A0A093JAK8_STRCA Loading...

Transmembrane and coiled-coil domain-containing protein 3

AlphaFold DB , UniProt , Accession A0A093JAK8, Species STRCA (Struthio camelus australis), Gene n/a, Length 678 aa.

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(Predicted Aligned Error values between residue pairs)

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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	27.9	Very low	30.8	Very low	229 Å²	229	145.5 Å²	145.5	100%	1.128	80%	0.795	S	S	*	*				0	113.7	0	-159.5	163.1	158.1	0	0	107.1
2	Q	24.2	Very low	31	Very low	172 Å²	172	143.8 Å²	143.8	80%	0.804	78%	0.783	S	S	*	*			trans	44.2	107.9	166.4	-70.4	167.9	-29.4	0	0	118.3
3	A	28.7	Very low	31.4	Very low	85 Å²	85	141.8 Å²	141.8	70%	0.702	77%	0.77	S	S	*	*				75.1	131.9	60.1	0	0	0	0	0	115.4
4	T	27.7	Very low	31.5	Very low	150 Å²	150	137.6 Å²	137.6	92%	0.92	76%	0.756	S	S	*	*			trans	100.9	124.8	151.8	71.2	0	0	0	0	119.4
5	G	25.9	Very low	31.5	Very low	72 Å²	72	138.7 Å²	138.7	74%	0.742	76%	0.759	S	S	*	*			trans	142.8	40.3	161.8	0	0	0	0	0	118.2
6	F	33.8	Very low	31.5	Very low	201 Å²	201	139.8 Å²	139.8	88%	0.882	76%	0.763	S	S	*	*			trans	-140.7	102.8	169.6	-110.6	-87.5	0	0	0	109.4
7	I	34.2	Very low	31.4	Very low	159 Å²	159	137.1 Å²	137.1	82%	0.815	76%	0.756	S	S	*	*			trans	-158.4	-16.9	162.1	-93.6	134.1	0	0	0	114	L9	I7-L9 PolarHBondContact O-N 3.05Å
8	S	34.2	Very low	31.3	Very low	97 Å²	97	133 Å²	133	68%	0.678	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	6.2	-166	77.5	0	0	0	0	118.7
9	L	35.8	Very low	31.2	Very low	131 Å²	131	136.1 Å²	136.1	69%	0.686	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.8	-11.2	-175.3	-142.3	81.8	0	0	0	115.2	I7	I7-L9 PolarHBondContact O-N 3.05Å
10	W	34.2	Very low	31.2	Very low	204 Å²	204	137.8 Å²	137.8	77%	0.773	76%	0.764	S	S	*	*	S	Bend	trans	-88.5	-27.3	-177.7	-99.8	76.9	0	0	0	113.5
11	T	32.4	Very low	31.1	Very low	101 Å²	101	135.9 Å²	135.9	62%	0.62	77%	0.766	S	S	*	*	H	α-helix	trans	-77	-24.3	-178.4	47.2	0	0	0	0	113.5
12	L	32.8	Very low	31.4	Very low	124 Å²	124	132.4 Å²	132.4	65%	0.649	75%	0.752	S	S	*	*	H	α-helix	trans	-82	-20.9	-179.6	-105.9	143.9	0	0	0	113.8
13	I	37	Very low	31.9	Very low	118 Å²	118	129.5 Å²	129.5	61%	0.605	75%	0.746	S	S	*	*	H	α-helix	trans	-92.8	-28.6	-178.6	-62.2	172.7	0	0	0	111.4	L15	I13-L15 VanDerWaalsContact C-N 3.29Å; I13-L15 PolarHBondContact O-N 2.81Å
14	S	32.9	Very low	32.1	Very low	83 Å²	83	128.7 Å²	128.7	58%	0.58	75%	0.747	S	S	*	*	H	α-helix	trans	-68.8	-23.2	173.9	-74.5	0	0	0	0	113.9
15	L	30.5	Very low	32.7	Very low	154 Å²	154	129.9 Å²	129.9	81%	0.806	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-27.1	-179	-128.5	94.5	0	0	0	113.6	I13	I13-L15 VanDerWaalsContact C-N 3.29Å; I13-L15 PolarHBondContact O-N 2.81Å
16	L	32.6	Very low	33.6	Very low	157 Å²	157	132.4 Å²	132.4	82%	0.822	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-13.7	-178.4	-104.9	98.5	0	0	0	114.1
17	C	29.1	Very low	33.8	Very low	94 Å²	94	127 Å²	127	64%	0.635	71%	0.712	S	S	*	*	S	Bend	trans	-102.9	8.2	-176.3	-149.8	0	0	0	0	113.6
18	G	29.3	Very low	34	Very low	63 Å²	63	124.6 Å²	124.6	65%	0.649	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	7.7	-173.8	0	0	0	0	0	116.7
19	Q	29.7	Very low	34.5	Very low	192 Å²	192	122.5 Å²	122.5	90%	0.897	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.9	5.9	-173.3	-81.7	-150.2	-49.2	0	0	117.4
20	L	31.2	Very low	34.7	Very low	169 Å²	169	120 Å²	120	89%	0.885	67%	0.673	S	S	*	*			trans	-135.9	64.4	175.5	-92.1	144.8	0	0	0	110.8
21	A	28.6	Very low	34.8	Very low	98 Å²	98	115.7 Å²	115.7	81%	0.81	66%	0.66	S	S	*	*			trans	-88	106.1	169.2	0	0	0	0	0	109.6
22	N	33.6	Very low	35.1	Very low	157 Å²	157	116.9 Å²	116.9	84%	0.84	66%	0.658	S	S	*	*			trans	-166.3	72.7	137	-135	13.9	0	0	0	113.1
23	T	34.8	Very low	35.3	Very low	110 Å²	110	114.1 Å²	114.1	68%	0.675	65%	0.653	S	S	*	*			trans	-169	85.4	156.5	34.9	0	0	0	0	108.8	E25	T23-E25 PolarHBondContact O-N 2.99Å
24	G	34.5	Very low	35.5	Very low	69 Å²	69	114.7 Å²	114.7	71%	0.711	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-15.3	-164.4	0	0	0	0	0	117.4
25	E	40.6	Very low	35.6	Very low	174 Å²	174	118.6 Å²	118.6	81%	0.813	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	-23	-170.9	-68.6	-172.1	150.4	0	0	114.5	T23	T23-E25 PolarHBondContact O-N 2.99Å
26	H	42.8	Very low	36	Very low	125 Å²	125	116.4 Å²	116.4	58%	0.579	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-10.6	-177.4	-71.1	-70.8	0	0	0	114.3
27	E	39.4	Very low	36.3	Very low	89 Å²	89	114.2 Å²	114.2	42%	0.416	64%	0.637	S	S	.	*	H	α-helix	trans	-76.4	-29.3	-177.8	-114.4	-164	178.6	0	0	113.6	V29 V30 K31	E27-V29 VanDerWaalsContact C-N 3.29Å; E27-V29 PolarHBondContact O-N 3.02Å; E27-V30 PolarHBondContact O-N 3.21Å; E27-K31 PolarHBondContact O-N 3.21Å; E27-K31 IonicContact OE2-NZ 2.72Å; E27-K31 PolarHBondContact OE2-NZ 2.82Å
28	D	38.6	Very low	36.8	Very low	108 Å²	108	122.3 Å²	122.3	58%	0.578	65%	0.654	S	S	*	*	H	α-helix	trans	-69.4	-30.5	-178.4	-78.6	-22	0	0	0	112.1	K31 H32	D28-K31 PolarHBondContact O-N 3.25Å; D28-H32 WeakPolarHBondContact O-CB 3.33Å; D28-H32 PolarHBondContact O-N 3.12Å
29	V	43.1	Very low	37.1	Very low	53 Å²	53	122.1 Å²	122.1	32%	0.321	65%	0.652	S	S	.	*	H	α-helix	trans	-65.9	-41.1	174.7	-177	0	0	0	0	110.7	E27 A33	E27-V29 VanDerWaalsContact C-N 3.29Å; E27-V29 PolarHBondContact O-N 3.02Å; V29-A33 WeakPolarHBondContact O-CB 3.25Å; V29-A33 PolarHBondContact O-N 2.94Å; V29-A33 VanDerWaalsContact O-N 3.12Å
30	V	40.1	Very low	37.7	Very low	78 Å²	78	123.7 Å²	123.7	47%	0.473	66%	0.656	S	S	.	*	H	α-helix	trans	-71.7	-39.2	179.5	-178.9	0	0	0	0	111.3	E27	E27-V30 PolarHBondContact O-N 3.21Å
31	K	38.1	Very low	38.4	Very low	113 Å²	113	119.4 Å²	119.4	49%	0.491	65%	0.652	S	S	.	*	H	α-helix	trans	-70.1	-32.6	176.9	-74.7	172.4	-172.7	154.6	0	112.6	E27 D28	E27-K31 PolarHBondContact O-N 3.21Å; E27-K31 IonicContact OE2-NZ 2.72Å; E27-K31 PolarHBondContact OE2-NZ 2.82Å; D28-K31 PolarHBondContact O-N 3.25Å
32	H	38.8	Very low	38.7	Very low	127 Å²	127	117.7 Å²	117.7	59%	0.588	64%	0.638	S	S	*	*	H	α-helix	trans	-75.3	-33.9	175.4	-107	44.2	0	0	0	113.7	D28 I34 K35	D28-H32 WeakPolarHBondContact O-CB 3.33Å; D28-H32 PolarHBondContact O-N 3.12Å; H32-I34 PolarHBondContact O-N 3.3Å; H32-K35 PolarHBondContact O-N 2.78Å
33	A	36.8	Very low	39.2	Very low	66 Å²	66	114.8 Å²	114.8	55%	0.545	63%	0.626	S	S	.	*	H	α-helix	trans	-61.8	-30.6	178	0	0	0	0	0	113.2	V29 K35	V29-A33 WeakPolarHBondContact O-CB 3.25Å; V29-A33 PolarHBondContact O-N 2.94Å; V29-A33 VanDerWaalsContact O-N 3.12Å; A33-K35 VanDerWaalsContact C-N 3.34Å; A33-K35 PolarHBondContact O-N 3.02Å
34	I	40.5	Very low	39.9	Very low	129 Å²	129	114.4 Å²	114.4	66%	0.662	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-20.2	-178.9	-64.2	170.4	0	0	0	112.3	H32	H32-I34 PolarHBondContact O-N 3.3Å
35	K	35.7	Very low	40.5	Very low	166 Å²	166	116 Å²	116	72%	0.722	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-13.3	-170.3	-155.4	172.6	-178.2	-179.2	0	114.8	H32 A33	H32-K35 PolarHBondContact O-N 2.78Å; A33-K35 VanDerWaalsContact C-N 3.34Å; A33-K35 PolarHBondContact O-N 3.02Å
36	L	37.2	Very low	40.9	Very low	107 Å²	107	114.6 Å²	114.6	56%	0.56	61%	0.612	S	S	*	*			trans	-112.4	12.5	-156.6	-135.9	95.1	0	0	0	119.8
37	H	40.9	Very low	41.2	Very low	112 Å²	112	115.5 Å²	115.5	52%	0.519	61%	0.611	S	S	.	*			trans	-129.6	91	178.9	-88.2	2.9	0	0	0	115.4	G39 L122	H37-G39 PolarHBondContact O-N 3.11Å; H37-L122 PolarHBondContact CE1-O 3.45Å; H37-L122 PolarHBondContact NE2-O 2.88Å
38	R	38.9	Very low	41.9	Very low	264 Å²	264	117.8 Å²	117.8	100%	0.996	62%	0.619	S	S	*	*			trans	-87.7	85.9	159.2	-99.1	-176.4	172.3	173.9	-1.2	109.5
39	G	34.6	Very low	42.5	Very low	59 Å²	59	119 Å²	119	61%	0.608	62%	0.622	S	S	*	*			trans	-120.6	118.4	162.2	0	0	0	0	0	108.7	H37 G41	H37-G39 PolarHBondContact O-N 3.11Å; G39-G41 PolarHBondContact O-N 3.4Å
40	K	42.9	Very low	43.3	Very low	225 Å²	225	124.9 Å²	124.9	98%	0.978	64%	0.638	S	S	*	*	S	Bend	trans	-63.5	127.7	-180	-78.4	177.1	174.1	177.5	0	110
41	G	45.4	Very low	44.4	Very low	78 Å²	78	124.3 Å²	124.3	80%	0.804	64%	0.635	S	S	*	*			trans	118.1	58.9	161.2	0	0	0	0	0	116.4	G39	G39-G41 PolarHBondContact O-N 3.4Å
42	A	35.9	Very low	45.6	Very low	63 Å²	63	124.1 Å²	124.1	52%	0.521	64%	0.639	S	S	.	*	S	Bend	trans	-170.9	146.8	146.9	0	0	0	0	0	109.5	V44	A42-V44 PolarHBondContact O-N 3.4Å; A42-V44 VanDerWaalsContact O-N 3.14Å
43	V	43.3	Very low	47.1	Very low	96 Å²	96	122.9 Å²	122.9	58%	0.582	63%	0.633	S	S	*	*			trans	-54.3	111.1	-171	-177.6	0	0	0	0	111.8	T45 Q46	V43-T45 WeakPolarHBondContact CG1-OG1 3.41Å; V43-T45 PolarHBondContact O-N 2.99Å; V43-T45 VanDerWaalsContact O-N 3.11Å; V43-Q46 PolarHBondContact O-N 3.21Å
44	V	49.8	Very low	48.6	Very low	102 Å²	102	122 Å²	122	62%	0.618	62%	0.623	S	S	*	*	H	α-helix	trans	-59.6	-25.1	-171.2	174.1	0	0	0	0	113.6	A42	A42-V44 PolarHBondContact O-N 3.4Å; A42-V44 VanDerWaalsContact O-N 3.14Å
45	T	46.8	Very low	49.9	Very low	102 Å²	102	118.9 Å²	118.9	63%	0.626	61%	0.612	S	S	*	*	H	α-helix	trans	-74.9	-43.5	-176.5	2.7	0	0	0	0	112.9	V43 R47 K48 Q49	V43-T45 WeakPolarHBondContact CG1-OG1 3.41Å; V43-T45 PolarHBondContact O-N 2.99Å; V43-T45 VanDerWaalsContact O-N 3.11Å; T45-R47 PolarHBondContact O-N 3.49Å; T45-K48 PolarHBondContact O-N 3.45Å; T45-Q49 PolarHBondContact O-N 2.93Å
46	Q	49.1	Very low	51.6	Low	144 Å²	144	119.1 Å²	119.1	67%	0.673	61%	0.608	S	S	*	*	H	α-helix	trans	-70.5	-34.3	-176.5	-142.5	170.2	-3.6	0	0	111.7	V43 Q49 W50	V43-Q46 PolarHBondContact O-N 3.21Å; Q46-Q49 PolarHBondContact O-N 3.34Å; Q46-W50 PolarHBondContact O-N 3.38Å
47	R	49.2	Very low	53.3	Low	144 Å²	144	120.6 Å²	120.6	54%	0.543	61%	0.61	S	S	.	*	H	α-helix	trans	-67.3	-38.7	177.4	-170.9	-178.4	-74.1	-175	-4	112.9	T45 V51	T45-R47 PolarHBondContact O-N 3.49Å; R47-V51 WeakPolarHBondContact O-CG2 3.33Å; R47-V51 PolarHBondContact O-N 3.45Å
48	K	54.1	Low	55	Low	137 Å²	137	117.7 Å²	117.7	60%	0.596	60%	0.598	S	S	*	*	H	α-helix	trans	-69.6	-35.7	177.3	-75.3	-176.7	178.2	-176.1	0	112.1	T45 L52	T45-K48 PolarHBondContact O-N 3.45Å; K48-L52 WeakPolarHBondContact O-CB 3.35Å; K48-L52 PolarHBondContact O-N 3.36Å; K48-L52 VanDerWaalsContact O-N 3.14Å
49	Q	52.1	Low	56.6	Low	135 Å²	135	108.5 Å²	108.5	63%	0.631	57%	0.574	S	S	*	*	H	α-helix	trans	-67.3	-43.4	179.6	-166.1	165	-9.2	0	0	111.6	T45 Q46 L52 E53	T45-Q49 PolarHBondContact O-N 2.93Å; Q46-Q49 PolarHBondContact O-N 3.34Å; Q49-L52 PolarHBondContact O-N 3.45Å; Q49-E53 WeakPolarHBondContact O-CB 3.33Å; Q49-E53 PolarHBondContact O-N 3.2Å
50	W	58.5	Low	58.7	Low	175 Å²	175	107.1 Å²	107.1	66%	0.663	56%	0.56	S	S	*	*	H	α-helix	trans	-61	-45.3	176.2	-174.9	82.9	0	0	0	113	Q46 L52 E53 S54	Q46-W50 PolarHBondContact O-N 3.38Å; W50-L52 VanDerWaalsContact C-N 3.34Å; W50-L52 PolarHBondContact O-N 3.35Å; W50-E53 PolarHBondContact O-N 3.14Å; W50-S54 WeakPolarHBondContact O-CB 3.44Å; W50-S54 PolarHBondContact O-N 3.02Å; W50-S54 PolarHBondContact O-OG 3.42Å; W50-S54 VanDerWaalsContact O-OG 3.09Å
51	V	64.4	Low	60.4	Low	66 Å²	66	101.5 Å²	101.5	40%	0.4	54%	0.54	S	S	.	.	H	α-helix	trans	-62.6	-43.1	177.4	174.1	0	0	0	0	111.1	R47 E53 S54 C55	R47-V51 WeakPolarHBondContact O-CG2 3.33Å; R47-V51 PolarHBondContact O-N 3.45Å; V51-E53 VanDerWaalsContact C-N 3.33Å; V51-E53 PolarHBondContact O-N 3.12Å; V51-S54 PolarHBondContact O-N 3.04Å; V51-C55 WeakPolarHBondContact O-CB 3.39Å; V51-C55 PolarHBondContact O-N 2.97Å; V51-C55 PolarHBondContact O-SG 2.77Å
52	L	63.2	Low	61.9	Low	110 Å²	110	99.9 Å²	99.9	58%	0.576	51%	0.513	S	S	*	.	H	α-helix	trans	-67.4	-35.7	-178	-152.9	118.8	0	0	0	112.1	K48 Q49 W50 R56	K48-L52 WeakPolarHBondContact O-CB 3.35Å; K48-L52 PolarHBondContact O-N 3.36Å; K48-L52 VanDerWaalsContact O-N 3.14Å; Q49-L52 PolarHBondContact O-N 3.45Å; W50-L52 VanDerWaalsContact C-N 3.34Å; W50-L52 PolarHBondContact O-N 3.35Å; L52-R56 WeakPolarHBondContact O-CB 3.46Å; L52-R56 PolarHBondContact O-N 3.42Å; L52-R56 VanDerWaalsContact O-N 3.11Å
53	E	69.3	Low	64	Low	100 Å²	100	106.2 Å²	106.2	47%	0.467	52%	0.523	S	S	.	.	H	α-helix	trans	-73	-42.4	177.7	-166	167.5	-172.2	0	0	112.1	Q49 W50 V51 R56 K57	Q49-E53 WeakPolarHBondContact O-CB 3.33Å; Q49-E53 PolarHBondContact O-N 3.2Å; W50-E53 PolarHBondContact O-N 3.14Å; V51-E53 VanDerWaalsContact C-N 3.33Å; V51-E53 PolarHBondContact O-N 3.12Å; E53-R56 WeakPolarHBondContact O-CB 3.46Å; E53-R56 PolarHBondContact O-N 3.43Å; E53-K57 WeakPolarHBondContact O-CG 3.21Å; E53-K57 PolarHBondContact O-N 3.12Å
54	S	68.3	Low	65.9	Low	48 Å²	48	107.7 Å²	107.7	34%	0.336	52%	0.524	S	S	.	.	H	α-helix	trans	-65.2	-42	174.9	-64.2	0	0	0	0	112.4	W50 V51 R56 K57 L58	W50-S54 WeakPolarHBondContact O-CB 3.44Å; W50-S54 PolarHBondContact O-N 3.02Å; W50-S54 PolarHBondContact O-OG 3.42Å; W50-S54 VanDerWaalsContact O-OG 3.09Å; V51-S54 PolarHBondContact O-N 3.04Å; S54-R56 VanDerWaalsContact C-N 3.3Å; S54-R56 PolarHBondContact O-N 2.91Å; S54-K57 PolarHBondContact O-N 2.61Å; S54-L58 WeakPolarHBondContact O-CB 3.44Å; S54-L58 PolarHBondContact O-N 3.26Å
55	C	67.7	Low	67.5	Low	64 Å²	64	103.8 Å²	103.8	43%	0.432	50%	0.499	S	S	.	.	H	α-helix	trans	-63.2	-36.6	173.7	-73.2	0	0	0	0	112	V51 S59	V51-C55 WeakPolarHBondContact O-CB 3.39Å; V51-C55 PolarHBondContact O-N 2.97Å; V51-C55 PolarHBondContact O-SG 2.77Å; C55-S59 WeakPolarHBondContact O-CB 3.31Å; C55-S59 PolarHBondContact O-N 2.88Å; C55-S59 PolarHBondContact O-OG 3.24Å
56	R	71.3	Confident	69.1	Low	170 Å²	170	103.2 Å²	103.2	64%	0.642	49%	0.492	S	S	*	.	H	α-helix	trans	-65.5	-45.4	175.5	-170.2	-176.8	-66.2	165.2	-1.2	111.3	L52 E53 S54 S59 G60	L52-R56 WeakPolarHBondContact O-CB 3.46Å; L52-R56 PolarHBondContact O-N 3.42Å; L52-R56 VanDerWaalsContact O-N 3.11Å; E53-R56 WeakPolarHBondContact O-CB 3.46Å; E53-R56 PolarHBondContact O-N 3.43Å; S54-R56 VanDerWaalsContact C-N 3.3Å; S54-R56 PolarHBondContact O-N 2.91Å; R56-S59 PolarHBondContact O-N 3.29Å; R56-S59 PolarHBondContact O-OG 3.41Å; R56-G60 PolarHBondContact O-N 3.42Å
57	K	74.1	Confident	70.9	Confident	139 Å²	139	100 Å²	100	60%	0.604	48%	0.482	S	S	*	.	H	α-helix	trans	-60.5	-46.6	175.9	-72.7	179.2	-178.2	-179.8	0	111.7	E53 S54 S59 G60 L61	E53-K57 WeakPolarHBondContact O-CG 3.21Å; E53-K57 PolarHBondContact O-N 3.12Å; S54-K57 PolarHBondContact O-N 2.61Å; K57-S59 PolarHBondContact O-N 2.95Å; K57-G60 WeakPolarHBondContact O-CA 3Å; K57-G60 PolarHBondContact O-N 3.3Å; K57-G60 VanDerWaalsContact O-N 3.11Å; K57-L61 PolarHBondContact O-N 2.79Å
58	L	75.4	Confident	72.5	Confident	51 Å²	51	96.2 Å²	96.2	27%	0.267	47%	0.474	S	S	.	.	H	α-helix	trans	-60.5	-44.8	177.1	-176.3	64.1	0	0	0	112	S54 G60 L61 L62 V111 I115	S54-L58 WeakPolarHBondContact O-CB 3.44Å; S54-L58 PolarHBondContact O-N 3.26Å; L58-G60 VanDerWaalsContact C-N 3.25Å; L58-G60 PolarHBondContact O-N 3.09Å; L58-L61 PolarHBondContact O-N 2.96Å; L58-L62 HydrophobicContact CG-CD1 4.37Å; L58-L62 WeakPolarHBondContact O-CG 3.42Å; L58-L62 PolarHBondContact O-N 2.95Å; L58-V111 HydrophobicContact CD1-CG1 3.89Å; L58-I115 HydrophobicContact CD2-CD1 3.9Å
59	S	73.8	Confident	73.9	Confident	70 Å²	70	90.6 Å²	90.6	49%	0.49	45%	0.451	S	S	.	.	H	α-helix	trans	-62.4	-33.4	175.7	73.8	0	0	0	0	112.8	C55 R56 K57 R63	C55-S59 WeakPolarHBondContact O-CB 3.31Å; C55-S59 PolarHBondContact O-N 2.88Å; C55-S59 PolarHBondContact O-OG 3.24Å; R56-S59 PolarHBondContact O-N 3.29Å; R56-S59 PolarHBondContact O-OG 3.41Å; K57-S59 PolarHBondContact O-N 2.95Å; S59-R63 WeakPolarHBondContact O-CB 3.08Å; S59-R63 PolarHBondContact O-N 2.91Å; S59-R63 VanDerWaalsContact O-N 3.11Å
60	G	78.4	Confident	75.5	Confident	31 Å²	31	88.7 Å²	88.7	32%	0.32	45%	0.445	S	S	.	.	H	α-helix	trans	-65.4	-45.3	173.9	0	0	0	0	0	112.3	R56 K57 L58 R63 Q64	R56-G60 PolarHBondContact O-N 3.42Å; K57-G60 WeakPolarHBondContact O-CA 3Å; K57-G60 PolarHBondContact O-N 3.3Å; K57-G60 VanDerWaalsContact O-N 3.11Å; L58-G60 VanDerWaalsContact C-N 3.25Å; L58-G60 PolarHBondContact O-N 3.09Å; G60-R63 PolarHBondContact O-N 3.24Å; G60-Q64 PolarHBondContact O-N 3.23Å
61	L	77.9	Confident	76.8	Confident	107 Å²	107	87.3 Å²	87.3	56%	0.56	44%	0.444	S	S	*	.	H	α-helix	trans	-64.4	-44.2	177.7	-69.6	173	0	0	0	112.1	K57 L58 R63 Q64 K65	K57-L61 PolarHBondContact O-N 2.79Å; L58-L61 PolarHBondContact O-N 2.96Å; L61-R63 VanDerWaalsContact C-N 3.26Å; L61-R63 PolarHBondContact O-N 3.45Å; L61-Q64 PolarHBondContact O-N 3.2Å; L61-Q64 VanDerWaalsContact O-N 3.17Å; L61-K65 WeakPolarHBondContact O-CB 3.21Å; L61-K65 PolarHBondContact O-N 3.25Å
62	L	77.1	Confident	77.8	Confident	43 Å²	43	85.3 Å²	85.3	23%	0.225	43%	0.431	C	S	.	.	H	α-helix	trans	-62.3	-34.8	175.7	-69.8	174.6	0	0	0	112	L58 N66 E108 F112	L58-L62 HydrophobicContact CG-CD1 4.37Å; L58-L62 WeakPolarHBondContact O-CG 3.42Å; L58-L62 PolarHBondContact O-N 2.95Å; L62-N66 PolarHBondContact O-N 3.47Å; L62-N66 VanDerWaalsContact O-N 3.16Å; L62-N66 PolarHBondContact O-ND2 2.98Å; L62-E108 HydrophobicContact CD2-CG 3.88Å; L62-E108 WeakPolarHBondContact CD2-OE1 3.28Å; L62-F112 HydrophobicContact CD1-CZ 4.19Å
63	R	80.3	Confident	78.9	Confident	197 Å²	197	84.4 Å²	84.4	74%	0.743	42%	0.422	S	S	*	.	H	α-helix	trans	-69.1	-41.9	174.3	-166.3	176.1	-178.4	-175.8	0.2	111.8	S59 G60 L61 N66 V67	S59-R63 WeakPolarHBondContact O-CB 3.08Å; S59-R63 PolarHBondContact O-N 2.91Å; S59-R63 VanDerWaalsContact O-N 3.11Å; G60-R63 PolarHBondContact O-N 3.24Å; L61-R63 VanDerWaalsContact C-N 3.26Å; L61-R63 PolarHBondContact O-N 3.45Å; R63-N66 PolarHBondContact O-N 3.05Å; R63-V67 WeakPolarHBondContact O-CG2 3.31Å; R63-V67 PolarHBondContact O-N 3.42Å
64	Q	82.4	Confident	79.6	Confident	127 Å²	127	83.9 Å²	83.9	59%	0.593	42%	0.422	S	S	*	.	H	α-helix	trans	-63.9	-44.1	175.3	-76.8	178.5	-26	0	0	111.9	G60 L61 N66 V67 V68	G60-Q64 PolarHBondContact O-N 3.23Å; L61-Q64 PolarHBondContact O-N 3.2Å; L61-Q64 VanDerWaalsContact O-N 3.17Å; Q64-N66 VanDerWaalsContact C-N 3.32Å; Q64-N66 PolarHBondContact O-N 3.49Å; Q64-V67 WeakPolarHBondContact O-CB 3.3Å; Q64-V67 PolarHBondContact O-N 2.89Å; Q64-V67 VanDerWaalsContact O-N 3.07Å; Q64-V68 WeakPolarHBondContact O-CG2 3.22Å; Q64-V68 PolarHBondContact O-N 2.87Å
65	K	83.3	Confident	80.3	Confident	20 Å²	20	83.2 Å²	83.2	9%	0.087	42%	0.42	C	S	.	.	H	α-helix	trans	-52.9	-49.1	173.5	174.5	-174.6	162.3	175.1	0	111.6	L61 V67 V68 L69 L104 N105 E108	L61-K65 WeakPolarHBondContact O-CB 3.21Å; L61-K65 PolarHBondContact O-N 3.25Å; K65-V67 PolarHBondContact O-N 3.32Å; K65-V68 PolarHBondContact O-N 3.42Å; K65-V68 VanDerWaalsContact O-N 3.08Å; K65-L69 HydrophobicContact CG-CD1 4.21Å; K65-L69 HydrophobicContact CG-CG 4.41Å; K65-L69 PolarHBondContact O-N 3Å; K65-L104 WeakPolarHBondContact CE-O 3.3Å; K65-L104 HydrophobicContact CG-CD2 4.47Å; K65-L104 PolarHBondContact NZ-O 2.98Å; K65-N105 VanDerWaalsContact NZ-CA 3.32Å; K65-N105 PolarHBondContact NZ-OD1 3.46Å; K65-E108 HydrophobicContact CD-CB 4.44Å; K65-E108 WeakPolarHBondContact CE-OE2 3.41Å; K65-E108 VanDerWaalsContact NZ-CB 3.27Å; K65-E108 IonicContact NZ-OE2 2.59Å; K65-E108 PolarHBondContact NZ-OE2 3.21Å
66	N	81.5	Confident	81.1	Confident	89 Å²	89	81 Å²	81	48%	0.476	40%	0.404	S	S	.	.	H	α-helix	trans	-61.6	-33.6	179.7	-80.1	-50.4	0	0	0	112.9	L62 R63 Q64 N70	L62-N66 PolarHBondContact O-N 3.47Å; L62-N66 VanDerWaalsContact O-N 3.16Å; L62-N66 PolarHBondContact O-ND2 2.98Å; R63-N66 PolarHBondContact O-N 3.05Å; Q64-N66 VanDerWaalsContact C-N 3.32Å; Q64-N66 PolarHBondContact O-N 3.49Å; N66-N70 PolarHBondContact O-N 2.74Å; N66-N70 VanDerWaalsContact O-N 3.15Å; N66-N70 PolarHBondContact O-ND2 3.23Å
67	V	86.3	Confident	81.7	Confident	77 Å²	77	79 Å²	79	47%	0.467	40%	0.396	S	S	.	.	H	α-helix	trans	-67.6	-43.3	173.1	174.6	0	0	0	0	111	R63 Q64 K65 N70 K71	R63-V67 WeakPolarHBondContact O-CG2 3.31Å; R63-V67 PolarHBondContact O-N 3.42Å; Q64-V67 WeakPolarHBondContact O-CB 3.3Å; Q64-V67 PolarHBondContact O-N 2.89Å; Q64-V67 VanDerWaalsContact O-N 3.07Å; K65-V67 PolarHBondContact O-N 3.32Å; V67-N70 PolarHBondContact O-N 3.3Å; V67-K71 WeakPolarHBondContact O-CG 3.49Å; V67-K71 PolarHBondContact O-N 3.32Å
68	V	83	Confident	82.2	Confident	64 Å²	64	75.3 Å²	75.3	39%	0.388	39%	0.391	S	S	.	.	H	α-helix	trans	-63.8	-44.7	177.3	175.7	0	0	0	0	111.1	Q64 K65 N70 K71 L72 L104	Q64-V68 WeakPolarHBondContact O-CG2 3.22Å; Q64-V68 PolarHBondContact O-N 2.87Å; K65-V68 PolarHBondContact O-N 3.42Å; K65-V68 VanDerWaalsContact O-N 3.08Å; V68-N70 VanDerWaalsContact C-N 3.3Å; V68-N70 PolarHBondContact O-N 3.41Å; V68-K71 WeakPolarHBondContact O-CB 3.11Å; V68-K71 PolarHBondContact O-N 3.23Å; V68-L72 PolarHBondContact O-N 3.44Å; V68-L104 HydrophobicContact CG1-CD1 3.81Å
69	L	84.3	Confident	82.5	Confident	20 Å²	20	73.7 Å²	73.7	11%	0.105	38%	0.383	C	S	.	.	H	α-helix	trans	-58.6	-40.6	175.8	-78.6	177.7	0	0	0	112.6	K65 K71 L72 K73 Q101 L104	K65-L69 HydrophobicContact CG-CD1 4.21Å; K65-L69 HydrophobicContact CG-CG 4.41Å; K65-L69 PolarHBondContact O-N 3Å; L69-K71 VanDerWaalsContact C-N 3.35Å; L69-L72 PolarHBondContact O-N 3.09Å; L69-K73 WeakPolarHBondContact O-CB 3.28Å; L69-K73 WeakPolarHBondContact O-CG 3.36Å; L69-K73 PolarHBondContact O-N 3.05Å; L69-Q101 HydrophobicContact CD2-CB 4.13Å; L69-Q101 HydrophobicContact CD2-CG 3.68Å; L69-L104 HydrophobicContact CD2-CB 4.45Å; L69-L104 HydrophobicContact CD2-CD1 4.34Å
70	N	85	Confident	82.8	Confident	95 Å²	95	75.9 Å²	75.9	51%	0.508	39%	0.386	S	S	.	.	H	α-helix	trans	-67.4	-36.1	175.9	-76	-22.5	0	0	0	112.3	N66 V67 V68 N74	N66-N70 PolarHBondContact O-N 2.74Å; N66-N70 VanDerWaalsContact O-N 3.15Å; N66-N70 PolarHBondContact O-ND2 3.23Å; V67-N70 PolarHBondContact O-N 3.3Å; V68-N70 VanDerWaalsContact C-N 3.3Å; V68-N70 PolarHBondContact O-N 3.41Å; N70-N74 PolarHBondContact O-N 2.67Å; N70-N74 VanDerWaalsContact O-N 3.14Å; N70-N74 PolarHBondContact O-ND2 3.12Å
71	K	86.9	Confident	82.9	Confident	145 Å²	145	82.8 Å²	82.8	63%	0.63	41%	0.407	S	S	*	.	H	α-helix	trans	-66.1	-42.9	173.1	-72.7	-177.3	177	-172.8	0	111.7	V67 V68 L69 N74 A75	V67-K71 WeakPolarHBondContact O-CG 3.49Å; V67-K71 PolarHBondContact O-N 3.32Å; V68-K71 WeakPolarHBondContact O-CB 3.11Å; V68-K71 PolarHBondContact O-N 3.23Å; L69-K71 VanDerWaalsContact C-N 3.35Å; K71-N74 WeakPolarHBondContact O-CB 3.17Å; K71-N74 PolarHBondContact O-N 3.37Å; K71-N74 VanDerWaalsContact O-N 3.13Å; K71-A75 PolarHBondContact O-N 2.7Å
72	L	84.4	Confident	82.8	Confident	25 Å²	25	81.6 Å²	81.6	13%	0.131	40%	0.402	C	S	.	.	H	α-helix	trans	-62.4	-45.7	178	-137.8	89.1	0	0	0	111.5	V68 L69 N74 A75 I76 F97 F100 Q101	V68-L72 PolarHBondContact O-N 3.44Å; L69-L72 PolarHBondContact O-N 3.09Å; L72-N74 PolarHBondContact O-N 3.21Å; L72-A75 WeakPolarHBondContact O-CB 3.46Å; L72-A75 PolarHBondContact O-N 3.04Å; L72-A75 VanDerWaalsContact O-N 3.07Å; L72-I76 WeakPolarHBondContact O-CG1 3.42Å; L72-I76 PolarHBondContact O-N 3.02Å; L72-F97 HydrophobicContact CD1-CD1 4.29Å; L72-F97 HydrophobicContact CD2-CB 4.25Å; L72-F97 WeakPolarHBondContact CD2-O 3.42Å; L72-F97 HydrophobicContact CG-CB 4.27Å; L72-F97 HydrophobicContact CG-CD1 4.31Å; L72-F100 HydrophobicContact CD2-CB 4.03Å; L72-Q101 HydrophobicContact CD2-CB 3.65Å
73	K	86.1	Confident	82.4	Confident	90 Å²	90	84.3 Å²	84.3	39%	0.391	43%	0.43	S	S	.	.	H	α-helix	trans	-62.5	-26.3	173.9	-75.2	179.4	-179.6	179.3	0	113.9	L69 R77	L69-K73 WeakPolarHBondContact O-CB 3.28Å; L69-K73 WeakPolarHBondContact O-CG 3.36Å; L69-K73 PolarHBondContact O-N 3.05Å; K73-R77 PolarHBondContact O-NE 2.82Å
74	N	85.3	Confident	82	Confident	89 Å²	89	78.2 Å²	78.2	48%	0.476	43%	0.429	S	S	.	.	H	α-helix	trans	-79.6	-36.7	173.5	-70.2	-19	0	0	0	111	N70 K71 L72 R77 A78	N70-N74 PolarHBondContact O-N 2.67Å; N70-N74 VanDerWaalsContact O-N 3.14Å; N70-N74 PolarHBondContact O-ND2 3.12Å; K71-N74 WeakPolarHBondContact O-CB 3.17Å; K71-N74 PolarHBondContact O-N 3.37Å; K71-N74 VanDerWaalsContact O-N 3.13Å; L72-N74 PolarHBondContact O-N 3.21Å; N74-R77 PolarHBondContact O-N 3.01Å; N74-R77 PolarHBondContact OD1-NH2 2.94Å; N74-A78 WeakPolarHBondContact O-CB 3.34Å; N74-A78 PolarHBondContact O-N 2.86Å
75	A	82.8	Confident	81.4	Confident	34 Å²	34	74.1 Å²	74.1	28%	0.281	41%	0.41	S	S	.	.	H	α-helix	trans	-65.4	-44.8	175.3	0	0	0	0	0	111.9	K71 L72 R77 A78 V79 F97	K71-A75 PolarHBondContact O-N 2.7Å; L72-A75 WeakPolarHBondContact O-CB 3.46Å; L72-A75 PolarHBondContact O-N 3.04Å; L72-A75 VanDerWaalsContact O-N 3.07Å; A75-R77 VanDerWaalsContact C-N 3.34Å; A75-R77 PolarHBondContact O-N 3.27Å; A75-A78 WeakPolarHBondContact O-CB 3.45Å; A75-A78 PolarHBondContact O-N 3.45Å; A75-V79 WeakPolarHBondContact O-CG2 3.12Å; A75-V79 PolarHBondContact O-N 3.11Å; A75-F97 HydrophobicContact CB-CE2 4.2Å; A75-F97 HydrophobicContact CB-CZ 4.33Å
76	I	84.4	Confident	81	Confident	18 Å²	18	76.2 Å²	76.2	9%	0.092	43%	0.428	C	S	.	.	H	α-helix	trans	-54.5	-50.1	173.7	-68.8	166	0	0	0	110.6	L72 A78 V79 E80 V94 F97 E98	L72-I76 WeakPolarHBondContact O-CG1 3.42Å; L72-I76 PolarHBondContact O-N 3.02Å; I76-A78 PolarHBondContact O-N 3.39Å; I76-V79 PolarHBondContact O-N 3.42Å; I76-E80 WeakPolarHBondContact O-CG 3.46Å; I76-E80 PolarHBondContact O-N 3.45Å; I76-V94 HydrophobicContact CG2-CG1 4.07Å; I76-V94 HydrophobicContact CG2-CG2 4.31Å; I76-F97 HydrophobicContact CD1-CB 3.8Å; I76-F97 HydrophobicContact CG1-CB 3.46Å; I76-F97 VanDerWaalsContact CG1-CB 3.46Å; I76-F97 HydrophobicContact CG1-CD2 4.01Å; I76-F97 HydrophobicContact CG1-CG 4.11Å; I76-E98 HydrophobicContact CD1-CG 4.46Å
77	R	84.1	Confident	80.5	Confident	129 Å²	129	78.1 Å²	78.1	49%	0.487	44%	0.438	S	S	.	.	H	α-helix	trans	-65.8	-22.7	177.4	-81.6	-177.5	-78.2	155.8	-5	114.3	K73 N74 A75 K81	K73-R77 PolarHBondContact O-NE 2.82Å; N74-R77 PolarHBondContact O-N 3.01Å; N74-R77 PolarHBondContact OD1-NH2 2.94Å; A75-R77 VanDerWaalsContact C-N 3.34Å; A75-R77 PolarHBondContact O-N 3.27Å; R77-K81 WeakPolarHBondContact O-CD 3.49Å; R77-K81 VanDerWaalsContact O-CG 3.3Å; R77-K81 WeakPolarHBondContact O-CG 3.45Å
78	A	83.4	Confident	79.6	Confident	61 Å²	61	82.1 Å²	82.1	50%	0.504	45%	0.452	S	S	.	.	H	α-helix	trans	-78	-43.6	175.5	0	0	0	0	0	110.6	N74 A75 I76 K81 D82	N74-A78 WeakPolarHBondContact O-CB 3.34Å; N74-A78 PolarHBondContact O-N 2.86Å; A75-A78 WeakPolarHBondContact O-CB 3.45Å; A75-A78 PolarHBondContact O-N 3.45Å; I76-A78 PolarHBondContact O-N 3.39Å; A78-K81 PolarHBondContact O-N 3.11Å; A78-D82 PolarHBondContact O-N 3.45Å
79	V	81.3	Confident	78.9	Confident	16 Å²	16	82.2 Å²	82.2	10%	0.097	45%	0.448	C	S	.	.	H	α-helix	trans	-64.2	-42	176.2	172.5	0	0	0	0	111.8	A75 I76 K81 D82 L85 Q93 V94 F97	A75-V79 WeakPolarHBondContact O-CG2 3.12Å; A75-V79 PolarHBondContact O-N 3.11Å; I76-V79 PolarHBondContact O-N 3.42Å; V79-K81 PolarHBondContact O-N 3.47Å; V79-D82 PolarHBondContact O-N 3.45Å; V79-L85 HydrophobicContact CG1-CD1 4.38Å; V79-Q93 HydrophobicContact CG1-CB 3.81Å; V79-V94 HydrophobicContact CG1-CG2 4.09Å; V79-F97 HydrophobicContact CG2-CE2 3.95Å
80	E	80	Confident	78.5	Confident	116 Å²	116	83.1 Å²	83.1	54%	0.542	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-27.4	175.9	-74.9	177.8	157.7	0	0	113.3	I76 V94	I76-E80 WeakPolarHBondContact O-CG 3.46Å; I76-E80 PolarHBondContact O-N 3.45Å; E80-V94 HydrophobicContact CG-CG2 3.96Å
81	K	80.6	Confident	78	Confident	176 Å²	176	85 Å²	85	77%	0.765	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-9.1	-177.7	-73.7	-178.3	-179.2	-175.7	0	114	R77 A78 V79 A83	R77-K81 WeakPolarHBondContact O-CD 3.49Å; R77-K81 VanDerWaalsContact O-CG 3.3Å; R77-K81 WeakPolarHBondContact O-CG 3.45Å; A78-K81 PolarHBondContact O-N 3.11Å; V79-K81 PolarHBondContact O-N 3.47Å; K81-A83 PolarHBondContact O-N 2.88Å
82	D	76	Confident	77.2	Confident	83 Å²	83	81.3 Å²	81.3	44%	0.444	44%	0.444	S	S	.	.			trans	-74.4	120.5	-178.2	-161.4	-22.6	0	0	0	110.1	A78 V79 G84 L85 K90	A78-D82 PolarHBondContact O-N 3.45Å; V79-D82 PolarHBondContact O-N 3.45Å; D82-G84 VanDerWaalsContact C-N 3.3Å; D82-G84 PolarHBondContact OD1-N 3.49Å; D82-L85 HydrophobicContact CB-CD1 4.07Å; D82-K90 WeakPolarHBondContact O-CE 3.42Å; D82-K90 PolarHBondContact O-NZ 2.96Å
83	A	69.9	Low	76.6	Confident	99 Å²	99	83.4 Å²	83.4	82%	0.818	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-8.5	-178.3	0	0	0	0	0	113	K81	K81-A83 PolarHBondContact O-N 2.88Å
84	G	71	Confident	76.3	Confident	70 Å²	70	79.9 Å²	79.9	72%	0.722	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-12.1	-175.9	0	0	0	0	0	116	D82	D82-G84 VanDerWaalsContact C-N 3.3Å; D82-G84 PolarHBondContact OD1-N 3.49Å
85	L	70.1	Confident	76	Confident	40 Å²	40	80.1 Å²	80.1	21%	0.209	44%	0.438	C	S	.	.	S	Bend	trans	-96	143.9	-176.7	-70.9	162.2	0	0	0	111.9	V79 D82 E89 K90	V79-L85 HydrophobicContact CG1-CD1 4.38Å; D82-L85 HydrophobicContact CB-CD1 4.07Å; L85-E89 HydrophobicContact CD2-CB 4.28Å; L85-K90 HydrophobicContact CB-CD 4.49Å; L85-K90 HydrophobicContact CB-CG 3.8Å; L85-K90 VanDerWaalsContact O-CE 3.27Å; L85-K90 WeakPolarHBondContact O-CE 3.32Å
86	S	74.3	Confident	75.6	Confident	64 Å²	64	80.5 Å²	80.5	45%	0.448	44%	0.436	S	S	.	.			trans	-63.1	149.3	170.6	178.9	0	0	0	0	110.8	E88 E89 K90	S86-E88 PolarHBondContact O-N 2.87Å; S86-E89 WeakPolarHBondContact CB-OE2 3.16Å; S86-E89 PolarHBondContact N-OE2 2.88Å; S86-E89 WeakPolarHBondContact O-CB 3.48Å; S86-E89 PolarHBondContact O-N 2.81Å; S86-K90 PolarHBondContact O-N 3.49Å
87	D	70.5	Confident	75.4	Confident	129 Å²	129	82.3 Å²	82.3	69%	0.69	44%	0.444	S	S	*	.	H	α-helix	trans	-60.2	-30.7	-179.7	-74.7	-23.7	0	0	0	112.5	L91	D87-L91 WeakPolarHBondContact O-CB 3.39Å; D87-L91 PolarHBondContact O-N 2.92Å; D87-L91 VanDerWaalsContact O-N 3.09Å
88	E	67.3	Low	75.3	Confident	162 Å²	162	81.1 Å²	81.1	76%	0.757	44%	0.443	S	S	*	.	H	α-helix	trans	-70	-38.1	174.3	-64.7	-173.7	170.4	0	0	112.2	S86 F92	S86-E88 PolarHBondContact O-N 2.87Å; E88-F92 WeakPolarHBondContact O-CB 2.92Å; E88-F92 PolarHBondContact O-N 2.92Å; E88-F92 VanDerWaalsContact O-N 3.07Å
89	E	69.6	Low	75	Confident	65 Å²	65	79.7 Å²	79.7	30%	0.304	43%	0.427	S	S	.	.	H	α-helix	trans	-70.4	-37.1	178	-66	172.8	149.9	0	0	111.4	L85 S86 Q93 M171	L85-E89 HydrophobicContact CD2-CB 4.28Å; S86-E89 WeakPolarHBondContact CB-OE2 3.16Å; S86-E89 PolarHBondContact N-OE2 2.88Å; S86-E89 WeakPolarHBondContact O-CB 3.48Å; S86-E89 PolarHBondContact O-N 2.81Å; E89-Q93 WeakPolarHBondContact O-CB 3.36Å; E89-Q93 WeakPolarHBondContact O-CG 3.47Å; E89-Q93 PolarHBondContact O-N 3.42Å; E89-M171 VanDerWaalsContact OE1-CE 3.32Å; E89-M171 WeakPolarHBondContact OE1-CE 3.25Å
90	K	75.1	Confident	74.9	Confident	40 Å²	40	84.3 Å²	84.3	17%	0.174	45%	0.446	C	S	.	.	H	α-helix	trans	-63.7	-50.5	174	-71.5	175.8	-179	173.6	0	111.5	D82 L85 S86 F92 Q93 V94	D82-K90 WeakPolarHBondContact O-CE 3.42Å; D82-K90 PolarHBondContact O-NZ 2.96Å; L85-K90 HydrophobicContact CB-CD 4.49Å; L85-K90 HydrophobicContact CB-CG 3.8Å; L85-K90 VanDerWaalsContact O-CE 3.27Å; L85-K90 WeakPolarHBondContact O-CE 3.32Å; S86-K90 PolarHBondContact O-N 3.49Å; K90-F92 PolarHBondContact O-N 3.32Å; K90-Q93 PolarHBondContact O-N 3.43Å; K90-V94 WeakPolarHBondContact O-CB 3.44Å; K90-V94 VanDerWaalsContact O-CG2 3.23Å; K90-V94 WeakPolarHBondContact O-CG2 3.37Å; K90-V94 PolarHBondContact O-N 2.87Å
91	L	74.6	Confident	74.9	Confident	133 Å²	133	81.6 Å²	81.6	70%	0.696	43%	0.434	S	S	*	.	H	α-helix	trans	-60	-38.6	-179.1	-168.8	137.8	0	0	0	110.8	D87 H95	D87-L91 WeakPolarHBondContact O-CB 3.39Å; D87-L91 PolarHBondContact O-N 2.92Å; D87-L91 VanDerWaalsContact O-N 3.09Å; L91-H95 VanDerWaalsContact O-CB 3.22Å; L91-H95 WeakPolarHBondContact O-CB 3.48Å; L91-H95 PolarHBondContact O-N 3.37Å
92	F	70.1	Confident	74.9	Confident	69 Å²	69	77.5 Å²	77.5	30%	0.303	42%	0.416	S	S	.	.	H	α-helix	trans	-68.8	-48.6	176.4	179.4	-98.4	0	0	0	114	E88 K90 V94 H95 T96 Q164	E88-F92 WeakPolarHBondContact O-CB 2.92Å; E88-F92 PolarHBondContact O-N 2.92Å; E88-F92 VanDerWaalsContact O-N 3.07Å; K90-F92 PolarHBondContact O-N 3.32Å; F92-V94 VanDerWaalsContact C-N 3.33Å; F92-V94 PolarHBondContact O-N 3.38Å; F92-H95 PolarHBondContact O-N 3.48Å; F92-T96 WeakPolarHBondContact O-CB 3.37Å; F92-T96 PolarHBondContact O-N 3.28Å; F92-T96 PolarHBondContact O-OG1 2.87Å; F92-Q164 HydrophobicContact CZ-CB 4.16Å; F92-Q164 HydrophobicContact CZ-CG 4.45Å
93	Q	72.6	Confident	74.9	Confident	68 Å²	68	76.2 Å²	76.2	32%	0.318	41%	0.407	S	S	.	.	H	α-helix	trans	-64.7	-38.7	179.3	-76.1	-177.5	13.5	0	0	111.8	V79 E89 K90 T96 F97	V79-Q93 HydrophobicContact CG1-CB 3.81Å; E89-Q93 WeakPolarHBondContact O-CB 3.36Å; E89-Q93 WeakPolarHBondContact O-CG 3.47Å; E89-Q93 PolarHBondContact O-N 3.42Å; K90-Q93 PolarHBondContact O-N 3.43Å; Q93-T96 PolarHBondContact O-N 3.41Å; Q93-F97 WeakPolarHBondContact O-CD2 3.41Å; Q93-F97 WeakPolarHBondContact O-CG 3.39Å; Q93-F97 PolarHBondContact O-N 3.42Å; Q93-F97 VanDerWaalsContact O-N 3.09Å
94	V	80.2	Confident	75.4	Confident	17 Å²	17	74.1 Å²	74.1	10%	0.103	38%	0.382	C	S	.	.	H	α-helix	trans	-62.5	-48.4	173	171	0	0	0	0	110.3	I76 V79 E80 K90 F92 T96 F97 E98	I76-V94 HydrophobicContact CG2-CG1 4.07Å; I76-V94 HydrophobicContact CG2-CG2 4.31Å; V79-V94 HydrophobicContact CG1-CG2 4.09Å; E80-V94 HydrophobicContact CG-CG2 3.96Å; K90-V94 WeakPolarHBondContact O-CB 3.44Å; K90-V94 VanDerWaalsContact O-CG2 3.23Å; K90-V94 WeakPolarHBondContact O-CG2 3.37Å; K90-V94 PolarHBondContact O-N 2.87Å; F92-V94 VanDerWaalsContact C-N 3.33Å; F92-V94 PolarHBondContact O-N 3.38Å; V94-T96 VanDerWaalsContact C-N 3.3Å; V94-T96 PolarHBondContact O-N 2.9Å; V94-F97 PolarHBondContact O-N 3.22Å; V94-E98 HydrophobicContact CG1-CG 4.41Å; V94-E98 WeakPolarHBondContact O-CG 3.4Å; V94-E98 PolarHBondContact O-N 3.14Å
95	H	77.8	Confident	75.8	Confident	94 Å²	94	74.6 Å²	74.6	44%	0.435	37%	0.368	S	S	.	.	H	α-helix	trans	-59.6	-39.8	178.2	-170.7	56.9	0	0	0	112.6	L91 F92 E98 I99	L91-H95 VanDerWaalsContact O-CB 3.22Å; L91-H95 WeakPolarHBondContact O-CB 3.48Å; L91-H95 PolarHBondContact O-N 3.37Å; F92-H95 PolarHBondContact O-N 3.48Å; H95-E98 WeakPolarHBondContact O-CB 3.46Å; H95-E98 PolarHBondContact O-N 3.48Å; H95-I99 WeakPolarHBondContact O-CG1 3.4Å; H95-I99 PolarHBondContact O-N 2.91Å
96	T	75.3	Confident	76.1	Confident	42 Å²	42	74.3 Å²	74.3	26%	0.258	37%	0.365	S	S	.	.	H	α-helix	trans	-62.4	-45.2	176.6	-57.4	0	0	0	0	111.6	F92 Q93 V94 E98 I99 F100	F92-T96 WeakPolarHBondContact O-CB 3.37Å; F92-T96 PolarHBondContact O-N 3.28Å; F92-T96 PolarHBondContact O-OG1 2.87Å; Q93-T96 PolarHBondContact O-N 3.41Å; V94-T96 VanDerWaalsContact C-N 3.3Å; V94-T96 PolarHBondContact O-N 2.9Å; T96-E98 VanDerWaalsContact C-N 3.34Å; T96-I99 PolarHBondContact O-N 3.36Å; T96-F100 HydrophobicContact CG2-CD2 4.11Å; T96-F100 HydrophobicContact CG2-CE2 3.7Å; T96-F100 WeakPolarHBondContact O-CD2 3.35Å; T96-F100 PolarHBondContact O-N 2.81Å; T96-F100 VanDerWaalsContact O-N 3.16Å
97	F	80.4	Confident	76.1	Confident	56 Å²	56	74.3 Å²	74.3	25%	0.246	37%	0.365	C	S	.	.	H	α-helix	trans	-67	-34.3	174.6	-67.4	-44.9	0	0	0	112.4	L72 A75 I76 V79 Q93 V94 I99 F100 Q101	L72-F97 HydrophobicContact CD1-CD1 4.29Å; L72-F97 HydrophobicContact CD2-CB 4.25Å; L72-F97 WeakPolarHBondContact CD2-O 3.42Å; L72-F97 HydrophobicContact CG-CB 4.27Å; L72-F97 HydrophobicContact CG-CD1 4.31Å; A75-F97 HydrophobicContact CB-CE2 4.2Å; A75-F97 HydrophobicContact CB-CZ 4.33Å; I76-F97 HydrophobicContact CD1-CB 3.8Å; I76-F97 HydrophobicContact CG1-CB 3.46Å; I76-F97 VanDerWaalsContact CG1-CB 3.46Å; I76-F97 HydrophobicContact CG1-CD2 4.01Å; I76-F97 HydrophobicContact CG1-CG 4.11Å; V79-F97 HydrophobicContact CG2-CE2 3.95Å; Q93-F97 WeakPolarHBondContact O-CD2 3.41Å; Q93-F97 WeakPolarHBondContact O-CG 3.39Å; Q93-F97 PolarHBondContact O-N 3.42Å; Q93-F97 VanDerWaalsContact O-N 3.09Å; V94-F97 PolarHBondContact O-N 3.22Å; F97-I99 VanDerWaalsContact C-N 3.34Å; F97-I99 PolarHBondContact O-N 2.93Å; F97-F100 PolarHBondContact O-N 3.34Å; F97-Q101 PolarHBondContact O-N 2.86Å
98	E	80.4	Confident	76.5	Confident	103 Å²	103	70.6 Å²	70.6	48%	0.481	34%	0.344	S	S	.	.	H	α-helix	trans	-63.3	-39.4	174	-73.7	-179.9	160.4	0	0	112.4	I76 V94 H95 T96 Q101 K102	I76-E98 HydrophobicContact CD1-CG 4.46Å; V94-E98 HydrophobicContact CG1-CG 4.41Å; V94-E98 WeakPolarHBondContact O-CG 3.4Å; V94-E98 PolarHBondContact O-N 3.14Å; H95-E98 WeakPolarHBondContact O-CB 3.46Å; H95-E98 PolarHBondContact O-N 3.48Å; T96-E98 VanDerWaalsContact C-N 3.34Å; E98-Q101 PolarHBondContact O-N 3.15Å; E98-K102 WeakPolarHBondContact O-CB 3.25Å; E98-K102 PolarHBondContact O-N 2.97Å
99	I	77.8	Confident	77	Confident	32 Å²	32	67.2 Å²	67.2	16%	0.164	33%	0.331	C	S	.	.	H	α-helix	trans	-60.7	-50.5	173.7	-66.9	164.6	0	0	0	110.2	H95 T96 F97 Q101 K102 E103 L157	H95-I99 WeakPolarHBondContact O-CG1 3.4Å; H95-I99 PolarHBondContact O-N 2.91Å; T96-I99 PolarHBondContact O-N 3.36Å; F97-I99 VanDerWaalsContact C-N 3.34Å; F97-I99 PolarHBondContact O-N 2.93Å; I99-Q101 VanDerWaalsContact C-N 3.27Å; I99-Q101 PolarHBondContact O-N 3.17Å; I99-K102 WeakPolarHBondContact O-CA 3.27Å; I99-K102 WeakPolarHBondContact O-CB 3.29Å; I99-K102 PolarHBondContact O-N 3.5Å; I99-E103 HydrophobicContact CG2-CG 4.36Å; I99-E103 WeakPolarHBondContact O-CG 3.38Å; I99-E103 PolarHBondContact O-N 3.23Å; I99-L157 HydrophobicContact CG2-CD2 3.94Å
100	F	78.6	Confident	77	Confident	113 Å²	113	67 Å²	67	50%	0.496	34%	0.337	S	S	.	.	H	α-helix	trans	-60	-35.7	177.4	-75.7	-59.7	0	0	0	113.4	L72 T96 F97 L104	L72-F100 HydrophobicContact CD2-CB 4.03Å; T96-F100 HydrophobicContact CG2-CD2 4.11Å; T96-F100 HydrophobicContact CG2-CE2 3.7Å; T96-F100 WeakPolarHBondContact O-CD2 3.35Å; T96-F100 PolarHBondContact O-N 2.81Å; T96-F100 VanDerWaalsContact O-N 3.16Å; F97-F100 PolarHBondContact O-N 3.34Å; F100-L104 WeakPolarHBondContact O-CG 3.24Å; F100-L104 PolarHBondContact O-N 3.46Å; F100-L104 VanDerWaalsContact O-N 3.13Å
101	Q	81.3	Confident	76.9	Confident	59 Å²	59	68.2 Å²	68.2	28%	0.276	35%	0.347	S	S	.	.	H	α-helix	trans	-66.5	-40	173.8	168.9	166.4	-19.8	0	0	111.8	L69 L72 F97 E98 I99 N105	L69-Q101 HydrophobicContact CD2-CB 4.13Å; L69-Q101 HydrophobicContact CD2-CG 3.68Å; L72-Q101 HydrophobicContact CD2-CB 3.65Å; F97-Q101 PolarHBondContact O-N 2.86Å; E98-Q101 PolarHBondContact O-N 3.15Å; I99-Q101 VanDerWaalsContact C-N 3.27Å; I99-Q101 PolarHBondContact O-N 3.17Å; Q101-N105 PolarHBondContact O-N 2.95Å
102	K	80.4	Confident	76.9	Confident	90 Å²	90	64.7 Å²	64.7	39%	0.391	33%	0.327	S	S	.	.	H	α-helix	trans	-62.8	-49.9	176	-170.9	-173.5	172.5	-126.4	0	110.4	E98 I99 L104 N105 E106 E153	E98-K102 WeakPolarHBondContact O-CB 3.25Å; E98-K102 PolarHBondContact O-N 2.97Å; I99-K102 WeakPolarHBondContact O-CA 3.27Å; I99-K102 WeakPolarHBondContact O-CB 3.29Å; I99-K102 PolarHBondContact O-N 3.5Å; K102-L104 PolarHBondContact O-N 3.47Å; K102-N105 CarbonylContact O-C 3.57Å; K102-N105 WeakPolarHBondContact O-CA 3.1Å; K102-N105 WeakPolarHBondContact O-CB 3.26Å; K102-N105 PolarHBondContact O-N 3.28Å; K102-E106 HydrophobicContact CG-CG 4.12Å; K102-E106 IonicContact NZ-OE1 3.99Å; K102-E106 WeakPolarHBondContact O-CG 3.44Å; K102-E106 PolarHBondContact O-N 3.1Å; K102-E153 IonicContact NZ-OE1 2.79Å; K102-E153 PolarHBondContact NZ-OE1 2.82Å
103	E	76.6	Confident	77	Confident	55 Å²	55	67.4 Å²	67.4	26%	0.257	34%	0.34	S	S	.	.	H	α-helix	trans	-56.8	-44.5	178.6	-72.9	-53.6	136	0	0	113.5	I99 N105 E106 S107	I99-E103 HydrophobicContact CG2-CG 4.36Å; I99-E103 WeakPolarHBondContact O-CG 3.38Å; I99-E103 PolarHBondContact O-N 3.23Å; E103-N105 PolarHBondContact O-N 3.23Å; E103-E106 WeakPolarHBondContact O-CB 3.08Å; E103-E106 PolarHBondContact O-N 3.09Å; E103-S107 WeakPolarHBondContact O-CB 3.41Å; E103-S107 PolarHBondContact O-N 3.01Å; E103-S107 PolarHBondContact O-OG 3.14Å
104	L	79.4	Confident	76.6	Confident	55 Å²	55	67.3 Å²	67.3	29%	0.288	35%	0.351	S	S	.	.	H	α-helix	trans	-62	-30	175.4	-79.8	165.4	0	0	0	111.9	K65 V68 L69 F100 K102	K65-L104 WeakPolarHBondContact CE-O 3.3Å; K65-L104 HydrophobicContact CG-CD2 4.47Å; K65-L104 PolarHBondContact NZ-O 2.98Å; V68-L104 HydrophobicContact CG1-CD1 3.81Å; L69-L104 HydrophobicContact CD2-CB 4.45Å; L69-L104 HydrophobicContact CD2-CD1 4.34Å; F100-L104 WeakPolarHBondContact O-CG 3.24Å; F100-L104 PolarHBondContact O-N 3.46Å; F100-L104 VanDerWaalsContact O-N 3.13Å; K102-L104 PolarHBondContact O-N 3.47Å
105	N	79.9	Confident	76.2	Confident	81 Å²	81	69.9 Å²	69.9	43%	0.433	36%	0.363	S	S	.	.	H	α-helix	trans	-81.1	-42.2	179.1	-142.3	38.3	0	0	0	113.5	K65 Q101 K102 E103 S107 E108 N109	K65-N105 VanDerWaalsContact NZ-CA 3.32Å; K65-N105 PolarHBondContact NZ-OD1 3.46Å; Q101-N105 PolarHBondContact O-N 2.95Å; K102-N105 CarbonylContact O-C 3.57Å; K102-N105 WeakPolarHBondContact O-CA 3.1Å; K102-N105 WeakPolarHBondContact O-CB 3.26Å; K102-N105 PolarHBondContact O-N 3.28Å; E103-N105 PolarHBondContact O-N 3.23Å; N105-S107 VanDerWaalsContact C-N 3.34Å; N105-E108 PolarHBondContact O-N 3.41Å; N105-N109 PolarHBondContact O-N 3.08Å
