Å; A1031-T1035 PolarHBondContact O-N 3.3Å; A1031-T1035 PolarHBondContact O-OG1 3.49Å; T1035-F1037 PolarHBondContact O-N 2.91Å; T1035-N1038 PolarHBondContact O-N 3.31Å; T1035-V1039 WeakPolarHBondContact O-CG2 3.47Å; T1035-V1039 PolarHBondContact O-N 3.03Å
1036	M	90.9	Very high	87	Confident	2 Å²	2	25.9 Å²	25.9	1%	0.01	14%	0.136	C	C	.	.	H	α-helix	trans	-57	-37	173.3	-71.9	158.6	174.8	0	0	112.6	W953 T1010 A1013 F1014 K1017 S1032 C1034	W953-M1036 HydrophobicContact CB-CE 4.4Å; W953-M1036 HydrophobicContact CD2-CE 3.47Å; W953-M1036 VanDerWaalsContact CD2-CE 3.47Å; W953-M1036 HydrophobicContact CD2-CG 3.74Å; W953-M1036 HydrophobicContact CD2-SD 4.49Å; W953-M1036 HydrophobicContact CE3-CB 4.32Å; W953-M1036 HydrophobicContact CE3-CE 4.08Å; W953-M1036 HydrophobicContact CE3-CG 3.31Å; W953-M1036 HydrophobicContact CG-CE 3.6Å; W953-M1036 HydrophobicContact CG-CG 4.45Å; W953-M1036 HydrophobicContact CH2-CG 4.21Å; W953-M1036 HydrophobicContact CZ2-CE 4.18Å; W953-M1036 HydrophobicContact CZ3-CB 4.35Å; W953-M1036 HydrophobicContact CZ3-CG 3.58Å; T1010-M1036 HydrophobicContact CG2-CB 4.12Å; T1010-M1036 HydrophobicContact CG2-CG 4.49Å; T1010-M1036 VanDerWaalsContact CG2-O 3.28Å; T1010-M1036 WeakPolarHBondContact CG2-O 3.43Å; A1013-M1036 HydrophobicContact CB-CE 3.8Å; F1014-M1036 VanDerWaalsContact CA-SD 3.55Å; F1014-M1036 HydrophobicContact CB-CB 4.35Å; F1014-M1036 HydrophobicContact CB-SD 4.01Å; F1014-M1036 HydrophobicContact CD2-CB 4.07Å; F1014-M1036 HydrophobicContact CD2-SD 4.43Å; K1017-M1036 HydrophobicContact CB-CE 4.31Å; K1017-M1036 HydrophobicContact CB-SD 4.38Å; S1032-M1036 WeakPolarHBondContact O-CG 3.14Å; S1032-M1036 PolarHBondContact O-N 2.96Å; C1034-M1036 PolarHBondContact O-N 3.45Å
1037	F	88.8	Confident	87.2	Confident	7 Å²	7	20.7 Å²	20.7	3%	0.031	11%	0.108	C	C	.	.	H	α-helix	trans	-66.5	-47.5	175.8	-162.5	-78.5	0	0	0	111.3	V1033 C1034 T1035 V1039 L1040 V1041 V1073 I1076 I1077 V1147 Y1152 L1156	V1033-F1037 PolarHBondContact O-N 3.12Å; V1033-F1037 VanDerWaalsContact O-N 3.11Å; C1034-F1037 WeakPolarHBondContact O-CA 3.19Å; C1034-F1037 VanDerWaalsContact O-CB 3.3Å; C1034-F1037 WeakPolarHBondContact O-CB 3.23Å; C1034-F1037 PolarHBondContact O-N 2.8Å; C1034-F1037 VanDerWaalsContact O-N 3.1Å; T1035-F1037 PolarHBondContact O-N 2.91Å; F1037-V1039 PolarHBondContact O-N 3.23Å; F1037-L1040 PolarHBondContact O-N 3Å; F1037-V1041 HydrophobicContact CD1-CG2 3.84Å; F1037-V1041 HydrophobicContact CE1-CG2 3.75Å; F1037-V1041 WeakPolarHBondContact O-CG2 3.16Å; F1037-V1041 PolarHBondContact O-N 3.18Å; F1037-V1041 VanDerWaalsContact O-N 3.15Å; F1037-V1073 HydrophobicContact CZ-CG1 4.12Å; F1037-I1076 HydrophobicContact CD2-CG2 3.53Å; F1037-I1076 HydrophobicContact CE2-CG2 3.76Å; F1037-I1077 HydrophobicContact CE2-CD1 4.5Å; F1037-I1077 HydrophobicContact CE2-CG1 3.75Å; F1037-I1077 HydrophobicContact CZ-CD1 4.17Å; F1037-I1077 HydrophobicContact CZ-CG1 3.91Å; F1037-V1147 HydrophobicContact CD1-CG1 3.69Å; F1037-V1147 HydrophobicContact CD1-CG2 4.37Å; F1037-V1147 HydrophobicContact CE1-CG1 3.83Å; F1037-Y1152 HydrophobicContact CE1-CG 4.32Å; F1037-L1156 HydrophobicContact CE2-CD1 4.48Å
1038	N	90.5	Very high	86.8	Confident	11 Å²	11	24.5 Å²	24.5	6%	0.059	13%	0.131	C	C	.	.	H	α-helix	trans	-65.6	-36	-179.3	-62.6	-20.5	0	0	0	112.4	N958 C1034 T1035 L1040 V1041 D1042 K1146 V1147 N1148	N958-N1038 CarbonylContact O-C 3.59Å; N958-N1038 WeakPolarHBondContact O-CB 3.13Å; C1034-N1038 PolarHBondContact O-N 2.89Å; T1035-N1038 PolarHBondContact O-N 3.31Å; N1038-L1040 VanDerWaalsContact C-N 3.26Å; N1038-L1040 PolarHBondContact O-N 3.1Å; N1038-V1041 PolarHBondContact O-N 2.8Å; N1038-V1041 VanDerWaalsContact O-N 3.12Å; N1038-D1042 PolarHBondContact O-N 2.84Å; N1038-K1146 PolarHBondContact ND2-O 3.47Å; N1038-V1147 VanDerWaalsContact OD1-CA 3.28Å; N1038-V1147 WeakPolarHBondContact OD1-CA 3.48Å; N1038-N1148 PolarHBondContact ND2-OD1 3.28Å; N1038-N1148 VanDerWaalsContact ND2-OD1 3.1Å; N1038-N1148 PolarHBondContact OD1-N 3.11Å
1039	V	90.9	Very high	86.4	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-55.4	-40.4	173.3	169	0	0	0	0	111.9	W953 T1010 T1035 F1037 A1043	W953-V1039 HydrophobicContact CZ3-CG2 4.4Å; T1010-V1039 HydrophobicContact CG2-CB 4.14Å; T1010-V1039 HydrophobicContact CG2-CG1 3.99Å; T1035-V1039 WeakPolarHBondContact O-CG2 3.47Å; T1035-V1039 PolarHBondContact O-N 3.03Å; F1037-V1039 PolarHBondContact O-N 3.23Å; V1039-A1043 VanDerWaalsContact O-CB 3.22Å; V1039-A1043 WeakPolarHBondContact O-CB 3.35Å; V1039-A1043 PolarHBondContact O-N 2.93Å
1040	L	89.3	Confident	85.9	Confident	1 Å²	1	25.6 Å²	25.6	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-74.7	-34	177.9	-63.4	-179.5	0	0	0	112.9	V1007 T1010 F1037 N1038 K1044 V1073 I1076	V1007-L1040 HydrophobicContact CB-CD2 3.97Å; V1007-L1040 HydrophobicContact CG1-CD2 3.75Å; V1007-L1040 HydrophobicContact CG2-CD2 3.89Å; T1010-L1040 HydrophobicContact CG2-CD1 4.38Å; T1010-L1040 HydrophobicContact CG2-CD2 3.92Å; T1010-L1040 HydrophobicContact CG2-CG 3.86Å; F1037-L1040 PolarHBondContact O-N 3Å; N1038-L1040 VanDerWaalsContact C-N 3.26Å; N1038-L1040 PolarHBondContact O-N 3.1Å; L1040-K1044 PolarHBondContact O-N 3.28Å; L1040-V1073 HydrophobicContact CB-CG2 3.94Å; L1040-V1073 HydrophobicContact CD1-CG2 4.48Å; L1040-I1076 HydrophobicContact CD1-CD1 3.25Å
1041	V	87.4	Confident	85.1	Confident	6 Å²	6	23.3 Å²	23.3	4%	0.036	12%	0.123	C	C	.	.	H	α-helix	trans	-68.5	-42.4	175.9	166.5	0	0	0	0	111.2	F1037 N1038 K1044 K1045 E1149 Y1152	F1037-V1041 HydrophobicContact CD1-CG2 3.84Å; F1037-V1041 HydrophobicContact CE1-CG2 3.75Å; F1037-V1041 WeakPolarHBondContact O-CG2 3.16Å; F1037-V1041 PolarHBondContact O-N 3.18Å; F1037-V1041 VanDerWaalsContact O-N 3.15Å; N1038-V1041 PolarHBondContact O-N 2.8Å; N1038-V1041 VanDerWaalsContact O-N 3.12Å; V1041-K1044 WeakPolarHBondContact O-CB 3.44Å; V1041-K1044 PolarHBondContact O-N 2.98Å; V1041-K1045 PolarHBondContact O-N 2.88Å; V1041-E1149 HydrophobicContact CG1-CB 3.86Å; V1041-E1149 HydrophobicContact CG1-CG 3.3Å; V1041-Y1152 HydrophobicContact CG1-CD2 4.44Å; V1041-Y1152 HydrophobicContact CG1-CE2 4.3Å; V1041-Y1152 HydrophobicContact CG2-CD2 3.83Å; V1041-Y1152 HydrophobicContact CG2-CE2 3.98Å; V1041-Y1152 HydrophobicContact CG2-CG 4.49Å
1042	D	87.2	Confident	84.1	Confident	5 Å²	5	23.2 Å²	23.2	3%	0.027	12%	0.123	C	C	.	.	H	α-helix	trans	-71.4	-39.7	175.4	-157.9	76.7	0	0	0	111.1	N958 F967 N1038 K1044 K1045 Q1046	N958-D1042 HydrophobicContact CB-CB 4.04Å; N958-D1042 WeakPolarHBondContact CB-OD1 3.47Å; N958-D1042 PolarHBondContact ND2-OD1 3.08Å; F967-D1042 HydrophobicContact CE2-CB 4.36Å; N1038-D1042 PolarHBondContact O-N 2.84Å; D1042-K1044 PolarHBondContact O-N 3.43Å; D1042-K1044 VanDerWaalsContact O-N 3.1Å; D1042-K1045 CarbonylContact O-C 3.56Å; D1042-K1045 WeakPolarHBondContact O-CA 3.25Å; D1042-K1045 WeakPolarHBondContact O-CB 3.29Å; D1042-K1045 PolarHBondContact O-N 2.88Å; D1042-Q1046 WeakPolarHBondContact O-CG 3.44Å; D1042-Q1046 PolarHBondContact O-N 2.66Å; D1042-Q1046 WeakPolarHBondContact OD2-CG 3.38Å; D1042-Q1046 PolarHBondContact OD2-NE2 2.66Å
1043	A	88.1	Confident	82.7	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-52.8	-33.9	170.4	0	0	0	0	0	112.6	F967 L1003 V1007 V1039 S1047 I1069	F967-A1043 HydrophobicContact CZ-CB 3.94Å; L1003-A1043 HydrophobicContact CD2-CB 4.07Å; V1007-A1043 HydrophobicContact CG2-CB 4.11Å; V1039-A1043 VanDerWaalsContact O-CB 3.22Å; V1039-A1043 WeakPolarHBondContact O-CB 3.35Å; V1039-A1043 PolarHBondContact O-N 2.93Å; A1043-S1047 VanDerWaalsContact O-CB 3.3Å; A1043-S1047 WeakPolarHBondContact O-CB 3.44Å; A1043-S1047 PolarHBondContact O-N 3.2Å; A1043-I1069 HydrophobicContact CB-CD1 4.39Å
1044	K	86.1	Confident	80.8	Confident	50 Å²	50	32.7 Å²	32.7	22%	0.217	17%	0.172	C	C	.	.	H	α-helix	trans	-66.6	-41.7	172.6	-156.8	-179.2	-176.2	176.1	0	112.7	L1040 V1041 D1042 S1047 T1048 I1069 D1070 Y1152	L1040-K1044 PolarHBondContact O-N 3.28Å; V1041-K1044 WeakPolarHBondContact O-CB 3.44Å; V1041-K1044 PolarHBondContact O-N 2.98Å; D1042-K1044 PolarHBondContact O-N 3.43Å; D1042-K1044 VanDerWaalsContact O-N 3.1Å; K1044-S1047 WeakPolarHBondContact O-CB 3.37Å; K1044-T1048 PolarHBondContact O-N 3.37Å; K1044-I1069 HydrophobicContact CB-CG2 3.84Å; K1044-I1069 HydrophobicContact CD-CG2 4.42Å; K1044-I1069 HydrophobicContact CG-CG2 4.07Å; K1044-D1070 IonicContact NZ-OD1 3.42Å; K1044-D1070 PolarHBondContact NZ-OD1 2.71Å; K1044-D1070 IonicContact NZ-OD2 2.75Å; K1044-D1070 PolarHBondContact NZ-OD2 3.3Å; K1044-Y1152 WeakPolarHBondContact CD-OH 3.39Å
1045	K	84	Confident	79	Confident	83 Å²	83	33.6 Å²	33.6	36%	0.361	18%	0.182	S	C	.	.	H	α-helix	trans	-63.7	-49.2	175.9	-62.1	178.5	179.5	-177.8	0	110.3	V1041 D1042 S1047 T1048 K1049 E1149	V1041-K1045 PolarHBondContact O-N 2.88Å; D1042-K1045 CarbonylContact O-C 3.56Å; D1042-K1045 WeakPolarHBondContact O-CA 3.25Å; D1042-K1045 WeakPolarHBondContact O-CB 3.29Å; D1042-K1045 PolarHBondContact O-N 2.88Å; K1045-S1047 PolarHBondContact O-N 2.99Å; K1045-T1048 PolarHBondContact O-N 3.09Å; K1045-T1048 PolarHBondContact O-OG1 3.17Å; K1045-K1049 PolarHBondContact O-N 2.97Å; K1045-E1149 WeakPolarHBondContact CE-OE1 3.26Å; K1045-E1149 IonicContact NZ-OE1 3.14Å; K1045-E1149 PolarHBondContact NZ-OE1 3.24Å
1046	Q	83.7	Confident	77	Confident	44 Å²	44	36.9 Å²	36.9	21%	0.206	22%	0.216	C	C	.	.	H	α-helix	trans	-66.5	-34.3	-179.7	-51.5	-52.2	-15.7	0	0	112.5	F967 D1042 T1048 K1049 L1050	F967-Q1046 HydrophobicContact CB-CG 4.19Å; F967-Q1046 HydrophobicContact CD1-CB 4.37Å; F967-Q1046 HydrophobicContact CD1-CG 4.18Å; F967-Q1046 HydrophobicContact CD2-CG 3.64Å; F967-Q1046 HydrophobicContact CE2-CG 3.99Å; F967-Q1046 HydrophobicContact CG-CB 4.41Å; F967-Q1046 HydrophobicContact CG-CG 3.75Å; F967-Q1046 HydrophobicContact CZ-CG 4.42Å; D1042-Q1046 WeakPolarHBondContact O-CG 3.44Å; D1042-Q1046 PolarHBondContact O-N 2.66Å; D1042-Q1046 WeakPolarHBondContact OD2-CG 3.38Å; D1042-Q1046 PolarHBondContact OD2-NE2 2.66Å; Q1046-T1048 VanDerWaalsContact C-N 3.34Å; Q1046-T1048 PolarHBondContact O-N 2.72Å; Q1046-K1049 PolarHBondContact O-N 3.25Å; Q1046-K1049 VanDerWaalsContact O-N 3.08Å; Q1046-L1050 HydrophobicContact CB-CD1 4.02Å; Q1046-L1050 WeakPolarHBondContact O-CB 3.33Å; Q1046-L1050 WeakPolarHBondContact O-CG 3.47Å; Q1046-L1050 PolarHBondContact O-N 2.81Å
1047	S	83.6	Confident	74.8	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-49.8	-54.7	170	179	0	0	0	0	110.8	A1043 K1044 K1045 K1049 L1050 C1051 H1062 D1066	A1043-S1047 VanDerWaalsContact O-CB 3.3Å; A1043-S1047 WeakPolarHBondContact O-CB 3.44Å; A1043-S1047 PolarHBondContact O-N 3.2Å; K1044-S1047 WeakPolarHBondContact O-CB 3.37Å; K1045-S1047 PolarHBondContact O-N 2.99Å; S1047-K1049 PolarHBondContact O-N 3.41Å; S1047-K1049 VanDerWaalsContact O-N 3.12Å; S1047-L1050 PolarHBondContact O-N 3.49Å; S1047-C1051 WeakPolarHBondContact O-CB 3.3Å; S1047-C1051 PolarHBondContact O-N 3.17Å; S1047-H1062 PolarHBondContact O-CE1 3.42Å; S1047-H1062 PolarHBondContact O-NE2 3.08Å; S1047-D1066 WeakPolarHBondContact CB-OD1 3.39Å; S1047-D1066 PolarHBondContact OG-OD1 2.97Å
1048	T	77	Confident	73	Confident	87 Å²	87	47.7 Å²	47.7	53%	0.534	27%	0.267	S	S	.	.	H	α-helix	trans	-66.1	-14	-179.4	62.3	0	0	0	0	115.4	K1044 K1045 Q1046	K1044-T1048 PolarHBondContact O-N 3.37Å; K1045-T1048 PolarHBondContact O-N 3.09Å; K1045-T1048 PolarHBondContact O-OG1 3.17Å; Q1046-T1048 VanDerWaalsContact C-N 3.34Å; Q1046-T1048 PolarHBondContact O-N 2.72Å
1049	K	78.8	Confident	71.2	Confident	112 Å²	112	52.9 Å²	52.9	49%	0.487	29%	0.291	S	S	.	.	H	α-helix	trans	-93.7	-51.2	174.2	-169.6	-165.1	-178.7	-165	0	111.7	D971 K1045 Q1046 S1047	D971-K1049 WeakPolarHBondContact OD1-CE 3.38Å; D971-K1049 IonicContact OD1-NZ 2.81Å; D971-K1049 PolarHBondContact OD1-NZ 3.44Å; D971-K1049 IonicContact OD2-NZ 3.34Å; D971-K1049 PolarHBondContact OD2-NZ 3.42Å; K1045-K1049 PolarHBondContact O-N 2.97Å; Q1046-K1049 PolarHBondContact O-N 3.25Å; Q1046-K1049 VanDerWaalsContact O-N 3.08Å; S1047-K1049 PolarHBondContact O-N 3.41Å; S1047-K1049 VanDerWaalsContact O-N 3.12Å
1050	L	75.5	Confident	69.4	Low	1 Å²	1	58.9 Å²	58.9	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-87.3	-22.1	-166.8	-60.4	174.3	0	0	0	113.6	L970 D971 Q974 A999 Q1046 S1047	L970-L1050 HydrophobicContact CB-CD1 3.98Å; L970-L1050 HydrophobicContact CD1-CD1 4.2Å; D971-L1050 HydrophobicContact CB-CD2 4.34Å; Q974-L1050 PolarHBondContact NE2-O 3.44Å; A999-L1050 HydrophobicContact CB-CB 4.32Å; Q1046-L1050 HydrophobicContact CB-CD1 4.02Å; Q1046-L1050 WeakPolarHBondContact O-CB 3.33Å; Q1046-L1050 WeakPolarHBondContact O-CG 3.47Å; Q1046-L1050 PolarHBondContact O-N 2.81Å; S1047-L1050 PolarHBondContact O-N 3.49Å
1051	C	69.9	Low	67.9	Low	7 Å²	7	63.8 Å²	63.8	5%	0.047	34%	0.338	C	S	.	.	S	Bend	trans	-106.3	-3.3	-174.4	-62.9	0	0	0	0	114.3	S1047 L1053 H1062	S1047-C1051 WeakPolarHBondContact O-CB 3.3Å; S1047-C1051 PolarHBondContact O-N 3.17Å; C1051-L1053 PolarHBondContact O-N 3.36Å; C1051-H1062 PolarHBondContact O-CD2 3.33Å
1052	A	62.5	Low	66.7	Low	46 Å²	46	65 Å²	65	38%	0.38	34%	0.343	S	S	.	.			trans	-59.7	129.3	-170.1	0	0	0	0	0	113.4	K996 H1062	K996-A1052 VanDerWaalsContact CE-O 3.3Å; K996-A1052 WeakPolarHBondContact CE-O 3.35Å; K996-A1052 PolarHBondContact NZ-O 3.33Å; A1052-H1062 PolarHBondContact N-NE2 3.26Å
1053	L	57.5	Low	65.7	Low	32 Å²	32	67.7 Å²	67.7	17%	0.168	36%	0.362	C	S	.	.			trans	-134.9	118.1	-174	-79.3	163.5	0	0	0	112.1	K996 C1051 G1055 E1058	K996-L1053 HydrophobicContact CD-CD2 3.58Å; K996-L1053 HydrophobicContact CD-CG 3.87Å; C1051-L1053 PolarHBondContact O-N 3.36Å; L1053-G1055 PolarHBondContact O-N 2.73Å; L1053-E1058 HydrophobicContact CD1-CB 3.95Å
1054	D	47.6	Very low	65	Low	185 Å²	185	71.9 Å²	71.9	99%	0.989	38%	0.381	S	S	*	.			trans	-78.8	67.3	168.2	-83.8	-38.2	0	0	0	110.9
1055	G	49.9	Very low	64.8	Low	22 Å²	22	69.9 Å²	69.9	23%	0.227	37%	0.372	C	S	.	.			trans	-156.6	113.3	-176.4	0	0	0	0	0	114.2	L1053 Q1057 E1058 Q1059	L1053-G1055 PolarHBondContact O-N 2.73Å; G1055-Q1057 PolarHBondContact O-N 3.45Å; G1055-Q1057 VanDerWaalsContact O-N 3.08Å; G1055-E1058 PolarHBondContact O-N 3.17Å; G1055-Q1059 PolarHBondContact O-N 3.38Å; G1055-Q1059 VanDerWaalsContact O-N 3.17Å
1056	G	46.9	Very low	64.6	Low	73 Å²	73	67.6 Å²	67.6	75%	0.753	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-8.8	-173.8	0	0	0	0	0	116.7
1057	Q	45.8	Very low	64.7	Low	188 Å²	188	69.3 Å²	69.3	88%	0.879	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-17.4	169.9	-74.5	-173.9	-33.7	0	0	113.2	G1055	G1055-Q1057 PolarHBondContact O-N 3.45Å; G1055-Q1057 VanDerWaalsContact O-N 3.08Å
1058	E	50.4	Low	64.8	Low	49 Å²	49	71.1 Å²	71.1	23%	0.229	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-14.9	-168.8	-53.5	-161.6	126.3	0	0	114	Q993 L1053 G1055 Q1060 Y1061	Q993-E1058 PolarHBondContact NE2-OE1 2.97Å; L1053-E1058 HydrophobicContact CD1-CB 3.95Å; G1055-E1058 PolarHBondContact O-N 3.17Å; E1058-Q1060 PolarHBondContact O-N 2.93Å; E1058-Y1061 PolarHBondContact O-N 2.92Å
1059	Q	52.3	Low	65.3	Low	120 Å²	120	67 Å²	67	56%	0.561	36%	0.359	S	S	*	.	H	α-helix	trans	-47.1	-21.8	164.7	-75.8	175.9	-10.7	0	0	113.7	G1055 Y1061 H1062 S1063	G1055-Q1059 PolarHBondContact O-N 3.38Å; G1055-Q1059 VanDerWaalsContact O-N 3.17Å; Q1059-Y1061 PolarHBondContact O-N 2.85Å; Q1059-H1062 PolarHBondContact O-N 3.17Å; Q1059-S1063 PolarHBondContact O-N 3.35Å; Q1059-S1063 VanDerWaalsContact O-N 3.08Å
1060	Q	54.9	Low	65.7	Low	125 Å²	125	63.8 Å²	63.8	58%	0.584	35%	0.347	S	S	*	.	H	α-helix	trans	-61.9	-24.3	175.8	-149.2	-159.9	58.2	0	0	114	E1058 K1064	E1058-Q1060 PolarHBondContact O-N 2.93Å; Q1060-K1064 VanDerWaalsContact O-CD 3.23Å; Q1060-K1064 WeakPolarHBondContact O-CD 3.36Å; Q1060-K1064 WeakPolarHBondContact O-CE 3.33Å; Q1060-K1064 WeakPolarHBondContact O-CG 3.49Å; Q1060-K1064 PolarHBondContact O-N 3.38Å; Q1060-K1064 VanDerWaalsContact OE1-CE 3.24Å
1061	Y	57.2	Low	66.3	Low	105 Å²	105	67 Å²	67	41%	0.412	36%	0.364	S	S	.	.	H	α-helix	trans	-81.4	-42.5	175.3	-71.3	-78.5	0	0	0	112.4	L997 E1058 Q1059 S1063 K1064 I1065	L997-Y1061 HydrophobicContact CD2-CD1 4.49Å; L997-Y1061 HydrophobicContact CD2-CD2 4.41Å; L997-Y1061 HydrophobicContact CD2-CE2 4.45Å; L997-Y1061 HydrophobicContact CD2-CG 4.42Å; E1058-Y1061 PolarHBondContact O-N 2.92Å; Q1059-Y1061 PolarHBondContact O-N 2.85Å; Y1061-S1063 VanDerWaalsContact C-N 3.33Å; Y1061-S1063 PolarHBondContact O-N 3.11Å; Y1061-K1064 HydrophobicContact CD1-CD 4.28Å; Y1061-K1064 PolarHBondContact O-N 3.05Å; Y1061-K1064 VanDerWaalsContact O-N 3.17Å; Y1061-I1065 PolarHBondContact O-N 3.35Å
1062	H	62	Low	67.2	Low	30 Å²	30	67 Å²	67	14%	0.139	36%	0.364	C	S	.	.	H	α-helix	trans	-57.6	-47.5	175	-144.2	-49.8	0	0	0	111.3	S1047 C1051 A1052 Q1059 K1064 I1065 D1066	S1047-H1062 PolarHBondContact O-CE1 3.42Å; S1047-H1062 PolarHBondContact O-NE2 3.08Å; C1051-H1062 PolarHBondContact O-CD2 3.33Å; A1052-H1062 PolarHBondContact N-NE2 3.26Å; Q1059-H1062 PolarHBondContact O-N 3.17Å; H1062-K1064 PolarHBondContact O-N 3.42Å; H1062-I1065 PolarHBondContact O-N 2.97Å; H1062-D1066 IonicContact CE1-OD2 2.68Å; H1062-D1066 PolarHBondContact CE1-OD2 2.96Å; H1062-D1066 IonicContact CG-OD2 2.71Å; H1062-D1066 IonicContact ND1-OD1 2.71Å; H1062-D1066 IonicContact ND1-OD2 3.4Å; H1062-D1066 PolarHBondContact ND1-OD2 2.91Å; H1062-D1066 PolarHBondContact O-N 3.38Å
1063	S	65.4	Low	68.5	Low	62 Å²	62	65 Å²	65	43%	0.434	35%	0.347	S	S	.	.	H	α-helix	trans	-55.7	-48.6	174.5	-167.8	0	0	0	0	111.7	Q1059 Y1061 I1065 D1066 D1067	Q1059-S1063 PolarHBondContact O-N 3.35Å; Q1059-S1063 VanDerWaalsContact O-N 3.08Å; Y1061-S1063 VanDerWaalsContact C-N 3.33Å; Y1061-S1063 PolarHBondContact O-N 3.11Å; S1063-I1065 VanDerWaalsContact C-N 3.27Å; S1063-I1065 PolarHBondContact O-N 3.42Å; S1063-D1066 PolarHBondContact O-N 3.1Å; S1063-D1067 WeakPolarHBondContact O-CB 3.23Å; S1063-D1067 VanDerWaalsContact O-CG 3.24Å; S1063-D1067 PolarHBondContact O-N 3.15Å; S1063-D1067 PolarHBondContact OG-OD2 3.15Å
1064	K	74.3	Confident	70	Confident	88 Å²	88	68.6 Å²	68.6	38%	0.383	36%	0.362	S	S	.	.	H	α-helix	trans	-56.6	-40.1	-178.9	-73.7	161.6	-160.4	159.2	0	112.4	Q1060 Y1061 H1062 L1068	Q1060-K1064 VanDerWaalsContact O-CD 3.23Å; Q1060-K1064 WeakPolarHBondContact O-CD 3.36Å; Q1060-K1064 WeakPolarHBondContact O-CE 3.33Å; Q1060-K1064 WeakPolarHBondContact O-CG 3.49Å; Q1060-K1064 PolarHBondContact O-N 3.38Å; Q1060-K1064 VanDerWaalsContact OE1-CE 3.24Å; Y1061-K1064 HydrophobicContact CD1-CD 4.28Å; Y1061-K1064 PolarHBondContact O-N 3.05Å; Y1061-K1064 VanDerWaalsContact O-N 3.17Å; H1062-K1064 PolarHBondContact O-N 3.42Å; K1064-L1068 WeakPolarHBondContact O-CB 3.16Å; K1064-L1068 PolarHBondContact O-N 2.96Å
1065	I	81.7	Confident	71.9	Confident	8 Å²	8	63.4 Å²	63.4	4%	0.041	33%	0.331	C	S	.	.	H	α-helix	trans	-77.2	-44.3	-179.4	-76.1	179.8	0	0	0	111.7	S1000 Y1061 H1062 S1063 D1067 L1068 I1069	S1000-I1065 VanDerWaalsContact C-CD1 3.49Å; S1000-I1065 VanDerWaalsContact CB-CD1 3.41Å; S1000-I1065 WeakPolarHBondContact O-CD1 3.28Å; S1000-I1065 VanDerWaalsContact OG-CD1 3.27Å; S1000-I1065 WeakPolarHBondContact OG-CD1 3.41Å; Y1061-I1065 PolarHBondContact O-N 3.35Å; H1062-I1065 PolarHBondContact O-N 2.97Å; S1063-I1065 VanDerWaalsContact C-N 3.27Å; S1063-I1065 PolarHBondContact O-N 3.42Å; I1065-D1067 VanDerWaalsContact C-N 3.31Å; I1065-D1067 PolarHBondContact O-N 3.44Å; I1065-L1068 PolarHBondContact O-N 2.96Å; I1065-L1068 VanDerWaalsContact O-N 3.15Å; I1065-I1069 HydrophobicContact CG2-CD1 3.63Å; I1065-I1069 HydrophobicContact CG2-CG1 4.32Å; I1065-I1069 WeakPolarHBondContact O-CB 3.36Å; I1065-I1069 VanDerWaalsContact O-CG1 3.29Å; I1065-I1069 WeakPolarHBondContact O-CG1 3.31Å; I1065-I1069 PolarHBondContact O-N 3.32Å