106	E	76.9	Confident	75.7	Confident	34 Å²	34	69.7 Å²	69.7	16%	0.159	36%	0.362	C	S	.	.	H	α-helix	trans	-53.3	-50.3	169.4	-66.1	-93	158.2	0	0	110.9	K102 E103 E108 N109 S110 K149	K102-E106 HydrophobicContact CG-CG 4.12Å; K102-E106 IonicContact NZ-OE1 3.99Å; K102-E106 WeakPolarHBondContact O-CG 3.44Å; K102-E106 PolarHBondContact O-N 3.1Å; E103-E106 WeakPolarHBondContact O-CB 3.08Å; E103-E106 PolarHBondContact O-N 3.09Å; E106-E108 VanDerWaalsContact C-N 3.31Å; E106-E108 PolarHBondContact O-N 3.1Å; E106-N109 WeakPolarHBondContact O-CB 3.48Å; E106-N109 PolarHBondContact O-N 2.77Å; E106-S110 PolarHBondContact O-N 2.88Å; E106-S110 PolarHBondContact O-OG 3.03Å; E106-K149 WeakPolarHBondContact OE1-CE 3.48Å; E106-K149 IonicContact OE1-NZ 2.64Å; E106-K149 PolarHBondContact OE1-NZ 2.99Å; E106-K149 WeakPolarHBondContact OE2-CE 3.41Å; E106-K149 IonicContact OE2-NZ 2.72Å; E106-K149 PolarHBondContact OE2-NZ 3.35Å
107	S	74.1	Confident	75.2	Confident	64 Å²	64	68.3 Å²	68.3	45%	0.448	36%	0.357	S	S	.	.	H	α-helix	trans	-58.5	-37.9	179.2	-64.9	0	0	0	0	113.4	E103 N105 V111	E103-S107 WeakPolarHBondContact O-CB 3.41Å; E103-S107 PolarHBondContact O-N 3.01Å; E103-S107 PolarHBondContact O-OG 3.14Å; N105-S107 VanDerWaalsContact C-N 3.34Å; S107-V111 WeakPolarHBondContact O-CG2 3.33Å; S107-V111 PolarHBondContact O-N 3.48Å
108	E	79.3	Confident	74.4	Confident	50 Å²	50	70.8 Å²	70.8	23%	0.234	37%	0.372	C	S	.	.	H	α-helix	trans	-65.7	-45	175.2	175.9	173.2	-168.8	0	0	111.2	L62 K65 N105 E106 S110 V111 F112	L62-E108 HydrophobicContact CD2-CG 3.88Å; L62-E108 WeakPolarHBondContact CD2-OE1 3.28Å; K65-E108 HydrophobicContact CD-CB 4.44Å; K65-E108 WeakPolarHBondContact CE-OE2 3.41Å; K65-E108 VanDerWaalsContact NZ-CB 3.27Å; K65-E108 IonicContact NZ-OE2 2.59Å; K65-E108 PolarHBondContact NZ-OE2 3.21Å; N105-E108 PolarHBondContact O-N 3.41Å; E106-E108 VanDerWaalsContact C-N 3.31Å; E106-E108 PolarHBondContact O-N 3.1Å; E108-S110 VanDerWaalsContact C-N 3.32Å; E108-S110 PolarHBondContact O-N 3.09Å; E108-V111 PolarHBondContact O-N 3.43Å; E108-F112 HydrophobicContact CG-CD2 3.71Å; E108-F112 HydrophobicContact CG-CE2 3.53Å; E108-F112 VanDerWaalsContact O-CD2 3.22Å; E108-F112 WeakPolarHBondContact O-CD2 3.46Å; E108-F112 PolarHBondContact O-N 3.46Å; E108-F112 VanDerWaalsContact O-N 3.08Å; E108-F112 WeakPolarHBondContact OE1-CE2 3.3Å
109	N	76.6	Confident	73.7	Confident	92 Å²	92	68.1 Å²	68.1	49%	0.492	36%	0.359	S	S	.	.	H	α-helix	trans	-61.2	-41.2	178.4	-74.4	-21.6	0	0	0	111.8	N105 E106 V111 F112 Q113	N105-N109 PolarHBondContact O-N 3.08Å; E106-N109 WeakPolarHBondContact O-CB 3.48Å; E106-N109 PolarHBondContact O-N 2.77Å; N109-V111 PolarHBondContact O-N 3.18Å; N109-F112 PolarHBondContact O-N 3.18Å; N109-Q113 WeakPolarHBondContact O-CB 3.32Å; N109-Q113 WeakPolarHBondContact O-CG 3.44Å; N109-Q113 PolarHBondContact O-N 2.9Å
110	S	70.1	Confident	73	Confident	60 Å²	60	71.8 Å²	71.8	42%	0.42	37%	0.371	S	S	.	.	H	α-helix	trans	-61.6	-42	176.8	-62.9	0	0	0	0	112.3	E106 E108 F112 Q113 A114	E106-S110 PolarHBondContact O-N 2.88Å; E106-S110 PolarHBondContact O-OG 3.03Å; E108-S110 VanDerWaalsContact C-N 3.32Å; E108-S110 PolarHBondContact O-N 3.09Å; S110-F112 PolarHBondContact O-N 2.93Å; S110-Q113 PolarHBondContact O-N 3.39Å; S110-A114 WeakPolarHBondContact O-CB 3.5Å; S110-A114 PolarHBondContact O-N 2.94Å
111	V	73.3	Confident	72.1	Confident	65 Å²	65	67 Å²	67	39%	0.394	35%	0.352	S	S	.	.	H	α-helix	trans	-63	-43.4	175.6	172.4	0	0	0	0	111.2	L58 S107 E108 N109 A114 I115	L58-V111 HydrophobicContact CD1-CG1 3.89Å; S107-V111 WeakPolarHBondContact O-CG2 3.33Å; S107-V111 PolarHBondContact O-N 3.48Å; E108-V111 PolarHBondContact O-N 3.43Å; N109-V111 PolarHBondContact O-N 3.18Å; V111-A114 PolarHBondContact O-N 3.45Å; V111-I115 HydrophobicContact CG1-CD1 4.02Å; V111-I115 VanDerWaalsContact O-CG1 3.3Å; V111-I115 WeakPolarHBondContact O-CG1 3.49Å; V111-I115 PolarHBondContact O-N 3.4Å
112	F	75.2	Confident	71.1	Confident	60 Å²	60	68.1 Å²	68.1	26%	0.263	36%	0.36	S	S	.	.	H	α-helix	trans	-67.9	-37.9	177.1	-79.4	-67.5	0	0	0	113.1	L62 E108 N109 S110 A114 I115 H116	L62-F112 HydrophobicContact CD1-CZ 4.19Å; E108-F112 HydrophobicContact CG-CD2 3.71Å; E108-F112 HydrophobicContact CG-CE2 3.53Å; E108-F112 VanDerWaalsContact O-CD2 3.22Å; E108-F112 WeakPolarHBondContact O-CD2 3.46Å; E108-F112 PolarHBondContact O-N 3.46Å; E108-F112 VanDerWaalsContact O-N 3.08Å; E108-F112 WeakPolarHBondContact OE1-CE2 3.3Å; N109-F112 PolarHBondContact O-N 3.18Å; S110-F112 PolarHBondContact O-N 2.93Å; F112-A114 VanDerWaalsContact C-N 3.34Å; F112-I115 PolarHBondContact O-N 3Å; F112-H116 PolarHBondContact O-CD2 3.46Å; F112-H116 PolarHBondContact O-N 3.24Å
113	Q	71.6	Confident	70.2	Confident	126 Å²	126	68.9 Å²	68.9	59%	0.589	37%	0.365	S	S	*	.	H	α-helix	trans	-62.5	-41.2	173.8	-77.5	-177.5	-7.8	0	0	111.9	N109 S110 H116 G117	N109-Q113 WeakPolarHBondContact O-CB 3.32Å; N109-Q113 WeakPolarHBondContact O-CG 3.44Å; N109-Q113 PolarHBondContact O-N 2.9Å; S110-Q113 PolarHBondContact O-N 3.39Å; Q113-H116 PolarHBondContact O-N 3.23Å; Q113-G117 PolarHBondContact O-N 2.97Å
114	A	64.9	Low	69.3	Low	66 Å²	66	67.9 Å²	67.9	55%	0.545	37%	0.37	S	S	.	.	H	α-helix	trans	-62.4	-42.5	175.1	0	0	0	0	0	111.8	S110 V111 F112 G117 L118	S110-A114 WeakPolarHBondContact O-CB 3.5Å; S110-A114 PolarHBondContact O-N 2.94Å; V111-A114 PolarHBondContact O-N 3.45Å; F112-A114 VanDerWaalsContact C-N 3.34Å; A114-G117 PolarHBondContact O-N 3.23Å; A114-L118 WeakPolarHBondContact O-CB 3.28Å; A114-L118 PolarHBondContact O-N 3.41Å
115	I	70.1	Confident	68.4	Low	71 Å²	71	70.9 Å²	70.9	36%	0.364	39%	0.386	S	S	.	.	H	α-helix	trans	-63.2	-43.9	175.7	-67.9	166.6	0	0	0	111	L58 V111 F112 G117 L118 Q119	L58-I115 HydrophobicContact CD2-CD1 3.9Å; V111-I115 HydrophobicContact CG1-CD1 4.02Å; V111-I115 VanDerWaalsContact O-CG1 3.3Å; V111-I115 WeakPolarHBondContact O-CG1 3.49Å; V111-I115 PolarHBondContact O-N 3.4Å; F112-I115 PolarHBondContact O-N 3Å; I115-G117 VanDerWaalsContact C-N 3.33Å; I115-G117 PolarHBondContact O-N 3.26Å; I115-L118 PolarHBondContact O-N 3.41Å; I115-Q119 PolarHBondContact O-N 3Å
116	H	66.9	Low	67.5	Low	89 Å²	89	73.9 Å²	73.9	41%	0.412	39%	0.392	S	S	.	.	H	α-helix	trans	-65.5	-34.8	174.8	-87.8	-65.8	0	0	0	112.9	F112 Q113 Q119 R120	F112-H116 PolarHBondContact O-CD2 3.46Å; F112-H116 PolarHBondContact O-N 3.24Å; Q113-H116 PolarHBondContact O-N 3.23Å; H116-Q119 PolarHBondContact O-N 2.84Å; H116-R120 WeakPolarHBondContact O-CG 3.41Å; H116-R120 PolarHBondContact O-N 3.34Å; H116-R120 PolarHBondContact O-NE 3.38Å
117	G	65.3	Low	66.7	Low	14 Å²	14	81.6 Å²	81.6	14%	0.144	43%	0.425	C	S	.	.	H	α-helix	trans	-62.6	-45	172	0	0	0	0	0	111.9	Q113 A114 I115 R120 A121	Q113-G117 PolarHBondContact O-N 2.97Å; A114-G117 PolarHBondContact O-N 3.23Å; I115-G117 VanDerWaalsContact C-N 3.33Å; I115-G117 PolarHBondContact O-N 3.26Å; G117-R120 PolarHBondContact O-N 3.2Å; G117-A121 WeakPolarHBondContact O-CB 3.22Å; G117-A121 PolarHBondContact O-N 2.97Å
118	L	64	Low	66.2	Low	107 Å²	107	82.1 Å²	82.1	56%	0.56	42%	0.423	S	S	*	.	H	α-helix	trans	-64.1	-42	176.1	-174.4	65.9	0	0	0	111.8	A114 I115 R120 A121 L122	A114-L118 WeakPolarHBondContact O-CB 3.28Å; A114-L118 PolarHBondContact O-N 3.41Å; I115-L118 PolarHBondContact O-N 3.41Å; L118-R120 PolarHBondContact O-N 2.91Å; L118-A121 WeakPolarHBondContact O-CB 3.43Å; L118-A121 PolarHBondContact O-N 3.39Å; L118-L122 HydrophobicContact CG-CD1 4.21Å; L118-L122 WeakPolarHBondContact O-CG 3.33Å; L118-L122 PolarHBondContact O-N 3.32Å
119	Q	64.9	Low	65.6	Low	47 Å²	47	84.7 Å²	84.7	22%	0.22	44%	0.442	C	S	.	.	H	α-helix	trans	-60.4	-45.6	175.5	-177.9	-177.7	-10.6	0	0	111.7	I115 H116 A121 L122 Q123	I115-Q119 PolarHBondContact O-N 3Å; H116-Q119 PolarHBondContact O-N 2.84Å; Q119-A121 VanDerWaalsContact C-N 3.34Å; Q119-L122 PolarHBondContact O-N 3.04Å; Q119-Q123 WeakPolarHBondContact O-CB 3.34Å; Q119-Q123 WeakPolarHBondContact O-CG 3.46Å; Q119-Q123 PolarHBondContact O-N 2.88Å
120	R	62.9	Low	65.3	Low	109 Å²	109	85.2 Å²	85.2	41%	0.411	45%	0.448	S	S	.	.	H	α-helix	trans	-63.7	-39.7	176.4	-77.5	-175.8	-70.7	153.6	-6.3	112.1	H116 G117 L118 L122 Q123 G124	H116-R120 WeakPolarHBondContact O-CG 3.41Å; H116-R120 PolarHBondContact O-N 3.34Å; H116-R120 PolarHBondContact O-NE 3.38Å; G117-R120 PolarHBondContact O-N 3.2Å; L118-R120 PolarHBondContact O-N 2.91Å; R120-L122 VanDerWaalsContact C-N 3.35Å; R120-Q123 PolarHBondContact O-N 3.2Å; R120-G124 PolarHBondContact O-N 2.94Å; R120-G124 VanDerWaalsContact O-N 3.1Å
121	A	61.5	Low	65.1	Low	12 Å²	12	86.8 Å²	86.8	10%	0.099	45%	0.452	C	S	.	.	H	α-helix	trans	-59.8	-48.1	175.4	0	0	0	0	0	110.6	G117 L118 Q119 Q123 G124 Y126	G117-A121 WeakPolarHBondContact O-CB 3.22Å; G117-A121 PolarHBondContact O-N 2.97Å; L118-A121 WeakPolarHBondContact O-CB 3.43Å; L118-A121 PolarHBondContact O-N 3.39Å; Q119-A121 VanDerWaalsContact C-N 3.34Å; A121-Q123 VanDerWaalsContact C-N 3.34Å; A121-Q123 PolarHBondContact O-N 3.43Å; A121-G124 PolarHBondContact O-N 3.47Å; A121-Y126 VanDerWaalsContact O-CZ 3.23Å; A121-Y126 PolarHBondContact O-OH 2.91Å
122	L	60.2	Low	64.6	Low	83 Å²	83	88 Å²	88	44%	0.435	45%	0.454	S	S	.	.	H	α-helix	trans	-65.7	-33.5	179.1	-69.7	169.1	0	0	0	113	H37 L118 Q119 R120	H37-L122 PolarHBondContact CE1-O 3.45Å; H37-L122 PolarHBondContact NE2-O 2.88Å; L118-L122 HydrophobicContact CG-CD1 4.21Å; L118-L122 WeakPolarHBondContact O-CG 3.33Å; L118-L122 PolarHBondContact O-N 3.32Å; Q119-L122 PolarHBondContact O-N 3.04Å; R120-L122 VanDerWaalsContact C-N 3.35Å
123	Q	60.2	Low	64.5	Low	107 Å²	107	92.9 Å²	92.9	50%	0.5	48%	0.475	S	S	.	.	H	α-helix	trans	-80.4	-11.6	177.8	-71.8	-179.9	-13.6	0	0	114.3	Q119 R120 A121	Q119-Q123 WeakPolarHBondContact O-CB 3.34Å; Q119-Q123 WeakPolarHBondContact O-CG 3.46Å; Q119-Q123 PolarHBondContact O-N 2.88Å; R120-Q123 PolarHBondContact O-N 3.2Å; A121-Q123 VanDerWaalsContact C-N 3.34Å; A121-Q123 PolarHBondContact O-N 3.43Å
124	G	59.2	Low	64.5	Low	34 Å²	34	90.3 Å²	90.3	35%	0.351	46%	0.463	S	S	.	.	S	Bend	trans	-69.8	134.8	-177.1	0	0	0	0	0	113	R120 A121 Y126	R120-G124 PolarHBondContact O-N 2.94Å; R120-G124 VanDerWaalsContact O-N 3.1Å; A121-G124 PolarHBondContact O-N 3.47Å; G124-Y126 WeakPolarHBondContact O-CD2 3.29Å; G124-Y126 WeakPolarHBondContact O-CE2 3.4Å; G124-Y126 PolarHBondContact O-N 3.14Å; G124-Y126 VanDerWaalsContact O-N 3.12Å
125	D	59.6	Low	64.6	Low	118 Å²	118	88.3 Å²	88.3	63%	0.631	45%	0.446	S	S	*	.			trans	-79.2	95	173.9	-155.1	-10.8	0	0	0	109.5	K127 D128	D125-K127 PolarHBondContact O-N 2.98Å; D125-D128 PolarHBondContact O-N 3.41Å; D125-D128 VanDerWaalsContact O-N 3.13Å
126	Y	61.2	Low	64.4	Low	144 Å²	144	88 Å²	88	57%	0.565	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	0.5	-175.1	-64	-85.1	0	0	0	115	A121 G124	A121-Y126 VanDerWaalsContact O-CZ 3.23Å; A121-Y126 PolarHBondContact O-OH 2.91Å; G124-Y126 WeakPolarHBondContact O-CD2 3.29Å; G124-Y126 WeakPolarHBondContact O-CE2 3.4Å; G124-Y126 PolarHBondContact O-N 3.14Å; G124-Y126 VanDerWaalsContact O-N 3.12Å
127	K	59.1	Low	64.8	Low	195 Å²	195	89.5 Å²	89.5	85%	0.848	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-20.5	174	-73.3	-177.9	176.9	179.2	0	113.4	D125	D125-K127 PolarHBondContact O-N 2.98Å
128	D	65.3	Low	65	Low	75 Å²	75	92.9 Å²	92.9	40%	0.401	46%	0.463	S	S	.	.			trans	-99.8	102.7	-178.2	-164.7	-8.3	0	0	0	110.8	D125 V130 N131 M132	D125-D128 PolarHBondContact O-N 3.41Å; D125-D128 VanDerWaalsContact O-N 3.13Å; D128-V130 PolarHBondContact O-N 2.86Å; D128-V130 PolarHBondContact OD1-N 3.48Å; D128-N131 HydrophobicContact CB-CB 4.23Å; D128-N131 PolarHBondContact O-N 3.41Å; D128-N131 PolarHBondContact OD2-ND2 3.48Å; D128-N131 VanDerWaalsContact OD2-ND2 3.17Å; D128-M132 PolarHBondContact O-N 3.34Å
129	V	65.1	Low	65.1	Low	105 Å²	105	92.1 Å²	92.1	64%	0.636	45%	0.453	S	S	*	.	H	α-helix	trans	-61.2	-29.3	-174.4	-179.6	0	0	0	0	111.8	M132 K133	V129-M132 PolarHBondContact O-N 2.87Å; V129-K133 WeakPolarHBondContact O-CB 3.46Å; V129-K133 PolarHBondContact O-N 3.39Å
130	V	71.1	Confident	65.2	Low	102 Å²	102	95.9 Å²	95.9	62%	0.618	47%	0.474	S	S	*	.	H	α-helix	trans	-71.5	-46.3	179.1	-179.9	0	0	0	0	110.5	D128 M132 K133 E134	D128-V130 PolarHBondContact O-N 2.86Å; D128-V130 PolarHBondContact OD1-N 3.48Å; V130-M132 VanDerWaalsContact C-N 3.28Å; V130-M132 PolarHBondContact O-N 3.02Å; V130-K133 PolarHBondContact O-N 3.22Å; V130-E134 WeakPolarHBondContact O-CB 3.24Å; V130-E134 PolarHBondContact O-N 3.24Å
131	N	65.5	Low	65.6	Low	93 Å²	93	94.7 Å²	94.7	50%	0.497	47%	0.473	S	S	.	.	H	α-helix	trans	-65.1	-32.9	174.9	-77.9	-28.1	0	0	0	112.2	D128 S135	D128-N131 HydrophobicContact CB-CB 4.23Å; D128-N131 PolarHBondContact O-N 3.41Å; D128-N131 PolarHBondContact OD2-ND2 3.48Å; D128-N131 VanDerWaalsContact OD2-ND2 3.17Å; N131-S135 VanDerWaalsContact O-CB 3.25Å; N131-S135 WeakPolarHBondContact O-CB 3.2Å; N131-S135 PolarHBondContact O-N 3.41Å
132	M	63.6	Low	65.9	Low	91 Å²	91	96.1 Å²	96.1	45%	0.448	49%	0.485	S	S	.	.	H	α-helix	trans	-67.2	-43.9	174.5	-168.1	168.4	74	0	0	111.8	D128 V129 V130 S135 S136	D128-M132 PolarHBondContact O-N 3.34Å; V129-M132 PolarHBondContact O-N 2.87Å; V130-M132 VanDerWaalsContact C-N 3.28Å; V130-M132 PolarHBondContact O-N 3.02Å; M132-S135 PolarHBondContact O-N 3.38Å; M132-S136 WeakPolarHBondContact O-CB 3.32Å; M132-S136 PolarHBondContact O-N 3.5Å; M132-S136 PolarHBondContact O-OG 3.39Å; M132-S136 VanDerWaalsContact O-OG 3.11Å
133	K	71.7	Confident	66.1	Low	163 Å²	163	97.9 Å²	97.9	71%	0.709	49%	0.494	S	S	*	.	H	α-helix	trans	-61.5	-44.2	175.3	-174.7	-178.8	178.7	-176.5	0	111.6	V129 V130 S136 R137	V129-K133 WeakPolarHBondContact O-CB 3.46Å; V129-K133 PolarHBondContact O-N 3.39Å; V130-K133 PolarHBondContact O-N 3.22Å; K133-S136 PolarHBondContact O-N 3.5Å; K133-R137 WeakPolarHBondContact O-CB 3.19Å; K133-R137 PolarHBondContact O-N 2.84Å
134	E	72.1	Confident	66.5	Low	71 Å²	71	101.2 Å²	101.2	33%	0.332	50%	0.502	S	S	.	.	H	α-helix	trans	-66.8	-42.1	179.8	-157.4	66.7	-160.8	0	0	111.7	V130 S136 R137 Q138	V130-E134 WeakPolarHBondContact O-CB 3.24Å; V130-E134 PolarHBondContact O-N 3.24Å; E134-S136 PolarHBondContact O-N 3.49Å; E134-R137 PolarHBondContact O-N 3.07Å; E134-R137 IonicContact OE1-CZ 4Å; E134-R137 IonicContact OE1-NE 2.57Å; E134-R137 PolarHBondContact OE1-NE 3.05Å; E134-R137 IonicContact OE1-NH2 3.76Å; E134-R137 PolarHBondContact OE1-NH2 2.81Å; E134-R137 IonicContact OE2-NE 2.68Å; E134-R137 IonicContact OE2-NH2 3.15Å; E134-Q138 WeakPolarHBondContact O-CG 3.48Å; E134-Q138 PolarHBondContact O-N 3.3Å
135	S	66.7	Low	67	Low	25 Å²	25	106.2 Å²	106.2	18%	0.175	52%	0.516	C	S	.	.	H	α-helix	trans	-65	-38.3	176.1	-174.1	0	0	0	0	112.6	N131 M132 R139	N131-S135 VanDerWaalsContact O-CB 3.25Å; N131-S135 WeakPolarHBondContact O-CB 3.2Å; N131-S135 PolarHBondContact O-N 3.41Å; M132-S135 PolarHBondContact O-N 3.38Å; S135-R139 WeakPolarHBondContact O-CG 3.45Å; S135-R139 PolarHBondContact O-N 2.91Å; S135-R139 PolarHBondContact O-NE 2.9Å; S135-R139 PolarHBondContact OG-NH2 3.46Å
136	S	67.3	Low	67.2	Low	63 Å²	63	102.8 Å²	102.8	44%	0.441	50%	0.504	S	S	.	.	H	α-helix	trans	-69.1	-39.8	175.1	-67.3	0	0	0	0	111.8	M132 K133 E134 R139 L140	M132-S136 WeakPolarHBondContact O-CB 3.32Å; M132-S136 PolarHBondContact O-N 3.5Å; M132-S136 PolarHBondContact O-OG 3.39Å; M132-S136 VanDerWaalsContact O-OG 3.11Å; K133-S136 PolarHBondContact O-N 3.5Å; E134-S136 PolarHBondContact O-N 3.49Å; S136-R139 PolarHBondContact O-N 2.87Å; S136-L140 PolarHBondContact O-N 3.37Å
137	R	74.4	Confident	67.4	Low	122 Å²	122	98.3 Å²	98.3	46%	0.46	50%	0.497	S	S	.	.	H	α-helix	trans	-60	-48.3	175.3	-175.4	170.9	79.4	109.4	-9.9	111.8	K133 E134 R139 L140 E141	K133-R137 WeakPolarHBondContact O-CB 3.19Å; K133-R137 PolarHBondContact O-N 2.84Å; E134-R137 PolarHBondContact O-N 3.07Å; E134-R137 IonicContact OE1-CZ 4Å; E134-R137 IonicContact OE1-NE 2.57Å; E134-R137 PolarHBondContact OE1-NE 3.05Å; E134-R137 IonicContact OE1-NH2 3.76Å; E134-R137 PolarHBondContact OE1-NH2 2.81Å; E134-R137 IonicContact OE2-NE 2.68Å; E134-R137 IonicContact OE2-NH2 3.15Å; R137-R139 VanDerWaalsContact C-N 3.3Å; R137-R139 PolarHBondContact O-N 3.16Å; R137-L140 WeakPolarHBondContact O-CB 3.44Å; R137-L140 PolarHBondContact O-N 3.29Å; R137-L140 VanDerWaalsContact O-N 3.16Å; R137-E141 WeakPolarHBondContact CG-OE1 3.27Å; R137-E141 IonicContact CZ-OE1 3.3Å; R137-E141 IonicContact NH1-OE1 3.1Å; R137-E141 PolarHBondContact NH1-OE1 3.27Å; R137-E141 WeakPolarHBondContact O-CG 3.16Å; R137-E141 PolarHBondContact O-N 2.79Å
138	Q	68.9	Low	67.7	Low	84 Å²	84	93.1 Å²	93.1	39%	0.393	48%	0.478	S	S	.	.	H	α-helix	trans	-64.4	-31.9	178.1	-71.5	177.1	-2.6	0	0	113.3	E134 A142	E134-Q138 WeakPolarHBondContact O-CG 3.48Å; E134-Q138 PolarHBondContact O-N 3.3Å; Q138-A142 WeakPolarHBondContact O-CB 3.46Å; Q138-A142 PolarHBondContact O-N 3.32Å
139	R	67.2	Low	67.9	Low	92 Å²	92	93.9 Å²	93.9	35%	0.347	48%	0.478	S	S	.	.	H	α-helix	trans	-69	-41	173.2	-77.6	179.4	-123.7	176.8	-1.6	111.8	S135 S136 R137 E141 A142 L143	S135-R139 WeakPolarHBondContact O-CG 3.45Å; S135-R139 PolarHBondContact O-N 2.91Å; S135-R139 PolarHBondContact O-NE 2.9Å; S135-R139 PolarHBondContact OG-NH2 3.46Å; S136-R139 PolarHBondContact O-N 2.87Å; R137-R139 VanDerWaalsContact C-N 3.3Å; R137-R139 PolarHBondContact O-N 3.16Å; R139-E141 VanDerWaalsContact C-N 3.35Å; R139-A142 PolarHBondContact O-N 3.18Å; R139-L143 WeakPolarHBondContact O-CG 3.35Å; R139-L143 PolarHBondContact O-N 3.4Å
140	L	66.3	Low	68	Low	126 Å²	126	95.8 Å²	95.8	66%	0.66	48%	0.479	S	S	*	.	H	α-helix	trans	-65.9	-40.2	177.2	-166.4	72.5	0	0	0	111.3	S136 R137 L143 R144	S136-L140 PolarHBondContact O-N 3.37Å; R137-L140 WeakPolarHBondContact O-CB 3.44Å; R137-L140 PolarHBondContact O-N 3.29Å; R137-L140 VanDerWaalsContact O-N 3.16Å; L140-L143 PolarHBondContact O-N 3.37Å; L140-R144 VanDerWaalsContact O-CB 3.3Å; L140-R144 WeakPolarHBondContact O-CB 3.16Å; L140-R144 PolarHBondContact O-N 3.05Å
141	E	71.9	Confident	67.7	Low	83 Å²	83	96.8 Å²	96.8	39%	0.388	48%	0.477	S	S	.	.	H	α-helix	trans	-63.2	-45	174.7	-73.4	169	-176.3	0	0	111.3	R137 R139 L143 R144 E145	R137-E141 WeakPolarHBondContact CG-OE1 3.27Å; R137-E141 IonicContact CZ-OE1 3.3Å; R137-E141 IonicContact NH1-OE1 3.1Å; R137-E141 PolarHBondContact NH1-OE1 3.27Å; R137-E141 WeakPolarHBondContact O-CG 3.16Å; R137-E141 PolarHBondContact O-N 2.79Å; R139-E141 VanDerWaalsContact C-N 3.35Å; E141-L143 PolarHBondContact O-N 2.74Å; E141-R144 WeakPolarHBondContact O-CB 3.26Å; E141-R144 PolarHBondContact O-N 2.72Å; E141-E145 WeakPolarHBondContact O-CG 3.33Å; E141-E145 PolarHBondContact O-N 3.31Å
142	A	66.8	Low	67.8	Low	42 Å²	42	98 Å²	98	35%	0.347	48%	0.481	S	S	.	.	H	α-helix	trans	-64.1	-39.7	176.4	0	0	0	0	0	113.4	Q138 R139 E145 A146	Q138-A142 WeakPolarHBondContact O-CB 3.46Å; Q138-A142 PolarHBondContact O-N 3.32Å; R139-A142 PolarHBondContact O-N 3.18Å; A142-E145 PolarHBondContact O-N 2.94Å; A142-A146 WeakPolarHBondContact O-CB 3.32Å; A142-A146 PolarHBondContact O-N 2.96Å
143	L	65.6	Low	67.8	Low	120 Å²	120	94.6 Å²	94.6	63%	0.628	47%	0.465	S	S	*	.	H	α-helix	trans	-66.4	-38.9	174.9	-76	171.3	0	0	0	111.7	R139 L140 E141 A146 A147	R139-L143 WeakPolarHBondContact O-CG 3.35Å; R139-L143 PolarHBondContact O-N 3.4Å; L140-L143 PolarHBondContact O-N 3.37Å; E141-L143 PolarHBondContact O-N 2.74Å; L143-A146 PolarHBondContact O-N 3.48Å; L143-A147 WeakPolarHBondContact O-CB 3.42Å; L143-A147 PolarHBondContact O-N 3.4Å
144	R	67.4	Low	67.6	Low	178 Å²	178	94.2 Å²	94.2	67%	0.672	46%	0.46	S	S	*	.	H	α-helix	trans	-63.9	-44.2	175.9	-176.9	-178.8	-178.8	175.9	1.7	111.5	L140 E141 A147 I148	L140-R144 VanDerWaalsContact O-CB 3.3Å; L140-R144 WeakPolarHBondContact O-CB 3.16Å; L140-R144 PolarHBondContact O-N 3.05Å; E141-R144 WeakPolarHBondContact O-CB 3.26Å; E141-R144 PolarHBondContact O-N 2.72Å; R144-A147 PolarHBondContact O-N 3.47Å; R144-I148 HydrophobicContact CG-CD1 3.89Å; R144-I148 WeakPolarHBondContact O-CD1 3.26Å; R144-I148 VanDerWaalsContact O-CG1 3.24Å; R144-I148 WeakPolarHBondContact O-CG1 3.17Å; R144-I148 PolarHBondContact O-N 3.49Å
145	E	70.5	Confident	67.4	Low	139 Å²	139	95.3 Å²	95.3	65%	0.65	47%	0.471	S	S	*	.	H	α-helix	trans	-63.8	-41.8	177	-75.2	178.2	-179.3	0	0	112	E141 A142 I148 K149	E141-E145 WeakPolarHBondContact O-CG 3.33Å; E141-E145 PolarHBondContact O-N 3.31Å; A142-E145 PolarHBondContact O-N 2.94Å; E145-I148 PolarHBondContact O-N 3.49Å; E145-K149 WeakPolarHBondContact O-CB 3.48Å; E145-K149 PolarHBondContact O-N 2.97Å; E145-K149 VanDerWaalsContact O-N 3.08Å
146	A	64.1	Low	67.5	Low	45 Å²	45	99.6 Å²	99.6	37%	0.372	49%	0.488	S	S	.	.	H	α-helix	trans	-61.7	-45.8	175	0	0	0	0	0	112	A142 L143 K149 E150	A142-A146 WeakPolarHBondContact O-CB 3.32Å; A142-A146 PolarHBondContact O-N 2.96Å; L143-A146 PolarHBondContact O-N 3.48Å; A146-K149 PolarHBondContact O-N 3.46Å; A146-E150 PolarHBondContact O-N 2.85Å
147	A	64.3	Low	67.3	Low	51 Å²	51	100.4 Å²	100.4	42%	0.421	49%	0.487	S	S	.	.	H	α-helix	trans	-65.4	-39.2	179.2	0	0	0	0	0	113	L143 R144 K149 E150 E151	L143-A147 WeakPolarHBondContact O-CB 3.42Å; L143-A147 PolarHBondContact O-N 3.4Å; R144-A147 PolarHBondContact O-N 3.47Å; A147-K149 VanDerWaalsContact C-N 3.29Å; A147-K149 PolarHBondContact O-N 3.05Å; A147-E150 PolarHBondContact O-N 3.02Å; A147-E151 PolarHBondContact O-N 2.6Å; A147-E151 VanDerWaalsContact O-N 3.08Å
148	I	66.9	Low	66.9	Low	85 Å²	85	98.4 Å²	98.4	44%	0.436	49%	0.485	S	S	.	.	H	α-helix	trans	-63.6	-40	175.3	-70.4	166.2	0	0	0	110.4	R144 E145 E151 M152	R144-I148 HydrophobicContact CG-CD1 3.89Å; R144-I148 WeakPolarHBondContact O-CD1 3.26Å; R144-I148 VanDerWaalsContact O-CG1 3.24Å; R144-I148 WeakPolarHBondContact O-CG1 3.17Å; R144-I148 PolarHBondContact O-N 3.49Å; E145-I148 PolarHBondContact O-N 3.49Å; I148-E151 PolarHBondContact O-N 3.04Å; I148-M152 HydrophobicContact CG2-SD 4.42Å; I148-M152 WeakPolarHBondContact O-CG 3.32Å; I148-M152 PolarHBondContact O-N 2.8Å
149	K	67.9	Low	66.9	Low	92 Å²	92	96.7 Å²	96.7	40%	0.4	49%	0.486	S	S	.	.	H	α-helix	trans	-67.4	-42.5	-179.8	-164.1	177.6	-176.6	-171.4	0	112	E106 E145 A146 A147 E151 M152 E153	E106-K149 WeakPolarHBondContact OE1-CE 3.48Å; E106-K149 IonicContact OE1-NZ 2.64Å; E106-K149 PolarHBondContact OE1-NZ 2.99Å; E106-K149 WeakPolarHBondContact OE2-CE 3.41Å; E106-K149 IonicContact OE2-NZ 2.72Å; E106-K149 PolarHBondContact OE2-NZ 3.35Å; E145-K149 WeakPolarHBondContact O-CB 3.48Å; E145-K149 PolarHBondContact O-N 2.97Å; E145-K149 VanDerWaalsContact O-N 3.08Å; A146-K149 PolarHBondContact O-N 3.46Å; A147-K149 VanDerWaalsContact C-N 3.29Å; A147-K149 PolarHBondContact O-N 3.05Å; K149-E151 PolarHBondContact O-N 3.46Å; K149-M152 PolarHBondContact O-N 3.43Å; K149-E153 PolarHBondContact O-N 3.33Å
150	E	67.2	Low	66.8	Low	144 Å²	144	93.5 Å²	93.5	67%	0.673	48%	0.479	S	S	*	.	H	α-helix	trans	-60.9	-42.1	175	-171	176.7	-177	0	0	111.8	A146 A147 M152 E153 Y154	A146-E150 PolarHBondContact O-N 2.85Å; A147-E150 PolarHBondContact O-N 3.02Å; E150-M152 PolarHBondContact O-N 3.34Å; E150-E153 PolarHBondContact O-N 3.46Å; E150-Y154 WeakPolarHBondContact O-CB 3.21Å; E150-Y154 PolarHBondContact O-N 3.29Å
151	E	64.5	Low	66.7	Low	124 Å²	124	93.7 Å²	93.7	58%	0.579	48%	0.476	S	S	*	.	H	α-helix	trans	-64.4	-38.9	173.6	-81.2	-143.3	154.2	0	0	112.8	A147 I148 K149 V155	A147-E151 PolarHBondContact O-N 2.6Å; A147-E151 VanDerWaalsContact O-N 3.08Å; I148-E151 PolarHBondContact O-N 3.04Å; K149-E151 PolarHBondContact O-N 3.46Å; E151-V155 VanDerWaalsContact O-CG2 3.25Å; E151-V155 WeakPolarHBondContact O-CG2 3.12Å; E151-V155 PolarHBondContact O-N 3.16Å
152	M	68	Low	66.4	Low	117 Å²	117	95.9 Å²	95.9	58%	0.576	49%	0.485	S	S	*	.	H	α-helix	trans	-64	-43.2	177.2	-74.8	-175.1	64.6	0	0	111.9	I148 K149 E150 V155 E156	I148-M152 HydrophobicContact CG2-SD 4.42Å; I148-M152 WeakPolarHBondContact O-CG 3.32Å; I148-M152 PolarHBondContact O-N 2.8Å; K149-M152 PolarHBondContact O-N 3.43Å; E150-M152 PolarHBondContact O-N 3.34Å; M152-V155 PolarHBondContact O-N 3.2Å; M152-E156 PolarHBondContact O-N 2.99Å
153	E	63.7	Low	66.3	Low	21 Å²	21	99.9 Å²	99.9	10%	0.098	50%	0.496	C	S	.	.	H	α-helix	trans	-68.9	-38.6	179.1	-71.9	176.9	154.8	0	0	111.7	K102 K149 E150 V155 E156 L157	K102-E153 IonicContact NZ-OE1 2.79Å; K102-E153 PolarHBondContact NZ-OE1 2.82Å; K149-E153 PolarHBondContact O-N 3.33Å; E150-E153 PolarHBondContact O-N 3.46Å; E153-V155 VanDerWaalsContact C-N 3.32Å; E153-V155 PolarHBondContact O-N 2.9Å; E153-E156 PolarHBondContact O-N 2.98Å; E153-L157 PolarHBondContact O-N 3.17Å
154	Y	67.6	Low	65.9	Low	155 Å²	155	98.8 Å²	98.8	61%	0.608	49%	0.487	S	S	*	.	H	α-helix	trans	-59.5	-41.9	171.6	-179.9	-99.6	0	0	0	112.3	E150 L157 L158	E150-Y154 WeakPolarHBondContact O-CB 3.21Å; E150-Y154 PolarHBondContact O-N 3.29Å; Y154-L157 PolarHBondContact O-N 3.47Å; Y154-L158 HydrophobicContact CE1-CD1 3.64Å; Y154-L158 WeakPolarHBondContact O-CB 3.43Å; Y154-L158 PolarHBondContact O-N 3.31Å
155	V	69.3	Low	65.6	Low	94 Å²	94	92.9 Å²	92.9	57%	0.57	48%	0.477	S	S	*	.	H	α-helix	trans	-66.6	-38.4	177.4	169.8	0	0	0	0	111.8	E151 M152 E153 L158 A159	E151-V155 VanDerWaalsContact O-CG2 3.25Å; E151-V155 WeakPolarHBondContact O-CG2 3.12Å; E151-V155 PolarHBondContact O-N 3.16Å; M152-V155 PolarHBondContact O-N 3.2Å; E153-V155 VanDerWaalsContact C-N 3.32Å; E153-V155 PolarHBondContact O-N 2.9Å; V155-L158 PolarHBondContact O-N 3.46Å; V155-A159 WeakPolarHBondContact O-CB 3.36Å; V155-A159 PolarHBondContact O-N 3.34Å
156	E	67.8	Low	65.2	Low	115 Å²	115	90.7 Å²	90.7	54%	0.537	47%	0.467	S	S	.	.	H	α-helix	trans	-64.2	-43	174.8	-76.1	-176.2	175.6	0	0	111.8	M152 E153 A159 A160	M152-E156 PolarHBondContact O-N 2.99Å; E153-E156 PolarHBondContact O-N 2.98Å; E156-A159 PolarHBondContact O-N 3.19Å; E156-A160 PolarHBondContact O-N 3.31Å
157	L	63.7	Low	64.9	Low	79 Å²	79	91 Å²	91	41%	0.414	47%	0.469	S	S	.	.	H	α-helix	trans	-61.6	-44.2	174.8	-78.9	172	0	0	0	112.2	I99 E153 Y154 A159 A160 E161	I99-L157 HydrophobicContact CG2-CD2 3.94Å; E153-L157 PolarHBondContact O-N 3.17Å; Y154-L157 PolarHBondContact O-N 3.47Å; L157-A159 VanDerWaalsContact C-N 3.29Å; L157-A159 PolarHBondContact O-N 3.35Å; L157-A160 WeakPolarHBondContact O-CB 3.37Å; L157-A160 PolarHBondContact O-N 2.99Å; L157-A160 VanDerWaalsContact O-N 3.16Å; L157-E161 PolarHBondContact O-N 3.46Å
158	L	65.1	Low	64.2	Low	81 Å²	81	92.9 Å²	92.9	42%	0.424	47%	0.471	S	S	.	.	H	α-helix	trans	-67.9	-32.2	180	-155.8	146.8	0	0	0	111.6	Y154 V155 K162	Y154-L158 HydrophobicContact CE1-CD1 3.64Å; Y154-L158 WeakPolarHBondContact O-CB 3.43Å; Y154-L158 PolarHBondContact O-N 3.31Å; V155-L158 PolarHBondContact O-N 3.46Å; L158-K162 WeakPolarHBondContact O-CB 3.15Å; L158-K162 PolarHBondContact O-N 3.14Å
159	A	69.9	Low	63.7	Low	48 Å²	48	95.9 Å²	95.9	40%	0.397	48%	0.482	S	S	.	.	H	α-helix	trans	-67.1	-42.2	171	0	0	0	0	0	111.9	V155 E156 L157 K162 H163	V155-A159 WeakPolarHBondContact O-CB 3.36Å; V155-A159 PolarHBondContact O-N 3.34Å; E156-A159 PolarHBondContact O-N 3.19Å; L157-A159 VanDerWaalsContact C-N 3.29Å; L157-A159 PolarHBondContact O-N 3.35Å; A159-K162 PolarHBondContact O-N 3.4Å; A159-H163 PolarHBondContact O-CD2 3.25Å; A159-H163 PolarHBondContact O-N 3.36Å
160	A	63.3	Low	63.1	Low	25 Å²	25	97.4 Å²	97.4	21%	0.207	49%	0.494	C	S	.	.	H	α-helix	trans	-63.9	-41.7	175.3	0	0	0	0	0	112.1	E156 L157 K162 H163 Q164	E156-A160 PolarHBondContact O-N 3.31Å; L157-A160 WeakPolarHBondContact O-CB 3.37Å; L157-A160 PolarHBondContact O-N 2.99Å; L157-A160 VanDerWaalsContact O-N 3.16Å; A160-K162 VanDerWaalsContact C-N 3.35Å; A160-K162 PolarHBondContact O-N 3.24Å; A160-H163 PolarHBondContact O-N 2.82Å; A160-Q164 PolarHBondContact O-N 3.42Å
161	E	64.5	Low	62.1	Low	129 Å²	129	95.4 Å²	95.4	60%	0.603	49%	0.486	S	S	*	.	H	α-helix	trans	-63.2	-40.2	175.2	-171.5	-174.9	-179.6	0	0	111.8	L157 Q164 A165	L157-E161 PolarHBondContact O-N 3.46Å; E161-Q164 CarbonylContact O-C 3.55Å; E161-Q164 WeakPolarHBondContact O-CA 3.26Å; E161-Q164 WeakPolarHBondContact O-CB 3.34Å; E161-Q164 PolarHBondContact O-N 3.3Å; E161-Q164 VanDerWaalsContact O-N 3.17Å; E161-A165 PolarHBondContact O-N 3.49Å
162	K	67.3	Low	61.3	Low	130 Å²	130	96.3 Å²	96.3	57%	0.565	49%	0.49	S	S	*	.	H	α-helix	trans	-65	-40.9	175.6	-169.8	-179.3	176.6	-172.4	0	112	L158 A159 A160 Q164 A165 E166	L158-K162 WeakPolarHBondContact O-CB 3.15Å; L158-K162 PolarHBondContact O-N 3.14Å; A159-K162 PolarHBondContact O-N 3.4Å; A160-K162 VanDerWaalsContact C-N 3.35Å; A160-K162 PolarHBondContact O-N 3.24Å; K162-Q164 VanDerWaalsContact C-N 3.29Å; K162-Q164 PolarHBondContact O-N 3.47Å; K162-A165 PolarHBondContact O-N 3.18Å; K162-E166 WeakPolarHBondContact O-CG 3.38Å; K162-E166 PolarHBondContact O-N 3.23Å
163	H	63	Low	60.3	Low	126 Å²	126	99.1 Å²	99.1	58%	0.583	50%	0.501	S	S	*	.	H	α-helix	trans	-62.4	-37.2	172	-83.5	-64.6	0	0	0	111.9	A159 A160 E166 A167	A159-H163 PolarHBondContact O-CD2 3.25Å; A159-H163 PolarHBondContact O-N 3.36Å; A160-H163 PolarHBondContact O-N 2.82Å; H163-E166 PolarHBondContact O-N 3.43Å; H163-A167 VanDerWaalsContact O-CB 3.3Å; H163-A167 WeakPolarHBondContact O-CB 3.26Å; H163-A167 PolarHBondContact O-N 2.93Å
164	Q	57.2	Low	59.4	Low	96 Å²	96	105.7 Å²	105.7	45%	0.449	53%	0.532	S	S	.	.	H	α-helix	trans	-64	-43.7	172	-178.6	178	-27.8	0	0	111.5	F92 A160 E161 K162 E166 A167 L168	F92-Q164 HydrophobicContact CZ-CB 4.16Å; F92-Q164 HydrophobicContact CZ-CG 4.45Å; A160-Q164 PolarHBondContact O-N 3.42Å; E161-Q164 CarbonylContact O-C 3.55Å; E161-Q164 WeakPolarHBondContact O-CA 3.26Å; E161-Q164 WeakPolarHBondContact O-CB 3.34Å; E161-Q164 PolarHBondContact O-N 3.3Å; E161-Q164 VanDerWaalsContact O-N 3.17Å; K162-Q164 VanDerWaalsContact C-N 3.29Å; K162-Q164 PolarHBondContact O-N 3.47Å; Q164-E166 VanDerWaalsContact C-N 3.29Å; Q164-E166 PolarHBondContact O-N 2.85Å; Q164-A167 PolarHBondContact O-N 2.71Å; Q164-L168 WeakPolarHBondContact O-CB 3.42Å; Q164-L168 PolarHBondContact O-N 3.21Å
165	A	61.5	Low	58.2	Low	54 Å²	54	105.7 Å²	105.7	45%	0.446	54%	0.542	S	S	.	.	H	α-helix	trans	-63.9	-34.2	177.1	0	0	0	0	0	112.6	E161 K162 K169	E161-A165 PolarHBondContact O-N 3.49Å; K162-A165 PolarHBondContact O-N 3.18Å; A165-K169 WeakPolarHBondContact O-CB 3.32Å; A165-K169 WeakPolarHBondContact O-CG 3.12Å; A165-K169 PolarHBondContact O-N 3.45Å
166	E	62.9	Low	57.3	Low	94 Å²	94	111.3 Å²	111.3	44%	0.439	56%	0.559	S	S	.	*	H	α-helix	trans	-74.3	-42.4	175.2	-73.6	175.4	-171.9	0	0	112.2	K162 H163 Q164 K169 N170	K162-E166 WeakPolarHBondContact O-CG 3.38Å; K162-E166 PolarHBondContact O-N 3.23Å; H163-E166 PolarHBondContact O-N 3.43Å; Q164-E166 VanDerWaalsContact C-N 3.29Å; Q164-E166 PolarHBondContact O-N 2.85Å; E166-K169 PolarHBondContact O-N 3.47Å; E166-N170 PolarHBondContact O-N 2.89Å
167	A	56.5	Low	56.5	Low	52 Å²	52	110.9 Å²	110.9	43%	0.43	57%	0.569	S	S	.	*	H	α-helix	trans	-64.9	-39.4	173.3	0	0	0	0	0	111.6	H163 Q164 N170 M171	H163-A167 VanDerWaalsContact O-CB 3.3Å; H163-A167 WeakPolarHBondContact O-CB 3.26Å; H163-A167 PolarHBondContact O-N 2.93Å; Q164-A167 PolarHBondContact O-N 2.71Å; A167-N170 PolarHBondContact O-N 3.32Å; A167-M171 WeakPolarHBondContact O-CB 3.23Å; A167-M171 VanDerWaalsContact O-CG 3.27Å; A167-M171 WeakPolarHBondContact O-CG 3.23Å; A167-M171 PolarHBondContact O-N 3.3Å
168	L	50.8	Low	56	Low	89 Å²	89	112.6 Å²	112.6	47%	0.466	58%	0.578	S	S	.	*	H	α-helix	trans	-69.1	-36.8	177.1	-157	123	0	0	0	110.9	Q164 M171 Q172	Q164-L168 WeakPolarHBondContact O-CB 3.42Å; Q164-L168 PolarHBondContact O-N 3.21Å; L168-M171 CarbonylContact O-C 3.14Å; L168-M171 PolarHBondContact O-N 2.99Å; L168-Q172 WeakPolarHBondContact O-CB 3.17Å; L168-Q172 PolarHBondContact O-N 2.77Å
169	K	56.7	Low	55.2	Low	149 Å²	149	113.5 Å²	113.5	65%	0.648	59%	0.591	S	S	*	*	H	α-helix	trans	-61.5	-40.2	168.6	-89.4	-179.9	176.9	175.1	0	112.8	A165 E166 Q172 H173	A165-K169 WeakPolarHBondContact O-CB 3.32Å; A165-K169 WeakPolarHBondContact O-CG 3.12Å; A165-K169 PolarHBondContact O-N 3.45Å; E166-K169 PolarHBondContact O-N 3.47Å; K169-Q172 PolarHBondContact O-N 3.42Å; K169-H173 PolarHBondContact O-N 2.87Å
170	N	54	Low	54.3	Low	124 Å²	124	116.7 Å²	116.7	66%	0.663	60%	0.6	S	S	*	*	H	α-helix	trans	-68.4	-37.4	176	-75	-16.8	0	0	0	111.8	E166 A167 H173	E166-N170 PolarHBondContact O-N 2.89Å; A167-N170 PolarHBondContact O-N 3.32Å; N170-H173 PolarHBondContact O-N 3.46Å
171	M	47	Very low	53.8	Low	101 Å²	101	119.8 Å²	119.8	50%	0.498	61%	0.613	S	S	.	*	H	α-helix	trans	-73.4	-29.2	174.4	-70.5	-76.4	-89.3	0	0	112.7	E89 A167 L168 H173 Q174	E89-M171 VanDerWaalsContact OE1-CE 3.32Å; E89-M171 WeakPolarHBondContact OE1-CE 3.25Å; A167-M171 WeakPolarHBondContact O-CB 3.23Å; A167-M171 VanDerWaalsContact O-CG 3.27Å; A167-M171 WeakPolarHBondContact O-CG 3.23Å; A167-M171 PolarHBondContact O-N 3.3Å; L168-M171 CarbonylContact O-C 3.14Å; L168-M171 PolarHBondContact O-N 2.99Å; M171-H173 PolarHBondContact O-N 2.84Å; M171-Q174 CarbonylContact O-C 3.58Å; M171-Q174 WeakPolarHBondContact O-CA 3.27Å; M171-Q174 PolarHBondContact O-N 2.92Å
172	Q	46.9	Very low	53.3	Low	144 Å²	144	119.2 Å²	119.2	67%	0.673	61%	0.614	S	S	*	*	H	α-helix	trans	-72.8	-14.3	177.8	-159.7	158	-0.9	0	0	112.5	L168 K169 Q174	L168-Q172 WeakPolarHBondContact O-CB 3.17Å; L168-Q172 PolarHBondContact O-N 2.77Å; K169-Q172 PolarHBondContact O-N 3.42Å; Q172-Q174 VanDerWaalsContact C-N 3.3Å
173	H	48.1	Very low	52.8	Low	176 Å²	176	119.2 Å²	119.2	82%	0.815	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-12.1	162.9	-95.8	-69.2	0	0	0	113.7	K169 N170 M171	K169-H173 PolarHBondContact O-N 2.87Å; N170-H173 PolarHBondContact O-N 3.46Å; M171-H173 PolarHBondContact O-N 2.84Å
174	Q	45.1	Very low	52.8	Low	159 Å²	159	118 Å²	118	74%	0.743	61%	0.613	S	S	*	*	S	Bend	trans	-125.8	94.8	172.9	-86	-170.9	-35.1	0	0	112	M171 Q172	M171-Q174 CarbonylContact O-C 3.58Å; M171-Q174 WeakPolarHBondContact O-CA 3.27Å; M171-Q174 PolarHBondContact O-N 2.92Å; Q172-Q174 VanDerWaalsContact C-N 3.3Å
175	N	42.3	Very low	52.9	Low	154 Å²	154	118.5 Å²	118.5	82%	0.824	62%	0.618	S	S	*	*			trans	85.9	118.9	167.7	-80.9	-28.3	0	0	0	119.8	S177	N175-S177 PolarHBondContact O-N 3.37Å; N175-S177 VanDerWaalsContact O-N 3.16Å
176	K	50.4	Low	53.1	Low	212 Å²	212	119.1 Å²	119.1	92%	0.922	61%	0.612	S	S	*	*			trans	-57.6	102.1	151.3	-90.1	175.8	167.8	175.1	0	109.9
177	S	51	Low	53.2	Low	106 Å²	106	119.4 Å²	119.4	74%	0.741	62%	0.616	S	S	*	*			trans	-174.6	112.7	144.4	-169.7	0	0	0	0	108.1	N175	N175-S177 PolarHBondContact O-N 3.37Å; N175-S177 VanDerWaalsContact O-N 3.16Å
178	L	51.3	Low	53.7	Low	115 Å²	115	121.3 Å²	121.3	60%	0.602	62%	0.622	S	S	*	*			trans	-176	74.2	147.5	-99.2	166.5	0	0	0	109.8	I180 L181	L178-I180 PolarHBondContact O-N 3.48Å; L178-L181 HydrophobicContact CD2-CB 4.38Å
179	S	49.6	Very low	54.5	Low	100 Å²	100	123.8 Å²	123.8	70%	0.699	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-3.8	169.3	179.2	0	0	0	0	113.1
180	I	50.8	Low	55.1	Low	115 Å²	115	121.3 Å²	121.3	59%	0.59	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	-27.2	-170.3	-59.2	170.2	0	0	0	111.3	L178 I184	L178-I180 PolarHBondContact O-N 3.48Å; I180-I184 HydrophobicContact CG2-CD1 4.4Å; I180-I184 WeakPolarHBondContact O-CG1 3.43Å; I180-I184 PolarHBondContact O-N 2.91Å
181	L	52.4	Low	55.6	Low	91 Å²	91	118.1 Å²	118.1	48%	0.476	61%	0.605	S	S	.	*	H	α-helix	trans	-75.7	-37.1	178.5	-160.2	78.9	0	0	0	111.6	L178 E183 I184 L185	L178-L181 HydrophobicContact CD2-CB 4.38Å; L181-E183 VanDerWaalsContact C-N 3.26Å; L181-E183 PolarHBondContact O-N 3.4Å; L181-I184 PolarHBondContact O-N 2.93Å; L181-L185 HydrophobicContact CG-CD1 4.43Å; L181-L185 PolarHBondContact O-N 3.44Å
182	D	54.7	Low	56.1	Low	116 Å²	116	115.9 Å²	115.9	62%	0.62	60%	0.603	S	S	*	*	H	α-helix	trans	-62.6	-34.2	174.5	-78.1	-17.2	0	0	0	111.9	E186	D182-E186 VanDerWaalsContact O-CB 3.3Å; D182-E186 WeakPolarHBondContact O-CB 3.48Å; D182-E186 PolarHBondContact O-N 3.29Å; D182-E186 VanDerWaalsContact O-N 3.1Å
183	E	57.5	Low	57	Low	130 Å²	130	113 Å²	113	61%	0.607	59%	0.592	S	S	*	*	H	α-helix	trans	-70.4	-39	177.3	-167.1	173.4	-172.6	0	0	111.8	L181 E186 D187	L181-E183 VanDerWaalsContact C-N 3.26Å; L181-E183 PolarHBondContact O-N 3.4Å; E183-E186 PolarHBondContact O-N 3.49Å; E183-D187 PolarHBondContact O-N 2.94Å
184	I	61.7	Low	58	Low	101 Å²	101	112.6 Å²	112.6	52%	0.518	58%	0.584	S	S	.	*	H	α-helix	trans	-70.9	-40.4	177.6	-65.4	169.6	0	0	0	111.3	I180 L181 E186 D187 V188	I180-I184 HydrophobicContact CG2-CD1 4.4Å; I180-I184 WeakPolarHBondContact O-CG1 3.43Å; I180-I184 PolarHBondContact O-N 2.91Å; L181-I184 PolarHBondContact O-N 2.93Å; I184-E186 VanDerWaalsContact C-N 3.29Å; I184-E186 PolarHBondContact O-N 3.26Å; I184-D187 PolarHBondContact O-N 2.92Å; I184-V188 WeakPolarHBondContact O-CG2 3.31Å; I184-V188 PolarHBondContact O-N 3.36Å
185	L	59.4	Low	58.5	Low	106 Å²	106	109.9 Å²	109.9	56%	0.555	57%	0.574	S	S	*	*	H	α-helix	trans	-63.3	-37.2	175.8	-95.5	155.6	0	0	0	111.9	L181 V188 R189	L181-L185 HydrophobicContact CG-CD1 4.43Å; L181-L185 PolarHBondContact O-N 3.44Å; L185-V188 PolarHBondContact O-N 3.4Å; L185-R189 WeakPolarHBondContact O-CB 3.48Å; L185-R189 PolarHBondContact O-N 3.35Å
186	E	65.8	Low	59.1	Low	67 Å²	67	108.5 Å²	108.5	31%	0.313	56%	0.562	S	S	.	*	H	α-helix	trans	-68.9	-35.2	178	-169.3	57.8	-160.2	0	0	112.7	D182 E183 I184 R189 K190	D182-E186 VanDerWaalsContact O-CB 3.3Å; D182-E186 WeakPolarHBondContact O-CB 3.48Å; D182-E186 PolarHBondContact O-N 3.29Å; D182-E186 VanDerWaalsContact O-N 3.1Å; E183-E186 PolarHBondContact O-N 3.49Å; I184-E186 VanDerWaalsContact C-N 3.29Å; I184-E186 PolarHBondContact O-N 3.26Å; E186-R189 IonicContact OE1-CZ 3.25Å; E186-R189 IonicContact OE1-NE 3.88Å; E186-R189 IonicContact OE1-NH2 3.92Å; E186-R189 PolarHBondContact OE1-NH2 3Å; E186-R189 IonicContact OE2-CZ 2.67Å; E186-R189 IonicContact OE2-NE 3.19Å; E186-R189 PolarHBondContact OE2-NE 2.94Å; E186-R189 IonicContact OE2-NH1 3.09Å; E186-R189 IonicContact OE2-NH2 3.74Å; E186-R189 PolarHBondContact OE2-NH2 3.12Å; E186-K190 WeakPolarHBondContact O-CG 3.18Å; E186-K190 PolarHBondContact O-N 3.25Å; E186-K190 VanDerWaalsContact O-N 3.13Å
187	D	65.3	Low	59.4	Low	100 Å²	100	105.7 Å²	105.7	54%	0.535	55%	0.552	S	S	.	*	H	α-helix	trans	-73.1	-35.5	174.9	-85.8	-8.7	0	0	0	112.6	E183 I184 K190 A191	E183-D187 PolarHBondContact O-N 2.94Å; I184-D187 PolarHBondContact O-N 2.92Å; D187-K190 PolarHBondContact O-N 2.69Å; D187-A191 PolarHBondContact O-N 2.95Å; D187-A191 VanDerWaalsContact O-N 3.13Å
188	V	65.9	Low	59.4	Low	92 Å²	92	108.5 Å²	108.5	56%	0.558	55%	0.554	S	S	*	*	H	α-helix	trans	-65.9	-40.9	173.2	172.2	0	0	0	0	110.7	I184 L185 A191 A192	I184-V188 WeakPolarHBondContact O-CG2 3.31Å; I184-V188 PolarHBondContact O-N 3.36Å; L185-V188 PolarHBondContact O-N 3.4Å; V188-A191 PolarHBondContact O-N 3.32Å; V188-A191 VanDerWaalsContact O-N 3.14Å; V188-A192 PolarHBondContact O-N 2.73Å
189	R	69.1	Low	59.4	Low	142 Å²	142	108.4 Å²	108.4	54%	0.536	55%	0.552	S	S	.	*	H	α-helix	trans	-59.4	-47.8	175.1	-169.5	173.4	70.6	167.5	3.7	111.7	L185 E186 A191 A192 D193	L185-R189 WeakPolarHBondContact O-CB 3.48Å; L185-R189 PolarHBondContact O-N 3.35Å; E186-R189 IonicContact OE1-CZ 3.25Å; E186-R189 IonicContact OE1-NE 3.88Å; E186-R189 IonicContact OE1-NH2 3.92Å; E186-R189 PolarHBondContact OE1-NH2 3Å; E186-R189 IonicContact OE2-CZ 2.67Å; E186-R189 IonicContact OE2-NE 3.19Å; E186-R189 PolarHBondContact OE2-NE 2.94Å; E186-R189 IonicContact OE2-NH1 3.09Å; E186-R189 IonicContact OE2-NH2 3.74Å; E186-R189 PolarHBondContact OE2-NH2 3.12Å; R189-A191 PolarHBondContact O-N 3.37Å; R189-A192 PolarHBondContact O-N 3.43Å; R189-D193 VanDerWaalsContact O-CG 3.31Å; R189-D193 PolarHBondContact O-N 2.94Å
190	K	68.4	Low	59.2	Low	97 Å²	97	111.7 Å²	111.7	42%	0.422	56%	0.557	S	S	.	*	H	α-helix	trans	-65.7	-18.9	176	-75.7	175.9	-175.1	161.3	0	114.9	E186 D187 R194	E186-K190 WeakPolarHBondContact O-CG 3.18Å; E186-K190 PolarHBondContact O-N 3.25Å; E186-K190 VanDerWaalsContact O-N 3.13Å; D187-K190 PolarHBondContact O-N 2.69Å; K190-R194 PolarHBondContact O-NE 3.17Å; K190-R194 VanDerWaalsContact O-NE 3.11Å
191	A	64.6	Low	59	Low	56 Å²	56	113.4 Å²	113.4	46%	0.463	56%	0.562	S	S	.	*	H	α-helix	trans	-84.8	-36.4	174.7	0	0	0	0	0	111.3	D187 V188 R189 L195	D187-A191 PolarHBondContact O-N 2.95Å; D187-A191 VanDerWaalsContact O-N 3.13Å; V188-A191 PolarHBondContact O-N 3.32Å; V188-A191 VanDerWaalsContact O-N 3.14Å; R189-A191 PolarHBondContact O-N 3.37Å; A191-L195 PolarHBondContact O-N 3.37Å
192	A	58.2	Low	58.6	Low	54 Å²	54	116.8 Å²	116.8	45%	0.446	58%	0.575	S	S	.	*	H	α-helix	trans	-64.7	-47.3	173.1	0	0	0	0	0	111.4	V188 R189 R194 L195 E196	V188-A192 PolarHBondContact O-N 2.73Å; R189-A192 PolarHBondContact O-N 3.43Å; A192-R194 PolarHBondContact O-N 3.31Å; A192-L195 WeakPolarHBondContact O-CB 3.5Å; A192-L195 PolarHBondContact O-N 2.63Å; A192-E196 PolarHBondContact O-N 3.09Å
193	D	64.9	Low	58.2	Low	85 Å²	85	114.9 Å²	114.9	46%	0.455	58%	0.576	S	S	.	*	H	α-helix	trans	-59	-36.5	178.9	-63.5	-12.9	0	0	0	112.1	R189 E197	R189-D193 VanDerWaalsContact O-CG 3.31Å; R189-D193 PolarHBondContact O-N 2.94Å; D193-E197 WeakPolarHBondContact O-CB 3.35Å; D193-E197 PolarHBondContact O-N 3.22Å; D193-E197 VanDerWaalsContact O-N 3.1Å
194	R	69.6	Low	57.5	Low	167 Å²	167	117.9 Å²	117.9	63%	0.63	59%	0.587	S	S	*	*	H	α-helix	trans	-72.5	-31.7	176.5	-87.6	-173.7	-84.3	-154.4	-2.3	113.7	K190 A192 E198	K190-R194 PolarHBondContact O-NE 3.17Å; K190-R194 VanDerWaalsContact O-NE 3.11Å; A192-R194 PolarHBondContact O-N 3.31Å; R194-E198 WeakPolarHBondContact O-CB 3.39Å; R194-E198 PolarHBondContact O-N 3.08Å
195	L	56.4	Low	56.7	Low	102 Å²	102	120.1 Å²	120.1	53%	0.534	60%	0.6	S	S	.	*	H	α-helix	trans	-72.8	-35.4	176.6	-171.6	71.8	0	0	0	110.7	A191 A192 E198 I199	A191-L195 PolarHBondContact O-N 3.37Å; A192-L195 WeakPolarHBondContact O-CB 3.5Å; A192-L195 PolarHBondContact O-N 2.63Å; L195-E198 PolarHBondContact O-N 3.41Å; L195-I199 HydrophobicContact CG-CD1 4Å; L195-I199 WeakPolarHBondContact O-CD1 3.49Å; L195-I199 WeakPolarHBondContact O-CG1 3.35Å; L195-I199 PolarHBondContact O-N 3.44Å; L195-I199 VanDerWaalsContact O-N 3.14Å
196	E	54.2	Low	55.8	Low	125 Å²	125	122.4 Å²	122.4	58%	0.584	61%	0.613	S	S	*	*	H	α-helix	trans	-67.1	-43.7	175.7	-163.1	164.2	-153.3	0	0	111.3	A192 E198 I199 E200	A192-E196 PolarHBondContact O-N 3.09Å; E196-E198 VanDerWaalsContact C-N 3.25Å; E196-E198 PolarHBondContact O-N 2.88Å; E196-I199 PolarHBondContact O-N 3.06Å; E196-E200 PolarHBondContact O-N 3.02Å; E196-E200 VanDerWaalsContact O-N 3.16Å
197	E	56.5	Low	54.8	Low	152 Å²	152	125.6 Å²	125.6	71%	0.71	63%	0.632	S	S	*	*	H	α-helix	trans	-63.3	-29.1	174.6	-158.8	172.7	-157.7	0	0	112.6	D193	D193-E197 WeakPolarHBondContact O-CB 3.35Å; D193-E197 PolarHBondContact O-N 3.22Å; D193-E197 VanDerWaalsContact O-N 3.1Å
198	E	51.2	Low	53.6	Low	165 Å²	165	130.8 Å²	130.8	77%	0.771	65%	0.65	S	S	*	*	H	α-helix	trans	-84.3	-18.4	178.2	-151.9	171.9	-148.3	0	0	113.1	R194 L195 E196	R194-E198 WeakPolarHBondContact O-CB 3.39Å; R194-E198 PolarHBondContact O-N 3.08Å; L195-E198 PolarHBondContact O-N 3.41Å; E196-E198 VanDerWaalsContact C-N 3.25Å; E196-E198 PolarHBondContact O-N 2.88Å
199	I	51.1	Low	52.4	Low	113 Å²	113	131.5 Å²	131.5	58%	0.579	66%	0.659	S	S	*	*	H	α-helix	trans	-91.6	-27.7	179.1	-71.6	169.8	0	0	0	112	L195 E196 E201	L195-I199 HydrophobicContact CG-CD1 4Å; L195-I199 WeakPolarHBondContact O-CD1 3.49Å; L195-I199 WeakPolarHBondContact O-CG1 3.35Å; L195-I199 PolarHBondContact O-N 3.44Å; L195-I199 VanDerWaalsContact O-N 3.14Å; E196-I199 PolarHBondContact O-N 3.06Å; I199-E201 PolarHBondContact O-N 3.14Å
200	E	45	Very low	51.1	Low	169 Å²	169	129.4 Å²	129.4	79%	0.79	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-18.8	-174.5	-92.9	-164.6	143.1	0	0	115.5	E196	E196-E200 PolarHBondContact O-N 3.02Å; E196-E200 VanDerWaalsContact O-N 3.16Å
201	E	46.8	Very low	49.6	Very low	151 Å²	151	136.8 Å²	136.8	71%	0.706	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-18.2	-167.5	-127.5	-178.6	180	0	0	116.5	I199	I199-E201 PolarHBondContact O-N 3.14Å
202	H	43.7	Very low	48.5	Very low	162 Å²	162	137.8 Å²	137.8	75%	0.75	70%	0.703	S	S	*	*	S	Bend	trans	-140.9	10.4	-167.1	-70.7	-33.3	0	0	0	119.3
203	A	47.3	Very low	47.5	Very low	77 Å²	77	139.2 Å²	139.2	64%	0.636	71%	0.706	S	S	*	*	S	Bend	trans	-86.9	-27.1	-177.5	0	0	0	0	0	115.1
204	F	42.8	Very low	46	Very low	193 Å²	193	142.6 Å²	142.6	85%	0.846	72%	0.724	S	S	*	*	S	Bend	trans	-109.8	-18.6	-166.3	-82.1	-81.1	0	0	0	116.3
205	D	45.5	Very low	44.5	Very low	148 Å²	148	143 Å²	143	79%	0.791	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-82.2	-17.2	-172.4	-89.2	-22.3	0	0	0	115.1	N207	D205-N207 VanDerWaalsContact C-N 3.34Å; D205-N207 PolarHBondContact O-N 3.21Å
206	D	40.5	Very low	43.6	Very low	154 Å²	154	145.5 Å²	145.5	82%	0.824	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-84.1	-0.5	-175.4	-102.1	-5.8	0	0	0	115.1	K208	D206-K208 PolarHBondContact O-N 3.01Å
207	N	44	Very low	43	Very low	134 Å²	134	142.8 Å²	142.8	72%	0.717	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-95.1	14.4	-170.2	-123.8	-9.2	0	0	0	115.8	D205 S209	D205-N207 VanDerWaalsContact C-N 3.34Å; D205-N207 PolarHBondContact O-N 3.21Å; N207-S209 PolarHBondContact O-N 2.94Å
208	K	39.3	Very low	42.2	Very low	209 Å²	209	139.7 Å²	139.7	91%	0.909	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	12.9	-175	-129.8	172.3	-169.5	165.6	0	115.8	D206	D206-K208 PolarHBondContact O-N 3.01Å
209	S	42.5	Very low	41.6	Very low	107 Å²	107	137.5 Å²	137.5	75%	0.748	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.6	5.1	-172.1	68.3	0	0	0	0	117.3	N207	N207-S209 PolarHBondContact O-N 2.94Å
210	V	41.8	Very low	41.2	Very low	97 Å²	97	137.9 Å²	137.9	59%	0.588	72%	0.717	S	S	*	*			trans	-101.4	99.3	177.3	-172.4	0	0	0	0	111.3
211	R	35.4	Very low	41.3	Very low	252 Å²	252	132.7 Å²	132.7	95%	0.951	70%	0.697	S	S	*	*			trans	-79	123.9	166.5	-86.6	-174.7	177	-175.1	-0.3	110.2
212	G	42.6	Very low	41.2	Very low	78 Å²	78	130.8 Å²	130.8	80%	0.804	69%	0.688	S	S	*	*	S	Bend	trans	125.3	11.8	159.9	0	0	0	0	0	117.7
213	V	36	Very low	41.1	Very low	83 Å²	83	131.2 Å²	131.2	50%	0.503	69%	0.69	S	S	.	*			trans	-130.4	118	176.8	-174.4	0	0	0	0	109.1	F215	V213-F215 HydrophobicContact CB-CD2 4.25Å; V213-F215 HydrophobicContact CB-CE2 3.76Å; V213-F215 HydrophobicContact CB-CZ 4.19Å; V213-F215 HydrophobicContact CG1-CD1 4.44Å; V213-F215 HydrophobicContact CG1-CD2 3.99Å; V213-F215 HydrophobicContact CG1-CE1 4.13Å; V213-F215 HydrophobicContact CG1-CE2 3.65Å; V213-F215 HydrophobicContact CG1-CG 4.38Å; V213-F215 HydrophobicContact CG1-CZ 3.73Å; V213-F215 PolarHBondContact O-N 3Å
214	N	33.7	Very low	40.6	Very low	156 Å²	156	134.1 Å²	134.1	83%	0.834	70%	0.695	S	S	*	*			trans	-78.7	111.8	166.3	-77	-7.1	0	0	0	107.2
215	F	38.1	Very low	40.4	Very low	176 Å²	176	134.1 Å²	134.1	77%	0.772	70%	0.698	S	S	*	*			trans	-87.7	116.3	169.8	-70.8	-85.7	0	0	0	108.1	V213	V213-F215 HydrophobicContact CB-CD2 4.25Å; V213-F215 HydrophobicContact CB-CE2 3.76Å; V213-F215 HydrophobicContact CB-CZ 4.19Å; V213-F215 HydrophobicContact CG1-CD1 4.44Å; V213-F215 HydrophobicContact CG1-CD2 3.99Å; V213-F215 HydrophobicContact CG1-CE1 4.13Å; V213-F215 HydrophobicContact CG1-CE2 3.65Å; V213-F215 HydrophobicContact CG1-CG 4.38Å; V213-F215 HydrophobicContact CG1-CZ 3.73Å; V213-F215 PolarHBondContact O-N 3Å
216	E	37.6	Very low	40	Very low	155 Å²	155	131 Å²	131	72%	0.724	69%	0.692	S	S	*	*			trans	-92.5	111.3	170.4	-70	174.7	177.3	0	0	107.5
217	A	42.5	Very low	39.7	Very low	67 Å²	67	131.5 Å²	131.5	55%	0.554	70%	0.695	S	S	*	*			trans	-125.3	134.9	173.9	0	0	0	0	0	108.7
218	V	39.3	Very low	39.2	Very low	87 Å²	87	129 Å²	129	53%	0.527	69%	0.688	S	S	.	*			trans	-95.6	119.1	174.2	-178.3	0	0	0	0	107.3	L246 I247	V218-L246 HydrophobicContact CG1-CB 3.96Å; V218-L246 HydrophobicContact CG1-CD2 3.98Å; V218-L246 HydrophobicContact CG1-CG 4.42Å; V218-I247 WeakPolarHBondContact CA-O 3.3Å
219	L	38.3	Very low	39.1	Very low	120 Å²	120	129.3 Å²	129.3	63%	0.628	69%	0.689	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.6	125.9	178.6	-82.6	144.2	0	0	0	109.2	I247	L219-I247 PolarHBondContact N-O 3.01Å; L219-I247 VanDerWaalsContact N-O 3.16Å; L219-I247 PolarHBondContact O-N 3.36Å
220	R	42.8	Very low	38.7	Very low	120 Å²	120	134.2 Å²	134.2	45%	0.453	69%	0.692	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.7	113.7	165.6	177.3	176.5	172.7	174	-7	106.6	E222 L246	R220-E222 HydrophobicContact CG-CG 4.4Å; R220-E222 IonicContact CZ-OE1 2.89Å; R220-E222 IonicContact NE-OE1 3.28Å; R220-E222 PolarHBondContact NE-OE1 2.89Å; R220-E222 IonicContact NH2-OE1 3.61Å; R220-E222 PolarHBondContact NH2-OE1 2.76Å; R220-L246 HydrophobicContact CB-CD2 4.29Å
221	V	46.7	Very low	38.2	Very low	61 Å²	61	135.8 Å²	135.8	37%	0.37	70%	0.697	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.7	115.4	175.7	-177.7	0	0	0	0	107.6	M245 I247	V221-M245 PolarHBondContact N-O 3.41Å; V221-M245 VanDerWaalsContact N-O 3.09Å; V221-I247 HydrophobicContact CG2-CD1 3.92Å; V221-I247 HydrophobicContact CG2-CG1 4.42Å
222	E	44.9	Very low	38.2	Very low	110 Å²	110	127.9 Å²	127.9	51%	0.514	69%	0.685	S	S	.	*			trans	-103.6	122.5	162.9	-65.1	-175.5	164.9	0	0	105.6	R220 D224	R220-E222 HydrophobicContact CG-CG 4.4Å; R220-E222 IonicContact CZ-OE1 2.89Å; R220-E222 IonicContact NE-OE1 3.28Å; R220-E222 PolarHBondContact NE-OE1 2.89Å; R220-E222 IonicContact NH2-OE1 3.61Å; R220-E222 PolarHBondContact NH2-OE1 2.76Å; E222-D224 PolarHBondContact O-N 3.42Å; E222-D224 VanDerWaalsContact O-N 3.15Å
223	E	41.3	Very low	37.6	Very low	172 Å²	172	130 Å²	130	80%	0.804	69%	0.687	S	S	*	*			trans	-78.8	96.4	176.7	-74.7	-169.5	163.7	0	0	108.2
224	D	37	Very low	37.7	Very low	137 Å²	137	135.7 Å²	135.7	73%	0.733	71%	0.706	S	S	*	*			trans	-77.7	134.8	171.8	-70.6	-35.8	0	0	0	110.6	E222 A226	E222-D224 PolarHBondContact O-N 3.42Å; E222-D224 VanDerWaalsContact O-N 3.15Å; D224-A226 PolarHBondContact O-N 3.44Å
225	E	37.8	Very low	37.7	Very low	193 Å²	193	136 Å²	136	90%	0.902	70%	0.695	S	S	*	*	S	Bend	trans	-57.5	2.3	-172.3	-72.6	-172.5	138.3	0	0	116.5	N227	E225-N227 PolarHBondContact O-N 3.29Å
226	A	37.7	Very low	37.4	Very low	82 Å²	82	135.6 Å²	135.6	68%	0.678	70%	0.696	S	S	*	*			trans	-97.3	33.4	-162.2	0	0	0	0	0	115.1	D224	D224-A226 PolarHBondContact O-N 3.44Å
227	N	35.7	Very low	37.4	Very low	166 Å²	166	134.6 Å²	134.6	89%	0.888	70%	0.7	S	S	*	*	S	Bend	trans	-169.2	72.2	160.8	-102.4	-31	0	0	0	115.6	E225	E225-N227 PolarHBondContact O-N 3.29Å
228	S	31.8	Very low	37.3	Very low	82 Å²	82	138.8 Å²	138.8	57%	0.573	71%	0.708	S	S	*	*			trans	-163	70.7	151.8	-151	0	0	0	0	114.6	R230	S228-R230 PolarHBondContact O-N 2.88Å
229	K	36.9	Very low	37.2	Very low	214 Å²	214	140 Å²	140	93%	0.93	71%	0.712	S	S	*	*			trans	-74.2	65.8	154.1	-81.9	-176.1	-179.6	170.9	0	110
230	R	34.3	Very low	37.3	Very low	210 Å²	210	142 Å²	142	79%	0.792	72%	0.723	S	S	*	*	S	Bend	trans	-174.7	84.5	159.8	-107.6	168.5	-175	-174.4	2.7	108.6	S228	S228-R230 PolarHBondContact O-N 2.88Å
231	N	31.6	Very low	37.5	Very low	131 Å²	131	139.1 Å²	139.1	70%	0.701	72%	0.716	S	S	*	*			trans	155.6	59.3	145.2	-73.3	-20.4	0	0	0	110	S233	N231-S233 PolarHBondContact O-N 3.16Å
232	A	35.3	Very low	37.4	Very low	86 Å²	86	139.3 Å²	139.3	71%	0.711	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	105.5	171.4	0	0	0	0	0	109.3
233	S	31.4	Very low	37.6	Very low	121 Å²	121	137.6 Å²	137.6	85%	0.846	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	178.7	4.7	151.7	44.5	0	0	0	0	113.5	N231	N231-S233 PolarHBondContact O-N 3.16Å
234	K	37.2	Very low	38.1	Very low	204 Å²	204	130 Å²	130	89%	0.887	69%	0.69	S	S	*	*	S	Bend	trans	-144.9	12.7	176.9	-126.5	178.3	-175.6	-177.6	0	116.9
235	R	34.6	Very low	38.8	Very low	161 Å²	161	126.6 Å²	126.6	61%	0.608	67%	0.67	S	S	*	*			trans	-119.7	-8.5	-172.7	-79.8	-179.4	173.9	171.9	-6.5	115.9	V237 E238	R235-V237 PolarHBondContact O-N 2.87Å; R235-E238 PolarHBondContact O-N 3.45Å
236	E	29.9	Very low	39.5	Very low	168 Å²	168	119.5 Å²	119.5	79%	0.785	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	18.2	-175.6	-66.5	176.4	171.6	0	0	115
237	V	38.9	Very low	40.2	Very low	135 Å²	135	117.2 Å²	117.2	82%	0.818	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.7	-8.2	178.4	-168.3	0	0	0	0	112.5	R235	R235-V237 PolarHBondContact O-N 2.87Å
238	E	39.8	Very low	41	Very low	155 Å²	155	111.3 Å²	111.3	72%	0.724	58%	0.583	S	S	*	*	S	Bend	trans	-90.6	-17.6	178.1	-82.6	177.3	147.9	0	0	113.8	R235 D240	R235-E238 PolarHBondContact O-N 3.45Å; E238-D240 PolarHBondContact O-N 3.49Å
239	D	38.1	Very low	41.9	Very low	113 Å²	113	110 Å²	110	60%	0.604	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-11.5	-165.9	-68	-23.8	0	0	0	116.1	L241	D239-L241 PolarHBondContact O-N 3.42Å
240	D	39.8	Very low	42.1	Very low	162 Å²	162	106.8 Å²	106.8	87%	0.866	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	8.1	-175.3	-154	31.2	0	0	0	114.3	E238	E238-D240 PolarHBondContact O-N 3.49Å
241	L	46.2	Very low	42.8	Very low	59 Å²	59	102.4 Å²	102.4	31%	0.309	55%	0.554	S	S	.	*	S	Bend	trans	-99.4	-2.5	-168.3	-107.6	111.3	0	0	0	116.9	D239 L243 I264	D239-L241 PolarHBondContact O-N 3.42Å; L241-L243 HydrophobicContact CB-CD1 4.12Å; L241-L243 HydrophobicContact CB-CG 4.11Å; L241-L243 HydrophobicContact CD2-CD1 3.96Å; L241-L243 HydrophobicContact CD2-CG 4.29Å; L241-L243 PolarHBondContact O-N 3.42Å; L241-I264 HydrophobicContact CD1-CD1 4.44Å; L241-I264 HydrophobicContact CD2-CD1 4.1Å; L241-I264 HydrophobicContact CD2-CG2 4.23Å; L241-I264 HydrophobicContact CG-CD1 4.15Å
242	G	45.3	Very low	43.6	Very low	64 Å²	64	99.3 Å²	99.3	66%	0.66	54%	0.538	S	S	*	.			trans	50	34.1	172.9	0	0	0	0	0	114.3	S244	G242-S244 PolarHBondContact O-N 2.9Å
243	L	50	Low	44.6	Very low	75 Å²	75	100.8 Å²	100.8	39%	0.393	53%	0.53	S	S	.	.			trans	-85	105.3	-178.3	-71.2	172.3	0	0	0	108.5	L241 I255 T257	L241-L243 HydrophobicContact CB-CD1 4.12Å; L241-L243 HydrophobicContact CB-CG 4.11Å; L241-L243 HydrophobicContact CD2-CD1 3.96Å; L241-L243 HydrophobicContact CD2-CG 4.29Å; L241-L243 PolarHBondContact O-N 3.42Å; L243-I255 HydrophobicContact CB-CG2 4.31Å; L243-I255 HydrophobicContact CD2-CG2 3.7Å; L243-I255 HydrophobicContact CG-CG2 4.4Å; L243-T257 HydrophobicContact CD2-CG2 4.4Å
244	S	50.8	Low	45.6	Very low	12 Å²	12	100.6 Å²	100.6	8%	0.084	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	124.6	171.8	41.5	0	0	0	0	108.9	G242 L256	G242-S244 PolarHBondContact O-N 2.9Å; S244-L256 WeakPolarHBondContact O-CB 2.93Å; S244-L256 PolarHBondContact O-N 3.48Å; S244-L256 WeakPolarHBondContact OG-CB 3.48Å; S244-L256 PolarHBondContact OG-O 3.09Å
245	M	51.2	Low	46.5	Very low	65 Å²	65	95.7 Å²	95.7	32%	0.32	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	122.7	178.5	-165.7	-178.9	-58.3	0	0	109	V221 I247 Q253	V221-M245 PolarHBondContact N-O 3.41Å; V221-M245 VanDerWaalsContact N-O 3.09Å; M245-I247 HydrophobicContact CG-CG1 4.44Å; M245-Q253 HydrophobicContact CG-CB 4.26Å; M245-Q253 HydrophobicContact SD-CB 4.02Å; M245-Q253 HydrophobicContact SD-CG 3.92Å
246	L	52.5	Low	47.3	Very low	44 Å²	44	91.9 Å²	91.9	23%	0.23	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	133	167.7	-64.3	174.5	0	0	0	108.7	V218 R220 Q253 Y254 L256	V218-L246 HydrophobicContact CG1-CB 3.96Å; V218-L246 HydrophobicContact CG1-CD2 3.98Å; V218-L246 HydrophobicContact CG1-CG 4.42Å; R220-L246 HydrophobicContact CB-CD2 4.29Å; L246-Q253 CarbonylContact O-C 3.57Å; L246-Q253 WeakPolarHBondContact O-CA 3.31Å; L246-Y254 PolarHBondContact N-O 3Å; L246-Y254 PolarHBondContact O-N 3.03Å; L246-L256 HydrophobicContact CD1-CD1 3.57Å; L246-L256 HydrophobicContact CD1-CD2 3.77Å; L246-L256 HydrophobicContact CD1-CG 3.59Å; L246-L256 HydrophobicContact CD2-CD1 3.9Å; L246-L256 HydrophobicContact CG-CD1 3.54Å; L246-L256 HydrophobicContact CG-CD2 4.48Å; L246-L256 HydrophobicContact CG-CG 3.75Å
247	I	52.9	Low	48.3	Very low	35 Å²	35	87.4 Å²	87.4	18%	0.179	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	116.4	172.6	-52.5	-176.6	0	0	0	107.4	V218 L219 V221 M245 N251 N252 Q253	V218-I247 WeakPolarHBondContact CA-O 3.3Å; L219-I247 PolarHBondContact N-O 3.01Å; L219-I247 VanDerWaalsContact N-O 3.16Å; L219-I247 PolarHBondContact O-N 3.36Å; V221-I247 HydrophobicContact CG2-CD1 3.92Å; V221-I247 HydrophobicContact CG2-CG1 4.42Å; M245-I247 HydrophobicContact CG-CG1 4.44Å; I247-N251 WeakPolarHBondContact CG2-OD1 3.26Å; I247-N252 WeakPolarHBondContact CA-O 3.31Å; I247-Q253 HydrophobicContact CG1-CG 4.26Å
248	D	53	Low	48.9	Very low	41 Å²	41	87 Å²	87	22%	0.219	46%	0.457	C	S	.	.			trans	-76.8	163.7	174.1	177	26.1	0	0	0	111	Q250 N251 N252 Y254	D248-Q250 PolarHBondContact O-N 3Å; D248-N251 WeakPolarHBondContact O-CA 3.17Å; D248-N251 PolarHBondContact O-N 3.27Å; D248-N252 HydrophobicContact CB-CB 4.32Å; D248-N252 PolarHBondContact N-O 2.69Å; D248-Y254 HydrophobicContact CB-CD2 4.33Å; D248-Y254 HydrophobicContact CB-CE2 3.61Å
249	S	49.2	Very low	49.3	Very low	56 Å²	56	85.5 Å²	85.5	39%	0.392	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.7	-28.3	174.1	61.2	0	0	0	0	115.4	N251	S249-N251 VanDerWaalsContact C-N 3.29Å
250	Q	42.3	Very low	49.9	Very low	146 Å²	146	91 Å²	91	68%	0.682	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	10.3	175.8	-62.2	-172.4	-2.3	0	0	113.7	D248 N252	D248-Q250 PolarHBondContact O-N 3Å; Q250-N252 PolarHBondContact O-N 3.29Å
251	N	47.9	Very low	50.3	Low	117 Å²	117	87.4 Å²	87.4	63%	0.626	45%	0.454	S	S	*	.			trans	61.2	25	-171.6	-151.3	32.6	0	0	0	113.3	I247 D248 S249	I247-N251 WeakPolarHBondContact CG2-OD1 3.26Å; D248-N251 WeakPolarHBondContact O-CA 3.17Å; D248-N251 PolarHBondContact O-N 3.27Å; S249-N251 VanDerWaalsContact C-N 3.29Å
252	N	50.1	Low	50.8	Low	66 Å²	66	90.5 Å²	90.5	35%	0.353	48%	0.481	S	S	.	.			trans	-77.3	124.2	172.7	-66	-30.7	0	0	0	108.3	I247 D248 Q250 Y254	I247-N252 WeakPolarHBondContact CA-O 3.31Å; D248-N252 HydrophobicContact CB-CB 4.32Å; D248-N252 PolarHBondContact N-O 2.69Å; Q250-N252 PolarHBondContact O-N 3.29Å; N252-Y254 HydrophobicContact CB-CD2 4.49Å; N252-Y254 HydrophobicContact CB-CE2 3.63Å; N252-Y254 WeakPolarHBondContact O-CD2 3.28Å; N252-Y254 WeakPolarHBondContact O-CE2 3.27Å
253	Q	54.4	Low	51.5	Low	118 Å²	118	92.6 Å²	92.6	55%	0.551	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	120.1	-179.7	-63.4	177.9	-12.1	0	0	109.3	M245 L246 I247	M245-Q253 HydrophobicContact CG-CB 4.26Å; M245-Q253 HydrophobicContact SD-CB 4.02Å; M245-Q253 HydrophobicContact SD-CG 3.92Å; L246-Q253 CarbonylContact O-C 3.57Å; L246-Q253 WeakPolarHBondContact O-CA 3.31Å; I247-Q253 HydrophobicContact CG1-CG 4.26Å
254	Y	53.4	Low	52.1	Low	117 Å²	117	92.5 Å²	92.5	46%	0.459	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	122.6	174	-54.6	-95	0	0	0	108.5	L246 D248 N252 L256	L246-Y254 PolarHBondContact N-O 3Å; L246-Y254 PolarHBondContact O-N 3.03Å; D248-Y254 HydrophobicContact CB-CD2 4.33Å; D248-Y254 HydrophobicContact CB-CE2 3.61Å; N252-Y254 HydrophobicContact CB-CD2 4.49Å; N252-Y254 HydrophobicContact CB-CE2 3.63Å; N252-Y254 WeakPolarHBondContact O-CD2 3.28Å; N252-Y254 WeakPolarHBondContact O-CE2 3.27Å; Y254-L256 PolarHBondContact O-N 2.89Å
255	I	57.2	Low	52.4	Low	100 Å²	100	97.6 Å²	97.6	51%	0.513	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	110.9	177.7	-61.4	169	0	0	0	107.4	L243 T257	L243-I255 HydrophobicContact CB-CG2 4.31Å; L243-I255 HydrophobicContact CD2-CG2 3.7Å; L243-I255 HydrophobicContact CG-CG2 4.4Å; I255-T257 HydrophobicContact CG2-CG2 4.24Å; I255-T257 PolarHBondContact O-N 3.35Å
256	L	50.3	Low	53	Low	81 Å²	81	100.3 Å²	100.3	42%	0.424	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	101	171.4	-71.7	175.4	0	0	0	108.5	S244 L246 Y254 K258	S244-L256 WeakPolarHBondContact O-CB 2.93Å; S244-L256 PolarHBondContact O-N 3.48Å; S244-L256 WeakPolarHBondContact OG-CB 3.48Å; S244-L256 PolarHBondContact OG-O 3.09Å; L246-L256 HydrophobicContact CD1-CD1 3.57Å; L246-L256 HydrophobicContact CD1-CD2 3.77Å; L246-L256 HydrophobicContact CD1-CG 3.59Å; L246-L256 HydrophobicContact CD2-CD1 3.9Å; L246-L256 HydrophobicContact CG-CD1 3.54Å; L246-L256 HydrophobicContact CG-CD2 4.48Å; L246-L256 HydrophobicContact CG-CG 3.75Å; Y254-L256 PolarHBondContact O-N 2.89Å; L256-K258 PolarHBondContact O-N 2.89Å
257	T	51.2	Low	53.9	Low	74 Å²	74	100.7 Å²	100.7	45%	0.454	53%	0.529	S	S	.	.			trans	-77.6	105.2	173.8	55.3	0	0	0	0	109.3	L243 I255 P259	L243-T257 HydrophobicContact CD2-CG2 4.4Å; I255-T257 HydrophobicContact CG2-CG2 4.24Å; I255-T257 PolarHBondContact O-N 3.35Å; T257-P259 WeakPolarHBondContact O-CD 3.34Å
258	K	52	Low	55.1	Low	127 Å²	127	102.2 Å²	102.2	55%	0.552	54%	0.537	S	S	*	.			trans	-64.6	121.8	156.4	-80.9	-178	177.8	173.1	0	107.1	L256 R260	L256-K258 PolarHBondContact O-N 2.89Å; K258-R260 VanDerWaalsContact C-N 3.26Å; K258-R260 PolarHBondContact O-N 3.33Å
259	P	47.2	Very low	56.5	Low	124 Å²	124	107.1 Å²	107.1	81%	0.805	56%	0.559	S	S	*	*			trans	-78.9	80.5	180	32.4	-31.2	0	0	0	108.3	T257	T257-P259 WeakPolarHBondContact O-CD 3.34Å
260	R	50.8	Low	58.2	Low	227 Å²	227	108.8 Å²	108.8	86%	0.857	56%	0.56	S	S	*	*	S	Bend	trans	-97	-22.2	168.9	-97.4	-173.4	176.2	150	0.6	113.4	K258	K258-R260 VanDerWaalsContact C-N 3.26Å; K258-R260 PolarHBondContact O-N 3.33Å
261	D	48.6	Very low	60.3	Low	88 Å²	88	104.4 Å²	104.4	47%	0.471	54%	0.539	S	S	.	.			trans	-154	123.6	178.2	-130.8	-40.4	0	0	0	112	T263	D261-T263 VanDerWaalsContact C-N 3.32Å; D261-T263 VanDerWaalsContact CG-OG1 3.3Å; D261-T263 PolarHBondContact OD1-OG1 3.05Å
262	S	56.4	Low	62.4	Low	124 Å²	124	103 Å²	103	87%	0.867	53%	0.53	S	S	*	.	S	Bend	trans	-89	-0.7	175.6	53.3	0	0	0	0	112.7
263	T	59.2	Low	64.3	Low	107 Å²	107	105.8 Å²	105.8	66%	0.656	54%	0.539	S	S	*	.			trans	-88	-14.3	-175.4	59.8	0	0	0	0	113.9	D261 P265	D261-T263 VanDerWaalsContact C-N 3.32Å; D261-T263 VanDerWaalsContact CG-OG1 3.3Å; D261-T263 PolarHBondContact OD1-OG1 3.05Å; T263-P265 WeakPolarHBondContact O-CD 3.2Å
264	I	63.1	Low	66.2	Low	73 Å²	73	100.3 Å²	100.3	37%	0.374	51%	0.514	S	S	.	.	S	Bend	trans	-87.7	114.4	177.2	-51.9	171.9	0	0	0	109.4	L241 R266	L241-I264 HydrophobicContact CD1-CD1 4.44Å; L241-I264 HydrophobicContact CD2-CD1 4.1Å; L241-I264 HydrophobicContact CD2-CG2 4.23Å; L241-I264 HydrophobicContact CG-CD1 4.15Å; I264-R266 PolarHBondContact O-N 3.23Å; I264-R266 VanDerWaalsContact O-N 3.12Å
265	P	58.3	Low	68	Low	120 Å²	120	96.2 Å²	96.2	78%	0.779	50%	0.499	S	S	*	.			trans	-67.4	112.5	177.6	26.9	-32.1	0	0	0	110	T263	T263-P265 WeakPolarHBondContact O-CD 3.2Å
266	R	62.3	Low	69.8	Low	121 Å²	121	95.3 Å²	95.3	46%	0.457	50%	0.498	S	S	.	.			trans	-84	119.6	173.8	-68.9	-167.5	166.4	94.6	0.9	109.6	I264	I264-R266 PolarHBondContact O-N 3.23Å; I264-R266 VanDerWaalsContact O-N 3.12Å
267	A	71.2	Confident	71.8	Confident	52 Å²	52	93 Å²	93	43%	0.43	49%	0.488	S	S	.	.			trans	-111.4	128.7	178.7	0	0	0	0	0	110.9	H269 I272	A267-H269 PolarHBondContact O-N 3.3Å; A267-H269 VanDerWaalsContact O-N 3.13Å; A267-H269 PolarHBondContact O-ND1 3.22Å; A267-H269 VanDerWaalsContact O-ND1 3.15Å; A267-I272 HydrophobicContact CB-CD1 3.95Å
268	D	79	Confident	73.9	Confident	67 Å²	67	89.6 Å²	89.6	36%	0.358	47%	0.467	S	S	.	.			trans	-77	95	167.5	-173.7	-16.7	0	0	0	108.8	H270 F271 I272 Q320	D268-H270 PolarHBondContact O-N 3.32Å; D268-H270 WeakPolarHBondContact OD1-CB 3.23Å; D268-H270 PolarHBondContact OD1-N 3.38Å; D268-F271 HydrophobicContact CB-CB 3.93Å; D268-F271 PolarHBondContact O-N 2.61Å; D268-F271 PolarHBondContact OD1-N 2.95Å; D268-F271 VanDerWaalsContact OD1-N 3.12Å; D268-I272 WeakPolarHBondContact O-CG1 3.28Å; D268-I272 PolarHBondContact O-N 2.95Å; D268-Q320 PolarHBondContact OD2-NE2 3.25Å; D268-Q320 VanDerWaalsContact OD2-NE2 3.09Å; D268-Q320 PolarHBondContact OD2-OE1 3.45Å
269	H	81.9	Confident	75.8	Confident	145 Å²	145	84.9 Å²	84.9	67%	0.671	45%	0.454	S	S	*	.	H	α-helix	trans	-62.2	-28.6	-179.2	-69.8	84.7	0	0	0	112.5	A267 K273	A267-H269 PolarHBondContact O-N 3.3Å; A267-H269 VanDerWaalsContact O-N 3.13Å; A267-H269 PolarHBondContact O-ND1 3.22Å; A267-H269 VanDerWaalsContact O-ND1 3.15Å; H269-K273 VanDerWaalsContact O-CB 3.27Å; H269-K273 WeakPolarHBondContact O-CB 3.47Å; H269-K273 PolarHBondContact O-N 3.24Å
270	H	84.8	Confident	78.1	Confident	90 Å²	90	85.7 Å²	85.7	42%	0.417	45%	0.449	S	S	.	.	H	α-helix	trans	-69.3	-47.9	176	-78.1	-63.6	0	0	0	110.7	D268 I272 K273 D274	D268-H270 PolarHBondContact O-N 3.32Å; D268-H270 WeakPolarHBondContact OD1-CB 3.23Å; D268-H270 PolarHBondContact OD1-N 3.38Å; H270-I272 PolarHBondContact O-N 2.85Å; H270-K273 PolarHBondContact O-N 2.85Å; H270-D274 WeakPolarHBondContact O-CB 3.5Å; H270-D274 PolarHBondContact O-N 2.98Å
271	F	87.9	Confident	80.2	Confident	54 Å²	54	77.4 Å²	77.4	24%	0.237	42%	0.421	C	S	.	.	H	α-helix	trans	-59.6	-45.4	176.3	-176.7	-121.8	0	0	0	112.4	D268 K273 D274 I275 Q320 V321 L324	D268-F271 HydrophobicContact CB-CB 3.93Å; D268-F271 PolarHBondContact O-N 2.61Å; D268-F271 PolarHBondContact OD1-N 2.95Å; D268-F271 VanDerWaalsContact OD1-N 3.12Å; F271-K273 VanDerWaalsContact C-N 3.34Å; F271-K273 PolarHBondContact O-N 3.32Å; F271-D274 PolarHBondContact O-N 3.15Å; F271-I275 HydrophobicContact CD2-CG1 4.27Å; F271-I275 HydrophobicContact CE1-CG1 4.28Å; F271-I275 HydrophobicContact CE2-CD1 3.87Å; F271-I275 HydrophobicContact CE2-CG1 3.83Å; F271-I275 HydrophobicContact CZ-CD1 4.06Å; F271-I275 HydrophobicContact CZ-CG1 3.85Å; F271-I275 WeakPolarHBondContact O-CG1 3.31Å; F271-I275 PolarHBondContact O-N 2.99Å; F271-Q320 HydrophobicContact CD2-CB 3.55Å; F271-Q320 HydrophobicContact CD2-CG 4.47Å; F271-Q320 HydrophobicContact CE2-CB 3.55Å; F271-Q320 HydrophobicContact CG-CB 4.41Å; F271-Q320 HydrophobicContact CZ-CB 4.39Å; F271-V321 HydrophobicContact CD2-CG2 4.4Å; F271-V321 HydrophobicContact CE2-CG2 4.16Å; F271-L324 HydrophobicContact CZ-CD2 4.09Å
272	I	90.5	Very high	82.3	Confident	87 Å²	87	73.3 Å²	73.3	45%	0.446	40%	0.4	S	S	.	.	H	α-helix	trans	-60.4	-46.5	178.2	-67.2	169.5	0	0	0	110.4	A267 D268 H270 D274 I275 V276	A267-I272 HydrophobicContact CB-CD1 3.95Å; D268-I272 WeakPolarHBondContact O-CG1 3.28Å; D268-I272 PolarHBondContact O-N 2.95Å; H270-I272 PolarHBondContact O-N 2.85Å; I272-D274 VanDerWaalsContact C-N 3.31Å; I272-D274 PolarHBondContact O-N 3.36Å; I272-I275 PolarHBondContact O-N 3.24Å; I272-V276 HydrophobicContact CG2-CG2 4.32Å; I272-V276 WeakPolarHBondContact O-CB 3.32Å; I272-V276 VanDerWaalsContact O-CG2 3.25Å; I272-V276 WeakPolarHBondContact O-CG2 3.1Å; I272-V276 PolarHBondContact O-N 2.85Å
273	K	91.6	Very high	84.1	Confident	126 Å²	126	73.3 Å²	73.3	55%	0.548	39%	0.389	S	S	.	.	H	α-helix	trans	-60.7	-41	177.3	-174.9	-179	178.1	-176.5	0	111.7	H269 H270 F271 V276 T277	H269-K273 VanDerWaalsContact O-CB 3.27Å; H269-K273 WeakPolarHBondContact O-CB 3.47Å; H269-K273 PolarHBondContact O-N 3.24Å; H270-K273 PolarHBondContact O-N 2.85Å; F271-K273 VanDerWaalsContact C-N 3.34Å; F271-K273 PolarHBondContact O-N 3.32Å; K273-V276 PolarHBondContact O-N 3.36Å; K273-T277 HydrophobicContact CG-CG2 4.31Å; K273-T277 WeakPolarHBondContact O-CB 3.5Å; K273-T277 VanDerWaalsContact O-CG2 3.3Å; K273-T277 WeakPolarHBondContact O-CG2 3.09Å; K273-T277 PolarHBondContact O-N 2.95Å; K273-T277 PolarHBondContact O-OG1 3.32Å
274	D	92.7	Very high	85.8	Confident	2 Å²	2	71.1 Å²	71.1	1%	0.011	38%	0.377	C	S	.	.	H	α-helix	trans	-62.5	-46.9	179.1	-73.9	-1.6	0	0	0	111.1	H270 F271 I272 V276 T277 I278 I315 K316 S317 V321	H270-D274 WeakPolarHBondContact O-CB 3.5Å; H270-D274 PolarHBondContact O-N 2.98Å; F271-D274 PolarHBondContact O-N 3.15Å; I272-D274 VanDerWaalsContact C-N 3.31Å; I272-D274 PolarHBondContact O-N 3.36Å; D274-V276 PolarHBondContact O-N 3.42Å; D274-T277 PolarHBondContact O-N 3.3Å; D274-T277 PolarHBondContact O-OG1 2.91Å; D274-I278 WeakPolarHBondContact O-CB 3.46Å; D274-I278 VanDerWaalsContact O-CG1 3.27Å; D274-I278 WeakPolarHBondContact O-CG1 3.36Å; D274-I278 PolarHBondContact O-N 3.44Å; D274-I315 HydrophobicContact CB-CD1 3.68Å; D274-I315 HydrophobicContact CB-CG2 4.25Å; D274-I315 WeakPolarHBondContact OD2-CG2 3.28Å; D274-K316 PolarHBondContact OD2-N 3.43Å; D274-S317 WeakPolarHBondContact OD2-CB 3.35Å; D274-S317 PolarHBondContact OD2-N 3.25Å; D274-V321 HydrophobicContact CB-CG2 4.18Å
275	I	92.4	Very high	87.3	Confident	31 Å²	31	68.2 Å²	68.2	16%	0.159	36%	0.363	C	S	.	.	H	α-helix	trans	-64.5	-42.7	176.4	-62	-56.3	0	0	0	112	F271 I272 I278 G279 V321 L324 I559	F271-I275 HydrophobicContact CD2-CG1 4.27Å; F271-I275 HydrophobicContact CE1-CG1 4.28Å; F271-I275 HydrophobicContact CE2-CD1 3.87Å; F271-I275 HydrophobicContact CE2-CG1 3.83Å; F271-I275 HydrophobicContact CZ-CD1 4.06Å; F271-I275 HydrophobicContact CZ-CG1 3.85Å; F271-I275 WeakPolarHBondContact O-CG1 3.31Å; F271-I275 PolarHBondContact O-N 2.99Å; I272-I275 PolarHBondContact O-N 3.24Å; I275-I278 PolarHBondContact O-N 2.61Å; I275-G279 PolarHBondContact O-N 3.49Å; I275-V321 HydrophobicContact CD1-CG2 4.08Å; I275-L324 HydrophobicContact CD1-CD2 3.71Å; I275-L324 HydrophobicContact CG1-CD2 4.33Å; I275-I559 HydrophobicContact CD1-CD1 4.48Å; I275-I559 HydrophobicContact CD1-CG2 4.36Å
276	V	93.8	Very high	88.9	Confident	81 Å²	81	62.8 Å²	62.8	49%	0.491	33%	0.328	S	S	.	.	H	α-helix	trans	-63.3	-44.7	178.3	170.7	0	0	0	0	111	I272 K273 D274 G279 M280	I272-V276 HydrophobicContact CG2-CG2 4.32Å; I272-V276 WeakPolarHBondContact O-CB 3.32Å; I272-V276 VanDerWaalsContact O-CG2 3.25Å; I272-V276 WeakPolarHBondContact O-CG2 3.1Å; I272-V276 PolarHBondContact O-N 2.85Å; K273-V276 PolarHBondContact O-N 3.36Å; D274-V276 PolarHBondContact O-N 3.42Å; V276-G279 PolarHBondContact O-N 3.33Å; V276-M280 HydrophobicContact CG1-CG 4.27Å; V276-M280 WeakPolarHBondContact O-CB 3.41Å; V276-M280 VanDerWaalsContact O-CG 3.28Å; V276-M280 WeakPolarHBondContact O-CG 3.49Å; V276-M280 PolarHBondContact O-N 3.27Å
277	T	93.5	Very high	90.4	Very high	34 Å²	34	65.5 Å²	65.5	21%	0.209	34%	0.339	C	S	.	.	H	α-helix	trans	-65.7	-40.8	178.8	52.8	0	0	0	0	112.2	K273 D274 M280 L281	K273-T277 HydrophobicContact CG-CG2 4.31Å; K273-T277 WeakPolarHBondContact O-CB 3.5Å; K273-T277 VanDerWaalsContact O-CG2 3.3Å; K273-T277 WeakPolarHBondContact O-CG2 3.09Å; K273-T277 PolarHBondContact O-N 2.95Å; K273-T277 PolarHBondContact O-OG1 3.32Å; D274-T277 PolarHBondContact O-N 3.3Å; D274-T277 PolarHBondContact O-OG1 2.91Å; T277-M280 PolarHBondContact O-N 2.88Å; T277-L281 WeakPolarHBondContact O-CB 3.36Å; T277-L281 PolarHBondContact O-N 3.38Å
278	I	94.4	Very high	91.5	Very high	2 Å²	2	68 Å²	68	1%	0.01	34%	0.344	C	S	.	.	H	α-helix	trans	-59	-49.7	172.7	-70.9	167.5	0	0	0	110.3	D274 I275 M280 S282 L307 I315 V321 I558 A562	D274-I278 WeakPolarHBondContact O-CB 3.46Å; D274-I278 VanDerWaalsContact O-CG1 3.27Å; D274-I278 WeakPolarHBondContact O-CG1 3.36Å; D274-I278 PolarHBondContact O-N 3.44Å; I275-I278 PolarHBondContact O-N 2.61Å; I278-M280 PolarHBondContact O-N 2.97Å; I278-S282 WeakPolarHBondContact O-CB 3.44Å; I278-S282 PolarHBondContact O-N 2.94Å; I278-S282 PolarHBondContact O-OG 3.28Å; I278-L307 HydrophobicContact CB-CD1 4.47Å; I278-L307 HydrophobicContact CG1-CD1 3.88Å; I278-I315 HydrophobicContact CD1-CD1 3.97Å; I278-I315 HydrophobicContact CG1-CD1 3.87Å; I278-V321 HydrophobicContact CD1-CG1 3.59Å; I278-V321 HydrophobicContact CD1-CG2 4.25Å; I278-I558 HydrophobicContact CG2-CG2 4.45Å; I278-A562 HydrophobicContact CG2-CB 3.59Å
279	G	92.6	Very high	91.9	Very high	28 Å²	28	65 Å²	65	29%	0.289	33%	0.329	S	S	.	.	H	α-helix	trans	-60	-46.6	179.8	0	0	0	0	0	112.7	I275 V276	I275-G279 PolarHBondContact O-N 3.49Å; V276-G279 PolarHBondContact O-N 3.33Å
280	M	94.2	Very high	92	Very high	140 Å²	140	61.2 Å²	61.2	69%	0.69	32%	0.316	S	S	*	.	H	α-helix	trans	-67.3	-42.8	-179	-70.7	-64	105.7	0	0	113	V276 T277 I278 P284	V276-M280 HydrophobicContact CG1-CG 4.27Å; V276-M280 WeakPolarHBondContact O-CB 3.41Å; V276-M280 VanDerWaalsContact O-CG 3.28Å; V276-M280 WeakPolarHBondContact O-CG 3.49Å; V276-M280 PolarHBondContact O-N 3.27Å; T277-M280 PolarHBondContact O-N 2.88Å; I278-M280 PolarHBondContact O-N 2.97Å; M280-P284 WeakPolarHBondContact O-CD 3.36Å
281	L	95.1	Very high	92	Very high	53 Å²	53	61.4 Å²	61.4	28%	0.277	32%	0.324	S	S	.	.	H	α-helix	trans	-80.3	-22.9	-178	-169.5	70.9	0	0	0	112.9	T277 L283 P284 C285 L306 L307	T277-L281 WeakPolarHBondContact O-CB 3.36Å; T277-L281 PolarHBondContact O-N 3.38Å; L281-L283 VanDerWaalsContact C-N 3.29Å; L281-L283 PolarHBondContact O-N 3.02Å; L281-P284 HydrophobicContact CD1-CG 4.32Å; L281-P284 VanDerWaalsContact O-CD 3.23Å; L281-P284 WeakPolarHBondContact O-CD 3.31Å; L281-P284 VanDerWaalsContact O-CG 3.31Å; L281-P284 WeakPolarHBondContact O-CG 3.44Å; L281-C285 PolarHBondContact O-N 3.32Å; L281-C285 PolarHBondContact O-SG 2.95Å; L281-L306 HydrophobicContact CD2-CB 4.22Å; L281-L306 HydrophobicContact CD2-CD1 4.46Å; L281-L307 HydrophobicContact CB-CD1 4.25Å; L281-L307 HydrophobicContact CD2-CD1 3.91Å; L281-L307 HydrophobicContact CD2-CD2 3.72Å; L281-L307 HydrophobicContact CD2-CG 3.54Å
282	S	94.1	Very high	91.7	Very high	2 Å²	2	64 Å²	64	1%	0.014	34%	0.339	C	S	.	.	H	α-helix	trans	-65	-31.5	176.9	-66.9	0	0	0	0	112.9	I278 G286 C303 I558	I278-S282 WeakPolarHBondContact O-CB 3.44Å; I278-S282 PolarHBondContact O-N 2.94Å; I278-S282 PolarHBondContact O-OG 3.28Å; S282-G286 WeakPolarHBondContact O-CA 3.29Å; S282-G286 PolarHBondContact O-N 3.21Å; S282-C303 PolarHBondContact N-SG 2.91Å; S282-C303 PolarHBondContact OG-SG 3.34Å; S282-C303 VanDerWaalsContact OG-SG 3.35Å; S282-I558 WeakPolarHBondContact OG-CG2 3.47Å
283	L	93.6	Very high	90.9	Very high	125 Å²	125	62.4 Å²	62.4	65%	0.654	34%	0.343	S	S	*	.	H	α-helix	trans	-63	-57.7	177.8	-176	156.6	0	0	0	112.8	L281 C285 G286 W287	L281-L283 VanDerWaalsContact C-N 3.29Å; L281-L283 PolarHBondContact O-N 3.02Å; L283-C285 VanDerWaalsContact C-N 3.32Å; L283-C285 PolarHBondContact O-N 2.93Å; L283-G286 PolarHBondContact O-N 2.92Å; L283-W287 WeakPolarHBondContact O-CB 3.23Å; L283-W287 PolarHBondContact O-N 2.93Å
284	P	95.7	Very high	90.1	Very high	60 Å²	60	58.2 Å²	58.2	39%	0.39	33%	0.327	S	S	.	.	H	α-helix	trans	-64	-36.8	179.3	24	-33.5	0	0	0	112.1	M280 L281 W287 L288	M280-P284 WeakPolarHBondContact O-CD 3.36Å; L281-P284 HydrophobicContact CD1-CG 4.32Å; L281-P284 VanDerWaalsContact O-CD 3.23Å; L281-P284 WeakPolarHBondContact O-CD 3.31Å; L281-P284 VanDerWaalsContact O-CG 3.31Å; L281-P284 WeakPolarHBondContact O-CG 3.44Å; P284-W287 PolarHBondContact O-N 2.99Å; P284-L288 WeakPolarHBondContact O-CB 3.46Å; P284-L288 PolarHBondContact O-N 3.39Å
285	C	94.3	Very high	89.4	Confident	13 Å²	13	59.5 Å²	59.5	9%	0.088	34%	0.335	C	S	.	.	H	α-helix	trans	-66.2	-44.7	176.6	-62.4	0	0	0	0	111.9	L281 L283 L288 C289 G299 C303	L281-C285 PolarHBondContact O-N 3.32Å; L281-C285 PolarHBondContact O-SG 2.95Å; L283-C285 VanDerWaalsContact C-N 3.32Å; L283-C285 PolarHBondContact O-N 2.93Å; C285-L288 PolarHBondContact O-N 3.11Å; C285-C289 PolarHBondContact O-N 3.09Å; C285-G299 WeakPolarHBondContact CB-O 3.39Å; C285-C303 HydrophobicContact CB-CB 4.21Å
286	G	91.6	Very high	89	Confident	5 Å²	5	61 Å²	61	5%	0.052	35%	0.346	C	S	.	.	H	α-helix	trans	-63.7	-41.3	175.6	0	0	0	0	0	112.5	S282 L283 C289 T290	S282-G286 WeakPolarHBondContact O-CA 3.29Å; S282-G286 PolarHBondContact O-N 3.21Å; L283-G286 PolarHBondContact O-N 2.92Å; G286-C289 PolarHBondContact O-N 3.28Å; G286-T290 WeakPolarHBondContact O-CG2 3.42Å; G286-T290 PolarHBondContact O-N 2.92Å; G286-T290 PolarHBondContact O-OG1 3.31Å
287	W	93.6	Very high	88.5	Confident	178 Å²	178	57.7 Å²	57.7	67%	0.674	33%	0.325	S	S	*	.	H	α-helix	trans	-64.4	-43.7	176.1	-173.6	23.1	0	0	0	111.6	L283 P284 C289 T290 T291	L283-W287 WeakPolarHBondContact O-CB 3.23Å; L283-W287 PolarHBondContact O-N 2.93Å; P284-W287 PolarHBondContact O-N 2.99Å; W287-C289 VanDerWaalsContact C-N 3.33Å; W287-C289 PolarHBondContact O-N 2.93Å; W287-T290 WeakPolarHBondContact CA-OG1 3.49Å; W287-T290 PolarHBondContact O-N 3.14Å; W287-T290 PolarHBondContact O-OG1 2.85Å; W287-T291 WeakPolarHBondContact O-CG2 3.48Å; W287-T291 PolarHBondContact O-N 2.85Å
288	L	93.1	Very high	88	Confident	105 Å²	105	56.7 Å²	56.7	55%	0.55	32%	0.318	S	S	.	.	H	α-helix	trans	-57.7	-46.5	174.1	-176.6	62.3	0	0	0	111.3	P284 C285 T290 T291 I292	P284-L288 WeakPolarHBondContact O-CB 3.46Å; P284-L288 PolarHBondContact O-N 3.39Å; C285-L288 PolarHBondContact O-N 3.11Å; L288-T290 PolarHBondContact O-N 3.01Å; L288-T291 PolarHBondContact O-N 3.16Å; L288-T291 PolarHBondContact O-OG1 3.39Å; L288-I292 HydrophobicContact CD1-CD1 4.32Å; L288-I292 HydrophobicContact CG-CD1 4.14Å; L288-I292 WeakPolarHBondContact O-CG1 3.24Å; L288-I292 PolarHBondContact O-N 3.14Å
289	C	87.9	Confident	87.8	Confident	4 Å²	4	56.6 Å²	56.6	3%	0.027	32%	0.317	C	S	.	.	H	α-helix	trans	-61.2	-41.3	176.9	-74.9	0	0	0	0	113	C285 G286 W287 T291 I292 G293 L294 G299	C285-C289 PolarHBondContact O-N 3.09Å; G286-C289 PolarHBondContact O-N 3.28Å; W287-C289 VanDerWaalsContact C-N 3.33Å; W287-C289 PolarHBondContact O-N 2.93Å; C289-T291 VanDerWaalsContact C-N 3.34Å; C289-T291 PolarHBondContact O-N 2.99Å; C289-I292 PolarHBondContact O-N 3.14Å; C289-G293 PolarHBondContact O-N 3.46Å; C289-L294 CarbonylContact C-O 3.55Å; C289-L294 HydrophobicContact CB-CB 4.19Å; C289-L294 WeakPolarHBondContact O-CB 3.27Å; C289-L294 PolarHBondContact O-N 3.27Å; C289-G299 WeakPolarHBondContact SG-CA 3.49Å; C289-G299 PolarHBondContact SG-N 3.11Å
290	T	84.7	Confident	87.7	Confident	65 Å²	65	57.3 Å²	57.3	40%	0.399	31%	0.312	S	S	.	.	H	α-helix	trans	-66.5	-35.6	178.2	53.1	0	0	0	0	112.3	G286 W287 L288 I292 G293 T296	G286-T290 WeakPolarHBondContact O-CG2 3.42Å; G286-T290 PolarHBondContact O-N 2.92Å; G286-T290 PolarHBondContact O-OG1 3.31Å; W287-T290 WeakPolarHBondContact CA-OG1 3.49Å; W287-T290 PolarHBondContact O-N 3.14Å; W287-T290 PolarHBondContact O-OG1 2.85Å; L288-T290 PolarHBondContact O-N 3.01Å; T290-I292 VanDerWaalsContact C-N 3.26Å; T290-I292 PolarHBondContact O-N 3.22Å; T290-G293 PolarHBondContact O-N 3.21Å; T290-T296 HydrophobicContact CG2-CG2 3.31Å
291	T	84.4	Confident	87.5	Confident	95 Å²	95	51 Å²	51	58%	0.583	28%	0.281	S	S	*	.	H	α-helix	trans	-64.1	-31.2	174	63.1	0	0	0	0	113	W287 L288 C289 G293	W287-T291 WeakPolarHBondContact O-CG2 3.48Å; W287-T291 PolarHBondContact O-N 2.85Å; L288-T291 PolarHBondContact O-N 3.16Å; L288-T291 PolarHBondContact O-OG1 3.39Å; C289-T291 VanDerWaalsContact C-N 3.34Å; C289-T291 PolarHBondContact O-N 2.99Å; T291-G293 PolarHBondContact O-N 2.99Å
292	I	82.1	Confident	87.2	Confident	109 Å²	109	52.2 Å²	52.2	56%	0.559	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-8.1	175.6	-59.5	165.4	0	0	0	111.2	L288 C289 T290 L294	L288-I292 HydrophobicContact CD1-CD1 4.32Å; L288-I292 HydrophobicContact CG-CD1 4.14Å; L288-I292 WeakPolarHBondContact O-CG1 3.24Å; L288-I292 PolarHBondContact O-N 3.14Å; C289-I292 PolarHBondContact O-N 3.14Å; T290-I292 VanDerWaalsContact C-N 3.26Å; T290-I292 PolarHBondContact O-N 3.22Å; I292-L294 HydrophobicContact CB-CD1 4.49Å; I292-L294 HydrophobicContact CB-CG 4.41Å; I292-L294 HydrophobicContact CG2-CD1 4.02Å; I292-L294 HydrophobicContact CG2-CG 4.04Å
293	G	73.3	Confident	87.2	Confident	52 Å²	52	52.1 Å²	52.1	54%	0.536	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.6	19.5	-175.8	0	0	0	0	0	113.6	C289 T290 T291	C289-G293 PolarHBondContact O-N 3.46Å; T290-G293 PolarHBondContact O-N 3.21Å; T291-G293 PolarHBondContact O-N 2.99Å
294	L	75.1	Confident	87.2	Confident	38 Å²	38	46.2 Å²	46.2	20%	0.199	26%	0.255	C	S	.	.			trans	-93	151.9	174.1	-62.9	175.6	0	0	0	111.2	C289 I292 F298 L655	C289-L294 CarbonylContact C-O 3.55Å; C289-L294 HydrophobicContact CB-CB 4.19Å; C289-L294 WeakPolarHBondContact O-CB 3.27Å; C289-L294 PolarHBondContact O-N 3.27Å; I292-L294 HydrophobicContact CB-CD1 4.49Å; I292-L294 HydrophobicContact CB-CG 4.41Å; I292-L294 HydrophobicContact CG2-CD1 4.02Å; I292-L294 HydrophobicContact CG2-CG 4.04Å; L294-F298 HydrophobicContact CB-CD2 4.38Å; L294-L655 HydrophobicContact CD1-CD1 3.82Å; L294-L655 HydrophobicContact CD2-CD1 3.41Å; L294-L655 VanDerWaalsContact CD2-CD1 3.41Å; L294-L655 HydrophobicContact CG-CD1 4.27Å
295	P	78.2	Confident	86.9	Confident	29 Å²	29	44.5 Å²	44.5	19%	0.188	24%	0.243	C	C	.	.			trans	-55.1	143	170.1	-26.8	34.8	0	0	0	113.1	M297 F298 L395	P295-M297 VanDerWaalsContact C-N 3.26Å; P295-M297 HydrophobicContact CB-CG 3.78Å; P295-M297 HydrophobicContact CB-SD 4.17Å; P295-M297 PolarHBondContact O-N 2.96Å; P295-F298 HydrophobicContact CB-CD2 3.91Å; P295-F298 HydrophobicContact CB-CE2 4.2Å; P295-F298 HydrophobicContact CG-CD2 4.03Å; P295-F298 HydrophobicContact CG-CE2 3.89Å; P295-F298 PolarHBondContact O-N 2.78Å; P295-L395 HydrophobicContact CG-CD1 3.33Å
296	T	84.3	Confident	86.9	Confident	62 Å²	62	47.5 Å²	47.5	38%	0.38	26%	0.258	S	S	.	.	H	α-helix	trans	-59.2	-33.1	-179	45.6	0	0	0	0	113.4	T290 F298 G299 Y300	T290-T296 HydrophobicContact CG2-CG2 3.31Å; T296-F298 PolarHBondContact O-N 3.38Å; T296-F298 VanDerWaalsContact O-N 3.14Å; T296-G299 WeakPolarHBondContact O-CA 3.41Å; T296-G299 PolarHBondContact O-N 3.02Å; T296-Y300 PolarHBondContact O-N 3.2Å
297	M	83.3	Confident	86.9	Confident	13 Å²	13	47.6 Å²	47.6	6%	0.064	26%	0.258	C	S	.	.	H	α-helix	trans	-52.1	-33.7	176.4	60.2	-171.3	-79.8	0	0	113.5	P295 G299 Y300 I301 F561 E623 L654	P295-M297 VanDerWaalsContact C-N 3.26Å; P295-M297 HydrophobicContact CB-CG 3.78Å; P295-M297 HydrophobicContact CB-SD 4.17Å; P295-M297 PolarHBondContact O-N 2.96Å; M297-G299 VanDerWaalsContact C-N 3.31Å; M297-G299 PolarHBondContact O-N 3.4Å; M297-Y300 PolarHBondContact O-N 3.41Å; M297-I301 WeakPolarHBondContact O-CG1 3.16Å; M297-I301 PolarHBondContact O-N 3.4Å; M297-F561 HydrophobicContact CB-CD1 4.45Å; M297-F561 HydrophobicContact CB-CD2 4.01Å; M297-F561 HydrophobicContact CB-CE1 4.41Å; M297-F561 HydrophobicContact CB-CE2 3.98Å; M297-F561 HydrophobicContact CB-CG 4.28Å; M297-F561 HydrophobicContact CB-CZ 4.18Å; M297-F561 HydrophobicContact CE-CE1 4Å; M297-F561 HydrophobicContact CE-CZ 4.19Å; M297-E623 HydrophobicContact CE-CB 3.77Å; M297-E623 HydrophobicContact CE-CG 4.42Å; M297-L654 HydrophobicContact CE-CD1 3.78Å