1066	D	80.8	Confident	73.8	Confident	36 Å²	36	62.4 Å²	62.4	19%	0.193	32%	0.321	C	S	.	.	H	α-helix	trans	-65.4	-37.8	177.7	-64	-32.8	0	0	0	111.3	S1047 H1062 S1063 I1069 D1070	S1047-D1066 WeakPolarHBondContact CB-OD1 3.39Å; S1047-D1066 PolarHBondContact OG-OD1 2.97Å; H1062-D1066 IonicContact CE1-OD2 2.68Å; H1062-D1066 PolarHBondContact CE1-OD2 2.96Å; H1062-D1066 IonicContact CG-OD2 2.71Å; H1062-D1066 IonicContact ND1-OD1 2.71Å; H1062-D1066 IonicContact ND1-OD2 3.4Å; H1062-D1066 PolarHBondContact ND1-OD2 2.91Å; H1062-D1066 PolarHBondContact O-N 3.38Å; S1063-D1066 PolarHBondContact O-N 3.1Å; D1066-I1069 PolarHBondContact O-N 2.8Å; D1066-D1070 WeakPolarHBondContact O-CB 3.16Å; D1066-D1070 PolarHBondContact O-N 2.68Å
1067	D	84.6	Confident	75.9	Confident	80 Å²	80	59.2 Å²	59.2	43%	0.428	29%	0.286	S	S	.	.	H	α-helix	trans	-61	-45.5	169.8	-78	-51.8	0	0	0	111.5	S1063 I1065 N1071	S1063-D1067 WeakPolarHBondContact O-CB 3.23Å; S1063-D1067 VanDerWaalsContact O-CG 3.24Å; S1063-D1067 PolarHBondContact O-N 3.15Å; S1063-D1067 PolarHBondContact OG-OD2 3.15Å; I1065-D1067 VanDerWaalsContact C-N 3.31Å; I1065-D1067 PolarHBondContact O-N 3.44Å; D1067-N1071 WeakPolarHBondContact O-CB 3.4Å; D1067-N1071 PolarHBondContact O-N 3.16Å; D1067-N1071 PolarHBondContact O-ND2 3.36Å
1068	L	86.7	Confident	78	Confident	38 Å²	38	53 Å²	53	20%	0.199	26%	0.264	C	S	.	.	H	α-helix	trans	-66.9	-37.4	179.3	173.7	138.5	0	0	0	112.4	E1004 V1007 K1064 I1065 S1072	E1004-L1068 HydrophobicContact CG-CD1 3.71Å; E1004-L1068 HydrophobicContact CG-CD2 3.88Å; E1004-L1068 HydrophobicContact CG-CG 4.45Å; E1004-L1068 WeakPolarHBondContact OE1-CD1 3.42Å; V1007-L1068 HydrophobicContact CB-CD2 3.95Å; V1007-L1068 HydrophobicContact CG1-CD2 3.51Å; K1064-L1068 WeakPolarHBondContact O-CB 3.16Å; K1064-L1068 PolarHBondContact O-N 2.96Å; I1065-L1068 PolarHBondContact O-N 2.96Å; I1065-L1068 VanDerWaalsContact O-N 3.15Å; L1068-S1072 VanDerWaalsContact O-CB 3.25Å; L1068-S1072 WeakPolarHBondContact O-CB 3.26Å; L1068-S1072 PolarHBondContact O-N 2.85Å; L1068-S1072 PolarHBondContact O-OG 2.86Å
1069	I	86.6	Confident	79.9	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-68.2	-51.9	173.8	-68.1	166.1	0	0	0	109.9	V1007 A1043 K1044 I1065 D1066 N1071 S1072 V1073	V1007-I1069 HydrophobicContact CG1-CG1 4.42Å; V1007-I1069 HydrophobicContact CG2-CD1 4.32Å; V1007-I1069 HydrophobicContact CG2-CG1 3.73Å; A1043-I1069 HydrophobicContact CB-CD1 4.39Å; K1044-I1069 HydrophobicContact CB-CG2 3.84Å; K1044-I1069 HydrophobicContact CD-CG2 4.42Å; K1044-I1069 HydrophobicContact CG-CG2 4.07Å; I1065-I1069 HydrophobicContact CG2-CD1 3.63Å; I1065-I1069 HydrophobicContact CG2-CG1 4.32Å; I1065-I1069 WeakPolarHBondContact O-CB 3.36Å; I1065-I1069 VanDerWaalsContact O-CG1 3.29Å; I1065-I1069 WeakPolarHBondContact O-CG1 3.31Å; I1065-I1069 PolarHBondContact O-N 3.32Å; D1066-I1069 PolarHBondContact O-N 2.8Å; I1069-N1071 VanDerWaalsContact C-N 3.3Å; I1069-N1071 PolarHBondContact O-N 3.34Å; I1069-S1072 PolarHBondContact O-N 3.34Å; I1069-S1072 VanDerWaalsContact O-N 3.16Å; I1069-V1073 HydrophobicContact CG2-CG2 4.39Å; I1069-V1073 WeakPolarHBondContact O-CG2 3.5Å; I1069-V1073 PolarHBondContact O-N 2.81Å
1070	D	87.2	Confident	81.7	Confident	43 Å²	43	48.4 Å²	48.4	23%	0.23	24%	0.244	C	C	.	.	H	α-helix	trans	-63.7	-35.2	-179.2	-98.2	-12.4	0	0	0	112.3	K1044 D1066 K1074	K1044-D1070 IonicContact NZ-OD1 3.42Å; K1044-D1070 PolarHBondContact NZ-OD1 2.71Å; K1044-D1070 IonicContact NZ-OD2 2.75Å; K1044-D1070 PolarHBondContact NZ-OD2 3.3Å; D1066-D1070 WeakPolarHBondContact O-CB 3.16Å; D1066-D1070 PolarHBondContact O-N 2.68Å; D1070-K1074 WeakPolarHBondContact O-CB 3.47Å; D1070-K1074 VanDerWaalsContact O-CD 3.26Å; D1070-K1074 WeakPolarHBondContact O-CD 3.32Å; D1070-K1074 VanDerWaalsContact O-CE 3.23Å; D1070-K1074 WeakPolarHBondContact O-CE 3.19Å; D1070-K1074 WeakPolarHBondContact O-CG 3.41Å; D1070-K1074 PolarHBondContact O-N 2.95Å
1071	N	88.5	Confident	83.4	Confident	70 Å²	70	42.6 Å²	42.6	37%	0.374	22%	0.217	S	C	.	.	H	α-helix	trans	-69.4	-44	173.5	-67.2	-28.1	0	0	0	111.3	D1067 I1069 V1073 K1074 E1075	D1067-N1071 WeakPolarHBondContact O-CB 3.4Å; D1067-N1071 PolarHBondContact O-N 3.16Å; D1067-N1071 PolarHBondContact O-ND2 3.36Å; I1069-N1071 VanDerWaalsContact C-N 3.3Å; I1069-N1071 PolarHBondContact O-N 3.34Å; N1071-V1073 VanDerWaalsContact C-N 3.33Å; N1071-V1073 PolarHBondContact O-N 2.97Å; N1071-K1074 PolarHBondContact O-N 2.87Å; N1071-K1074 PolarHBondContact OD1-NZ 3.44Å; N1071-E1075 WeakPolarHBondContact O-CB 3.39Å; N1071-E1075 VanDerWaalsContact O-CG 3.32Å; N1071-E1075 WeakPolarHBondContact O-CG 3.35Å; N1071-E1075 PolarHBondContact O-N 3.25Å
1072	S	88.7	Confident	84.9	Confident	6 Å²	6	41.2 Å²	41.2	4%	0.042	22%	0.223	C	C	.	.	H	α-helix	trans	-59.4	-40.9	175.1	-61.9	0	0	0	0	112.5	L1068 I1069 I1076	L1068-S1072 VanDerWaalsContact O-CB 3.25Å; L1068-S1072 WeakPolarHBondContact O-CB 3.26Å; L1068-S1072 PolarHBondContact O-N 2.85Å; L1068-S1072 PolarHBondContact O-OG 2.86Å; I1069-S1072 PolarHBondContact O-N 3.34Å; I1069-S1072 VanDerWaalsContact O-N 3.16Å; S1072-I1076 VanDerWaalsContact O-CB 3.28Å; S1072-I1076 WeakPolarHBondContact O-CB 3.28Å; S1072-I1076 WeakPolarHBondContact O-CG1 3.35Å; S1072-I1076 PolarHBondContact O-N 2.74Å
1073	V	88.9	Confident	86.2	Confident	4 Å²	4	40.7 Å²	40.7	2%	0.024	22%	0.22	C	C	.	.	H	α-helix	trans	-68.5	-44.1	176.1	174.3	0	0	0	0	111.6	F1037 L1040 I1069 N1071 E1075 I1076 I1077 Y1152	F1037-V1073 HydrophobicContact CZ-CG1 4.12Å; L1040-V1073 HydrophobicContact CB-CG2 3.94Å; L1040-V1073 HydrophobicContact CD1-CG2 4.48Å; I1069-V1073 HydrophobicContact CG2-CG2 4.39Å; I1069-V1073 WeakPolarHBondContact O-CG2 3.5Å; I1069-V1073 PolarHBondContact O-N 2.81Å; N1071-V1073 VanDerWaalsContact C-N 3.33Å; N1071-V1073 PolarHBondContact O-N 2.97Å; V1073-E1075 VanDerWaalsContact C-N 3.34Å; V1073-E1075 PolarHBondContact O-N 2.86Å; V1073-I1076 PolarHBondContact O-N 3.33Å; V1073-I1077 HydrophobicContact CG1-CD1 4.05Å; V1073-I1077 WeakPolarHBondContact O-CG1 3.42Å; V1073-I1077 PolarHBondContact O-N 3.29Å; V1073-Y1152 HydrophobicContact CG1-CD1 3.67Å; V1073-Y1152 HydrophobicContact CG1-CE1 3.76Å; V1073-Y1152 HydrophobicContact CG1-CG 4.44Å
1074	K	89.1	Confident	87.4	Confident	108 Å²	108	37.9 Å²	37.9	47%	0.47	20%	0.2	S	C	.	.	H	α-helix	trans	-58.2	-44.7	173.9	-71	160.6	-148.5	158.3	0	111.6	D1070 N1071 I1077 S1078	D1070-K1074 WeakPolarHBondContact O-CB 3.47Å; D1070-K1074 VanDerWaalsContact O-CD 3.26Å; D1070-K1074 WeakPolarHBondContact O-CD 3.32Å; D1070-K1074 VanDerWaalsContact O-CE 3.23Å; D1070-K1074 WeakPolarHBondContact O-CE 3.19Å; D1070-K1074 WeakPolarHBondContact O-CG 3.41Å; D1070-K1074 PolarHBondContact O-N 2.95Å; N1071-K1074 PolarHBondContact O-N 2.87Å; N1071-K1074 PolarHBondContact OD1-NZ 3.44Å; K1074-I1077 PolarHBondContact O-N 2.97Å; K1074-S1078 WeakPolarHBondContact O-CB 3.23Å; K1074-S1078 PolarHBondContact O-N 2.99Å
1075	E	88.7	Confident	88.2	Confident	75 Å²	75	34.3 Å²	34.3	35%	0.35	19%	0.186	S	C	.	.	H	α-helix	trans	-65.7	-40.8	178.6	-72.7	175	95.1	0	0	111.5	R1011 N1071 V1073 S1078 L1079	R1011-E1075 IonicContact CZ-OE1 3.36Å; R1011-E1075 IonicContact CZ-OE2 3.77Å; R1011-E1075 VanDerWaalsContact NH1-CD 3.26Å; R1011-E1075 IonicContact NH1-OE1 3.23Å; R1011-E1075 PolarHBondContact NH1-OE1 2.91Å; R1011-E1075 IonicContact NH1-OE2 3.97Å; R1011-E1075 PolarHBondContact NH1-OE2 2.74Å; R1011-E1075 VanDerWaalsContact NH2-CD 3.33Å; R1011-E1075 IonicContact NH2-OE1 3.35Å; R1011-E1075 PolarHBondContact NH2-OE1 2.68Å; R1011-E1075 IonicContact NH2-OE2 2.68Å; N1071-E1075 WeakPolarHBondContact O-CB 3.39Å; N1071-E1075 VanDerWaalsContact O-CG 3.32Å; N1071-E1075 WeakPolarHBondContact O-CG 3.35Å; N1071-E1075 PolarHBondContact O-N 3.25Å; V1073-E1075 VanDerWaalsContact C-N 3.34Å; V1073-E1075 PolarHBondContact O-N 2.86Å; E1075-S1078 WeakPolarHBondContact O-CB 3.26Å; E1075-S1078 PolarHBondContact O-N 3.06Å; E1075-L1079 WeakPolarHBondContact O-CB 3.08Å; E1075-L1079 VanDerWaalsContact O-CG 3.26Å; E1075-L1079 WeakPolarHBondContact O-CG 3.4Å; E1075-L1079 PolarHBondContact O-N 3.07Å
1076	I	89.9	Confident	88.5	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-65	-43.1	176.1	-85.7	168.8	0	0	0	112.5	F1014 F1037 L1040 S1072 V1073 S1078 L1079 L1080	F1014-I1076 HydrophobicContact CB-CD1 4.25Å; F1014-I1076 HydrophobicContact CD1-CD1 4.22Å; F1014-I1076 HydrophobicContact CD1-CG1 3.68Å; F1014-I1076 HydrophobicContact CD2-CD1 4.31Å; F1014-I1076 HydrophobicContact CD2-CG1 4.34Å; F1014-I1076 HydrophobicContact CD2-CG2 4.15Å; F1014-I1076 HydrophobicContact CE1-CB 4.22Å; F1014-I1076 HydrophobicContact CE1-CG1 3.83Å; F1014-I1076 HydrophobicContact CE1-CG2 4.04Å; F1014-I1076 HydrophobicContact CE2-CG1 4.46Å; F1014-I1076 HydrophobicContact CE2-CG2 3.61Å; F1014-I1076 HydrophobicContact CG-CD1 4.02Å; F1014-I1076 HydrophobicContact CG-CG1 3.97Å; F1014-I1076 HydrophobicContact CZ-CB 4.25Å; F1014-I1076 HydrophobicContact CZ-CG1 4.25Å; F1014-I1076 HydrophobicContact CZ-CG2 3.58Å; F1037-I1076 HydrophobicContact CD2-CG2 3.53Å; F1037-I1076 HydrophobicContact CE2-CG2 3.76Å; L1040-I1076 HydrophobicContact CD1-CD1 3.25Å; S1072-I1076 VanDerWaalsContact O-CB 3.28Å; S1072-I1076 WeakPolarHBondContact O-CB 3.28Å; S1072-I1076 WeakPolarHBondContact O-CG1 3.35Å; S1072-I1076 PolarHBondContact O-N 2.74Å; V1073-I1076 PolarHBondContact O-N 3.33Å; I1076-S1078 VanDerWaalsContact C-N 3.34Å; I1076-L1079 PolarHBondContact O-N 2.93Å; I1076-L1080 WeakPolarHBondContact O-CB 3.38Å; I1076-L1080 PolarHBondContact O-N 2.77Å
1077	I	90.1	Very high	88.9	Confident	7 Å²	7	33 Å²	33	4%	0.036	18%	0.18	C	C	.	.	H	α-helix	trans	-58.6	-48.4	170.7	-68.6	170.7	0	0	0	109.7	F1037 V1073 K1074 L1079 L1080 V1081 Y1152 L1156	F1037-I1077 HydrophobicContact CE2-CD1 4.5Å; F1037-I1077 HydrophobicContact CE2-CG1 3.75Å; F1037-I1077 HydrophobicContact CZ-CD1 4.17Å; F1037-I1077 HydrophobicContact CZ-CG1 3.91Å; V1073-I1077 HydrophobicContact CG1-CD1 4.05Å; V1073-I1077 WeakPolarHBondContact O-CG1 3.42Å; V1073-I1077 PolarHBondContact O-N 3.29Å; K1074-I1077 PolarHBondContact O-N 2.97Å; I1077-L1079 PolarHBondContact O-N 3.47Å; I1077-L1080 PolarHBondContact O-N 3.05Å; I1077-V1081 HydrophobicContact CG2-CG2 4.24Å; I1077-V1081 WeakPolarHBondContact O-CB 3.48Å; I1077-V1081 VanDerWaalsContact O-CG2 3.29Å; I1077-V1081 WeakPolarHBondContact O-CG2 3.46Å; I1077-V1081 PolarHBondContact O-N 3.35Å; I1077-Y1152 HydrophobicContact CD1-CD1 4.46Å; I1077-L1156 HydrophobicContact CG1-CB 4.4Å; I1077-L1156 HydrophobicContact CG2-CB 4.01Å; I1077-L1156 HydrophobicContact CG2-CG 4.2Å
1078	S	90.1	Very high	89.1	Confident	57 Å²	57	29.1 Å²	29.1	40%	0.399	16%	0.159	S	C	.	.	H	α-helix	trans	-61	-41.6	-179.6	-165.8	0	0	0	0	113.2	K1074 E1075 I1076 S1082	K1074-S1078 WeakPolarHBondContact O-CB 3.23Å; K1074-S1078 PolarHBondContact O-N 2.99Å; E1075-S1078 WeakPolarHBondContact O-CB 3.26Å; E1075-S1078 PolarHBondContact O-N 3.06Å; I1076-S1078 VanDerWaalsContact C-N 3.34Å; S1078-S1082 VanDerWaalsContact O-CB 3.24Å; S1078-S1082 WeakPolarHBondContact O-CB 3.27Å; S1078-S1082 PolarHBondContact O-N 3.07Å
1079	L	89.9	Confident	89.1	Confident	68 Å²	68	32 Å²	32	36%	0.356	17%	0.171	S	C	.	.	H	α-helix	trans	-65	-42.5	175.4	-74.4	168.1	0	0	0	112	F1014 E1015 L1018 E1075 I1076 I1077 S1082 K1083	F1014-L1079 HydrophobicContact CE1-CB 4.32Å; E1015-L1079 HydrophobicContact CG-CD1 3.85Å; L1018-L1079 HydrophobicContact CD2-CB 3.93Å; E1075-L1079 WeakPolarHBondContact O-CB 3.08Å; E1075-L1079 VanDerWaalsContact O-CG 3.26Å; E1075-L1079 WeakPolarHBondContact O-CG 3.4Å; E1075-L1079 PolarHBondContact O-N 3.07Å; I1076-L1079 PolarHBondContact O-N 2.93Å; I1077-L1079 PolarHBondContact O-N 3.47Å; L1079-S1082 PolarHBondContact O-N 2.77Å; L1079-K1083 PolarHBondContact O-N 2.81Å
1080	L	89.6	Confident	89	Confident	4 Å²	4	33.3 Å²	33.3	2%	0.021	19%	0.185	C	C	.	.	H	α-helix	trans	-65.9	-46.3	177.9	-160.4	83.6	0	0	0	111.4	F1014 L1018 I1029 V1033 I1076 I1077 S1082 K1083 F1084 L1143 L1156	F1014-L1080 HydrophobicContact CZ-CD1 4.04Å; L1018-L1080 HydrophobicContact CD1-CD1 4.11Å; L1018-L1080 HydrophobicContact CD2-CD1 4.37Å; I1029-L1080 HydrophobicContact CD1-CD1 3.78Å; I1029-L1080 HydrophobicContact CD1-CD2 3.77Å; I1029-L1080 HydrophobicContact CD1-CG 4.09Å; I1029-L1080 HydrophobicContact CG1-CD1 4.38Å; V1033-L1080 HydrophobicContact CG1-CD1 4.23Å; I1076-L1080 WeakPolarHBondContact O-CB 3.38Å; I1076-L1080 PolarHBondContact O-N 2.77Å; I1077-L1080 PolarHBondContact O-N 3.05Å; L1080-S1082 PolarHBondContact O-N 3.21Å; L1080-K1083 WeakPolarHBondContact O-CB 3.4Å; L1080-K1083 PolarHBondContact O-N 3.2Å; L1080-F1084 HydrophobicContact CD2-CE2 3.98Å; L1080-F1084 HydrophobicContact CD2-CZ 4.24Å; L1080-F1084 HydrophobicContact CG-CE2 4.16Å; L1080-F1084 HydrophobicContact CG-CZ 4.35Å; L1080-F1084 WeakPolarHBondContact O-CG 3.04Å; L1080-F1084 PolarHBondContact O-N 3.22Å; L1080-L1143 HydrophobicContact CD2-CD1 4.21Å; L1080-L1143 HydrophobicContact CD2-CD2 4.23Å; L1080-L1156 HydrophobicContact CD2-CD1 3.72Å; L1080-L1156 HydrophobicContact CD2-CD2 4.33Å; L1080-L1156 HydrophobicContact CD2-CG 4.28Å
1081	V	91	Very high	88.9	Confident	3 Å²	3	31.3 Å²	31.3	2%	0.018	18%	0.175	C	C	.	.	H	α-helix	trans	-59.7	-45.6	174	170.1	0	0	0	0	110.9	I1077 K1083 F1084 V1085 Q1159 W1160	I1077-V1081 HydrophobicContact CG2-CG2 4.24Å; I1077-V1081 WeakPolarHBondContact O-CB 3.48Å; I1077-V1081 VanDerWaalsContact O-CG2 3.29Å; I1077-V1081 WeakPolarHBondContact O-CG2 3.46Å; I1077-V1081 PolarHBondContact O-N 3.35Å; V1081-K1083 VanDerWaalsContact C-N 3.29Å; V1081-K1083 PolarHBondContact O-N 3.29Å; V1081-F1084 PolarHBondContact O-N 2.9Å; V1081-V1085 HydrophobicContact CG1-CG2 4.11Å; V1081-V1085 WeakPolarHBondContact O-CB 3.4Å; V1081-V1085 VanDerWaalsContact O-CG2 3.28Å; V1081-V1085 WeakPolarHBondContact O-CG2 3.17Å; V1081-V1085 PolarHBondContact O-N 2.61Å; V1081-Q1159 HydrophobicContact CG1-CG 4.28Å; V1081-Q1159 HydrophobicContact CG2-CB 4.23Å; V1081-Q1159 HydrophobicContact CG2-CG 4.21Å; V1081-W1160 HydrophobicContact CG1-CB 4.5Å; V1081-W1160 HydrophobicContact CG2-CB 4.02Å
1082	S	89.9	Confident	88.7	Confident	76 Å²	76	28.1 Å²	28.1	53%	0.531	16%	0.158	S	C	.	.	H	α-helix	trans	-58.8	-40.7	175.5	-179.5	0	0	0	0	111.8	S1078 L1079 L1080 V1085 S1086	S1078-S1082 VanDerWaalsContact O-CB 3.24Å; S1078-S1082 WeakPolarHBondContact O-CB 3.27Å; S1078-S1082 PolarHBondContact O-N 3.07Å; L1079-S1082 PolarHBondContact O-N 2.77Å; L1080-S1082 PolarHBondContact O-N 3.21Å; S1082-V1085 PolarHBondContact O-N 2.9Å; S1082-S1086 PolarHBondContact O-N 3Å
1083	K	88.8	Confident	88.5	Confident	20 Å²	20	31.2 Å²	31.2	9%	0.087	18%	0.18	C	C	.	.	H	α-helix	trans	-61.3	-49.1	174.7	-165.4	80.2	-179.3	-155.4	0	111.4	L1018 Q1019 A1021 S1022 L1027 L1079 L1080 V1081 S1086 V1087	L1018-K1083 HydrophobicContact CD1-CB 4.07Å; L1018-K1083 HydrophobicContact CD1-CD 4.18Å; L1018-K1083 HydrophobicContact CD1-CG 3.86Å; L1018-K1083 HydrophobicContact CD2-CB 4.47Å; L1018-K1083 HydrophobicContact CG-CB 4.44Å; L1018-K1083 HydrophobicContact CG-CD 4.34Å; L1018-K1083 HydrophobicContact CG-CG 4.44Å; L1018-K1083 PolarHBondContact O-NZ 3.2Å; Q1019-K1083 PolarHBondContact O-NZ 3.45Å; A1021-K1083 WeakPolarHBondContact O-CE 3.23Å; A1021-K1083 PolarHBondContact O-NZ 2.92Å; S1022-K1083 WeakPolarHBondContact O-CE 3.46Å; L1027-K1083 HydrophobicContact CD2-CG 3.95Å; L1079-K1083 PolarHBondContact O-N 2.81Å; L1080-K1083 WeakPolarHBondContact O-CB 3.4Å; L1080-K1083 PolarHBondContact O-N 3.2Å; V1081-K1083 VanDerWaalsContact C-N 3.29Å; V1081-K1083 PolarHBondContact O-N 3.29Å; K1083-S1086 PolarHBondContact O-N 3.07Å; K1083-S1086 PolarHBondContact O-OG 2.94Å; K1083-V1087 PolarHBondContact O-N 3.1Å
1084	F	91.1	Very high	88.1	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.009	20%	0.197	C	C	.	.	H	α-helix	trans	-62.7	-43.7	178.1	-66.5	-34.6	0	0	0	112.8	L1027 I1029 L1080 V1081 S1086 V1087 L1088 F1135 N1139 L1143 L1156 W1160	L1027-F1084 HydrophobicContact CD2-CD1 4.4Å; I1029-F1084 HydrophobicContact CD1-CE1 3.82Å; I1029-F1084 HydrophobicContact CD1-CE2 4.38Å; I1029-F1084 HydrophobicContact CD1-CZ 3.39Å; I1029-F1084 HydrophobicContact CG1-CE1 4.09Å; I1029-F1084 HydrophobicContact CG1-CZ 4.16Å; L1080-F1084 HydrophobicContact CD2-CE2 3.98Å; L1080-F1084 HydrophobicContact CD2-CZ 4.24Å; L1080-F1084 HydrophobicContact CG-CE2 4.16Å; L1080-F1084 HydrophobicContact CG-CZ 4.35Å; L1080-F1084 WeakPolarHBondContact O-CG 3.04Å; L1080-F1084 PolarHBondContact O-N 3.22Å; V1081-F1084 PolarHBondContact O-N 2.9Å; F1084-S1086 VanDerWaalsContact C-N 3.26Å; F1084-S1086 PolarHBondContact O-N 3.35Å; F1084-V1087 VanDerWaalsContact O-CB 3.32Å; F1084-V1087 WeakPolarHBondContact O-CB 3.21Å; F1084-V1087 PolarHBondContact O-N 2.97Å; F1084-L1088 PolarHBondContact O-N 2.68Å; F1084-F1135 HydrophobicContact CB-CZ 4.31Å; F1084-F1135 HydrophobicContact CD1-CE2 4.23Å; F1084-F1135 AromaticContact CD1-CZ 3.7Å; F1084-F1135 HydrophobicContact CD1-CZ 3.7Å; F1084-F1135 HydrophobicContact CE1-CZ 4.36Å; F1084-F1135 HydrophobicContact CG-CZ 4.36Å; F1084-N1139 HydrophobicContact CE1-CB 3.9Å; F1084-N1139 HydrophobicContact CZ-CB 3.85Å; F1084-L1143 HydrophobicContact CE2-CD1 4.07Å; F1084-L1143 HydrophobicContact CZ-CD1 4Å; F1084-L1156 HydrophobicContact CE2-CD2 4.4Å; F1084-W1160 HydrophobicContact CB-CD2 4.28Å; F1084-W1160 HydrophobicContact CB-CG 4.5Å; F1084-W1160 HydrophobicContact CB-CZ2 3.98Å; F1084-W1160 HydrophobicContact CD1-CH2 4.49Å; F1084-W1160 HydrophobicContact CD1-CZ2 4.26Å; F1084-W1160 AromaticContact CD2-CD2 3.34Å; F1084-W1160 HydrophobicContact CD2-CD2 3.34Å; F1084-W1160 AromaticContact CD2-CE2 3.42Å; F1084-W1160 VanDerWaalsContact CD2-CE2 3.42Å; F1084-W1160 AromaticContact CD2-CE3 3.55Å; F1084-W1160 HydrophobicContact CD2-CE3 3.55Å; F1084-W1160 AromaticContact CD2-CG 3.92Å; F1084-W1160 HydrophobicContact CD2-CG 3.92Å; F1084-W1160 AromaticContact CD2-CH2 3.92Å; F1084-W1160 HydrophobicContact CD2-CH2 3.92Å; F1084-W1160 AromaticContact CD2-CZ2 3.73Å; F1084-W1160 HydrophobicContact CD2-CZ2 3.73Å; F1084-W1160 AromaticContact CD2-CZ3 3.83Å; F1084-W1160 HydrophobicContact CD2-CZ3 3.83Å; F1084-W1160 AromaticContact CD2-NE1 3.94Å; F1084-W1160 HydrophobicContact CE1-CH2 4.33Å; F1084-W1160 AromaticContact CE2-CD2 3.77Å; F1084-W1160 HydrophobicContact CE2-CD2 3.77Å; F1084-W1160 AromaticContact CE2-CE3 3.42Å; F1084-W1160 HydrophobicContact CE2-CE3 3.42Å; F1084-W1160 VanDerWaalsContact CE2-CE3 3.42Å; F1084-W1160 AromaticContact CE2-CH2 3.75Å; F1084-W1160 HydrophobicContact CE2-CH2 3.75Å; F1084-W1160 HydrophobicContact CE2-CZ2 4.06Å; F1084-W1160 AromaticContact CE2-CZ3 3.41Å; F1084-W1160 HydrophobicContact CE2-CZ3 3.41Å; F1084-W1160 VanDerWaalsContact CE2-CZ3 3.41Å; F1084-W1160 HydrophobicContact CG-CD2 4.13Å; F1084-W1160 AromaticContact CG-CE2 3.71Å; F1084-W1160 HydrophobicContact CG-CH2 4.26Å; F1084-W1160 AromaticContact CG-CZ2 3.79Å; F1084-W1160 HydrophobicContact CG-CZ2 3.79Å; F1084-W1160 HydrophobicContact CZ-CE3 4.33Å; F1084-W1160 AromaticContact CZ-CH2 3.92Å; F1084-W1160 HydrophobicContact CZ-CH2 3.92Å; F1084-W1160 HydrophobicContact CZ-CZ2 4.41Å; F1084-W1160 AromaticContact CZ-CZ3 3.87Å; F1084-W1160 HydrophobicContact CZ-CZ3 3.87Å