298	F	83.1	Confident	86.7	Confident	12 Å²	12	39.2 Å²	39.2	5%	0.053	23%	0.226	C	C	.	.	H	α-helix	trans	-66.3	-35.7	176.3	-74.1	-75.5	0	0	0	112.4	L294 P295 T296 Y300 I301 I302 T651 L654	L294-F298 HydrophobicContact CB-CD2 4.38Å; P295-F298 HydrophobicContact CB-CD2 3.91Å; P295-F298 HydrophobicContact CB-CE2 4.2Å; P295-F298 HydrophobicContact CG-CD2 4.03Å; P295-F298 HydrophobicContact CG-CE2 3.89Å; P295-F298 PolarHBondContact O-N 2.78Å; T296-F298 PolarHBondContact O-N 3.38Å; T296-F298 VanDerWaalsContact O-N 3.14Å; F298-Y300 VanDerWaalsContact C-N 3.28Å; F298-Y300 PolarHBondContact O-N 2.98Å; F298-I301 PolarHBondContact O-N 3.11Å; F298-I302 VanDerWaalsContact O-CG1 3.26Å; F298-I302 WeakPolarHBondContact O-CG1 3.42Å; F298-I302 PolarHBondContact O-N 3.03Å; F298-T651 HydrophobicContact CD1-CG2 4.24Å; F298-T651 HydrophobicContact CE1-CG2 3.88Å; F298-T651 WeakPolarHBondContact CE1-O 3.32Å; F298-L654 HydrophobicContact CE1-CB 4.11Å; F298-L654 HydrophobicContact CE2-CB 4.13Å; F298-L654 HydrophobicContact CZ-CB 3.33Å; F298-L654 HydrophobicContact CZ-CD1 4.33Å; F298-L654 HydrophobicContact CZ-CG 4.47Å
299	G	89.9	Confident	86.4	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.2	-37.1	175.2	0	0	0	0	0	111.5	C285 C289 T296 M297 I302 C303	C285-G299 WeakPolarHBondContact CB-O 3.39Å; C289-G299 WeakPolarHBondContact SG-CA 3.49Å; C289-G299 PolarHBondContact SG-N 3.11Å; T296-G299 WeakPolarHBondContact O-CA 3.41Å; T296-G299 PolarHBondContact O-N 3.02Å; M297-G299 VanDerWaalsContact C-N 3.31Å; M297-G299 PolarHBondContact O-N 3.4Å; G299-I302 PolarHBondContact O-N 3.23Å; G299-C303 WeakPolarHBondContact O-CB 3.39Å; G299-C303 PolarHBondContact O-N 2.83Å
300	Y	90.8	Very high	86	Confident	44 Å²	44	38.9 Å²	38.9	17%	0.173	23%	0.231	C	C	.	.	H	α-helix	trans	-68.4	-40.2	176.1	-48	-27.3	0	0	0	111.5	T296 M297 F298 C303 G304 I558 F561 A562	T296-Y300 PolarHBondContact O-N 3.2Å; M297-Y300 PolarHBondContact O-N 3.41Å; F298-Y300 VanDerWaalsContact C-N 3.28Å; F298-Y300 PolarHBondContact O-N 2.98Å; Y300-C303 WeakPolarHBondContact O-CB 3.46Å; Y300-C303 PolarHBondContact O-N 3.47Å; Y300-G304 PolarHBondContact O-N 2.92Å; Y300-I558 HydrophobicContact CD1-CG1 4.25Å; Y300-I558 HydrophobicContact CD1-CG2 4.31Å; Y300-I558 HydrophobicContact CD2-CB 4.39Å; Y300-I558 HydrophobicContact CD2-CG1 3.93Å; Y300-I558 HydrophobicContact CE1-CG1 3.96Å; Y300-I558 HydrophobicContact CE2-CG1 3.6Å; Y300-I558 HydrophobicContact CG-CG1 4.26Å; Y300-I558 HydrophobicContact CG-CG2 4.35Å; Y300-F561 HydrophobicContact CD2-CB 4.35Å; Y300-F561 HydrophobicContact CD2-CD2 4.2Å; Y300-A562 WeakPolarHBondContact O-CA 3.27Å
301	I	89.1	Confident	86.1	Confident	8 Å²	8	37.9 Å²	37.9	4%	0.041	23%	0.234	C	C	.	.	H	α-helix	trans	-62.7	-46.3	173.4	-64.5	169.6	0	0	0	110.7	M297 F298 C303 G304 V305 F561 G565 F626	M297-I301 WeakPolarHBondContact O-CG1 3.16Å; M297-I301 PolarHBondContact O-N 3.4Å; F298-I301 PolarHBondContact O-N 3.11Å; I301-C303 VanDerWaalsContact C-N 3.3Å; I301-C303 PolarHBondContact O-N 3.13Å; I301-G304 CarbonylContact O-C 3.55Å; I301-G304 WeakPolarHBondContact O-CA 3.41Å; I301-G304 PolarHBondContact O-N 3.43Å; I301-G304 VanDerWaalsContact O-N 3.09Å; I301-V305 HydrophobicContact CG2-CG2 4.3Å; I301-V305 WeakPolarHBondContact O-CG2 3.46Å; I301-V305 PolarHBondContact O-N 2.7Å; I301-F561 HydrophobicContact CD1-CD1 4.35Å; I301-F561 HydrophobicContact CG1-CB 4.14Å; I301-F561 HydrophobicContact CG1-CD1 4.33Å; I301-G565 WeakPolarHBondContact O-CA 3.3Å; I301-F626 HydrophobicContact CD1-CE2 4.1Å; I301-F626 HydrophobicContact CD1-CZ 4.39Å
302	I	90	Very high	86.2	Confident	78 Å²	78	39.5 Å²	39.5	40%	0.4	24%	0.239	S	C	.	.	H	α-helix	trans	-59.4	-42.8	176.7	-69.9	165.2	0	0	0	110.6	F298 G299 G304 V305 L306	F298-I302 VanDerWaalsContact O-CG1 3.26Å; F298-I302 WeakPolarHBondContact O-CG1 3.42Å; F298-I302 PolarHBondContact O-N 3.03Å; G299-I302 PolarHBondContact O-N 3.23Å; I302-G304 VanDerWaalsContact C-N 3.31Å; I302-G304 PolarHBondContact O-N 3.49Å; I302-V305 WeakPolarHBondContact O-CB 3.19Å; I302-V305 PolarHBondContact O-N 3.43Å; I302-V305 VanDerWaalsContact O-N 3.16Å; I302-L306 HydrophobicContact CG2-CD1 3.96Å; I302-L306 HydrophobicContact CG2-CG 4.25Å; I302-L306 WeakPolarHBondContact O-CB 3.39Å; I302-L306 VanDerWaalsContact O-CG 3.29Å; I302-L306 WeakPolarHBondContact O-CG 3.3Å; I302-L306 PolarHBondContact O-N 3.16Å
303	C	93.8	Very high	86.4	Confident	0 Å²	0	39 Å²	39	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-55.3	-47.3	173.4	175.4	0	0	0	0	111.2	S282 C285 G299 Y300 I301 V305 L306 L307	S282-C303 PolarHBondContact N-SG 2.91Å; S282-C303 PolarHBondContact OG-SG 3.34Å; S282-C303 VanDerWaalsContact OG-SG 3.35Å; C285-C303 HydrophobicContact CB-CB 4.21Å; G299-C303 WeakPolarHBondContact O-CB 3.39Å; G299-C303 PolarHBondContact O-N 2.83Å; Y300-C303 WeakPolarHBondContact O-CB 3.46Å; Y300-C303 PolarHBondContact O-N 3.47Å; I301-C303 VanDerWaalsContact C-N 3.3Å; I301-C303 PolarHBondContact O-N 3.13Å; C303-V305 PolarHBondContact O-N 2.88Å; C303-L306 PolarHBondContact O-N 2.96Å; C303-L307 WeakPolarHBondContact O-CB 3.12Å; C303-L307 WeakPolarHBondContact O-CG 3.25Å; C303-L307 PolarHBondContact O-N 2.94Å
304	G	92.3	Very high	87.1	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.8	-43.3	173.5	0	0	0	0	0	113.9	Y300 I301 I302 L306 L307 G308 A562 G565 L566	Y300-G304 PolarHBondContact O-N 2.92Å; I301-G304 CarbonylContact O-C 3.55Å; I301-G304 WeakPolarHBondContact O-CA 3.41Å; I301-G304 PolarHBondContact O-N 3.43Å; I301-G304 VanDerWaalsContact O-N 3.09Å; I302-G304 VanDerWaalsContact C-N 3.31Å; I302-G304 PolarHBondContact O-N 3.49Å; G304-L306 VanDerWaalsContact C-N 3.32Å; G304-L306 PolarHBondContact O-N 3.48Å; G304-L307 PolarHBondContact O-N 3.46Å; G304-G308 WeakPolarHBondContact O-CA 3.31Å; G304-G308 PolarHBondContact O-N 3.42Å; G304-A562 WeakPolarHBondContact CA-O 3.48Å; G304-G565 VanDerWaalsContact C-C 3.43Å; G304-L566 WeakPolarHBondContact O-CD2 3.31Å
305	V	91	Very high	87.8	Confident	24 Å²	24	36.6 Å²	36.6	15%	0.145	22%	0.215	C	C	.	.	H	α-helix	trans	-61.4	-42.6	176.5	178.9	0	0	0	0	111.3	I301 I302 C303 G565 V568 P570	I301-V305 HydrophobicContact CG2-CG2 4.3Å; I301-V305 WeakPolarHBondContact O-CG2 3.46Å; I301-V305 PolarHBondContact O-N 2.7Å; I302-V305 WeakPolarHBondContact O-CB 3.19Å; I302-V305 PolarHBondContact O-N 3.43Å; I302-V305 VanDerWaalsContact O-N 3.16Å; C303-V305 PolarHBondContact O-N 2.88Å; V305-G565 WeakPolarHBondContact CA-O 3.3Å; V305-G565 PolarHBondContact N-O 3.45Å; V305-V568 HydrophobicContact CG2-CB 3.7Å; V305-V568 HydrophobicContact CG2-CG1 4.01Å; V305-V568 HydrophobicContact CG2-CG2 4.22Å; V305-P570 HydrophobicContact CG1-CG 3.31Å
306	L	92.9	Very high	88	Confident	76 Å²	76	42.1 Å²	42.1	40%	0.398	24%	0.236	S	C	.	.	H	α-helix	trans	-69.2	-40.5	179.6	-70	175.1	0	0	0	112	L281 I302 C303 G304 L312	L281-L306 HydrophobicContact CD2-CB 4.22Å; L281-L306 HydrophobicContact CD2-CD1 4.46Å; I302-L306 HydrophobicContact CG2-CD1 3.96Å; I302-L306 HydrophobicContact CG2-CG 4.25Å; I302-L306 WeakPolarHBondContact O-CB 3.39Å; I302-L306 VanDerWaalsContact O-CG 3.29Å; I302-L306 WeakPolarHBondContact O-CG 3.3Å; I302-L306 PolarHBondContact O-N 3.16Å; C303-L306 PolarHBondContact O-N 2.96Å; G304-L306 VanDerWaalsContact C-N 3.32Å; G304-L306 PolarHBondContact O-N 3.48Å; L306-L312 WeakPolarHBondContact O-CB 3.39Å; L306-L312 WeakPolarHBondContact O-CG 3.49Å; L306-L312 PolarHBondContact O-N 3.22Å
307	L	93.1	Very high	88.1	Confident	8 Å²	8	40 Å²	40	4%	0.042	22%	0.224	C	C	.	.	H	α-helix	trans	-83.8	-22.1	-178.7	-68.9	175.4	0	0	0	113.4	I278 L281 C303 G304 S314 I315	I278-L307 HydrophobicContact CB-CD1 4.47Å; I278-L307 HydrophobicContact CG1-CD1 3.88Å; L281-L307 HydrophobicContact CB-CD1 4.25Å; L281-L307 HydrophobicContact CD2-CD1 3.91Å; L281-L307 HydrophobicContact CD2-CD2 3.72Å; L281-L307 HydrophobicContact CD2-CG 3.54Å; C303-L307 WeakPolarHBondContact O-CB 3.12Å; C303-L307 WeakPolarHBondContact O-CG 3.25Å; C303-L307 PolarHBondContact O-N 2.94Å; G304-L307 PolarHBondContact O-N 3.46Å; L307-S314 PolarHBondContact O-N 3.02Å; L307-I315 HydrophobicContact CB-CD1 4.35Å; L307-I315 HydrophobicContact CB-CG1 3.84Å; L307-I315 HydrophobicContact CD1-CD1 4.45Å; L307-I315 PolarHBondContact O-N 2.9Å
308	G	89.1	Confident	88.2	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.01	23%	0.232	C	C	.	.	S	Bend	trans	-71.8	177.5	-176.8	0	0	0	0	0	114.2	G304 S310 G311 N313 L566	G304-G308 WeakPolarHBondContact O-CA 3.31Å; G304-G308 PolarHBondContact O-N 3.42Å; G308-S310 PolarHBondContact O-N 3.09Å; G308-S310 VanDerWaalsContact O-N 3.11Å; G308-G311 PolarHBondContact O-N 3.32Å; G308-N313 WeakPolarHBondContact O-CA 3.33Å; G308-N313 PolarHBondContact O-N 3.15Å; G308-L566 VanDerWaalsContact CA-CD2 3.47Å
309	P	85.3	Confident	88.4	Confident	61 Å²	61	46 Å²	46	40%	0.396	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-28.2	-175.2	-24.7	34.5	0	0	0	114.2	G311 N313 L566	P309-G311 VanDerWaalsContact C-N 3.32Å; P309-N313 WeakPolarHBondContact CA-OD1 3.24Å; P309-L566 WeakPolarHBondContact CD-O 3.32Å
310	S	80.9	Confident	88.4	Confident	41 Å²	41	49.7 Å²	49.7	29%	0.287	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-19.4	178	-48.6	0	0	0	0	114.2	G308 V568 F569	G308-S310 PolarHBondContact O-N 3.09Å; G308-S310 VanDerWaalsContact O-N 3.11Å; S310-V568 PolarHBondContact OG-O 3.32Å; S310-V568 VanDerWaalsContact OG-O 3.06Å; S310-F569 WeakPolarHBondContact OG-CD1 3.37Å; S310-F569 WeakPolarHBondContact OG-CE1 3.46Å; S310-F569 WeakPolarHBondContact OG-CG 3.38Å
311	G	85.8	Confident	88.4	Confident	45 Å²	45	47.6 Å²	47.6	46%	0.464	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-109.8	-175.2	0	0	0	0	0	111.7	G308 P309	G308-G311 PolarHBondContact O-N 3.32Å; P309-G311 VanDerWaalsContact C-N 3.32Å
312	L	86.3	Confident	88.3	Confident	129 Å²	129	49.5 Å²	49.5	68%	0.675	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-11.9	179.6	-62.9	173.7	0	0	0	112.9	L306 S314	L306-L312 WeakPolarHBondContact O-CB 3.39Å; L306-L312 WeakPolarHBondContact O-CG 3.49Å; L306-L312 PolarHBondContact O-N 3.22Å; L312-S314 PolarHBondContact O-N 3.45Å
313	N	87.4	Confident	88.2	Confident	98 Å²	98	49.1 Å²	49.1	52%	0.524	28%	0.279	S	S	.	.			trans	49.1	41.8	-176.2	-166.2	33.9	0	0	0	112.5	G308 P309	G308-N313 WeakPolarHBondContact O-CA 3.33Å; G308-N313 PolarHBondContact O-N 3.15Å; P309-N313 WeakPolarHBondContact CA-OD1 3.24Å
314	S	87.4	Confident	88.1	Confident	39 Å²	39	51.4 Å²	51.4	27%	0.273	29%	0.291	S	S	.	.			trans	-83.7	-29	-175.5	-173.6	0	0	0	0	112.3	L307 L312	L307-S314 PolarHBondContact O-N 3.02Å; L312-S314 PolarHBondContact O-N 3.45Å
315	I	89.1	Confident	87.8	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.291	C	S	.	.			trans	-83.1	118	180	-55.6	-59.8	0	0	0	108.9	D274 I278 L307 I318 V321 L566	D274-I315 HydrophobicContact CB-CD1 3.68Å; D274-I315 HydrophobicContact CB-CG2 4.25Å; D274-I315 WeakPolarHBondContact OD2-CG2 3.28Å; I278-I315 HydrophobicContact CD1-CD1 3.97Å; I278-I315 HydrophobicContact CG1-CD1 3.87Å; L307-I315 HydrophobicContact CB-CD1 4.35Å; L307-I315 HydrophobicContact CB-CG1 3.84Å; L307-I315 HydrophobicContact CD1-CD1 4.45Å; L307-I315 PolarHBondContact O-N 2.9Å; I315-I318 HydrophobicContact CG2-CG1 4.23Å; I315-V321 HydrophobicContact CG2-CG2 4.21Å; I315-L566 HydrophobicContact CB-CD2 4.19Å; I315-L566 HydrophobicContact CG1-CD2 3.91Å; I315-L566 HydrophobicContact CG2-CD1 4.21Å; I315-L566 HydrophobicContact CG2-CD2 4.46Å
316	K	83.8	Confident	87.5	Confident	146 Å²	146	52.3 Å²	52.3	64%	0.635	29%	0.293	S	S	*	.			trans	-98.3	-31.3	177.4	-64	-167.7	179	-171.2	0	111.7	D274 I318	D274-K316 PolarHBondContact OD2-N 3.43Å; K316-I318 PolarHBondContact O-N 3.47Å
317	S	86.1	Confident	87.4	Confident	17 Å²	17	52.4 Å²	52.4	12%	0.119	29%	0.291	C	S	.	.			trans	-94.5	53.6	-174.5	-74.6	0	0	0	0	113	D274 V319 Q320 V321	D274-S317 WeakPolarHBondContact OD2-CB 3.35Å; D274-S317 PolarHBondContact OD2-N 3.25Å; S317-V319 VanDerWaalsContact C-N 3.35Å; S317-V319 PolarHBondContact O-N 3.44Å; S317-Q320 PolarHBondContact O-N 3.47Å; S317-Q320 PolarHBondContact OG-OE1 3.46Å; S317-V321 WeakPolarHBondContact O-CG2 3.48Å; S317-V321 PolarHBondContact O-N 3.42Å; S317-V321 VanDerWaalsContact O-N 3.08Å
318	I	86	Confident	87.1	Confident	46 Å²	46	52 Å²	52	24%	0.236	29%	0.289	C	S	.	.	H	α-helix	trans	-54.4	-46.2	-175.1	-70.2	109.5	0	0	0	112.8	I315 K316 Q320 V321 E322 L566	I315-I318 HydrophobicContact CG2-CG1 4.23Å; K316-I318 PolarHBondContact O-N 3.47Å; I318-Q320 PolarHBondContact O-N 2.93Å; I318-V321 PolarHBondContact O-N 3.33Å; I318-E322 HydrophobicContact CG2-CG 4.4Å; I318-E322 WeakPolarHBondContact CG2-OE1 3.38Å; I318-E322 WeakPolarHBondContact O-CB 3.33Å; I318-E322 WeakPolarHBondContact O-CG 3.29Å; I318-E322 PolarHBondContact O-N 3.48Å; I318-L566 HydrophobicContact CG1-CD1 4.38Å
319	V	86.6	Confident	86.8	Confident	104 Å²	104	52.2 Å²	52.2	63%	0.63	29%	0.29	S	S	*	.	H	α-helix	trans	-64.7	-41	-176.7	179.5	0	0	0	0	111.8	S317 E322 T323	S317-V319 VanDerWaalsContact C-N 3.35Å; S317-V319 PolarHBondContact O-N 3.44Å; V319-E322 PolarHBondContact O-N 2.99Å; V319-T323 WeakPolarHBondContact O-CB 3.19Å; V319-T323 PolarHBondContact O-N 3.27Å; V319-T323 PolarHBondContact O-OG1 3.32Å
320	Q	89.7	Confident	86.9	Confident	78 Å²	78	49.8 Å²	49.8	36%	0.364	27%	0.273	S	S	.	.	H	α-helix	trans	-69.4	-41.2	-179.5	-62.8	164.5	-16.4	0	0	110.6	D268 F271 S317 I318 T323 L324	D268-Q320 PolarHBondContact OD2-NE2 3.25Å; D268-Q320 VanDerWaalsContact OD2-NE2 3.09Å; D268-Q320 PolarHBondContact OD2-OE1 3.45Å; F271-Q320 HydrophobicContact CD2-CB 3.55Å; F271-Q320 HydrophobicContact CD2-CG 4.47Å; F271-Q320 HydrophobicContact CE2-CB 3.55Å; F271-Q320 HydrophobicContact CG-CB 4.41Å; F271-Q320 HydrophobicContact CZ-CB 4.39Å; S317-Q320 PolarHBondContact O-N 3.47Å; S317-Q320 PolarHBondContact OG-OE1 3.46Å; I318-Q320 PolarHBondContact O-N 2.93Å; Q320-T323 PolarHBondContact O-N 3.06Å; Q320-L324 PolarHBondContact O-N 3.46Å
321	V	90.8	Very high	87.3	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.7	-42.1	174.9	174.2	0	0	0	0	111.3	F271 D274 I275 I278 I315 S317 I318 L324 G325 I559 L566	F271-V321 HydrophobicContact CD2-CG2 4.4Å; F271-V321 HydrophobicContact CE2-CG2 4.16Å; D274-V321 HydrophobicContact CB-CG2 4.18Å; I275-V321 HydrophobicContact CD1-CG2 4.08Å; I278-V321 HydrophobicContact CD1-CG1 3.59Å; I278-V321 HydrophobicContact CD1-CG2 4.25Å; I315-V321 HydrophobicContact CG2-CG2 4.21Å; S317-V321 WeakPolarHBondContact O-CG2 3.48Å; S317-V321 PolarHBondContact O-N 3.42Å; S317-V321 VanDerWaalsContact O-N 3.08Å; I318-V321 PolarHBondContact O-N 3.33Å; V321-L324 PolarHBondContact O-N 3.26Å; V321-G325 PolarHBondContact O-N 3.15Å; V321-I559 HydrophobicContact CG1-CG2 4.16Å; V321-L566 HydrophobicContact CG1-CD1 4.23Å
322	E	86.5	Confident	87.3	Confident	49 Å²	49	47.4 Å²	47.4	23%	0.229	25%	0.247	C	C	.	.	H	α-helix	trans	-59.9	-46.4	173	-81	170.5	-159.6	0	0	112.4	I318 V319 L324 G325 E326 S563 H567	I318-E322 HydrophobicContact CG2-CG 4.4Å; I318-E322 WeakPolarHBondContact CG2-OE1 3.38Å; I318-E322 WeakPolarHBondContact O-CB 3.33Å; I318-E322 WeakPolarHBondContact O-CG 3.29Å; I318-E322 PolarHBondContact O-N 3.48Å; V319-E322 PolarHBondContact O-N 2.99Å; E322-L324 VanDerWaalsContact C-N 3.31Å; E322-L324 PolarHBondContact O-N 3.44Å; E322-G325 CarbonylContact O-C 3.59Å; E322-G325 WeakPolarHBondContact O-CA 3.44Å; E322-G325 PolarHBondContact O-N 3.42Å; E322-E326 PolarHBondContact O-N 2.78Å; E322-S563 WeakPolarHBondContact CA-OG 3.42Å; E322-S563 WeakPolarHBondContact CG-OG 3.41Å; E322-H567 IonicContact OE1-CD2 3.82Å; E322-H567 IonicContact OE1-CE1 3.15Å; E322-H567 PolarHBondContact OE1-CE1 2.82Å; E322-H567 VanDerWaalsContact OE1-CE1 3.29Å; E322-H567 IonicContact OE1-NE2 2.98Å; E322-H567 PolarHBondContact OE1-NE2 3.5Å
323	T	88.8	Confident	87.1	Confident	69 Å²	69	41.4 Å²	41.4	42%	0.423	22%	0.215	S	C	.	.	H	α-helix	trans	-61.7	-42	179.8	-54	0	0	0	0	110.8	V319 Q320 G325 E326 F327	V319-T323 WeakPolarHBondContact O-CB 3.19Å; V319-T323 PolarHBondContact O-N 3.27Å; V319-T323 PolarHBondContact O-OG1 3.32Å; Q320-T323 PolarHBondContact O-N 3.06Å; T323-G325 VanDerWaalsContact C-N 3.32Å; T323-G325 PolarHBondContact O-N 2.84Å; T323-E326 PolarHBondContact O-N 3.04Å; T323-F327 WeakPolarHBondContact O-CD2 3.08Å
324	L	90.9	Very high	87.1	Confident	48 Å²	48	36.7 Å²	36.7	25%	0.251	19%	0.19	S	C	.	.	H	α-helix	trans	-66.4	-36.2	174.4	-171.6	62.8	0	0	0	111.9	F271 I275 Q320 V321 E322 E326 F327 L556 I559	F271-L324 HydrophobicContact CZ-CD2 4.09Å; I275-L324 HydrophobicContact CD1-CD2 3.71Å; I275-L324 HydrophobicContact CG1-CD2 4.33Å; Q320-L324 PolarHBondContact O-N 3.46Å; V321-L324 PolarHBondContact O-N 3.26Å; E322-L324 VanDerWaalsContact C-N 3.31Å; E322-L324 PolarHBondContact O-N 3.44Å; L324-E326 VanDerWaalsContact C-N 3.3Å; L324-E326 PolarHBondContact O-N 2.9Å; L324-F327 WeakPolarHBondContact O-CB 3.48Å; L324-F327 PolarHBondContact O-N 3.48Å; L324-L556 HydrophobicContact CD1-CD2 4.15Å; L324-L556 HydrophobicContact CG-CD2 4.36Å; L324-I559 HydrophobicContact CB-CG2 4.34Å; L324-I559 HydrophobicContact CD2-CD1 3.55Å; L324-I559 HydrophobicContact CD2-CG2 4.28Å; L324-I559 HydrophobicContact CG-CD1 4.07Å; L324-I559 HydrophobicContact CG-CG2 4.3Å
325	G	87.4	Confident	87	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.3	-32.7	172.7	0	0	0	0	0	113.6	V321 E322 T323 F327 G328 V329 F560	V321-G325 PolarHBondContact O-N 3.15Å; E322-G325 CarbonylContact O-C 3.59Å; E322-G325 WeakPolarHBondContact O-CA 3.44Å; E322-G325 PolarHBondContact O-N 3.42Å; T323-G325 VanDerWaalsContact C-N 3.32Å; T323-G325 PolarHBondContact O-N 2.84Å; G325-F327 VanDerWaalsContact C-N 3.27Å; G325-F327 PolarHBondContact O-N 3.46Å; G325-G328 WeakPolarHBondContact O-CA 3.49Å; G325-G328 PolarHBondContact O-N 3.04Å; G325-V329 PolarHBondContact O-N 2.9Å; G325-F560 WeakPolarHBondContact O-CB 3.09Å; G325-F560 WeakPolarHBondContact O-CD2 3.31Å
326	E	84.3	Confident	86.5	Confident	43 Å²	43	35.6 Å²	35.6	20%	0.201	18%	0.182	C	C	.	.	H	α-helix	trans	-61.7	-34.9	176	-66.7	-165.9	143.8	0	0	112	E322 T323 L324 G328 V329 F330 R631 R634	E322-E326 PolarHBondContact O-N 2.78Å; T323-E326 PolarHBondContact O-N 3.04Å; L324-E326 VanDerWaalsContact C-N 3.3Å; L324-E326 PolarHBondContact O-N 2.9Å; E326-G328 PolarHBondContact O-N 3.15Å; E326-V329 WeakPolarHBondContact O-CB 3.44Å; E326-V329 PolarHBondContact O-N 2.91Å; E326-F330 PolarHBondContact O-N 3.37Å; E326-F330 VanDerWaalsContact O-N 3.13Å; E326-R631 IonicContact OE1-CZ 3.75Å; E326-R631 IonicContact OE1-NE 3.63Å; E326-R631 PolarHBondContact OE1-NE 2.9Å; E326-R631 VanDerWaalsContact OE1-NE 3.1Å; E326-R631 IonicContact OE1-NH2 3.5Å; E326-R631 PolarHBondContact OE1-NH2 2.71Å; E326-R631 IonicContact OE2-NH2 3.47Å; E326-R634 IonicContact OE1-NH1 3.29Å; E326-R634 PolarHBondContact OE1-NH1 3.37Å; E326-R634 IonicContact OE2-NH1 2.62Å
327	F	89.3	Confident	86.3	Confident	78 Å²	78	28.7 Å²	28.7	34%	0.342	15%	0.152	S	C	.	.	H	α-helix	trans	-61.3	-34.5	172.1	-73.5	-86.3	0	0	0	112.2	T323 L324 G325 V329 F330 F331 F510 L556	T323-F327 WeakPolarHBondContact O-CD2 3.08Å; L324-F327 WeakPolarHBondContact O-CB 3.48Å; L324-F327 PolarHBondContact O-N 3.48Å; G325-F327 VanDerWaalsContact C-N 3.27Å; G325-F327 PolarHBondContact O-N 3.46Å; F327-V329 VanDerWaalsContact C-N 3.25Å; F327-V329 PolarHBondContact O-N 3.48Å; F327-F330 HydrophobicContact CD1-CD2 4.02Å; F327-F330 HydrophobicContact CD1-CE2 4.5Å; F327-F330 HydrophobicContact CG-CD2 4.41Å; F327-F330 WeakPolarHBondContact O-CB 3.45Å; F327-F330 PolarHBondContact O-N 2.94Å; F327-F330 VanDerWaalsContact O-N 3.15Å; F327-F331 VanDerWaalsContact O-CD2 3.26Å; F327-F331 WeakPolarHBondContact O-CD2 3.45Å; F327-F331 PolarHBondContact O-N 3.01Å; F327-F510 HydrophobicContact CD1-CE1 4.24Å; F327-F510 HydrophobicContact CE1-CE1 4.11Å; F327-F510 HydrophobicContact CE1-CZ 4.48Å; F327-L556 HydrophobicContact CB-CD1 4.11Å; F327-L556 HydrophobicContact CB-CD2 4.44Å
328	G	88.3	Confident	86.1	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-59.3	-37.1	173.8	0	0	0	0	0	112.9	G325 E326 T332	G325-G328 WeakPolarHBondContact O-CA 3.49Å; G325-G328 PolarHBondContact O-N 3.04Å; E326-G328 PolarHBondContact O-N 3.15Å; G328-T332 VanDerWaalsContact O-CB 3.31Å; G328-T332 WeakPolarHBondContact O-CB 3.38Å; G328-T332 PolarHBondContact O-N 3.41Å; G328-T332 PolarHBondContact O-OG1 2.89Å
329	V	82.4	Confident	85.6	Confident	6 Å²	6	29.4 Å²	29.4	4%	0.036	15%	0.152	C	C	.	.	H	α-helix	trans	-67.1	-44.5	174.2	-177.4	0	0	0	0	110.9	G325 E326 F327 F331 T332 L333 F560 V627	G325-V329 PolarHBondContact O-N 2.9Å; E326-V329 WeakPolarHBondContact O-CB 3.44Å; E326-V329 PolarHBondContact O-N 2.91Å; F327-V329 VanDerWaalsContact C-N 3.25Å; F327-V329 PolarHBondContact O-N 3.48Å; V329-F331 PolarHBondContact O-N 3.09Å; V329-T332 PolarHBondContact O-N 3.05Å; V329-L333 HydrophobicContact CG1-CD1 3.93Å; V329-L333 HydrophobicContact CG1-CG 4.3Å; V329-L333 WeakPolarHBondContact O-CG 3.4Å; V329-L333 PolarHBondContact O-N 3.48Å; V329-F560 HydrophobicContact CG2-CD1 4.29Å; V329-F560 HydrophobicContact CG2-CD2 3.41Å; V329-F560 VanDerWaalsContact CG2-CD2 3.41Å; V329-F560 HydrophobicContact CG2-CE1 4.13Å; V329-F560 HydrophobicContact CG2-CE2 3.24Å; V329-F560 HydrophobicContact CG2-CG 3.96Å; V329-F560 HydrophobicContact CG2-CZ 3.63Å; V329-V627 HydrophobicContact CG1-CG1 3.86Å; V329-V627 HydrophobicContact CG1-CG2 3.9Å; V329-V627 HydrophobicContact CG2-CG1 4.44Å; V329-V627 HydrophobicContact CG2-CG2 3.75Å
330	F	87.4	Confident	84.8	Confident	9 Å²	9	26 Å²	26	4%	0.039	13%	0.129	C	C	.	.	H	α-helix	trans	-57.9	-49.2	178.9	-62.6	-22.3	0	0	0	112.2	E326 F327 T332 L333 F334 L513 M523 E524 C527	E326-F330 PolarHBondContact O-N 3.37Å; E326-F330 VanDerWaalsContact O-N 3.13Å; F327-F330 HydrophobicContact CD1-CD2 4.02Å; F327-F330 HydrophobicContact CD1-CE2 4.5Å; F327-F330 HydrophobicContact CG-CD2 4.41Å; F327-F330 WeakPolarHBondContact O-CB 3.45Å; F327-F330 PolarHBondContact O-N 2.94Å; F327-F330 VanDerWaalsContact O-N 3.15Å; F330-T332 VanDerWaalsContact C-N 3.34Å; F330-T332 PolarHBondContact O-N 2.93Å; F330-L333 PolarHBondContact O-N 3.14Å; F330-F334 WeakPolarHBondContact O-CB 3.29Å; F330-F334 PolarHBondContact O-N 3.47Å; F330-L513 HydrophobicContact CD1-CD1 4.47Å; F330-L513 HydrophobicContact CD2-CD1 3.68Å; F330-L513 HydrophobicContact CE1-CD1 4.45Å; F330-L513 HydrophobicContact CE2-CD1 3.67Å; F330-L513 HydrophobicContact CG-CD1 4.11Å; F330-L513 HydrophobicContact CZ-CD1 4.08Å; F330-M523 HydrophobicContact CE1-CB 3.93Å; F330-M523 HydrophobicContact CZ-CB 4.02Å; F330-M523 HydrophobicContact CZ-SD 4.02Å; F330-E524 HydrophobicContact CD1-CG 4.45Å; F330-E524 HydrophobicContact CE1-CG 4.25Å; F330-E524 WeakPolarHBondContact CE1-OE1 3.4Å; F330-C527 HydrophobicContact CB-CB 4.46Å; F330-C527 WeakPolarHBondContact O-CB 3.18Å
331	F	89.4	Confident	83.5	Confident	10 Å²	10	23.1 Å²	23.1	4%	0.044	12%	0.118	C	C	.	.	H	α-helix	trans	-68.8	-32.2	177.9	-76.8	-77.6	0	0	0	112.8	F327 V329 L335 I509 F510 I549 I552 R553 L556	F327-F331 VanDerWaalsContact O-CD2 3.26Å; F327-F331 WeakPolarHBondContact O-CD2 3.45Å; F327-F331 PolarHBondContact O-N 3.01Å; V329-F331 PolarHBondContact O-N 3.09Å; F331-L335 PolarHBondContact O-N 3.48Å; F331-I509 HydrophobicContact CD1-CD1 4.1Å; F331-I509 HydrophobicContact CE1-CD1 3.87Å; F331-F510 HydrophobicContact CE2-CE1 4.48Å; F331-F510 HydrophobicContact CE2-CZ 4.38Å; F331-F510 HydrophobicContact CZ-CE1 4.34Å; F331-F510 HydrophobicContact CZ-CZ 4.06Å; F331-I549 HydrophobicContact CD1-CD1 4.33Å; F331-I549 HydrophobicContact CD1-CG2 3.98Å; F331-I549 HydrophobicContact CE1-CD1 4.12Å; F331-I552 HydrophobicContact CD1-CG2 4.34Å; F331-I552 HydrophobicContact CD2-CG2 4.31Å; F331-I552 HydrophobicContact CE1-CG2 4.22Å; F331-I552 HydrophobicContact CE2-CG2 4.21Å; F331-I552 HydrophobicContact CG-CG2 4.38Å; F331-I552 HydrophobicContact CZ-CG2 4.16Å; F331-R553 HydrophobicContact CB-CB 4.13Å; F331-L556 HydrophobicContact CD2-CD1 3.35Å; F331-L556 HydrophobicContact CE2-CD1 3.7Å; F331-L556 HydrophobicContact CG-CD1 4.27Å
332	T	84.4	Confident	82.2	Confident	26 Å²	26	25.3 Å²	25.3	16%	0.16	13%	0.132	C	C	.	.	H	α-helix	trans	-64.7	-49.3	174	-61.1	0	0	0	0	111	G328 V329 F330 F334 L335 V336 F624	G328-T332 VanDerWaalsContact O-CB 3.31Å; G328-T332 WeakPolarHBondContact O-CB 3.38Å; G328-T332 PolarHBondContact O-N 3.41Å; G328-T332 PolarHBondContact O-OG1 2.89Å; V329-T332 PolarHBondContact O-N 3.05Å; F330-T332 VanDerWaalsContact C-N 3.34Å; F330-T332 PolarHBondContact O-N 2.93Å; T332-F334 VanDerWaalsContact C-N 3.32Å; T332-F334 PolarHBondContact O-N 3.16Å; T332-L335 PolarHBondContact O-N 3.03Å; T332-L335 VanDerWaalsContact O-N 3.16Å; T332-V336 WeakPolarHBondContact O-CG2 3.35Å; T332-V336 PolarHBondContact O-N 3.05Å; T332-F624 HydrophobicContact CG2-CE1 4.19Å; T332-F624 HydrophobicContact CG2-CZ 4.01Å
333	L	82.3	Confident	81.2	Confident	3 Å²	3	27.5 Å²	27.5	2%	0.016	14%	0.142	C	C	.	.	H	α-helix	trans	-66.8	-34.2	179	-72.3	175.8	0	0	0	112.7	V329 F330 V336 G337 E524 F624	V329-L333 HydrophobicContact CG1-CD1 3.93Å; V329-L333 HydrophobicContact CG1-CG 4.3Å; V329-L333 WeakPolarHBondContact O-CG 3.4Å; V329-L333 PolarHBondContact O-N 3.48Å; F330-L333 PolarHBondContact O-N 3.14Å; L333-V336 PolarHBondContact O-N 3.47Å; L333-G337 PolarHBondContact O-N 3.5Å; L333-E524 HydrophobicContact CD1-CB 3.44Å; L333-E524 VanDerWaalsContact CD1-CB 3.44Å; L333-E524 HydrophobicContact CD1-CG 3.72Å; L333-F624 HydrophobicContact CD2-CD1 4.35Å; L333-F624 HydrophobicContact CD2-CE1 3.67Å; L333-F624 HydrophobicContact CD2-CZ 3.97Å; L333-F624 HydrophobicContact CG-CE1 4.24Å
334	F	88.3	Confident	79.9	Confident	0 Å²	0	32 Å²	32	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-58.9	-47.7	170.2	168.7	-103.3	0	0	0	111.7	F330 T332 V336 G337 L338 I505 I509 C527 A530 G531 I534 I545 I549	F330-F334 WeakPolarHBondContact O-CB 3.29Å; F330-F334 PolarHBondContact O-N 3.47Å; T332-F334 VanDerWaalsContact C-N 3.32Å; T332-F334 PolarHBondContact O-N 3.16Å; F334-V336 VanDerWaalsContact C-N 3.34Å; F334-V336 PolarHBondContact O-N 3.05Å; F334-G337 CarbonylContact O-C 3.48Å; F334-G337 WeakPolarHBondContact O-CA 3.33Å; F334-G337 PolarHBondContact O-N 3.47Å; F334-G337 VanDerWaalsContact O-N 3.09Å; F334-L338 HydrophobicContact CD1-CD1 3.94Å; F334-L338 HydrophobicContact CD1-CG 4.47Å; F334-L338 HydrophobicContact CE1-CD1 3.22Å; F334-L338 HydrophobicContact CE1-CG 3.93Å; F334-L338 HydrophobicContact CE2-CD1 4.32Å; F334-L338 HydrophobicContact CE2-CD2 4.36Å; F334-L338 HydrophobicContact CE2-CG 4.18Å; F334-L338 HydrophobicContact CZ-CD1 3.46Å; F334-L338 VanDerWaalsContact CZ-CD1 3.46Å; F334-L338 HydrophobicContact CZ-CD2 3.99Å; F334-L338 HydrophobicContact CZ-CG 3.77Å; F334-L338 PolarHBondContact O-N 3.28Å; F334-I505 HydrophobicContact CE1-CG2 3.97Å; F334-I505 HydrophobicContact CE2-CG2 4.4Å; F334-I505 HydrophobicContact CZ-CG2 3.55Å; F334-I509 HydrophobicContact CB-CD1 4.22Å; F334-I509 HydrophobicContact CD1-CD1 3.54Å; F334-I509 HydrophobicContact CD1-CG1 4.33Å; F334-I509 HydrophobicContact CD2-CD1 3.65Å; F334-I509 HydrophobicContact CD2-CG1 3.47Å; F334-I509 VanDerWaalsContact CD2-CG1 3.47Å; F334-I509 HydrophobicContact CE1-CD1 3.68Å; F334-I509 HydrophobicContact CE1-CG1 4.42Å; F334-I509 HydrophobicContact CE2-CD1 3.79Å; F334-I509 HydrophobicContact CE2-CG1 3.59Å; F334-I509 HydrophobicContact CG-CD1 3.49Å; F334-I509 VanDerWaalsContact CG-CD1 3.49Å; F334-I509 HydrophobicContact CG-CG1 3.85Å; F334-I509 HydrophobicContact CZ-CD1 3.8Å; F334-I509 HydrophobicContact CZ-CG1 4.07Å; F334-C527 WeakPolarHBondContact CA-O 3.36Å; F334-C527 HydrophobicContact CB-CB 4.37Å; F334-A530 HydrophobicContact CD2-CB 4.1Å; F334-A530 HydrophobicContact CE2-CB 4.3Å; F334-G531 VanDerWaalsContact CE2-CA 3.49Å; F334-I534 HydrophobicContact CE2-CD1 3.94Å; F334-I534 HydrophobicContact CZ-CD1 4.03Å; F334-I545 HydrophobicContact CE1-CG2 4.29Å; F334-I545 HydrophobicContact CZ-CG2 4.1Å; F334-I549 HydrophobicContact CD1-CG2 3.93Å; F334-I549 HydrophobicContact CE1-CB 4.32Å; F334-I549 HydrophobicContact CE1-CD1 4.24Å; F334-I549 HydrophobicContact CE1-CG1 3.96Å; F334-I549 HydrophobicContact CE1-CG2 4Å
335	L	85.7	Confident	78.7	Confident	3 Å²	3	30.2 Å²	30.2	2%	0.016	14%	0.142	C	C	.	.	H	α-helix	trans	-66.5	-37.3	179.7	-157.8	77.2	0	0	0	112.1	F331 T332 G337 L338 E339 M546 I549 E550	F331-L335 PolarHBondContact O-N 3.48Å; T332-L335 PolarHBondContact O-N 3.03Å; T332-L335 VanDerWaalsContact O-N 3.16Å; L335-G337 VanDerWaalsContact C-N 3.27Å; L335-G337 PolarHBondContact O-N 3.32Å; L335-L338 HydrophobicContact CD1-CD1 3.72Å; L335-L338 WeakPolarHBondContact O-CA 3.42Å; L335-L338 WeakPolarHBondContact O-CB 3.32Å; L335-L338 PolarHBondContact O-N 3.34Å; L335-E339 WeakPolarHBondContact O-CG 3.13Å; L335-E339 PolarHBondContact O-N 3.37Å; L335-M546 HydrophobicContact CD1-CB 4.18Å; L335-M546 HydrophobicContact CD1-CG 3.79Å; L335-M546 HydrophobicContact CD2-CE 4.27Å; L335-M546 HydrophobicContact CG-CG 4.48Å; L335-I549 HydrophobicContact CD1-CG2 4.48Å; L335-E550 HydrophobicContact CD1-CG 4.45Å; L335-E550 HydrophobicContact CD2-CG 3.97Å
336	V	78.7	Confident	77.9	Confident	13 Å²	13	38.1 Å²	38.1	8%	0.079	17%	0.172	C	C	.	.	H	α-helix	trans	-60.3	-40.2	170.9	174.3	0	0	0	0	111	T332 L333 F334 L338 E339 F340 D426 F528 F624	T332-V336 WeakPolarHBondContact O-CG2 3.35Å; T332-V336 PolarHBondContact O-N 3.05Å; L333-V336 PolarHBondContact O-N 3.47Å; F334-V336 VanDerWaalsContact C-N 3.34Å; F334-V336 PolarHBondContact O-N 3.05Å; V336-L338 VanDerWaalsContact C-N 3.31Å; V336-L338 PolarHBondContact O-N 2.87Å; V336-E339 PolarHBondContact O-N 3.15Å; V336-F340 PolarHBondContact O-N 3.18Å; V336-F340 VanDerWaalsContact O-N 3.15Å; V336-D426 HydrophobicContact CG1-CB 3.65Å; V336-F528 HydrophobicContact CG1-CD2 4.46Å; V336-F528 HydrophobicContact CG1-CE2 4.27Å; V336-F624 HydrophobicContact CG2-CZ 4.46Å
337	G	80	Confident	77.2	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.2	-36.1	171.3	0	0	0	0	0	113.1	L333 F334 L335 F340 G531 A532	L333-G337 PolarHBondContact O-N 3.5Å; F334-G337 CarbonylContact O-C 3.48Å; F334-G337 WeakPolarHBondContact O-CA 3.33Å; F334-G337 PolarHBondContact O-N 3.47Å; F334-G337 VanDerWaalsContact O-N 3.09Å; L335-G337 VanDerWaalsContact C-N 3.27Å; L335-G337 PolarHBondContact O-N 3.32Å; G337-F340 VanDerWaalsContact O-CB 3.3Å; G337-F340 WeakPolarHBondContact O-CB 3.12Å; G337-F340 PolarHBondContact O-N 3.04Å; G337-G531 CarbonylContact O-C 3.49Å; G337-G531 VanDerWaalsContact O-C 3.24Å; G337-A532 VanDerWaalsContact O-CA 3.23Å; G337-A532 WeakPolarHBondContact O-CA 3.39Å; G337-A532 PolarHBondContact O-N 3.2Å; G337-A532 VanDerWaalsContact O-N 3.15Å
338	L	81.6	Confident	76.4	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-69	-41.3	174.4	-73.5	173.7	0	0	0	112.5	F334 L335 V336 F340 G531 I534 S535 T542 I545	F334-L338 HydrophobicContact CD1-CD1 3.94Å; F334-L338 HydrophobicContact CD1-CG 4.47Å; F334-L338 HydrophobicContact CE1-CD1 3.22Å; F334-L338 HydrophobicContact CE1-CG 3.93Å; F334-L338 HydrophobicContact CE2-CD1 4.32Å; F334-L338 HydrophobicContact CE2-CD2 4.36Å; F334-L338 HydrophobicContact CE2-CG 4.18Å; F334-L338 HydrophobicContact CZ-CD1 3.46Å; F334-L338 VanDerWaalsContact CZ-CD1 3.46Å; F334-L338 HydrophobicContact CZ-CD2 3.99Å; F334-L338 HydrophobicContact CZ-CG 3.77Å; F334-L338 PolarHBondContact O-N 3.28Å; L335-L338 HydrophobicContact CD1-CD1 3.72Å; L335-L338 WeakPolarHBondContact O-CA 3.42Å; L335-L338 WeakPolarHBondContact O-CB 3.32Å; L335-L338 PolarHBondContact O-N 3.34Å; V336-L338 VanDerWaalsContact C-N 3.31Å; V336-L338 PolarHBondContact O-N 2.87Å; L338-F340 PolarHBondContact O-N 2.73Å; L338-G531 WeakPolarHBondContact CD2-O 3.49Å; L338-I534 HydrophobicContact CD2-CB 3.7Å; L338-I534 HydrophobicContact CD2-CG2 3.4Å; L338-I534 VanDerWaalsContact CD2-CG2 3.4Å; L338-S535 VanDerWaalsContact O-CB 3.25Å; L338-S535 WeakPolarHBondContact O-CB 3.43Å; L338-T542 HydrophobicContact CB-CG2 4.12Å; L338-T542 HydrophobicContact CD2-CG2 4.45Å; L338-T542 VanDerWaalsContact O-CG2 3.32Å; L338-T542 WeakPolarHBondContact O-CG2 3.08Å; L338-I545 HydrophobicContact CD1-CG2 3.64Å; L338-I545 HydrophobicContact CD2-CG2 4.2Å
339	E	75.3	Confident	76	Confident	76 Å²	76	47.5 Å²	47.5	36%	0.355	21%	0.21	S	C	.	.	H	α-helix	trans	-63.9	-22.6	176.5	-72.4	-178.3	-177.8	0	0	112.3	L335 V336 S341 M546	L335-E339 WeakPolarHBondContact O-CG 3.13Å; L335-E339 PolarHBondContact O-N 3.37Å; V336-E339 PolarHBondContact O-N 3.15Å; E339-S341 VanDerWaalsContact C-N 3.32Å; E339-S341 PolarHBondContact O-N 3.05Å; E339-M546 HydrophobicContact CG-CE 4.36Å
340	F	69.4	Low	76.1	Confident	32 Å²	32	54.8 Å²	54.8	14%	0.14	24%	0.241	C	C	.	.			trans	-66.2	86.2	170.9	-172.6	-97	0	0	0	110.9	V336 G337 L338 P342 L345 W349 V423 M424 V427 A532 S535	V336-F340 PolarHBondContact O-N 3.18Å; V336-F340 VanDerWaalsContact O-N 3.15Å; G337-F340 VanDerWaalsContact O-CB 3.3Å; G337-F340 WeakPolarHBondContact O-CB 3.12Å; G337-F340 PolarHBondContact O-N 3.04Å; L338-F340 PolarHBondContact O-N 2.73Å; F340-P342 HydrophobicContact CD1-CG 4.48Å; F340-P342 HydrophobicContact CE1-CG 4.24Å; F340-P342 WeakPolarHBondContact O-CD 3.36Å; F340-L345 HydrophobicContact CD2-CD2 4.46Å; F340-L345 HydrophobicContact CE2-CD2 3.82Å; F340-L345 HydrophobicContact CZ-CD2 4.49Å; F340-W349 HydrophobicContact CZ-CH2 4.35Å; F340-W349 HydrophobicContact CZ-CZ3 4.11Å; F340-V423 HydrophobicContact CB-CG1 4.32Å; F340-V423 HydrophobicContact CD2-CG1 3.54Å; F340-V423 HydrophobicContact CE2-CG1 4.37Å; F340-V423 HydrophobicContact CG-CG1 4.42Å; F340-M424 HydrophobicContact CE2-CE 4.01Å; F340-M424 HydrophobicContact CE2-SD 4.44Å; F340-M424 HydrophobicContact CZ-CE 4.41Å; F340-V427 HydrophobicContact CD2-CG2 4.15Å; F340-V427 HydrophobicContact CE2-CG2 4.18Å; F340-A532 HydrophobicContact CD1-CB 4.27Å; F340-S535 WeakPolarHBondContact O-CB 3.3Å; F340-S535 PolarHBondContact O-OG 3.21Å
341	S	63.3	Low	75.9	Confident	19 Å²	19	55.4 Å²	55.4	13%	0.133	25%	0.245	C	C	.	.			trans	-90.6	116	166.6	164.4	0	0	0	0	110.3	E339 E343 R344 L345	E339-S341 VanDerWaalsContact C-N 3.32Å; E339-S341 PolarHBondContact O-N 3.05Å; S341-E343 PolarHBondContact O-N 3.38Å; S341-E343 PolarHBondContact OG-N 2.64Å; S341-E343 PolarHBondContact OG-OE2 3.46Å; S341-R344 PolarHBondContact O-N 3.17Å; S341-R344 PolarHBondContact OG-N 3.02Å; S341-L345 PolarHBondContact O-N 3.08Å
342	P	63.6	Low	75.7	Confident	46 Å²	46	55 Å²	55	30%	0.299	24%	0.243	S	C	.	.	H	α-helix	trans	-61.4	-25.1	174.2	-19.6	31.2	0	0	0	113	F340	F340-P342 HydrophobicContact CD1-CG 4.48Å; F340-P342 HydrophobicContact CE1-CG 4.24Å; F340-P342 WeakPolarHBondContact O-CD 3.36Å
343	E	64.4	Low	75.8	Confident	94 Å²	94	57.2 Å²	57.2	44%	0.439	25%	0.254	S	S	.	.	H	α-helix	trans	-72.2	-47	176.4	-59.8	84.8	-153.2	0	0	112.2	S341 L345 R346	S341-E343 PolarHBondContact O-N 3.38Å; S341-E343 PolarHBondContact OG-N 2.64Å; S341-E343 PolarHBondContact OG-OE2 3.46Å; E343-L345 VanDerWaalsContact C-N 3.31Å; E343-L345 PolarHBondContact O-N 3.5Å; E343-R346 WeakPolarHBondContact O-CB 3.35Å; E343-R346 PolarHBondContact O-N 3.43Å
344	R	60.9	Low	76.1	Confident	163 Å²	163	61.2 Å²	61.2	62%	0.615	27%	0.273	S	S	*	.	H	α-helix	trans	-65	-37.6	-178.3	-71.3	-179	174.3	-174.7	-5.9	111.7	S341 R346 H539	S341-R344 PolarHBondContact O-N 3.17Å; S341-R344 PolarHBondContact OG-N 3.02Å; R344-R346 VanDerWaalsContact C-N 3.29Å; R344-R346 PolarHBondContact O-N 3.5Å; R344-H539 PolarHBondContact NH2-NE2 3.2Å
345	L	66.6	Low	76.2	Confident	12 Å²	12	61.2 Å²	61.2	6%	0.063	27%	0.273	C	S	.	.	H	α-helix	trans	-75.8	-16.7	-178.1	-154	57.8	0	0	0	113.6	F340 S341 E343 K347 V348 W349 S352 G420 M424	F340-L345 HydrophobicContact CD2-CD2 4.46Å; F340-L345 HydrophobicContact CE2-CD2 3.82Å; F340-L345 HydrophobicContact CZ-CD2 4.49Å; S341-L345 PolarHBondContact O-N 3.08Å; E343-L345 VanDerWaalsContact C-N 3.31Å; E343-L345 PolarHBondContact O-N 3.5Å; L345-K347 VanDerWaalsContact C-N 3.28Å; L345-K347 PolarHBondContact O-N 3.02Å; L345-V348 HydrophobicContact CD1-CG2 4.14Å; L345-V348 CarbonylContact O-C 3.38Å; L345-V348 PolarHBondContact O-N 3.27Å; L345-V348 VanDerWaalsContact O-N 3.16Å; L345-W349 HydrophobicContact CB-CE3 4.1Å; L345-W349 HydrophobicContact CD2-CE3 3.77Å; L345-W349 HydrophobicContact CD2-CZ3 3.77Å; L345-W349 HydrophobicContact CG-CE3 3.87Å; L345-W349 HydrophobicContact CG-CZ3 4.34Å; L345-W349 VanDerWaalsContact O-CA 3.23Å; L345-W349 WeakPolarHBondContact O-CA 3.33Å; L345-W349 WeakPolarHBondContact O-CB 3.16Å; L345-W349 PolarHBondContact O-N 2.95Å; L345-S352 WeakPolarHBondContact CD1-OG 3.4Å; L345-G420 VanDerWaalsContact CD1-CA 3.44Å; L345-M424 HydrophobicContact CD2-CE 3.28Å; L345-M424 HydrophobicContact CD2-CG 4.2Å; L345-M424 HydrophobicContact CD2-SD 4.41Å; L345-M424 HydrophobicContact CG-CE 4.43Å
346	R	70.5	Confident	76.4	Confident	166 Å²	166	61.2 Å²	61.2	63%	0.626	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-35.6	-174.3	-162	176.6	-55.2	152.8	7.4	113.5	E343 R344 V348	E343-R346 WeakPolarHBondContact O-CB 3.35Å; E343-R346 PolarHBondContact O-N 3.43Å; R344-R346 VanDerWaalsContact C-N 3.29Å; R344-R346 PolarHBondContact O-N 3.5Å; R346-V348 VanDerWaalsContact C-N 3.33Å; R346-V348 PolarHBondContact O-N 2.94Å
347	K	68.5	Low	77	Confident	199 Å²	199	63.2 Å²	63.2	87%	0.865	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-33.8	180	-69.4	-175.7	-179.7	-179.7	0	112.7	L345	L345-K347 VanDerWaalsContact C-N 3.28Å; L345-K347 PolarHBondContact O-N 3.02Å
348	V	73.7	Confident	77.6	Confident	14 Å²	14	68.6 Å²	68.6	9%	0.085	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	14.1	-176.7	-64.9	0	0	0	0	113.1	L345 R346 K350 I351 S352 V417	L345-V348 HydrophobicContact CD1-CG2 4.14Å; L345-V348 CarbonylContact O-C 3.38Å; L345-V348 PolarHBondContact O-N 3.27Å; L345-V348 VanDerWaalsContact O-N 3.16Å; R346-V348 VanDerWaalsContact C-N 3.33Å; R346-V348 PolarHBondContact O-N 2.94Å; V348-K350 VanDerWaalsContact C-N 3.31Å; V348-K350 PolarHBondContact O-N 3.46Å; V348-K350 VanDerWaalsContact O-N 3.17Å; V348-I351 PolarHBondContact O-N 3.45Å; V348-S352 VanDerWaalsContact O-CB 3.28Å; V348-S352 WeakPolarHBondContact O-CB 3.23Å; V348-S352 PolarHBondContact O-N 3.33Å; V348-V417 HydrophobicContact CG1-CG2 3.99Å
349	W	80.1	Confident	78.1	Confident	104 Å²	104	68.8 Å²	68.8	39%	0.394	31%	0.309	S	S	.	.	H	α-helix	trans	-54.4	-43	-168.7	179.2	-91.8	0	0	0	113.3	F340 L345 I351 S352 L353 M424	F340-W349 HydrophobicContact CZ-CH2 4.35Å; F340-W349 HydrophobicContact CZ-CZ3 4.11Å; L345-W349 HydrophobicContact CB-CE3 4.1Å; L345-W349 HydrophobicContact CD2-CE3 3.77Å; L345-W349 HydrophobicContact CD2-CZ3 3.77Å; L345-W349 HydrophobicContact CG-CE3 3.87Å; L345-W349 HydrophobicContact CG-CZ3 4.34Å; L345-W349 VanDerWaalsContact O-CA 3.23Å; L345-W349 WeakPolarHBondContact O-CA 3.33Å; L345-W349 WeakPolarHBondContact O-CB 3.16Å; L345-W349 PolarHBondContact O-N 2.95Å; W349-I351 PolarHBondContact O-N 2.86Å; W349-S352 PolarHBondContact O-N 3.12Å; W349-L353 HydrophobicContact CZ2-CD2 4.33Å; W349-L353 VanDerWaalsContact O-CB 3.24Å; W349-L353 WeakPolarHBondContact O-CB 3.18Å; W349-L353 PolarHBondContact O-N 3.44Å; W349-M424 HydrophobicContact CD2-CE 4.34Å; W349-M424 HydrophobicContact CE3-CE 3.8Å; W349-M424 HydrophobicContact CH2-CE 3.43Å; W349-M424 VanDerWaalsContact CH2-CE 3.43Å; W349-M424 HydrophobicContact CZ2-CE 4Å; W349-M424 HydrophobicContact CZ3-CE 3.32Å
350	K	83.2	Confident	78.9	Confident	159 Å²	159	66.2 Å²	66.2	69%	0.691	30%	0.298	S	S	*	.	H	α-helix	trans	-60.8	-47.3	179.5	-67.9	-175.2	179.5	-179.7	0	111.6	V348 Q354	V348-K350 VanDerWaalsContact C-N 3.31Å; V348-K350 PolarHBondContact O-N 3.46Å; V348-K350 VanDerWaalsContact O-N 3.17Å; K350-Q354 VanDerWaalsContact O-CB 3.23Å; K350-Q354 WeakPolarHBondContact O-CB 3.35Å; K350-Q354 VanDerWaalsContact O-CG 3.27Å; K350-Q354 WeakPolarHBondContact O-CG 3.2Å; K350-Q354 PolarHBondContact O-N 3.5Å
351	I	84.4	Confident	80	Confident	23 Å²	23	69.2 Å²	69.2	12%	0.118	32%	0.315	C	S	.	.	H	α-helix	trans	-69.2	-46	-178.7	-57.7	161.5	0	0	0	109.8	V348 W349 L353 G355 V417 I602 L603	V348-I351 PolarHBondContact O-N 3.45Å; W349-I351 PolarHBondContact O-N 2.86Å; I351-L353 VanDerWaalsContact C-N 3.32Å; I351-L353 PolarHBondContact O-N 3.14Å; I351-G355 PolarHBondContact O-N 3.29Å; I351-V417 HydrophobicContact CG2-CG1 3.92Å; I351-I602 HydrophobicContact CB-CG2 4.17Å; I351-I602 HydrophobicContact CG1-CG2 3.79Å; I351-I602 HydrophobicContact CG2-CG2 4.13Å; I351-L603 HydrophobicContact CG2-CD1 3.88Å
352	S	84.8	Confident	81.5	Confident	1 Å²	1	70.5 Å²	70.5	1%	0.007	32%	0.319	C	S	.	.	H	α-helix	trans	-61.5	-36	-179.4	178.9	0	0	0	0	113.1	L345 V348 W349 P356 G420 M424	L345-S352 WeakPolarHBondContact CD1-OG 3.4Å; V348-S352 VanDerWaalsContact O-CB 3.28Å; V348-S352 WeakPolarHBondContact O-CB 3.23Å; V348-S352 PolarHBondContact O-N 3.33Å; W349-S352 PolarHBondContact O-N 3.12Å; S352-P356 WeakPolarHBondContact O-CD 3.29Å; S352-P356 WeakPolarHBondContact O-CG 3.48Å; S352-G420 PolarHBondContact OG-O 3.15Å; S352-M424 VanDerWaalsContact O-CB 3.28Å; S352-M424 WeakPolarHBondContact O-CB 3.39Å; S352-M424 WeakPolarHBondContact O-CG 3.49Å; S352-M424 WeakPolarHBondContact OG-CG 3.17Å
353	L	86.1	Confident	82.9	Confident	73 Å²	73	68.5 Å²	68.5	38%	0.382	31%	0.306	S	S	.	.	H	α-helix	trans	-84.9	-46.7	179.1	-174.7	66	0	0	0	112.5	W349 I351 C357 M424	W349-L353 HydrophobicContact CZ2-CD2 4.33Å; W349-L353 VanDerWaalsContact O-CB 3.24Å; W349-L353 WeakPolarHBondContact O-CB 3.18Å; W349-L353 PolarHBondContact O-N 3.44Å; I351-L353 VanDerWaalsContact C-N 3.32Å; I351-L353 PolarHBondContact O-N 3.14Å; L353-C357 WeakPolarHBondContact O-CB 3.36Å; L353-M424 HydrophobicContact CD1-CE 4.18Å; L353-M424 HydrophobicContact CD1-SD 3.97Å
354	Q	89.4	Confident	84.3	Confident	87 Å²	87	65.8 Å²	65.8	41%	0.407	29%	0.294	S	S	.	.	H	α-helix	trans	-71.6	-39.8	-175.6	-69.4	177.8	-13.8	0	0	112.2	K350 C357 Y358 I602	K350-Q354 VanDerWaalsContact O-CB 3.23Å; K350-Q354 WeakPolarHBondContact O-CB 3.35Å; K350-Q354 VanDerWaalsContact O-CG 3.27Å; K350-Q354 WeakPolarHBondContact O-CG 3.2Å; K350-Q354 PolarHBondContact O-N 3.5Å; Q354-C357 PolarHBondContact O-N 2.96Å; Q354-Y358 HydrophobicContact CB-CD2 4.19Å; Q354-Y358 HydrophobicContact CB-CE2 3.95Å; Q354-Y358 WeakPolarHBondContact O-CD2 3.43Å; Q354-Y358 PolarHBondContact O-N 2.62Å; Q354-I602 HydrophobicContact CB-CD1 4.09Å
355	G	90.4	Very high	85.8	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-56.5	-62.2	-177	0	0	0	0	0	112.7	I351 C357 Y358 M359	I351-G355 PolarHBondContact O-N 3.29Å; G355-C357 VanDerWaalsContact C-N 3.29Å; G355-C357 PolarHBondContact O-N 3.08Å; G355-Y358 PolarHBondContact O-N 3.35Å; G355-M359 WeakPolarHBondContact O-CB 3.31Å; G355-M359 WeakPolarHBondContact O-CG 2.94Å; G355-M359 PolarHBondContact O-N 3.03Å
356	P	90.6	Very high	87	Confident	2 Å²	2	64.6 Å²	64.6	1%	0.013	30%	0.304	C	S	.	.	H	α-helix	trans	-57	-38.3	177.2	-30.6	41	0	0	0	113.6	S352 M359 T360 M421 M424 Q425 Q428	S352-P356 WeakPolarHBondContact O-CD 3.29Å; S352-P356 WeakPolarHBondContact O-CG 3.48Å; P356-M359 PolarHBondContact O-N 3.3Å; P356-T360 WeakPolarHBondContact O-CB 3.49Å; P356-T360 PolarHBondContact O-N 3.5Å; P356-T360 PolarHBondContact O-OG1 3.08Å; P356-T360 VanDerWaalsContact O-OG1 3.08Å; P356-M421 HydrophobicContact CG-CB 3.76Å; P356-M421 HydrophobicContact CG-CG 3.87Å; P356-M421 VanDerWaalsContact CG-O 3.3Å; P356-M421 WeakPolarHBondContact CG-O 3.33Å; P356-M421 HydrophobicContact CG-SD 4.45Å; P356-M424 HydrophobicContact CB-CB 4.44Å; P356-M424 HydrophobicContact CG-CB 3.98Å; P356-Q425 HydrophobicContact CB-CG 3.73Å; P356-Q425 HydrophobicContact CG-CG 4.17Å; P356-Q428 PolarHBondContact O-OE1 3.43Å
357	C	90.1	Very high	88.1	Confident	55 Å²	55	57.4 Å²	57.4	37%	0.372	28%	0.281	S	S	.	.	H	α-helix	trans	-63	-50.3	178.3	-170.7	0	0	0	0	111.5	L353 Q354 G355 M359 T360 I361	L353-C357 WeakPolarHBondContact O-CB 3.36Å; Q354-C357 PolarHBondContact O-N 2.96Å; G355-C357 VanDerWaalsContact C-N 3.29Å; G355-C357 PolarHBondContact O-N 3.08Å; C357-M359 VanDerWaalsContact C-N 3.33Å; C357-M359 PolarHBondContact O-N 3.3Å; C357-T360 PolarHBondContact O-N 3.38Å; C357-I361 WeakPolarHBondContact O-CB 3.33Å; C357-I361 VanDerWaalsContact O-CG1 3.27Å; C357-I361 WeakPolarHBondContact O-CG1 3.25Å; C357-I361 PolarHBondContact O-N 2.91Å
358	Y	92.8	Very high	89.2	Confident	114 Å²	114	51.1 Å²	51.1	45%	0.447	26%	0.257	S	S	.	.	H	α-helix	trans	-63.1	-40.2	175.3	-70	-49.8	0	0	0	112.1	Q354 G355 I361 L362 V598 I602	Q354-Y358 HydrophobicContact CB-CD2 4.19Å; Q354-Y358 HydrophobicContact CB-CE2 3.95Å; Q354-Y358 WeakPolarHBondContact O-CD2 3.43Å; Q354-Y358 PolarHBondContact O-N 2.62Å; G355-Y358 PolarHBondContact O-N 3.35Å; Y358-I361 PolarHBondContact O-N 3.47Å; Y358-L362 WeakPolarHBondContact O-CB 3.24Å; Y358-L362 WeakPolarHBondContact O-CD1 3.25Å; Y358-L362 PolarHBondContact O-N 2.94Å; Y358-V598 HydrophobicContact CD2-CG1 4.43Å; Y358-I602 HydrophobicContact CD2-CD1 4.17Å
359	M	93.1	Very high	90.1	Very high	6 Å²	6	56 Å²	56	3%	0.03	28%	0.282	C	S	.	.	H	α-helix	trans	-58	-51.1	176.4	-73.9	-75.2	-91.4	0	0	111.7	G355 P356 C357 I361 L362 M363 L594 A595 V598	G355-M359 WeakPolarHBondContact O-CB 3.31Å; G355-M359 WeakPolarHBondContact O-CG 2.94Å; G355-M359 PolarHBondContact O-N 3.03Å; P356-M359 PolarHBondContact O-N 3.3Å; C357-M359 VanDerWaalsContact C-N 3.33Å; C357-M359 PolarHBondContact O-N 3.3Å; M359-I361 PolarHBondContact O-N 3.13Å; M359-L362 PolarHBondContact O-N 3.31Å; M359-M363 WeakPolarHBondContact O-CB 3.19Å; M359-M363 WeakPolarHBondContact O-CG 3.43Å; M359-M363 PolarHBondContact O-N 3.41Å; M359-L594 HydrophobicContact SD-CB 3.97Å; M359-A595 HydrophobicContact CE-CB 3.31Å; M359-A595 WeakPolarHBondContact SD-CA 3.47Å; M359-A595 HydrophobicContact SD-CB 4.13Å; M359-A595 PolarHBondContact SD-N 3.08Å; M359-V598 HydrophobicContact CG-CB 4.27Å; M359-V598 HydrophobicContact CG-CG1 4.25Å; M359-V598 HydrophobicContact CG-CG2 4.13Å; M359-V598 HydrophobicContact SD-CB 4.19Å; M359-V598 HydrophobicContact SD-CG2 3.94Å
360	T	91.5	Very high	90.6	Very high	21 Å²	21	58.3 Å²	58.3	13%	0.129	29%	0.291	C	S	.	.	H	α-helix	trans	-63.5	-42.3	179.2	-61.5	0	0	0	0	111.9	P356 C357 M363 I364 S389 Q428	P356-T360 WeakPolarHBondContact O-CB 3.49Å; P356-T360 PolarHBondContact O-N 3.5Å; P356-T360 PolarHBondContact O-OG1 3.08Å; P356-T360 VanDerWaalsContact O-OG1 3.08Å; C357-T360 PolarHBondContact O-N 3.38Å; T360-M363 PolarHBondContact O-N 2.98Å; T360-I364 HydrophobicContact CG2-CD1 3.85Å; T360-I364 WeakPolarHBondContact O-CB 3.5Å; T360-I364 VanDerWaalsContact O-CG1 3.24Å; T360-I364 WeakPolarHBondContact O-CG1 3.15Å; T360-I364 PolarHBondContact O-N 3.5Å; T360-S389 VanDerWaalsContact CA-OG 3.3Å; T360-S389 WeakPolarHBondContact CA-OG 3.35Å; T360-S389 PolarHBondContact OG1-OG 3.45Å; T360-S389 VanDerWaalsContact OG1-OG 3.09Å; T360-Q428 PolarHBondContact OG1-OE1 3.41Å
361	I	92.1	Very high	90.9	Very high	96 Å²	96	50.9 Å²	50.9	49%	0.492	26%	0.259	S	S	.	.	H	α-helix	trans	-62.4	-46.2	176.3	-69.1	167.4	0	0	0	111.2	C357 Y358 M359 I364 A365	C357-I361 WeakPolarHBondContact O-CB 3.33Å; C357-I361 VanDerWaalsContact O-CG1 3.27Å; C357-I361 WeakPolarHBondContact O-CG1 3.25Å; C357-I361 PolarHBondContact O-N 2.91Å; Y358-I361 PolarHBondContact O-N 3.47Å; M359-I361 PolarHBondContact O-N 3.13Å; I361-I364 PolarHBondContact O-N 3.26Å; I361-A365 WeakPolarHBondContact O-CB 3.21Å; I361-A365 PolarHBondContact O-N 3.15Å
362	L	94.1	Very high	91.1	Very high	45 Å²	45	57.5 Å²	57.5	24%	0.236	29%	0.289	C	S	.	.	H	α-helix	trans	-65.6	-42.6	178.7	-90.6	75.9	0	0	0	111	Y358 M359 I364 A365 F366 L594 L597	Y358-L362 WeakPolarHBondContact O-CB 3.24Å; Y358-L362 WeakPolarHBondContact O-CD1 3.25Å; Y358-L362 PolarHBondContact O-N 2.94Å; M359-L362 PolarHBondContact O-N 3.31Å; L362-I364 VanDerWaalsContact C-N 3.34Å; L362-I364 PolarHBondContact O-N 3.43Å; L362-A365 PolarHBondContact O-N 3.25Å; L362-F366 WeakPolarHBondContact O-CD2 3.45Å; L362-F366 PolarHBondContact O-N 3.35Å; L362-L594 HydrophobicContact CB-CD1 4.13Å; L362-L594 HydrophobicContact CB-CD2 4.19Å; L362-L594 HydrophobicContact CD2-CD2 3.66Å; L362-L597 HydrophobicContact CD2-CD2 4.03Å
363	M	94.4	Very high	91.4	Very high	4 Å²	4	63.4 Å²	63.4	2%	0.02	32%	0.32	C	S	.	.	H	α-helix	trans	-57	-46.7	174.9	-76.1	-66	-60.8	0	0	111.6	M359 T360 F366 G367 S385 L388 M590 K591 L594	M359-M363 WeakPolarHBondContact O-CB 3.19Å; M359-M363 WeakPolarHBondContact O-CG 3.43Å; M359-M363 PolarHBondContact O-N 3.41Å; T360-M363 PolarHBondContact O-N 2.98Å; M363-F366 PolarHBondContact O-N 3.13Å; M363-G367 PolarHBondContact O-N 3.06Å; M363-S385 WeakPolarHBondContact O-CB 3.3Å; M363-L388 HydrophobicContact CE-CB 4.02Å; M363-M590 HydrophobicContact CE-CE 4.08Å; M363-M590 HydrophobicContact CE-SD 4.02Å; M363-M590 HydrophobicContact SD-CE 4.08Å; M363-M590 HydrophobicContact SD-SD 3.29Å; M363-K591 HydrophobicContact CE-CD 4.42Å; M363-K591 HydrophobicContact CE-CG 3.88Å; M363-K591 HydrophobicContact SD-CG 3.7Å; M363-L594 HydrophobicContact CG-CD1 4.11Å; M363-L594 HydrophobicContact SD-CD1 3.65Å
364	I	92.4	Very high	91.4	Very high	37 Å²	37	64.6 Å²	64.6	19%	0.19	33%	0.326	C	S	.	.	H	α-helix	trans	-62.6	-43.8	176.3	-68.1	165.8	0	0	0	111.1	T360 I361 L362 F366 G367 L368 V382	T360-I364 HydrophobicContact CG2-CD1 3.85Å; T360-I364 WeakPolarHBondContact O-CB 3.5Å; T360-I364 VanDerWaalsContact O-CG1 3.24Å; T360-I364 WeakPolarHBondContact O-CG1 3.15Å; T360-I364 PolarHBondContact O-N 3.5Å; I361-I364 PolarHBondContact O-N 3.26Å; L362-I364 VanDerWaalsContact C-N 3.34Å; L362-I364 PolarHBondContact O-N 3.43Å; I364-F366 PolarHBondContact O-N 3.34Å; I364-G367 PolarHBondContact O-N 3.32Å; I364-L368 HydrophobicContact CG2-CD1 3.95Å; I364-L368 HydrophobicContact CG2-CG 4.33Å; I364-L368 WeakPolarHBondContact O-CB 3.31Å; I364-L368 WeakPolarHBondContact O-CG 3.42Å; I364-L368 PolarHBondContact O-N 3.03Å; I364-V382 HydrophobicContact CG2-CG1 4.33Å; I364-V382 HydrophobicContact CG2-CG2 4.08Å
365	A	93.2	Very high	91.4	Very high	56 Å²	56	69.2 Å²	69.2	46%	0.463	35%	0.348	S	S	.	.	H	α-helix	trans	-61.2	-44.9	177.8	0	0	0	0	0	111.9	I361 L362 L368 L369	I361-A365 WeakPolarHBondContact O-CB 3.21Å; I361-A365 PolarHBondContact O-N 3.15Å; L362-A365 PolarHBondContact O-N 3.25Å; A365-L368 PolarHBondContact O-N 2.93Å; A365-L369 WeakPolarHBondContact O-CB 3.46Å; A365-L369 PolarHBondContact O-N 3.47Å
366	F	92.4	Very high	91.2	Very high	95 Å²	95	71.9 Å²	71.9	42%	0.417	36%	0.362	S	S	.	.	H	α-helix	trans	-65	-42.5	176.6	-90.8	-78.4	0	0	0	112.6	L362 M363 I364 L369 W370 M590 L594	L362-F366 WeakPolarHBondContact O-CD2 3.45Å; L362-F366 PolarHBondContact O-N 3.35Å; M363-F366 PolarHBondContact O-N 3.13Å; I364-F366 PolarHBondContact O-N 3.34Å; F366-L369 WeakPolarHBondContact O-CB 3.35Å; F366-L369 PolarHBondContact O-N 3.41Å; F366-W370 WeakPolarHBondContact O-CB 3.36Å; F366-W370 PolarHBondContact O-N 3.18Å; F366-M590 HydrophobicContact CB-CE 3.95Å; F366-M590 HydrophobicContact CB-SD 4.4Å; F366-L594 HydrophobicContact CD2-CD1 4.08Å; F366-L594 HydrophobicContact CD2-CD2 4.1Å; F366-L594 HydrophobicContact CE2-CD1 4.49Å; F366-L594 HydrophobicContact CE2-CD2 3.68Å
367	G	92.1	Very high	91	Very high	15 Å²	15	80.5 Å²	80.5	16%	0.155	39%	0.394	C	S	.	.	H	α-helix	trans	-76.7	-22.8	179	0	0	0	0	0	114	M363 I364 G371 S385	M363-G367 PolarHBondContact O-N 3.06Å; I364-G367 PolarHBondContact O-N 3.32Å; G367-G371 VanDerWaalsContact O-CA 3.31Å; G367-G371 WeakPolarHBondContact O-CA 3.49Å; G367-G371 PolarHBondContact O-N 2.99Å; G367-S385 VanDerWaalsContact CA-OG 3.23Å; G367-S385 WeakPolarHBondContact CA-OG 3.46Å
368	L	92.1	Very high	90.7	Very high	66 Å²	66	82.1 Å²	82.1	35%	0.346	40%	0.403	S	S	.	.	H	α-helix	trans	-67	-43.2	164.3	-80.4	172.8	0	0	0	111.5	I364 A365 G371 H372 P378 V382	I364-L368 HydrophobicContact CG2-CD1 3.95Å; I364-L368 HydrophobicContact CG2-CG 4.33Å; I364-L368 WeakPolarHBondContact O-CB 3.31Å; I364-L368 WeakPolarHBondContact O-CG 3.42Å; I364-L368 PolarHBondContact O-N 3.03Å; A365-L368 PolarHBondContact O-N 2.93Å; L368-G371 PolarHBondContact O-N 3.14Å; L368-H372 WeakPolarHBondContact O-CB 3.39Å; L368-H372 PolarHBondContact O-N 3.29Å; L368-P378 HydrophobicContact CD2-CB 4.14Å; L368-V382 HydrophobicContact CD1-CG2 4.21Å; L368-V382 HydrophobicContact CD2-CG2 3.83Å; L368-V382 HydrophobicContact CG-CG2 4.11Å
369	L	92.9	Very high	90.3	Very high	118 Å²	118	78.6 Å²	78.6	62%	0.618	39%	0.394	S	S	*	.	H	α-helix	trans	-60.7	-49.7	175.8	179.8	68.9	0	0	0	111.1	A365 F366 H372 L373	A365-L369 WeakPolarHBondContact O-CB 3.46Å; A365-L369 PolarHBondContact O-N 3.47Å; F366-L369 WeakPolarHBondContact O-CB 3.35Å; F366-L369 PolarHBondContact O-N 3.41Å; L369-H372 PolarHBondContact O-N 2.86Å; L369-L373 PolarHBondContact O-N 2.94Å
370	W	89.9	Confident	90	Very high	152 Å²	152	79.8 Å²	79.8	58%	0.576	40%	0.399	S	S	*	.	H	α-helix	trans	-69.3	-37.6	178.9	-156.4	-98.7	0	0	0	112.1	F366 H372 L373 L374	F366-W370 WeakPolarHBondContact O-CB 3.36Å; F366-W370 PolarHBondContact O-N 3.18Å; W370-H372 VanDerWaalsContact C-N 3.33Å; W370-H372 PolarHBondContact O-N 3.44Å; W370-L373 HydrophobicContact CE3-CD2 4.42Å; W370-L373 HydrophobicContact CZ3-CD2 4.38Å; W370-L373 WeakPolarHBondContact O-CB 3.19Å; W370-L373 PolarHBondContact O-N 2.93Å; W370-L374 WeakPolarHBondContact O-CB 3.41Å; W370-L374 WeakPolarHBondContact O-CG 3.27Å; W370-L374 PolarHBondContact O-N 2.86Å
371	G	89.1	Confident	89.9	Confident	3 Å²	3	79 Å²	79	3%	0.031	40%	0.395	C	S	.	.	H	α-helix	trans	-60.9	-41.1	174.6	0	0	0	0	0	112.5	G367 L368 L374 Q375 I376 S381	G367-G371 VanDerWaalsContact O-CA 3.31Å; G367-G371 WeakPolarHBondContact O-CA 3.49Å; G367-G371 PolarHBondContact O-N 2.99Å; L368-G371 PolarHBondContact O-N 3.14Å; G371-L374 CarbonylContact O-C 3.6Å; G371-L374 PolarHBondContact O-N 3.42Å; G371-Q375 PolarHBondContact O-N 3.42Å; G371-I376 PolarHBondContact O-N 3.21Å; G371-S381 WeakPolarHBondContact CA-OG 3.27Å
372	H	89.5	Confident	89.8	Confident	162 Å²	162	75.9 Å²	75.9	75%	0.75	38%	0.38	S	S	*	.	H	α-helix	trans	-63.3	-42.4	174	-172.5	62.1	0	0	0	111.7	L368 L369 W370 L374 Q375	L368-H372 WeakPolarHBondContact O-CB 3.39Å; L368-H372 PolarHBondContact O-N 3.29Å; L369-H372 PolarHBondContact O-N 2.86Å; W370-H372 VanDerWaalsContact C-N 3.33Å; W370-H372 PolarHBondContact O-N 3.44Å; H372-L374 VanDerWaalsContact C-N 3.3Å; H372-L374 PolarHBondContact O-N 3.28Å; H372-Q375 PolarHBondContact O-N 3.43Å
373	L	90.9	Very high	89.5	Confident	124 Å²	124	73.7 Å²	73.7	65%	0.649	37%	0.369	S	S	*	.	H	α-helix	trans	-63.2	-36.5	176.6	-172.9	63.4	0	0	0	112.4	L369 W370	L369-L373 PolarHBondContact O-N 2.94Å; W370-L373 HydrophobicContact CE3-CD2 4.42Å; W370-L373 HydrophobicContact CZ3-CD2 4.38Å; W370-L373 WeakPolarHBondContact O-CB 3.19Å; W370-L373 PolarHBondContact O-N 2.93Å
374	L	86.9	Confident	89.3	Confident	98 Å²	98	75 Å²	75	51%	0.513	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	4.8	178.3	-65.4	-179	0	0	0	114.2	W370 G371 H372 I376	W370-L374 WeakPolarHBondContact O-CB 3.41Å; W370-L374 WeakPolarHBondContact O-CG 3.27Å; W370-L374 PolarHBondContact O-N 2.86Å; G371-L374 CarbonylContact O-C 3.6Å; G371-L374 PolarHBondContact O-N 3.42Å; H372-L374 VanDerWaalsContact C-N 3.3Å; H372-L374 PolarHBondContact O-N 3.28Å; L374-I376 HydrophobicContact CB-CD1 3.87Å; L374-I376 HydrophobicContact CB-CG1 3.88Å; L374-I376 HydrophobicContact CD1-CD1 3.96Å; L374-I376 PolarHBondContact O-N 2.9Å
375	Q	88.5	Confident	89.3	Confident	184 Å²	184	73.6 Å²	73.6	86%	0.86	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	33	-176.2	-57.4	-171.6	-16.7	0	0	114.6	G371 H372	G371-Q375 PolarHBondContact O-N 3.42Å; H372-Q375 PolarHBondContact O-N 3.43Å
376	I	86.9	Confident	89.2	Confident	57 Å²	57	71.2 Å²	71.2	29%	0.292	35%	0.348	S	S	.	.			trans	-81.2	145.5	175	-58.5	173.3	0	0	0	109.1	G371 L374 Q380	G371-I376 PolarHBondContact O-N 3.21Å; L374-I376 HydrophobicContact CB-CD1 3.87Å; L374-I376 HydrophobicContact CB-CG1 3.88Å; L374-I376 HydrophobicContact CD1-CD1 3.96Å; L374-I376 PolarHBondContact O-N 2.9Å; I376-Q380 HydrophobicContact CG2-CB 3.91Å; I376-Q380 HydrophobicContact CG2-CG 3.72Å
377	R	85.8	Confident	89.1	Confident	183 Å²	183	66.7 Å²	66.7	69%	0.691	33%	0.329	S	S	*	.			trans	-58.3	136.2	175.6	-68.3	-178.4	179.7	173	0	110.1	T379 Q380 S381	R377-T379 VanDerWaalsContact C-N 3.25Å; R377-T379 PolarHBondContact O-N 3.39Å; R377-Q380 HydrophobicContact CB-CB 4.22Å; R377-Q380 WeakPolarHBondContact O-CB 3.42Å; R377-Q380 PolarHBondContact O-N 2.95Å; R377-S381 PolarHBondContact O-N 3.15Å; R377-S381 PolarHBondContact O-OG 3.48Å
378	P	84.4	Confident	89	Confident	88 Å²	88	67 Å²	67	57%	0.571	33%	0.326	S	S	*	.	H	α-helix	trans	-60.6	-34.9	-175.7	23.3	-33.5	0	0	0	112.6	L368 Q380 S381 V382	L368-P378 HydrophobicContact CD2-CB 4.14Å; P378-Q380 PolarHBondContact O-N 3.01Å; P378-S381 PolarHBondContact O-N 3.14Å; P378-V382 WeakPolarHBondContact O-CG2 3.39Å; P378-V382 PolarHBondContact O-N 3.11Å
379	T	83.4	Confident	89.1	Confident	40 Å²	40	63.9 Å²	63.9	25%	0.245	31%	0.31	C	S	.	.	H	α-helix	trans	-61.5	-43.4	175	49.6	0	0	0	0	112.2	R377 F383	R377-T379 VanDerWaalsContact C-N 3.25Å; R377-T379 PolarHBondContact O-N 3.39Å; T379-F383 WeakPolarHBondContact O-CB 3.24Å; T379-F383 PolarHBondContact O-N 3.5Å; T379-F383 VanDerWaalsContact O-N 3.08Å
380	Q	87.9	Confident	89	Confident	31 Å²	31	58.4 Å²	58.4	15%	0.145	28%	0.282	C	S	.	.	H	α-helix	trans	-67	-41	175.8	177.8	172.1	17.8	0	0	111.2	I376 R377 P378 F383 I384 I638	I376-Q380 HydrophobicContact CG2-CB 3.91Å; I376-Q380 HydrophobicContact CG2-CG 3.72Å; R377-Q380 HydrophobicContact CB-CB 4.22Å; R377-Q380 WeakPolarHBondContact O-CB 3.42Å; R377-Q380 PolarHBondContact O-N 2.95Å; P378-Q380 PolarHBondContact O-N 3.01Å; Q380-F383 PolarHBondContact O-N 3.37Å; Q380-I384 HydrophobicContact CG-CD1 3.65Å; Q380-I384 HydrophobicContact CG-CG1 4.3Å; Q380-I384 WeakPolarHBondContact O-CB 3.45Å; Q380-I384 WeakPolarHBondContact O-CG1 3.31Å; Q380-I384 PolarHBondContact O-N 2.86Å; Q380-I638 HydrophobicContact CG-CG2 4.2Å
381	S	89.9	Confident	89	Confident	4 Å²	4	51.2 Å²	51.2	3%	0.028	26%	0.255	C	S	.	.	H	α-helix	trans	-63.5	-45.2	176.2	-65.2	0	0	0	0	112.9	G371 R377 P378 F383 I384 S385	G371-S381 WeakPolarHBondContact CA-OG 3.27Å; R377-S381 PolarHBondContact O-N 3.15Å; R377-S381 PolarHBondContact O-OG 3.48Å; P378-S381 PolarHBondContact O-N 3.14Å; S381-F383 VanDerWaalsContact C-N 3.3Å; S381-F383 PolarHBondContact O-N 3.32Å; S381-I384 PolarHBondContact O-N 3.46Å; S381-S385 VanDerWaalsContact O-CB 3.29Å; S381-S385 WeakPolarHBondContact O-CB 3.38Å; S381-S385 PolarHBondContact O-N 2.65Å; S381-S385 PolarHBondContact O-OG 3.47Å
382	V	88.8	Confident	88.8	Confident	31 Å²	31	51 Å²	51	19%	0.188	25%	0.253	C	S	.	.	H	α-helix	trans	-57.6	-47.9	173.9	171.6	0	0	0	0	109.7	I364 L368 P378 S385 T386 L439	I364-V382 HydrophobicContact CG2-CG1 4.33Å; I364-V382 HydrophobicContact CG2-CG2 4.08Å; L368-V382 HydrophobicContact CD1-CG2 4.21Å; L368-V382 HydrophobicContact CD2-CG2 3.83Å; L368-V382 HydrophobicContact CG-CG2 4.11Å; P378-V382 WeakPolarHBondContact O-CG2 3.39Å; P378-V382 PolarHBondContact O-N 3.11Å; V382-S385 PolarHBondContact O-N 2.72Å; V382-T386 PolarHBondContact O-N 3.5Å; V382-T386 PolarHBondContact O-OG1 3.36Å; V382-L439 HydrophobicContact CG1-CD2 4.41Å
383	F	88.6	Confident	88.5	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.8	-51.1	-179	-178.2	-90.3	0	0	0	113.1	T379 Q380 S381 S385 T386 C387 F432 M436 L628 A632 I637 I638	T379-F383 WeakPolarHBondContact O-CB 3.24Å; T379-F383 PolarHBondContact O-N 3.5Å; T379-F383 VanDerWaalsContact O-N 3.08Å; Q380-F383 PolarHBondContact O-N 3.37Å; S381-F383 VanDerWaalsContact C-N 3.3Å; S381-F383 PolarHBondContact O-N 3.32Å; F383-S385 VanDerWaalsContact C-N 3.29Å; F383-S385 PolarHBondContact O-N 3.24Å; F383-T386 PolarHBondContact O-N 2.87Å; F383-C387 WeakPolarHBondContact CE1-SG 3.49Å; F383-C387 WeakPolarHBondContact CZ-SG 3.42Å; F383-C387 PolarHBondContact O-N 2.98Å; F383-C387 PolarHBondContact O-SG 3.5Å; F383-F432 AromaticContact CD2-CE1 3.74Å; F383-F432 HydrophobicContact CD2-CE1 3.74Å; F383-F432 AromaticContact CD2-CZ 3.74Å; F383-F432 HydrophobicContact CD2-CZ 3.74Å; F383-F432 AromaticContact CE2-CE1 3.76Å; F383-F432 HydrophobicContact CE2-CE1 3.76Å; F383-F432 HydrophobicContact CE2-CZ 4.25Å; F383-M436 HydrophobicContact CD2-SD 4.48Å; F383-M436 HydrophobicContact CE2-CG 4.49Å; F383-M436 HydrophobicContact CE2-SD 3.86Å; F383-L628 HydrophobicContact CE2-CB 4.45Å; F383-L628 HydrophobicContact CZ-CB 3.92Å; F383-L628 VanDerWaalsContact CZ-O 3.3Å; F383-L628 WeakPolarHBondContact CZ-O 3.46Å; F383-A632 HydrophobicContact CD1-CB 3.82Å; F383-A632 HydrophobicContact CD2-CB 4.09Å; F383-A632 HydrophobicContact CE1-CB 3.19Å; F383-A632 HydrophobicContact CE2-CB 3.52Å; F383-A632 HydrophobicContact CG-CB 4.24Å; F383-A632 HydrophobicContact CZ-CB 3.05Å; F383-I637 HydrophobicContact CB-CG2 4.15Å; F383-I637 HydrophobicContact CD2-CD1 4.41Å; F383-I637 HydrophobicContact CG-CG2 4.19Å; F383-I638 HydrophobicContact CD1-CG2 3.73Å; F383-I638 HydrophobicContact CE1-CD1 4.25Å; F383-I638 HydrophobicContact CE1-CG2 4.15Å
384	I	90.3	Very high	87.4	Confident	32 Å²	32	40.3 Å²	40.3	16%	0.164	21%	0.205	C	C	.	.	H	α-helix	trans	-59.6	-44	178.8	-66.4	167.1	0	0	0	110.1	Q380 S381 T386 C387 L388 V642 I646	Q380-I384 HydrophobicContact CG-CD1 3.65Å; Q380-I384 HydrophobicContact CG-CG1 4.3Å; Q380-I384 WeakPolarHBondContact O-CB 3.45Å; Q380-I384 WeakPolarHBondContact O-CG1 3.31Å; Q380-I384 PolarHBondContact O-N 2.86Å; S381-I384 PolarHBondContact O-N 3.46Å; I384-T386 PolarHBondContact O-N 3.4Å; I384-C387 WeakPolarHBondContact O-CB 3.3Å; I384-C387 PolarHBondContact O-N 3.33Å; I384-L388 HydrophobicContact CG2-CD1 3.8Å; I384-L388 HydrophobicContact CG2-CG 4.32Å; I384-L388 VanDerWaalsContact O-CG 3.29Å; I384-L388 WeakPolarHBondContact O-CG 3.2Å; I384-L388 PolarHBondContact O-N 3.25Å; I384-V642 HydrophobicContact CD1-CG1 3.71Å; I384-V642 HydrophobicContact CG1-CG1 4.12Å; I384-I646 HydrophobicContact CG1-CD1 4.15Å
385	S	92.1	Very high	86.9	Confident	7 Å²	7	36 Å²	36	5%	0.049	18%	0.182	C	C	.	.	H	α-helix	trans	-64.5	-42.1	-179.2	-52.6	0	0	0	0	112.4	M363 G367 S381 V382 F383 L388 S389	M363-S385 WeakPolarHBondContact O-CB 3.3Å; G367-S385 VanDerWaalsContact CA-OG 3.23Å; G367-S385 WeakPolarHBondContact CA-OG 3.46Å; S381-S385 VanDerWaalsContact O-CB 3.29Å; S381-S385 WeakPolarHBondContact O-CB 3.38Å; S381-S385 PolarHBondContact O-N 2.65Å; S381-S385 PolarHBondContact O-OG 3.47Å; V382-S385 PolarHBondContact O-N 2.72Å; F383-S385 VanDerWaalsContact C-N 3.29Å; F383-S385 PolarHBondContact O-N 3.24Å; S385-L388 PolarHBondContact O-N 3.15Å; S385-S389 WeakPolarHBondContact O-CB 3.44Å; S385-S389 PolarHBondContact O-N 3.09Å
386	T	90.1	Very high	86.5	Confident	5 Å²	5	27.2 Å²	27.2	3%	0.031	14%	0.141	C	C	.	.	H	α-helix	trans	-62.7	-45	174.5	-56.8	0	0	0	0	110.8	V382 F383 I384 L388 S389 F432	V382-T386 PolarHBondContact O-N 3.5Å; V382-T386 PolarHBondContact O-OG1 3.36Å; F383-T386 PolarHBondContact O-N 2.87Å; I384-T386 PolarHBondContact O-N 3.4Å; T386-L388 VanDerWaalsContact C-N 3.31Å; T386-L388 PolarHBondContact O-N 3.01Å; T386-S389 WeakPolarHBondContact O-CB 3.48Å; T386-S389 PolarHBondContact O-N 3.17Å; T386-F432 HydrophobicContact CG2-CB 4.34Å; T386-F432 HydrophobicContact CG2-CD1 3.73Å; T386-F432 HydrophobicContact CG2-CD2 3.7Å; T386-F432 HydrophobicContact CG2-CE1 3.83Å; T386-F432 HydrophobicContact CG2-CE2 3.81Å; T386-F432 HydrophobicContact CG2-CG 3.64Å; T386-F432 HydrophobicContact CG2-CZ 3.88Å
387	C	90.1	Very high	85.7	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-57.7	-44.3	176.4	-68.4	0	0	0	0	112	F383 I384 S389 S625	F383-C387 WeakPolarHBondContact CE1-SG 3.49Å; F383-C387 WeakPolarHBondContact CZ-SG 3.42Å; F383-C387 PolarHBondContact O-N 2.98Å; F383-C387 PolarHBondContact O-SG 3.5Å; I384-C387 WeakPolarHBondContact O-CB 3.3Å; I384-C387 PolarHBondContact O-N 3.33Å; C387-S389 VanDerWaalsContact C-N 3.34Å; C387-S625 PolarHBondContact O-OG 3.43Å
388	L	91.8	Very high	85.1	Confident	21 Å²	21	27.3 Å²	27.3	11%	0.11	15%	0.145	C	C	.	.	H	α-helix	trans	-73.8	-25.8	-179.4	-63.8	174.8	0	0	0	112.4	M363 I384 S385 T386 L390 V587 K591 V621 V649	M363-L388 HydrophobicContact CE-CB 4.02Å; I384-L388 HydrophobicContact CG2-CD1 3.8Å; I384-L388 HydrophobicContact CG2-CG 4.32Å; I384-L388 VanDerWaalsContact O-CG 3.29Å; I384-L388 WeakPolarHBondContact O-CG 3.2Å; I384-L388 PolarHBondContact O-N 3.25Å; S385-L388 PolarHBondContact O-N 3.15Å; T386-L388 VanDerWaalsContact C-N 3.31Å; T386-L388 PolarHBondContact O-N 3.01Å; L388-L390 VanDerWaalsContact C-N 3.3Å; L388-L390 PolarHBondContact O-N 3.11Å; L388-V587 HydrophobicContact CB-CG1 4.32Å; L388-V587 HydrophobicContact CD1-CG2 3.96Å; L388-V587 HydrophobicContact CD2-CG1 4.39Å; L388-K591 VanDerWaalsContact O-CD 3.23Å; L388-K591 WeakPolarHBondContact O-CD 3.45Å; L388-K591 WeakPolarHBondContact O-CE 3.49Å; L388-K591 PolarHBondContact O-NZ 3.48Å; L388-K591 VanDerWaalsContact O-NZ 3.16Å; L388-V621 HydrophobicContact CD2-CG1 4.31Å; L388-V621 HydrophobicContact CD2-CG2 4.17Å; L388-V649 HydrophobicContact CD2-CG1 4.15Å
389	S	92.6	Very high	84.6	Confident	1 Å²	1	24.6 Å²	24.6	1%	0.007	13%	0.125	C	C	.	.	H	α-helix	trans	-63.4	-33.9	179	-174.4	0	0	0	0	113.4	T360 S385 T386 C387 Q425 K591	T360-S389 VanDerWaalsContact CA-OG 3.3Å; T360-S389 WeakPolarHBondContact CA-OG 3.35Å; T360-S389 PolarHBondContact OG1-OG 3.45Å; T360-S389 VanDerWaalsContact OG1-OG 3.09Å; S385-S389 WeakPolarHBondContact O-CB 3.44Å; S385-S389 PolarHBondContact O-N 3.09Å; T386-S389 WeakPolarHBondContact O-CB 3.48Å; T386-S389 PolarHBondContact O-N 3.17Å; C387-S389 VanDerWaalsContact C-N 3.34Å; S389-Q425 PolarHBondContact O-NE2 3.39Å; S389-K591 VanDerWaalsContact O-CE 3.32Å; S389-K591 WeakPolarHBondContact O-CE 3.4Å; S389-K591 PolarHBondContact O-NZ 3.29Å
390	L	91.2	Very high	84.1	Confident	4 Å²	4	23.8 Å²	23.8	2%	0.021	12%	0.119	C	C	.	.			trans	-64.6	143.9	-177.2	-57.9	164.6	0	0	0	111.3	L388 L429 K591 V621 S622 F624 L628	L388-L390 VanDerWaalsContact C-N 3.3Å; L388-L390 PolarHBondContact O-N 3.11Å; L390-L429 HydrophobicContact CD1-CD1 3.31Å; L390-L429 HydrophobicContact CD1-CG 4.4Å; L390-L429 HydrophobicContact CD2-CB 4.02Å; L390-L429 HydrophobicContact CD2-CD1 4Å; L390-L429 HydrophobicContact CG-CD1 4.27Å; L390-K591 PolarHBondContact O-NZ 3.32Å; L390-V621 CarbonylContact O-C 3.55Å; L390-V621 WeakPolarHBondContact O-CA 3.41Å; L390-S622 PolarHBondContact O-N 3.11Å; L390-F624 HydrophobicContact CD1-CB 4.41Å; L390-L628 HydrophobicContact CD1-CD2 3.99Å
391	S	91.4	Very high	83	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.139	C	C	.	.			trans	-118.8	155	178.8	-33.7	0	0	0	0	111	T393 Q425 K591 L618 Q620 S622	S391-T393 PolarHBondContact O-N 2.87Å; S391-Q425 VanDerWaalsContact N-OE1 3.13Å; S391-Q425 PolarHBondContact OG-OE1 3.26Å; S391-K591 PolarHBondContact OG-NZ 2.97Å; S391-L618 PolarHBondContact OG-O 2.98Å; S391-L618 VanDerWaalsContact OG-O 3.09Å; S391-Q620 WeakPolarHBondContact CA-O 3.48Å; S391-Q620 WeakPolarHBondContact CB-O 3.44Å; S391-S622 WeakPolarHBondContact O-CB 3.44Å; S391-S622 PolarHBondContact O-OG 3.27Å
392	S	84.7	Confident	81.3	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.172	C	C	.	.			trans	-81.5	118.1	-175.1	177	0	0	0	0	111.9	L395 V396 E623	S392-L395 VanDerWaalsContact OG-CB 3.31Å; S392-L395 WeakPolarHBondContact OG-CB 3.25Å; S392-L395 PolarHBondContact OG-N 3.27Å; S392-V396 WeakPolarHBondContact O-CG2 3.44Å; S392-E623 VanDerWaalsContact CB-OE2 3.28Å; S392-E623 WeakPolarHBondContact CB-OE2 3.48Å; S392-E623 PolarHBondContact OG-OE2 2.63Å
393	T	81.6	Confident	79.6	Confident	4 Å²	4	28.9 Å²	28.9	3%	0.025	17%	0.174	C	C	.	.	H	α-helix	trans	-75.2	-49.1	177.7	-52.8	0	0	0	0	112.5	S391 L395 V396 S397 L422 D426	S391-T393 PolarHBondContact O-N 2.87Å; T393-L395 VanDerWaalsContact C-N 3.31Å; T393-L395 PolarHBondContact O-N 3.35Å; T393-V396 PolarHBondContact O-N 3.45Å; T393-S397 PolarHBondContact O-N 2.89Å; T393-S397 PolarHBondContact O-OG 3.33Å; T393-L422 HydrophobicContact CG2-CB 4.19Å; T393-D426 PolarHBondContact OG1-OD2 3.33Å
394	P	69.5	Low	77.4	Confident	57 Å²	57	35.3 Å²	35.3	37%	0.37	21%	0.213	S	C	.	.	H	α-helix	trans	-65.5	-30.6	-177.5	-26.7	40.7	0	0	0	114	S397 R398 E623	P394-S397 PolarHBondContact O-OG 3.16Å; P394-R398 WeakPolarHBondContact O-CG 3.38Å; P394-R398 PolarHBondContact O-N 3.11Å; P394-E623 WeakPolarHBondContact CD-OE1 3.49Å; P394-E623 WeakPolarHBondContact CG-OE1 3.22Å
395	L	75.8	Confident	75.2	Confident	6 Å²	6	41.7 Å²	41.7	3%	0.031	24%	0.235	C	C	.	.	H	α-helix	trans	-68.7	-44	175.7	-177.4	50.2	0	0	0	111.8	P295 S392 T393 R398 F399 Q620 L654 A657	P295-L395 HydrophobicContact CG-CD1 3.33Å; S392-L395 VanDerWaalsContact OG-CB 3.31Å; S392-L395 WeakPolarHBondContact OG-CB 3.25Å; S392-L395 PolarHBondContact OG-N 3.27Å; T393-L395 VanDerWaalsContact C-N 3.31Å; T393-L395 PolarHBondContact O-N 3.35Å; L395-R398 PolarHBondContact O-N 3.33Å; L395-F399 HydrophobicContact CD1-CE1 3.72Å; L395-F399 HydrophobicContact CD1-CE2 4.08Å; L395-F399 HydrophobicContact CD1-CZ 3.42Å; L395-F399 VanDerWaalsContact CD1-CZ 3.42Å; L395-F399 HydrophobicContact CD2-CE2 4.35Å; L395-F399 HydrophobicContact CD2-CZ 4.13Å; L395-F399 HydrophobicContact CG-CE1 4.29Å; L395-F399 HydrophobicContact CG-CE2 3.72Å; L395-F399 HydrophobicContact CG-CZ 3.56Å; L395-F399 WeakPolarHBondContact O-CG 3.48Å; L395-F399 PolarHBondContact O-N 3.41Å; L395-Q620 HydrophobicContact CD2-CG 4.46Å; L395-L654 HydrophobicContact CD2-CB 4.4Å; L395-L654 HydrophobicContact CD2-CD2 3.67Å; L395-A657 HydrophobicContact CD2-CB 3.78Å
396	V	80.4	Confident	72.8	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-71.6	-39.2	-178	176.2	0	0	0	0	111.3	S392 T393 R398 F399 L400 L418 L422 G617	S392-V396 WeakPolarHBondContact O-CG2 3.44Å; T393-V396 PolarHBondContact O-N 3.45Å; V396-R398 PolarHBondContact O-N 3.08Å; V396-F399 WeakPolarHBondContact O-CA 3.32Å; V396-F399 WeakPolarHBondContact O-CB 3.28Å; V396-F399 PolarHBondContact O-N 2.9Å; V396-L400 HydrophobicContact CG1-CD1 3.72Å; V396-L400 VanDerWaalsContact O-CD1 3.32Å; V396-L400 WeakPolarHBondContact O-CD1 3.49Å; V396-L400 PolarHBondContact O-N 3.44Å; V396-L418 HydrophobicContact CG1-CD1 4.26Å; V396-L418 HydrophobicContact CG1-CD2 3.45Å; V396-L418 VanDerWaalsContact CG1-CD2 3.45Å; V396-L418 HydrophobicContact CG1-CG 3.67Å; V396-L422 HydrophobicContact CB-CD1 3.61Å; V396-L422 HydrophobicContact CG1-CD1 3.56Å; V396-L422 HydrophobicContact CG2-CD1 3.99Å; V396-G617 VanDerWaalsContact CG2-O 3.24Å; V396-G617 WeakPolarHBondContact CG2-O 3.47Å
397	S	70.3	Confident	70.4	Confident	48 Å²	48	51.3 Å²	51.3	34%	0.336	30%	0.303	S	S	.	.	H	α-helix	trans	-58.3	-34.7	176	68.3	0	0	0	0	111.9	T393 P394 L400 A401	T393-S397 PolarHBondContact O-N 2.89Å; T393-S397 PolarHBondContact O-OG 3.33Å; P394-S397 PolarHBondContact O-OG 3.16Å; S397-L400 PolarHBondContact O-N 2.83Å; S397-A401 WeakPolarHBondContact O-CB 3.2Å; S397-A401 PolarHBondContact O-N 3.3Å
398	R	72.3	Confident	67.8	Low	194 Å²	194	60.4 Å²	60.4	73%	0.732	34%	0.342	S	S	*	.	H	α-helix	trans	-67.8	-40.2	172.5	-68.6	-74.7	164.6	176.8	-4.4	113	P394 L395 V396 L400 A401 G402	P394-R398 WeakPolarHBondContact O-CG 3.38Å; P394-R398 PolarHBondContact O-N 3.11Å; L395-R398 PolarHBondContact O-N 3.33Å; V396-R398 PolarHBondContact O-N 3.08Å; R398-L400 VanDerWaalsContact C-N 3.28Å; R398-L400 PolarHBondContact O-N 2.67Å; R398-A401 PolarHBondContact O-N 3.1Å; R398-G402 PolarHBondContact O-N 2.53Å
399	F	74.2	Confident	65	Low	31 Å²	31	68.4 Å²	68.4	14%	0.136	38%	0.379	C	S	.	.	H	α-helix	trans	-62.2	-37.4	174.3	-64.5	-23	0	0	0	112.4	L395 V396 S403 A657 P658 W661	L395-F399 HydrophobicContact CD1-CE1 3.72Å; L395-F399 HydrophobicContact CD1-CE2 4.08Å; L395-F399 HydrophobicContact CD1-CZ 3.42Å; L395-F399 VanDerWaalsContact CD1-CZ 3.42Å; L395-F399 HydrophobicContact CD2-CE2 4.35Å; L395-F399 HydrophobicContact CD2-CZ 4.13Å; L395-F399 HydrophobicContact CG-CE1 4.29Å; L395-F399 HydrophobicContact CG-CE2 3.72Å; L395-F399 HydrophobicContact CG-CZ 3.56Å; L395-F399 WeakPolarHBondContact O-CG 3.48Å; L395-F399 PolarHBondContact O-N 3.41Å; V396-F399 WeakPolarHBondContact O-CA 3.32Å; V396-F399 WeakPolarHBondContact O-CB 3.28Å; V396-F399 PolarHBondContact O-N 2.9Å; F399-S403 WeakPolarHBondContact O-CB 3.42Å; F399-S403 PolarHBondContact O-N 3.41Å; F399-S403 PolarHBondContact O-OG 2.91Å; F399-A657 HydrophobicContact CE2-CB 4.31Å; F399-A657 HydrophobicContact CZ-CB 4.4Å; F399-P658 HydrophobicContact CE1-CB 3.96Å; F399-P658 HydrophobicContact CE1-CG 4.01Å; F399-P658 HydrophobicContact CZ-CB 3.93Å; F399-P658 HydrophobicContact CZ-CG 3.74Å; F399-W661 HydrophobicContact CB-CD2 4.07Å; F399-W661 HydrophobicContact CB-CG 4.21Å; F399-W661 HydrophobicContact CB-CZ2 4.12Å; F399-W661 HydrophobicContact CD2-CB 4.06Å; F399-W661 AromaticContact CD2-CD2 3.96Å; F399-W661 HydrophobicContact CD2-CD2 3.96Å; F399-W661 HydrophobicContact CD2-CE3 4.39Å; F399-W661 AromaticContact CD2-CG 3.8Å; F399-W661 HydrophobicContact CD2-CG 3.8Å; F399-W661 HydrophobicContact CE2-CB 4.1Å; F399-W661 HydrophobicContact CE2-CG 4.34Å; F399-W661 AromaticContact CG-CD1 3.9Å; F399-W661 HydrophobicContact CG-CD2 4.25Å; F399-W661 AromaticContact CG-CG 4Å; F399-W661 HydrophobicContact CG-CG 4Å
400	L	72.9	Confident	62.6	Low	24 Å²	24	72.2 Å²	72.2	13%	0.126	42%	0.418	C	S	.	.	H	α-helix	trans	-70.7	-47.2	176.2	-90.2	56.4	0	0	0	111.5	V396 S397 R398 G402 S403 S415 L418 W661	V396-L400 HydrophobicContact CG1-CD1 3.72Å; V396-L400 VanDerWaalsContact O-CD1 3.32Å; V396-L400 WeakPolarHBondContact O-CD1 3.49Å; V396-L400 PolarHBondContact O-N 3.44Å; S397-L400 PolarHBondContact O-N 2.83Å; R398-L400 VanDerWaalsContact C-N 3.28Å; R398-L400 PolarHBondContact O-N 2.67Å; L400-G402 PolarHBondContact O-N 3.39Å; L400-S403 PolarHBondContact O-N 3.31Å; L400-S415 WeakPolarHBondContact CD2-OG 3.38Å; L400-L418 HydrophobicContact CD1-CD2 3.97Å; L400-W661 HydrophobicContact CD1-CH2 3.72Å; L400-W661 HydrophobicContact CD1-CZ2 3.89Å
401	A	63.9	Low	60.8	Low	69 Å²	69	77.2 Å²	77.2	57%	0.57	45%	0.445	S	S	*	.	H	α-helix	trans	-61.5	-30	178.1	0	0	0	0	0	113	S397 R398 V404	S397-A401 WeakPolarHBondContact O-CB 3.2Å; S397-A401 PolarHBondContact O-N 3.3Å; R398-A401 PolarHBondContact O-N 3.1Å; A401-V404 WeakPolarHBondContact O-CG2 3.47Å
402	G	54.4	Low	59.2	Low	70 Å²	70	80 Å²	80	72%	0.722	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-11.1	174.4	0	0	0	0	0	115.1	R398 L400	R398-G402 PolarHBondContact O-N 2.53Å; L400-G402 PolarHBondContact O-N 3.39Å
403	S	53.8	Low	58.8	Low	33 Å²	33	83.1 Å²	83.1	23%	0.231	48%	0.476	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	21.8	-172.4	-59.9	0	0	0	0	113.8	F399 L400 R405	F399-S403 WeakPolarHBondContact O-CB 3.42Å; F399-S403 PolarHBondContact O-N 3.41Å; F399-S403 PolarHBondContact O-OG 2.91Å; L400-S403 PolarHBondContact O-N 3.31Å; S403-R405 PolarHBondContact O-N 3.26Å
404	V	42.9	Very low	58.7	Low	135 Å²	135	85.3 Å²	85.3	82%	0.818	49%	0.485	S	S	*	.			trans	-51.5	97.5	-178.1	-175.4	0	0	0	0	110.6	A401	A401-V404 WeakPolarHBondContact O-CG2 3.47Å
405	R	44.5	Very low	59.1	Low	167 Å²	167	84.1 Å²	84.1	63%	0.63	48%	0.478	S	S	*	.			trans	-123.1	122.5	170.3	-137.4	175.7	-176.4	177.4	1	105.9	S403	S403-R405 PolarHBondContact O-N 3.26Å
406	G	41.4	Very low	59.3	Low	71 Å²	71	86 Å²	86	73%	0.732	49%	0.491	S	S	*	.			trans	-49.5	136.3	-165.6	0	0	0	0	0	114.6	K408	G406-K408 PolarHBondContact O-N 3.28Å
407	D	38.1	Very low	59.4	Low	143 Å²	143	86 Å²	86	77%	0.765	49%	0.491	S	S	*	.			trans	-46.8	125.4	173.2	-60.5	-48.9	0	0	0	111.4
408	K	36.9	Very low	60.2	Low	190 Å²	190	83.7 Å²	83.7	83%	0.826	48%	0.475	S	S	*	.			trans	-100	107.6	153.2	-77.4	-172.8	177	178.1	0	106.8	G406 G410	G406-K408 PolarHBondContact O-N 3.28Å; K408-G410 PolarHBondContact O-N 3.45Å; K408-G410 VanDerWaalsContact O-N 3.12Å
409	E	32.7	Very low	60.6	Low	189 Å²	189	77.5 Å²	77.5	88%	0.883	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	112.5	176.1	-164.1	68	-147.5	0	0	110.4
410	G	41.9	Very low	60.9	Low	81 Å²	81	76.2 Å²	76.2	84%	0.835	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	125.5	-13.7	166.5	0	0	0	0	0	118.2	K408	K408-G410 PolarHBondContact O-N 3.45Å; K408-G410 VanDerWaalsContact O-N 3.12Å
411	D	52.8	Low	61.6	Low	109 Å²	109	75.2 Å²	75.2	58%	0.583	45%	0.446	S	S	*	.	S	Bend	trans	-96.3	153.1	176.9	-147.8	-9	0	0	0	111.8	D413	D411-D413 PolarHBondContact O-N 3.38Å
412	I	59.3	Low	62.7	Low	60 Å²	60	72 Å²	72	31%	0.308	42%	0.419	S	S	.	.			trans	-63.3	113.6	176.7	-64.7	172.9	0	0	0	107.5	Y414 V417 I610	I412-Y414 PolarHBondContact O-N 2.9Å; I412-V417 HydrophobicContact CG2-CG2 3.42Å; I412-V417 VanDerWaalsContact CG2-CG2 3.42Å; I412-I610 WeakPolarHBondContact O-CD1 3.49Å
413	D	76	Confident	63.9	Low	64 Å²	64	69.1 Å²	69.1	34%	0.342	39%	0.388	S	S	.	.			trans	-75	125.7	179.5	-171.7	3.9	0	0	0	110.4	D411 S415 S416 V417	D411-D413 PolarHBondContact O-N 3.38Å; D413-S415 PolarHBondContact O-N 3.44Å; D413-S415 PolarHBondContact OD1-N 3.25Å; D413-S415 VanDerWaalsContact OD1-N 3.12Å; D413-S415 WeakPolarHBondContact OD2-CB 3.24Å; D413-S416 PolarHBondContact O-N 2.73Å; D413-S416 VanDerWaalsContact O-N 3.09Å; D413-S416 PolarHBondContact O-OG 2.93Å; D413-V417 PolarHBondContact O-N 2.97Å
414	Y	79.4	Confident	65.3	Low	51 Å²	51	68 Å²	68	20%	0.2	38%	0.379	C	S	.	.	H	α-helix	trans	-59.4	-30.8	176.9	65.2	-87.1	0	0	0	111.2	I412 V417 L418 I613 W661	I412-Y414 PolarHBondContact O-N 2.9Å; Y414-V417 PolarHBondContact O-N 3.06Å; Y414-L418 WeakPolarHBondContact O-CB 3.4Å; Y414-L418 PolarHBondContact O-N 3.28Å; Y414-I613 HydrophobicContact CD2-CG2 3.71Å; Y414-I613 HydrophobicContact CE2-CG2 4.14Å; Y414-I613 HydrophobicContact CG-CG2 4.33Å; Y414-W661 HydrophobicContact CE2-CH2 4.38Å
415	S	78.1	Confident	67.4	Low	32 Å²	32	61.6 Å²	61.6	22%	0.224	34%	0.34	C	S	.	.	H	α-helix	trans	-61.8	-47.7	174.8	176.6	0	0	0	0	111.3	L400 D413 V417 L418 L419	L400-S415 WeakPolarHBondContact CD2-OG 3.38Å; D413-S415 PolarHBondContact O-N 3.44Å; D413-S415 PolarHBondContact OD1-N 3.25Å; D413-S415 VanDerWaalsContact OD1-N 3.12Å; D413-S415 WeakPolarHBondContact OD2-CB 3.24Å; S415-V417 PolarHBondContact O-N 3.42Å; S415-L418 PolarHBondContact O-N 3.24Å; S415-L419 VanDerWaalsContact O-CB 3.27Å; S415-L419 WeakPolarHBondContact O-CB 3.1Å; S415-L419 PolarHBondContact O-N 3.12Å
416	S	78.6	Confident	69.1	Low	45 Å²	45	53.6 Å²	53.6	32%	0.315	31%	0.31	S	S	.	.	H	α-helix	trans	-64.3	-38.2	179.1	74.1	0	0	0	0	113	D413 G420	D413-S416 PolarHBondContact O-N 2.73Å; D413-S416 VanDerWaalsContact O-N 3.09Å; D413-S416 PolarHBondContact O-OG 2.93Å; S416-G420 PolarHBondContact O-N 2.89Å
417	V	84	Confident	70.8	Confident	0 Å²	0	52 Å²	52	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-70.2	-45	177.9	170.1	0	0	0	0	111	V348 I351 I412 D413 Y414 S415 M421 V614	V348-V417 HydrophobicContact CG1-CG2 3.99Å; I351-V417 HydrophobicContact CG2-CG1 3.92Å; I412-V417 HydrophobicContact CG2-CG2 3.42Å; I412-V417 VanDerWaalsContact CG2-CG2 3.42Å; D413-V417 PolarHBondContact O-N 2.97Å; Y414-V417 PolarHBondContact O-N 3.06Å; S415-V417 PolarHBondContact O-N 3.42Å; V417-M421 HydrophobicContact CG1-CE 3.71Å; V417-M421 WeakPolarHBondContact O-CG 3.39Å; V417-M421 PolarHBondContact O-N 2.67Å; V417-V614 HydrophobicContact CG1-CG1 4.26Å; V417-V614 HydrophobicContact CG1-CG2 4.31Å
418	L	86.6	Confident	72.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-66.1	-50.9	179.6	179.8	52.4	0	0	0	111.7	V396 L400 Y414 S415 G420 M421 L422 V614 L618 W661	V396-L418 HydrophobicContact CG1-CD1 4.26Å; V396-L418 HydrophobicContact CG1-CD2 3.45Å; V396-L418 VanDerWaalsContact CG1-CD2 3.45Å; V396-L418 HydrophobicContact CG1-CG 3.67Å; L400-L418 HydrophobicContact CD1-CD2 3.97Å; Y414-L418 WeakPolarHBondContact O-CB 3.4Å; Y414-L418 PolarHBondContact O-N 3.28Å; S415-L418 PolarHBondContact O-N 3.24Å; L418-G420 VanDerWaalsContact C-N 3.31Å; L418-G420 PolarHBondContact O-N 3.37Å; L418-M421 PolarHBondContact O-N 3.46Å; L418-L422 HydrophobicContact CD1-CD1 4.06Å; L418-L422 HydrophobicContact CD1-CG 4.31Å; L418-L422 HydrophobicContact CG-CD1 4.1Å; L418-L422 VanDerWaalsContact O-CG 3.31Å; L418-L422 WeakPolarHBondContact O-CG 3.49Å; L418-L422 PolarHBondContact O-N 2.93Å; L418-V614 HydrophobicContact CB-CG1 4.22Å; L418-V614 HydrophobicContact CB-CG2 4.29Å; L418-V614 HydrophobicContact CD1-CG1 4.11Å; L418-L618 HydrophobicContact CD1-CD2 3.7Å; L418-L618 HydrophobicContact CD1-CG 3.71Å; L418-W661 HydrophobicContact CD2-CH2 3.82Å; L418-W661 HydrophobicContact CD2-CZ3 3.69Å
419	L	80.7	Confident	74.9	Confident	64 Å²	64	38.3 Å²	38.3	34%	0.335	22%	0.22	S	C	.	.	H	α-helix	trans	-61	-42.3	177.3	-170.9	73.9	0	0	0	111	S415 M421 L422 V423	S415-L419 VanDerWaalsContact O-CB 3.27Å; S415-L419 WeakPolarHBondContact O-CB 3.1Å; S415-L419 PolarHBondContact O-N 3.12Å; L419-M421 PolarHBondContact O-N 2.86Å; L419-L422 PolarHBondContact O-N 3.25Å; L419-V423 HydrophobicContact CG-CG2 4.49Å; L419-V423 WeakPolarHBondContact O-CB 3.39Å; L419-V423 VanDerWaalsContact O-CG2 3.27Å; L419-V423 WeakPolarHBondContact O-CG2 3.41Å; L419-V423 PolarHBondContact O-N 3.38Å
420	G	80.1	Confident	76.8	Confident	4 Å²	4	29.3 Å²	29.3	4%	0.041	18%	0.179	C	C	.	.	H	α-helix	trans	-58.5	-48.4	176.8	0	0	0	0	0	112.4	L345 S352 S416 L418 V423 M424	L345-G420 VanDerWaalsContact CD1-CA 3.44Å; S352-G420 PolarHBondContact OG-O 3.15Å; S416-G420 PolarHBondContact O-N 2.89Å; L418-G420 VanDerWaalsContact C-N 3.31Å; L418-G420 PolarHBondContact O-N 3.37Å; G420-V423 PolarHBondContact O-N 3.32Å; G420-M424 PolarHBondContact O-N 2.92Å
421	M	88	Confident	78.4	Confident	3 Å²	3	28.7 Å²	28.7	2%	0.015	16%	0.156	C	C	.	.	H	α-helix	trans	-64.9	-38.6	178.6	-76.1	-163	-74.2	0	0	113.2	P356 V417 L418 L419 M424 Q425 L599 V614 L618	P356-M421 HydrophobicContact CG-CB 3.76Å; P356-M421 HydrophobicContact CG-CG 3.87Å; P356-M421 VanDerWaalsContact CG-O 3.3Å; P356-M421 WeakPolarHBondContact CG-O 3.33Å; P356-M421 HydrophobicContact CG-SD 4.45Å; V417-M421 HydrophobicContact CG1-CE 3.71Å; V417-M421 WeakPolarHBondContact O-CG 3.39Å; V417-M421 PolarHBondContact O-N 2.67Å; L418-M421 PolarHBondContact O-N 3.46Å; L419-M421 PolarHBondContact O-N 2.86Å; M421-M424 PolarHBondContact O-N 2.82Å; M421-Q425 WeakPolarHBondContact O-CG 3.12Å; M421-Q425 PolarHBondContact O-N 3.38Å; M421-L599 HydrophobicContact CE-CD1 4.33Å; M421-L599 HydrophobicContact CE-CD2 3.69Å; M421-L599 HydrophobicContact CE-CG 4.44Å; M421-L599 HydrophobicContact SD-CD2 4.22Å; M421-V614 HydrophobicContact CE-CG1 3.1Å; M421-L618 HydrophobicContact CE-CD1 3.61Å; M421-L618 HydrophobicContact SD-CD1 4.06Å