1085	V	90.2	Very high	87.6	Confident	13 Å²	13	30.2 Å²	30.2	8%	0.079	18%	0.175	C	C	.	.	H	α-helix	trans	-60.8	-36.9	175.7	169.2	0	0	0	0	110.8	V1081 S1082 V1087 L1088 E1089 V1167	V1081-V1085 HydrophobicContact CG1-CG2 4.11Å; V1081-V1085 WeakPolarHBondContact O-CB 3.4Å; V1081-V1085 VanDerWaalsContact O-CG2 3.28Å; V1081-V1085 WeakPolarHBondContact O-CG2 3.17Å; V1081-V1085 PolarHBondContact O-N 2.61Å; S1082-V1085 PolarHBondContact O-N 2.9Å; V1085-V1087 PolarHBondContact O-N 2.95Å; V1085-L1088 CarbonylContact O-C 3.6Å; V1085-L1088 WeakPolarHBondContact O-CA 3.12Å; V1085-L1088 WeakPolarHBondContact O-CB 3.38Å; V1085-L1088 PolarHBondContact O-N 3.37Å; V1085-E1089 HydrophobicContact CG1-CG 4.35Å; V1085-E1089 WeakPolarHBondContact O-CG 3.33Å; V1085-E1089 PolarHBondContact O-N 2.86Å; V1085-V1167 HydrophobicContact CG1-CB 4.34Å; V1085-V1167 HydrophobicContact CG1-CG2 3.51Å
1086	S	88.4	Confident	87.1	Confident	14 Å²	14	28.1 Å²	28.1	10%	0.098	17%	0.168	C	C	.	.	H	α-helix	trans	-65.2	-20.4	174.9	79.9	0	0	0	0	114.3	S1082 K1083 F1084 E1089 G1090	S1082-S1086 PolarHBondContact O-N 3Å; K1083-S1086 PolarHBondContact O-N 3.07Å; K1083-S1086 PolarHBondContact O-OG 2.94Å; F1084-S1086 VanDerWaalsContact C-N 3.26Å; F1084-S1086 PolarHBondContact O-N 3.35Å; S1086-E1089 WeakPolarHBondContact CA-OE2 3.4Å; S1086-G1090 PolarHBondContact O-N 3.44Å; S1086-G1090 VanDerWaalsContact O-N 3.12Å
1087	V	88.3	Confident	86.4	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.012	20%	0.196	C	C	.	.	H	α-helix	trans	-74.7	-40.6	169.5	-179.2	0	0	0	0	110.6	T1025 L1027 K1083 F1084 V1085 G1090 V1091 F1135	T1025-V1087 HydrophobicContact CG2-CG1 3.91Å; L1027-V1087 HydrophobicContact CD2-CG2 3.94Å; K1083-V1087 PolarHBondContact O-N 3.1Å; F1084-V1087 VanDerWaalsContact O-CB 3.32Å; F1084-V1087 WeakPolarHBondContact O-CB 3.21Å; F1084-V1087 PolarHBondContact O-N 2.97Å; V1085-V1087 PolarHBondContact O-N 2.95Å; V1087-G1090 CarbonylContact O-C 3.57Å; V1087-G1090 PolarHBondContact O-N 3.24Å; V1087-V1091 WeakPolarHBondContact O-CG2 3.46Å; V1087-V1091 PolarHBondContact O-N 3.3Å; V1087-F1135 HydrophobicContact CB-CE1 3.93Å; V1087-F1135 HydrophobicContact CB-CE2 4.43Å; V1087-F1135 HydrophobicContact CB-CZ 3.83Å; V1087-F1135 HydrophobicContact CG1-CD1 4.05Å; V1087-F1135 HydrophobicContact CG1-CD2 4.42Å; V1087-F1135 HydrophobicContact CG1-CE1 3.85Å; V1087-F1135 HydrophobicContact CG1-CE2 4.26Å; V1087-F1135 HydrophobicContact CG1-CG 4.33Å; V1087-F1135 HydrophobicContact CG1-CZ 3.97Å; V1087-F1135 HydrophobicContact CG2-CE1 4.44Å; V1087-F1135 HydrophobicContact CG2-CE2 4.13Å; V1087-F1135 HydrophobicContact CG2-CZ 3.83Å
1088	L	88.4	Confident	85.5	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.5	-43.6	173.8	178.1	58.2	0	0	0	111.7	F1084 V1085 G1090 V1091 L1092 Y1132 I1168	F1084-L1088 PolarHBondContact O-N 2.68Å; V1085-L1088 CarbonylContact O-C 3.6Å; V1085-L1088 WeakPolarHBondContact O-CA 3.12Å; V1085-L1088 WeakPolarHBondContact O-CB 3.38Å; V1085-L1088 PolarHBondContact O-N 3.37Å; L1088-G1090 VanDerWaalsContact C-N 3.27Å; L1088-G1090 PolarHBondContact O-N 2.94Å; L1088-V1091 CarbonylContact O-C 3.57Å; L1088-V1091 WeakPolarHBondContact O-CA 3.4Å; L1088-V1091 WeakPolarHBondContact O-CB 3.41Å; L1088-V1091 PolarHBondContact O-N 3.01Å; L1088-L1092 HydrophobicContact CD1-CD1 4.11Å; L1088-L1092 HydrophobicContact CD1-CG 4.19Å; L1088-L1092 HydrophobicContact CG-CD1 3.9Å; L1088-L1092 HydrophobicContact CG-CG 4.44Å; L1088-L1092 WeakPolarHBondContact O-CB 3.31Å; L1088-L1092 WeakPolarHBondContact O-CG 3.29Å; L1088-L1092 PolarHBondContact O-N 2.85Å; L1088-Y1132 HydrophobicContact CB-CE2 3.76Å; L1088-Y1132 HydrophobicContact CD1-CE1 4.06Å; L1088-Y1132 HydrophobicContact CD1-CE2 4.01Å; L1088-Y1132 HydrophobicContact CG-CE2 4.43Å; L1088-I1168 HydrophobicContact CD1-CD1 4.46Å; L1088-I1168 HydrophobicContact CD1-CG1 4.46Å; L1088-I1168 HydrophobicContact CD2-CD1 4.18Å; L1088-I1168 HydrophobicContact CD2-CG1 4.12Å
1089	E	87.4	Confident	84.7	Confident	97 Å²	97	35.5 Å²	35.5	45%	0.453	19%	0.189	S	C	.	.	H	α-helix	trans	-56.9	-41.2	170.9	-68.1	172.6	162.3	0	0	111.3	V1085 S1086 V1091 L1092 S1093 V1167	V1085-E1089 HydrophobicContact CG1-CG 4.35Å; V1085-E1089 WeakPolarHBondContact O-CG 3.33Å; V1085-E1089 PolarHBondContact O-N 2.86Å; S1086-E1089 WeakPolarHBondContact CA-OE2 3.4Å; E1089-V1091 VanDerWaalsContact C-N 3.3Å; E1089-V1091 PolarHBondContact O-N 2.82Å; E1089-L1092 PolarHBondContact O-N 3.42Å; E1089-S1093 VanDerWaalsContact O-CB 3.25Å; E1089-S1093 WeakPolarHBondContact O-CB 3.41Å; E1089-S1093 PolarHBondContact O-N 3.37Å; E1089-V1167 HydrophobicContact CG-CG1 3.82Å
1090	G	85.3	Confident	83.3	Confident	29 Å²	29	38.2 Å²	38.2	30%	0.299	20%	0.2	S	C	.	.	H	α-helix	trans	-65	-28	173.8	0	0	0	0	0	114.5	S1086 V1087 L1088 K1094	S1086-G1090 PolarHBondContact O-N 3.44Å; S1086-G1090 VanDerWaalsContact O-N 3.12Å; V1087-G1090 CarbonylContact O-C 3.57Å; V1087-G1090 PolarHBondContact O-N 3.24Å; L1088-G1090 VanDerWaalsContact C-N 3.27Å; L1088-G1090 PolarHBondContact O-N 2.94Å; G1090-K1094 WeakPolarHBondContact O-CG 3.48Å; G1090-K1094 PolarHBondContact O-N 3.5Å
1091	V	84.3	Confident	81.8	Confident	2 Å²	2	42 Å²	42	1%	0.012	24%	0.24	C	C	.	.	H	α-helix	trans	-76.7	-44.9	171.4	167.3	0	0	0	0	110.8	T1025 V1087 L1088 E1089 S1093 K1094 L1095 L1128 Y1132 I1191	T1025-V1091 HydrophobicContact CG2-CG2 3.88Å; V1087-V1091 WeakPolarHBondContact O-CG2 3.46Å; V1087-V1091 PolarHBondContact O-N 3.3Å; L1088-V1091 CarbonylContact O-C 3.57Å; L1088-V1091 WeakPolarHBondContact O-CA 3.4Å; L1088-V1091 WeakPolarHBondContact O-CB 3.41Å; L1088-V1091 PolarHBondContact O-N 3.01Å; E1089-V1091 VanDerWaalsContact C-N 3.3Å; E1089-V1091 PolarHBondContact O-N 2.82Å; V1091-S1093 VanDerWaalsContact C-N 3.32Å; V1091-S1093 PolarHBondContact O-N 3.17Å; V1091-K1094 WeakPolarHBondContact O-CB 3.45Å; V1091-K1094 PolarHBondContact O-N 3.49Å; V1091-K1094 VanDerWaalsContact O-N 3.08Å; V1091-L1095 HydrophobicContact CG1-CD1 4.12Å; V1091-L1095 PolarHBondContact O-N 3.44Å; V1091-L1128 HydrophobicContact CG1-CD1 4.27Å; V1091-L1128 HydrophobicContact CG1-CD2 4.2Å; V1091-L1128 HydrophobicContact CG1-CG 4.02Å; V1091-L1128 HydrophobicContact CG2-CD1 4.21Å; V1091-Y1132 HydrophobicContact CG2-CD2 3.99Å; V1091-Y1132 HydrophobicContact CG2-CG 4.43Å; V1091-I1191 HydrophobicContact CG1-CD1 4.08Å
1092	L	85	Confident	80.2	Confident	3 Å²	3	44 Å²	44	2%	0.016	25%	0.252	C	S	.	.	H	α-helix	trans	-66	-32.1	178	-68.4	167.7	0	0	0	112.6	L1088 E1089 L1095 S1096 V1167 I1168 W1171 L1188	L1088-L1092 HydrophobicContact CD1-CD1 4.11Å; L1088-L1092 HydrophobicContact CD1-CG 4.19Å; L1088-L1092 HydrophobicContact CG-CD1 3.9Å; L1088-L1092 HydrophobicContact CG-CG 4.44Å; L1088-L1092 WeakPolarHBondContact O-CB 3.31Å; L1088-L1092 WeakPolarHBondContact O-CG 3.29Å; L1088-L1092 PolarHBondContact O-N 2.85Å; E1089-L1092 PolarHBondContact O-N 3.42Å; L1092-L1095 HydrophobicContact CD2-CD1 4.25Å; L1092-L1095 PolarHBondContact O-N 2.72Å; L1092-S1096 PolarHBondContact O-N 2.96Å; L1092-V1167 HydrophobicContact CD1-CG1 3.76Å; L1092-I1168 HydrophobicContact CD1-CG1 4.3Å; L1092-W1171 HydrophobicContact CB-CG 4.17Å; L1092-W1171 HydrophobicContact CD1-CB 4.27Å; L1092-W1171 HydrophobicContact CD1-CG 4.35Å; L1092-W1171 HydrophobicContact CD2-CD2 4.01Å; L1092-W1171 HydrophobicContact CD2-CE3 4.45Å; L1092-W1171 HydrophobicContact CD2-CG 4.05Å; L1092-W1171 HydrophobicContact CG-CG 4.43Å; L1092-W1171 PolarHBondContact O-NE1 3.48Å; L1092-W1171 VanDerWaalsContact O-NE1 3.16Å; L1092-L1188 HydrophobicContact CD2-CD2 3.62Å
1093	S	83.6	Confident	78.3	Confident	71 Å²	71	48.9 Å²	48.9	50%	0.497	26%	0.264	S	S	.	.	H	α-helix	trans	-73.6	-21.7	171.8	176.9	0	0	0	0	113.6	E1089 V1091 S1096	E1089-S1093 VanDerWaalsContact O-CB 3.25Å; E1089-S1093 WeakPolarHBondContact O-CB 3.41Å; E1089-S1093 PolarHBondContact O-N 3.37Å; V1091-S1093 VanDerWaalsContact C-N 3.32Å; V1091-S1093 PolarHBondContact O-N 3.17Å; S1093-S1096 PolarHBondContact O-OG 2.94Å
1094	K	81.1	Confident	76.5	Confident	90 Å²	90	53.9 Å²	53.9	39%	0.391	29%	0.286	S	S	.	.	H	α-helix	trans	-76.6	-34	165.4	-69.2	166.7	-175.9	178.2	0	110.9	G1090 V1091 R1097 L1128	G1090-K1094 WeakPolarHBondContact O-CG 3.48Å; G1090-K1094 PolarHBondContact O-N 3.5Å; V1091-K1094 WeakPolarHBondContact O-CB 3.45Å; V1091-K1094 PolarHBondContact O-N 3.49Å; V1091-K1094 VanDerWaalsContact O-N 3.08Å; K1094-R1097 WeakPolarHBondContact O-CB 3.33Å; K1094-R1097 WeakPolarHBondContact O-CG 3.28Å; K1094-L1128 HydrophobicContact CB-CD2 4.09Å; K1094-L1128 HydrophobicContact CD-CD1 4.02Å
1095	L	78.9	Confident	74.5	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-73.5	-33.1	179	-73.1	164	0	0	0	113.7	V1091 L1092 R1097 Y1098 L1128 W1171 Y1183 Q1184 T1187 L1188	V1091-L1095 HydrophobicContact CG1-CD1 4.12Å; V1091-L1095 PolarHBondContact O-N 3.44Å; L1092-L1095 HydrophobicContact CD2-CD1 4.25Å; L1092-L1095 PolarHBondContact O-N 2.72Å; L1095-R1097 PolarHBondContact O-N 2.83Å; L1095-R1097 VanDerWaalsContact O-N 3.11Å; L1095-Y1098 WeakPolarHBondContact O-CD2 3.38Å; L1095-Y1098 PolarHBondContact O-N 2.98Å; L1095-Y1098 VanDerWaalsContact O-N 3.15Å; L1095-L1128 HydrophobicContact CD2-CD2 4.15Å; L1095-L1128 HydrophobicContact CG-CD2 4Å; L1095-W1171 HydrophobicContact CB-CZ2 4.14Å; L1095-Y1183 HydrophobicContact CD2-CD1 4.44Å; L1095-Y1183 HydrophobicContact CD2-CE1 3.87Å; L1095-Q1184 PolarHBondContact O-NE2 2.91Å; L1095-T1187 HydrophobicContact CD1-CG2 3.97Å; L1095-T1187 HydrophobicContact CD2-CG2 3.92Å; L1095-L1188 HydrophobicContact CD1-CD2 4.36Å
1096	S	78.1	Confident	72.5	Confident	31 Å²	31	58.7 Å²	58.7	22%	0.217	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-65.5	-11.3	175.6	58.7	0	0	0	0	114.3	L1092 S1093 Y1098 D1099 R1175	L1092-S1096 PolarHBondContact O-N 2.96Å; S1093-S1096 PolarHBondContact O-OG 2.94Å; S1096-Y1098 PolarHBondContact O-N 3.24Å; S1096-Y1098 VanDerWaalsContact O-N 3.11Å; S1096-D1099 WeakPolarHBondContact CA-OD2 3.46Å; S1096-D1099 VanDerWaalsContact CB-OD2 3.29Å; S1096-D1099 WeakPolarHBondContact CB-OD2 3.24Å; S1096-D1099 WeakPolarHBondContact O-CB 3.41Å; S1096-D1099 PolarHBondContact O-N 2.85Å; S1096-R1175 VanDerWaalsContact CB-NH2 3.33Å
1097	R	75	Confident	70.7	Confident	153 Å²	153	62.5 Å²	62.5	58%	0.577	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-67.8	-4.3	171	-57.8	-179.3	-180	-159.8	-3.3	114.1	K1094 L1095 T1102	K1094-R1097 WeakPolarHBondContact O-CB 3.33Å; K1094-R1097 WeakPolarHBondContact O-CG 3.28Å; L1095-R1097 PolarHBondContact O-N 2.83Å; L1095-R1097 VanDerWaalsContact O-N 3.11Å; R1097-T1102 PolarHBondContact O-OG1 3.21Å
1098	Y	70.5	Confident	68.9	Low	44 Å²	44	64.8 Å²	64.8	17%	0.173	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-112.4	5.2	178	-60.7	-96.7	0	0	0	112.3	L1095 S1096 L1108 H1181 Y1183	L1095-Y1098 WeakPolarHBondContact O-CD2 3.38Å; L1095-Y1098 PolarHBondContact O-N 2.98Å; L1095-Y1098 VanDerWaalsContact O-N 3.15Å; S1096-Y1098 PolarHBondContact O-N 3.24Å; S1096-Y1098 VanDerWaalsContact O-N 3.11Å; Y1098-L1108 HydrophobicContact CD1-CD1 4.33Å; Y1098-L1108 HydrophobicContact CE1-CD1 3.74Å; Y1098-H1181 AromaticContact CD1-CE1 4Å; Y1098-H1181 AromaticContact CD1-ND1 3.9Å; Y1098-Y1183 AromaticContact CD1-CD1 3.88Å; Y1098-Y1183 HydrophobicContact CD1-CD1 3.88Å; Y1098-Y1183 AromaticContact CD2-CD1 3.96Å; Y1098-Y1183 HydrophobicContact CD2-CD1 3.96Å; Y1098-Y1183 HydrophobicContact CD2-CE1 4Å; Y1098-Y1183 AromaticContact CE1-CD1 3.7Å; Y1098-Y1183 HydrophobicContact CE1-CD1 3.7Å; Y1098-Y1183 HydrophobicContact CE1-CE1 4.11Å; Y1098-Y1183 AromaticContact CE2-CD1 3.81Å; Y1098-Y1183 HydrophobicContact CE2-CD1 3.81Å; Y1098-Y1183 AromaticContact CE2-CE1 3.52Å; Y1098-Y1183 HydrophobicContact CE2-CE1 3.52Å; Y1098-Y1183 HydrophobicContact CG-CD1 4Å; Y1098-Y1183 AromaticContact CZ-CD1 3.67Å; Y1098-Y1183 AromaticContact CZ-CE1 3.57Å
1099	D	73.6	Confident	66.8	Low	23 Å²	23	70 Å²	70	12%	0.123	39%	0.387	C	S	.	.	S	Bend	trans	-62.1	147.7	174.8	-64	-21.4	0	0	0	110.5	S1096 T1102 R1175 Q1184	S1096-D1099 WeakPolarHBondContact CA-OD2 3.46Å; S1096-D1099 VanDerWaalsContact CB-OD2 3.29Å; S1096-D1099 WeakPolarHBondContact CB-OD2 3.24Å; S1096-D1099 WeakPolarHBondContact O-CB 3.41Å; S1096-D1099 PolarHBondContact O-N 2.85Å; D1099-T1102 HydrophobicContact CB-CG2 4.16Å; D1099-T1102 WeakPolarHBondContact O-CB 3.29Å; D1099-T1102 WeakPolarHBondContact O-CG2 3.44Å; D1099-T1102 PolarHBondContact O-N 3.42Å; D1099-T1102 PolarHBondContact O-OG1 2.9Å; D1099-R1175 IonicContact OD1-CZ 2.68Å; D1099-R1175 IonicContact OD1-NE 2.71Å; D1099-R1175 PolarHBondContact OD1-NE 3.4Å; D1099-R1175 IonicContact OD1-NH2 3.68Å; D1099-R1175 IonicContact OD2-CZ 2.72Å; D1099-R1175 IonicContact OD2-NE 2.96Å; D1099-R1175 PolarHBondContact OD2-NE 2.87Å; D1099-R1175 VanDerWaalsContact OD2-NE 3.11Å; D1099-R1175 IonicContact OD2-NH2 3.72Å; D1099-R1175 PolarHBondContact OD2-NH2 3.24Å; D1099-Q1184 PolarHBondContact OD1-NE2 3Å
1100	E	60.1	Low	64.6	Low	126 Å²	126	74.2 Å²	74.2	59%	0.589	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	144.2	179.3	-63.2	-158.9	122.5	0	0	112	T1102	E1100-T1102 VanDerWaalsContact C-N 3.3Å; E1100-T1102 PolarHBondContact O-N 3.01Å
1101	G	59.5	Low	62.7	Low	84 Å²	84	76.1 Å²	76.1	87%	0.866	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.6	-7.2	-172.9	0	0	0	0	0	115.7
1102	T	57.2	Low	60.9	Low	43 Å²	43	81 Å²	81	26%	0.264	44%	0.44	S	S	.	.	S	Bend	trans	-78.7	149	173.5	64.2	0	0	0	0	112.9	R1097 D1099 E1100 F1104 S1105	R1097-T1102 PolarHBondContact O-OG1 3.21Å; D1099-T1102 HydrophobicContact CB-CG2 4.16Å; D1099-T1102 WeakPolarHBondContact O-CB 3.29Å; D1099-T1102 WeakPolarHBondContact O-CG2 3.44Å; D1099-T1102 PolarHBondContact O-N 3.42Å; D1099-T1102 PolarHBondContact O-OG1 2.9Å; E1100-T1102 VanDerWaalsContact C-N 3.3Å; E1100-T1102 PolarHBondContact O-N 3.01Å; T1102-F1104 PolarHBondContact O-N 2.87Å; T1102-S1105 PolarHBondContact O-N 3.09Å; T1102-S1105 VanDerWaalsContact O-N 3.16Å; T1102-S1105 PolarHBondContact O-OG 3.44Å; T1102-S1105 VanDerWaalsContact O-OG 3.06Å
1103	F	49.8	Very low	58.8	Low	179 Å²	179	91 Å²	91	79%	0.785	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-19.7	-178	-114.7	-81.3	0	0	0	115.3	I1107	F1103-I1107 WeakPolarHBondContact O-CD1 3.31Å
1104	F	50.9	Low	56.9	Low	125 Å²	125	91.9 Å²	91.9	55%	0.548	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-25.3	-177.6	-71.8	-80.1	0	0	0	114	T1102 S1106 I1107 L1108	T1102-F1104 PolarHBondContact O-N 2.87Å; F1104-S1106 VanDerWaalsContact C-N 3.33Å; F1104-S1106 PolarHBondContact O-N 3.29Å; F1104-I1107 PolarHBondContact O-N 3.26Å; F1104-L1108 PolarHBondContact O-N 2.81Å
1105	S	48.5	Very low	55	Low	31 Å²	31	90.9 Å²	90.9	22%	0.217	50%	0.503	C	S	.	.	H	α-helix	trans	-64.1	-40	-178.9	67.4	0	0	0	0	111.6	T1102	T1102-S1105 PolarHBondContact O-N 3.09Å; T1102-S1105 VanDerWaalsContact O-N 3.16Å; T1102-S1105 PolarHBondContact O-OG 3.44Å; T1102-S1105 VanDerWaalsContact O-OG 3.06Å
1106	S	48.6	Very low	53.3	Low	85 Å²	85	95.5 Å²	95.5	59%	0.594	54%	0.542	S	S	*	.	H	α-helix	trans	-71.4	-32	-178.5	-24.3	0	0	0	0	113.4	F1104	F1104-S1106 VanDerWaalsContact C-N 3.33Å; F1104-S1106 PolarHBondContact O-N 3.29Å
1107	I	50	Low	51.6	Low	95 Å²	95	102.3 Å²	102.3	49%	0.487	57%	0.567	S	S	.	*	H	α-helix	trans	-81.5	-36.4	-173.6	-64.2	177.1	0	0	0	111.5	F1103 F1104 T1111	F1103-I1107 WeakPolarHBondContact O-CD1 3.31Å; F1104-I1107 PolarHBondContact O-N 3.26Å; I1107-T1111 HydrophobicContact CG2-CG2 4.46Å; I1107-T1111 WeakPolarHBondContact O-CG2 3.24Å; I1107-T1111 PolarHBondContact O-N 3.46Å; I1107-T1111 PolarHBondContact O-OG1 3.49Å
1108	L	50.2	Low	50.1	Low	49 Å²	49	104.5 Å²	104.5	26%	0.257	58%	0.577	S	S	.	*	H	α-helix	trans	-75.3	-31.7	-177.1	-78.7	164.7	0	0	0	113.3	Y1098 F1104 F1110 V1112 P1124	Y1098-L1108 HydrophobicContact CD1-CD1 4.33Å; Y1098-L1108 HydrophobicContact CE1-CD1 3.74Å; F1104-L1108 PolarHBondContact O-N 2.81Å; L1108-F1110 VanDerWaalsContact C-N 3.26Å; L1108-F1110 PolarHBondContact O-N 2.81Å; L1108-V1112 WeakPolarHBondContact O-CG2 3.33Å; L1108-P1124 HydrophobicContact CD2-CG 4.41Å
1109	S	45.7	Very low	48.4	Very low	110 Å²	110	108.6 Å²	108.6	77%	0.769	61%	0.606	S	S	*	*	H	α-helix	trans	-62.7	-32.1	175.6	-174.4	0	0	0	0	112.8
1110	F	40	Very low	46.9	Very low	186 Å²	186	115.3 Å²	115.3	82%	0.816	64%	0.642	S	S	*	*	H	α-helix	trans	-94.1	-25.8	-173.4	-146.4	-95.1	0	0	0	115	L1108	L1108-F1110 VanDerWaalsContact C-N 3.26Å; L1108-F1110 PolarHBondContact O-N 2.81Å
1111	T	46.8	Very low	45.6	Very low	69 Å²	69	113.9 Å²	113.9	42%	0.423	64%	0.642	S	S	.	*	H	α-helix	trans	-92	-22	-169	46.6	0	0	0	0	115	I1107 K1113 A1114	I1107-T1111 HydrophobicContact CG2-CG2 4.46Å; I1107-T1111 WeakPolarHBondContact O-CG2 3.24Å; I1107-T1111 PolarHBondContact O-N 3.46Å; I1107-T1111 PolarHBondContact O-OG1 3.49Å; T1111-K1113 VanDerWaalsContact C-N 3.28Å; T1111-K1113 PolarHBondContact O-N 3.09Å; T1111-A1114 PolarHBondContact O-N 3.21Å
1112	V	45.5	Very low	44.4	Very low	104 Å²	104	115.3 Å²	115.3	63%	0.63	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-23.9	-172.1	170.6	0	0	0	0	114.2	L1108	L1108-V1112 WeakPolarHBondContact O-CG2 3.33Å
1113	K	42.2	Very low	43.4	Very low	214 Å²	214	122.2 Å²	122.2	93%	0.93	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-7.5	-179.9	-86.1	177.9	176.4	168.1	0	115.7	T1111	T1111-K1113 VanDerWaalsContact C-N 3.28Å; T1111-K1113 PolarHBondContact O-N 3.09Å
1114	A	42.1	Very low	42.9	Very low	89 Å²	89	117.9 Å²	117.9	74%	0.736	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.8	-30.5	-171	0	0	0	0	0	115.5	T1111	T1111-A1114 PolarHBondContact O-N 3.21Å
1115	A	41.8	Very low	43	Very low	68 Å²	68	112.8 Å²	112.8	56%	0.562	64%	0.635	S	S	*	*			trans	-88.9	-3	-166.9	0	0	0	0	0	115.9	K1117	A1115-K1117 PolarHBondContact O-N 2.99Å
1116	A	43.4	Very low	43.1	Very low	98 Å²	98	118.6 Å²	118.6	81%	0.81	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	34	-165.3	0	0	0	0	0	116.2
1117	K	42	Very low	43.9	Very low	173 Å²	173	119.9 Å²	119.9	75%	0.752	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.4	-16	-175.8	-150.9	165.1	-173.1	174.6	0	117.6	A1115	A1115-K1117 PolarHBondContact O-N 2.99Å
1118	Y	44.2	Very low	45.2	Very low	200 Å²	200	116.5 Å²	116.5	78%	0.784	64%	0.644	S	S	*	*	S	Bend	trans	-146	138.6	175.2	-63.4	-76.5	0	0	0	110.1
1119	V	35.3	Very low	46.5	Very low	130 Å²	130	114.3 Å²	114.3	79%	0.788	63%	0.633	S	S	*	*	S	Bend	trans	71.6	129.6	-166.9	-170.8	0	0	0	0	113.4	V1121	V1119-V1121 HydrophobicContact CG1-CG2 4.18Å; V1119-V1121 PolarHBondContact O-N 3.3Å
1120	D	40.3	Very low	48.3	Very low	163 Å²	163	111.3 Å²	111.3	87%	0.872	61%	0.608	S	S	*	*			trans	-84.6	89.2	179.8	-160.3	2	0	0	0	109.9
1121	V	33.6	Very low	50.3	Low	97 Å²	97	104.4 Å²	104.4	59%	0.588	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-91	125.8	-178.5	-179.7	0	0	0	0	109.4	V1119 K1123	V1119-V1121 HydrophobicContact CG1-CG2 4.18Å; V1119-V1121 PolarHBondContact O-N 3.3Å; V1121-K1123 PolarHBondContact O-N 2.93Å
1122	P	34	Very low	52.3	Low	114 Å²	114	101.2 Å²	101.2	74%	0.74	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-53.5	126.5	177.2	-28	35.5	0	0	0	112.3
1123	K	36.4	Very low	54.3	Low	187 Å²	187	96.4 Å²	96.4	81%	0.813	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-56.7	129.2	-176.9	-68.9	177	-178.8	172	0	111	V1121 G1125	V1121-K1123 PolarHBondContact O-N 2.93Å; K1123-G1125 PolarHBondContact O-N 2.82Å; K1123-G1125 VanDerWaalsContact O-N 3.13Å
1124	P	40	Very low	56.4	Low	88 Å²	88	91 Å²	91	57%	0.571	51%	0.511	S	S	*	.	S	Bend	trans	-61.8	115.5	174.8	-25.3	35.2	0	0	0	113.1	L1108 M1126	L1108-P1124 HydrophobicContact CD2-CG 4.41Å; P1124-M1126 PolarHBondContact O-N 3.07Å
1125	G	52.6	Low	58.8	Low	19 Å²	19	86.8 Å²	86.8	20%	0.196	48%	0.476	C	S	.	.	S	Bend	trans	98.7	-42.2	145.2	0	0	0	0	0	119.4	K1123 D1127 L1128 Y1183	K1123-G1125 PolarHBondContact O-N 2.82Å; K1123-G1125 VanDerWaalsContact O-N 3.13Å; G1125-D1127 PolarHBondContact O-N 3.17Å; G1125-L1128 PolarHBondContact O-N 3.34Å; G1125-L1128 VanDerWaalsContact O-N 3.16Å; G1125-Y1183 VanDerWaalsContact C-CE2 3.41Å; G1125-Y1183 WeakPolarHBondContact CA-OH 3.42Å; G1125-Y1183 WeakPolarHBondContact O-CE2 3.11Å; G1125-Y1183 PolarHBondContact O-OH 2.94Å
1126	M	49.9	Very low	61.1	Low	153 Å²	153	83.6 Å²	83.6	75%	0.754	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-16.4	-161.6	-89.8	-161.3	-70.3	0	0	117.5	P1124	P1124-M1126 PolarHBondContact O-N 3.07Å
1127	D	66.6	Low	63.3	Low	112 Å²	112	83.8 Å²	83.8	60%	0.599	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-34.9	-179.9	-152.6	-26.6	0	0	0	113.6	G1125 A1129 D1130 T1131	G1125-D1127 PolarHBondContact O-N 3.17Å; D1127-A1129 VanDerWaalsContact C-N 3.27Å; D1127-A1129 CarbonylContact O-C 3.59Å; D1127-A1129 PolarHBondContact O-N 3.36Å; D1127-D1130 PolarHBondContact O-N 3.24Å; D1127-T1131 PolarHBondContact O-N 3.28Å; D1127-T1131 PolarHBondContact O-OG1 3.12Å; D1127-T1131 PolarHBondContact OD1-OG1 3.37Å
1128	L	76.1	Confident	65.6	Low	24 Å²	24	79.1 Å²	79.1	13%	0.126	41%	0.41	C	S	.	.	H	α-helix	trans	-56.8	-34.1	-163.3	-175.6	63.2	0	0	0	114.7	V1091 K1094 L1095 G1125 Y1132 Y1183	V1091-L1128 HydrophobicContact CG1-CD1 4.27Å; V1091-L1128 HydrophobicContact CG1-CD2 4.2Å; V1091-L1128 HydrophobicContact CG1-CG 4.02Å; V1091-L1128 HydrophobicContact CG2-CD1 4.21Å; K1094-L1128 HydrophobicContact CB-CD2 4.09Å; K1094-L1128 HydrophobicContact CD-CD1 4.02Å; L1095-L1128 HydrophobicContact CD2-CD2 4.15Å; L1095-L1128 HydrophobicContact CG-CD2 4Å; G1125-L1128 PolarHBondContact O-N 3.34Å; G1125-L1128 VanDerWaalsContact O-N 3.16Å; L1128-Y1132 PolarHBondContact O-N 3.35Å; L1128-Y1183 WeakPolarHBondContact CB-OH 3.28Å
1129	A	79	Confident	67.8	Low	3 Å²	3	69.6 Å²	69.6	3%	0.025	37%	0.373	C	S	.	.	H	α-helix	trans	-67.2	-50.1	172.4	0	0	0	0	0	111.9	D1127 T1131 Y1132 I1133 T1187 K1190 I1191	D1127-A1129 VanDerWaalsContact C-N 3.27Å; D1127-A1129 CarbonylContact O-C 3.59Å; D1127-A1129 PolarHBondContact O-N 3.36Å; A1129-T1131 VanDerWaalsContact C-N 3.35Å; A1129-T1131 PolarHBondContact O-N 3.24Å; A1129-Y1132 PolarHBondContact O-N 3.23Å; A1129-I1133 HydrophobicContact CB-CD1 4.21Å; A1129-I1133 WeakPolarHBondContact O-CD1 3.22Å; A1129-I1133 VanDerWaalsContact O-CG1 3.28Å; A1129-I1133 WeakPolarHBondContact O-CG1 3.32Å; A1129-I1133 PolarHBondContact O-N 3Å; A1129-T1187 HydrophobicContact CB-CG2 3.82Å; A1129-K1190 HydrophobicContact CB-CB 4.21Å; A1129-K1190 HydrophobicContact CB-CD 3.82Å; A1129-K1190 HydrophobicContact CB-CG 4.02Å; A1129-I1191 HydrophobicContact CB-CD1 4.5Å; A1129-I1191 HydrophobicContact CB-CG1 3.99Å
1130	D	81.7	Confident	70.4	Confident	46 Å²	46	63.4 Å²	63.4	25%	0.246	34%	0.336	C	S	.	.	H	α-helix	trans	-69	-34.3	-177.4	-70.7	-40.3	0	0	0	111.4	D1127 Y1132 I1133 M1134 K1190 K1194	D1127-D1130 PolarHBondContact O-N 3.24Å; D1130-Y1132 VanDerWaalsContact C-N 3.31Å; D1130-Y1132 PolarHBondContact O-N 2.85Å; D1130-I1133 PolarHBondContact O-N 3.32Å; D1130-M1134 WeakPolarHBondContact O-CB 3.42Å; D1130-M1134 WeakPolarHBondContact O-CG 3.29Å; D1130-M1134 PolarHBondContact O-N 2.99Å; D1130-K1190 VanDerWaalsContact CG-CE 3.45Å; D1130-K1190 VanDerWaalsContact CG-NZ 3.31Å; D1130-K1190 WeakPolarHBondContact OD1-CE 3.48Å; D1130-K1190 IonicContact OD1-NZ 3.34Å; D1130-K1190 PolarHBondContact OD1-NZ 2.7Å; D1130-K1190 VanDerWaalsContact OD2-CE 3.25Å; D1130-K1190 WeakPolarHBondContact OD2-CE 3.38Å; D1130-K1190 IonicContact OD2-NZ 2.9Å; D1130-K1190 PolarHBondContact OD2-NZ 3.45Å; D1130-K1194 IonicContact OD1-NZ 3.89Å; D1130-K1194 PolarHBondContact OD1-NZ 2.99Å
1131	T	83.7	Confident	72.7	Confident	42 Å²	42	59.7 Å²	59.7	26%	0.258	32%	0.315	S	S	.	.	H	α-helix	trans	-60.5	-39.8	171.5	-27.4	0	0	0	0	111.9	D1127 A1129 F1135	D1127-T1131 PolarHBondContact O-N 3.28Å; D1127-T1131 PolarHBondContact O-OG1 3.12Å; D1127-T1131 PolarHBondContact OD1-OG1 3.37Å; A1129-T1131 VanDerWaalsContact C-N 3.35Å; A1129-T1131 PolarHBondContact O-N 3.24Å; T1131-F1135 WeakPolarHBondContact O-CB 3.4Å; T1131-F1135 PolarHBondContact O-N 3.21Å; T1131-F1135 VanDerWaalsContact O-N 3.09Å
1132	Y	87.4	Confident	75.4	Confident	1 Å²	1	56.6 Å²	56.6	0%	0.004	30%	0.296	C	S	.	.	H	α-helix	trans	-71.1	-39.8	175.4	180	-98.5	0	0	0	112.5	T1025 L1088 V1091 L1128 A1129 D1130 F1135 V1136 I1191	T1025-Y1132 HydrophobicContact CG2-CD2 4.37Å; L1088-Y1132 HydrophobicContact CB-CE2 3.76Å; L1088-Y1132 HydrophobicContact CD1-CE1 4.06Å; L1088-Y1132 HydrophobicContact CD1-CE2 4.01Å; L1088-Y1132 HydrophobicContact CG-CE2 4.43Å; V1091-Y1132 HydrophobicContact CG2-CD2 3.99Å; V1091-Y1132 HydrophobicContact CG2-CG 4.43Å; L1128-Y1132 PolarHBondContact O-N 3.35Å; A1129-Y1132 PolarHBondContact O-N 3.23Å; D1130-Y1132 VanDerWaalsContact C-N 3.31Å; D1130-Y1132 PolarHBondContact O-N 2.85Å; Y1132-F1135 AromaticContact CD2-CD1 3.78Å; Y1132-F1135 HydrophobicContact CD2-CD1 3.78Å; Y1132-F1135 HydrophobicContact CD2-CE1 4.31Å; Y1132-F1135 AromaticContact CE2-CD1 3.65Å; Y1132-F1135 HydrophobicContact CE2-CD1 3.65Å; Y1132-F1135 AromaticContact CE2-CE1 3.76Å; Y1132-F1135 HydrophobicContact CE2-CE1 3.76Å; Y1132-F1135 VanDerWaalsContact O-CB 3.29Å; Y1132-F1135 WeakPolarHBondContact O-CB 3.36Å; Y1132-F1135 PolarHBondContact O-N 3.01Å; Y1132-V1136 HydrophobicContact CD1-CG2 4.17Å; Y1132-V1136 HydrophobicContact CE1-CG2 3.55Å; Y1132-V1136 HydrophobicContact CE2-CG2 4.34Å; Y1132-V1136 WeakPolarHBondContact O-CG2 3.48Å; Y1132-V1136 PolarHBondContact O-N 2.86Å; Y1132-I1191 HydrophobicContact CD1-CD1 4.23Å; Y1132-I1191 HydrophobicContact CD1-CG1 4.16Å; Y1132-I1191 HydrophobicContact CD1-CG2 3.94Å; Y1132-I1191 HydrophobicContact CE1-CG2 3.98Å
1133	I	87.9	Confident	78	Confident	3 Å²	3	51.4 Å²	51.4	2%	0.015	26%	0.261	C	S	.	.	H	α-helix	trans	-68.7	-38.8	178.9	-69.1	144.8	0	0	0	111	A1129 D1130 F1135 V1136 R1137 K1190 I1191 K1194	A1129-I1133 HydrophobicContact CB-CD1 4.21Å; A1129-I1133 WeakPolarHBondContact O-CD1 3.22Å; A1129-I1133 VanDerWaalsContact O-CG1 3.28Å; A1129-I1133 WeakPolarHBondContact O-CG1 3.32Å; A1129-I1133 PolarHBondContact O-N 3Å; D1130-I1133 PolarHBondContact O-N 3.32Å; I1133-F1135 VanDerWaalsContact C-N 3.32Å; I1133-F1135 PolarHBondContact O-N 2.72Å; I1133-V1136 PolarHBondContact O-N 3.45Å; I1133-R1137 WeakPolarHBondContact O-CG 3.5Å; I1133-R1137 PolarHBondContact O-N 3.36Å; I1133-K1190 HydrophobicContact CD1-CG 4.29Å; I1133-I1191 HydrophobicContact CD1-CG1 4.37Å; I1133-K1194 HydrophobicContact CD1-CB 3.91Å; I1133-K1194 HydrophobicContact CD1-CD 3.68Å; I1133-K1194 HydrophobicContact CD1-CG 4.15Å; I1133-K1194 HydrophobicContact CG1-CB 4.03Å; I1133-K1194 HydrophobicContact CG1-CD 4.29Å; I1133-K1194 HydrophobicContact CG2-CB 4.14Å; I1133-K1194 HydrophobicContact CG2-CD 3.86Å
1134	M	87.4	Confident	80.5	Confident	102 Å²	102	46.4 Å²	46.4	50%	0.502	24%	0.238	S	C	.	.	H	α-helix	trans	-64	-36.2	170.7	-73.9	-178.1	65.9	0	0	112.2	D1130 Q1138	D1130-M1134 WeakPolarHBondContact O-CB 3.42Å; D1130-M1134 WeakPolarHBondContact O-CG 3.29Å; D1130-M1134 PolarHBondContact O-N 2.99Å; M1134-Q1138 VanDerWaalsContact O-CB 3.29Å; M1134-Q1138 WeakPolarHBondContact O-CB 3.32Å; M1134-Q1138 VanDerWaalsContact O-CG 3.31Å; M1134-Q1138 WeakPolarHBondContact O-CG 3.36Å; M1134-Q1138 PolarHBondContact O-N 2.73Å
1135	F	91.8	Very high	82.7	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.5	-45.9	171.6	156.9	-100	0	0	0	112.3	T1025 L1027 F1084 V1087 T1131 Y1132 I1133 N1139 W1160	T1025-F1135 HydrophobicContact CG2-CB 4.44Å; T1025-F1135 WeakPolarHBondContact O-CB 3.42Å; L1027-F1135 HydrophobicContact CB-CD2 4.38Å; L1027-F1135 HydrophobicContact CB-CE2 3.93Å; L1027-F1135 HydrophobicContact CD2-CE2 4.14Å; L1027-F1135 HydrophobicContact CG-CE2 4.19Å; L1027-F1135 WeakPolarHBondContact O-CD2 3.14Å; F1084-F1135 HydrophobicContact CB-CZ 4.31Å; F1084-F1135 HydrophobicContact CD1-CE2 4.23Å; F1084-F1135 AromaticContact CD1-CZ 3.7Å; F1084-F1135 HydrophobicContact CD1-CZ 3.7Å; F1084-F1135 HydrophobicContact CE1-CZ 4.36Å; F1084-F1135 HydrophobicContact CG-CZ 4.36Å; V1087-F1135 HydrophobicContact CB-CE1 3.93Å; V1087-F1135 HydrophobicContact CB-CE2 4.43Å; V1087-F1135 HydrophobicContact CB-CZ 3.83Å; V1087-F1135 HydrophobicContact CG1-CD1 4.05Å; V1087-F1135 HydrophobicContact CG1-CD2 4.42Å; V1087-F1135 HydrophobicContact CG1-CE1 3.85Å; V1087-F1135 HydrophobicContact CG1-CE2 4.26Å; V1087-F1135 HydrophobicContact CG1-CG 4.33Å; V1087-F1135 HydrophobicContact CG1-CZ 3.97Å; V1087-F1135 HydrophobicContact CG2-CE1 4.44Å; V1087-F1135 HydrophobicContact CG2-CE2 4.13Å; V1087-F1135 HydrophobicContact CG2-CZ 3.83Å; T1131-F1135 WeakPolarHBondContact O-CB 3.4Å; T1131-F1135 PolarHBondContact O-N 3.21Å; T1131-F1135 VanDerWaalsContact O-N 3.09Å; Y1132-F1135 AromaticContact CD2-CD1 3.78Å; Y1132-F1135 HydrophobicContact CD2-CD1 3.78Å; Y1132-F1135 HydrophobicContact CD2-CE1 4.31Å; Y1132-F1135 AromaticContact CE2-CD1 3.65Å; Y1132-F1135 HydrophobicContact CE2-CD1 3.65Å; Y1132-F1135 AromaticContact CE2-CE1 3.76Å; Y1132-F1135 HydrophobicContact CE2-CE1 3.76Å; Y1132-F1135 VanDerWaalsContact O-CB 3.29Å; Y1132-F1135 WeakPolarHBondContact O-CB 3.36Å; Y1132-F1135 PolarHBondContact O-N 3.01Å; I1133-F1135 VanDerWaalsContact C-N 3.32Å; I1133-F1135 PolarHBondContact O-N 2.72Å; F1135-N1139 VanDerWaalsContact CD2-ND2 3.33Å; F1135-N1139 WeakPolarHBondContact CD2-ND2 3.47Å; F1135-N1139 WeakPolarHBondContact CE2-ND2 3.24Å; F1135-N1139 PolarHBondContact O-N 2.76Å; F1135-N1139 PolarHBondContact O-ND2 2.94Å; F1135-W1160 HydrophobicContact CE1-CZ2 4.15Å; F1135-W1160 HydrophobicContact CZ-CZ2 4.43Å
1136	V	89.9	Confident	84.3	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.4	-58.7	176.7	169.3	0	0	0	0	110	Y1132 I1133 Q1138 N1139 Q1140 W1160 F1199	Y1132-V1136 HydrophobicContact CD1-CG2 4.17Å; Y1132-V1136 HydrophobicContact CE1-CG2 3.55Å; Y1132-V1136 HydrophobicContact CE2-CG2 4.34Å; Y1132-V1136 WeakPolarHBondContact O-CG2 3.48Å; Y1132-V1136 PolarHBondContact O-N 2.86Å; I1133-V1136 PolarHBondContact O-N 3.45Å; V1136-Q1138 PolarHBondContact O-N 2.93Å; V1136-N1139 PolarHBondContact O-N 3.38Å; V1136-Q1140 HydrophobicContact CG1-CG 4.33Å; V1136-Q1140 WeakPolarHBondContact O-CG 3.05Å; V1136-Q1140 PolarHBondContact O-N 3Å; V1136-W1160 HydrophobicContact CB-CH2 4.45Å; V1136-W1160 HydrophobicContact CB-CZ2 4.39Å; V1136-W1160 HydrophobicContact CG1-CH2 4.26Å; V1136-W1160 HydrophobicContact CG1-CZ2 4.37Å; V1136-W1160 HydrophobicContact CG2-CZ2 4.02Å; V1136-F1199 HydrophobicContact CG1-CD2 4.35Å; V1136-F1199 HydrophobicContact CG1-CE2 3.58Å; V1136-F1199 HydrophobicContact CG1-CZ 4.12Å
1137	R	89.7	Confident	86	Confident	103 Å²	103	44.7 Å²	44.7	39%	0.389	21%	0.214	S	C	.	.	H	α-helix	trans	-55.1	-54.9	-177.3	-68.8	171.6	179.6	-151.5	-10.2	112.2	I1133 N1139 Q1140 D1141 D1198	I1133-R1137 WeakPolarHBondContact O-CG 3.5Å; I1133-R1137 PolarHBondContact O-N 3.36Å; R1137-N1139 PolarHBondContact O-N 3.23Å; R1137-N1139 VanDerWaalsContact O-N 3.1Å; R1137-Q1140 WeakPolarHBondContact O-CA 3.35Å; R1137-Q1140 WeakPolarHBondContact O-CB 3.44Å; R1137-Q1140 PolarHBondContact O-N 3Å; R1137-D1141 PolarHBondContact O-N 2.9Å; R1137-D1141 VanDerWaalsContact O-OD2 3.11Å; R1137-D1198 IonicContact CZ-OD1 2.68Å; R1137-D1198 IonicContact CZ-OD2 3.68Å; R1137-D1198 VanDerWaalsContact NE-CG 3.33Å; R1137-D1198 IonicContact NE-OD1 3.06Å; R1137-D1198 PolarHBondContact NE-OD1 3.46Å; R1137-D1198 IonicContact NE-OD2 2.74Å; R1137-D1198 PolarHBondContact NE-OD2 2.67Å; R1137-D1198 IonicContact NH2-OD1 2.71Å; R1137-D1198 PolarHBondContact NH2-OD1 3.47Å; R1137-D1198 IonicContact NH2-OD2 2.68Å; R1137-D1198 PolarHBondContact NH2-OD2 3.38Å
1138	Q	89.6	Confident	86.8	Confident	74 Å²	74	43.1 Å²	43.1	35%	0.346	21%	0.206	S	C	.	.	H	α-helix	trans	-65.1	-21.3	-175.8	-68.6	-179.6	-11	0	0	113.7	M1134 V1136 I1142	M1134-Q1138 VanDerWaalsContact O-CB 3.29Å; M1134-Q1138 WeakPolarHBondContact O-CB 3.32Å; M1134-Q1138 VanDerWaalsContact O-CG 3.31Å; M1134-Q1138 WeakPolarHBondContact O-CG 3.36Å; M1134-Q1138 PolarHBondContact O-N 2.73Å; V1136-Q1138 PolarHBondContact O-N 2.93Å; Q1138-I1142 WeakPolarHBondContact O-CB 3.45Å; Q1138-I1142 VanDerWaalsContact O-CD1 3.23Å; Q1138-I1142 WeakPolarHBondContact O-CD1 3.32Å; Q1138-I1142 WeakPolarHBondContact O-CG1 3.49Å; Q1138-I1142 PolarHBondContact O-N 2.98Å
1139	N	90.9	Very high	87.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-87.4	-30.4	170.8	-74.6	-80.4	0	0	0	112.9	L1027 R1028 I1029 F1084 F1135 V1136 R1137 L1143 W1160	L1027-N1139 PolarHBondContact O-ND2 3.1Å; R1028-N1139 WeakPolarHBondContact CA-OD1 3.35Å; I1029-N1139 PolarHBondContact N-OD1 2.86Å; F1084-N1139 HydrophobicContact CE1-CB 3.9Å; F1084-N1139 HydrophobicContact CZ-CB 3.85Å; F1135-N1139 VanDerWaalsContact CD2-ND2 3.33Å; F1135-N1139 WeakPolarHBondContact CD2-ND2 3.47Å; F1135-N1139 WeakPolarHBondContact CE2-ND2 3.24Å; F1135-N1139 PolarHBondContact O-N 2.76Å; F1135-N1139 PolarHBondContact O-ND2 2.94Å; V1136-N1139 PolarHBondContact O-N 3.38Å; R1137-N1139 PolarHBondContact O-N 3.23Å; R1137-N1139 VanDerWaalsContact O-N 3.1Å; N1139-L1143 WeakPolarHBondContact O-CB 3.23Å; N1139-L1143 WeakPolarHBondContact O-CD1 3.22Å; N1139-L1143 VanDerWaalsContact O-CG 3.27Å; N1139-L1143 WeakPolarHBondContact O-CG 3.31Å; N1139-L1143 PolarHBondContact O-N 3.2Å; N1139-L1143 VanDerWaalsContact O-N 3.07Å; N1139-W1160 HydrophobicContact CB-CH2 4.08Å
1140	Q	90.3	Very high	87.3	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-45.9	168.6	-69.4	171	-39.3	0	0	110.9	V1136 R1137 L1143 R1144 F1157 W1160 F1199 Q1202	V1136-Q1140 HydrophobicContact CG1-CG 4.33Å; V1136-Q1140 WeakPolarHBondContact O-CG 3.05Å; V1136-Q1140 PolarHBondContact O-N 3Å; R1137-Q1140 WeakPolarHBondContact O-CA 3.35Å; R1137-Q1140 WeakPolarHBondContact O-CB 3.44Å; R1137-Q1140 PolarHBondContact O-N 3Å; Q1140-L1143 PolarHBondContact O-N 3.41Å; Q1140-R1144 PolarHBondContact O-N 3.3Å; Q1140-F1157 HydrophobicContact CB-CE1 4.19Å; Q1140-F1157 HydrophobicContact CB-CE2 4.47Å; Q1140-F1157 HydrophobicContact CB-CZ 3.8Å; Q1140-F1157 HydrophobicContact CG-CD1 4.43Å; Q1140-F1157 HydrophobicContact CG-CE1 3.84Å; Q1140-F1157 HydrophobicContact CG-CZ 3.89Å; Q1140-W1160 HydrophobicContact CG-CH2 4.27Å; Q1140-W1160 HydrophobicContact CG-CZ3 3.73Å; Q1140-F1199 VanDerWaalsContact NE2-CD1 3.32Å; Q1140-F1199 VanDerWaalsContact NE2-CE1 3.28Å; Q1140-F1199 VanDerWaalsContact NE2-CZ 3.34Å; Q1140-Q1202 HydrophobicContact CB-CG 4.47Å
1141	D	89.1	Confident	87.5	Confident	84 Å²	84	52.6 Å²	52.6	45%	0.449	25%	0.249	S	C	.	.	H	α-helix	trans	-59.8	-49.2	178.2	-58.2	-31.2	0	0	0	111.2	R1137 L1143 R1144 E1145	R1137-D1141 PolarHBondContact O-N 2.9Å; R1137-D1141 VanDerWaalsContact O-OD2 3.11Å; D1141-L1143 VanDerWaalsContact C-N 3.28Å; D1141-L1143 PolarHBondContact O-N 3.49Å; D1141-R1144 PolarHBondContact O-N 3.23Å; D1141-E1145 VanDerWaalsContact O-CB 3.31Å; D1141-E1145 WeakPolarHBondContact O-CB 3.37Å; D1141-E1145 PolarHBondContact O-N 2.75Å
1142	I	89	Confident	87.6	Confident	33 Å²	33	51.6 Å²	51.6	17%	0.169	24%	0.24	C	C	.	.	H	α-helix	trans	-61.6	-34.6	176.9	-72.7	168.9	0	0	0	112.1	R1028 I1029 Q1138 K1146	R1028-I1142 HydrophobicContact CB-CD1 4.19Å; I1029-I1142 HydrophobicContact CB-CG2 4.21Å; I1029-I1142 HydrophobicContact CG2-CG2 4.46Å; Q1138-I1142 WeakPolarHBondContact O-CB 3.45Å; Q1138-I1142 VanDerWaalsContact O-CD1 3.23Å; Q1138-I1142 WeakPolarHBondContact O-CD1 3.32Å; Q1138-I1142 WeakPolarHBondContact O-CG1 3.49Å; Q1138-I1142 PolarHBondContact O-N 2.98Å; I1142-K1146 WeakPolarHBondContact O-CB 3.32Å; I1142-K1146 PolarHBondContact O-N 3.28Å
1143	L	89.3	Confident	87.6	Confident	4 Å²	4	51.8 Å²	51.8	2%	0.021	24%	0.242	C	C	.	.	H	α-helix	trans	-72.5	-42.9	177.2	-77	167.4	0	0	0	111.7	I1029 L1080 F1084 N1139 Q1140 D1141 K1146 V1147 L1156 F1157	I1029-L1143 HydrophobicContact CD1-CD1 3.97Å; I1029-L1143 HydrophobicContact CD1-CD2 3.88Å; I1029-L1143 HydrophobicContact CD1-CG 3.94Å; L1080-L1143 HydrophobicContact CD2-CD1 4.21Å; L1080-L1143 HydrophobicContact CD2-CD2 4.23Å; F1084-L1143 HydrophobicContact CE2-CD1 4.07Å; F1084-L1143 HydrophobicContact CZ-CD1 4Å; N1139-L1143 WeakPolarHBondContact O-CB 3.23Å; N1139-L1143 WeakPolarHBondContact O-CD1 3.22Å; N1139-L1143 VanDerWaalsContact O-CG 3.27Å; N1139-L1143 WeakPolarHBondContact O-CG 3.31Å; N1139-L1143 PolarHBondContact O-N 3.2Å; N1139-L1143 VanDerWaalsContact O-N 3.07Å; Q1140-L1143 PolarHBondContact O-N 3.41Å; D1141-L1143 VanDerWaalsContact C-N 3.28Å; D1141-L1143 PolarHBondContact O-N 3.49Å; L1143-K1146 PolarHBondContact O-N 3.44Å; L1143-V1147 HydrophobicContact CD2-CG2 4Å; L1143-V1147 WeakPolarHBondContact O-CB 3.34Å; L1143-V1147 PolarHBondContact O-N 2.92Å; L1143-L1156 HydrophobicContact CD1-CD1 4.21Å; L1143-L1156 HydrophobicContact CD1-CD2 3.78Å; L1143-L1156 HydrophobicContact CD2-CD1 4.31Å; L1143-F1157 HydrophobicContact CB-CE1 4.35Å; L1143-F1157 HydrophobicContact CB-CZ 4.24Å; L1143-F1157 HydrophobicContact CD1-CE1 3.91Å
1144	R	88	Confident	87.5	Confident	83 Å²	83	55.4 Å²	55.4	31%	0.313	26%	0.258	S	S	.	.	H	α-helix	trans	-66.4	-37.7	174.7	-79.8	-165.1	179.8	-86.4	-9.5	113.8	Q1140 D1141 K1146 E1150 I1153 F1157 Q1202	Q1140-R1144 PolarHBondContact O-N 3.3Å; D1141-R1144 PolarHBondContact O-N 3.23Å; R1144-K1146 VanDerWaalsContact C-N 3.27Å; R1144-K1146 PolarHBondContact O-N 2.79Å; R1144-E1150 IonicContact CZ-OE1 2.62Å; R1144-E1150 IonicContact NH1-OE1 3.45Å; R1144-E1150 PolarHBondContact NH1-OE1 3.03Å; R1144-E1150 IonicContact NH2-OE1 2.7Å; R1144-I1153 HydrophobicContact CG-CG2 4.17Å; R1144-F1157 HydrophobicContact CG-CE2 4.27Å; R1144-Q1202 VanDerWaalsContact CD-OE1 3.27Å; R1144-Q1202 PolarHBondContact NH2-O 2.9Å
1145	E	86.1	Confident	87.5	Confident	137 Å²	137	54.5 Å²	54.5	64%	0.64	25%	0.252	S	S	*	.	H	α-helix	trans	-68.5	-26.7	179.7	-175.2	-165.4	-165.3	0	0	112.3	D1141	D1141-E1145 VanDerWaalsContact O-CB 3.31Å; D1141-E1145 WeakPolarHBondContact O-CB 3.37Å; D1141-E1145 PolarHBondContact O-N 2.75Å
1146	K	86.4	Confident	87.5	Confident	77 Å²	77	54.6 Å²	54.6	34%	0.335	25%	0.252	S	S	.	.	H	α-helix	trans	-132.2	2.1	-162.2	-58.4	-176.5	168.7	117.7	0	115.8	A1031 C1034 N1038 I1142 L1143 R1144	A1031-K1146 HydrophobicContact CB-CD 4.31Å; C1034-K1146 HydrophobicContact CB-CB 3.82Å; C1034-K1146 WeakPolarHBondContact CB-O 3.39Å; N1038-K1146 PolarHBondContact ND2-O 3.47Å; I1142-K1146 WeakPolarHBondContact O-CB 3.32Å; I1142-K1146 PolarHBondContact O-N 3.28Å; L1143-K1146 PolarHBondContact O-N 3.44Å; R1144-K1146 VanDerWaalsContact C-N 3.27Å; R1144-K1146 PolarHBondContact O-N 2.79Å