422	L	86.1	Confident	79.6	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61.7	-49.8	176	-75.6	166.5	0	0	0	111.5	T393 V396 L418 L419 M424 Q425 D426 L618	T393-L422 HydrophobicContact CG2-CB 4.19Å; V396-L422 HydrophobicContact CB-CD1 3.61Å; V396-L422 HydrophobicContact CG1-CD1 3.56Å; V396-L422 HydrophobicContact CG2-CD1 3.99Å; L418-L422 HydrophobicContact CD1-CD1 4.06Å; L418-L422 HydrophobicContact CD1-CG 4.31Å; L418-L422 HydrophobicContact CG-CD1 4.1Å; L418-L422 VanDerWaalsContact O-CG 3.31Å; L418-L422 WeakPolarHBondContact O-CG 3.49Å; L418-L422 PolarHBondContact O-N 2.93Å; L419-L422 PolarHBondContact O-N 3.25Å; L422-M424 PolarHBondContact O-N 3.08Å; L422-Q425 WeakPolarHBondContact O-CA 3.42Å; L422-Q425 WeakPolarHBondContact O-CB 3.46Å; L422-Q425 PolarHBondContact O-N 3.17Å; L422-D426 PolarHBondContact O-N 2.75Å; L422-L618 HydrophobicContact CD2-CD2 3.8Å; L422-L618 HydrophobicContact CG-CD2 4.02Å
423	V	79.4	Confident	80.4	Confident	11 Å²	11	22.4 Å²	22.4	7%	0.067	12%	0.122	C	C	.	.	H	α-helix	trans	-57.8	-40.5	176.5	169.9	0	0	0	0	111	F340 L419 G420 D426 V427	F340-V423 HydrophobicContact CB-CG1 4.32Å; F340-V423 HydrophobicContact CD2-CG1 3.54Å; F340-V423 HydrophobicContact CE2-CG1 4.37Å; F340-V423 HydrophobicContact CG-CG1 4.42Å; L419-V423 HydrophobicContact CG-CG2 4.49Å; L419-V423 WeakPolarHBondContact O-CB 3.39Å; L419-V423 VanDerWaalsContact O-CG2 3.27Å; L419-V423 WeakPolarHBondContact O-CG2 3.41Å; L419-V423 PolarHBondContact O-N 3.38Å; G420-V423 PolarHBondContact O-N 3.32Å; V423-D426 PolarHBondContact O-N 2.95Å; V423-V427 WeakPolarHBondContact O-CG2 3.3Å; V423-V427 PolarHBondContact O-N 2.98Å
424	M	83	Confident	80	Confident	8 Å²	8	20.2 Å²	20.2	4%	0.039	11%	0.112	C	C	.	.	H	α-helix	trans	-68.6	-31.8	175.7	-79.2	-67.1	-175	0	0	113.8	F340 L345 W349 S352 L353 P356 G420 M421 L422 V427 Q428	F340-M424 HydrophobicContact CE2-CE 4.01Å; F340-M424 HydrophobicContact CE2-SD 4.44Å; F340-M424 HydrophobicContact CZ-CE 4.41Å; L345-M424 HydrophobicContact CD2-CE 3.28Å; L345-M424 HydrophobicContact CD2-CG 4.2Å; L345-M424 HydrophobicContact CD2-SD 4.41Å; L345-M424 HydrophobicContact CG-CE 4.43Å; W349-M424 HydrophobicContact CD2-CE 4.34Å; W349-M424 HydrophobicContact CE3-CE 3.8Å; W349-M424 HydrophobicContact CH2-CE 3.43Å; W349-M424 VanDerWaalsContact CH2-CE 3.43Å; W349-M424 HydrophobicContact CZ2-CE 4Å; W349-M424 HydrophobicContact CZ3-CE 3.32Å; S352-M424 VanDerWaalsContact O-CB 3.28Å; S352-M424 WeakPolarHBondContact O-CB 3.39Å; S352-M424 WeakPolarHBondContact O-CG 3.49Å; S352-M424 WeakPolarHBondContact OG-CG 3.17Å; L353-M424 HydrophobicContact CD1-CE 4.18Å; L353-M424 HydrophobicContact CD1-SD 3.97Å; P356-M424 HydrophobicContact CB-CB 4.44Å; P356-M424 HydrophobicContact CG-CB 3.98Å; G420-M424 PolarHBondContact O-N 2.92Å; M421-M424 PolarHBondContact O-N 2.82Å; L422-M424 PolarHBondContact O-N 3.08Å; M424-V427 PolarHBondContact O-N 3.33Å; M424-Q428 VanDerWaalsContact O-CG 3.31Å; M424-Q428 WeakPolarHBondContact O-CG 3.49Å; M424-Q428 PolarHBondContact O-N 2.9Å
425	Q	87.9	Confident	79.6	Confident	1 Å²	1	19.5 Å²	19.5	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-65	-40.5	170.5	-75.1	-170.8	-37.1	0	0	111.4	P356 S389 S391 M421 L422 V427 Q428 L429	P356-Q425 HydrophobicContact CB-CG 3.73Å; P356-Q425 HydrophobicContact CG-CG 4.17Å; S389-Q425 PolarHBondContact O-NE2 3.39Å; S391-Q425 VanDerWaalsContact N-OE1 3.13Å; S391-Q425 PolarHBondContact OG-OE1 3.26Å; M421-Q425 WeakPolarHBondContact O-CG 3.12Å; M421-Q425 PolarHBondContact O-N 3.38Å; L422-Q425 WeakPolarHBondContact O-CA 3.42Å; L422-Q425 WeakPolarHBondContact O-CB 3.46Å; L422-Q425 PolarHBondContact O-N 3.17Å; Q425-V427 VanDerWaalsContact C-N 3.31Å; Q425-V427 PolarHBondContact O-N 3.47Å; Q425-Q428 WeakPolarHBondContact O-CB 3.37Å; Q425-Q428 PolarHBondContact O-N 2.82Å; Q425-L429 WeakPolarHBondContact O-CB 3.46Å; Q425-L429 PolarHBondContact O-N 3.04Å
426	D	81	Confident	79.3	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-68.3	-30.4	177.3	-63.5	-24.5	0	0	0	112	V336 T393 L422 V423 L429 G430 F624	V336-D426 HydrophobicContact CG1-CB 3.65Å; T393-D426 PolarHBondContact OG1-OD2 3.33Å; L422-D426 PolarHBondContact O-N 2.75Å; V423-D426 PolarHBondContact O-N 2.95Å; D426-L429 VanDerWaalsContact O-CB 3.31Å; D426-L429 WeakPolarHBondContact O-CB 3.05Å; D426-G430 PolarHBondContact O-N 3.27Å; D426-F624 WeakPolarHBondContact OD1-CE2 3.46Å
427	V	76.2	Confident	78.9	Confident	38 Å²	38	19.8 Å²	19.8	23%	0.23	11%	0.112	C	C	.	.	H	α-helix	trans	-67.6	-46.5	169.1	-175.9	0	0	0	0	111.2	F340 V423 M424 Q425 L429 G430 L431 F528	F340-V427 HydrophobicContact CD2-CG2 4.15Å; F340-V427 HydrophobicContact CE2-CG2 4.18Å; V423-V427 WeakPolarHBondContact O-CG2 3.3Å; V423-V427 PolarHBondContact O-N 2.98Å; M424-V427 PolarHBondContact O-N 3.33Å; Q425-V427 VanDerWaalsContact C-N 3.31Å; Q425-V427 PolarHBondContact O-N 3.47Å; V427-L429 PolarHBondContact O-N 3.12Å; V427-G430 PolarHBondContact O-N 3.5Å; V427-L431 PolarHBondContact O-N 3.27Å; V427-L431 VanDerWaalsContact O-N 3.14Å; V427-F528 HydrophobicContact CB-CE1 4.4Å; V427-F528 HydrophobicContact CB-CZ 4.04Å; V427-F528 HydrophobicContact CG1-CE1 4Å; V427-F528 HydrophobicContact CG1-CZ 4.1Å; V427-F528 HydrophobicContact CG2-CE1 4.06Å; V427-F528 HydrophobicContact CG2-CE2 3.9Å; V427-F528 HydrophobicContact CG2-CZ 3.29Å
428	Q	81.8	Confident	77.9	Confident	42 Å²	42	21.3 Å²	21.3	20%	0.196	12%	0.121	C	C	.	.	H	α-helix	trans	-60.1	-34.3	177.2	-74.7	176.1	4.4	0	0	111.8	P356 T360 M424 Q425 L431 F432	P356-Q428 PolarHBondContact O-OE1 3.43Å; T360-Q428 PolarHBondContact OG1-OE1 3.41Å; M424-Q428 VanDerWaalsContact O-CG 3.31Å; M424-Q428 WeakPolarHBondContact O-CG 3.49Å; M424-Q428 PolarHBondContact O-N 2.9Å; Q425-Q428 WeakPolarHBondContact O-CB 3.37Å; Q425-Q428 PolarHBondContact O-N 2.82Å; Q428-L431 PolarHBondContact O-N 3.02Å; Q428-F432 WeakPolarHBondContact O-CB 3.44Å; Q428-F432 PolarHBondContact O-N 3.44Å
429	L	80.4	Confident	77	Confident	2 Å²	2	23.5 Å²	23.5	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-57.9	-54.8	173.5	178.8	63.9	0	0	0	111.7	L390 Q425 D426 V427 L431 F432 I433 F624 L628	L390-L429 HydrophobicContact CD1-CD1 3.31Å; L390-L429 HydrophobicContact CD1-CG 4.4Å; L390-L429 HydrophobicContact CD2-CB 4.02Å; L390-L429 HydrophobicContact CD2-CD1 4Å; L390-L429 HydrophobicContact CG-CD1 4.27Å; Q425-L429 WeakPolarHBondContact O-CB 3.46Å; Q425-L429 PolarHBondContact O-N 3.04Å; D426-L429 VanDerWaalsContact O-CB 3.31Å; D426-L429 WeakPolarHBondContact O-CB 3.05Å; V427-L429 PolarHBondContact O-N 3.12Å; L429-L431 PolarHBondContact O-N 3.3Å; L429-F432 WeakPolarHBondContact O-CB 3.27Å; L429-F432 PolarHBondContact O-N 3.5Å; L429-I433 HydrophobicContact CD1-CD1 4.44Å; L429-I433 HydrophobicContact CD1-CG1 4.46Å; L429-I433 HydrophobicContact CG-CD1 4.2Å; L429-I433 WeakPolarHBondContact O-CG1 3.37Å; L429-I433 PolarHBondContact O-N 3.19Å; L429-F624 HydrophobicContact CD2-CB 3.37Å; L429-F624 HydrophobicContact CD2-CD1 3.74Å; L429-F624 HydrophobicContact CD2-CD2 3.82Å; L429-F624 HydrophobicContact CD2-CE1 4.48Å; L429-F624 HydrophobicContact CD2-CG 3.37Å; L429-L628 HydrophobicContact CD1-CD1 3.26Å; L429-L628 HydrophobicContact CD1-CD2 3.49Å; L429-L628 VanDerWaalsContact CD1-CD2 3.49Å; L429-L628 HydrophobicContact CD1-CG 3.97Å; L429-L628 HydrophobicContact CG-CD1 4.15Å
430	G	72.4	Confident	76.3	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.01	13%	0.131	C	C	.	.	H	α-helix	trans	-56.4	-41.1	178.4	0	0	0	0	0	111.9	D426 V427 I433 A434	D426-G430 PolarHBondContact O-N 3.27Å; V427-G430 PolarHBondContact O-N 3.5Å; G430-I433 PolarHBondContact O-N 3.41Å; G430-A434 PolarHBondContact O-N 3.05Å; G430-A434 VanDerWaalsContact O-N 3.13Å
431	L	74.5	Confident	75.5	Confident	67 Å²	67	28.2 Å²	28.2	35%	0.351	15%	0.153	S	C	.	.	H	α-helix	trans	-63.2	-42.9	174.4	-178.1	64.5	0	0	0	112.3	V427 Q428 L429 A434 V435 L468	V427-L431 PolarHBondContact O-N 3.27Å; V427-L431 VanDerWaalsContact O-N 3.14Å; Q428-L431 PolarHBondContact O-N 3.02Å; L429-L431 PolarHBondContact O-N 3.3Å; L431-A434 WeakPolarHBondContact O-CB 3.08Å; L431-A434 PolarHBondContact O-N 3.31Å; L431-V435 WeakPolarHBondContact O-CG2 3.45Å; L431-V435 PolarHBondContact O-N 2.75Å; L431-V435 VanDerWaalsContact O-N 3.11Å; L431-L468 HydrophobicContact CD1-CD1 3.49Å; L431-L468 VanDerWaalsContact CD1-CD1 3.49Å; L431-L468 HydrophobicContact CD1-CD2 3.72Å; L431-L468 HydrophobicContact CD1-CG 4.25Å
432	F	78.9	Confident	74.2	Confident	30 Å²	30	29.6 Å²	29.6	13%	0.132	17%	0.165	C	C	.	.	H	α-helix	trans	-65.1	-41.2	179	179.1	-102.3	0	0	0	112.3	F383 T386 Q428 L429 A434 V435 M436 L628	F383-F432 AromaticContact CD2-CE1 3.74Å; F383-F432 HydrophobicContact CD2-CE1 3.74Å; F383-F432 AromaticContact CD2-CZ 3.74Å; F383-F432 HydrophobicContact CD2-CZ 3.74Å; F383-F432 AromaticContact CE2-CE1 3.76Å; F383-F432 HydrophobicContact CE2-CE1 3.76Å; F383-F432 HydrophobicContact CE2-CZ 4.25Å; T386-F432 HydrophobicContact CG2-CB 4.34Å; T386-F432 HydrophobicContact CG2-CD1 3.73Å; T386-F432 HydrophobicContact CG2-CD2 3.7Å; T386-F432 HydrophobicContact CG2-CE1 3.83Å; T386-F432 HydrophobicContact CG2-CE2 3.81Å; T386-F432 HydrophobicContact CG2-CG 3.64Å; T386-F432 HydrophobicContact CG2-CZ 3.88Å; Q428-F432 WeakPolarHBondContact O-CB 3.44Å; Q428-F432 PolarHBondContact O-N 3.44Å; L429-F432 WeakPolarHBondContact O-CB 3.27Å; L429-F432 PolarHBondContact O-N 3.5Å; F432-A434 VanDerWaalsContact C-N 3.29Å; F432-A434 PolarHBondContact O-N 2.91Å; F432-V435 PolarHBondContact O-N 3.26Å; F432-V435 VanDerWaalsContact O-N 3.12Å; F432-M436 PolarHBondContact O-N 3.43Å; F432-L628 HydrophobicContact CD1-CD2 3.69Å; F432-L628 HydrophobicContact CE1-CD2 3.85Å
433	I	74.4	Confident	72.8	Confident	8 Å²	8	31.6 Å²	31.6	4%	0.041	19%	0.185	C	C	.	.	H	α-helix	trans	-61.8	-41	175.9	-57.1	170.2	0	0	0	110	L429 G430 V435 M436 P437 S522 E524 L628	L429-I433 HydrophobicContact CD1-CD1 4.44Å; L429-I433 HydrophobicContact CD1-CG1 4.46Å; L429-I433 HydrophobicContact CG-CD1 4.2Å; L429-I433 WeakPolarHBondContact O-CG1 3.37Å; L429-I433 PolarHBondContact O-N 3.19Å; G430-I433 PolarHBondContact O-N 3.41Å; I433-V435 VanDerWaalsContact C-N 3.26Å; I433-V435 PolarHBondContact O-N 3.44Å; I433-M436 WeakPolarHBondContact O-CB 3.4Å; I433-M436 PolarHBondContact O-N 3.4Å; I433-M436 VanDerWaalsContact O-N 3.16Å; I433-P437 WeakPolarHBondContact O-CD 3.44Å; I433-S522 VanDerWaalsContact CG2-CB 3.49Å; I433-S522 WeakPolarHBondContact CG2-OG 3.41Å; I433-E524 HydrophobicContact CD1-CB 4.08Å; I433-E524 HydrophobicContact CD1-CG 4.09Å; I433-L628 HydrophobicContact CD1-CD1 3.64Å; I433-L628 HydrophobicContact CG1-CD1 3.63Å; I433-L628 HydrophobicContact CG1-CG 4.27Å
434	A	68.6	Low	71.7	Confident	17 Å²	17	34.9 Å²	34.9	14%	0.14	21%	0.214	C	C	.	.	H	α-helix	trans	-61.6	-32.5	175.2	0	0	0	0	0	113.4	G430 L431 F432 V521 L525	G430-A434 PolarHBondContact O-N 3.05Å; G430-A434 VanDerWaalsContact O-N 3.13Å; L431-A434 WeakPolarHBondContact O-CB 3.08Å; L431-A434 PolarHBondContact O-N 3.31Å; F432-A434 VanDerWaalsContact C-N 3.29Å; F432-A434 PolarHBondContact O-N 2.91Å; A434-V521 HydrophobicContact CB-CG1 3.89Å; A434-L525 HydrophobicContact CB-CD2 3.8Å
435	V	70.4	Confident	70.1	Confident	37 Å²	37	36.5 Å²	36.5	22%	0.224	23%	0.226	C	C	.	.	H	α-helix	trans	-82.9	-20.4	177.4	176.3	0	0	0	0	112.3	L431 F432 I433 T438 L439 I464	L431-V435 WeakPolarHBondContact O-CG2 3.45Å; L431-V435 PolarHBondContact O-N 2.75Å; L431-V435 VanDerWaalsContact O-N 3.11Å; F432-V435 PolarHBondContact O-N 3.26Å; F432-V435 VanDerWaalsContact O-N 3.12Å; I433-V435 VanDerWaalsContact C-N 3.26Å; I433-V435 PolarHBondContact O-N 3.44Å; V435-T438 PolarHBondContact O-N 3.12Å; V435-T438 VanDerWaalsContact O-N 3.11Å; V435-T438 PolarHBondContact O-OG1 3.42Å; V435-L439 PolarHBondContact O-N 2.91Å; V435-I464 HydrophobicContact CG1-CD1 3.88Å; V435-I464 HydrophobicContact CG2-CG2 3.74Å
436	M	73.1	Confident	68.3	Low	18 Å²	18	41.9 Å²	41.9	9%	0.089	26%	0.259	C	S	.	.	H	α-helix	trans	-54.6	-44.2	-173.8	-162.5	-169.7	81.4	0	0	114.7	F383 F432 I433 T438 L439 I440 R631 A635 I637	F383-M436 HydrophobicContact CD2-SD 4.48Å; F383-M436 HydrophobicContact CE2-CG 4.49Å; F383-M436 HydrophobicContact CE2-SD 3.86Å; F432-M436 PolarHBondContact O-N 3.43Å; I433-M436 WeakPolarHBondContact O-CB 3.4Å; I433-M436 PolarHBondContact O-N 3.4Å; I433-M436 VanDerWaalsContact O-N 3.16Å; M436-T438 VanDerWaalsContact C-N 3.26Å; M436-T438 PolarHBondContact O-N 2.93Å; M436-L439 WeakPolarHBondContact O-CB 3.45Å; M436-L439 PolarHBondContact O-N 2.97Å; M436-L439 VanDerWaalsContact O-N 3.11Å; M436-I440 HydrophobicContact CE-CD1 4.21Å; M436-I440 WeakPolarHBondContact O-CG1 3.35Å; M436-I440 PolarHBondContact O-N 3Å; M436-I440 VanDerWaalsContact O-N 3.17Å; M436-R631 HydrophobicContact CE-CB 4.14Å; M436-A635 HydrophobicContact CE-CB 4.13Å; M436-I637 HydrophobicContact CE-CD1 4.46Å; M436-I637 HydrophobicContact CG-CD1 3.85Å; M436-I637 HydrophobicContact SD-CD1 4.09Å
437	P	68.6	Low	66.8	Low	64 Å²	64	52.2 Å²	52.2	42%	0.416	30%	0.3	S	S	.	.	H	α-helix	trans	-54.7	-40.5	176.9	-27	36.5	0	0	0	113.6	I433 I440 Q441	I433-P437 WeakPolarHBondContact O-CD 3.44Å; P437-I440 WeakPolarHBondContact O-CB 3.48Å; P437-I440 PolarHBondContact O-N 3.5Å; P437-Q441 PolarHBondContact O-N 2.85Å
438	T	64.8	Low	65.5	Low	32 Å²	32	55.2 Å²	55.2	20%	0.196	32%	0.322	C	S	.	.	H	α-helix	trans	-71.4	-34.2	179.8	69.2	0	0	0	0	112.2	V435 M436 I440 Q441 A442 I464	V435-T438 PolarHBondContact O-N 3.12Å; V435-T438 VanDerWaalsContact O-N 3.11Å; V435-T438 PolarHBondContact O-OG1 3.42Å; M436-T438 VanDerWaalsContact C-N 3.26Å; M436-T438 PolarHBondContact O-N 2.93Å; T438-I440 VanDerWaalsContact C-N 3.3Å; T438-I440 PolarHBondContact O-N 3.44Å; T438-Q441 PolarHBondContact O-N 2.92Å; T438-A442 PolarHBondContact O-N 3.39Å; T438-I464 HydrophobicContact CG2-CD1 4.32Å; T438-I464 HydrophobicContact CG2-CG1 3.85Å; T438-I464 WeakPolarHBondContact OG1-CD1 3.37Å
439	L	65.7	Low	64.7	Low	46 Å²	46	55.8 Å²	55.8	24%	0.241	33%	0.331	C	S	.	.	H	α-helix	trans	-66.4	-33.6	176.8	-163.3	68.9	0	0	0	111.6	V382 V435 M436 G443	V382-L439 HydrophobicContact CG1-CD2 4.41Å; V435-L439 PolarHBondContact O-N 2.91Å; M436-L439 WeakPolarHBondContact O-CB 3.45Å; M436-L439 PolarHBondContact O-N 2.97Å; M436-L439 VanDerWaalsContact O-N 3.11Å; L439-G443 PolarHBondContact O-N 3.23Å; L439-G443 VanDerWaalsContact O-N 3.15Å
440	I	66.6	Low	64.3	Low	59 Å²	59	62.3 Å²	62.3	30%	0.303	36%	0.364	S	S	.	.	H	α-helix	trans	-64.8	-47.2	173.1	-62.8	159.5	0	0	0	110.3	M436 P437 T438 A442 G443 A444 A635 I637	M436-I440 HydrophobicContact CE-CD1 4.21Å; M436-I440 WeakPolarHBondContact O-CG1 3.35Å; M436-I440 PolarHBondContact O-N 3Å; M436-I440 VanDerWaalsContact O-N 3.17Å; P437-I440 WeakPolarHBondContact O-CB 3.48Å; P437-I440 PolarHBondContact O-N 3.5Å; T438-I440 VanDerWaalsContact C-N 3.3Å; T438-I440 PolarHBondContact O-N 3.44Å; I440-A442 VanDerWaalsContact C-N 3.26Å; I440-A442 PolarHBondContact O-N 3.34Å; I440-G443 PolarHBondContact O-N 2.85Å; I440-G443 VanDerWaalsContact O-N 3.09Å; I440-A444 PolarHBondContact O-N 2.75Å; I440-A635 HydrophobicContact CD1-CB 3.46Å; I440-A635 VanDerWaalsContact CD1-CB 3.46Å; I440-A635 HydrophobicContact CG1-CB 4.33Å; I440-I637 HydrophobicContact CD1-CD1 3.94Å; I440-I637 HydrophobicContact CD1-CG1 4.24Å; I440-I637 HydrophobicContact CG1-CD1 3.49Å; I440-I637 VanDerWaalsContact CG1-CD1 3.49Å; I440-I637 HydrophobicContact CG1-CG1 3.63Å
441	Q	64.3	Low	64.3	Low	108 Å²	108	67.7 Å²	67.7	51%	0.505	40%	0.397	S	S	.	.	H	α-helix	trans	-66.1	-30.5	-178.2	-159.8	175	72.3	0	0	112.4	P437 T438	P437-Q441 PolarHBondContact O-N 2.85Å; T438-Q441 PolarHBondContact O-N 2.92Å
442	A	59.6	Low	64.2	Low	33 Å²	33	71.5 Å²	71.5	27%	0.273	41%	0.41	S	S	.	.	H	α-helix	trans	-71.7	-31.5	172.1	0	0	0	0	0	113.3	T438 I440 A444 S445 L460	T438-A442 PolarHBondContact O-N 3.39Å; I440-A442 VanDerWaalsContact C-N 3.26Å; I440-A442 PolarHBondContact O-N 3.34Å; A442-A444 PolarHBondContact O-N 3.08Å; A442-S445 PolarHBondContact O-OG 3.18Å; A442-L460 HydrophobicContact CB-CD1 3.95Å
443	G	56.3	Low	63.7	Low	41 Å²	41	73 Å²	73	42%	0.423	42%	0.418	S	S	.	.	H	α-helix	trans	-79.4	-10.1	-177.6	0	0	0	0	0	115.7	L439 I440	L439-G443 PolarHBondContact O-N 3.23Å; L439-G443 VanDerWaalsContact O-N 3.15Å; I440-G443 PolarHBondContact O-N 2.85Å; I440-G443 VanDerWaalsContact O-N 3.09Å
444	A	57.2	Low	63.7	Low	81 Å²	81	77.7 Å²	77.7	67%	0.669	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-4.3	-174.3	0	0	0	0	0	114.8	I440 A442	I440-A444 PolarHBondContact O-N 2.75Å; A442-A444 PolarHBondContact O-N 3.08Å
445	S	50.1	Low	64.1	Low	41 Å²	41	81.7 Å²	81.7	29%	0.287	46%	0.46	S	S	.	.			trans	-86.3	125.8	-177.9	22.5	0	0	0	0	113.5	A442 E453 R456	A442-S445 PolarHBondContact O-OG 3.18Å; S445-E453 PolarHBondContact OG-OE1 3.3Å; S445-R456 PolarHBondContact OG-NH1 3.13Å
446	T	48.8	Very low	64.1	Low	115 Å²	115	84.6 Å²	84.6	71%	0.706	47%	0.467	S	S	*	.			trans	-112.5	103.9	169.5	-64	0	0	0	0	108.6
447	Y	49.6	Very low	63.9	Low	217 Å²	217	87.6 Å²	87.6	85%	0.851	48%	0.483	S	S	*	.			trans	57.8	138.8	170.1	-51.1	-69.2	0	0	0	118.5
448	S	49.1	Very low	64.3	Low	100 Å²	100	90 Å²	90	70%	0.699	49%	0.492	S	S	*	.	S	Bend		-167	11.2	71.5	63.4	0	0	0	0	116.7
449	S	66.1	Low	64.9	Low	54 Å²	54	93 Å²	93	38%	0.378	51%	0.505	S	S	.	.			trans	-154.8	121.6	175.9	-60.2	0	0	0	0	113.1	V451 K452 E453	S449-V451 PolarHBondContact O-N 2.95Å; S449-V451 VanDerWaalsContact O-N 3.13Å; S449-K452 PolarHBondContact O-N 3.43Å; S449-E453 PolarHBondContact O-N 3.01Å
450	I	71.1	Confident	65.2	Low	140 Å²	140	91.4 Å²	91.4	72%	0.718	50%	0.497	S	S	*	.	H	α-helix	trans	-51.7	-38.3	178	-64.4	165.8	0	0	0	111.6	E453 I454	I450-E453 PolarHBondContact O-N 3.37Å; I450-I454 HydrophobicContact CG2-CD1 3.81Å; I450-I454 HydrophobicContact CG2-CG1 4.47Å; I450-I454 VanDerWaalsContact O-CG1 3.28Å; I450-I454 WeakPolarHBondContact O-CG1 3.36Å; I450-I454 PolarHBondContact O-N 2.77Å
451	V	72.8	Confident	65.5	Low	114 Å²	114	92.8 Å²	92.8	69%	0.691	50%	0.504	S	S	*	.	H	α-helix	trans	-67.7	-38.8	179.1	-178.1	0	0	0	0	112.4	S449 L455	S449-V451 PolarHBondContact O-N 2.95Å; S449-V451 VanDerWaalsContact O-N 3.13Å; V451-L455 WeakPolarHBondContact O-CB 3.46Å; V451-L455 PolarHBondContact O-N 3.2Å
452	K	71.3	Confident	66.1	Low	146 Å²	146	89.5 Å²	89.5	64%	0.635	50%	0.499	S	S	*	.	H	α-helix	trans	-71.5	-34	176.6	-70	-177.3	179.7	176.4	0	111.2	S449 R456	S449-K452 PolarHBondContact O-N 3.43Å; K452-R456 VanDerWaalsContact O-CB 3.25Å; K452-R456 WeakPolarHBondContact O-CB 3.23Å; K452-R456 PolarHBondContact O-N 3.24Å
453	E	70.1	Confident	66.8	Low	63 Å²	63	93.1 Å²	93.1	29%	0.294	51%	0.51	S	S	.	.	H	α-helix	trans	-66.6	-46.5	174.9	-142.9	68.7	-159	0	0	111	S445 S449 I450 L455 R456 I457	S445-E453 PolarHBondContact OG-OE1 3.3Å; S449-E453 PolarHBondContact O-N 3.01Å; I450-E453 PolarHBondContact O-N 3.37Å; E453-L455 PolarHBondContact O-N 3.38Å; E453-R456 PolarHBondContact O-N 3.45Å; E453-I457 HydrophobicContact CG-CD1 4.33Å; E453-I457 WeakPolarHBondContact O-CB 3.26Å; E453-I457 WeakPolarHBondContact O-CD1 3.49Å; E453-I457 WeakPolarHBondContact O-CG1 3.35Å; E453-I457 PolarHBondContact O-N 3.03Å
454	I	73.4	Confident	67.5	Low	106 Å²	106	92.8 Å²	92.8	54%	0.544	50%	0.499	S	S	.	.	H	α-helix	trans	-61.8	-44.7	176.6	-68	166.6	0	0	0	111	I450 R456 I457 L458	I450-I454 HydrophobicContact CG2-CD1 3.81Å; I450-I454 HydrophobicContact CG2-CG1 4.47Å; I450-I454 VanDerWaalsContact O-CG1 3.28Å; I450-I454 WeakPolarHBondContact O-CG1 3.36Å; I450-I454 PolarHBondContact O-N 2.77Å; I454-R456 VanDerWaalsContact C-N 3.35Å; I454-R456 PolarHBondContact O-N 3.05Å; I454-I457 PolarHBondContact O-N 3.35Å; I454-L458 WeakPolarHBondContact O-CB 3.44Å; I454-L458 PolarHBondContact O-N 3.46Å
455	L	77.5	Confident	68.4	Low	100 Å²	100	94.8 Å²	94.8	52%	0.524	50%	0.497	S	S	.	.	H	α-helix	trans	-64	-40.1	178.5	-173.9	64	0	0	0	111.7	V451 E453 L458 I459	V451-L455 WeakPolarHBondContact O-CB 3.46Å; V451-L455 PolarHBondContact O-N 3.2Å; E453-L455 PolarHBondContact O-N 3.38Å; L455-L458 PolarHBondContact O-N 3.38Å; L455-I459 HydrophobicContact CG-CD1 4.18Å; L455-I459 WeakPolarHBondContact O-CD1 3.41Å; L455-I459 VanDerWaalsContact O-CG1 3.25Å; L455-I459 WeakPolarHBondContact O-CG1 3.41Å; L455-I459 PolarHBondContact O-N 2.84Å
456	R	69.6	Low	69.8	Low	98 Å²	98	100.5 Å²	100.5	37%	0.37	52%	0.517	S	S	.	.	H	α-helix	trans	-68.5	-42.4	177.1	-168.8	179.9	-169.9	-160.2	1.2	112.1	S445 K452 E453 I454 L458 I459 L460	S445-R456 PolarHBondContact OG-NH1 3.13Å; K452-R456 VanDerWaalsContact O-CB 3.25Å; K452-R456 WeakPolarHBondContact O-CB 3.23Å; K452-R456 PolarHBondContact O-N 3.24Å; E453-R456 PolarHBondContact O-N 3.45Å; I454-R456 VanDerWaalsContact C-N 3.35Å; I454-R456 PolarHBondContact O-N 3.05Å; R456-L458 VanDerWaalsContact C-N 3.28Å; R456-L458 PolarHBondContact O-N 3.29Å; R456-I459 PolarHBondContact O-N 3.48Å; R456-L460 HydrophobicContact CG-CD1 4.31Å; R456-L460 WeakPolarHBondContact O-CB 3.18Å; R456-L460 WeakPolarHBondContact O-CG 3.25Å; R456-L460 PolarHBondContact O-N 2.97Å
457	I	69.6	Low	70.9	Confident	82 Å²	82	96.6 Å²	96.6	42%	0.421	50%	0.495	S	S	.	.	H	α-helix	trans	-60	-42	173.5	-70	164.7	0	0	0	109.9	E453 I454 L460 I461	E453-I457 HydrophobicContact CG-CD1 4.33Å; E453-I457 WeakPolarHBondContact O-CB 3.26Å; E453-I457 WeakPolarHBondContact O-CD1 3.49Å; E453-I457 WeakPolarHBondContact O-CG1 3.35Å; E453-I457 PolarHBondContact O-N 3.03Å; I454-I457 PolarHBondContact O-N 3.35Å; I457-L460 PolarHBondContact O-N 3.01Å; I457-I461 HydrophobicContact CG2-CD1 3.66Å; I457-I461 HydrophobicContact CG2-CG1 4.33Å; I457-I461 WeakPolarHBondContact O-CB 3.36Å; I457-I461 VanDerWaalsContact O-CG1 3.25Å; I457-I461 WeakPolarHBondContact O-CG1 3.44Å; I457-I461 PolarHBondContact O-N 2.96Å
458	L	76.8	Confident	72	Confident	114 Å²	114	89.6 Å²	89.6	60%	0.597	47%	0.472	S	S	*	.	H	α-helix	trans	-64.5	-40	176.6	-170.6	68.3	0	0	0	112.1	I454 L455 R456 G462	I454-L458 WeakPolarHBondContact O-CB 3.44Å; I454-L458 PolarHBondContact O-N 3.46Å; L455-L458 PolarHBondContact O-N 3.38Å; R456-L458 VanDerWaalsContact C-N 3.28Å; R456-L458 PolarHBondContact O-N 3.29Å; L458-G462 PolarHBondContact O-N 3.38Å
459	I	77.8	Confident	73.5	Confident	94 Å²	94	87.5 Å²	87.5	48%	0.482	46%	0.46	S	S	.	.	H	α-helix	trans	-64.8	-44.7	174.6	-69.6	163.1	0	0	0	110.8	L455 R456 G462 Q463	L455-I459 HydrophobicContact CG-CD1 4.18Å; L455-I459 WeakPolarHBondContact O-CD1 3.41Å; L455-I459 VanDerWaalsContact O-CG1 3.25Å; L455-I459 WeakPolarHBondContact O-CG1 3.41Å; L455-I459 PolarHBondContact O-N 2.84Å; R456-I459 PolarHBondContact O-N 3.48Å; I459-G462 CarbonylContact O-C 3.53Å; I459-G462 PolarHBondContact O-N 3.3Å; I459-Q463 HydrophobicContact CG2-CG 4.5Å; I459-Q463 WeakPolarHBondContact O-CB 3.21Å; I459-Q463 WeakPolarHBondContact O-CG 3.44Å; I459-Q463 PolarHBondContact O-N 2.85Å
460	L	71.7	Confident	74.2	Confident	13 Å²	13	86 Å²	86	7%	0.068	45%	0.452	C	S	.	.	H	α-helix	trans	-63.4	-45.4	177.8	-73.6	167.9	0	0	0	111.6	A442 R456 I457 G462 Q463 I464	A442-L460 HydrophobicContact CB-CD1 3.95Å; R456-L460 HydrophobicContact CG-CD1 4.31Å; R456-L460 WeakPolarHBondContact O-CB 3.18Å; R456-L460 WeakPolarHBondContact O-CG 3.25Å; R456-L460 PolarHBondContact O-N 2.97Å; I457-L460 PolarHBondContact O-N 3.01Å; L460-G462 VanDerWaalsContact C-N 3.31Å; L460-G462 PolarHBondContact O-N 2.94Å; L460-Q463 PolarHBondContact O-N 3.49Å; L460-I464 WeakPolarHBondContact O-CD1 3.22Å; L460-I464 VanDerWaalsContact O-CG1 3.25Å; L460-I464 WeakPolarHBondContact O-CG1 3.46Å; L460-I464 PolarHBondContact O-N 3.47Å
461	I	72	Confident	74.6	Confident	89 Å²	89	79.7 Å²	79.7	46%	0.456	42%	0.42	S	S	.	.	H	α-helix	trans	-61.8	-41.8	173.9	-68.3	169.4	0	0	0	110.5	I457 I464 L465	I457-I461 HydrophobicContact CG2-CD1 3.66Å; I457-I461 HydrophobicContact CG2-CG1 4.33Å; I457-I461 WeakPolarHBondContact O-CB 3.36Å; I457-I461 VanDerWaalsContact O-CG1 3.25Å; I457-I461 WeakPolarHBondContact O-CG1 3.44Å; I457-I461 PolarHBondContact O-N 2.96Å; I461-I464 PolarHBondContact O-N 2.89Å; I461-L465 WeakPolarHBondContact O-CB 3.44Å; I461-L465 PolarHBondContact O-N 3.42Å
462	G	77.9	Confident	74.9	Confident	39 Å²	39	80.7 Å²	80.7	40%	0.402	42%	0.415	S	S	.	.	H	α-helix	trans	-60.8	-42.1	175	0	0	0	0	0	112.7	L458 I459 L460 L465 F466	L458-G462 PolarHBondContact O-N 3.38Å; I459-G462 CarbonylContact O-C 3.53Å; I459-G462 PolarHBondContact O-N 3.3Å; L460-G462 VanDerWaalsContact C-N 3.31Å; L460-G462 PolarHBondContact O-N 2.94Å; G462-L465 PolarHBondContact O-N 3.37Å; G462-F466 WeakPolarHBondContact O-CB 3.45Å; G462-F466 PolarHBondContact O-N 3.34Å
463	Q	74.6	Confident	75.5	Confident	108 Å²	108	79 Å²	79	51%	0.505	41%	0.412	S	S	.	.	H	α-helix	trans	-64.7	-42.5	175.2	-76.5	177.1	-46	0	0	112	I459 L460 F466 S467	I459-Q463 HydrophobicContact CG2-CG 4.5Å; I459-Q463 WeakPolarHBondContact O-CB 3.21Å; I459-Q463 WeakPolarHBondContact O-CG 3.44Å; I459-Q463 PolarHBondContact O-N 2.85Å; L460-Q463 PolarHBondContact O-N 3.49Å; Q463-F466 PolarHBondContact O-N 3.35Å; Q463-S467 WeakPolarHBondContact O-CB 3.39Å; Q463-S467 PolarHBondContact O-N 2.86Å; Q463-S467 PolarHBondContact O-OG 3.25Å
464	I	69.8	Low	76.2	Confident	34 Å²	34	78.6 Å²	78.6	17%	0.174	41%	0.411	C	S	.	.	H	α-helix	trans	-62.5	-47.4	175	-66.5	158.9	0	0	0	110.7	V435 T438 L460 I461 F466 S467 L468	V435-I464 HydrophobicContact CG1-CD1 3.88Å; V435-I464 HydrophobicContact CG2-CG2 3.74Å; T438-I464 HydrophobicContact CG2-CD1 4.32Å; T438-I464 HydrophobicContact CG2-CG1 3.85Å; T438-I464 WeakPolarHBondContact OG1-CD1 3.37Å; L460-I464 WeakPolarHBondContact O-CD1 3.22Å; L460-I464 VanDerWaalsContact O-CG1 3.25Å; L460-I464 WeakPolarHBondContact O-CG1 3.46Å; L460-I464 PolarHBondContact O-N 3.47Å; I461-I464 PolarHBondContact O-N 2.89Å; I464-F466 VanDerWaalsContact C-N 3.26Å; I464-F466 PolarHBondContact O-N 3Å; I464-S467 PolarHBondContact O-N 3.23Å; I464-S467 PolarHBondContact O-OG 2.94Å; I464-S467 VanDerWaalsContact O-OG 3.08Å; I464-L468 WeakPolarHBondContact O-CB 3.45Å; I464-L468 PolarHBondContact O-N 3.45Å
465	L	76.1	Confident	76.6	Confident	123 Å²	123	74.1 Å²	74.1	64%	0.644	39%	0.389	S	S	*	.	H	α-helix	trans	-64.7	-38.1	-178.6	-145.6	96.1	0	0	0	110.5	I461 G462 A469	I461-L465 WeakPolarHBondContact O-CB 3.44Å; I461-L465 PolarHBondContact O-N 3.42Å; G462-L465 PolarHBondContact O-N 3.37Å; L465-A469 WeakPolarHBondContact O-CB 3.41Å; L465-A469 PolarHBondContact O-N 2.86Å
466	F	80.4	Confident	76.8	Confident	161 Å²	161	72.8 Å²	72.8	71%	0.706	38%	0.383	S	S	*	.	H	α-helix	trans	-67.7	-47.4	176.3	-177.2	-96.7	0	0	0	112.1	G462 Q463 I464 L468 A469 A470	G462-F466 WeakPolarHBondContact O-CB 3.45Å; G462-F466 PolarHBondContact O-N 3.34Å; Q463-F466 PolarHBondContact O-N 3.35Å; I464-F466 VanDerWaalsContact C-N 3.26Å; I464-F466 PolarHBondContact O-N 3Å; F466-L468 VanDerWaalsContact C-N 3.35Å; F466-L468 PolarHBondContact O-N 3.11Å; F466-A469 PolarHBondContact O-N 2.8Å; F466-A470 VanDerWaalsContact O-CB 3.28Å; F466-A470 WeakPolarHBondContact O-CB 3.2Å; F466-A470 PolarHBondContact O-N 3.23Å
467	S	70.5	Confident	77.5	Confident	34 Å²	34	71.7 Å²	71.7	24%	0.238	39%	0.387	C	S	.	.	H	α-helix	trans	-63.9	-41.9	178.1	68.5	0	0	0	0	111.1	Q463 I464 A470 V471	Q463-S467 WeakPolarHBondContact O-CB 3.39Å; Q463-S467 PolarHBondContact O-N 2.86Å; Q463-S467 PolarHBondContact O-OG 3.25Å; I464-S467 PolarHBondContact O-N 3.23Å; I464-S467 PolarHBondContact O-OG 2.94Å; I464-S467 VanDerWaalsContact O-OG 3.08Å; S467-A470 PolarHBondContact O-N 2.84Å; S467-V471 WeakPolarHBondContact O-CB 3.46Å; S467-V471 VanDerWaalsContact O-CG2 3.3Å; S467-V471 WeakPolarHBondContact O-CG2 3.42Å; S467-V471 PolarHBondContact O-N 3.25Å
468	L	74.1	Confident	78.1	Confident	69 Å²	69	68.6 Å²	68.6	36%	0.361	37%	0.371	S	S	.	.	H	α-helix	trans	-65.1	-41.8	175.9	-169.3	67	0	0	0	112	L431 I464 F466 F472	L431-L468 HydrophobicContact CD1-CD1 3.49Å; L431-L468 VanDerWaalsContact CD1-CD1 3.49Å; L431-L468 HydrophobicContact CD1-CD2 3.72Å; L431-L468 HydrophobicContact CD1-CG 4.25Å; I464-L468 WeakPolarHBondContact O-CB 3.45Å; I464-L468 PolarHBondContact O-N 3.45Å; F466-L468 VanDerWaalsContact C-N 3.35Å; F466-L468 PolarHBondContact O-N 3.11Å; L468-F472 VanDerWaalsContact O-CB 3.28Å; L468-F472 WeakPolarHBondContact O-CB 3.28Å; L468-F472 PolarHBondContact O-N 3.26Å
469	A	80.1	Confident	78.4	Confident	56 Å²	56	68 Å²	68	46%	0.463	36%	0.363	S	S	.	.	H	α-helix	trans	-65.9	-39.2	175.3	0	0	0	0	0	112.1	L465 F466 F472 L473	L465-A469 WeakPolarHBondContact O-CB 3.41Å; L465-A469 PolarHBondContact O-N 2.86Å; F466-A469 PolarHBondContact O-N 2.8Å; A469-F472 PolarHBondContact O-N 2.93Å; A469-L473 VanDerWaalsContact O-CB 3.3Å; A469-L473 WeakPolarHBondContact O-CB 3.47Å; A469-L473 PolarHBondContact O-N 3.46Å
470	A	80.8	Confident	78.3	Confident	24 Å²	24	68 Å²	68	20%	0.198	37%	0.368	C	S	.	.	H	α-helix	trans	-64.3	-47.4	176	0	0	0	0	0	111.2	F466 S467 F472 L473 I474	F466-A470 VanDerWaalsContact O-CB 3.28Å; F466-A470 WeakPolarHBondContact O-CB 3.2Å; F466-A470 PolarHBondContact O-N 3.23Å; S467-A470 PolarHBondContact O-N 2.84Å; A470-F472 VanDerWaalsContact C-N 3.34Å; A470-F472 PolarHBondContact O-N 3.4Å; A470-L473 PolarHBondContact O-N 3.35Å; A470-I474 WeakPolarHBondContact O-CB 3.45Å; A470-I474 VanDerWaalsContact O-CG1 3.28Å; A470-I474 WeakPolarHBondContact O-CG1 3.25Å; A470-I474 PolarHBondContact O-N 3.23Å
471	V	78.8	Confident	78.5	Confident	7 Å²	7	75.8 Å²	75.8	4%	0.042	40%	0.397	C	S	.	.	H	α-helix	trans	-60.2	-44.1	174.6	170.5	0	0	0	0	111.1	S467 I474 C475 L519 V521 L529	S467-V471 WeakPolarHBondContact O-CB 3.46Å; S467-V471 VanDerWaalsContact O-CG2 3.3Å; S467-V471 WeakPolarHBondContact O-CG2 3.42Å; S467-V471 PolarHBondContact O-N 3.25Å; V471-I474 PolarHBondContact O-N 2.93Å; V471-C475 WeakPolarHBondContact O-CB 3.47Å; V471-C475 PolarHBondContact O-N 3.29Å; V471-C475 PolarHBondContact O-SG 2.83Å; V471-L519 HydrophobicContact CG2-CD1 3.69Å; V471-V521 HydrophobicContact CG2-CG2 3.98Å; V471-L529 HydrophobicContact CG1-CD1 3.34Å
472	F	80.9	Confident	78.8	Confident	135 Å²	135	75.3 Å²	75.3	59%	0.592	40%	0.396	S	S	*	.	H	α-helix	trans	-63.1	-43.2	177.3	-177.1	-103.8	0	0	0	112.1	L468 A469 A470 C475 L476	L468-F472 VanDerWaalsContact O-CB 3.28Å; L468-F472 WeakPolarHBondContact O-CB 3.28Å; L468-F472 PolarHBondContact O-N 3.26Å; A469-F472 PolarHBondContact O-N 2.93Å; A470-F472 VanDerWaalsContact C-N 3.34Å; A470-F472 PolarHBondContact O-N 3.4Å; F472-C475 WeakPolarHBondContact O-CB 3.46Å; F472-C475 PolarHBondContact O-N 2.9Å; F472-L476 HydrophobicContact CD1-CD1 3.93Å; F472-L476 HydrophobicContact CD1-CG 4.41Å; F472-L476 HydrophobicContact CE1-CD1 3.46Å; F472-L476 VanDerWaalsContact CE1-CD1 3.46Å; F472-L476 HydrophobicContact CE1-CG 4.08Å; F472-L476 HydrophobicContact CZ-CD1 4.01Å; F472-L476 HydrophobicContact CZ-CD2 4.39Å; F472-L476 HydrophobicContact CZ-CG 4.24Å; F472-L476 WeakPolarHBondContact O-CG 3.34Å; F472-L476 PolarHBondContact O-N 2.9Å
473	L	83.5	Confident	78.7	Confident	109 Å²	109	73.7 Å²	73.7	57%	0.571	38%	0.377	S	S	*	.	H	α-helix	trans	-62.9	-45.1	176.4	-174.3	69.2	0	0	0	111.3	A469 A470 C475 L476 V477	A469-L473 VanDerWaalsContact O-CB 3.3Å; A469-L473 WeakPolarHBondContact O-CB 3.47Å; A469-L473 PolarHBondContact O-N 3.46Å; A470-L473 PolarHBondContact O-N 3.35Å; L473-C475 VanDerWaalsContact C-N 3.34Å; L473-C475 PolarHBondContact O-N 3.32Å; L473-L476 WeakPolarHBondContact O-CB 3.39Å; L473-L476 PolarHBondContact O-N 3.41Å; L473-L476 VanDerWaalsContact O-N 3.17Å; L473-V477 WeakPolarHBondContact O-CG2 3.47Å; L473-V477 PolarHBondContact O-N 3.1Å
474	I	83.8	Confident	78.6	Confident	55 Å²	55	69.8 Å²	69.8	28%	0.282	37%	0.367	S	S	.	.	H	α-helix	trans	-60.7	-44.7	175.6	-72.1	165.4	0	0	0	110.4	A470 V471 L476 V477 I478 I515 L519	A470-I474 WeakPolarHBondContact O-CB 3.45Å; A470-I474 VanDerWaalsContact O-CG1 3.28Å; A470-I474 WeakPolarHBondContact O-CG1 3.25Å; A470-I474 PolarHBondContact O-N 3.23Å; V471-I474 PolarHBondContact O-N 2.93Å; I474-L476 VanDerWaalsContact C-N 3.3Å; I474-L476 PolarHBondContact O-N 3.35Å; I474-V477 PolarHBondContact O-N 3.49Å; I474-I478 HydrophobicContact CG2-CD1 3.61Å; I474-I478 HydrophobicContact CG2-CG1 4.25Å; I474-I478 WeakPolarHBondContact O-CB 3.44Å; I474-I478 VanDerWaalsContact O-CG1 3.28Å; I474-I478 WeakPolarHBondContact O-CG1 3.41Å; I474-I478 PolarHBondContact O-N 2.89Å; I474-I515 HydrophobicContact CG2-CG2 4.22Å; I474-L519 HydrophobicContact CD1-CD1 3.64Å; I474-L519 HydrophobicContact CD1-CD2 4.47Å
475	C	82.1	Confident	78.8	Confident	12 Å²	12	71 Å²	71	8%	0.081	38%	0.377	C	S	.	.	H	α-helix	trans	-59.8	-40.4	175.1	-73.4	0	0	0	0	112	V471 F472 L473 I478 K479 L533	V471-C475 WeakPolarHBondContact O-CB 3.47Å; V471-C475 PolarHBondContact O-N 3.29Å; V471-C475 PolarHBondContact O-SG 2.83Å; F472-C475 WeakPolarHBondContact O-CB 3.46Å; F472-C475 PolarHBondContact O-N 2.9Å; L473-C475 VanDerWaalsContact C-N 3.34Å; L473-C475 PolarHBondContact O-N 3.32Å; C475-I478 PolarHBondContact O-N 2.8Å; C475-K479 WeakPolarHBondContact O-CB 3.36Å; C475-K479 PolarHBondContact O-N 2.85Å; C475-L533 HydrophobicContact CB-CD2 4.21Å; C475-L533 WeakPolarHBondContact O-CD2 3.32Å
476	L	81.8	Confident	78.9	Confident	73 Å²	73	69.2 Å²	69.2	38%	0.382	36%	0.362	S	S	.	.	H	α-helix	trans	-64.7	-41.3	175.3	-75.4	177.9	0	0	0	112.4	F472 L473 I474 K479 T480	F472-L476 HydrophobicContact CD1-CD1 3.93Å; F472-L476 HydrophobicContact CD1-CG 4.41Å; F472-L476 HydrophobicContact CE1-CD1 3.46Å; F472-L476 VanDerWaalsContact CE1-CD1 3.46Å; F472-L476 HydrophobicContact CE1-CG 4.08Å; F472-L476 HydrophobicContact CZ-CD1 4.01Å; F472-L476 HydrophobicContact CZ-CD2 4.39Å; F472-L476 HydrophobicContact CZ-CG 4.24Å; F472-L476 WeakPolarHBondContact O-CG 3.34Å; F472-L476 PolarHBondContact O-N 2.9Å; L473-L476 WeakPolarHBondContact O-CB 3.39Å; L473-L476 PolarHBondContact O-N 3.41Å; L473-L476 VanDerWaalsContact O-N 3.17Å; I474-L476 VanDerWaalsContact C-N 3.3Å; I474-L476 PolarHBondContact O-N 3.35Å; L476-K479 PolarHBondContact O-N 2.96Å; L476-T480 VanDerWaalsContact O-CB 3.32Å; L476-T480 WeakPolarHBondContact O-CB 3.22Å; L476-T480 PolarHBondContact O-N 2.81Å; L476-T480 PolarHBondContact O-OG1 3.06Å
477	V	84.1	Confident	78.5	Confident	75 Å²	75	62.9 Å²	62.9	46%	0.455	33%	0.334	S	S	.	.	H	α-helix	trans	-63.9	-48.7	175.7	172.7	0	0	0	0	110.2	L473 I474 K479 T480 Y481	L473-V477 WeakPolarHBondContact O-CG2 3.47Å; L473-V477 PolarHBondContact O-N 3.1Å; I474-V477 PolarHBondContact O-N 3.49Å; V477-K479 VanDerWaalsContact C-N 3.34Å; V477-K479 PolarHBondContact O-N 3.29Å; V477-T480 PolarHBondContact O-N 3Å; V477-Y481 HydrophobicContact CG1-CD2 4.05Å; V477-Y481 WeakPolarHBondContact O-CB 3.45Å; V477-Y481 WeakPolarHBondContact O-CD2 3.39Å; V477-Y481 PolarHBondContact O-N 2.88Å
478	I	83.5	Confident	78.6	Confident	16 Å²	16	70.1 Å²	70.1	8%	0.082	36%	0.356	C	S	.	.	I	π-helix	trans	-60.1	-45.1	177.7	-69.2	172.4	0	0	0	110.6	I474 C475 T480 L482 I483 F508 M512 I515 L533	I474-I478 HydrophobicContact CG2-CD1 3.61Å; I474-I478 HydrophobicContact CG2-CG1 4.25Å; I474-I478 WeakPolarHBondContact O-CB 3.44Å; I474-I478 VanDerWaalsContact O-CG1 3.28Å; I474-I478 WeakPolarHBondContact O-CG1 3.41Å; I474-I478 PolarHBondContact O-N 2.89Å; C475-I478 PolarHBondContact O-N 2.8Å; I478-T480 VanDerWaalsContact C-N 3.32Å; I478-T480 PolarHBondContact O-N 3.39Å; I478-L482 HydrophobicContact CG2-CB 4.24Å; I478-L482 HydrophobicContact CG2-CD2 4.36Å; I478-L482 CarbonylContact O-C 3.58Å; I478-L482 WeakPolarHBondContact O-CA 3.41Å; I478-L482 WeakPolarHBondContact O-CB 3.28Å; I478-L482 PolarHBondContact O-N 3.45Å; I478-I483 PolarHBondContact O-N 3.45Å; I478-F508 HydrophobicContact CG2-CE2 4.17Å; I478-F508 HydrophobicContact CG2-CZ 4.25Å; I478-M512 HydrophobicContact CD1-CE 4.39Å; I478-M512 HydrophobicContact CD1-SD 3.62Å; I478-I515 HydrophobicContact CD1-CD1 4.26Å; I478-L533 HydrophobicContact CG2-CD1 4Å
479	K	81.4	Confident	78.7	Confident	102 Å²	102	73.9 Å²	73.9	44%	0.443	37%	0.369	S	S	.	.	I	π-helix	trans	-60.3	-40.9	176.6	-177.1	-176.6	173	177.8	0	112.3	C475 L476 V477 I483 L533	C475-K479 WeakPolarHBondContact O-CB 3.36Å; C475-K479 PolarHBondContact O-N 2.85Å; L476-K479 PolarHBondContact O-N 2.96Å; V477-K479 VanDerWaalsContact C-N 3.34Å; V477-K479 PolarHBondContact O-N 3.29Å; K479-I483 WeakPolarHBondContact O-CG2 3.44Å; K479-L533 HydrophobicContact CB-CD2 3.81Å
480	T	77.3	Confident	78.6	Confident	94 Å²	94	72.2 Å²	72.2	58%	0.577	35%	0.352	S	S	*	.	I	π-helix	trans	-80	-41.2	-174.2	-55.7	0	0	0	0	111.7	L476 V477 I478	L476-T480 VanDerWaalsContact O-CB 3.32Å; L476-T480 WeakPolarHBondContact O-CB 3.22Å; L476-T480 PolarHBondContact O-N 2.81Å; L476-T480 PolarHBondContact O-OG1 3.06Å; V477-T480 PolarHBondContact O-N 3Å; I478-T480 VanDerWaalsContact C-N 3.32Å; I478-T480 PolarHBondContact O-N 3.39Å
481	Y	75.5	Confident	78.2	Confident	176 Å²	176	74.4 Å²	74.4	69%	0.69	36%	0.358	S	S	*	.	I	π-helix	trans	-109	-28.5	-167.9	-67	-78.3	0	0	0	114.6	V477 P485	V477-Y481 HydrophobicContact CG1-CD2 4.05Å; V477-Y481 WeakPolarHBondContact O-CB 3.45Å; V477-Y481 WeakPolarHBondContact O-CD2 3.39Å; V477-Y481 PolarHBondContact O-N 2.88Å; Y481-P485 WeakPolarHBondContact O-CG 3.5Å
482	L	76.9	Confident	77.9	Confident	80 Å²	80	77 Å²	77	42%	0.419	38%	0.38	S	S	.	.	I	π-helix	trans	-109	-46	-168.3	-167.5	62.6	0	0	0	112.9	I478 G484 P485 Y486	I478-L482 HydrophobicContact CG2-CB 4.24Å; I478-L482 HydrophobicContact CG2-CD2 4.36Å; I478-L482 CarbonylContact O-C 3.58Å; I478-L482 WeakPolarHBondContact O-CA 3.41Å; I478-L482 WeakPolarHBondContact O-CB 3.28Å; I478-L482 PolarHBondContact O-N 3.45Å; L482-G484 PolarHBondContact O-N 3.21Å; L482-P485 WeakPolarHBondContact O-CD 3.48Å; L482-P485 WeakPolarHBondContact O-CG 3.44Å; L482-Y486 WeakPolarHBondContact O-CB 3.36Å; L482-Y486 PolarHBondContact O-N 3.29Å
483	I	76.4	Confident	77.5	Confident	4 Å²	4	76.4 Å²	76.4	2%	0.021	38%	0.379	C	S	.	.	H	α-helix	trans	-65.4	-44	-168.6	-155.1	81.5	0	0	0	112.4	I478 K479 Y487 F508 L533 I534 Q537	I478-I483 PolarHBondContact O-N 3.45Å; K479-I483 WeakPolarHBondContact O-CG2 3.44Å; I483-Y487 WeakPolarHBondContact O-CB 3.36Å; I483-Y487 PolarHBondContact O-N 2.86Å; I483-F508 HydrophobicContact CD1-CE1 3.8Å; I483-F508 HydrophobicContact CD1-CE2 3.87Å; I483-F508 HydrophobicContact CD1-CZ 3.39Å; I483-L533 HydrophobicContact CD1-CB 4.19Å; I483-I534 HydrophobicContact CD1-CG1 4.12Å; I483-Q537 HydrophobicContact CG1-CG 4.07Å; I483-Q537 HydrophobicContact CG2-CG 4.24Å
484	G	73.3	Confident	76.8	Confident	27 Å²	27	71.8 Å²	71.8	28%	0.278	36%	0.356	S	S	.	.	H	α-helix	trans	-63.3	-54.5	-179.3	0	0	0	0	0	112.9	L482 R488	L482-G484 PolarHBondContact O-N 3.21Å; G484-R488 WeakPolarHBondContact O-CB 3.46Å; G484-R488 PolarHBondContact O-N 3.35Å
485	P	74	Confident	75.9	Confident	60 Å²	60	77.3 Å²	77.3	39%	0.39	38%	0.378	S	S	.	.	H	α-helix	trans	-68.4	-36.8	177.2	24.1	-31.4	0	0	0	113.1	Y481 L482 K489	Y481-P485 WeakPolarHBondContact O-CG 3.5Å; L482-P485 WeakPolarHBondContact O-CD 3.48Å; L482-P485 WeakPolarHBondContact O-CG 3.44Å; P485-K489 VanDerWaalsContact O-CB 3.31Å; P485-K489 WeakPolarHBondContact O-CB 3.22Å; P485-K489 PolarHBondContact O-N 3.41Å
486	Y	77.5	Confident	75.1	Confident	85 Å²	85	80.8 Å²	80.8	33%	0.333	42%	0.416	S	S	.	.	H	α-helix	trans	-61.9	-51	176.7	-179.4	-102	0	0	0	111	L482 K489 L490 G504 F508	L482-Y486 WeakPolarHBondContact O-CB 3.36Å; L482-Y486 PolarHBondContact O-N 3.29Å; Y486-K489 PolarHBondContact O-N 3.09Å; Y486-L490 HydrophobicContact CE1-CD2 4.3Å; Y486-L490 VanDerWaalsContact O-CB 3.32Å; Y486-L490 WeakPolarHBondContact O-CB 3.32Å; Y486-L490 PolarHBondContact O-N 2.94Å; Y486-G504 WeakPolarHBondContact OH-CA 3.49Å; Y486-G504 PolarHBondContact OH-O 2.76Å; Y486-F508 HydrophobicContact CE1-CB 4.34Å
487	Y	72.5	Confident	74.8	Confident	27 Å²	27	80 Å²	80	11%	0.106	41%	0.412	C	S	.	.	H	α-helix	trans	-65.9	-43.2	178.6	-177.4	-98.7	0	0	0	112	I483 K489 L490 H491 V541 E544 I545	I483-Y487 WeakPolarHBondContact O-CB 3.36Å; I483-Y487 PolarHBondContact O-N 2.86Å; Y487-K489 PolarHBondContact O-N 3.35Å; Y487-L490 PolarHBondContact O-N 3.49Å; Y487-H491 HydrophobicContact CD1-CB 4.4Å; Y487-H491 HydrophobicContact CE1-CB 3.91Å; Y487-H491 VanDerWaalsContact O-CB 3.27Å; Y487-H491 WeakPolarHBondContact O-CB 3.46Å; Y487-H491 PolarHBondContact O-N 3.34Å; Y487-H491 PolarHBondContact OH-CD2 2.95Å; Y487-V541 HydrophobicContact CD1-CG1 4.33Å; Y487-V541 HydrophobicContact CD1-CG2 4.21Å; Y487-V541 HydrophobicContact CD2-CG1 3.98Å; Y487-V541 HydrophobicContact CE1-CB 4.16Å; Y487-V541 HydrophobicContact CE1-CG1 3.77Å; Y487-V541 HydrophobicContact CE1-CG2 3.35Å; Y487-V541 HydrophobicContact CE2-CB 4.46Å; Y487-V541 HydrophobicContact CE2-CG1 3.36Å; Y487-V541 HydrophobicContact CE2-CG2 4.48Å; Y487-V541 HydrophobicContact CG-CG1 4.43Å; Y487-V541 WeakPolarHBondContact OH-CG1 3.45Å; Y487-V541 WeakPolarHBondContact OH-CG2 3.43Å; Y487-E544 PolarHBondContact OH-OE2 2.93Å; Y487-I545 HydrophobicContact CE2-CD1 4.01Å