1147	V	86.8	Confident	87.6	Confident	10 Å²	10	54.6 Å²	54.6	6%	0.061	25%	0.252	C	S	.	.			trans	-109	128	169.9	175.3	0	0	0	0	109.5	C1034 F1037 N1038 L1143 E1149 I1153	C1034-V1147 HydrophobicContact CB-CG2 4.16Å; F1037-V1147 HydrophobicContact CD1-CG1 3.69Å; F1037-V1147 HydrophobicContact CD1-CG2 4.37Å; F1037-V1147 HydrophobicContact CE1-CG1 3.83Å; N1038-V1147 VanDerWaalsContact OD1-CA 3.28Å; N1038-V1147 WeakPolarHBondContact OD1-CA 3.48Å; L1143-V1147 HydrophobicContact CD2-CG2 4Å; L1143-V1147 WeakPolarHBondContact O-CB 3.34Å; L1143-V1147 PolarHBondContact O-N 2.92Å; V1147-E1149 PolarHBondContact O-N 3.47Å; V1147-I1153 HydrophobicContact CB-CD1 3.95Å; V1147-I1153 HydrophobicContact CB-CG1 3.96Å; V1147-I1153 HydrophobicContact CG1-CD1 4.15Å; V1147-I1153 HydrophobicContact CG1-CG1 3.82Å
1148	N	81.9	Confident	87.6	Confident	78 Å²	78	51.3 Å²	51.3	42%	0.417	24%	0.242	S	C	.	.	S	Bend	trans	-82.8	-8.7	-164.5	-68.1	12.5	0	0	0	114.8	N1038	N1038-N1148 PolarHBondContact ND2-OD1 3.28Å; N1038-N1148 VanDerWaalsContact ND2-OD1 3.1Å; N1038-N1148 PolarHBondContact OD1-N 3.11Å
1149	E	82.7	Confident	87.6	Confident	58 Å²	58	51 Å²	51	27%	0.271	24%	0.241	S	C	.	.			trans	-128.7	112.9	-175.2	-80.7	-63.9	154.4	0	0	112.3	V1041 K1045 V1147 M1151 Y1152 I1153	V1041-E1149 HydrophobicContact CG1-CB 3.86Å; V1041-E1149 HydrophobicContact CG1-CG 3.3Å; K1045-E1149 WeakPolarHBondContact CE-OE1 3.26Å; K1045-E1149 IonicContact NZ-OE1 3.14Å; K1045-E1149 PolarHBondContact NZ-OE1 3.24Å; V1147-E1149 PolarHBondContact O-N 3.47Å; E1149-M1151 VanDerWaalsContact C-N 3.33Å; E1149-M1151 PolarHBondContact O-N 2.94Å; E1149-Y1152 HydrophobicContact CB-CD2 3.73Å; E1149-Y1152 HydrophobicContact CB-CE2 4.35Å; E1149-Y1152 HydrophobicContact CG-CD2 4.47Å; E1149-Y1152 PolarHBondContact O-N 3.16Å; E1149-I1153 PolarHBondContact O-N 2.82Å
1150	E	83.2	Confident	87.7	Confident	109 Å²	109	51 Å²	51	51%	0.509	24%	0.241	S	C	.	.	H	α-helix	trans	-61.7	-38	-175.3	-174.1	151	-137.2	0	0	112.8	R1144 Y1152 I1153 E1154	R1144-E1150 IonicContact CZ-OE1 2.62Å; R1144-E1150 IonicContact NH1-OE1 3.45Å; R1144-E1150 PolarHBondContact NH1-OE1 3.03Å; R1144-E1150 IonicContact NH2-OE1 2.7Å; E1150-Y1152 PolarHBondContact O-N 2.9Å; E1150-I1153 WeakPolarHBondContact O-CA 3.4Å; E1150-I1153 WeakPolarHBondContact O-CB 3.46Å; E1150-I1153 PolarHBondContact O-N 2.62Å; E1150-E1154 HydrophobicContact CG-CG 4.27Å; E1150-E1154 WeakPolarHBondContact O-CG 3.45Å; E1150-E1154 PolarHBondContact O-N 3.33Å
1151	M	86.4	Confident	87.8	Confident	105 Å²	105	51 Å²	51	52%	0.517	24%	0.241	S	C	.	.	H	α-helix	trans	-59.8	-21.8	179.7	-161.7	-136	-163	0	0	114.1	E1149 K1155	E1149-M1151 VanDerWaalsContact C-N 3.33Å; E1149-M1151 PolarHBondContact O-N 2.94Å; M1151-K1155 VanDerWaalsContact O-CD 3.24Å; M1151-K1155 WeakPolarHBondContact O-CD 3.25Å; M1151-K1155 WeakPolarHBondContact O-CE 3.06Å; M1151-K1155 VanDerWaalsContact O-CG 3.28Å; M1151-K1155 WeakPolarHBondContact O-CG 3.27Å; M1151-K1155 PolarHBondContact SD-NZ 3.13Å
1152	Y	85.7	Confident	87.9	Confident	21 Å²	21	49.2 Å²	49.2	8%	0.082	24%	0.235	C	C	.	.	H	α-helix	trans	-92.6	-28.4	173.5	-66.3	-71.4	0	0	0	112.6	F1037 V1041 K1044 V1073 I1077 E1149 E1150 K1155 L1156	F1037-Y1152 HydrophobicContact CE1-CG 4.32Å; V1041-Y1152 HydrophobicContact CG1-CD2 4.44Å; V1041-Y1152 HydrophobicContact CG1-CE2 4.3Å; V1041-Y1152 HydrophobicContact CG2-CD2 3.83Å; V1041-Y1152 HydrophobicContact CG2-CE2 3.98Å; V1041-Y1152 HydrophobicContact CG2-CG 4.49Å; K1044-Y1152 WeakPolarHBondContact CD-OH 3.39Å; V1073-Y1152 HydrophobicContact CG1-CD1 3.67Å; V1073-Y1152 HydrophobicContact CG1-CE1 3.76Å; V1073-Y1152 HydrophobicContact CG1-CG 4.44Å; I1077-Y1152 HydrophobicContact CD1-CD1 4.46Å; E1149-Y1152 HydrophobicContact CB-CD2 3.73Å; E1149-Y1152 HydrophobicContact CB-CE2 4.35Å; E1149-Y1152 HydrophobicContact CG-CD2 4.47Å; E1149-Y1152 PolarHBondContact O-N 3.16Å; E1150-Y1152 PolarHBondContact O-N 2.9Å; Y1152-K1155 HydrophobicContact CD1-CD 4.44Å; Y1152-L1156 WeakPolarHBondContact O-CB 3.44Å; Y1152-L1156 PolarHBondContact O-N 2.84Å
1153	I	87.2	Confident	88	Confident	6 Å²	6	49.2 Å²	49.2	3%	0.031	24%	0.238	C	C	.	.	H	α-helix	trans	-65.5	-45.5	172	-61.5	170.6	0	0	0	110	R1144 V1147 E1149 E1150 L1156 F1157	R1144-I1153 HydrophobicContact CG-CG2 4.17Å; V1147-I1153 HydrophobicContact CB-CD1 3.95Å; V1147-I1153 HydrophobicContact CB-CG1 3.96Å; V1147-I1153 HydrophobicContact CG1-CD1 4.15Å; V1147-I1153 HydrophobicContact CG1-CG1 3.82Å; E1149-I1153 PolarHBondContact O-N 2.82Å; E1150-I1153 WeakPolarHBondContact O-CA 3.4Å; E1150-I1153 WeakPolarHBondContact O-CB 3.46Å; E1150-I1153 PolarHBondContact O-N 2.62Å; I1153-L1156 WeakPolarHBondContact O-CB 3.29Å; I1153-L1156 PolarHBondContact O-N 2.68Å; I1153-F1157 HydrophobicContact CG2-CD2 3.72Å; I1153-F1157 HydrophobicContact CG2-CE1 4.31Å; I1153-F1157 HydrophobicContact CG2-CE2 3.28Å; I1153-F1157 HydrophobicContact CG2-CG 4.4Å; I1153-F1157 HydrophobicContact CG2-CZ 3.62Å; I1153-F1157 WeakPolarHBondContact O-CB 3.07Å; I1153-F1157 WeakPolarHBondContact O-CG 3.28Å; I1153-F1157 PolarHBondContact O-N 3.23Å
1154	E	86.9	Confident	88.1	Confident	79 Å²	79	49 Å²	49	37%	0.369	24%	0.237	S	C	.	.	H	α-helix	trans	-55.1	-54.7	175.4	-69.8	175.8	149.5	0	0	111.5	E1150 L1156 F1157 D1158	E1150-E1154 HydrophobicContact CG-CG 4.27Å; E1150-E1154 WeakPolarHBondContact O-CG 3.45Å; E1150-E1154 PolarHBondContact O-N 3.33Å; E1154-L1156 VanDerWaalsContact C-N 3.28Å; E1154-L1156 PolarHBondContact O-N 3.21Å; E1154-F1157 PolarHBondContact O-N 2.81Å; E1154-F1157 VanDerWaalsContact O-N 3.09Å; E1154-D1158 PolarHBondContact O-N 3.45Å
1155	K	87.7	Confident	88.3	Confident	83 Å²	83	45.1 Å²	45.1	36%	0.361	22%	0.222	S	C	.	.	H	α-helix	trans	-57.6	-39.9	178	-69.1	168.6	-169.4	164.8	0	112.8	M1151 Y1152 Q1159	M1151-K1155 VanDerWaalsContact O-CD 3.24Å; M1151-K1155 WeakPolarHBondContact O-CD 3.25Å; M1151-K1155 WeakPolarHBondContact O-CE 3.06Å; M1151-K1155 VanDerWaalsContact O-CG 3.28Å; M1151-K1155 WeakPolarHBondContact O-CG 3.27Å; M1151-K1155 PolarHBondContact SD-NZ 3.13Å; Y1152-K1155 HydrophobicContact CD1-CD 4.44Å; K1155-Q1159 VanDerWaalsContact O-CB 3.31Å; K1155-Q1159 WeakPolarHBondContact O-CB 3.21Å; K1155-Q1159 PolarHBondContact O-N 2.7Å
1156	L	90.1	Very high	88.5	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-65.5	-42.5	177.6	-175.8	168.9	0	0	0	110.6	F1037 I1077 L1080 F1084 L1143 Y1152 I1153 E1154 W1160	F1037-L1156 HydrophobicContact CE2-CD1 4.48Å; I1077-L1156 HydrophobicContact CG1-CB 4.4Å; I1077-L1156 HydrophobicContact CG2-CB 4.01Å; I1077-L1156 HydrophobicContact CG2-CG 4.2Å; L1080-L1156 HydrophobicContact CD2-CD1 3.72Å; L1080-L1156 HydrophobicContact CD2-CD2 4.33Å; L1080-L1156 HydrophobicContact CD2-CG 4.28Å; F1084-L1156 HydrophobicContact CE2-CD2 4.4Å; L1143-L1156 HydrophobicContact CD1-CD1 4.21Å; L1143-L1156 HydrophobicContact CD1-CD2 3.78Å; L1143-L1156 HydrophobicContact CD2-CD1 4.31Å; Y1152-L1156 WeakPolarHBondContact O-CB 3.44Å; Y1152-L1156 PolarHBondContact O-N 2.84Å; I1153-L1156 WeakPolarHBondContact O-CB 3.29Å; I1153-L1156 PolarHBondContact O-N 2.68Å; E1154-L1156 VanDerWaalsContact C-N 3.28Å; E1154-L1156 PolarHBondContact O-N 3.21Å; L1156-W1160 HydrophobicContact CD2-CE3 4.37Å; L1156-W1160 WeakPolarHBondContact O-CB 3.44Å; L1156-W1160 PolarHBondContact O-N 3.25Å
1157	F	92.7	Very high	88.7	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-72	-40.8	177.2	-68.5	-15.1	0	0	0	113.1	Q1140 L1143 R1144 I1153 E1154 Q1159 W1160 Y1161 F1199 Q1202 V1204	Q1140-F1157 HydrophobicContact CB-CE1 4.19Å; Q1140-F1157 HydrophobicContact CB-CE2 4.47Å; Q1140-F1157 HydrophobicContact CB-CZ 3.8Å; Q1140-F1157 HydrophobicContact CG-CD1 4.43Å; Q1140-F1157 HydrophobicContact CG-CE1 3.84Å; Q1140-F1157 HydrophobicContact CG-CZ 3.89Å; L1143-F1157 HydrophobicContact CB-CE1 4.35Å; L1143-F1157 HydrophobicContact CB-CZ 4.24Å; L1143-F1157 HydrophobicContact CD1-CE1 3.91Å; R1144-F1157 HydrophobicContact CG-CE2 4.27Å; I1153-F1157 HydrophobicContact CG2-CD2 3.72Å; I1153-F1157 HydrophobicContact CG2-CE1 4.31Å; I1153-F1157 HydrophobicContact CG2-CE2 3.28Å; I1153-F1157 HydrophobicContact CG2-CG 4.4Å; I1153-F1157 HydrophobicContact CG2-CZ 3.62Å; I1153-F1157 WeakPolarHBondContact O-CB 3.07Å; I1153-F1157 WeakPolarHBondContact O-CG 3.28Å; I1153-F1157 PolarHBondContact O-N 3.23Å; E1154-F1157 PolarHBondContact O-N 2.81Å; E1154-F1157 VanDerWaalsContact O-N 3.09Å; F1157-Q1159 VanDerWaalsContact C-N 3.34Å; F1157-Q1159 PolarHBondContact O-N 3.19Å; F1157-W1160 HydrophobicContact CD1-CE3 4.03Å; F1157-W1160 HydrophobicContact CD1-CZ3 4.46Å; F1157-W1160 HydrophobicContact CE1-CE3 4.26Å; F1157-W1160 HydrophobicContact CE1-CZ3 4.27Å; F1157-W1160 PolarHBondContact O-N 3.41Å; F1157-Y1161 VanDerWaalsContact O-CB 3.31Å; F1157-Y1161 WeakPolarHBondContact O-CB 3.38Å; F1157-Y1161 PolarHBondContact O-N 3.29Å; F1157-F1199 HydrophobicContact CB-CD1 3.98Å; F1157-F1199 HydrophobicContact CB-CE1 3.97Å; F1157-F1199 HydrophobicContact CD1-CE1 4.21Å; F1157-F1199 HydrophobicContact CG-CD1 4.45Å; F1157-F1199 HydrophobicContact CG-CE1 4.23Å; F1157-Q1202 HydrophobicContact CD2-CB 3.93Å; F1157-Q1202 HydrophobicContact CE2-CB 4.08Å; F1157-Q1202 VanDerWaalsContact CE2-OE1 3.28Å; F1157-V1204 HydrophobicContact CB-CG2 3.7Å
1158	D	89.3	Confident	88.8	Confident	34 Å²	34	42.4 Å²	42.4	18%	0.182	21%	0.21	C	C	.	.	H	α-helix	trans	-54.5	-50	170.4	-92.3	-33.2	0	0	0	110.7	E1154 S1162 V1204 T1208	E1154-D1158 PolarHBondContact O-N 3.45Å; D1158-S1162 VanDerWaalsContact O-CB 3.23Å; D1158-S1162 WeakPolarHBondContact O-CB 3.32Å; D1158-S1162 PolarHBondContact O-N 3.43Å; D1158-S1162 PolarHBondContact O-OG 3.16Å; D1158-V1204 WeakPolarHBondContact OD1-CG1 3.25Å; D1158-T1208 HydrophobicContact CB-CG2 4.23Å; D1158-T1208 WeakPolarHBondContact OD1-CB 3.49Å; D1158-T1208 WeakPolarHBondContact OD1-CG2 3.33Å; D1158-T1208 PolarHBondContact OD1-OG1 2.93Å
1159	Q	90.9	Very high	89.1	Confident	68 Å²	68	39.6 Å²	39.6	32%	0.318	20%	0.196	S	C	.	.	H	α-helix	trans	-70	-37.8	-178.7	-170.1	178.7	-19.6	0	0	112	V1081 K1155 F1157 S1163	V1081-Q1159 HydrophobicContact CG1-CG 4.28Å; V1081-Q1159 HydrophobicContact CG2-CB 4.23Å; V1081-Q1159 HydrophobicContact CG2-CG 4.21Å; K1155-Q1159 VanDerWaalsContact O-CB 3.31Å; K1155-Q1159 WeakPolarHBondContact O-CB 3.21Å; K1155-Q1159 PolarHBondContact O-N 2.7Å; F1157-Q1159 VanDerWaalsContact C-N 3.34Å; F1157-Q1159 PolarHBondContact O-N 3.19Å; Q1159-S1163 VanDerWaalsContact O-CB 3.24Å; Q1159-S1163 WeakPolarHBondContact O-CB 3.19Å; Q1159-S1163 PolarHBondContact O-N 3.32Å; Q1159-S1163 PolarHBondContact O-OG 3.16Å
1160	W	92.9	Very high	89.4	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.5	-48.2	176	-173.8	7.4	0	0	0	111.7	V1081 F1084 F1135 V1136 N1139 Q1140 L1156 F1157 S1163 S1164 F1199	V1081-W1160 HydrophobicContact CG1-CB 4.5Å; V1081-W1160 HydrophobicContact CG2-CB 4.02Å; F1084-W1160 HydrophobicContact CB-CD2 4.28Å; F1084-W1160 HydrophobicContact CB-CG 4.5Å; F1084-W1160 HydrophobicContact CB-CZ2 3.98Å; F1084-W1160 HydrophobicContact CD1-CH2 4.49Å; F1084-W1160 HydrophobicContact CD1-CZ2 4.26Å; F1084-W1160 AromaticContact CD2-CD2 3.34Å; F1084-W1160 HydrophobicContact CD2-CD2 3.34Å; F1084-W1160 AromaticContact CD2-CE2 3.42Å; F1084-W1160 VanDerWaalsContact CD2-CE2 3.42Å; F1084-W1160 AromaticContact CD2-CE3 3.55Å; F1084-W1160 HydrophobicContact CD2-CE3 3.55Å; F1084-W1160 AromaticContact CD2-CG 3.92Å; F1084-W1160 HydrophobicContact CD2-CG 3.92Å; F1084-W1160 AromaticContact CD2-CH2 3.92Å; F1084-W1160 HydrophobicContact CD2-CH2 3.92Å; F1084-W1160 AromaticContact CD2-CZ2 3.73Å; F1084-W1160 HydrophobicContact CD2-CZ2 3.73Å; F1084-W1160 AromaticContact CD2-CZ3 3.83Å; F1084-W1160 HydrophobicContact CD2-CZ3 3.83Å; F1084-W1160 AromaticContact CD2-NE1 3.94Å; F1084-W1160 HydrophobicContact CE1-CH2 4.33Å; F1084-W1160 AromaticContact CE2-CD2 3.77Å; F1084-W1160 HydrophobicContact CE2-CD2 3.77Å; F1084-W1160 AromaticContact CE2-CE3 3.42Å; F1084-W1160 HydrophobicContact CE2-CE3 3.42Å; F1084-W1160 VanDerWaalsContact CE2-CE3 3.42Å; F1084-W1160 AromaticContact CE2-CH2 3.75Å; F1084-W1160 HydrophobicContact CE2-CH2 3.75Å; F1084-W1160 HydrophobicContact CE2-CZ2 4.06Å; F1084-W1160 AromaticContact CE2-CZ3 3.41Å; F1084-W1160 HydrophobicContact CE2-CZ3 3.41Å; F1084-W1160 VanDerWaalsContact CE2-CZ3 3.41Å; F1084-W1160 HydrophobicContact CG-CD2 4.13Å; F1084-W1160 AromaticContact CG-CE2 3.71Å; F1084-W1160 HydrophobicContact CG-CH2 4.26Å; F1084-W1160 AromaticContact CG-CZ2 3.79Å; F1084-W1160 HydrophobicContact CG-CZ2 3.79Å; F1084-W1160 HydrophobicContact CZ-CE3 4.33Å; F1084-W1160 AromaticContact CZ-CH2 3.92Å; F1084-W1160 HydrophobicContact CZ-CH2 3.92Å; F1084-W1160 HydrophobicContact CZ-CZ2 4.41Å; F1084-W1160 AromaticContact CZ-CZ3 3.87Å; F1084-W1160 HydrophobicContact CZ-CZ3 3.87Å; F1135-W1160 HydrophobicContact CE1-CZ2 4.15Å; F1135-W1160 HydrophobicContact CZ-CZ2 4.43Å; V1136-W1160 HydrophobicContact CB-CH2 4.45Å; V1136-W1160 HydrophobicContact CB-CZ2 4.39Å; V1136-W1160 HydrophobicContact CG1-CH2 4.26Å; V1136-W1160 HydrophobicContact CG1-CZ2 4.37Å; V1136-W1160 HydrophobicContact CG2-CZ2 4.02Å; N1139-W1160 HydrophobicContact CB-CH2 4.08Å; Q1140-W1160 HydrophobicContact CG-CH2 4.27Å; Q1140-W1160 HydrophobicContact CG-CZ3 3.73Å; L1156-W1160 HydrophobicContact CD2-CE3 4.37Å; L1156-W1160 WeakPolarHBondContact O-CB 3.44Å; L1156-W1160 PolarHBondContact O-N 3.25Å; F1157-W1160 HydrophobicContact CD1-CE3 4.03Å; F1157-W1160 HydrophobicContact CD1-CZ3 4.46Å; F1157-W1160 HydrophobicContact CE1-CE3 4.26Å; F1157-W1160 HydrophobicContact CE1-CZ3 4.27Å; F1157-W1160 PolarHBondContact O-N 3.41Å; W1160-S1163 PolarHBondContact O-N 2.83Å; W1160-S1164 WeakPolarHBondContact O-CB 3.42Å; W1160-S1164 PolarHBondContact O-N 3.03Å; W1160-S1164 PolarHBondContact O-OG 3.33Å; W1160-F1199 HydrophobicContact CB-CE1 4.19Å; W1160-F1199 HydrophobicContact CB-CZ 4.25Å; W1160-F1199 HydrophobicContact CD2-CE1 4.09Å; W1160-F1199 AromaticContact CD2-CZ 3.53Å; W1160-F1199 HydrophobicContact CD2-CZ 3.53Å; W1160-F1199 AromaticContact CE2-CZ 3.97Å; W1160-F1199 AromaticContact CE3-CE1 3.93Å; W1160-F1199 HydrophobicContact CE3-CE1 3.93Å; W1160-F1199 AromaticContact CE3-CZ 3.65Å; W1160-F1199 HydrophobicContact CE3-CZ 3.65Å; W1160-F1199 HydrophobicContact CG-CE1 4.25Å; W1160-F1199 AromaticContact CG-CZ 3.84Å; W1160-F1199 HydrophobicContact CG-CZ 3.84Å; W1160-F1199 HydrophobicContact CZ2-CZ 4.46Å; W1160-F1199 HydrophobicContact CZ3-CZ 4.17Å
1161	Y	92.3	Very high	89.7	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59.9	-51.4	176.5	177.2	-91.4	0	0	0	111.1	F1157 S1163 S1164 M1165 T1195 Y1196 F1199 V1204 T1208 L1209 Y1214	F1157-Y1161 VanDerWaalsContact O-CB 3.31Å; F1157-Y1161 WeakPolarHBondContact O-CB 3.38Å; F1157-Y1161 PolarHBondContact O-N 3.29Å; Y1161-S1163 VanDerWaalsContact C-N 3.32Å; Y1161-S1163 PolarHBondContact O-N 3.02Å; Y1161-S1164 WeakPolarHBondContact O-CB 3.37Å; Y1161-S1164 PolarHBondContact O-N 3.38Å; Y1161-S1164 VanDerWaalsContact O-N 3.16Å; Y1161-M1165 HydrophobicContact CD1-CG 4.36Å; Y1161-M1165 HydrophobicContact CD2-CE 4.21Å; Y1161-M1165 HydrophobicContact CD2-CG 4.48Å; Y1161-M1165 HydrophobicContact CE1-CG 3.84Å; Y1161-M1165 HydrophobicContact CE2-CE 3.41Å; Y1161-M1165 VanDerWaalsContact CE2-CE 3.41Å; Y1161-M1165 HydrophobicContact CE2-CG 3.99Å; Y1161-M1165 PolarHBondContact O-N 3.48Å; Y1161-T1195 HydrophobicContact CD2-CG2 4.2Å; Y1161-T1195 HydrophobicContact CE2-CG2 4.39Å; Y1161-Y1196 WeakPolarHBondContact OH-CD2 3.42Å; Y1161-F1199 HydrophobicContact CD2-CB 3.78Å; Y1161-F1199 AromaticContact CD2-CD2 3.93Å; Y1161-F1199 HydrophobicContact CD2-CD2 3.93Å; Y1161-F1199 AromaticContact CD2-CG 3.86Å; Y1161-F1199 HydrophobicContact CD2-CG 3.86Å; Y1161-F1199 HydrophobicContact CG-CB 4.38Å; Y1161-F1199 HydrophobicContact CG-CG 4.37Å; Y1161-V1204 HydrophobicContact CD1-CG1 4.45Å; Y1161-V1204 HydrophobicContact CG-CG1 4.43Å; Y1161-T1208 HydrophobicContact CD1-CG2 4.23Å; Y1161-T1208 WeakPolarHBondContact CE1-O 3.38Å; Y1161-L1209 HydrophobicContact CD1-CD2 4.49Å; Y1161-L1209 HydrophobicContact CD2-CD2 4.26Å; Y1161-L1209 HydrophobicContact CE1-CD2 4.22Å; Y1161-L1209 WeakPolarHBondContact CE1-O 3.48Å; Y1161-L1209 HydrophobicContact CE2-CD2 3.96Å; Y1161-L1209 PolarHBondContact OH-O 3Å; Y1161-Y1214 VanDerWaalsContact OH-CD2 3.22Å; Y1161-Y1214 WeakPolarHBondContact OH-CD2 3.49Å
1162	S	90.4	Very high	89.6	Confident	46 Å²	46	31.5 Å²	31.5	32%	0.322	16%	0.161	S	C	.	.	H	α-helix	trans	-57.3	-44.1	-179.9	-62.2	0	0	0	0	112.4	D1158 K1166 T1208	D1158-S1162 VanDerWaalsContact O-CB 3.23Å; D1158-S1162 WeakPolarHBondContact O-CB 3.32Å; D1158-S1162 PolarHBondContact O-N 3.43Å; D1158-S1162 PolarHBondContact O-OG 3.16Å; S1162-K1166 WeakPolarHBondContact O-CB 3.33Å; S1162-K1166 PolarHBondContact O-N 3.36Å; S1162-T1208 WeakPolarHBondContact OG-CG2 3.34Å
1163	S	91.5	Very high	89.5	Confident	34 Å²	34	33.8 Å²	33.8	24%	0.238	18%	0.178	C	C	.	.	H	α-helix	trans	-70	-37.5	179.5	-55.3	0	0	0	0	111.8	Q1159 W1160 Y1161 K1166 V1167	Q1159-S1163 VanDerWaalsContact O-CB 3.24Å; Q1159-S1163 WeakPolarHBondContact O-CB 3.19Å; Q1159-S1163 PolarHBondContact O-N 3.32Å; Q1159-S1163 PolarHBondContact O-OG 3.16Å; W1160-S1163 PolarHBondContact O-N 2.83Å; Y1161-S1163 VanDerWaalsContact C-N 3.32Å; Y1161-S1163 PolarHBondContact O-N 3.02Å; S1163-K1166 PolarHBondContact O-N 3.46Å; S1163-V1167 WeakPolarHBondContact O-CG2 3.46Å; S1163-V1167 PolarHBondContact O-N 3.02Å
1164	S	90.3	Very high	89.4	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.8	-47.9	176.6	-59	0	0	0	0	111.6	W1160 Y1161 K1166 V1167 I1168	W1160-S1164 WeakPolarHBondContact O-CB 3.42Å; W1160-S1164 PolarHBondContact O-N 3.03Å; W1160-S1164 PolarHBondContact O-OG 3.33Å; Y1161-S1164 WeakPolarHBondContact O-CB 3.37Å; Y1161-S1164 PolarHBondContact O-N 3.38Å; Y1161-S1164 VanDerWaalsContact O-N 3.16Å; S1164-K1166 VanDerWaalsContact C-N 3.32Å; S1164-K1166 PolarHBondContact O-N 3Å; S1164-V1167 PolarHBondContact O-N 3.08Å; S1164-I1168 WeakPolarHBondContact O-CG1 3.38Å; S1164-I1168 PolarHBondContact O-N 2.94Å
1165	M	91.9	Very high	89.2	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.6	-34.2	177.1	-66.8	-55.8	170.2	0	0	112.1	Y1161 I1168 C1169 V1192 T1195 T1213 Y1214	Y1161-M1165 HydrophobicContact CD1-CG 4.36Å; Y1161-M1165 HydrophobicContact CD2-CE 4.21Å; Y1161-M1165 HydrophobicContact CD2-CG 4.48Å; Y1161-M1165 HydrophobicContact CE1-CG 3.84Å; Y1161-M1165 HydrophobicContact CE2-CE 3.41Å; Y1161-M1165 VanDerWaalsContact CE2-CE 3.41Å; Y1161-M1165 HydrophobicContact CE2-CG 3.99Å; Y1161-M1165 PolarHBondContact O-N 3.48Å; M1165-I1168 HydrophobicContact SD-CD1 4.26Å; M1165-C1169 VanDerWaalsContact O-CB 3.25Å; M1165-C1169 WeakPolarHBondContact O-CB 3.43Å; M1165-C1169 PolarHBondContact O-N 2.91Å; M1165-V1192 HydrophobicContact CE-CG1 4.26Å; M1165-V1192 HydrophobicContact SD-CG1 4.41Å; M1165-V1192 HydrophobicContact SD-CG2 4.42Å; M1165-T1195 HydrophobicContact CE-CG2 3.9Å; M1165-T1213 HydrophobicContact CB-CG2 4.39Å; M1165-Y1214 HydrophobicContact CE-CD2 4.35Å; M1165-Y1214 HydrophobicContact SD-CD2 4.19Å
1166	K	90.9	Very high	88.7	Confident	137 Å²	137	37.6 Å²	37.6	60%	0.596	20%	0.202	S	C	*	.	H	α-helix	trans	-62.7	-43.7	172.6	-173.1	178.1	179	-177.4	0	112.5	S1162 S1163 S1164 C1169 V1170 T1213	S1162-K1166 WeakPolarHBondContact O-CB 3.33Å; S1162-K1166 PolarHBondContact O-N 3.36Å; S1163-K1166 PolarHBondContact O-N 3.46Å; S1164-K1166 VanDerWaalsContact C-N 3.32Å; S1164-K1166 PolarHBondContact O-N 3Å; K1166-C1169 WeakPolarHBondContact O-CB 3.4Å; K1166-C1169 PolarHBondContact O-N 3.48Å; K1166-V1170 WeakPolarHBondContact O-CG2 3.49Å; K1166-V1170 PolarHBondContact O-N 2.85Å; K1166-T1213 HydrophobicContact CB-CG2 4.33Å
1167	V	91.1	Very high	88	Confident	30 Å²	30	45.4 Å²	45.4	18%	0.182	24%	0.243	C	C	.	.	H	α-helix	trans	-69	-38.7	178.6	169.2	0	0	0	0	111.9	V1085 E1089 L1092 S1163 S1164 C1169 V1170 W1171	V1085-V1167 HydrophobicContact CG1-CB 4.34Å; V1085-V1167 HydrophobicContact CG1-CG2 3.51Å; E1089-V1167 HydrophobicContact CG-CG1 3.82Å; L1092-V1167 HydrophobicContact CD1-CG1 3.76Å; S1163-V1167 WeakPolarHBondContact O-CG2 3.46Å; S1163-V1167 PolarHBondContact O-N 3.02Å; S1164-V1167 PolarHBondContact O-N 3.08Å; V1167-C1169 VanDerWaalsContact C-N 3.34Å; V1167-V1170 PolarHBondContact O-N 3.45Å; V1167-W1171 WeakPolarHBondContact O-CB 3.33Å; V1167-W1171 PolarHBondContact O-N 2.89Å
1168	I	87.9	Confident	87.2	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-62.7	-42.1	171.4	-66.3	166.1	0	0	0	110.6	L1088 L1092 S1164 M1165 W1171 L1172 I1191 V1192 V1217	L1088-I1168 HydrophobicContact CD1-CD1 4.46Å; L1088-I1168 HydrophobicContact CD1-CG1 4.46Å; L1088-I1168 HydrophobicContact CD2-CD1 4.18Å; L1088-I1168 HydrophobicContact CD2-CG1 4.12Å; L1092-I1168 HydrophobicContact CD1-CG1 4.3Å; S1164-I1168 WeakPolarHBondContact O-CG1 3.38Å; S1164-I1168 PolarHBondContact O-N 2.94Å; M1165-I1168 HydrophobicContact SD-CD1 4.26Å; I1168-W1171 PolarHBondContact O-N 2.92Å; I1168-L1172 HydrophobicContact CG2-CD1 3.99Å; I1168-L1172 WeakPolarHBondContact O-CB 3.42Å; I1168-L1172 WeakPolarHBondContact O-CG 3.39Å; I1168-L1172 PolarHBondContact O-N 2.92Å; I1168-I1191 HydrophobicContact CD1-CG2 4.27Å; I1168-V1192 HydrophobicContact CD1-CG2 4.08Å; I1168-V1192 HydrophobicContact CG2-CG2 4.22Å; I1168-V1217 HydrophobicContact CG2-CG1 3.78Å; I1168-V1217 HydrophobicContact CG2-CG2 4.17Å
1169	C	88.9	Confident	86.4	Confident	19 Å²	19	51.1 Å²	51.1	13%	0.128	27%	0.271	C	S	.	.	H	α-helix	trans	-61.7	-43.6	176.4	-166.7	0	0	0	0	112.3	M1165 K1166 V1167 L1172 T1173 T1213 V1217	M1165-C1169 VanDerWaalsContact O-CB 3.25Å; M1165-C1169 WeakPolarHBondContact O-CB 3.43Å; M1165-C1169 PolarHBondContact O-N 2.91Å; K1166-C1169 WeakPolarHBondContact O-CB 3.4Å; K1166-C1169 PolarHBondContact O-N 3.48Å; V1167-C1169 VanDerWaalsContact C-N 3.34Å; C1169-L1172 PolarHBondContact O-N 2.63Å; C1169-T1173 WeakPolarHBondContact O-CB 3.35Å; C1169-T1173 PolarHBondContact O-N 3.42Å; C1169-T1173 PolarHBondContact O-OG1 3.26Å; C1169-T1213 HydrophobicContact CB-CG2 3.68Å; C1169-V1217 HydrophobicContact CB-CG2 3.54Å
1170	V	89.4	Confident	85.8	Confident	73 Å²	73	48.2 Å²	48.2	44%	0.442	26%	0.257	S	S	.	.	H	α-helix	trans	-64.5	-48.3	176.2	171.2	0	0	0	0	110.7	K1166 V1167 L1172 T1173 D1174	K1166-V1170 WeakPolarHBondContact O-CG2 3.49Å; K1166-V1170 PolarHBondContact O-N 2.85Å; V1167-V1170 PolarHBondContact O-N 3.45Å; V1170-L1172 PolarHBondContact O-N 3.15Å; V1170-T1173 CarbonylContact O-C 3.41Å; V1170-T1173 WeakPolarHBondContact O-CA 3.22Å; V1170-T1173 WeakPolarHBondContact O-CB 3.43Å; V1170-T1173 PolarHBondContact O-N 2.68Å; V1170-D1174 VanDerWaalsContact O-CG 3.25Å; V1170-D1174 PolarHBondContact O-N 3.03Å
1171	W	88.9	Confident	85	Confident	20 Å²	20	51.7 Å²	51.7	8%	0.076	27%	0.274	C	S	.	.	H	α-helix	trans	-59.6	-33	179.4	-173.9	95.8	0	0	0	113.3	L1092 L1095 V1167 I1168 R1175 L1180 L1188	L1092-W1171 HydrophobicContact CB-CG 4.17Å; L1092-W1171 HydrophobicContact CD1-CB 4.27Å; L1092-W1171 HydrophobicContact CD1-CG 4.35Å; L1092-W1171 HydrophobicContact CD2-CD2 4.01Å; L1092-W1171 HydrophobicContact CD2-CE3 4.45Å; L1092-W1171 HydrophobicContact CD2-CG 4.05Å; L1092-W1171 HydrophobicContact CG-CG 4.43Å; L1092-W1171 PolarHBondContact O-NE1 3.48Å; L1092-W1171 VanDerWaalsContact O-NE1 3.16Å; L1095-W1171 HydrophobicContact CB-CZ2 4.14Å; V1167-W1171 WeakPolarHBondContact O-CB 3.33Å; V1167-W1171 PolarHBondContact O-N 2.89Å; I1168-W1171 PolarHBondContact O-N 2.92Å; W1171-R1175 VanDerWaalsContact CE2-CZ 3.46Å; W1171-R1175 VanDerWaalsContact CZ2-NE 3.32Å; W1171-R1175 PolarHBondContact O-NH1 3.38Å; W1171-L1180 HydrophobicContact CH2-CD2 4.31Å; W1171-L1180 HydrophobicContact CZ3-CD2 3.98Å; W1171-L1188 HydrophobicContact CE3-CD1 4.1Å; W1171-L1188 HydrophobicContact CH2-CD1 4.17Å; W1171-L1188 HydrophobicContact CZ3-CD1 3.51Å
1172	L	84.7	Confident	84.2	Confident	8 Å²	8	53.7 Å²	53.7	4%	0.042	28%	0.284	C	S	.	.	H	α-helix	trans	-75.7	-34	171	-72.5	171.3	0	0	0	112.8	I1168 C1169 V1170 R1175 L1176 L1180 L1188 V1217 L1221	I1168-L1172 HydrophobicContact CG2-CD1 3.99Å; I1168-L1172 WeakPolarHBondContact O-CB 3.42Å; I1168-L1172 WeakPolarHBondContact O-CG 3.39Å; I1168-L1172 PolarHBondContact O-N 2.92Å; C1169-L1172 PolarHBondContact O-N 2.63Å; V1170-L1172 PolarHBondContact O-N 3.15Å; L1172-R1175 CarbonylContact O-C 3.52Å; L1172-R1175 PolarHBondContact O-N 2.88Å; L1172-R1175 VanDerWaalsContact O-N 3.15Å; L1172-L1176 PolarHBondContact O-N 2.97Å; L1172-L1180 HydrophobicContact CD2-CD1 3.64Å; L1172-L1180 HydrophobicContact CD2-CD2 4.38Å; L1172-L1188 HydrophobicContact CD2-CD1 4.16Å; L1172-V1217 HydrophobicContact CD1-CB 4.41Å; L1172-V1217 HydrophobicContact CD1-CG1 3.98Å; L1172-V1217 HydrophobicContact CD1-CG2 4.28Å; L1172-L1221 HydrophobicContact CD1-CD2 4.33Å; L1172-L1221 HydrophobicContact CD1-CG 4.29Å; L1172-L1221 HydrophobicContact CD2-CD2 4.31Å
1173	T	84.4	Confident	83.4	Confident	70 Å²	70	53.2 Å²	53.2	43%	0.429	28%	0.275	S	S	.	.	H	α-helix	trans	-67.4	-40.4	177.3	-57.2	0	0	0	0	111	C1169 V1170 R1175 L1176	C1169-T1173 WeakPolarHBondContact O-CB 3.35Å; C1169-T1173 PolarHBondContact O-N 3.42Å; C1169-T1173 PolarHBondContact O-OG1 3.26Å; V1170-T1173 CarbonylContact O-C 3.41Å; V1170-T1173 WeakPolarHBondContact O-CA 3.22Å; V1170-T1173 WeakPolarHBondContact O-CB 3.43Å; V1170-T1173 PolarHBondContact O-N 2.68Å; T1173-R1175 PolarHBondContact O-N 2.82Å; T1173-L1176 HydrophobicContact CG2-CD1 3.95Å; T1173-L1176 VanDerWaalsContact O-CG 3.3Å; T1173-L1176 WeakPolarHBondContact O-CG 3.29Å; T1173-L1176 PolarHBondContact O-N 2.85Å; T1173-L1176 VanDerWaalsContact O-N 3.16Å
1174	D	83.4	Confident	82.7	Confident	116 Å²	116	51.7 Å²	51.7	62%	0.62	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-9.1	172.5	-59.5	-25	0	0	0	113.3	V1170	V1170-D1174 VanDerWaalsContact O-CG 3.25Å; V1170-D1174 PolarHBondContact O-N 3.03Å
1175	R	82.9	Confident	82.2	Confident	32 Å²	32	51.7 Å²	51.7	12%	0.121	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.6	19.6	-177.7	-69.6	170.5	-179.7	60.9	18.7	112.5	S1096 D1099 W1171 L1172 T1173 D1177 L1178 R1220	S1096-R1175 VanDerWaalsContact CB-NH2 3.33Å; D1099-R1175 IonicContact OD1-CZ 2.68Å; D1099-R1175 IonicContact OD1-NE 2.71Å; D1099-R1175 PolarHBondContact OD1-NE 3.4Å; D1099-R1175 IonicContact OD1-NH2 3.68Å; D1099-R1175 IonicContact OD2-CZ 2.72Å; D1099-R1175 IonicContact OD2-NE 2.96Å; D1099-R1175 PolarHBondContact OD2-NE 2.87Å; D1099-R1175 VanDerWaalsContact OD2-NE 3.11Å; D1099-R1175 IonicContact OD2-NH2 3.72Å; D1099-R1175 PolarHBondContact OD2-NH2 3.24Å; W1171-R1175 VanDerWaalsContact CE2-CZ 3.46Å; W1171-R1175 VanDerWaalsContact CZ2-NE 3.32Å; W1171-R1175 PolarHBondContact O-NH1 3.38Å; L1172-R1175 CarbonylContact O-C 3.52Å; L1172-R1175 PolarHBondContact O-N 2.88Å; L1172-R1175 VanDerWaalsContact O-N 3.15Å; T1173-R1175 PolarHBondContact O-N 2.82Å; R1175-D1177 PolarHBondContact O-N 2.92Å; R1175-D1177 VanDerWaalsContact O-N 3.13Å; R1175-L1178 HydrophobicContact CG-CD1 4.38Å; R1175-L1178 PolarHBondContact O-N 2.91Å; R1175-R1220 PolarHBondContact O-NH2 3.44Å
1176	L	78.3	Confident	81.5	Confident	100 Å²	100	54.3 Å²	54.3	52%	0.524	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-41.7	-178.3	-87.9	167.1	0	0	0	113.2	L1172 T1173 R1220	L1172-L1176 PolarHBondContact O-N 2.97Å; T1173-L1176 HydrophobicContact CG2-CD1 3.95Å; T1173-L1176 VanDerWaalsContact O-CG 3.3Å; T1173-L1176 WeakPolarHBondContact O-CG 3.29Å; T1173-L1176 PolarHBondContact O-N 2.85Å; T1173-L1176 VanDerWaalsContact O-N 3.16Å; L1176-R1220 PolarHBondContact O-NH1 2.74Å; L1176-R1220 PolarHBondContact O-NH2 2.9Å; L1176-R1220 VanDerWaalsContact O-NH2 3.07Å
1177	D	74.7	Confident	81	Confident	165 Å²	165	48.1 Å²	48.1	88%	0.882	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92	4.6	-175.8	-55.1	-47.8	0	0	0	114.5	R1175	R1175-D1177 PolarHBondContact O-N 2.92Å; R1175-D1177 VanDerWaalsContact O-N 3.13Å
1178	L	75.2	Confident	80.7	Confident	70 Å²	70	46.7 Å²	46.7	37%	0.366	24%	0.241	S	C	.	.	S	Bend	trans	-112.5	144.6	178.3	-62.3	176.4	0	0	0	110.6	R1175 R1220	R1175-L1178 HydrophobicContact CG-CD1 4.38Å; R1175-L1178 PolarHBondContact O-N 2.91Å; L1178-R1220 PolarHBondContact O-NH2 3.3Å
1179	Q	74	Confident	80.4	Confident	84 Å²	84	46.7 Å²	46.7	39%	0.393	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-81.7	137.2	169.6	-172.6	172.5	-8.4	0	0	109.8
1180	L	77.8	Confident	80.2	Confident	7 Å²	7	47.9 Å²	47.9	4%	0.037	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-76.8	129.4	-179.3	-63.9	179.8	0	0	0	111.3	W1171 L1172 L1185 L1188 L1221 E1224	W1171-L1180 HydrophobicContact CH2-CD2 4.31Å; W1171-L1180 HydrophobicContact CZ3-CD2 3.98Å; L1172-L1180 HydrophobicContact CD2-CD1 3.64Å; L1172-L1180 HydrophobicContact CD2-CD2 4.38Å; L1180-L1185 HydrophobicContact CB-CB 4.38Å; L1180-L1185 HydrophobicContact CD1-CD1 4.3Å; L1180-L1188 HydrophobicContact CD1-CD1 4.39Å; L1180-L1221 HydrophobicContact CD1-CD2 4.19Å; L1180-E1224 HydrophobicContact CD1-CB 4.45Å; L1180-E1224 HydrophobicContact CD1-CG 3.89Å; L1180-E1224 HydrophobicContact CG-CG 4.18Å; L1180-E1224 PolarHBondContact N-OE2 2.71Å
1181	H	76.9	Confident	80.1	Confident	74 Å²	74	44.4 Å²	44.4	34%	0.343	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-63	138.9	174.1	175.4	-104.4	0	0	0	110.2	Y1098 Y1183 Q1184 L1185	Y1098-H1181 AromaticContact CD1-CE1 4Å; Y1098-H1181 AromaticContact CD1-ND1 3.9Å; H1181-Y1183 PolarHBondContact O-N 2.86Å; H1181-Q1184 HydrophobicContact CB-CG 4.18Å; H1181-Q1184 WeakPolarHBondContact O-CA 3.48Å; H1181-Q1184 VanDerWaalsContact O-CB 3.3Å; H1181-Q1184 WeakPolarHBondContact O-CB 3.36Å; H1181-Q1184 PolarHBondContact O-N 3.01Å; H1181-L1185 PolarHBondContact O-N 2.96Å
1182	I	73.9	Confident	80	Confident	41 Å²	41	43.5 Å²	43.5	21%	0.21	22%	0.219	C	C	.	.	H	α-helix	trans	-52.2	-35	-170.3	-66.3	167.1	0	0	0	113.1	K1186 E1232	I1182-K1186 HydrophobicContact CG2-CD 4.42Å; I1182-K1186 WeakPolarHBondContact O-CB 3.39Å; I1182-K1186 WeakPolarHBondContact O-CG 3.45Å; I1182-K1186 PolarHBondContact O-N 3.16Å; I1182-E1232 HydrophobicContact CD1-CB 4.49Å; I1182-E1232 HydrophobicContact CD1-CG 4.47Å; I1182-E1232 WeakPolarHBondContact CD1-OE2 3.45Å
1183	Y	73.5	Confident	80.1	Confident	36 Å²	36	45.1 Å²	45.1	14%	0.141	23%	0.226	C	C	.	.	H	α-helix	trans	-69.3	-37.8	174.7	170.1	-111.1	0	0	0	113.4	L1095 Y1098 G1125 L1128 H1181 T1187	L1095-Y1183 HydrophobicContact CD2-CD1 4.44Å; L1095-Y1183 HydrophobicContact CD2-CE1 3.87Å; Y1098-Y1183 AromaticContact CD1-CD1 3.88Å; Y1098-Y1183 HydrophobicContact CD1-CD1 3.88Å; Y1098-Y1183 AromaticContact CD2-CD1 3.96Å; Y1098-Y1183 HydrophobicContact CD2-CD1 3.96Å; Y1098-Y1183 HydrophobicContact CD2-CE1 4Å; Y1098-Y1183 AromaticContact CE1-CD1 3.7Å; Y1098-Y1183 HydrophobicContact CE1-CD1 3.7Å; Y1098-Y1183 HydrophobicContact CE1-CE1 4.11Å; Y1098-Y1183 AromaticContact CE2-CD1 3.81Å; Y1098-Y1183 HydrophobicContact CE2-CD1 3.81Å; Y1098-Y1183 AromaticContact CE2-CE1 3.52Å; Y1098-Y1183 HydrophobicContact CE2-CE1 3.52Å; Y1098-Y1183 HydrophobicContact CG-CD1 4Å; Y1098-Y1183 AromaticContact CZ-CD1 3.67Å; Y1098-Y1183 AromaticContact CZ-CE1 3.57Å; G1125-Y1183 VanDerWaalsContact C-CE2 3.41Å; G1125-Y1183 WeakPolarHBondContact CA-OH 3.42Å; G1125-Y1183 WeakPolarHBondContact O-CE2 3.11Å; G1125-Y1183 PolarHBondContact O-OH 2.94Å; L1128-Y1183 WeakPolarHBondContact CB-OH 3.28Å; H1181-Y1183 PolarHBondContact O-N 2.86Å; Y1183-T1187 WeakPolarHBondContact CE2-OG1 3.46Å; Y1183-T1187 WeakPolarHBondContact O-CB 3.39Å; Y1183-T1187 PolarHBondContact O-N 3.41Å; Y1183-T1187 VanDerWaalsContact O-N 3.09Å; Y1183-T1187 PolarHBondContact O-OG1 3.11Å
1184	Q	77.9	Confident	80.2	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.009	22%	0.22	C	C	.	.	H	α-helix	trans	-63.2	-50.3	173.3	-59.3	174.1	-47.2	0	0	109.9	L1095 D1099 H1181 K1186 T1187 L1188	L1095-Q1184 PolarHBondContact O-NE2 2.91Å; D1099-Q1184 PolarHBondContact OD1-NE2 3Å; H1181-Q1184 HydrophobicContact CB-CG 4.18Å; H1181-Q1184 WeakPolarHBondContact O-CA 3.48Å; H1181-Q1184 VanDerWaalsContact O-CB 3.3Å; H1181-Q1184 WeakPolarHBondContact O-CB 3.36Å; H1181-Q1184 PolarHBondContact O-N 3.01Å; Q1184-K1186 PolarHBondContact O-N 3.38Å; Q1184-T1187 PolarHBondContact O-N 2.87Å; Q1184-T1187 VanDerWaalsContact O-N 3.13Å; Q1184-L1188 WeakPolarHBondContact O-CB 3.17Å; Q1184-L1188 WeakPolarHBondContact O-CG 3.34Å; Q1184-L1188 PolarHBondContact O-N 3.27Å
1185	L	79.3	Confident	80.4	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-56.1	-52.9	-179.9	-175.4	58.7	0	0	0	111.7	L1180 H1181 T1187 L1188 I1189 L1221 E1224 A1228	L1180-L1185 HydrophobicContact CB-CB 4.38Å; L1180-L1185 HydrophobicContact CD1-CD1 4.3Å; H1181-L1185 PolarHBondContact O-N 2.96Å; L1185-T1187 VanDerWaalsContact C-N 3.31Å; L1185-T1187 PolarHBondContact O-N 2.83Å; L1185-L1188 PolarHBondContact O-N 3.15Å; L1185-I1189 HydrophobicContact CD1-CD1 3.82Å; L1185-I1189 HydrophobicContact CD1-CG1 4.18Å; L1185-I1189 HydrophobicContact CG-CD1 3.85Å; L1185-I1189 WeakPolarHBondContact O-CB 3.47Å; L1185-I1189 VanDerWaalsContact O-CG1 3.25Å; L1185-I1189 WeakPolarHBondContact O-CG1 3.41Å; L1185-I1189 PolarHBondContact O-N 3.17Å; L1185-L1221 HydrophobicContact CD1-CD2 3.93Å; L1185-E1224 HydrophobicContact CD1-CB 3.6Å; L1185-E1224 HydrophobicContact CD2-CB 4.16Å; L1185-A1228 HydrophobicContact CD2-CB 3.88Å
1186	K	77.7	Confident	80.6	Confident	56 Å²	56	39.6 Å²	39.6	24%	0.243	19%	0.191	C	C	.	.	H	α-helix	trans	-57.4	-40.6	175.2	-77.4	-174.1	178.1	-170.5	0	113.3	I1182 Q1184 K1190 G1235 L1236 I1239	I1182-K1186 HydrophobicContact CG2-CD 4.42Å; I1182-K1186 WeakPolarHBondContact O-CB 3.39Å; I1182-K1186 WeakPolarHBondContact O-CG 3.45Å; I1182-K1186 PolarHBondContact O-N 3.16Å; Q1184-K1186 PolarHBondContact O-N 3.38Å; K1186-K1190 WeakPolarHBondContact O-CB 3.46Å; K1186-K1190 PolarHBondContact O-N 2.95Å; K1186-K1190 VanDerWaalsContact O-N 3.14Å; K1186-G1235 WeakPolarHBondContact CE-O 3.29Å; K1186-G1235 PolarHBondContact NZ-O 3.33Å; K1186-L1236 HydrophobicContact CG-CD2 3.92Å; K1186-I1239 HydrophobicContact CB-CD1 4.35Å; K1186-I1239 HydrophobicContact CD-CD1 4.43Å; K1186-I1239 HydrophobicContact CG-CD1 4.42Å
1187	T	80.2	Confident	80.9	Confident	7 Å²	7	40.4 Å²	40.4	4%	0.043	19%	0.187	C	C	.	.	H	α-helix	trans	-68.6	-42.4	-179.4	-53.5	0	0	0	0	110.8	L1095 A1129 Y1183 Q1184 L1185 I1191	L1095-T1187 HydrophobicContact CD1-CG2 3.97Å; L1095-T1187 HydrophobicContact CD2-CG2 3.92Å; A1129-T1187 HydrophobicContact CB-CG2 3.82Å; Y1183-T1187 WeakPolarHBondContact CE2-OG1 3.46Å; Y1183-T1187 WeakPolarHBondContact O-CB 3.39Å; Y1183-T1187 PolarHBondContact O-N 3.41Å; Y1183-T1187 VanDerWaalsContact O-N 3.09Å; Y1183-T1187 PolarHBondContact O-OG1 3.11Å; Q1184-T1187 PolarHBondContact O-N 2.87Å; Q1184-T1187 VanDerWaalsContact O-N 3.13Å; L1185-T1187 VanDerWaalsContact C-N 3.31Å; L1185-T1187 PolarHBondContact O-N 2.83Å; T1187-I1191 HydrophobicContact CG2-CD1 3.98Å; T1187-I1191 WeakPolarHBondContact O-CB 3.4Å; T1187-I1191 VanDerWaalsContact O-CG1 3.29Å; T1187-I1191 WeakPolarHBondContact O-CG1 3.45Å; T1187-I1191 PolarHBondContact O-N 2.75Å
1188	L	84.4	Confident	81.5	Confident	0 Å²	0	33 Å²	33	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-69.8	-46.2	179.4	-69.3	168.9	0	0	0	112.5	L1092 L1095 W1171 L1172 L1180 Q1184 L1185 K1190 I1191 V1192 L1221	L1092-L1188 HydrophobicContact CD2-CD2 3.62Å; L1095-L1188 HydrophobicContact CD1-CD2 4.36Å; W1171-L1188 HydrophobicContact CE3-CD1 4.1Å; W1171-L1188 HydrophobicContact CH2-CD1 4.17Å; W1171-L1188 HydrophobicContact CZ3-CD1 3.51Å; L1172-L1188 HydrophobicContact CD2-CD1 4.16Å; L1180-L1188 HydrophobicContact CD1-CD1 4.39Å; Q1184-L1188 WeakPolarHBondContact O-CB 3.17Å; Q1184-L1188 WeakPolarHBondContact O-CG 3.34Å; Q1184-L1188 PolarHBondContact O-N 3.27Å; L1185-L1188 PolarHBondContact O-N 3.15Å; L1188-K1190 VanDerWaalsContact C-N 3.28Å; L1188-K1190 PolarHBondContact O-N 3.11Å; L1188-I1191 PolarHBondContact O-N 3.31Å; L1188-V1192 WeakPolarHBondContact O-CB 3.34Å; L1188-V1192 VanDerWaalsContact O-CG2 3.32Å; L1188-V1192 WeakPolarHBondContact O-CG2 3.32Å; L1188-V1192 PolarHBondContact O-N 3.44Å; L1188-L1221 HydrophobicContact CB-CD1 4.39Å; L1188-L1221 HydrophobicContact CB-CD2 3.97Å; L1188-L1221 HydrophobicContact CD1-CD2 4.4Å
1189	I	83.1	Confident	82.3	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-54.5	-48	173.9	-67	172.5	0	0	0	110	L1185 V1192 K1193 L1221 E1225 I1239 M1241	L1185-I1189 HydrophobicContact CD1-CD1 3.82Å; L1185-I1189 HydrophobicContact CD1-CG1 4.18Å; L1185-I1189 HydrophobicContact CG-CD1 3.85Å; L1185-I1189 WeakPolarHBondContact O-CB 3.47Å; L1185-I1189 VanDerWaalsContact O-CG1 3.25Å; L1185-I1189 WeakPolarHBondContact O-CG1 3.41Å; L1185-I1189 PolarHBondContact O-N 3.17Å; I1189-V1192 PolarHBondContact O-N 3.34Å; I1189-K1193 HydrophobicContact CG2-CD 4.18Å; I1189-K1193 HydrophobicContact CG2-CG 4.47Å; I1189-K1193 WeakPolarHBondContact O-CB 3.25Å; I1189-K1193 WeakPolarHBondContact O-CG 3.41Å; I1189-K1193 PolarHBondContact O-N 3.04Å; I1189-L1221 HydrophobicContact CG1-CB 4.36Å; I1189-E1225 HydrophobicContact CD1-CB 4.31Å; I1189-E1225 HydrophobicContact CD1-CG 4.42Å; I1189-I1239 HydrophobicContact CB-CG2 4.1Å; I1189-I1239 HydrophobicContact CG2-CG2 3.6Å; I1189-M1241 HydrophobicContact CB-CG 4.49Å; I1189-M1241 HydrophobicContact CB-SD 4.03Å; I1189-M1241 HydrophobicContact CD1-CG 4.05Å; I1189-M1241 HydrophobicContact CG1-CG 3.79Å; I1189-M1241 HydrophobicContact CG1-SD 3.75Å; I1189-M1241 HydrophobicContact CG2-CG 4.09Å; I1189-M1241 HydrophobicContact CG2-SD 3.74Å
1190	K	83.9	Confident	82.8	Confident	44 Å²	44	31.1 Å²	31.1	19%	0.191	13%	0.132	C	C	.	.	H	α-helix	trans	-66.1	-40.3	-179.2	-172.4	172.2	172.8	-175.4	0	112.9	A1129 D1130 I1133 K1186 L1188 K1194 I1239	A1129-K1190 HydrophobicContact CB-CB 4.21Å; A1129-K1190 HydrophobicContact CB-CD 3.82Å; A1129-K1190 HydrophobicContact CB-CG 4.02Å; D1130-K1190 VanDerWaalsContact CG-CE 3.45Å; D1130-K1190 VanDerWaalsContact CG-NZ 3.31Å; D1130-K1190 WeakPolarHBondContact OD1-CE 3.48Å; D1130-K1190 IonicContact OD1-NZ 3.34Å; D1130-K1190 PolarHBondContact OD1-NZ 2.7Å; D1130-K1190 VanDerWaalsContact OD2-CE 3.25Å; D1130-K1190 WeakPolarHBondContact OD2-CE 3.38Å; D1130-K1190 IonicContact OD2-NZ 2.9Å; D1130-K1190 PolarHBondContact OD2-NZ 3.45Å; I1133-K1190 HydrophobicContact CD1-CG 4.29Å; K1186-K1190 WeakPolarHBondContact O-CB 3.46Å; K1186-K1190 PolarHBondContact O-N 2.95Å; K1186-K1190 VanDerWaalsContact O-N 3.14Å; L1188-K1190 VanDerWaalsContact C-N 3.28Å; L1188-K1190 PolarHBondContact O-N 3.11Å; K1190-K1194 WeakPolarHBondContact O-CB 3.48Å; K1190-K1194 WeakPolarHBondContact O-CG 3.3Å; K1190-K1194 PolarHBondContact O-N 2.89Å; K1190-I1239 HydrophobicContact CD-CD1 4.31Å