488	R	71.9	Confident	74.6	Confident	187 Å²	187	83.7 Å²	83.7	71%	0.706	42%	0.422	S	S	*	.	H	α-helix	trans	-59	-39.5	177.3	-177.2	175.4	64	-179.6	-0.8	111.7	G484 A492	G484-R488 WeakPolarHBondContact O-CB 3.46Å; G484-R488 PolarHBondContact O-N 3.35Å; R488-A492 VanDerWaalsContact O-CB 3.26Å; R488-A492 WeakPolarHBondContact O-CB 3.17Å; R488-A492 PolarHBondContact O-N 3.13Å
489	K	77.6	Confident	74.6	Confident	148 Å²	148	89.7 Å²	89.7	64%	0.643	45%	0.45	S	S	*	.	H	α-helix	trans	-69.8	-45.6	175.3	-168	174.1	-177.6	-179.1	0	111	P485 Y486 Y487 H491 A492 E493	P485-K489 VanDerWaalsContact O-CB 3.31Å; P485-K489 WeakPolarHBondContact O-CB 3.22Å; P485-K489 PolarHBondContact O-N 3.41Å; Y486-K489 PolarHBondContact O-N 3.09Å; Y487-K489 PolarHBondContact O-N 3.35Å; K489-H491 PolarHBondContact O-N 3.19Å; K489-A492 PolarHBondContact O-N 2.97Å; K489-E493 VanDerWaalsContact O-CG 3.31Å; K489-E493 WeakPolarHBondContact O-CG 3.46Å; K489-E493 PolarHBondContact O-N 3.48Å
490	L	77	Confident	74.8	Confident	20 Å²	20	88.1 Å²	88.1	11%	0.105	45%	0.446	C	S	.	.	H	α-helix	trans	-59	-47.2	177.5	-171.4	67.5	0	0	0	111.7	Y486 Y487 E493 S494 I500 L501	Y486-L490 HydrophobicContact CE1-CD2 4.3Å; Y486-L490 VanDerWaalsContact O-CB 3.32Å; Y486-L490 WeakPolarHBondContact O-CB 3.32Å; Y486-L490 PolarHBondContact O-N 2.94Å; Y487-L490 PolarHBondContact O-N 3.49Å; L490-E493 PolarHBondContact O-N 2.83Å; L490-S494 WeakPolarHBondContact O-CA 3.27Å; L490-S494 WeakPolarHBondContact O-CB 3.4Å; L490-S494 PolarHBondContact O-N 2.99Å; L490-I500 HydrophobicContact CD1-CG2 3.93Å; L490-L501 HydrophobicContact CD2-CD1 3.88Å; L490-L501 HydrophobicContact CG-CD1 4.21Å
491	H	73.3	Confident	75.2	Confident	71 Å²	71	83.7 Å²	83.7	33%	0.329	42%	0.418	S	S	.	.	H	α-helix	trans	-67.7	-33.4	177.3	-179.2	-85.9	0	0	0	112.3	Y487 K489 K495 E544	Y487-H491 HydrophobicContact CD1-CB 4.4Å; Y487-H491 HydrophobicContact CE1-CB 3.91Å; Y487-H491 VanDerWaalsContact O-CB 3.27Å; Y487-H491 WeakPolarHBondContact O-CB 3.46Å; Y487-H491 PolarHBondContact O-N 3.34Å; Y487-H491 PolarHBondContact OH-CD2 2.95Å; K489-H491 PolarHBondContact O-N 3.19Å; H491-K495 PolarHBondContact O-N 2.93Å; H491-E544 IonicContact CD2-OE2 3.48Å
492	A	72.1	Confident	75.7	Confident	60 Å²	60	77.8 Å²	77.8	50%	0.496	40%	0.398	S	S	.	.	H	α-helix	trans	-65.6	-44.3	173.9	0	0	0	0	0	112	R488 K489	R488-A492 VanDerWaalsContact O-CB 3.26Å; R488-A492 WeakPolarHBondContact O-CB 3.17Å; R488-A492 PolarHBondContact O-N 3.13Å; K489-A492 PolarHBondContact O-N 2.97Å
493	E	72.7	Confident	76.3	Confident	123 Å²	123	80 Å²	80	58%	0.575	41%	0.41	S	S	*	.	H	α-helix	trans	-75.5	-27.4	177.7	-61.8	-68.1	171.2	0	0	112.3	K489 L490 K495	K489-E493 VanDerWaalsContact O-CG 3.31Å; K489-E493 WeakPolarHBondContact O-CG 3.46Å; K489-E493 PolarHBondContact O-N 3.48Å; L490-E493 PolarHBondContact O-N 2.83Å; E493-K495 VanDerWaalsContact C-N 3.3Å; E493-K495 PolarHBondContact O-N 3.46Å
494	S	68	Low	76.9	Confident	13 Å²	13	80.2 Å²	80.2	9%	0.091	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-5.3	179.5	-176.7	0	0	0	0	113.6	L490 G496 N497 L501	L490-S494 WeakPolarHBondContact O-CA 3.27Å; L490-S494 WeakPolarHBondContact O-CB 3.4Å; L490-S494 PolarHBondContact O-N 2.99Å; S494-G496 PolarHBondContact O-N 2.89Å; S494-N497 PolarHBondContact O-N 3.38Å; S494-N497 PolarHBondContact OG-O 2.85Å; S494-L501 WeakPolarHBondContact OG-CB 3.3Å
495	K	64.1	Low	77.6	Confident	171 Å²	171	79 Å²	79	74%	0.743	40%	0.4	S	S	*	.	S	Bend	trans	-65.9	80.6	171.6	-84.5	-174.4	176.9	-176	0	110	H491 E493	H491-K495 PolarHBondContact O-N 2.93Å; E493-K495 VanDerWaalsContact C-N 3.3Å; E493-K495 PolarHBondContact O-N 3.46Å
496	G	65.3	Low	78.4	Confident	85 Å²	85	77 Å²	77	88%	0.876	39%	0.387	S	S	*	.	S	Bend	trans	133.9	-22.7	179	0	0	0	0	0	114.8	S494	S494-G496 PolarHBondContact O-N 2.89Å
497	N	76.6	Confident	79.1	Confident	57 Å²	57	75.2 Å²	75.2	31%	0.305	39%	0.39	S	S	.	.			trans	-135.1	109.9	-179.6	-166.9	-1.1	0	0	0	113.2	S494 E499 I500	S494-N497 PolarHBondContact O-N 3.38Å; S494-N497 PolarHBondContact OG-O 2.85Å; N497-E499 PolarHBondContact ND2-OE2 2.92Å; N497-E499 PolarHBondContact O-N 2.87Å; N497-E499 VanDerWaalsContact OD1-CB 3.29Å; N497-E499 WeakPolarHBondContact OD1-CB 3.47Å; N497-E499 VanDerWaalsContact OD1-CG 3.3Å; N497-E499 WeakPolarHBondContact OD1-CG 3.21Å; N497-E499 PolarHBondContact OD1-N 3.15Å; N497-I500 HydrophobicContact CB-CD1 4.29Å; N497-I500 HydrophobicContact CB-CG1 4.45Å
498	K	79.6	Confident	79.9	Confident	152 Å²	152	74.2 Å²	74.2	66%	0.661	39%	0.386	S	S	*	.	H	α-helix	trans	-68.3	-21.1	177.1	-66	-174.3	177.8	-174.9	0	113.2	L501 I502	K498-L501 WeakPolarHBondContact O-CB 3.32Å; K498-L501 PolarHBondContact O-N 2.9Å; K498-I502 WeakPolarHBondContact O-CG1 3.46Å; K498-I502 PolarHBondContact O-N 3.34Å; K498-I502 VanDerWaalsContact O-N 3.08Å
499	E	84.3	Confident	80.8	Confident	141 Å²	141	65.3 Å²	65.3	66%	0.659	35%	0.353	S	S	*	.	H	α-helix	trans	-65	-41.6	-179.4	-62	171	168.1	0	0	111.6	N497 L501 I502 L503	N497-E499 PolarHBondContact ND2-OE2 2.92Å; N497-E499 PolarHBondContact O-N 2.87Å; N497-E499 VanDerWaalsContact OD1-CB 3.29Å; N497-E499 WeakPolarHBondContact OD1-CB 3.47Å; N497-E499 VanDerWaalsContact OD1-CG 3.3Å; N497-E499 WeakPolarHBondContact OD1-CG 3.21Å; N497-E499 PolarHBondContact OD1-N 3.15Å; E499-L501 VanDerWaalsContact C-N 3.29Å; E499-L501 PolarHBondContact O-N 2.83Å; E499-I502 PolarHBondContact O-N 2.82Å; E499-L503 WeakPolarHBondContact O-CB 3.45Å; E499-L503 PolarHBondContact O-N 3.32Å
500	I	85.9	Confident	81.6	Confident	69 Å²	69	62 Å²	62	35%	0.354	34%	0.339	S	S	.	.	H	α-helix	trans	-63.7	-39.2	178.4	-63.6	175	0	0	0	110.1	L490 N497 G504	L490-I500 HydrophobicContact CD1-CG2 3.93Å; N497-I500 HydrophobicContact CB-CD1 4.29Å; N497-I500 HydrophobicContact CB-CG1 4.45Å; I500-G504 PolarHBondContact O-N 2.98Å
501	L	84.4	Confident	82.3	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.005	36%	0.355	C	S	.	.	H	α-helix	trans	-62	-52.5	176	-176.7	61.8	0	0	0	111.2	L490 S494 K498 E499 L503 G504 I505 E544	L490-L501 HydrophobicContact CD2-CD1 3.88Å; L490-L501 HydrophobicContact CG-CD1 4.21Å; S494-L501 WeakPolarHBondContact OG-CB 3.3Å; K498-L501 WeakPolarHBondContact O-CB 3.32Å; K498-L501 PolarHBondContact O-N 2.9Å; E499-L501 VanDerWaalsContact C-N 3.29Å; E499-L501 PolarHBondContact O-N 2.83Å; L501-L503 VanDerWaalsContact C-N 3.32Å; L501-L503 PolarHBondContact O-N 2.98Å; L501-G504 PolarHBondContact O-N 3.44Å; L501-I505 HydrophobicContact CD1-CD1 3.85Å; L501-I505 HydrophobicContact CD1-CG1 4.26Å; L501-I505 HydrophobicContact CG-CD1 3.67Å; L501-I505 VanDerWaalsContact O-CD1 3.22Å; L501-I505 WeakPolarHBondContact O-CD1 3.32Å; L501-I505 WeakPolarHBondContact O-CG1 3.2Å; L501-I505 PolarHBondContact O-N 2.74Å; L501-E544 HydrophobicContact CD2-CG 3.98Å
502	I	87.4	Confident	83	Confident	53 Å²	53	61.8 Å²	61.8	27%	0.272	34%	0.34	S	S	.	.	H	α-helix	trans	-57.8	-45.8	178.8	-68	167.3	0	0	0	110.8	K498 E499 S506 C548 I552	K498-I502 WeakPolarHBondContact O-CG1 3.46Å; K498-I502 PolarHBondContact O-N 3.34Å; K498-I502 VanDerWaalsContact O-N 3.08Å; E499-I502 PolarHBondContact O-N 2.82Å; I502-S506 VanDerWaalsContact O-CB 3.3Å; I502-S506 WeakPolarHBondContact O-CB 3.27Å; I502-S506 PolarHBondContact O-N 3.5Å; I502-S506 PolarHBondContact O-OG 3.12Å; I502-C548 HydrophobicContact CD1-CB 4.49Å; I502-C548 HydrophobicContact CG1-CB 3.91Å; I502-I552 HydrophobicContact CG2-CD1 3.77Å
503	L	88.8	Confident	83.9	Confident	126 Å²	126	59.7 Å²	59.7	66%	0.66	32%	0.32	S	S	*	.	H	α-helix	trans	-64.1	-44.3	178.7	-177.3	63.3	0	0	0	111.6	E499 L501 S506 A507	E499-L503 WeakPolarHBondContact O-CB 3.45Å; E499-L503 PolarHBondContact O-N 3.32Å; L501-L503 VanDerWaalsContact C-N 3.32Å; L501-L503 PolarHBondContact O-N 2.98Å; L503-S506 PolarHBondContact O-N 2.96Å; L503-A507 WeakPolarHBondContact O-CB 3.21Å; L503-A507 PolarHBondContact O-N 3.49Å
504	G	88.7	Confident	84.7	Confident	8 Å²	8	58.4 Å²	58.4	8%	0.082	32%	0.315	C	S	.	.	H	α-helix	trans	-63.2	-44.7	178.6	0	0	0	0	0	112.6	Y486 I500 L501 A507 F508	Y486-G504 WeakPolarHBondContact OH-CA 3.49Å; Y486-G504 PolarHBondContact OH-O 2.76Å; I500-G504 PolarHBondContact O-N 2.98Å; L501-G504 PolarHBondContact O-N 3.44Å; G504-A507 PolarHBondContact O-N 3.02Å; G504-F508 WeakPolarHBondContact O-CB 3.3Å; G504-F508 PolarHBondContact O-N 3.04Å
505	I	88.8	Confident	85.6	Confident	3 Å²	3	59.9 Å²	59.9	2%	0.015	32%	0.321	C	S	.	.	H	α-helix	trans	-63.4	-48.3	175.7	-60.7	150.7	0	0	0	110.2	F334 L501 A507 F508 I509 I534 I545 I549	F334-I505 HydrophobicContact CE1-CG2 3.97Å; F334-I505 HydrophobicContact CE2-CG2 4.4Å; F334-I505 HydrophobicContact CZ-CG2 3.55Å; L501-I505 HydrophobicContact CD1-CD1 3.85Å; L501-I505 HydrophobicContact CD1-CG1 4.26Å; L501-I505 HydrophobicContact CG-CD1 3.67Å; L501-I505 VanDerWaalsContact O-CD1 3.22Å; L501-I505 WeakPolarHBondContact O-CD1 3.32Å; L501-I505 WeakPolarHBondContact O-CG1 3.2Å; L501-I505 PolarHBondContact O-N 2.74Å; I505-A507 VanDerWaalsContact C-N 3.34Å; I505-A507 PolarHBondContact O-N 3.2Å; I505-F508 WeakPolarHBondContact O-CB 3.29Å; I505-F508 PolarHBondContact O-N 3.35Å; I505-F508 VanDerWaalsContact O-N 3.12Å; I505-I509 HydrophobicContact CG2-CD1 3.99Å; I505-I509 HydrophobicContact CG2-CG1 4.42Å; I505-I509 WeakPolarHBondContact O-CG1 3.02Å; I505-I509 PolarHBondContact O-N 2.97Å; I505-I534 HydrophobicContact CG2-CD1 4.41Å; I505-I545 HydrophobicContact CD1-CB 4.16Å; I505-I545 HydrophobicContact CD1-CD1 4.4Å; I505-I545 HydrophobicContact CD1-CG1 3.8Å; I505-I545 HydrophobicContact CD1-CG2 3.8Å; I505-I545 HydrophobicContact CG1-CD1 4.3Å; I505-I545 HydrophobicContact CG1-CG1 4.24Å; I505-I545 HydrophobicContact CG1-CG2 4.19Å; I505-I545 HydrophobicContact CG2-CG2 4.08Å; I505-I549 HydrophobicContact CB-CD1 4.31Å; I505-I549 HydrophobicContact CG2-CD1 3.7Å; I505-I549 HydrophobicContact CG2-CG1 3.99Å
506	S	90.8	Very high	86.5	Confident	16 Å²	16	51.7 Å²	51.7	11%	0.112	29%	0.286	C	S	.	.	H	α-helix	trans	-61.7	-42.2	-179.5	-56.5	0	0	0	0	111.7	I502 L503 F508 I509 F510	I502-S506 VanDerWaalsContact O-CB 3.3Å; I502-S506 WeakPolarHBondContact O-CB 3.27Å; I502-S506 PolarHBondContact O-N 3.5Å; I502-S506 PolarHBondContact O-OG 3.12Å; L503-S506 PolarHBondContact O-N 2.96Å; S506-F508 VanDerWaalsContact C-N 3.32Å; S506-F508 PolarHBondContact O-N 2.92Å; S506-I509 PolarHBondContact O-N 3.05Å; S506-F510 WeakPolarHBondContact O-CD2 3.26Å; S506-F510 VanDerWaalsContact O-CG 3.32Å; S506-F510 WeakPolarHBondContact O-CG 3.47Å; S506-F510 PolarHBondContact O-N 3.16Å
507	A	90.9	Very high	87.4	Confident	48 Å²	48	51.6 Å²	51.6	40%	0.397	26%	0.262	S	S	.	.	H	α-helix	trans	-61.8	-39.4	174.4	0	0	0	0	0	112	L503 G504 I505 F510 L511	L503-A507 WeakPolarHBondContact O-CB 3.21Å; L503-A507 PolarHBondContact O-N 3.49Å; G504-A507 PolarHBondContact O-N 3.02Å; I505-A507 VanDerWaalsContact C-N 3.34Å; I505-A507 PolarHBondContact O-N 3.2Å; A507-F510 PolarHBondContact O-N 2.92Å; A507-L511 VanDerWaalsContact O-CB 3.27Å; A507-L511 WeakPolarHBondContact O-CB 3.36Å; A507-L511 PolarHBondContact O-N 3.01Å
508	F	90	Very high	87.8	Confident	6 Å²	6	55.4 Å²	55.4	3%	0.026	28%	0.282	C	S	.	.	H	α-helix	trans	-66.6	-40.4	175.3	-178.3	-106.4	0	0	0	112.5	I478 I483 Y486 G504 I505 S506 L511 M512 A530 L533 I534	I478-F508 HydrophobicContact CG2-CE2 4.17Å; I478-F508 HydrophobicContact CG2-CZ 4.25Å; I483-F508 HydrophobicContact CD1-CE1 3.8Å; I483-F508 HydrophobicContact CD1-CE2 3.87Å; I483-F508 HydrophobicContact CD1-CZ 3.39Å; Y486-F508 HydrophobicContact CE1-CB 4.34Å; G504-F508 WeakPolarHBondContact O-CB 3.3Å; G504-F508 PolarHBondContact O-N 3.04Å; I505-F508 WeakPolarHBondContact O-CB 3.29Å; I505-F508 PolarHBondContact O-N 3.35Å; I505-F508 VanDerWaalsContact O-N 3.12Å; S506-F508 VanDerWaalsContact C-N 3.32Å; S506-F508 PolarHBondContact O-N 2.92Å; F508-L511 PolarHBondContact O-N 3.09Å; F508-M512 HydrophobicContact CE1-CG 4.1Å; F508-M512 HydrophobicContact CE2-CG 4.09Å; F508-M512 HydrophobicContact CE2-SD 4.41Å; F508-M512 HydrophobicContact CZ-CG 3.83Å; F508-M512 HydrophobicContact CZ-SD 4.26Å; F508-M512 WeakPolarHBondContact O-CG 3.35Å; F508-M512 PolarHBondContact O-N 3.48Å; F508-A530 HydrophobicContact CD1-CB 4Å; F508-A530 HydrophobicContact CE1-CB 3.78Å; F508-L533 HydrophobicContact CE1-CB 4.47Å; F508-L533 HydrophobicContact CZ-CB 4.35Å; F508-L533 HydrophobicContact CZ-CD1 4.07Å; F508-I534 HydrophobicContact CD1-CD1 3.63Å; F508-I534 HydrophobicContact CD1-CG1 4.1Å; F508-I534 HydrophobicContact CE1-CD1 3.96Å; F508-I534 HydrophobicContact CE1-CG1 3.93Å
509	I	91.6	Very high	87.7	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-58.8	-50	173.9	-65.4	166.9	0	0	0	110.1	F331 F334 I505 S506 L511 M512 L513 C527 A530 I549	F331-I509 HydrophobicContact CD1-CD1 4.1Å; F331-I509 HydrophobicContact CE1-CD1 3.87Å; F334-I509 HydrophobicContact CB-CD1 4.22Å; F334-I509 HydrophobicContact CD1-CD1 3.54Å; F334-I509 HydrophobicContact CD1-CG1 4.33Å; F334-I509 HydrophobicContact CD2-CD1 3.65Å; F334-I509 HydrophobicContact CD2-CG1 3.47Å; F334-I509 VanDerWaalsContact CD2-CG1 3.47Å; F334-I509 HydrophobicContact CE1-CD1 3.68Å; F334-I509 HydrophobicContact CE1-CG1 4.42Å; F334-I509 HydrophobicContact CE2-CD1 3.79Å; F334-I509 HydrophobicContact CE2-CG1 3.59Å; F334-I509 HydrophobicContact CG-CD1 3.49Å; F334-I509 VanDerWaalsContact CG-CD1 3.49Å; F334-I509 HydrophobicContact CG-CG1 3.85Å; F334-I509 HydrophobicContact CZ-CD1 3.8Å; F334-I509 HydrophobicContact CZ-CG1 4.07Å; I505-I509 HydrophobicContact CG2-CD1 3.99Å; I505-I509 HydrophobicContact CG2-CG1 4.42Å; I505-I509 WeakPolarHBondContact O-CG1 3.02Å; I505-I509 PolarHBondContact O-N 2.97Å; S506-I509 PolarHBondContact O-N 3.05Å; I509-L511 PolarHBondContact O-N 3.45Å; I509-M512 PolarHBondContact O-N 3.37Å; I509-L513 WeakPolarHBondContact O-CB 3.4Å; I509-L513 PolarHBondContact O-N 2.83Å; I509-C527 HydrophobicContact CG2-CB 4.3Å; I509-A530 HydrophobicContact CG1-CB 4.46Å; I509-I549 HydrophobicContact CD1-CD1 4.21Å
510	F	92.7	Very high	87.2	Confident	79 Å²	79	51.4 Å²	51.4	35%	0.346	27%	0.272	S	S	.	.	H	α-helix	trans	-67.4	-35.4	180	-60.6	-35.3	0	0	0	112.7	F327 F331 S506 A507 L513 M514	F327-F510 HydrophobicContact CD1-CE1 4.24Å; F327-F510 HydrophobicContact CE1-CE1 4.11Å; F327-F510 HydrophobicContact CE1-CZ 4.48Å; F331-F510 HydrophobicContact CE2-CE1 4.48Å; F331-F510 HydrophobicContact CE2-CZ 4.38Å; F331-F510 HydrophobicContact CZ-CE1 4.34Å; F331-F510 HydrophobicContact CZ-CZ 4.06Å; S506-F510 WeakPolarHBondContact O-CD2 3.26Å; S506-F510 VanDerWaalsContact O-CG 3.32Å; S506-F510 WeakPolarHBondContact O-CG 3.47Å; S506-F510 PolarHBondContact O-N 3.16Å; A507-F510 PolarHBondContact O-N 2.92Å; F510-L513 WeakPolarHBondContact O-CB 3.34Å; F510-L513 PolarHBondContact O-N 2.77Å; F510-M514 VanDerWaalsContact O-CG 3.31Å; F510-M514 WeakPolarHBondContact O-CG 3.25Å; F510-M514 PolarHBondContact O-N 3.21Å
511	L	91.6	Very high	86.5	Confident	85 Å²	85	48.7 Å²	48.7	45%	0.445	26%	0.259	S	S	.	.	H	α-helix	trans	-59.8	-48.2	172.9	177.7	68.2	0	0	0	111	A507 F508 I509 L513 M514 I515	A507-L511 VanDerWaalsContact O-CB 3.27Å; A507-L511 WeakPolarHBondContact O-CB 3.36Å; A507-L511 PolarHBondContact O-N 3.01Å; F508-L511 PolarHBondContact O-N 3.09Å; I509-L511 PolarHBondContact O-N 3.45Å; L511-L513 VanDerWaalsContact C-N 3.34Å; L511-M514 PolarHBondContact O-N 3.33Å; L511-I515 HydrophobicContact CD1-CD1 4.29Å; L511-I515 HydrophobicContact CG-CD1 4.01Å; L511-I515 VanDerWaalsContact O-CG1 3.3Å; L511-I515 WeakPolarHBondContact O-CG1 3.25Å; L511-I515 PolarHBondContact O-N 2.79Å
512	M	88.9	Confident	86.2	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-65.2	-38.6	178.3	-74.2	-59.3	-57.5	0	0	112.1	I478 F508 I509 I515 T516 G526 L529 A530 L533	I478-M512 HydrophobicContact CD1-CE 4.39Å; I478-M512 HydrophobicContact CD1-SD 3.62Å; F508-M512 HydrophobicContact CE1-CG 4.1Å; F508-M512 HydrophobicContact CE2-CG 4.09Å; F508-M512 HydrophobicContact CE2-SD 4.41Å; F508-M512 HydrophobicContact CZ-CG 3.83Å; F508-M512 HydrophobicContact CZ-SD 4.26Å; F508-M512 WeakPolarHBondContact O-CG 3.35Å; F508-M512 PolarHBondContact O-N 3.48Å; I509-M512 PolarHBondContact O-N 3.37Å; M512-I515 PolarHBondContact O-N 3.46Å; M512-I515 HydrophobicContact SD-CD1 4.25Å; M512-T516 PolarHBondContact O-N 3.13Å; M512-T516 PolarHBondContact O-OG1 3.45Å; M512-T516 VanDerWaalsContact O-OG1 3.06Å; M512-G526 WeakPolarHBondContact CB-O 3.28Å; M512-L529 HydrophobicContact CE-CB 4.24Å; M512-A530 HydrophobicContact CB-CB 3.83Å; M512-A530 HydrophobicContact CG-CB 3.76Å; M512-L533 HydrophobicContact CE-CD1 3.99Å; M512-L533 HydrophobicContact SD-CD1 4.19Å
513	L	90	Very high	86	Confident	15 Å²	15	49.3 Å²	49.3	8%	0.079	26%	0.263	C	S	.	.	H	α-helix	trans	-56.8	-50.5	173.4	-175.8	156.5	0	0	0	111.1	F330 I509 F510 L511 I515 T516 E517 M523	F330-L513 HydrophobicContact CD1-CD1 4.47Å; F330-L513 HydrophobicContact CD2-CD1 3.68Å; F330-L513 HydrophobicContact CE1-CD1 4.45Å; F330-L513 HydrophobicContact CE2-CD1 3.67Å; F330-L513 HydrophobicContact CG-CD1 4.11Å; F330-L513 HydrophobicContact CZ-CD1 4.08Å; I509-L513 WeakPolarHBondContact O-CB 3.4Å; I509-L513 PolarHBondContact O-N 2.83Å; F510-L513 WeakPolarHBondContact O-CB 3.34Å; F510-L513 PolarHBondContact O-N 2.77Å; L511-L513 VanDerWaalsContact C-N 3.34Å; L513-I515 PolarHBondContact O-N 2.91Å; L513-T516 PolarHBondContact O-N 2.97Å; L513-T516 PolarHBondContact O-OG1 3.21Å; L513-E517 WeakPolarHBondContact O-CB 3.5Å; L513-E517 PolarHBondContact O-N 3.41Å; L513-M523 HydrophobicContact CD1-CB 4.12Å; L513-M523 HydrophobicContact CD2-CB 4.2Å; L513-M523 HydrophobicContact CD2-CG 3.82Å; L513-M523 HydrophobicContact CD2-SD 4.27Å; L513-M523 HydrophobicContact CG-CB 3.79Å; L513-M523 HydrophobicContact CG-CG 3.98Å
514	M	89.6	Confident	85.6	Confident	97 Å²	97	43.4 Å²	43.4	48%	0.478	23%	0.232	S	C	.	.	H	α-helix	trans	-62.6	-41.6	177.6	-70.9	-63.7	-58.4	0	0	112.3	F510 L511 T516 E517 L518	F510-M514 VanDerWaalsContact O-CG 3.31Å; F510-M514 WeakPolarHBondContact O-CG 3.25Å; F510-M514 PolarHBondContact O-N 3.21Å; L511-M514 PolarHBondContact O-N 3.33Å; M514-T516 VanDerWaalsContact C-N 3.33Å; M514-T516 PolarHBondContact O-N 3.5Å; M514-E517 PolarHBondContact O-N 2.99Å; M514-L518 WeakPolarHBondContact O-CB 3.25Å; M514-L518 VanDerWaalsContact O-CG 3.25Å; M514-L518 WeakPolarHBondContact O-CG 3.5Å; M514-L518 PolarHBondContact O-N 2.89Å
515	I	88.3	Confident	85	Confident	43 Å²	43	43.6 Å²	43.6	22%	0.221	23%	0.231	C	C	.	.	H	α-helix	trans	-60.5	-44.1	177.1	-71.9	167.7	0	0	0	110.6	I474 I478 L511 M512 L513 L518 L519	I474-I515 HydrophobicContact CG2-CG2 4.22Å; I478-I515 HydrophobicContact CD1-CD1 4.26Å; L511-I515 HydrophobicContact CD1-CD1 4.29Å; L511-I515 HydrophobicContact CG-CD1 4.01Å; L511-I515 VanDerWaalsContact O-CG1 3.3Å; L511-I515 WeakPolarHBondContact O-CG1 3.25Å; L511-I515 PolarHBondContact O-N 2.79Å; M512-I515 PolarHBondContact O-N 3.46Å; M512-I515 HydrophobicContact SD-CD1 4.25Å; L513-I515 PolarHBondContact O-N 2.91Å; I515-L518 PolarHBondContact O-N 3.47Å; I515-L519 HydrophobicContact CG2-CD1 4.16Å; I515-L519 WeakPolarHBondContact O-CG 3.41Å; I515-L519 PolarHBondContact O-N 2.73Å
516	T	82.8	Confident	84.8	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-68.7	-39.4	178.5	46.2	0	0	0	0	112.5	M512 L513 M514 L518 L519 V521 G526	M512-T516 PolarHBondContact O-N 3.13Å; M512-T516 PolarHBondContact O-OG1 3.45Å; M512-T516 VanDerWaalsContact O-OG1 3.06Å; L513-T516 PolarHBondContact O-N 2.97Å; L513-T516 PolarHBondContact O-OG1 3.21Å; M514-T516 VanDerWaalsContact C-N 3.33Å; M514-T516 PolarHBondContact O-N 3.5Å; T516-L518 VanDerWaalsContact C-N 3.34Å; T516-L518 PolarHBondContact O-N 3.38Å; T516-L519 PolarHBondContact O-N 3.15Å; T516-L519 VanDerWaalsContact O-N 3.1Å; T516-V521 CarbonylContact C-O 3.24Å; T516-V521 HydrophobicContact CG2-CG1 4.31Å; T516-V521 CarbonylContact O-C 3.56Å; T516-V521 WeakPolarHBondContact O-CA 3.25Å; T516-V521 WeakPolarHBondContact O-CB 3.37Å; T516-V521 PolarHBondContact O-N 3.12Å; T516-G526 VanDerWaalsContact CG2-CA 3.44Å; T516-G526 WeakPolarHBondContact OG1-CA 3.48Å
517	E	83.7	Confident	84.7	Confident	82 Å²	82	42.7 Å²	42.7	38%	0.383	23%	0.225	S	C	.	.	H	α-helix	trans	-61.1	-42.6	175.9	-176.5	177.9	-166.9	0	0	111.6	L513 M514 L519 D520 M523	L513-E517 WeakPolarHBondContact O-CB 3.5Å; L513-E517 PolarHBondContact O-N 3.41Å; M514-E517 PolarHBondContact O-N 2.99Å; E517-L519 PolarHBondContact O-N 3.14Å; E517-D520 PolarHBondContact O-N 3.45Å; E517-M523 HydrophobicContact CB-CG 4.41Å; E517-M523 HydrophobicContact CG-CE 3.99Å; E517-M523 WeakPolarHBondContact OE1-CE 3.13Å; E517-M523 WeakPolarHBondContact OE2-CE 3.35Å
518	L	84.2	Confident	84.3	Confident	137 Å²	137	40.9 Å²	40.9	72%	0.717	21%	0.208	S	C	*	.	H	α-helix	trans	-63.4	-21.6	176.1	-72.4	172.1	0	0	0	113.9	M514 I515 T516 D520	M514-L518 WeakPolarHBondContact O-CB 3.25Å; M514-L518 VanDerWaalsContact O-CG 3.25Å; M514-L518 WeakPolarHBondContact O-CG 3.5Å; M514-L518 PolarHBondContact O-N 2.89Å; I515-L518 PolarHBondContact O-N 3.47Å; T516-L518 VanDerWaalsContact C-N 3.34Å; T516-L518 PolarHBondContact O-N 3.38Å; L518-D520 VanDerWaalsContact C-N 3.31Å
519	L	78.5	Confident	84	Confident	59 Å²	59	42.1 Å²	42.1	31%	0.309	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93	11.7	177.2	-65.4	169.9	0	0	0	112.4	V471 I474 I515 T516 E517 V521	V471-L519 HydrophobicContact CG2-CD1 3.69Å; I474-L519 HydrophobicContact CD1-CD1 3.64Å; I474-L519 HydrophobicContact CD1-CD2 4.47Å; I515-L519 HydrophobicContact CG2-CD1 4.16Å; I515-L519 WeakPolarHBondContact O-CG 3.41Å; I515-L519 PolarHBondContact O-N 2.73Å; T516-L519 PolarHBondContact O-N 3.15Å; T516-L519 VanDerWaalsContact O-N 3.1Å; E517-L519 PolarHBondContact O-N 3.14Å; L519-V521 HydrophobicContact CB-CG2 4.17Å; L519-V521 PolarHBondContact O-N 3.17Å
520	D	73.2	Confident	83.9	Confident	151 Å²	151	42.1 Å²	42.1	81%	0.807	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	55	29.5	-171.3	-67.6	-46.7	0	0	0	112.7	E517 L518	E517-D520 PolarHBondContact O-N 3.45Å; L518-D520 VanDerWaalsContact C-N 3.31Å
521	V	72.5	Confident	83.6	Confident	11 Å²	11	38.4 Å²	38.4	7%	0.067	20%	0.198	C	C	.	.			trans	-102.9	151.2	175.6	174.7	0	0	0	0	108.9	A434 V471 T516 L519 L525	A434-V521 HydrophobicContact CB-CG1 3.89Å; V471-V521 HydrophobicContact CG2-CG2 3.98Å; T516-V521 CarbonylContact C-O 3.24Å; T516-V521 HydrophobicContact CG2-CG1 4.31Å; T516-V521 CarbonylContact O-C 3.56Å; T516-V521 WeakPolarHBondContact O-CA 3.25Å; T516-V521 WeakPolarHBondContact O-CB 3.37Å; T516-V521 PolarHBondContact O-N 3.12Å; L519-V521 HydrophobicContact CB-CG2 4.17Å; L519-V521 PolarHBondContact O-N 3.17Å; V521-L525 HydrophobicContact CG1-CB 4.27Å; V521-L525 HydrophobicContact CG1-CD2 3.67Å; V521-L525 HydrophobicContact CG1-CG 4.43Å
522	S	77.2	Confident	83.1	Confident	14 Å²	14	35.3 Å²	35.3	10%	0.098	19%	0.185	C	C	.	.			trans	-63.7	138.5	-178	130.8	0	0	0	0	112.5	I433 E524 L525	I433-S522 VanDerWaalsContact CG2-CB 3.49Å; I433-S522 WeakPolarHBondContact CG2-OG 3.41Å; S522-E524 WeakPolarHBondContact CB-OE2 3.43Å; S522-E524 PolarHBondContact O-N 3.27Å; S522-E524 WeakPolarHBondContact OG-CB 3.2Å; S522-E524 PolarHBondContact OG-N 3.01Å; S522-E524 PolarHBondContact OG-OE2 3.23Å; S522-L525 PolarHBondContact O-N 2.95Å; S522-L525 VanDerWaalsContact O-N 3.15Å
523	M	82.8	Confident	83	Confident	53 Å²	53	35.9 Å²	35.9	26%	0.261	19%	0.188	S	C	.	.	H	α-helix	trans	-55.6	-37.3	178.4	-68.9	169.3	178.5	0	0	112.6	F330 L513 E517 L525 G526 C527	F330-M523 HydrophobicContact CE1-CB 3.93Å; F330-M523 HydrophobicContact CZ-CB 4.02Å; F330-M523 HydrophobicContact CZ-SD 4.02Å; L513-M523 HydrophobicContact CD1-CB 4.12Å; L513-M523 HydrophobicContact CD2-CB 4.2Å; L513-M523 HydrophobicContact CD2-CG 3.82Å; L513-M523 HydrophobicContact CD2-SD 4.27Å; L513-M523 HydrophobicContact CG-CB 3.79Å; L513-M523 HydrophobicContact CG-CG 3.98Å; E517-M523 HydrophobicContact CB-CG 4.41Å; E517-M523 HydrophobicContact CG-CE 3.99Å; E517-M523 WeakPolarHBondContact OE1-CE 3.13Å; E517-M523 WeakPolarHBondContact OE2-CE 3.35Å; M523-L525 VanDerWaalsContact C-N 3.3Å; M523-L525 PolarHBondContact O-N 3.22Å; M523-G526 PolarHBondContact O-N 3.44Å; M523-G526 VanDerWaalsContact O-N 3.12Å; M523-C527 PolarHBondContact O-N 2.8Å
524	E	80.1	Confident	82.7	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.009	19%	0.187	C	C	.	.	H	α-helix	trans	-58.4	-41.3	178.7	-69.2	76.3	-158.5	0	0	112.4	F330 L333 I433 S522 G526 C527 F528 R631	F330-E524 HydrophobicContact CD1-CG 4.45Å; F330-E524 HydrophobicContact CE1-CG 4.25Å; F330-E524 WeakPolarHBondContact CE1-OE1 3.4Å; L333-E524 HydrophobicContact CD1-CB 3.44Å; L333-E524 VanDerWaalsContact CD1-CB 3.44Å; L333-E524 HydrophobicContact CD1-CG 3.72Å; I433-E524 HydrophobicContact CD1-CB 4.08Å; I433-E524 HydrophobicContact CD1-CG 4.09Å; S522-E524 WeakPolarHBondContact CB-OE2 3.43Å; S522-E524 PolarHBondContact O-N 3.27Å; S522-E524 WeakPolarHBondContact OG-CB 3.2Å; S522-E524 PolarHBondContact OG-N 3.01Å; S522-E524 PolarHBondContact OG-OE2 3.23Å; E524-G526 VanDerWaalsContact C-N 3.31Å; E524-G526 PolarHBondContact O-N 3.4Å; E524-C527 PolarHBondContact O-N 2.91Å; E524-F528 PolarHBondContact O-N 2.98Å; E524-F528 VanDerWaalsContact O-N 3.08Å; E524-R631 VanDerWaalsContact CD-NH1 3.32Å; E524-R631 IonicContact OE1-CZ 3.76Å; E524-R631 IonicContact OE1-NH1 2.83Å; E524-R631 PolarHBondContact OE1-NH1 3.13Å; E524-R631 IonicContact OE1-NH2 2.67Å; E524-R631 PolarHBondContact OE1-NH2 2.86Å; E524-R631 IonicContact OE2-NH1 2.98Å; E524-R631 PolarHBondContact OE2-NH1 3.37Å
525	L	77.4	Confident	82.4	Confident	12 Å²	12	31.2 Å²	31.2	6%	0.063	17%	0.166	C	C	.	.	H	α-helix	trans	-66.8	-36.3	178.6	-176.5	61.9	0	0	0	110.9	A434 V521 S522 M523 F528 L529	A434-L525 HydrophobicContact CB-CD2 3.8Å; V521-L525 HydrophobicContact CG1-CB 4.27Å; V521-L525 HydrophobicContact CG1-CD2 3.67Å; V521-L525 HydrophobicContact CG1-CG 4.43Å; S522-L525 PolarHBondContact O-N 2.95Å; S522-L525 VanDerWaalsContact O-N 3.15Å; M523-L525 VanDerWaalsContact C-N 3.3Å; M523-L525 PolarHBondContact O-N 3.22Å; L525-F528 HydrophobicContact CD1-CD1 4.29Å; L525-F528 PolarHBondContact O-N 3.11Å; L525-L529 HydrophobicContact CD1-CD1 4.27Å; L525-L529 HydrophobicContact CD1-CG 4.18Å; L525-L529 HydrophobicContact CD2-CD1 4.42Å; L525-L529 HydrophobicContact CG-CD1 3.85Å; L525-L529 HydrophobicContact CG-CG 4.24Å; L525-L529 WeakPolarHBondContact O-CB 3.3Å; L525-L529 WeakPolarHBondContact O-CG 3.48Å; L525-L529 PolarHBondContact O-N 3.33Å
526	G	85.1	Confident	81.9	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-59.1	-46	174.5	0	0	0	0	0	112.5	M512 T516 M523 E524 L529 A530	M512-G526 WeakPolarHBondContact CB-O 3.28Å; T516-G526 VanDerWaalsContact CG2-CA 3.44Å; T516-G526 WeakPolarHBondContact OG1-CA 3.48Å; M523-G526 PolarHBondContact O-N 3.44Å; M523-G526 VanDerWaalsContact O-N 3.12Å; E524-G526 VanDerWaalsContact C-N 3.31Å; E524-G526 PolarHBondContact O-N 3.4Å; G526-L529 PolarHBondContact O-N 3.16Å; G526-A530 WeakPolarHBondContact O-CB 3.3Å; G526-A530 PolarHBondContact O-N 2.94Å
527	C	86.9	Confident	81.7	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.9	-44.6	176.4	-62.1	0	0	0	0	112.5	F330 F334 I509 M523 E524 A530 G531	F330-C527 HydrophobicContact CB-CB 4.46Å; F330-C527 WeakPolarHBondContact O-CB 3.18Å; F334-C527 WeakPolarHBondContact CA-O 3.36Å; F334-C527 HydrophobicContact CB-CB 4.37Å; I509-C527 HydrophobicContact CG2-CB 4.3Å; M523-C527 PolarHBondContact O-N 2.8Å; E524-C527 PolarHBondContact O-N 2.91Å; C527-A530 WeakPolarHBondContact O-CB 3.09Å; C527-A530 PolarHBondContact O-N 3.5Å; C527-G531 PolarHBondContact O-N 3.44Å; C527-G531 VanDerWaalsContact O-N 3.14Å
528	F	83.7	Confident	81.4	Confident	10 Å²	10	30.9 Å²	30.9	4%	0.044	17%	0.172	C	C	.	.	H	α-helix	trans	-59.7	-47	175.7	172.8	-93.9	0	0	0	111.8	V336 V427 E524 L525 A530 G531 A532	V336-F528 HydrophobicContact CG1-CD2 4.46Å; V336-F528 HydrophobicContact CG1-CE2 4.27Å; V427-F528 HydrophobicContact CB-CE1 4.4Å; V427-F528 HydrophobicContact CB-CZ 4.04Å; V427-F528 HydrophobicContact CG1-CE1 4Å; V427-F528 HydrophobicContact CG1-CZ 4.1Å; V427-F528 HydrophobicContact CG2-CE1 4.06Å; V427-F528 HydrophobicContact CG2-CE2 3.9Å; V427-F528 HydrophobicContact CG2-CZ 3.29Å; E524-F528 PolarHBondContact O-N 2.98Å; E524-F528 VanDerWaalsContact O-N 3.08Å; L525-F528 HydrophobicContact CD1-CD1 4.29Å; L525-F528 PolarHBondContact O-N 3.11Å; F528-A530 VanDerWaalsContact C-N 3.32Å; F528-A530 PolarHBondContact O-N 2.97Å; F528-G531 PolarHBondContact O-N 3.45Å; F528-A532 HydrophobicContact CE1-CB 4.5Å; F528-A532 PolarHBondContact O-N 3.01Å
529	L	83.6	Confident	81	Confident	33 Å²	33	28.4 Å²	28.4	17%	0.173	16%	0.157	C	C	.	.	H	α-helix	trans	-63.6	-37.3	177.9	-71.5	170.1	0	0	0	111.8	V471 M512 L525 G526 G531 A532 L533	V471-L529 HydrophobicContact CG1-CD1 3.34Å; M512-L529 HydrophobicContact CE-CB 4.24Å; L525-L529 HydrophobicContact CD1-CD1 4.27Å; L525-L529 HydrophobicContact CD1-CG 4.18Å; L525-L529 HydrophobicContact CD2-CD1 4.42Å; L525-L529 HydrophobicContact CG-CD1 3.85Å; L525-L529 HydrophobicContact CG-CG 4.24Å; L525-L529 WeakPolarHBondContact O-CB 3.3Å; L525-L529 WeakPolarHBondContact O-CG 3.48Å; L525-L529 PolarHBondContact O-N 3.33Å; G526-L529 PolarHBondContact O-N 3.16Å; L529-G531 VanDerWaalsContact C-N 3.3Å; L529-G531 PolarHBondContact O-N 3.01Å; L529-A532 PolarHBondContact O-N 3.36Å; L529-L533 WeakPolarHBondContact O-CB 3.5Å; L529-L533 WeakPolarHBondContact O-CG 3.36Å; L529-L533 PolarHBondContact O-N 2.9Å
530	A	88.5	Confident	80.9	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-57.5	-45	173.7	0	0	0	0	0	111.4	F334 F508 I509 M512 G526 C527 F528 L533 I534	F334-A530 HydrophobicContact CD2-CB 4.1Å; F334-A530 HydrophobicContact CE2-CB 4.3Å; F508-A530 HydrophobicContact CD1-CB 4Å; F508-A530 HydrophobicContact CE1-CB 3.78Å; I509-A530 HydrophobicContact CG1-CB 4.46Å; M512-A530 HydrophobicContact CB-CB 3.83Å; M512-A530 HydrophobicContact CG-CB 3.76Å; G526-A530 WeakPolarHBondContact O-CB 3.3Å; G526-A530 PolarHBondContact O-N 2.94Å; C527-A530 WeakPolarHBondContact O-CB 3.09Å; C527-A530 PolarHBondContact O-N 3.5Å; F528-A530 VanDerWaalsContact C-N 3.32Å; F528-A530 PolarHBondContact O-N 2.97Å; A530-L533 PolarHBondContact O-N 3.3Å; A530-I534 WeakPolarHBondContact O-CG1 3.28Å; A530-I534 PolarHBondContact O-N 3.16Å; A530-I534 VanDerWaalsContact O-N 3.14Å
531	G	87.6	Confident	81.2	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61.8	-49.1	175.1	0	0	0	0	0	112.2	F334 G337 L338 C527 F528 L529 L533 I534 S535	F334-G531 VanDerWaalsContact CE2-CA 3.49Å; G337-G531 CarbonylContact O-C 3.49Å; G337-G531 VanDerWaalsContact O-C 3.24Å; L338-G531 WeakPolarHBondContact CD2-O 3.49Å; C527-G531 PolarHBondContact O-N 3.44Å; C527-G531 VanDerWaalsContact O-N 3.14Å; F528-G531 PolarHBondContact O-N 3.45Å; L529-G531 VanDerWaalsContact C-N 3.3Å; L529-G531 PolarHBondContact O-N 3.01Å; G531-L533 VanDerWaalsContact C-N 3.28Å; G531-L533 PolarHBondContact O-N 3.19Å; G531-I534 PolarHBondContact O-N 3.17Å; G531-I534 VanDerWaalsContact O-N 3.15Å; G531-S535 PolarHBondContact O-N 3.31Å
532	A	81.4	Confident	81.6	Confident	21 Å²	21	27.4 Å²	27.4	17%	0.174	15%	0.15	C	C	.	.	H	α-helix	trans	-65.1	-30	-179.1	0	0	0	0	0	113.4	G337 F340 F528 L529 S535 S536	G337-A532 VanDerWaalsContact O-CA 3.23Å; G337-A532 WeakPolarHBondContact O-CA 3.39Å; G337-A532 PolarHBondContact O-N 3.2Å; G337-A532 VanDerWaalsContact O-N 3.15Å; F340-A532 HydrophobicContact CD1-CB 4.27Å; F528-A532 HydrophobicContact CE1-CB 4.5Å; F528-A532 PolarHBondContact O-N 3.01Å; L529-A532 PolarHBondContact O-N 3.36Å; A532-S535 PolarHBondContact O-OG 3.1Å; A532-S536 PolarHBondContact O-N 2.64Å
533	L	85.2	Confident	81.9	Confident	13 Å²	13	31.9 Å²	31.9	7%	0.068	17%	0.169	C	C	.	.	H	α-helix	trans	-69.9	-42.6	174	-74.6	170.6	0	0	0	111.2	C475 I478 K479 I483 F508 M512 L529 A530 G531 S536	C475-L533 HydrophobicContact CB-CD2 4.21Å; C475-L533 WeakPolarHBondContact O-CD2 3.32Å; I478-L533 HydrophobicContact CG2-CD1 4Å; K479-L533 HydrophobicContact CB-CD2 3.81Å; I483-L533 HydrophobicContact CD1-CB 4.19Å; F508-L533 HydrophobicContact CE1-CB 4.47Å; F508-L533 HydrophobicContact CZ-CB 4.35Å; F508-L533 HydrophobicContact CZ-CD1 4.07Å; M512-L533 HydrophobicContact CE-CD1 3.99Å; M512-L533 HydrophobicContact SD-CD1 4.19Å; L529-L533 WeakPolarHBondContact O-CB 3.5Å; L529-L533 WeakPolarHBondContact O-CG 3.36Å; L529-L533 PolarHBondContact O-N 2.9Å; A530-L533 PolarHBondContact O-N 3.3Å; G531-L533 VanDerWaalsContact C-N 3.28Å; G531-L533 PolarHBondContact O-N 3.19Å; L533-S536 PolarHBondContact O-N 2.81Å; L533-S536 PolarHBondContact O-OG 3.49Å
534	I	84.8	Confident	82	Confident	12 Å²	12	32.7 Å²	32.7	6%	0.062	17%	0.172	C	C	.	.	H	α-helix	trans	-68	-42.4	177.2	-72.6	174.5	0	0	0	111.2	F334 L338 I483 I505 F508 A530 G531 S536 Q537 V541 I545	F334-I534 HydrophobicContact CE2-CD1 3.94Å; F334-I534 HydrophobicContact CZ-CD1 4.03Å; L338-I534 HydrophobicContact CD2-CB 3.7Å; L338-I534 HydrophobicContact CD2-CG2 3.4Å; L338-I534 VanDerWaalsContact CD2-CG2 3.4Å; I483-I534 HydrophobicContact CD1-CG1 4.12Å; I505-I534 HydrophobicContact CG2-CD1 4.41Å; F508-I534 HydrophobicContact CD1-CD1 3.63Å; F508-I534 HydrophobicContact CD1-CG1 4.1Å; F508-I534 HydrophobicContact CE1-CD1 3.96Å; F508-I534 HydrophobicContact CE1-CG1 3.93Å; A530-I534 WeakPolarHBondContact O-CG1 3.28Å; A530-I534 PolarHBondContact O-N 3.16Å; A530-I534 VanDerWaalsContact O-N 3.14Å; G531-I534 PolarHBondContact O-N 3.17Å; G531-I534 VanDerWaalsContact O-N 3.15Å; I534-S536 PolarHBondContact O-N 3.11Å; I534-S536 VanDerWaalsContact O-N 3.11Å; I534-Q537 WeakPolarHBondContact O-CB 3.44Å; I534-Q537 PolarHBondContact O-N 3.14Å; I534-V541 HydrophobicContact CG2-CG1 4.43Å; I534-I545 HydrophobicContact CG2-CD1 3.26Å
535	S	82.4	Confident	82.3	Confident	3 Å²	3	32.6 Å²	32.6	2%	0.021	17%	0.172	C	C	.	.	H	α-helix	trans	-58.8	-29	-179.8	74.1	0	0	0	0	112.5	L338 F340 G531 A532 Q537 G538 T542	L338-S535 VanDerWaalsContact O-CB 3.25Å; L338-S535 WeakPolarHBondContact O-CB 3.43Å; F340-S535 WeakPolarHBondContact O-CB 3.3Å; F340-S535 PolarHBondContact O-OG 3.21Å; G531-S535 PolarHBondContact O-N 3.31Å; A532-S535 PolarHBondContact O-OG 3.1Å; S535-Q537 PolarHBondContact O-N 3.39Å; S535-G538 PolarHBondContact O-N 3.39Å; S535-T542 WeakPolarHBondContact CA-OG1 3.48Å
536	S	79.3	Confident	82.7	Confident	28 Å²	28	34.2 Å²	34.2	20%	0.196	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-13	177.4	81.3	0	0	0	0	115	A532 L533 I534 G538	A532-S536 PolarHBondContact O-N 2.64Å; L533-S536 PolarHBondContact O-N 2.81Å; L533-S536 PolarHBondContact O-OG 3.49Å; I534-S536 PolarHBondContact O-N 3.11Å; I534-S536 VanDerWaalsContact O-N 3.11Å; S536-G538 VanDerWaalsContact C-N 3.33Å
537	Q	78.4	Confident	82.8	Confident	67 Å²	67	37.6 Å²	37.6	31%	0.313	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-11.1	178.5	-62.5	-54.1	-74.2	0	0	113.6	I483 I534 S535 V541	I483-Q537 HydrophobicContact CG1-CG 4.07Å; I483-Q537 HydrophobicContact CG2-CG 4.24Å; I534-Q537 WeakPolarHBondContact O-CB 3.44Å; I534-Q537 PolarHBondContact O-N 3.14Å; S535-Q537 PolarHBondContact O-N 3.39Å; Q537-V541 HydrophobicContact CB-CG1 4.41Å
538	G	77.1	Confident	82.8	Confident	23 Å²	23	38.3 Å²	38.3	24%	0.237	21%	0.208	C	C	.	.			trans	127	164.1	173.2	0	0	0	0	0	113.8	S535 S536 M540 V541 T542	S535-G538 PolarHBondContact O-N 3.39Å; S536-G538 VanDerWaalsContact C-N 3.33Å; G538-M540 PolarHBondContact O-N 3.48Å; G538-V541 PolarHBondContact O-N 3.44Å; G538-T542 PolarHBondContact O-N 3.35Å; G538-T542 PolarHBondContact O-OG1 3.1Å
539	H	75.7	Confident	83.1	Confident	85 Å²	85	37.8 Å²	37.8	39%	0.394	21%	0.205	S	C	.	.	H	α-helix	trans	-62.9	-45.7	-172.8	-169.2	-89.9	0	0	0	113.7	R344 V541 T542 E543	R344-H539 PolarHBondContact NH2-NE2 3.2Å; H539-V541 VanDerWaalsContact C-N 3.3Å; H539-V541 PolarHBondContact O-N 3.2Å; H539-T542 WeakPolarHBondContact O-CB 3.37Å; H539-T542 PolarHBondContact O-N 3.04Å; H539-T542 VanDerWaalsContact O-N 3.15Å; H539-E543 IonicContact CE1-OE1 3.36Å; H539-E543 PolarHBondContact CE1-OE1 2.95Å; H539-E543 IonicContact CE1-OE2 3.92Å; H539-E543 PolarHBondContact CE1-OE2 3.43Å; H539-E543 VanDerWaalsContact ND1-CD 3.35Å; H539-E543 IonicContact ND1-OE1 2.81Å; H539-E543 IonicContact ND1-OE2 2.69Å; H539-E543 PolarHBondContact ND1-OE2 3.32Å; H539-E543 VanDerWaalsContact ND1-OE2 3.15Å; H539-E543 IonicContact NE2-OE1 3.81Å; H539-E543 PolarHBondContact O-N 3.27Å
540	M	76.8	Confident	83.4	Confident	163 Å²	163	39.2 Å²	39.2	80%	0.803	21%	0.211	S	C	*	.	H	α-helix	trans	-62	-40.1	-176.7	-58.7	-178.4	86.5	0	0	111.6	G538 E544	G538-M540 PolarHBondContact O-N 3.48Å; M540-E544 PolarHBondContact O-N 3.29Å; M540-E544 VanDerWaalsContact O-N 3.17Å
541	V	78.4	Confident	83.5	Confident	18 Å²	18	43 Å²	43	11%	0.109	24%	0.236	C	C	.	.	H	α-helix	trans	-63.7	-44.6	176.1	174.5	0	0	0	0	111	Y487 I534 Q537 G538 H539 E543 E544 I545	Y487-V541 HydrophobicContact CD1-CG1 4.33Å; Y487-V541 HydrophobicContact CD1-CG2 4.21Å; Y487-V541 HydrophobicContact CD2-CG1 3.98Å; Y487-V541 HydrophobicContact CE1-CB 4.16Å; Y487-V541 HydrophobicContact CE1-CG1 3.77Å; Y487-V541 HydrophobicContact CE1-CG2 3.35Å; Y487-V541 HydrophobicContact CE2-CB 4.46Å; Y487-V541 HydrophobicContact CE2-CG1 3.36Å; Y487-V541 HydrophobicContact CE2-CG2 4.48Å; Y487-V541 HydrophobicContact CG-CG1 4.43Å; Y487-V541 WeakPolarHBondContact OH-CG1 3.45Å; Y487-V541 WeakPolarHBondContact OH-CG2 3.43Å; I534-V541 HydrophobicContact CG2-CG1 4.43Å; Q537-V541 HydrophobicContact CB-CG1 4.41Å; G538-V541 PolarHBondContact O-N 3.44Å; H539-V541 VanDerWaalsContact C-N 3.3Å; H539-V541 PolarHBondContact O-N 3.2Å; V541-E543 PolarHBondContact O-N 2.97Å; V541-E544 PolarHBondContact O-N 2.94Å; V541-I545 HydrophobicContact CG1-CD1 3.63Å; V541-I545 HydrophobicContact CG1-CG1 4.38Å; V541-I545 WeakPolarHBondContact O-CB 3.39Å; V541-I545 VanDerWaalsContact O-CG1 3.24Å; V541-I545 WeakPolarHBondContact O-CG1 3.28Å; V541-I545 PolarHBondContact O-N 3.5Å
542	T	82.1	Confident	83.7	Confident	19 Å²	19	45.6 Å²	45.6	12%	0.117	25%	0.249	C	C	.	.	H	α-helix	trans	-61.8	-45	-178.8	-53.4	0	0	0	0	111.1	L338 S535 G538 H539 I545 M546	L338-T542 HydrophobicContact CB-CG2 4.12Å; L338-T542 HydrophobicContact CD2-CG2 4.45Å; L338-T542 VanDerWaalsContact O-CG2 3.32Å; L338-T542 WeakPolarHBondContact O-CG2 3.08Å; S535-T542 WeakPolarHBondContact CA-OG1 3.48Å; G538-T542 PolarHBondContact O-N 3.35Å; G538-T542 PolarHBondContact O-OG1 3.1Å; H539-T542 WeakPolarHBondContact O-CB 3.37Å; H539-T542 PolarHBondContact O-N 3.04Å; H539-T542 VanDerWaalsContact O-N 3.15Å; T542-I545 PolarHBondContact O-N 2.98Å; T542-M546 WeakPolarHBondContact O-CB 3.21Å; T542-M546 PolarHBondContact O-N 2.69Å
543	E	82.5	Confident	84.1	Confident	107 Å²	107	46.5 Å²	46.5	50%	0.5	25%	0.248	S	C	.	.	H	α-helix	trans	-65.4	-41.2	178.9	-71.6	-178.7	141.3	0	0	112.6	H539 V541 M546 S547	H539-E543 IonicContact CE1-OE1 3.36Å; H539-E543 PolarHBondContact CE1-OE1 2.95Å; H539-E543 IonicContact CE1-OE2 3.92Å; H539-E543 PolarHBondContact CE1-OE2 3.43Å; H539-E543 VanDerWaalsContact ND1-CD 3.35Å; H539-E543 IonicContact ND1-OE1 2.81Å; H539-E543 IonicContact ND1-OE2 2.69Å; H539-E543 PolarHBondContact ND1-OE2 3.32Å; H539-E543 VanDerWaalsContact ND1-OE2 3.15Å; H539-E543 IonicContact NE2-OE1 3.81Å; H539-E543 PolarHBondContact O-N 3.27Å; V541-E543 PolarHBondContact O-N 2.97Å; E543-M546 PolarHBondContact O-N 3.47Å; E543-S547 PolarHBondContact O-N 3.42Å
544	E	84.8	Confident	84.4	Confident	70 Å²	70	49.7 Å²	49.7	33%	0.327	27%	0.265	S	S	.	.	H	α-helix	trans	-61.2	-48.9	177.1	-174	178.3	-168.2	0	0	111.2	Y487 H491 L501 M540 V541 S547 C548	Y487-E544 PolarHBondContact OH-OE2 2.93Å; H491-E544 IonicContact CD2-OE2 3.48Å; L501-E544 HydrophobicContact CD2-CG 3.98Å; M540-E544 PolarHBondContact O-N 3.29Å; M540-E544 VanDerWaalsContact O-N 3.17Å; V541-E544 PolarHBondContact O-N 2.94Å; E544-S547 PolarHBondContact O-N 3.04Å; E544-S547 PolarHBondContact O-OG 3.26Å; E544-C548 PolarHBondContact O-N 2.93Å; E544-C548 PolarHBondContact O-SG 3.48Å