1191	I	87	Confident	83.2	Confident	0 Å²	0	37 Å²	37	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.4	-52.4	173.3	-73.4	171.3	0	0	0	110.1	V1091 A1129 Y1132 I1133 I1168 T1187 L1188 T1195	V1091-I1191 HydrophobicContact CG1-CD1 4.08Å; A1129-I1191 HydrophobicContact CB-CD1 4.5Å; A1129-I1191 HydrophobicContact CB-CG1 3.99Å; Y1132-I1191 HydrophobicContact CD1-CD1 4.23Å; Y1132-I1191 HydrophobicContact CD1-CG1 4.16Å; Y1132-I1191 HydrophobicContact CD1-CG2 3.94Å; Y1132-I1191 HydrophobicContact CE1-CG2 3.98Å; I1133-I1191 HydrophobicContact CD1-CG1 4.37Å; I1168-I1191 HydrophobicContact CD1-CG2 4.27Å; T1187-I1191 HydrophobicContact CG2-CD1 3.98Å; T1187-I1191 WeakPolarHBondContact O-CB 3.4Å; T1187-I1191 VanDerWaalsContact O-CG1 3.29Å; T1187-I1191 WeakPolarHBondContact O-CG1 3.45Å; T1187-I1191 PolarHBondContact O-N 2.75Å; L1188-I1191 PolarHBondContact O-N 3.31Å; I1191-T1195 WeakPolarHBondContact O-CB 3.41Å; I1191-T1195 PolarHBondContact O-N 3.42Å; I1191-T1195 PolarHBondContact O-OG1 3.32Å
1192	V	87.6	Confident	83.5	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.8	-51.1	-175.1	171	0	0	0	0	111.2	M1165 I1168 L1188 I1189 T1195 Y1196 Y1214 V1217 L1221	M1165-V1192 HydrophobicContact CE-CG1 4.26Å; M1165-V1192 HydrophobicContact SD-CG1 4.41Å; M1165-V1192 HydrophobicContact SD-CG2 4.42Å; I1168-V1192 HydrophobicContact CD1-CG2 4.08Å; I1168-V1192 HydrophobicContact CG2-CG2 4.22Å; L1188-V1192 WeakPolarHBondContact O-CB 3.34Å; L1188-V1192 VanDerWaalsContact O-CG2 3.32Å; L1188-V1192 WeakPolarHBondContact O-CG2 3.32Å; L1188-V1192 PolarHBondContact O-N 3.44Å; I1189-V1192 PolarHBondContact O-N 3.34Å; V1192-T1195 PolarHBondContact O-N 2.91Å; V1192-Y1196 WeakPolarHBondContact O-CB 3.39Å; V1192-Y1196 PolarHBondContact O-N 3.36Å; V1192-Y1214 HydrophobicContact CG1-CD2 4.26Å; V1192-Y1214 HydrophobicContact CG1-CE2 3.68Å; V1192-V1217 HydrophobicContact CG1-CG1 4.38Å; V1192-V1217 HydrophobicContact CG2-CG1 3.92Å; V1192-L1221 HydrophobicContact CB-CD1 4.35Å; V1192-L1221 HydrophobicContact CG2-CD1 3.95Å
1193	K	86.3	Confident	83.8	Confident	42 Å²	42	34.6 Å²	34.6	18%	0.183	16%	0.161	C	C	.	.	H	α-helix	trans	-65.7	-45.1	-178.8	-64.8	-168.4	90	-176	0	113.6	I1189 Y1196 R1197 T1240 M1241 K1242 D1243	I1189-K1193 HydrophobicContact CG2-CD 4.18Å; I1189-K1193 HydrophobicContact CG2-CG 4.47Å; I1189-K1193 WeakPolarHBondContact O-CB 3.25Å; I1189-K1193 WeakPolarHBondContact O-CG 3.41Å; I1189-K1193 PolarHBondContact O-N 3.04Å; K1193-Y1196 PolarHBondContact O-N 3.2Å; K1193-R1197 PolarHBondContact O-N 2.8Å; K1193-T1240 VanDerWaalsContact CD-O 3.22Å; K1193-T1240 WeakPolarHBondContact CD-O 3.46Å; K1193-T1240 PolarHBondContact NZ-O 2.68Å; K1193-M1241 WeakPolarHBondContact CE-O 3.31Å; K1193-M1241 HydrophobicContact CG-SD 4.29Å; K1193-M1241 PolarHBondContact NZ-O 3.48Å; K1193-K1242 PolarHBondContact NZ-O 2.86Å; K1193-D1243 WeakPolarHBondContact CE-OD1 3.36Å; K1193-D1243 IonicContact NZ-OD1 3.16Å; K1193-D1243 PolarHBondContact NZ-OD1 3.13Å
1194	K	86.5	Confident	84.4	Confident	70 Å²	70	33.2 Å²	33.2	30%	0.304	16%	0.157	S	C	.	.	H	α-helix	trans	-67.2	-40	177	-68.5	-161.1	-169.1	174.8	0	111	D1130 I1133 K1190 Y1196 R1197 D1198	D1130-K1194 IonicContact OD1-NZ 3.89Å; D1130-K1194 PolarHBondContact OD1-NZ 2.99Å; I1133-K1194 HydrophobicContact CD1-CB 3.91Å; I1133-K1194 HydrophobicContact CD1-CD 3.68Å; I1133-K1194 HydrophobicContact CD1-CG 4.15Å; I1133-K1194 HydrophobicContact CG1-CB 4.03Å; I1133-K1194 HydrophobicContact CG1-CD 4.29Å; I1133-K1194 HydrophobicContact CG2-CB 4.14Å; I1133-K1194 HydrophobicContact CG2-CD 3.86Å; K1190-K1194 WeakPolarHBondContact O-CB 3.48Å; K1190-K1194 WeakPolarHBondContact O-CG 3.3Å; K1190-K1194 PolarHBondContact O-N 2.89Å; K1194-Y1196 PolarHBondContact O-N 2.77Å; K1194-R1197 PolarHBondContact O-N 3.09Å; K1194-D1198 WeakPolarHBondContact O-CB 3.48Å; K1194-D1198 PolarHBondContact O-N 3.14Å
1195	T	86.5	Confident	84.7	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.012	18%	0.184	C	C	.	.	H	α-helix	trans	-60.9	-44.6	175.7	-56.7	0	0	0	0	111.1	Y1161 M1165 I1191 V1192 D1198 F1199	Y1161-T1195 HydrophobicContact CD2-CG2 4.2Å; Y1161-T1195 HydrophobicContact CE2-CG2 4.39Å; M1165-T1195 HydrophobicContact CE-CG2 3.9Å; I1191-T1195 WeakPolarHBondContact O-CB 3.41Å; I1191-T1195 PolarHBondContact O-N 3.42Å; I1191-T1195 PolarHBondContact O-OG1 3.32Å; V1192-T1195 PolarHBondContact O-N 2.91Å; T1195-D1198 PolarHBondContact O-N 2.98Å; T1195-F1199 HydrophobicContact CG2-CD2 3.54Å; T1195-F1199 HydrophobicContact CG2-CE2 3.69Å; T1195-F1199 WeakPolarHBondContact O-CB 3.4Å; T1195-F1199 WeakPolarHBondContact O-CD2 3.41Å; T1195-F1199 PolarHBondContact O-N 3.26Å
1196	Y	87.3	Confident	84.7	Confident	31 Å²	31	45.1 Å²	45.1	12%	0.122	22%	0.216	C	C	.	.	H	α-helix	trans	-56.5	-52.4	173.5	-178.5	-84.3	0	0	0	111.7	Y1161 V1192 K1193 K1194 D1198 R1200 L1209 N1210 Y1214	Y1161-Y1196 WeakPolarHBondContact OH-CD2 3.42Å; V1192-Y1196 WeakPolarHBondContact O-CB 3.39Å; V1192-Y1196 PolarHBondContact O-N 3.36Å; K1193-Y1196 PolarHBondContact O-N 3.2Å; K1194-Y1196 PolarHBondContact O-N 2.77Å; Y1196-D1198 PolarHBondContact O-N 2.95Å; Y1196-R1200 VanDerWaalsContact O-CB 3.27Å; Y1196-R1200 WeakPolarHBondContact O-CB 3.49Å; Y1196-R1200 PolarHBondContact O-N 3.2Å; Y1196-L1209 HydrophobicContact CD2-CB 4.28Å; Y1196-L1209 HydrophobicContact CD2-CD2 4.42Å; Y1196-L1209 HydrophobicContact CE2-CB 3.71Å; Y1196-N1210 PolarHBondContact OH-ND2 3.37Å; Y1196-N1210 PolarHBondContact OH-OD1 2.68Å; Y1196-Y1214 HydrophobicContact CD2-CD1 4.45Å; Y1196-Y1214 HydrophobicContact CD2-CD2 4.25Å; Y1196-Y1214 AromaticContact CD2-CE1 3.85Å; Y1196-Y1214 HydrophobicContact CD2-CE1 3.85Å; Y1196-Y1214 AromaticContact CD2-CE2 3.61Å; Y1196-Y1214 HydrophobicContact CD2-CE2 3.61Å; Y1196-Y1214 AromaticContact CD2-CZ 3.37Å; Y1196-Y1214 WeakPolarHBondContact CD2-OH 3.25Å; Y1196-Y1214 HydrophobicContact CE2-CD1 4.36Å; Y1196-Y1214 AromaticContact CE2-CE1 3.76Å; Y1196-Y1214 HydrophobicContact CE2-CE1 3.76Å; Y1196-Y1214 HydrophobicContact CE2-CE2 4.37Å; Y1196-Y1214 AromaticContact CE2-CZ 3.77Å; Y1196-Y1214 HydrophobicContact CG-CE2 4.27Å
1197	R	86.4	Confident	84.8	Confident	117 Å²	117	45.7 Å²	45.7	44%	0.442	24%	0.237	S	C	.	.	H	α-helix	trans	-64.2	-40.2	-179.6	-173.7	166.3	177.3	154.2	-8.7	112.6	K1193 K1194 L1201 D1245	K1193-R1197 PolarHBondContact O-N 2.8Å; K1194-R1197 PolarHBondContact O-N 3.09Å; R1197-L1201 HydrophobicContact CG-CD1 4.33Å; R1197-L1201 VanDerWaalsContact O-CG 3.29Å; R1197-L1201 WeakPolarHBondContact O-CG 3.49Å; R1197-L1201 PolarHBondContact O-N 3.3Å; R1197-D1245 IonicContact CZ-OD2 3.94Å; R1197-D1245 IonicContact NH1-OD1 3.11Å; R1197-D1245 PolarHBondContact NH1-OD1 3.13Å; R1197-D1245 IonicContact NH1-OD2 3.38Å; R1197-D1245 PolarHBondContact NH1-OD2 3.36Å
1198	D	87.1	Confident	85	Confident	10 Å²	10	46.6 Å²	46.6	5%	0.053	24%	0.243	C	C	.	.	H	α-helix	trans	-70	-46	-178.7	-66.2	-15.4	0	0	0	111.1	R1137 K1194 T1195 Y1196 L1201 Q1202	R1137-D1198 IonicContact CZ-OD1 2.68Å; R1137-D1198 IonicContact CZ-OD2 3.68Å; R1137-D1198 VanDerWaalsContact NE-CG 3.33Å; R1137-D1198 IonicContact NE-OD1 3.06Å; R1137-D1198 PolarHBondContact NE-OD1 3.46Å; R1137-D1198 IonicContact NE-OD2 2.74Å; R1137-D1198 PolarHBondContact NE-OD2 2.67Å; R1137-D1198 IonicContact NH2-OD1 2.71Å; R1137-D1198 PolarHBondContact NH2-OD1 3.47Å; R1137-D1198 IonicContact NH2-OD2 2.68Å; R1137-D1198 PolarHBondContact NH2-OD2 3.38Å; K1194-D1198 WeakPolarHBondContact O-CB 3.48Å; K1194-D1198 PolarHBondContact O-N 3.14Å; T1195-D1198 PolarHBondContact O-N 2.98Å; Y1196-D1198 PolarHBondContact O-N 2.95Å; D1198-L1201 PolarHBondContact O-N 2.7Å; D1198-Q1202 WeakPolarHBondContact O-CB 3.45Å; D1198-Q1202 WeakPolarHBondContact O-CG 3.22Å; D1198-Q1202 PolarHBondContact O-N 3.49Å; D1198-Q1202 VanDerWaalsContact O-N 3.17Å
1199	F	90.3	Very high	85	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-69.1	-31.3	175.3	-82.1	-87.1	0	0	0	112.9	V1136 Q1140 F1157 W1160 Y1161 T1195 Q1202 G1203 V1204 L1209	V1136-F1199 HydrophobicContact CG1-CD2 4.35Å; V1136-F1199 HydrophobicContact CG1-CE2 3.58Å; V1136-F1199 HydrophobicContact CG1-CZ 4.12Å; Q1140-F1199 VanDerWaalsContact NE2-CD1 3.32Å; Q1140-F1199 VanDerWaalsContact NE2-CE1 3.28Å; Q1140-F1199 VanDerWaalsContact NE2-CZ 3.34Å; F1157-F1199 HydrophobicContact CB-CD1 3.98Å; F1157-F1199 HydrophobicContact CB-CE1 3.97Å; F1157-F1199 HydrophobicContact CD1-CE1 4.21Å; F1157-F1199 HydrophobicContact CG-CD1 4.45Å; F1157-F1199 HydrophobicContact CG-CE1 4.23Å; W1160-F1199 HydrophobicContact CB-CE1 4.19Å; W1160-F1199 HydrophobicContact CB-CZ 4.25Å; W1160-F1199 HydrophobicContact CD2-CE1 4.09Å; W1160-F1199 AromaticContact CD2-CZ 3.53Å; W1160-F1199 HydrophobicContact CD2-CZ 3.53Å; W1160-F1199 AromaticContact CE2-CZ 3.97Å; W1160-F1199 AromaticContact CE3-CE1 3.93Å; W1160-F1199 HydrophobicContact CE3-CE1 3.93Å; W1160-F1199 AromaticContact CE3-CZ 3.65Å; W1160-F1199 HydrophobicContact CE3-CZ 3.65Å; W1160-F1199 HydrophobicContact CG-CE1 4.25Å; W1160-F1199 AromaticContact CG-CZ 3.84Å; W1160-F1199 HydrophobicContact CG-CZ 3.84Å; W1160-F1199 HydrophobicContact CZ2-CZ 4.46Å; W1160-F1199 HydrophobicContact CZ3-CZ 4.17Å; Y1161-F1199 HydrophobicContact CD2-CB 3.78Å; Y1161-F1199 AromaticContact CD2-CD2 3.93Å; Y1161-F1199 HydrophobicContact CD2-CD2 3.93Å; Y1161-F1199 AromaticContact CD2-CG 3.86Å; Y1161-F1199 HydrophobicContact CD2-CG 3.86Å; Y1161-F1199 HydrophobicContact CG-CB 4.38Å; Y1161-F1199 HydrophobicContact CG-CG 4.37Å; T1195-F1199 HydrophobicContact CG2-CD2 3.54Å; T1195-F1199 HydrophobicContact CG2-CE2 3.69Å; T1195-F1199 WeakPolarHBondContact O-CB 3.4Å; T1195-F1199 WeakPolarHBondContact O-CD2 3.41Å; T1195-F1199 PolarHBondContact O-N 3.26Å; F1199-Q1202 CarbonylContact O-C 3.58Å; F1199-Q1202 WeakPolarHBondContact O-CA 3.41Å; F1199-Q1202 PolarHBondContact O-N 3.43Å; F1199-G1203 PolarHBondContact O-N 2.66Å; F1199-V1204 HydrophobicContact CB-CB 4.28Å; F1199-V1204 HydrophobicContact CB-CG2 3.93Å; F1199-V1204 HydrophobicContact CD1-CG2 3.72Å; F1199-V1204 HydrophobicContact CG-CG2 4.31Å; F1199-V1204 WeakPolarHBondContact O-CB 3.42Å; F1199-V1204 PolarHBondContact O-N 3.11Å; F1199-L1209 HydrophobicContact CB-CD2 4.29Å
1200	R	86.3	Confident	85.1	Confident	113 Å²	113	50 Å²	50	43%	0.426	26%	0.261	S	S	.	.	H	α-helix	trans	-62.5	-43.6	170.6	-172.9	178	71.1	177.7	-0.8	112.2	Y1196 Q1202 G1203 L1209	Y1196-R1200 VanDerWaalsContact O-CB 3.27Å; Y1196-R1200 WeakPolarHBondContact O-CB 3.49Å; Y1196-R1200 PolarHBondContact O-N 3.2Å; R1200-Q1202 PolarHBondContact O-N 2.87Å; R1200-G1203 PolarHBondContact O-N 3.44Å; R1200-L1209 HydrophobicContact CB-CD1 3.65Å; R1200-L1209 HydrophobicContact CB-CD2 4.49Å; R1200-L1209 HydrophobicContact CG-CD1 3.74Å
1201	L	85.8	Confident	85.3	Confident	130 Å²	130	49 Å²	49	68%	0.681	26%	0.26	S	S	*	.	H	α-helix	trans	-66.6	-14.9	173.2	-70.9	169	0	0	0	113	R1197 D1198	R1197-L1201 HydrophobicContact CG-CD1 4.33Å; R1197-L1201 VanDerWaalsContact O-CG 3.29Å; R1197-L1201 WeakPolarHBondContact O-CG 3.49Å; R1197-L1201 PolarHBondContact O-N 3.3Å; D1198-L1201 PolarHBondContact O-N 2.7Å
1202	Q	83.7	Confident	85.2	Confident	24 Å²	24	57.9 Å²	57.9	11%	0.112	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	18.8	179.2	-62.6	-88.1	-11	0	0	112.3	Q1140 R1144 F1157 D1198 F1199 R1200 V1204	Q1140-Q1202 HydrophobicContact CB-CG 4.47Å; R1144-Q1202 VanDerWaalsContact CD-OE1 3.27Å; R1144-Q1202 PolarHBondContact NH2-O 2.9Å; F1157-Q1202 HydrophobicContact CD2-CB 3.93Å; F1157-Q1202 HydrophobicContact CE2-CB 4.08Å; F1157-Q1202 VanDerWaalsContact CE2-OE1 3.28Å; D1198-Q1202 WeakPolarHBondContact O-CB 3.45Å; D1198-Q1202 WeakPolarHBondContact O-CG 3.22Å; D1198-Q1202 PolarHBondContact O-N 3.49Å; D1198-Q1202 VanDerWaalsContact O-N 3.17Å; F1199-Q1202 CarbonylContact O-C 3.58Å; F1199-Q1202 WeakPolarHBondContact O-CA 3.41Å; F1199-Q1202 PolarHBondContact O-N 3.43Å; R1200-Q1202 PolarHBondContact O-N 2.87Å; Q1202-V1204 PolarHBondContact O-N 3.21Å
1203	G	79.4	Confident	85.2	Confident	41 Å²	41	60.2 Å²	60.2	42%	0.423	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	4.6	168.5	0	0	0	0	0	116.5	F1199 R1200 L1205	F1199-G1203 PolarHBondContact O-N 2.66Å; R1200-G1203 PolarHBondContact O-N 3.44Å; G1203-L1205 PolarHBondContact O-N 2.96Å
1204	V	85.8	Confident	85.2	Confident	7 Å²	7	58.7 Å²	58.7	4%	0.042	31%	0.306	C	S	.	.			trans	-60.7	130.3	175.7	173.1	0	0	0	0	110.2	F1157 D1158 Y1161 F1199 Q1202 T1208 L1209	F1157-V1204 HydrophobicContact CB-CG2 3.7Å; D1158-V1204 WeakPolarHBondContact OD1-CG1 3.25Å; Y1161-V1204 HydrophobicContact CD1-CG1 4.45Å; Y1161-V1204 HydrophobicContact CG-CG1 4.43Å; F1199-V1204 HydrophobicContact CB-CB 4.28Å; F1199-V1204 HydrophobicContact CB-CG2 3.93Å; F1199-V1204 HydrophobicContact CD1-CG2 3.72Å; F1199-V1204 HydrophobicContact CG-CG2 4.31Å; F1199-V1204 WeakPolarHBondContact O-CB 3.42Å; F1199-V1204 PolarHBondContact O-N 3.11Å; Q1202-V1204 PolarHBondContact O-N 3.21Å; V1204-T1208 HydrophobicContact CG1-CG2 3.96Å; V1204-L1209 HydrophobicContact CB-CD2 4.07Å; V1204-L1209 HydrophobicContact CB-CG 4.31Å; V1204-L1209 HydrophobicContact CG1-CD2 3.71Å; V1204-L1209 HydrophobicContact CG1-CG 3.85Å; V1204-L1209 WeakPolarHBondContact O-CD1 3.15Å
1205	L	84.1	Confident	85.2	Confident	112 Å²	112	58 Å²	58	59%	0.586	31%	0.305	S	S	*	.			trans	-62.8	144	-172.6	-64.5	173.6	0	0	0	111.8	G1203 G1207 T1208 L1209	G1203-L1205 PolarHBondContact O-N 2.96Å; L1205-G1207 PolarHBondContact O-N 2.9Å; L1205-G1207 VanDerWaalsContact O-N 3.15Å; L1205-T1208 WeakPolarHBondContact O-CA 3.08Å; L1205-T1208 WeakPolarHBondContact O-CB 3.38Å; L1205-T1208 PolarHBondContact O-N 3.35Å; L1205-L1209 PolarHBondContact O-N 3.25Å
1206	E	79.5	Confident	85.2	Confident	141 Å²	141	61.6 Å²	61.6	66%	0.659	33%	0.327	S	S	*	.	H	α-helix	trans	-58.7	-31.8	-179.6	-65.5	-163.8	138.9	0	0	113.4	T1208 L1209 N1210	E1206-T1208 VanDerWaalsContact C-N 3.3Å; E1206-T1208 PolarHBondContact O-N 3.47Å; E1206-L1209 PolarHBondContact O-N 3.14Å; E1206-N1210 WeakPolarHBondContact O-CB 3.45Å; E1206-N1210 PolarHBondContact O-N 3.06Å; E1206-N1210 PolarHBondContact O-ND2 3.15Å
1207	G	78.9	Confident	85.1	Confident	68 Å²	68	60.1 Å²	60.1	70%	0.701	32%	0.322	S	S	*	.	H	α-helix	trans	-69.1	-24.1	173.4	0	0	0	0	0	114.2	L1205	L1205-G1207 PolarHBondContact O-N 2.9Å; L1205-G1207 VanDerWaalsContact O-N 3.15Å
1208	T	84.6	Confident	85.2	Confident	25 Å²	25	57.1 Å²	57.1	15%	0.153	31%	0.313	C	S	.	.	H	α-helix	trans	-81.9	-45.6	171.4	-48	0	0	0	0	110.4	D1158 Y1161 S1162 V1204 L1205 E1206 S1211	D1158-T1208 HydrophobicContact CB-CG2 4.23Å; D1158-T1208 WeakPolarHBondContact OD1-CB 3.49Å; D1158-T1208 WeakPolarHBondContact OD1-CG2 3.33Å; D1158-T1208 PolarHBondContact OD1-OG1 2.93Å; Y1161-T1208 HydrophobicContact CD1-CG2 4.23Å; Y1161-T1208 WeakPolarHBondContact CE1-O 3.38Å; S1162-T1208 WeakPolarHBondContact OG-CG2 3.34Å; V1204-T1208 HydrophobicContact CG1-CG2 3.96Å; L1205-T1208 WeakPolarHBondContact O-CA 3.08Å; L1205-T1208 WeakPolarHBondContact O-CB 3.38Å; L1205-T1208 PolarHBondContact O-N 3.35Å; E1206-T1208 VanDerWaalsContact C-N 3.3Å; E1206-T1208 PolarHBondContact O-N 3.47Å; T1208-S1211 WeakPolarHBondContact O-CB 3.41Å; T1208-S1211 PolarHBondContact O-N 2.75Å; T1208-S1211 PolarHBondContact O-OG 3.04Å
1209	L	84.4	Confident	85.1	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-56.7	-55.1	177.7	-69	174	0	0	0	111.4	Y1161 Y1196 F1199 R1200 V1204 L1205 E1206 S1211 Y1214	Y1161-L1209 HydrophobicContact CD1-CD2 4.49Å; Y1161-L1209 HydrophobicContact CD2-CD2 4.26Å; Y1161-L1209 HydrophobicContact CE1-CD2 4.22Å; Y1161-L1209 WeakPolarHBondContact CE1-O 3.48Å; Y1161-L1209 HydrophobicContact CE2-CD2 3.96Å; Y1161-L1209 PolarHBondContact OH-O 3Å; Y1196-L1209 HydrophobicContact CD2-CB 4.28Å; Y1196-L1209 HydrophobicContact CD2-CD2 4.42Å; Y1196-L1209 HydrophobicContact CE2-CB 3.71Å; F1199-L1209 HydrophobicContact CB-CD2 4.29Å; R1200-L1209 HydrophobicContact CB-CD1 3.65Å; R1200-L1209 HydrophobicContact CB-CD2 4.49Å; R1200-L1209 HydrophobicContact CG-CD1 3.74Å; V1204-L1209 HydrophobicContact CB-CD2 4.07Å; V1204-L1209 HydrophobicContact CB-CG 4.31Å; V1204-L1209 HydrophobicContact CG1-CD2 3.71Å; V1204-L1209 HydrophobicContact CG1-CG 3.85Å; V1204-L1209 WeakPolarHBondContact O-CD1 3.15Å; L1205-L1209 PolarHBondContact O-N 3.25Å; E1206-L1209 PolarHBondContact O-N 3.14Å; L1209-S1211 PolarHBondContact O-N 3.16Å; L1209-S1211 VanDerWaalsContact O-N 3.16Å; L1209-Y1214 VanDerWaalsContact O-CB 3.31Å; L1209-Y1214 WeakPolarHBondContact O-CB 3.37Å
1210	N	84.9	Confident	84.8	Confident	72 Å²	72	67.1 Å²	67.1	39%	0.385	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	41.7	180	-61.6	-56.2	0	0	0	112.3	Y1196 E1206	Y1196-N1210 PolarHBondContact OH-ND2 3.37Å; Y1196-N1210 PolarHBondContact OH-OD1 2.68Å; E1206-N1210 WeakPolarHBondContact O-CB 3.45Å; E1206-N1210 PolarHBondContact O-N 3.06Å; E1206-N1210 PolarHBondContact O-ND2 3.15Å
1211	S	88.3	Confident	84.7	Confident	25 Å²	25	61.7 Å²	61.7	18%	0.175	33%	0.329	C	S	.	.			trans	-64.9	152.5	174.7	63.3	0	0	0	0	111.7	T1208 L1209 T1213 Y1214 D1215	T1208-S1211 WeakPolarHBondContact O-CB 3.41Å; T1208-S1211 PolarHBondContact O-N 2.75Å; T1208-S1211 PolarHBondContact O-OG 3.04Å; L1209-S1211 PolarHBondContact O-N 3.16Å; L1209-S1211 VanDerWaalsContact O-N 3.16Å; S1211-T1213 PolarHBondContact O-N 3.25Å; S1211-Y1214 WeakPolarHBondContact O-CA 3.49Å; S1211-Y1214 WeakPolarHBondContact O-CB 3.42Å; S1211-Y1214 PolarHBondContact O-N 2.78Å; S1211-Y1214 PolarHBondContact OG-N 3.16Å; S1211-D1215 PolarHBondContact O-N 3.34Å
1212	K	85.6	Confident	84.5	Confident	185 Å²	185	57.7 Å²	57.7	80%	0.804	31%	0.31	S	S	*	.	H	α-helix	trans	-53.6	-27	173.7	-64.5	-179.6	-178.9	177.2	0	113.1	T1216	K1212-T1216 WeakPolarHBondContact O-CB 3.3Å; K1212-T1216 PolarHBondContact O-N 2.96Å; K1212-T1216 VanDerWaalsContact O-N 3.14Å; K1212-T1216 PolarHBondContact O-OG1 2.98Å
1213	T	87	Confident	84.4	Confident	49 Å²	49	60.8 Å²	60.8	30%	0.301	33%	0.33	S	S	.	.	H	α-helix	trans	-69.6	-47.8	174	-53.7	0	0	0	0	111.6	M1165 K1166 C1169 S1211 T1216 V1217	M1165-T1213 HydrophobicContact CB-CG2 4.39Å; K1166-T1213 HydrophobicContact CB-CG2 4.33Å; C1169-T1213 HydrophobicContact CB-CG2 3.68Å; S1211-T1213 PolarHBondContact O-N 3.25Å; T1213-T1216 PolarHBondContact O-N 3.48Å; T1213-V1217 WeakPolarHBondContact O-CG2 3.4Å; T1213-V1217 PolarHBondContact O-N 2.97Å
1214	Y	87.9	Confident	84.3	Confident	10 Å²	10	59.3 Å²	59.3	4%	0.039	31%	0.313	C	S	.	.	H	α-helix	trans	-59.6	-47.3	173	175.4	-102.6	0	0	0	111.4	Y1161 M1165 V1192 Y1196 L1209 S1211 T1216 V1217 H1218	Y1161-Y1214 VanDerWaalsContact OH-CD2 3.22Å; Y1161-Y1214 WeakPolarHBondContact OH-CD2 3.49Å; M1165-Y1214 HydrophobicContact CE-CD2 4.35Å; M1165-Y1214 HydrophobicContact SD-CD2 4.19Å; V1192-Y1214 HydrophobicContact CG1-CD2 4.26Å; V1192-Y1214 HydrophobicContact CG1-CE2 3.68Å; Y1196-Y1214 HydrophobicContact CD2-CD1 4.45Å; Y1196-Y1214 HydrophobicContact CD2-CD2 4.25Å; Y1196-Y1214 AromaticContact CD2-CE1 3.85Å; Y1196-Y1214 HydrophobicContact CD2-CE1 3.85Å; Y1196-Y1214 AromaticContact CD2-CE2 3.61Å; Y1196-Y1214 HydrophobicContact CD2-CE2 3.61Å; Y1196-Y1214 AromaticContact CD2-CZ 3.37Å; Y1196-Y1214 WeakPolarHBondContact CD2-OH 3.25Å; Y1196-Y1214 HydrophobicContact CE2-CD1 4.36Å; Y1196-Y1214 AromaticContact CE2-CE1 3.76Å; Y1196-Y1214 HydrophobicContact CE2-CE1 3.76Å; Y1196-Y1214 HydrophobicContact CE2-CE2 4.37Å; Y1196-Y1214 AromaticContact CE2-CZ 3.77Å; Y1196-Y1214 HydrophobicContact CG-CE2 4.27Å; L1209-Y1214 VanDerWaalsContact O-CB 3.31Å; L1209-Y1214 WeakPolarHBondContact O-CB 3.37Å; S1211-Y1214 WeakPolarHBondContact O-CA 3.49Å; S1211-Y1214 WeakPolarHBondContact O-CB 3.42Å; S1211-Y1214 PolarHBondContact O-N 2.78Å; S1211-Y1214 PolarHBondContact OG-N 3.16Å; Y1214-T1216 PolarHBondContact O-N 3.22Å; Y1214-V1217 PolarHBondContact O-N 3.48Å; Y1214-V1217 VanDerWaalsContact O-N 3.16Å; Y1214-H1218 AromaticContact CZ-CD2 3.96Å; Y1214-H1218 VanDerWaalsContact O-CB 3.32Å; Y1214-H1218 WeakPolarHBondContact O-CB 3.32Å; Y1214-H1218 PolarHBondContact O-N 3.27Å
1215	D	85.6	Confident	83.9	Confident	55 Å²	55	60.1 Å²	60.1	29%	0.294	32%	0.316	S	S	.	.	H	α-helix	trans	-51.5	-42.5	174	-102.5	37.6	0	0	0	113	S1211 R1219	S1211-D1215 PolarHBondContact O-N 3.34Å; D1215-R1219 WeakPolarHBondContact O-CB 3.1Å; D1215-R1219 WeakPolarHBondContact O-CD 3.32Å; D1215-R1219 WeakPolarHBondContact O-CG 3.33Å; D1215-R1219 PolarHBondContact O-N 2.95Å; D1215-R1219 IonicContact OD2-CZ 3.5Å; D1215-R1219 IonicContact OD2-NE 3.69Å; D1215-R1219 IonicContact OD2-NH2 2.65Å; D1215-R1219 PolarHBondContact OD2-NH2 3.11Å
1216	T	86.1	Confident	83.4	Confident	78 Å²	78	57.5 Å²	57.5	48%	0.479	31%	0.311	S	S	.	.	H	α-helix	trans	-70.7	-43.6	-179.2	-57.2	0	0	0	0	111.4	K1212 T1213 Y1214 R1220	K1212-T1216 WeakPolarHBondContact O-CB 3.3Å; K1212-T1216 PolarHBondContact O-N 2.96Å; K1212-T1216 VanDerWaalsContact O-N 3.14Å; K1212-T1216 PolarHBondContact O-OG1 2.98Å; T1213-T1216 PolarHBondContact O-N 3.48Å; Y1214-T1216 PolarHBondContact O-N 3.22Å; T1216-R1220 PolarHBondContact O-N 2.65Å; T1216-R1220 VanDerWaalsContact O-N 3.11Å
1217	V	86.4	Confident	83.1	Confident	1 Å²	1	54 Å²	54	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-60.5	-50.3	173.5	169.9	0	0	0	0	110.9	I1168 C1169 L1172 V1192 T1213 Y1214 R1219 R1220 L1221	I1168-V1217 HydrophobicContact CG2-CG1 3.78Å; I1168-V1217 HydrophobicContact CG2-CG2 4.17Å; C1169-V1217 HydrophobicContact CB-CG2 3.54Å; L1172-V1217 HydrophobicContact CD1-CB 4.41Å; L1172-V1217 HydrophobicContact CD1-CG1 3.98Å; L1172-V1217 HydrophobicContact CD1-CG2 4.28Å; V1192-V1217 HydrophobicContact CG1-CG1 4.38Å; V1192-V1217 HydrophobicContact CG2-CG1 3.92Å; T1213-V1217 WeakPolarHBondContact O-CG2 3.4Å; T1213-V1217 PolarHBondContact O-N 2.97Å; Y1214-V1217 PolarHBondContact O-N 3.48Å; Y1214-V1217 VanDerWaalsContact O-N 3.16Å; V1217-R1219 PolarHBondContact O-N 2.86Å; V1217-R1220 PolarHBondContact O-N 2.91Å; V1217-L1221 HydrophobicContact CG1-CD1 3.81Å; V1217-L1221 HydrophobicContact CG1-CG 4.42Å; V1217-L1221 WeakPolarHBondContact O-CG 3.39Å; V1217-L1221 PolarHBondContact O-N 3.49Å
1218	H	86.7	Confident	82.6	Confident	54 Å²	54	51 Å²	51	25%	0.25	27%	0.267	C	S	.	.	H	α-helix	trans	-58.3	-51	-179.5	-173.9	-49.5	0	0	0	110.7	Y1214 R1220 L1221 T1222 M1241	Y1214-H1218 AromaticContact CZ-CD2 3.96Å; Y1214-H1218 VanDerWaalsContact O-CB 3.32Å; Y1214-H1218 WeakPolarHBondContact O-CB 3.32Å; Y1214-H1218 PolarHBondContact O-N 3.27Å; H1218-R1220 PolarHBondContact O-N 2.38Å; H1218-L1221 PolarHBondContact O-N 3.06Å; H1218-T1222 VanDerWaalsContact CE1-CB 3.47Å; H1218-T1222 WeakPolarHBondContact CE1-CB 3.48Å; H1218-T1222 PolarHBondContact CE1-OG1 3.39Å; H1218-T1222 PolarHBondContact ND1-OG1 3.19Å; H1218-T1222 PolarHBondContact NE2-OG1 3.19Å; H1218-T1222 WeakPolarHBondContact O-CB 3.47Å; H1218-T1222 PolarHBondContact O-N 3.34Å; H1218-T1222 PolarHBondContact O-OG1 3.44Å; H1218-M1241 HydrophobicContact CB-CE 4.04Å; H1218-M1241 WeakPolarHBondContact CD2-CE 3.42Å; H1218-M1241 VanDerWaalsContact CG-CE 3.44Å
1219	R	84.9	Confident	81.6	Confident	160 Å²	160	52.7 Å²	52.7	60%	0.604	28%	0.28	S	S	*	.	H	α-helix	trans	-61.2	-42.1	-179.7	-69	166.6	-161.1	-157.4	6.8	112.1	D1215 V1217 V1223	D1215-R1219 WeakPolarHBondContact O-CB 3.1Å; D1215-R1219 WeakPolarHBondContact O-CD 3.32Å; D1215-R1219 WeakPolarHBondContact O-CG 3.33Å; D1215-R1219 PolarHBondContact O-N 2.95Å; D1215-R1219 IonicContact OD2-CZ 3.5Å; D1215-R1219 IonicContact OD2-NE 3.69Å; D1215-R1219 IonicContact OD2-NH2 2.65Å; D1215-R1219 PolarHBondContact OD2-NH2 3.11Å; V1217-R1219 PolarHBondContact O-N 2.86Å; R1219-V1223 VanDerWaalsContact O-CG2 3.32Å; R1219-V1223 WeakPolarHBondContact O-CG2 3.43Å; R1219-V1223 PolarHBondContact O-N 3.16Å
1220	R	84.6	Confident	80.6	Confident	59 Å²	59	59 Å²	59	22%	0.223	32%	0.318	C	S	.	.	H	α-helix	trans	-64.1	-45.7	175.5	-179.3	60.2	-177.5	-123.9	-1.5	111.4	R1175 L1176 L1178 T1216 V1217 H1218 T1222 V1223 E1224	R1175-R1220 PolarHBondContact O-NH2 3.44Å; L1176-R1220 PolarHBondContact O-NH1 2.74Å; L1176-R1220 PolarHBondContact O-NH2 2.9Å; L1176-R1220 VanDerWaalsContact O-NH2 3.07Å; L1178-R1220 PolarHBondContact O-NH2 3.3Å; T1216-R1220 PolarHBondContact O-N 2.65Å; T1216-R1220 VanDerWaalsContact O-N 3.11Å; V1217-R1220 PolarHBondContact O-N 2.91Å; H1218-R1220 PolarHBondContact O-N 2.38Å; R1220-T1222 PolarHBondContact O-N 2.73Å; R1220-V1223 PolarHBondContact O-N 3.01Å; R1220-E1224 HydrophobicContact CG-CG 4.33Å; R1220-E1224 IonicContact CZ-OE1 3.11Å; R1220-E1224 IonicContact NE-OE1 2.79Å; R1220-E1224 PolarHBondContact NE-OE1 3Å; R1220-E1224 IonicContact NH2-OE1 2.68Å; R1220-E1224 PolarHBondContact NH2-OE1 2.68Å; R1220-E1224 VanDerWaalsContact O-CG 3.26Å; R1220-E1224 WeakPolarHBondContact O-CG 3.28Å; R1220-E1224 PolarHBondContact O-N 3.07Å
1221	L	83.6	Confident	79.3	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-64.6	-38.1	178.8	-67.8	175.7	0	0	0	112.6	L1172 L1180 L1185 L1188 I1189 V1192 V1217 H1218 E1224 E1225 M1241	L1172-L1221 HydrophobicContact CD1-CD2 4.33Å; L1172-L1221 HydrophobicContact CD1-CG 4.29Å; L1172-L1221 HydrophobicContact CD2-CD2 4.31Å; L1180-L1221 HydrophobicContact CD1-CD2 4.19Å; L1185-L1221 HydrophobicContact CD1-CD2 3.93Å; L1188-L1221 HydrophobicContact CB-CD1 4.39Å; L1188-L1221 HydrophobicContact CB-CD2 3.97Å; L1188-L1221 HydrophobicContact CD1-CD2 4.4Å; I1189-L1221 HydrophobicContact CG1-CB 4.36Å; V1192-L1221 HydrophobicContact CB-CD1 4.35Å; V1192-L1221 HydrophobicContact CG2-CD1 3.95Å; V1217-L1221 HydrophobicContact CG1-CD1 3.81Å; V1217-L1221 HydrophobicContact CG1-CG 4.42Å; V1217-L1221 WeakPolarHBondContact O-CG 3.39Å; V1217-L1221 PolarHBondContact O-N 3.49Å; H1218-L1221 PolarHBondContact O-N 3.06Å; L1221-E1224 PolarHBondContact O-N 2.94Å; L1221-E1225 VanDerWaalsContact O-CB 3.3Å; L1221-E1225 WeakPolarHBondContact O-CB 3.32Å; L1221-E1225 PolarHBondContact O-N 3.4Å; L1221-M1241 HydrophobicContact CB-CE 4.48Å; L1221-M1241 HydrophobicContact CB-CG 3.95Å; L1221-M1241 HydrophobicContact CB-SD 3.91Å; L1221-M1241 HydrophobicContact CD1-SD 4.13Å
1222	T	82.1	Confident	77.6	Confident	45 Å²	45	63.5 Å²	63.5	28%	0.276	34%	0.342	S	S	.	.	H	α-helix	trans	-66.2	-37.6	174.5	-54.3	0	0	0	0	112.3	H1218 R1220 A1226	H1218-T1222 VanDerWaalsContact CE1-CB 3.47Å; H1218-T1222 WeakPolarHBondContact CE1-CB 3.48Å; H1218-T1222 PolarHBondContact CE1-OG1 3.39Å; H1218-T1222 PolarHBondContact ND1-OG1 3.19Å; H1218-T1222 PolarHBondContact NE2-OG1 3.19Å; H1218-T1222 WeakPolarHBondContact O-CB 3.47Å; H1218-T1222 PolarHBondContact O-N 3.34Å; H1218-T1222 PolarHBondContact O-OG1 3.44Å; R1220-T1222 PolarHBondContact O-N 2.73Å; T1222-A1226 WeakPolarHBondContact O-CB 3.19Å; T1222-A1226 PolarHBondContact O-N 2.55Å
1223	V	82.2	Confident	75.9	Confident	89 Å²	89	59.1 Å²	59.1	54%	0.539	35%	0.35	S	S	.	.	H	α-helix	trans	-68.2	-46.3	175.1	169.9	0	0	0	0	111	R1219 R1220 E1225 A1226 T1227	R1219-V1223 VanDerWaalsContact O-CG2 3.32Å; R1219-V1223 WeakPolarHBondContact O-CG2 3.43Å; R1219-V1223 PolarHBondContact O-N 3.16Å; R1220-V1223 PolarHBondContact O-N 3.01Å; V1223-E1225 VanDerWaalsContact C-N 3.31Å; V1223-E1225 PolarHBondContact O-N 2.79Å; V1223-A1226 PolarHBondContact O-N 3.04Å; V1223-T1227 PolarHBondContact O-N 3.13Å; V1223-T1227 PolarHBondContact O-OG1 3.37Å
1224	E	77.1	Confident	74.3	Confident	11 Å²	11	59.7 Å²	59.7	5%	0.051	37%	0.366	C	S	.	.	H	α-helix	trans	-58.9	-41.1	175	-69.9	-81.2	170.5	0	0	112.1	L1180 L1185 R1220 L1221 T1227 A1228	L1180-E1224 HydrophobicContact CD1-CB 4.45Å; L1180-E1224 HydrophobicContact CD1-CG 3.89Å; L1180-E1224 HydrophobicContact CG-CG 4.18Å; L1180-E1224 PolarHBondContact N-OE2 2.71Å; L1185-E1224 HydrophobicContact CD1-CB 3.6Å; L1185-E1224 HydrophobicContact CD2-CB 4.16Å; R1220-E1224 HydrophobicContact CG-CG 4.33Å; R1220-E1224 IonicContact CZ-OE1 3.11Å; R1220-E1224 IonicContact NE-OE1 2.79Å; R1220-E1224 PolarHBondContact NE-OE1 3Å; R1220-E1224 IonicContact NH2-OE1 2.68Å; R1220-E1224 PolarHBondContact NH2-OE1 2.68Å; R1220-E1224 VanDerWaalsContact O-CG 3.26Å; R1220-E1224 WeakPolarHBondContact O-CG 3.28Å; R1220-E1224 PolarHBondContact O-N 3.07Å; L1221-E1224 PolarHBondContact O-N 2.94Å; E1224-T1227 PolarHBondContact O-N 2.82Å; E1224-A1228 VanDerWaalsContact O-CB 3.23Å; E1224-A1228 WeakPolarHBondContact O-CB 3.44Å; E1224-A1228 PolarHBondContact O-N 2.98Å
1225	E	77.8	Confident	72.6	Confident	24 Å²	24	60.4 Å²	60.4	11%	0.112	38%	0.376	C	S	.	.	H	α-helix	trans	-62.6	-45.2	174.5	-173.8	-172.1	151.2	0	0	112.2	I1189 L1221 V1223 A1228 S1229 L1236 T1240 M1241	I1189-E1225 HydrophobicContact CD1-CB 4.31Å; I1189-E1225 HydrophobicContact CD1-CG 4.42Å; L1221-E1225 VanDerWaalsContact O-CB 3.3Å; L1221-E1225 WeakPolarHBondContact O-CB 3.32Å; L1221-E1225 PolarHBondContact O-N 3.4Å; V1223-E1225 VanDerWaalsContact C-N 3.31Å; V1223-E1225 PolarHBondContact O-N 2.79Å; E1225-A1228 PolarHBondContact O-N 2.92Å; E1225-S1229 VanDerWaalsContact O-CB 3.24Å; E1225-S1229 WeakPolarHBondContact O-CB 3.11Å; E1225-S1229 PolarHBondContact O-N 3.04Å; E1225-S1229 PolarHBondContact O-OG 3.43Å; E1225-L1236 HydrophobicContact CG-CD1 4.29Å; E1225-T1240 VanDerWaalsContact OE1-CA 3.3Å; E1225-T1240 WeakPolarHBondContact OE1-CA 3.3Å; E1225-T1240 WeakPolarHBondContact OE1-CB 3.3Å; E1225-T1240 PolarHBondContact OE1-OG1 3.41Å; E1225-M1241 VanDerWaalsContact OE2-CB 3.28Å; E1225-M1241 WeakPolarHBondContact OE2-CB 3.48Å; E1225-M1241 WeakPolarHBondContact OE2-CG 3.24Å; E1225-M1241 PolarHBondContact OE2-N 3.3Å
1226	A	73.5	Confident	71.3	Confident	57 Å²	57	59 Å²	59	47%	0.471	37%	0.368	S	S	.	.	H	α-helix	trans	-62.6	-43.3	176.6	0	0	0	0	0	111.6	T1222 V1223 S1229 V1230	T1222-A1226 WeakPolarHBondContact O-CB 3.19Å; T1222-A1226 PolarHBondContact O-N 2.55Å; V1223-A1226 PolarHBondContact O-N 3.04Å; A1226-S1229 PolarHBondContact O-N 3.02Å; A1226-V1230 WeakPolarHBondContact O-CG2 3.23Å; A1226-V1230 PolarHBondContact O-N 3.42Å
1227	T	73.1	Confident	69.8	Low	68 Å²	68	63.7 Å²	63.7	42%	0.417	39%	0.385	S	S	.	.	H	α-helix	trans	-64.8	-48.5	176.8	-64	0	0	0	0	111.9	V1223 E1224 S1229 V1230 S1231	V1223-T1227 PolarHBondContact O-N 3.13Å; V1223-T1227 PolarHBondContact O-OG1 3.37Å; E1224-T1227 PolarHBondContact O-N 2.82Å; T1227-S1229 VanDerWaalsContact C-N 3.3Å; T1227-S1229 PolarHBondContact O-N 3.2Å; T1227-V1230 PolarHBondContact O-N 2.84Å; T1227-V1230 VanDerWaalsContact O-N 3.13Å; T1227-S1231 PolarHBondContact O-N 3.4Å; T1227-S1231 VanDerWaalsContact O-N 3.16Å; T1227-S1231 PolarHBondContact O-OG 3.23Å
1228	A	67.5	Low	68.5	Low	3 Å²	3	67.7 Å²	67.7	3%	0.025	43%	0.426	C	S	.	.	H	α-helix	trans	-64.1	-33.6	179.1	0	0	0	0	0	112.9	L1185 E1224 E1225 V1230 S1231 E1232 L1236	L1185-A1228 HydrophobicContact CD2-CB 3.88Å; E1224-A1228 VanDerWaalsContact O-CB 3.23Å; E1224-A1228 WeakPolarHBondContact O-CB 3.44Å; E1224-A1228 PolarHBondContact O-N 2.98Å; E1225-A1228 PolarHBondContact O-N 2.92Å; A1228-V1230 VanDerWaalsContact C-N 3.25Å; A1228-V1230 PolarHBondContact O-N 3.22Å; A1228-S1231 WeakPolarHBondContact CA-OG 3.26Å; A1228-S1231 PolarHBondContact O-N 2.92Å; A1228-S1231 PolarHBondContact O-OG 3.21Å; A1228-E1232 PolarHBondContact O-N 3.28Å; A1228-L1236 HydrophobicContact CB-CD1 3.95Å
1229	S	65.5	Low	67.2	Low	62 Å²	62	67.4 Å²	67.4	43%	0.434	43%	0.426	S	S	.	.	H	α-helix	trans	-66.5	-24.9	175.4	-61.5	0	0	0	0	113.4	E1225 A1226 T1227 L1236	E1225-S1229 VanDerWaalsContact O-CB 3.24Å; E1225-S1229 WeakPolarHBondContact O-CB 3.11Å; E1225-S1229 PolarHBondContact O-N 3.04Å; E1225-S1229 PolarHBondContact O-OG 3.43Å; A1226-S1229 PolarHBondContact O-N 3.02Å; T1227-S1229 VanDerWaalsContact C-N 3.3Å; T1227-S1229 PolarHBondContact O-N 3.2Å; S1229-L1236 WeakPolarHBondContact OG-CD1 3.32Å
1230	V	61.9	Low	66.4	Low	131 Å²	131	61.9 Å²	61.9	79%	0.794	41%	0.41	S	S	*	.	H	α-helix	trans	-89	-29.2	177.4	174.1	0	0	0	0	111.8	A1226 T1227 A1228	A1226-V1230 WeakPolarHBondContact O-CG2 3.23Å; A1226-V1230 PolarHBondContact O-N 3.42Å; T1227-V1230 PolarHBondContact O-N 2.84Å; T1227-V1230 VanDerWaalsContact O-N 3.13Å; A1228-V1230 VanDerWaalsContact C-N 3.25Å; A1228-V1230 PolarHBondContact O-N 3.22Å
1231	S	57.3	Low	65.8	Low	75 Å²	75	59.1 Å²	59.1	52%	0.524	40%	0.4	S	S	.	.	H	α-helix	trans	-82.6	-35	-178.1	59.1	0	0	0	0	114.8	T1227 A1228	T1227-S1231 PolarHBondContact O-N 3.4Å; T1227-S1231 VanDerWaalsContact O-N 3.16Å; T1227-S1231 PolarHBondContact O-OG 3.23Å; A1228-S1231 WeakPolarHBondContact CA-OG 3.26Å; A1228-S1231 PolarHBondContact O-N 2.92Å; A1228-S1231 PolarHBondContact O-OG 3.21Å
1232	E	53.3	Low	64.8	Low	117 Å²	117	66.7 Å²	66.7	55%	0.547	43%	0.432	S	S	.	.	S	Bend	trans	-130.1	101.9	176.8	-72	-157.9	152.1	0	0	112.3	I1182 A1228 G1234 G1235	I1182-E1232 HydrophobicContact CD1-CB 4.49Å; I1182-E1232 HydrophobicContact CD1-CG 4.47Å; I1182-E1232 WeakPolarHBondContact CD1-OE2 3.45Å; A1228-E1232 PolarHBondContact O-N 3.28Å; E1232-G1234 PolarHBondContact O-N 3.39Å; E1232-G1235 PolarHBondContact O-N 2.92Å
1233	G	50.7	Low	63.6	Low	94 Å²	94	69 Å²	69	97%	0.969	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	54.6	-177.1	0	0	0	0	0	116.1
1234	G	52.8	Low	62.1	Low	61 Å²	61	68.3 Å²	68.3	63%	0.629	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	174.2	-7.4	176.9	0	0	0	0	0	115.4	E1232 L1236	E1232-G1234 PolarHBondContact O-N 3.39Å; G1234-L1236 PolarHBondContact O-N 3.38Å
1235	G	52	Low	60.7	Low	24 Å²	24	72.7 Å²	72.7	25%	0.247	47%	0.466	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-26.2	-168.1	0	0	0	0	0	116.5	K1186 E1232	K1186-G1235 WeakPolarHBondContact CE-O 3.29Å; K1186-G1235 PolarHBondContact NZ-O 3.33Å; E1232-G1235 PolarHBondContact O-N 2.92Å
1236	L	57.3	Low	59.1	Low	26 Å²	26	79.9 Å²	79.9	14%	0.136	50%	0.5	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	13.4	-158.7	-85.1	163.1	0	0	0	117.3	K1186 E1225 A1228 S1229 G1234 G1238 I1239	K1186-L1236 HydrophobicContact CG-CD2 3.92Å; E1225-L1236 HydrophobicContact CG-CD1 4.29Å; A1228-L1236 HydrophobicContact CB-CD1 3.95Å; S1229-L1236 WeakPolarHBondContact OG-CD1 3.32Å; G1234-L1236 PolarHBondContact O-N 3.38Å; L1236-G1238 PolarHBondContact O-N 3.5Å; L1236-I1239 PolarHBondContact O-N 3.5Å
1237	Q	54.7	Low	57.4	Low	177 Å²	177	85.9 Å²	85.9	83%	0.827	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.4	124	-178.7	-74.7	-174.6	-23.5	0	0	114
1238	G	60	Low	55.7	Low	84 Å²	84	91.7 Å²	91.7	87%	0.866	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.6	3.7	167.7	0	0	0	0	0	117.7	L1236	L1236-G1238 PolarHBondContact O-N 3.5Å
1239	I	60.3	Low	54.2	Low	49 Å²	49	101.1 Å²	101.1	25%	0.251	58%	0.584	S	S	.	*			trans	-138.7	113.6	178.6	-58.4	178.9	0	0	0	109.9	K1186 I1189 K1190 L1236	K1186-I1239 HydrophobicContact CB-CD1 4.35Å; K1186-I1239 HydrophobicContact CD-CD1 4.43Å; K1186-I1239 HydrophobicContact CG-CD1 4.42Å; I1189-I1239 HydrophobicContact CB-CG2 4.1Å; I1189-I1239 HydrophobicContact CG2-CG2 3.6Å; K1190-I1239 HydrophobicContact CD-CD1 4.31Å; L1236-I1239 PolarHBondContact O-N 3.5Å
1240	T	68.2	Low	52.7	Low	44 Å²	44	105.6 Å²	105.6	27%	0.27	64%	0.64	S	S	.	*			trans	-136.5	148.4	177.9	178.8	0	0	0	0	111.9	K1193 E1225 K1242	K1193-T1240 VanDerWaalsContact CD-O 3.22Å; K1193-T1240 WeakPolarHBondContact CD-O 3.46Å; K1193-T1240 PolarHBondContact NZ-O 2.68Å; E1225-T1240 VanDerWaalsContact OE1-CA 3.3Å; E1225-T1240 WeakPolarHBondContact OE1-CA 3.3Å; E1225-T1240 WeakPolarHBondContact OE1-CB 3.3Å; E1225-T1240 PolarHBondContact OE1-OG1 3.41Å; T1240-K1242 VanDerWaalsContact C-N 3.31Å; T1240-K1242 HydrophobicContact CG2-CB 4.23Å; T1240-K1242 PolarHBondContact OG1-N 2.73Å
1241	M	70.4	Confident	52.2	Low	1 Å²	1	104.4 Å²	104.4	1%	0.005	63%	0.632	C	S	.	*	S	Bend	trans	-66.8	-26.4	169.9	-76.7	-61.6	-54.9	0	0	113.1	I1189 K1193 H1218 L1221 E1225 D1243	I1189-M1241 HydrophobicContact CB-CG 4.49Å; I1189-M1241 HydrophobicContact CB-SD 4.03Å; I1189-M1241 HydrophobicContact CD1-CG 4.05Å; I1189-M1241 HydrophobicContact CG1-CG 3.79Å; I1189-M1241 HydrophobicContact CG1-SD 3.75Å; I1189-M1241 HydrophobicContact CG2-CG 4.09Å; I1189-M1241 HydrophobicContact CG2-SD 3.74Å; K1193-M1241 WeakPolarHBondContact CE-O 3.31Å; K1193-M1241 HydrophobicContact CG-SD 4.29Å; K1193-M1241 PolarHBondContact NZ-O 3.48Å; H1218-M1241 HydrophobicContact CB-CE 4.04Å; H1218-M1241 WeakPolarHBondContact CD2-CE 3.42Å; H1218-M1241 VanDerWaalsContact CG-CE 3.44Å; L1221-M1241 HydrophobicContact CB-CE 4.48Å; L1221-M1241 HydrophobicContact CB-CG 3.95Å; L1221-M1241 HydrophobicContact CB-SD 3.91Å; L1221-M1241 HydrophobicContact CD1-SD 4.13Å; E1225-M1241 VanDerWaalsContact OE2-CB 3.28Å; E1225-M1241 WeakPolarHBondContact OE2-CB 3.48Å; E1225-M1241 WeakPolarHBondContact OE2-CG 3.24Å; E1225-M1241 PolarHBondContact OE2-N 3.3Å; M1241-D1243 PolarHBondContact O-N 3.47Å
1242	K	64	Low	51.9	Low	158 Å²	158	105.9 Å²	105.9	69%	0.687	64%	0.638	S	S	*	*	S	Bend	trans	-59.6	135	174.9	-73.9	-170.1	172.2	-167.9	0	110.7	K1193 T1240 S1244	K1193-K1242 PolarHBondContact NZ-O 2.86Å; T1240-K1242 VanDerWaalsContact C-N 3.31Å; T1240-K1242 HydrophobicContact CG2-CB 4.23Å; T1240-K1242 PolarHBondContact OG1-N 2.73Å; K1242-S1244 PolarHBondContact O-N 3.16Å
1243	D	57.2	Low	51.8	Low	95 Å²	95	105.3 Å²	105.3	51%	0.508	64%	0.643	S	S	.	*			trans	-70.8	128.8	174.2	-71.5	-41.6	0	0	0	111	K1193 M1241	K1193-D1243 WeakPolarHBondContact CE-OD1 3.36Å; K1193-D1243 IonicContact NZ-OD1 3.16Å; K1193-D1243 PolarHBondContact NZ-OD1 3.13Å; M1241-D1243 PolarHBondContact O-N 3.47Å
1244	S	50.1	Low	51.9	Low	74 Å²	74	105.9 Å²	105.9	52%	0.517	62%	0.624	S	S	.	*	S	Bend	trans	-99.2	2.3	-175.9	-43.7	0	0	0	0	111.7	K1242 E1246	K1242-S1244 PolarHBondContact O-N 3.16Å; S1244-E1246 VanDerWaalsContact C-N 3.32Å
1245	D	47.5	Very low	51.9	Low	102 Å²	102	108.8 Å²	108.8	55%	0.545	62%	0.623	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.7	1.1	-179.5	-64.9	-16.7	0	0	0	111.6	R1197	R1197-D1245 IonicContact CZ-OD2 3.94Å; R1197-D1245 IonicContact NH1-OD1 3.11Å; R1197-D1245 PolarHBondContact NH1-OD1 3.13Å; R1197-D1245 IonicContact NH1-OD2 3.38Å; R1197-D1245 PolarHBondContact NH1-OD2 3.36Å
1246	E	43.3	Very low	51.9	Low	176 Å²	176	114.4 Å²	114.4	82%	0.822	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	-1.3	178.2	-71	-166.5	155.4	0	0	114.8	S1244	S1244-E1246 VanDerWaalsContact C-N 3.32Å
1247	E	39.1	Very low	51.5	Low	183 Å²	183	120.7 Å²	120.7	86%	0.855	69%	0.685	S	S	*	*	S	Bend	trans	-107.5	13	-177.3	-69.7	-171.5	154.1	0	0	114.5
1248	E	36.8	Very low	51.2	Low	189 Å²	189	116.4 Å²	116.4	88%	0.883	67%	0.674	S	S	*	*	S	Bend	trans	-113.1	10	178.6	-83.4	-165.3	154.5	0	0	116
1249	E	35	Very low	50.5	Low	202 Å²	202	119.1 Å²	119.1	94%	0.944	66%	0.658	S	S	*	*			trans	-112.7	97.4	162.9	-73.1	-160.2	155.9	0	0	111.4
1250	G	34	Very low	49.6	Very low	156 Å²	156	125.5 Å²	125.5	100%	1.608	70%	0.695	S	S	*	*			trans	-161.9	0	177.4	0	0	0	0	0	113.6

Retrieved 1,250 of 1,250 residues in 337.8 ms (Link to these results)

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