545	I	86	Confident	84.7	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-64.8	-43.3	179.8	-68.6	178.7	0	0	0	111.2	F334 L338 Y487 I505 I534 V541 T542 S547 C548 I549	F334-I545 HydrophobicContact CE1-CG2 4.29Å; F334-I545 HydrophobicContact CZ-CG2 4.1Å; L338-I545 HydrophobicContact CD1-CG2 3.64Å; L338-I545 HydrophobicContact CD2-CG2 4.2Å; Y487-I545 HydrophobicContact CE2-CD1 4.01Å; I505-I545 HydrophobicContact CD1-CB 4.16Å; I505-I545 HydrophobicContact CD1-CD1 4.4Å; I505-I545 HydrophobicContact CD1-CG1 3.8Å; I505-I545 HydrophobicContact CD1-CG2 3.8Å; I505-I545 HydrophobicContact CG1-CD1 4.3Å; I505-I545 HydrophobicContact CG1-CG1 4.24Å; I505-I545 HydrophobicContact CG1-CG2 4.19Å; I505-I545 HydrophobicContact CG2-CG2 4.08Å; I534-I545 HydrophobicContact CG2-CD1 3.26Å; V541-I545 HydrophobicContact CG1-CD1 3.63Å; V541-I545 HydrophobicContact CG1-CG1 4.38Å; V541-I545 WeakPolarHBondContact O-CB 3.39Å; V541-I545 VanDerWaalsContact O-CG1 3.24Å; V541-I545 WeakPolarHBondContact O-CG1 3.28Å; V541-I545 PolarHBondContact O-N 3.5Å; T542-I545 PolarHBondContact O-N 2.98Å; I545-S547 PolarHBondContact O-N 3.43Å; I545-C548 PolarHBondContact O-N 3.18Å; I545-C548 VanDerWaalsContact O-N 3.14Å; I545-I549 HydrophobicContact CG2-CG1 4.41Å; I545-I549 PolarHBondContact O-N 3.47Å
546	M	86.8	Confident	85.2	Confident	46 Å²	46	55.1 Å²	55.1	23%	0.227	29%	0.289	C	S	.	.	H	α-helix	trans	-56.1	-51.4	176.4	-176.5	168.1	-175.7	0	0	110	L335 E339 T542 E543 C548 I549 E550	L335-M546 HydrophobicContact CD1-CB 4.18Å; L335-M546 HydrophobicContact CD1-CG 3.79Å; L335-M546 HydrophobicContact CD2-CE 4.27Å; L335-M546 HydrophobicContact CG-CG 4.48Å; E339-M546 HydrophobicContact CG-CE 4.36Å; T542-M546 WeakPolarHBondContact O-CB 3.21Å; T542-M546 PolarHBondContact O-N 2.69Å; E543-M546 PolarHBondContact O-N 3.47Å; M546-C548 PolarHBondContact O-N 2.98Å; M546-I549 PolarHBondContact O-N 3.03Å; M546-I549 VanDerWaalsContact O-N 3.16Å; M546-E550 WeakPolarHBondContact CE-OE1 3.42Å; M546-E550 HydrophobicContact CG-CG 3.92Å; M546-E550 WeakPolarHBondContact O-CB 3.27Å; M546-E550 WeakPolarHBondContact O-CG 3.41Å; M546-E550 PolarHBondContact O-N 3.47Å
547	S	87	Confident	85.6	Confident	71 Å²	71	54.2 Å²	54.2	50%	0.497	28%	0.284	S	S	.	.	H	α-helix	trans	-58.8	-25.4	179.6	76.4	0	0	0	0	114.5	E543 E544 I545	E543-S547 PolarHBondContact O-N 3.42Å; E544-S547 PolarHBondContact O-N 3.04Å; E544-S547 PolarHBondContact O-OG 3.26Å; I545-S547 PolarHBondContact O-N 3.43Å
548	C	87.2	Confident	86.3	Confident	14 Å²	14	52.7 Å²	52.7	10%	0.095	28%	0.277	C	S	.	.	H	α-helix	trans	-86.7	-36.2	179.6	-65.3	0	0	0	0	113.1	I502 E544 I545 M546	I502-C548 HydrophobicContact CD1-CB 4.49Å; I502-C548 HydrophobicContact CG1-CB 3.91Å; E544-C548 PolarHBondContact O-N 2.93Å; E544-C548 PolarHBondContact O-SG 3.48Å; I545-C548 PolarHBondContact O-N 3.18Å; I545-C548 VanDerWaalsContact O-N 3.14Å; M546-C548 PolarHBondContact O-N 2.98Å
549	I	90.2	Very high	87	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-88.8	-28.1	-175.6	-68.3	-87	0	0	0	111.9	F331 F334 L335 I505 I509 I545 M546 I552 R553	F331-I549 HydrophobicContact CD1-CD1 4.33Å; F331-I549 HydrophobicContact CD1-CG2 3.98Å; F331-I549 HydrophobicContact CE1-CD1 4.12Å; F334-I549 HydrophobicContact CD1-CG2 3.93Å; F334-I549 HydrophobicContact CE1-CB 4.32Å; F334-I549 HydrophobicContact CE1-CD1 4.24Å; F334-I549 HydrophobicContact CE1-CG1 3.96Å; F334-I549 HydrophobicContact CE1-CG2 4Å; L335-I549 HydrophobicContact CD1-CG2 4.48Å; I505-I549 HydrophobicContact CB-CD1 4.31Å; I505-I549 HydrophobicContact CG2-CD1 3.7Å; I505-I549 HydrophobicContact CG2-CG1 3.99Å; I509-I549 HydrophobicContact CD1-CD1 4.21Å; I545-I549 HydrophobicContact CG2-CG1 4.41Å; I545-I549 PolarHBondContact O-N 3.47Å; M546-I549 PolarHBondContact O-N 3.03Å; M546-I549 VanDerWaalsContact O-N 3.16Å; I549-I552 WeakPolarHBondContact O-CB 3.32Å; I549-I552 PolarHBondContact O-N 2.92Å; I549-R553 PolarHBondContact O-N 2.99Å
550	E	89.2	Confident	87.6	Confident	62 Å²	62	48.8 Å²	48.8	29%	0.29	25%	0.253	S	S	.	.	H	α-helix	trans	-49.9	-45.8	-179.1	-82.9	-170.3	148.5	0	0	114.4	L335 M546 I552 R553 D554	L335-E550 HydrophobicContact CD1-CG 4.45Å; L335-E550 HydrophobicContact CD2-CG 3.97Å; M546-E550 WeakPolarHBondContact CE-OE1 3.42Å; M546-E550 HydrophobicContact CG-CG 3.92Å; M546-E550 WeakPolarHBondContact O-CB 3.27Å; M546-E550 WeakPolarHBondContact O-CG 3.41Å; M546-E550 PolarHBondContact O-N 3.47Å; E550-I552 VanDerWaalsContact C-N 3.34Å; E550-I552 PolarHBondContact O-N 3.48Å; E550-R553 VanDerWaalsContact CG-NH2 3.33Å; E550-R553 PolarHBondContact O-N 2.97Å; E550-R553 IonicContact OE1-NH1 3.61Å; E550-R553 IonicContact OE1-NH2 3.67Å; E550-D554 WeakPolarHBondContact O-CB 3.42Å; E550-D554 PolarHBondContact O-N 3.45Å
551	P	91.4	Very high	88.1	Confident	81 Å²	81	42 Å²	42	53%	0.526	22%	0.219	S	C	.	.	H	α-helix	trans	-63.6	-37.2	178	-22.7	34.4	0	0	0	113.5	D554 F555	P551-D554 PolarHBondContact O-N 3.08Å; P551-F555 PolarHBondContact O-N 3.48Å; P551-F555 VanDerWaalsContact O-N 3.09Å
552	I	91.7	Very high	88.8	Confident	54 Å²	54	41.2 Å²	41.2	28%	0.277	21%	0.214	S	C	.	.	H	α-helix	trans	-67.7	-48	178.3	-62.6	172.7	0	0	0	109.4	F331 I502 I549 E550 D554 F555 L556	F331-I552 HydrophobicContact CD1-CG2 4.34Å; F331-I552 HydrophobicContact CD2-CG2 4.31Å; F331-I552 HydrophobicContact CE1-CG2 4.22Å; F331-I552 HydrophobicContact CE2-CG2 4.21Å; F331-I552 HydrophobicContact CG-CG2 4.38Å; F331-I552 HydrophobicContact CZ-CG2 4.16Å; I502-I552 HydrophobicContact CG2-CD1 3.77Å; I549-I552 WeakPolarHBondContact O-CB 3.32Å; I549-I552 PolarHBondContact O-N 2.92Å; E550-I552 VanDerWaalsContact C-N 3.34Å; E550-I552 PolarHBondContact O-N 3.48Å; I552-D554 VanDerWaalsContact C-N 3.34Å; I552-D554 PolarHBondContact O-N 3.49Å; I552-F555 PolarHBondContact O-N 3.11Å; I552-L556 HydrophobicContact CG2-CD1 3.85Å; I552-L556 WeakPolarHBondContact O-CB 3.46Å; I552-L556 WeakPolarHBondContact O-CG 3.21Å; I552-L556 PolarHBondContact O-N 2.99Å
553	R	90.1	Very high	89.1	Confident	39 Å²	39	40.7 Å²	40.7	15%	0.147	21%	0.211	C	C	.	.	H	α-helix	trans	-54.9	-50.3	173.8	173.8	-147.6	58.3	-162.2	-14.9	110.6	F331 I549 E550 F555 L556 A557	F331-R553 HydrophobicContact CB-CB 4.13Å; I549-R553 PolarHBondContact O-N 2.99Å; E550-R553 VanDerWaalsContact CG-NH2 3.33Å; E550-R553 PolarHBondContact O-N 2.97Å; E550-R553 IonicContact OE1-NH1 3.61Å; E550-R553 IonicContact OE1-NH2 3.67Å; R553-F555 PolarHBondContact O-N 3.43Å; R553-L556 PolarHBondContact O-N 3.02Å; R553-A557 WeakPolarHBondContact O-CB 3.45Å; R553-A557 PolarHBondContact O-N 3.18Å
554	D	89.7	Confident	89.2	Confident	81 Å²	81	36 Å²	36	43%	0.433	19%	0.189	S	C	.	.	H	α-helix	trans	-63.7	-42.2	-174.5	-73.7	-16.2	0	0	0	112.4	E550 P551 I552 A557 I558	E550-D554 WeakPolarHBondContact O-CB 3.42Å; E550-D554 PolarHBondContact O-N 3.45Å; P551-D554 PolarHBondContact O-N 3.08Å; I552-D554 VanDerWaalsContact C-N 3.34Å; I552-D554 PolarHBondContact O-N 3.49Å; D554-A557 PolarHBondContact O-N 3.23Å; D554-I558 WeakPolarHBondContact O-CG1 3.44Å; D554-I558 PolarHBondContact O-N 3.13Å; D554-I558 VanDerWaalsContact O-N 3.15Å
555	F	92.3	Very high	89.3	Confident	109 Å²	109	32.6 Å²	32.6	48%	0.478	17%	0.173	S	C	.	.	H	α-helix	trans	-63.8	-47	175.8	-178.8	-103.3	0	0	0	112	P551 I552 R553 A557 I558 I559	P551-F555 PolarHBondContact O-N 3.48Å; P551-F555 VanDerWaalsContact O-N 3.09Å; I552-F555 PolarHBondContact O-N 3.11Å; R553-F555 PolarHBondContact O-N 3.43Å; F555-A557 VanDerWaalsContact C-N 3.3Å; F555-A557 PolarHBondContact O-N 3.01Å; F555-I558 WeakPolarHBondContact O-CB 2.99Å; F555-I558 PolarHBondContact O-N 3.2Å; F555-I559 HydrophobicContact CD1-CD1 4.23Å; F555-I559 HydrophobicContact CE1-CD1 3.72Å; F555-I559 HydrophobicContact CZ-CD1 4.13Å; F555-I559 PolarHBondContact O-N 2.68Å
556	L	92.4	Very high	89.4	Confident	19 Å²	19	32.9 Å²	32.9	10%	0.099	18%	0.175	C	C	.	.	H	α-helix	trans	-68.6	-30.6	178.6	-66.8	170.9	0	0	0	112.3	L324 F327 F331 I552 R553 I558 I559 F560	L324-L556 HydrophobicContact CD1-CD2 4.15Å; L324-L556 HydrophobicContact CG-CD2 4.36Å; F327-L556 HydrophobicContact CB-CD1 4.11Å; F327-L556 HydrophobicContact CB-CD2 4.44Å; F331-L556 HydrophobicContact CD2-CD1 3.35Å; F331-L556 HydrophobicContact CE2-CD1 3.7Å; F331-L556 HydrophobicContact CG-CD1 4.27Å; I552-L556 HydrophobicContact CG2-CD1 3.85Å; I552-L556 WeakPolarHBondContact O-CB 3.46Å; I552-L556 WeakPolarHBondContact O-CG 3.21Å; I552-L556 PolarHBondContact O-N 2.99Å; R553-L556 PolarHBondContact O-N 3.02Å; L556-I558 VanDerWaalsContact C-N 3.34Å; L556-I559 HydrophobicContact CD2-CD1 4.45Å; L556-I559 PolarHBondContact O-N 2.89Å; L556-F560 WeakPolarHBondContact O-CB 3.33Å; L556-F560 PolarHBondContact O-N 3.28Å
557	A	87.1	Confident	89.2	Confident	10 Å²	10	32.4 Å²	32.4	8%	0.083	17%	0.172	C	C	.	.	H	α-helix	trans	-64.7	-36.7	174.2	0	0	0	0	0	111.8	R553 D554 F555 I559 F560 F561	R553-A557 WeakPolarHBondContact O-CB 3.45Å; R553-A557 PolarHBondContact O-N 3.18Å; D554-A557 PolarHBondContact O-N 3.23Å; F555-A557 VanDerWaalsContact C-N 3.3Å; F555-A557 PolarHBondContact O-N 3.01Å; A557-I559 VanDerWaalsContact C-N 3.32Å; A557-I559 PolarHBondContact O-N 3.47Å; A557-F560 PolarHBondContact O-N 3.33Å; A557-F561 HydrophobicContact CB-CD2 4.32Å; A557-F561 HydrophobicContact CB-CE2 4.26Å; A557-F561 WeakPolarHBondContact O-CB 3.31Å; A557-F561 WeakPolarHBondContact O-CD2 3.32Å; A557-F561 PolarHBondContact O-N 3.36Å
558	I	92.8	Very high	89	Confident	34 Å²	34	29.9 Å²	29.9	17%	0.174	15%	0.154	C	C	.	.	H	α-helix	trans	-57.2	-48.5	172.8	-67.4	163.7	0	0	0	110.1	I278 S282 Y300 D554 F555 L556 A562	I278-I558 HydrophobicContact CG2-CG2 4.45Å; S282-I558 WeakPolarHBondContact OG-CG2 3.47Å; Y300-I558 HydrophobicContact CD1-CG1 4.25Å; Y300-I558 HydrophobicContact CD1-CG2 4.31Å; Y300-I558 HydrophobicContact CD2-CB 4.39Å; Y300-I558 HydrophobicContact CD2-CG1 3.93Å; Y300-I558 HydrophobicContact CE1-CG1 3.96Å; Y300-I558 HydrophobicContact CE2-CG1 3.6Å; Y300-I558 HydrophobicContact CG-CG1 4.26Å; Y300-I558 HydrophobicContact CG-CG2 4.35Å; D554-I558 WeakPolarHBondContact O-CG1 3.44Å; D554-I558 PolarHBondContact O-N 3.13Å; D554-I558 VanDerWaalsContact O-N 3.15Å; F555-I558 WeakPolarHBondContact O-CB 2.99Å; F555-I558 PolarHBondContact O-N 3.2Å; L556-I558 VanDerWaalsContact C-N 3.34Å; I558-A562 VanDerWaalsContact O-CB 3.24Å; I558-A562 WeakPolarHBondContact O-CB 3.38Å; I558-A562 PolarHBondContact O-N 2.99Å
559	I	93.1	Very high	88.8	Confident	3 Å²	3	31.8 Å²	31.8	2%	0.015	16%	0.16	C	C	.	.	H	α-helix	trans	-64.7	-43.3	-179.6	-59.3	169.8	0	0	0	110.6	I275 V321 L324 F555 L556 A557 A562 S563	I275-I559 HydrophobicContact CD1-CD1 4.48Å; I275-I559 HydrophobicContact CD1-CG2 4.36Å; V321-I559 HydrophobicContact CG1-CG2 4.16Å; L324-I559 HydrophobicContact CB-CG2 4.34Å; L324-I559 HydrophobicContact CD2-CD1 3.55Å; L324-I559 HydrophobicContact CD2-CG2 4.28Å; L324-I559 HydrophobicContact CG-CD1 4.07Å; L324-I559 HydrophobicContact CG-CG2 4.3Å; F555-I559 HydrophobicContact CD1-CD1 4.23Å; F555-I559 HydrophobicContact CE1-CD1 3.72Å; F555-I559 HydrophobicContact CZ-CD1 4.13Å; F555-I559 PolarHBondContact O-N 2.68Å; L556-I559 HydrophobicContact CD2-CD1 4.45Å; L556-I559 PolarHBondContact O-N 2.89Å; A557-I559 VanDerWaalsContact C-N 3.32Å; A557-I559 PolarHBondContact O-N 3.47Å; I559-A562 PolarHBondContact O-N 3.31Å; I559-S563 VanDerWaalsContact O-CB 3.27Å; I559-S563 WeakPolarHBondContact O-CB 3.39Å; I559-S563 PolarHBondContact O-N 3.09Å
560	F	88.6	Confident	88.4	Confident	24 Å²	24	34 Å²	34	11%	0.105	18%	0.175	C	C	.	.	H	α-helix	trans	-59.1	-52.1	176.8	172.4	-110.5	0	0	0	112.7	G325 V329 L556 A557 A562 S563 I564 V627	G325-F560 WeakPolarHBondContact O-CB 3.09Å; G325-F560 WeakPolarHBondContact O-CD2 3.31Å; V329-F560 HydrophobicContact CG2-CD1 4.29Å; V329-F560 HydrophobicContact CG2-CD2 3.41Å; V329-F560 VanDerWaalsContact CG2-CD2 3.41Å; V329-F560 HydrophobicContact CG2-CE1 4.13Å; V329-F560 HydrophobicContact CG2-CE2 3.24Å; V329-F560 HydrophobicContact CG2-CG 3.96Å; V329-F560 HydrophobicContact CG2-CZ 3.63Å; L556-F560 WeakPolarHBondContact O-CB 3.33Å; L556-F560 PolarHBondContact O-N 3.28Å; A557-F560 PolarHBondContact O-N 3.33Å; F560-A562 PolarHBondContact O-N 3.44Å; F560-S563 WeakPolarHBondContact O-CB 3.36Å; F560-S563 PolarHBondContact O-N 3.14Å; F560-I564 HydrophobicContact CD1-CD1 4.03Å; F560-I564 HydrophobicContact CD2-CD1 4.37Å; F560-I564 HydrophobicContact CE1-CD1 3.4Å; F560-I564 HydrophobicContact CE2-CD1 3.78Å; F560-I564 HydrophobicContact CE2-CG1 4.21Å; F560-I564 HydrophobicContact CG-CD1 4.47Å; F560-I564 HydrophobicContact CZ-CD1 3.24Å; F560-I564 HydrophobicContact CZ-CG1 4.13Å; F560-I564 PolarHBondContact O-N 2.97Å; F560-V627 HydrophobicContact CE1-CG2 4.14Å; F560-V627 HydrophobicContact CE2-CG2 3.95Å; F560-V627 HydrophobicContact CZ-CG2 3.31Å
561	F	87.6	Confident	88.1	Confident	21 Å²	21	35.2 Å²	35.2	9%	0.092	19%	0.187	C	C	.	.	H	α-helix	trans	-68.2	-35.7	-179.5	-74	-59.6	0	0	0	112.4	M297 Y300 I301 A557 I564 G565 E623 F626	M297-F561 HydrophobicContact CB-CD1 4.45Å; M297-F561 HydrophobicContact CB-CD2 4.01Å; M297-F561 HydrophobicContact CB-CE1 4.41Å; M297-F561 HydrophobicContact CB-CE2 3.98Å; M297-F561 HydrophobicContact CB-CG 4.28Å; M297-F561 HydrophobicContact CB-CZ 4.18Å; M297-F561 HydrophobicContact CE-CE1 4Å; M297-F561 HydrophobicContact CE-CZ 4.19Å; Y300-F561 HydrophobicContact CD2-CB 4.35Å; Y300-F561 HydrophobicContact CD2-CD2 4.2Å; I301-F561 HydrophobicContact CD1-CD1 4.35Å; I301-F561 HydrophobicContact CG1-CB 4.14Å; I301-F561 HydrophobicContact CG1-CD1 4.33Å; A557-F561 HydrophobicContact CB-CD2 4.32Å; A557-F561 HydrophobicContact CB-CE2 4.26Å; A557-F561 WeakPolarHBondContact O-CB 3.31Å; A557-F561 WeakPolarHBondContact O-CD2 3.32Å; A557-F561 PolarHBondContact O-N 3.36Å; F561-I564 HydrophobicContact CD1-CD1 4.08Å; F561-I564 PolarHBondContact O-N 3.02Å; F561-G565 PolarHBondContact O-N 3.49Å; F561-G565 VanDerWaalsContact O-N 3.13Å; F561-E623 HydrophobicContact CE1-CB 3.86Å; F561-E623 HydrophobicContact CE1-CG 4.34Å; F561-E623 HydrophobicContact CZ-CB 4.17Å; F561-E623 HydrophobicContact CZ-CG 4.15Å; F561-F626 HydrophobicContact CE1-CD2 4.46Å
562	A	92	Very high	87.7	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.5	-43	171.2	0	0	0	0	0	111.6	I278 Y300 G304 I558 I559 F560 I564 G565 L566	I278-A562 HydrophobicContact CG2-CB 3.59Å; Y300-A562 WeakPolarHBondContact O-CA 3.27Å; G304-A562 WeakPolarHBondContact CA-O 3.48Å; I558-A562 VanDerWaalsContact O-CB 3.24Å; I558-A562 WeakPolarHBondContact O-CB 3.38Å; I558-A562 PolarHBondContact O-N 2.99Å; I559-A562 PolarHBondContact O-N 3.31Å; F560-A562 PolarHBondContact O-N 3.44Å; A562-I564 VanDerWaalsContact C-N 3.33Å; A562-I564 PolarHBondContact O-N 3.39Å; A562-G565 WeakPolarHBondContact O-CA 3.25Å; A562-G565 PolarHBondContact O-N 3.45Å; A562-L566 PolarHBondContact O-N 3.28Å; A562-L566 VanDerWaalsContact O-N 3.11Å
563	S	88.8	Confident	87.3	Confident	9 Å²	9	33.1 Å²	33.1	6%	0.063	17%	0.17	C	C	.	.	H	α-helix	trans	-58.5	-42.5	175.7	168.4	0	0	0	0	112.2	E322 I559 F560 G565 L566	E322-S563 WeakPolarHBondContact CA-OG 3.42Å; E322-S563 WeakPolarHBondContact CG-OG 3.41Å; I559-S563 VanDerWaalsContact O-CB 3.27Å; I559-S563 WeakPolarHBondContact O-CB 3.39Å; I559-S563 PolarHBondContact O-N 3.09Å; F560-S563 WeakPolarHBondContact O-CB 3.36Å; F560-S563 PolarHBondContact O-N 3.14Å; S563-G565 VanDerWaalsContact C-N 3.29Å; S563-G565 PolarHBondContact O-N 2.89Å; S563-L566 VanDerWaalsContact O-CB 3.27Å; S563-L566 WeakPolarHBondContact O-CB 3.47Å; S563-L566 PolarHBondContact O-N 2.89Å; S563-L566 VanDerWaalsContact O-N 3.11Å
564	I	84.3	Confident	87.1	Confident	7 Å²	7	37.2 Å²	37.2	4%	0.036	19%	0.194	C	C	.	.	H	α-helix	trans	-59	-43.3	172.8	-68.1	161.3	0	0	0	111.2	F560 F561 A562 L566 H567 F626 L647	F560-I564 HydrophobicContact CD1-CD1 4.03Å; F560-I564 HydrophobicContact CD2-CD1 4.37Å; F560-I564 HydrophobicContact CE1-CD1 3.4Å; F560-I564 HydrophobicContact CE2-CD1 3.78Å; F560-I564 HydrophobicContact CE2-CG1 4.21Å; F560-I564 HydrophobicContact CG-CD1 4.47Å; F560-I564 HydrophobicContact CZ-CD1 3.24Å; F560-I564 HydrophobicContact CZ-CG1 4.13Å; F560-I564 PolarHBondContact O-N 2.97Å; F561-I564 HydrophobicContact CD1-CD1 4.08Å; F561-I564 PolarHBondContact O-N 3.02Å; A562-I564 VanDerWaalsContact C-N 3.33Å; A562-I564 PolarHBondContact O-N 3.39Å; I564-L566 PolarHBondContact O-N 3.36Å; I564-H567 PolarHBondContact O-N 3.48Å; I564-H567 VanDerWaalsContact O-N 3.09Å; I564-F626 HydrophobicContact CD1-CB 3.52Å; I564-F626 HydrophobicContact CD1-CD2 3.71Å; I564-F626 HydrophobicContact CD1-CG 3.9Å; I564-F626 HydrophobicContact CG1-CB 4.14Å; I564-F626 HydrophobicContact CG2-CB 4.36Å; I564-F626 HydrophobicContact CG2-CD1 4.45Å; I564-F626 HydrophobicContact CG2-CD2 4.46Å; I564-F626 HydrophobicContact CG2-CG 4.2Å; I564-L647 HydrophobicContact CG2-CD1 3.34Å; I564-L647 HydrophobicContact CG2-CD2 4.41Å
565	G	87.1	Confident	87	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.6	-31.9	176.1	0	0	0	0	0	113.6	I301 G304 V305 F561 A562 S563 H567 V568	I301-G565 WeakPolarHBondContact O-CA 3.3Å; G304-G565 VanDerWaalsContact C-C 3.43Å; V305-G565 WeakPolarHBondContact CA-O 3.3Å; V305-G565 PolarHBondContact N-O 3.45Å; F561-G565 PolarHBondContact O-N 3.49Å; F561-G565 VanDerWaalsContact O-N 3.13Å; A562-G565 WeakPolarHBondContact O-CA 3.25Å; A562-G565 PolarHBondContact O-N 3.45Å; S563-G565 VanDerWaalsContact C-N 3.29Å; S563-G565 PolarHBondContact O-N 2.89Å; G565-H567 PolarHBondContact O-N 3.25Å; G565-H567 VanDerWaalsContact O-N 3.16Å; G565-V568 PolarHBondContact O-N 2.91Å
566	L	88.3	Confident	86.7	Confident	7 Å²	7	41.4 Å²	41.4	4%	0.037	21%	0.205	C	C	.	.	H	α-helix	trans	-59.8	-27	176.9	-56.5	173.9	0	0	0	112.6	G304 G308 P309 I315 I318 V321 A562 S563 I564	G304-L566 WeakPolarHBondContact O-CD2 3.31Å; G308-L566 VanDerWaalsContact CA-CD2 3.47Å; P309-L566 WeakPolarHBondContact CD-O 3.32Å; I315-L566 HydrophobicContact CB-CD2 4.19Å; I315-L566 HydrophobicContact CG1-CD2 3.91Å; I315-L566 HydrophobicContact CG2-CD1 4.21Å; I315-L566 HydrophobicContact CG2-CD2 4.46Å; I318-L566 HydrophobicContact CG1-CD1 4.38Å; V321-L566 HydrophobicContact CG1-CD1 4.23Å; A562-L566 PolarHBondContact O-N 3.28Å; A562-L566 VanDerWaalsContact O-N 3.11Å; S563-L566 VanDerWaalsContact O-CB 3.27Å; S563-L566 WeakPolarHBondContact O-CB 3.47Å; S563-L566 PolarHBondContact O-N 2.89Å; S563-L566 VanDerWaalsContact O-N 3.11Å; I564-L566 PolarHBondContact O-N 3.36Å
567	H	82.4	Confident	86.6	Confident	35 Å²	35	44.5 Å²	44.5	16%	0.162	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-9.6	178.1	-70.3	-86.1	0	0	0	113.8	E322 I564 G565 F569 R633 Y643 L644	E322-H567 IonicContact OE1-CD2 3.82Å; E322-H567 IonicContact OE1-CE1 3.15Å; E322-H567 PolarHBondContact OE1-CE1 2.82Å; E322-H567 VanDerWaalsContact OE1-CE1 3.29Å; E322-H567 IonicContact OE1-NE2 2.98Å; E322-H567 PolarHBondContact OE1-NE2 3.5Å; I564-H567 PolarHBondContact O-N 3.48Å; I564-H567 VanDerWaalsContact O-N 3.09Å; G565-H567 PolarHBondContact O-N 3.25Å; G565-H567 VanDerWaalsContact O-N 3.16Å; H567-F569 VanDerWaalsContact O-CD2 3.25Å; H567-F569 WeakPolarHBondContact O-CD2 3.48Å; H567-F569 WeakPolarHBondContact O-CE2 3.35Å; H567-R633 PolarHBondContact CE1-NH1 2.92Å; H567-R633 PolarHBondContact ND1-NH1 3.01Å; H567-Y643 HydrophobicContact CB-CE1 4.01Å; H567-L644 WeakPolarHBondContact O-CD2 3.44Å
568	V	82.8	Confident	86.8	Confident	19 Å²	19	49.7 Å²	49.7	12%	0.115	25%	0.252	C	S	.	.			trans	-80	127.5	-179	-178.1	0	0	0	0	109.5	V305 S310 G565 P570 V573 L647	V305-V568 HydrophobicContact CG2-CB 3.7Å; V305-V568 HydrophobicContact CG2-CG1 4.01Å; V305-V568 HydrophobicContact CG2-CG2 4.22Å; S310-V568 PolarHBondContact OG-O 3.32Å; S310-V568 VanDerWaalsContact OG-O 3.06Å; G565-V568 PolarHBondContact O-N 2.91Å; V568-P570 WeakPolarHBondContact O-CD 3.45Å; V568-V573 HydrophobicContact CG1-CG2 4.41Å; V568-L647 HydrophobicContact CG2-CD1 4.33Å; V568-L647 HydrophobicContact CG2-CD2 3.52Å; V568-L647 HydrophobicContact CG2-CG 3.99Å
569	F	82.4	Confident	86.7	Confident	54 Å²	54	51.8 Å²	51.8	24%	0.237	27%	0.266	C	S	.	.			trans	-103.5	107	172.8	-68	-90	0	0	0	109	S310 H567 T571 F572 V573 L644	S310-F569 WeakPolarHBondContact OG-CD1 3.37Å; S310-F569 WeakPolarHBondContact OG-CE1 3.46Å; S310-F569 WeakPolarHBondContact OG-CG 3.38Å; H567-F569 VanDerWaalsContact O-CD2 3.25Å; H567-F569 WeakPolarHBondContact O-CD2 3.48Å; H567-F569 WeakPolarHBondContact O-CE2 3.35Å; F569-T571 PolarHBondContact O-N 3.38Å; F569-F572 HydrophobicContact CB-CB 4.03Å; F569-F572 WeakPolarHBondContact O-CB 3.41Å; F569-F572 PolarHBondContact O-N 3Å; F569-F572 VanDerWaalsContact O-N 3.12Å; F569-V573 PolarHBondContact O-N 3.08Å; F569-L644 HydrophobicContact CD2-CD1 4.29Å; F569-L644 HydrophobicContact CD2-CD2 4.15Å
570	P	81.7	Confident	86.6	Confident	46 Å²	46	51.7 Å²	51.7	30%	0.299	27%	0.266	S	S	.	.	H	α-helix	trans	-59.5	-34.6	-178.6	-27.3	37.4	0	0	0	113.1	V305 V568 F572 V573 I574	V305-P570 HydrophobicContact CG1-CG 3.31Å; V568-P570 WeakPolarHBondContact O-CD 3.45Å; P570-F572 VanDerWaalsContact C-N 3.35Å; P570-F572 PolarHBondContact O-N 3.3Å; P570-V573 PolarHBondContact O-N 3.05Å; P570-I574 WeakPolarHBondContact O-CG1 3.25Å; P570-I574 PolarHBondContact O-N 2.95Å
571	T	84.4	Confident	86.8	Confident	88 Å²	88	55.3 Å²	55.3	54%	0.54	29%	0.286	S	S	.	.	H	α-helix	trans	-58.8	-46.6	176.1	48.2	0	0	0	0	111.2	F569 V573 I574 Y575	F569-T571 PolarHBondContact O-N 3.38Å; T571-V573 VanDerWaalsContact C-N 3.33Å; T571-V573 PolarHBondContact O-N 3.37Å; T571-I574 PolarHBondContact O-N 3.5Å; T571-Y575 WeakPolarHBondContact O-CD2 3.5Å; T571-Y575 PolarHBondContact O-N 3.43Å
572	F	82.7	Confident	87.1	Confident	54 Å²	54	61.1 Å²	61.1	24%	0.237	31%	0.311	C	S	.	.	H	α-helix	trans	-58.4	-44.3	175.9	176.2	-98.9	0	0	0	111.8	F569 P570 I574 Y575 E576 L644 L645	F569-F572 HydrophobicContact CB-CB 4.03Å; F569-F572 WeakPolarHBondContact O-CB 3.41Å; F569-F572 PolarHBondContact O-N 3Å; F569-F572 VanDerWaalsContact O-N 3.12Å; P570-F572 VanDerWaalsContact C-N 3.35Å; P570-F572 PolarHBondContact O-N 3.3Å; F572-I574 VanDerWaalsContact C-N 3.33Å; F572-I574 PolarHBondContact O-N 3.23Å; F572-Y575 PolarHBondContact O-N 3.49Å; F572-E576 HydrophobicContact CD2-CG 4.2Å; F572-E576 HydrophobicContact CE2-CG 3.88Å; F572-E576 HydrophobicContact CZ-CG 4.29Å; F572-E576 WeakPolarHBondContact O-CB 3.43Å; F572-E576 PolarHBondContact O-N 3.17Å; F572-L644 HydrophobicContact CD1-CB 4.28Å; F572-L644 HydrophobicContact CE1-CB 3.94Å; F572-L644 HydrophobicContact CZ-CB 4.44Å; F572-L645 HydrophobicContact CE1-CD2 4.3Å; F572-L645 HydrophobicContact CZ-CD2 3.96Å; F572-L645 HydrophobicContact CZ-CG 4.23Å
573	V	82.1	Confident	87.1	Confident	36 Å²	36	64.1 Å²	64.1	22%	0.218	33%	0.327	C	S	.	.	H	α-helix	trans	-62.8	-39.1	179.3	178.6	0	0	0	0	111.9	V568 F569 P570 T571 L577 L580	V568-V573 HydrophobicContact CG1-CG2 4.41Å; F569-V573 PolarHBondContact O-N 3.08Å; P570-V573 PolarHBondContact O-N 3.05Å; T571-V573 VanDerWaalsContact C-N 3.33Å; T571-V573 PolarHBondContact O-N 3.37Å; V573-L577 VanDerWaalsContact O-CA 3.27Å; V573-L577 WeakPolarHBondContact O-CA 3.39Å; V573-L577 WeakPolarHBondContact O-CB 3.49Å; V573-L577 PolarHBondContact O-N 3.48Å; V573-L577 VanDerWaalsContact O-N 3.14Å; V573-L580 HydrophobicContact CG1-CD2 3.92Å
574	I	85.9	Confident	87.4	Confident	125 Å²	125	64.2 Å²	64.2	64%	0.641	33%	0.327	S	S	*	.	H	α-helix	trans	-73.4	-45.7	-180	-66.3	167	0	0	0	111.1	P570 T571 F572 L577	P570-I574 WeakPolarHBondContact O-CG1 3.25Å; P570-I574 PolarHBondContact O-N 2.95Å; T571-I574 PolarHBondContact O-N 3.5Å; F572-I574 VanDerWaalsContact C-N 3.33Å; F572-I574 PolarHBondContact O-N 3.23Å; I574-L577 WeakPolarHBondContact O-CB 3.15Å; I574-L577 PolarHBondContact O-N 2.96Å
575	Y	87.9	Confident	87.8	Confident	198 Å²	198	67.6 Å²	67.6	78%	0.776	35%	0.345	S	S	*	.	H	α-helix	trans	-65.2	-41.2	-179.6	-82.3	-68.3	0	0	0	112.2	T571 F572	T571-Y575 WeakPolarHBondContact O-CD2 3.5Å; T571-Y575 PolarHBondContact O-N 3.43Å; F572-Y575 PolarHBondContact O-N 3.49Å
576	E	87.4	Confident	88.1	Confident	80 Å²	80	70.3 Å²	70.3	37%	0.374	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	16.1	-178.3	-64.2	-62.4	163.8	0	0	113.4	F572 T578 V579 L580	F572-E576 HydrophobicContact CD2-CG 4.2Å; F572-E576 HydrophobicContact CE2-CG 3.88Å; F572-E576 HydrophobicContact CZ-CG 4.29Å; F572-E576 WeakPolarHBondContact O-CB 3.43Å; F572-E576 PolarHBondContact O-N 3.17Å; E576-T578 PolarHBondContact O-N 2.99Å; E576-T578 VanDerWaalsContact O-N 3.11Å; E576-V579 PolarHBondContact O-N 3.17Å; E576-V579 VanDerWaalsContact O-N 3.11Å; E576-L580 VanDerWaalsContact O-CB 3.26Å; E576-L580 WeakPolarHBondContact O-CB 3.39Å; E576-L580 PolarHBondContact O-N 3.04Å
577	L	88.8	Confident	88.4	Confident	84 Å²	84	70.4 Å²	70.4	44%	0.44	37%	0.365	S	S	.	.	H	α-helix	trans	-55.2	-38	-172.4	-173.9	62.5	0	0	0	112.6	V573 I574 L580 L581	V573-L577 VanDerWaalsContact O-CA 3.27Å; V573-L577 WeakPolarHBondContact O-CA 3.39Å; V573-L577 WeakPolarHBondContact O-CB 3.49Å; V573-L577 PolarHBondContact O-N 3.48Å; V573-L577 VanDerWaalsContact O-N 3.14Å; I574-L577 WeakPolarHBondContact O-CB 3.15Å; I574-L577 PolarHBondContact O-N 2.96Å; L577-L580 PolarHBondContact O-N 3.45Å; L577-L581 VanDerWaalsContact O-CB 3.25Å; L577-L581 WeakPolarHBondContact O-CB 3.33Å; L577-L581 PolarHBondContact O-N 3.05Å
578	T	91.6	Very high	89	Confident	119 Å²	119	69.1 Å²	69.1	73%	0.73	36%	0.359	S	S	*	.	H	α-helix	trans	-65.3	-48.8	179.6	-54.4	0	0	0	0	111.9	E576 L580 L581 F582	E576-T578 PolarHBondContact O-N 2.99Å; E576-T578 VanDerWaalsContact O-N 3.11Å; T578-L580 VanDerWaalsContact C-N 3.27Å; T578-L580 PolarHBondContact O-N 3Å; T578-L581 PolarHBondContact O-N 3.14Å; T578-F582 WeakPolarHBondContact O-CB 3.5Å; T578-F582 PolarHBondContact O-N 2.98Å
579	V	90.7	Very high	89.5	Confident	78 Å²	78	72.4 Å²	72.4	47%	0.473	38%	0.375	S	S	.	.	H	α-helix	trans	-62.6	-42	177.8	176.2	0	0	0	0	109.7	E576 F582 L583	E576-V579 PolarHBondContact O-N 3.17Å; E576-V579 VanDerWaalsContact O-N 3.11Å; V579-F582 PolarHBondContact O-N 3.04Å; V579-L583 VanDerWaalsContact O-CB 3.32Å; V579-L583 WeakPolarHBondContact O-CB 3.42Å; V579-L583 PolarHBondContact O-N 2.99Å
580	L	91.6	Very high	90.1	Very high	2 Å²	2	72.2 Å²	72.2	1%	0.01	38%	0.376	C	S	.	.	H	α-helix	trans	-67.6	-42.3	-178.6	-178.3	63.2	0	0	0	112.4	V573 E576 L577 T578 L583 T584 V649 L652	V573-L580 HydrophobicContact CG1-CD2 3.92Å; E576-L580 VanDerWaalsContact O-CB 3.26Å; E576-L580 WeakPolarHBondContact O-CB 3.39Å; E576-L580 PolarHBondContact O-N 3.04Å; L577-L580 PolarHBondContact O-N 3.45Å; T578-L580 VanDerWaalsContact C-N 3.27Å; T578-L580 PolarHBondContact O-N 3Å; L580-L583 PolarHBondContact O-N 3.31Å; L580-T584 HydrophobicContact CD1-CG2 4.3Å; L580-T584 WeakPolarHBondContact O-CB 3.44Å; L580-T584 WeakPolarHBondContact O-CG2 3.48Å; L580-T584 PolarHBondContact O-N 3.04Å; L580-T584 PolarHBondContact O-OG1 3.42Å; L580-V649 HydrophobicContact CD1-CB 4.45Å; L580-V649 HydrophobicContact CD1-CG2 3.65Å; L580-L652 HydrophobicContact CB-CD1 4.5Å; L580-L652 HydrophobicContact CD1-CD1 4.16Å; L580-L652 HydrophobicContact CD2-CD1 3.29Å; L580-L652 HydrophobicContact CD2-CG 4.46Å; L580-L652 HydrophobicContact CG-CD1 3.35Å
581	L	92	Very high	90.7	Very high	100 Å²	100	70.1 Å²	70.1	52%	0.524	36%	0.362	S	S	.	.	H	α-helix	trans	-65.4	-42.2	175.9	-163.7	159.5	0	0	0	110.6	L577 T578 T584 L585	L577-L581 VanDerWaalsContact O-CB 3.25Å; L577-L581 WeakPolarHBondContact O-CB 3.33Å; L577-L581 PolarHBondContact O-N 3.05Å; T578-L581 PolarHBondContact O-N 3.14Å; L581-T584 VanDerWaalsContact CA-OG1 3.29Å; L581-T584 WeakPolarHBondContact CA-OG1 3.48Å; L581-T584 PolarHBondContact O-N 3.45Å; L581-T584 PolarHBondContact O-OG1 3.13Å; L581-L585 VanDerWaalsContact O-CB 3.28Å; L581-L585 WeakPolarHBondContact O-CB 3.42Å; L581-L585 PolarHBondContact O-N 3.41Å
582	F	94.1	Very high	91.2	Very high	142 Å²	142	68 Å²	68	62%	0.623	35%	0.346	S	S	*	.	H	α-helix	trans	-60.9	-47.6	174.3	-179.9	-98.4	0	0	0	112	T578 V579 L585 S586	T578-F582 WeakPolarHBondContact O-CB 3.5Å; T578-F582 PolarHBondContact O-N 2.98Å; V579-F582 PolarHBondContact O-N 3.04Å; F582-L585 PolarHBondContact O-N 2.98Å; F582-S586 VanDerWaalsContact O-CB 3.24Å; F582-S586 WeakPolarHBondContact O-CB 3.5Å; F582-S586 PolarHBondContact O-N 3.42Å
583	L	92.6	Very high	91.7	Very high	63 Å²	63	69.3 Å²	69.3	33%	0.33	36%	0.358	S	S	.	.	H	α-helix	trans	-64.3	-43.2	-179.9	-174.7	60.1	0	0	0	111.8	V579 L580 S586 V587 V649	V579-L583 VanDerWaalsContact O-CB 3.32Å; V579-L583 WeakPolarHBondContact O-CB 3.42Å; V579-L583 PolarHBondContact O-N 2.99Å; L580-L583 PolarHBondContact O-N 3.31Å; L583-S586 PolarHBondContact O-N 3.18Å; L583-V587 HydrophobicContact CD1-CG2 4.4Å; L583-V587 WeakPolarHBondContact O-CB 3.49Å; L583-V587 VanDerWaalsContact O-CG2 3.26Å; L583-V587 WeakPolarHBondContact O-CG2 3.4Å; L583-V587 PolarHBondContact O-N 3.1Å; L583-V649 HydrophobicContact CB-CG2 4.14Å; L583-V649 HydrophobicContact CD2-CG2 3.4Å; L583-V649 VanDerWaalsContact CD2-CG2 3.4Å; L583-V649 HydrophobicContact CG-CG2 3.62Å
584	T	93.9	Very high	92.3	Very high	11 Å²	11	67.9 Å²	67.9	7%	0.067	35%	0.349	C	S	.	.	H	α-helix	trans	-62.5	-48.4	177.1	52.5	0	0	0	0	111.9	L580 L581 S586 V587 V588 V649 L652	L580-T584 HydrophobicContact CD1-CG2 4.3Å; L580-T584 WeakPolarHBondContact O-CB 3.44Å; L580-T584 WeakPolarHBondContact O-CG2 3.48Å; L580-T584 PolarHBondContact O-N 3.04Å; L580-T584 PolarHBondContact O-OG1 3.42Å; L581-T584 VanDerWaalsContact CA-OG1 3.29Å; L581-T584 WeakPolarHBondContact CA-OG1 3.48Å; L581-T584 PolarHBondContact O-N 3.45Å; L581-T584 PolarHBondContact O-OG1 3.13Å; T584-S586 VanDerWaalsContact C-N 3.34Å; T584-S586 PolarHBondContact O-N 3.47Å; T584-V587 PolarHBondContact O-N 3.02Å; T584-V588 WeakPolarHBondContact O-CB 3.3Å; T584-V588 VanDerWaalsContact O-CG2 3.3Å; T584-V588 WeakPolarHBondContact O-CG2 3.47Å; T584-V588 PolarHBondContact O-N 3.47Å; T584-V649 HydrophobicContact CG2-CB 4.03Å; T584-V649 HydrophobicContact CG2-CG1 3.97Å; T584-V649 HydrophobicContact CG2-CG2 4.06Å; T584-L652 HydrophobicContact CG2-CB 3.54Å; T584-L652 HydrophobicContact CG2-CD1 3.87Å; T584-L652 HydrophobicContact CG2-CG 4.39Å
585	L	94.2	Very high	92.6	Very high	79 Å²	79	62 Å²	62	41%	0.414	32%	0.318	S	S	.	.	H	α-helix	trans	-63.8	-42.3	178.8	-171.5	66.7	0	0	0	110.9	L581 F582 V587 V588 I589	L581-L585 VanDerWaalsContact O-CB 3.28Å; L581-L585 WeakPolarHBondContact O-CB 3.42Å; L581-L585 PolarHBondContact O-N 3.41Å; F582-L585 PolarHBondContact O-N 2.98Å; L585-V587 PolarHBondContact O-N 3.2Å; L585-V588 PolarHBondContact O-N 3.35Å; L585-I589 HydrophobicContact CD1-CD1 3.91Å; L585-I589 HydrophobicContact CD1-CG1 4.22Å; L585-I589 HydrophobicContact CD2-CD1 4.27Å; L585-I589 HydrophobicContact CG-CD1 3.66Å; L585-I589 HydrophobicContact CG-CG1 4.3Å; L585-I589 VanDerWaalsContact O-CB 3.3Å; L585-I589 WeakPolarHBondContact O-CB 3.49Å; L585-I589 WeakPolarHBondContact O-CG1 3.24Å; L585-I589 PolarHBondContact O-N 3.28Å
586	S	93.4	Very high	92.8	Very high	57 Å²	57	54 Å²	54	40%	0.399	29%	0.29	S	S	.	.	H	α-helix	trans	-59.7	-46.1	175.8	-173.7	0	0	0	0	111.7	F582 L583 T584 M590	F582-S586 VanDerWaalsContact O-CB 3.24Å; F582-S586 WeakPolarHBondContact O-CB 3.5Å; F582-S586 PolarHBondContact O-N 3.42Å; L583-S586 PolarHBondContact O-N 3.18Å; T584-S586 VanDerWaalsContact C-N 3.34Å; T584-S586 PolarHBondContact O-N 3.47Å; S586-M590 WeakPolarHBondContact O-CB 3.39Å; S586-M590 PolarHBondContact O-N 3.47Å
587	V	94.1	Very high	93.1	Very high	8 Å²	8	54.2 Å²	54.2	5%	0.048	29%	0.294	C	S	.	.	H	α-helix	trans	-65.6	-46.3	178.9	170.9	0	0	0	0	111.1	L388 L583 T584 L585 M590 K591 V621 V649	L388-V587 HydrophobicContact CB-CG1 4.32Å; L388-V587 HydrophobicContact CD1-CG2 3.96Å; L388-V587 HydrophobicContact CD2-CG1 4.39Å; L583-V587 HydrophobicContact CD1-CG2 4.4Å; L583-V587 WeakPolarHBondContact O-CB 3.49Å; L583-V587 VanDerWaalsContact O-CG2 3.26Å; L583-V587 WeakPolarHBondContact O-CG2 3.4Å; L583-V587 PolarHBondContact O-N 3.1Å; T584-V587 PolarHBondContact O-N 3.02Å; L585-V587 PolarHBondContact O-N 3.2Å; V587-M590 PolarHBondContact O-N 2.99Å; V587-K591 HydrophobicContact CG1-CD 4.21Å; V587-K591 HydrophobicContact CG1-CG 4.44Å; V587-K591 WeakPolarHBondContact O-CB 3.48Å; V587-K591 WeakPolarHBondContact O-CG 3.49Å; V587-K591 PolarHBondContact O-N 2.93Å; V587-V621 HydrophobicContact CG1-CG2 3.82Å; V587-V649 HydrophobicContact CG2-CG1 4.42Å
588	V	94.6	Very high	93.3	Very high	8 Å²	8	50.5 Å²	50.5	5%	0.048	27%	0.274	C	S	.	.	H	α-helix	trans	-64.1	-45.7	-179.4	170.4	0	0	0	0	111.2	T584 L585 F592 A619 S653 L656 L660	T584-V588 WeakPolarHBondContact O-CB 3.3Å; T584-V588 VanDerWaalsContact O-CG2 3.3Å; T584-V588 WeakPolarHBondContact O-CG2 3.47Å; T584-V588 PolarHBondContact O-N 3.47Å; L585-V588 PolarHBondContact O-N 3.35Å; V588-F592 VanDerWaalsContact O-CB 3.22Å; V588-F592 WeakPolarHBondContact O-CB 3.37Å; V588-F592 PolarHBondContact O-N 3.37Å; V588-A619 HydrophobicContact CG1-CB 4.14Å; V588-S653 VanDerWaalsContact CG2-OG 3.32Å; V588-S653 WeakPolarHBondContact CG2-OG 3.39Å; V588-L656 HydrophobicContact CB-CD2 4.47Å; V588-L656 HydrophobicContact CG1-CD2 4.16Å; V588-L656 HydrophobicContact CG2-CD2 4.36Å; V588-L660 HydrophobicContact CG1-CD2 4Å
589	I	94.3	Very high	93.2	Very high	89 Å²	89	44.9 Å²	44.9	46%	0.456	24%	0.24	S	C	.	.	H	α-helix	trans	-63.4	-46.2	176.9	-69.1	173.4	0	0	0	110.2	L585 F592 V593	L585-I589 HydrophobicContact CD1-CD1 3.91Å; L585-I589 HydrophobicContact CD1-CG1 4.22Å; L585-I589 HydrophobicContact CD2-CD1 4.27Å; L585-I589 HydrophobicContact CG-CD1 3.66Å; L585-I589 HydrophobicContact CG-CG1 4.3Å; L585-I589 VanDerWaalsContact O-CB 3.3Å; L585-I589 WeakPolarHBondContact O-CB 3.49Å; L585-I589 WeakPolarHBondContact O-CG1 3.24Å; L585-I589 PolarHBondContact O-N 3.28Å; I589-F592 PolarHBondContact O-N 3.12Å; I589-V593 HydrophobicContact CG2-CG2 4.25Å; I589-V593 WeakPolarHBondContact O-CB 3.38Å; I589-V593 VanDerWaalsContact O-CG2 3.3Å; I589-V593 WeakPolarHBondContact O-CG2 3.43Å; I589-V593 PolarHBondContact O-N 2.94Å
590	M	93.9	Very high	93.1	Very high	50 Å²	50	44 Å²	44	25%	0.246	24%	0.237	C	C	.	.	H	α-helix	trans	-62.4	-48.6	-178.9	-174.4	-105.5	-89.3	0	0	110.9	M363 F366 S586 V587 F592 V593 L594	M363-M590 HydrophobicContact CE-CE 4.08Å; M363-M590 HydrophobicContact CE-SD 4.02Å; M363-M590 HydrophobicContact SD-CE 4.08Å; M363-M590 HydrophobicContact SD-SD 3.29Å; F366-M590 HydrophobicContact CB-CE 3.95Å; F366-M590 HydrophobicContact CB-SD 4.4Å; S586-M590 WeakPolarHBondContact O-CB 3.39Å; S586-M590 PolarHBondContact O-N 3.47Å; V587-M590 PolarHBondContact O-N 2.99Å; M590-F592 VanDerWaalsContact C-N 3.33Å; M590-F592 PolarHBondContact O-N 3.46Å; M590-V593 PolarHBondContact O-N 3.37Å; M590-L594 HydrophobicContact CG-CD1 4.27Å; M590-L594 HydrophobicContact CG-CG 4.49Å; M590-L594 WeakPolarHBondContact O-CB 3.44Å; M590-L594 VanDerWaalsContact O-CG 3.26Å; M590-L594 WeakPolarHBondContact O-CG 3.45Å; M590-L594 PolarHBondContact O-N 3.11Å; M590-L594 HydrophobicContact SD-CD1 3.48Å; M590-L594 WeakPolarHBondContact SD-CD1 3.22Å; M590-L594 HydrophobicContact SD-CG 4.29Å
591	K	94.4	Very high	92.9	Very high	1 Å²	1	50.8 Å²	50.8	0%	0.004	27%	0.273	C	S	.	.	H	α-helix	trans	-57.9	-44	174.2	-76.9	-173.1	77.4	178.2	0	112.4	M363 L388 S389 L390 S391 V587 L594 A595 L618 A619 Q620 V621	M363-K591 HydrophobicContact CE-CD 4.42Å; M363-K591 HydrophobicContact CE-CG 3.88Å; M363-K591 HydrophobicContact SD-CG 3.7Å; L388-K591 VanDerWaalsContact O-CD 3.23Å; L388-K591 WeakPolarHBondContact O-CD 3.45Å; L388-K591 WeakPolarHBondContact O-CE 3.49Å; L388-K591 PolarHBondContact O-NZ 3.48Å; L388-K591 VanDerWaalsContact O-NZ 3.16Å; S389-K591 VanDerWaalsContact O-CE 3.32Å; S389-K591 WeakPolarHBondContact O-CE 3.4Å; S389-K591 PolarHBondContact O-NZ 3.29Å; L390-K591 PolarHBondContact O-NZ 3.32Å; S391-K591 PolarHBondContact OG-NZ 2.97Å; V587-K591 HydrophobicContact CG1-CD 4.21Å; V587-K591 HydrophobicContact CG1-CG 4.44Å; V587-K591 WeakPolarHBondContact O-CB 3.48Å; V587-K591 WeakPolarHBondContact O-CG 3.49Å; V587-K591 PolarHBondContact O-N 2.93Å; K591-L594 PolarHBondContact O-N 3.46Å; K591-A595 VanDerWaalsContact O-CB 3.28Å; K591-A595 WeakPolarHBondContact O-CB 3.44Å; K591-A595 PolarHBondContact O-N 3.27Å; K591-L618 VanDerWaalsContact CE-O 3.26Å; K591-L618 WeakPolarHBondContact CE-O 3.43Å; K591-L618 PolarHBondContact NZ-O 3.42Å; K591-A619 WeakPolarHBondContact CD-O 3.08Å; K591-Q620 PolarHBondContact NZ-O 3.26Å; K591-V621 HydrophobicContact CD-CG2 4.49Å
592	F	94.2	Very high	92.7	Very high	45 Å²	45	47.7 Å²	47.7	20%	0.197	26%	0.256	C	S	.	.	H	α-helix	trans	-61.8	-46.1	178.3	179.1	-102.8	0	0	0	112	V588 I589 M590 A595 V596 W612 A616 A619	V588-F592 VanDerWaalsContact O-CB 3.22Å; V588-F592 WeakPolarHBondContact O-CB 3.37Å; V588-F592 PolarHBondContact O-N 3.37Å; I589-F592 PolarHBondContact O-N 3.12Å; M590-F592 VanDerWaalsContact C-N 3.33Å; M590-F592 PolarHBondContact O-N 3.46Å; F592-A595 WeakPolarHBondContact O-CB 3.48Å; F592-A595 PolarHBondContact O-N 2.95Å; F592-V596 HydrophobicContact CE1-CG2 4.29Å; F592-V596 HydrophobicContact CZ-CG2 4.32Å; F592-V596 WeakPolarHBondContact O-CG2 3.38Å; F592-V596 PolarHBondContact O-N 2.87Å; F592-W612 HydrophobicContact CE1-CE3 4.01Å; F592-W612 AromaticContact CE1-CZ3 3.7Å; F592-W612 HydrophobicContact CE1-CZ3 3.7Å; F592-W612 HydrophobicContact CE2-CE3 4.46Å; F592-W612 AromaticContact CZ-CE3 3.53Å; F592-W612 HydrophobicContact CZ-CE3 3.53Å; F592-W612 AromaticContact CZ-CZ3 3.73Å; F592-W612 HydrophobicContact CZ-CZ3 3.73Å; F592-A616 HydrophobicContact CE2-CB 4.07Å; F592-A619 HydrophobicContact CB-CB 3.9Å; F592-A619 HydrophobicContact CD2-CB 4.31Å
593	V	94.4	Very high	92.2	Very high	81 Å²	81	41.2 Å²	41.2	49%	0.491	23%	0.228	S	C	.	.	H	α-helix	trans	-64.1	-43	178	171	0	0	0	0	111.1	I589 M590 V596 L597	I589-V593 HydrophobicContact CG2-CG2 4.25Å; I589-V593 WeakPolarHBondContact O-CB 3.38Å; I589-V593 VanDerWaalsContact O-CG2 3.3Å; I589-V593 WeakPolarHBondContact O-CG2 3.43Å; I589-V593 PolarHBondContact O-N 2.94Å; M590-V593 PolarHBondContact O-N 3.37Å; V593-V596 PolarHBondContact O-N 3.11Å; V593-L597 WeakPolarHBondContact O-CB 3.41Å; V593-L597 PolarHBondContact O-N 3.21Å
594	L	93.9	Very high	91.4	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.026	24%	0.236	C	C	.	.	H	α-helix	trans	-63.3	-41.5	175.4	-69	-176	0	0	0	111.8	M359 L362 M363 F366 M590 K591 V596 L597 V598	M359-L594 HydrophobicContact SD-CB 3.97Å; L362-L594 HydrophobicContact CB-CD1 4.13Å; L362-L594 HydrophobicContact CB-CD2 4.19Å; L362-L594 HydrophobicContact CD2-CD2 3.66Å; M363-L594 HydrophobicContact CG-CD1 4.11Å; M363-L594 HydrophobicContact SD-CD1 3.65Å; F366-L594 HydrophobicContact CD2-CD1 4.08Å; F366-L594 HydrophobicContact CD2-CD2 4.1Å; F366-L594 HydrophobicContact CE2-CD1 4.49Å; F366-L594 HydrophobicContact CE2-CD2 3.68Å; M590-L594 HydrophobicContact CG-CD1 4.27Å; M590-L594 HydrophobicContact CG-CG 4.49Å; M590-L594 WeakPolarHBondContact O-CB 3.44Å; M590-L594 VanDerWaalsContact O-CG 3.26Å; M590-L594 WeakPolarHBondContact O-CG 3.45Å; M590-L594 PolarHBondContact O-N 3.11Å; M590-L594 HydrophobicContact SD-CD1 3.48Å; M590-L594 WeakPolarHBondContact SD-CD1 3.22Å; M590-L594 HydrophobicContact SD-CG 4.29Å; K591-L594 PolarHBondContact O-N 3.46Å; L594-V596 PolarHBondContact O-N 2.99Å; L594-L597 PolarHBondContact O-N 3.48Å; L594-V598 WeakPolarHBondContact O-CB 3.3Å; L594-V598 WeakPolarHBondContact O-CG2 3.46Å; L594-V598 PolarHBondContact O-N 3.28Å
595	A	92.9	Very high	90.3	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.008	27%	0.271	C	S	.	.	H	α-helix	trans	-59.2	-48.2	175.4	0	0	0	0	0	111	M359 K591 F592 L597 V598 L599 S615	M359-A595 HydrophobicContact CE-CB 3.31Å; M359-A595 WeakPolarHBondContact SD-CA 3.47Å; M359-A595 HydrophobicContact SD-CB 4.13Å; M359-A595 PolarHBondContact SD-N 3.08Å; K591-A595 VanDerWaalsContact O-CB 3.28Å; K591-A595 WeakPolarHBondContact O-CB 3.44Å; K591-A595 PolarHBondContact O-N 3.27Å; F592-A595 WeakPolarHBondContact O-CB 3.48Å; F592-A595 PolarHBondContact O-N 2.95Å; A595-L597 VanDerWaalsContact C-N 3.32Å; A595-L597 PolarHBondContact O-N 3.42Å; A595-V598 PolarHBondContact O-N 2.99Å; A595-L599 WeakPolarHBondContact O-CB 3.46Å; A595-L599 WeakPolarHBondContact O-CD1 3.38Å; A595-L599 WeakPolarHBondContact O-CG 3.38Å; A595-L599 PolarHBondContact O-N 3.06Å; A595-S615 VanDerWaalsContact C-OG 3.29Å; A595-S615 WeakPolarHBondContact CB-OG 3.11Å
596	V	92.6	Very high	88.7	Confident	30 Å²	30	52 Å²	52	18%	0.182	29%	0.291	C	S	.	.	H	α-helix	trans	-61.5	-43.3	177.9	172.2	0	0	0	0	110.3	F592 V593 L594 S600 W612 S615	F592-V596 HydrophobicContact CE1-CG2 4.29Å; F592-V596 HydrophobicContact CZ-CG2 4.32Å; F592-V596 WeakPolarHBondContact O-CG2 3.38Å; F592-V596 PolarHBondContact O-N 2.87Å; V593-V596 PolarHBondContact O-N 3.11Å; L594-V596 PolarHBondContact O-N 2.99Å; V596-S600 WeakPolarHBondContact O-CA 3.25Å; V596-S600 WeakPolarHBondContact O-CB 3.4Å; V596-S600 PolarHBondContact O-N 3.25Å; V596-W612 HydrophobicContact CG1-CH2 4.47Å; V596-W612 HydrophobicContact CG2-CE3 3.89Å; V596-W612 HydrophobicContact CG2-CZ3 3.94Å; V596-S615 WeakPolarHBondContact CA-OG 3.11Å; V596-S615 VanDerWaalsContact CG2-OG 3.28Å; V596-S615 WeakPolarHBondContact CG2-OG 3.35Å; V596-S615 PolarHBondContact N-OG 3.49Å; V596-S615 VanDerWaalsContact N-OG 3.12Å
597	L	92.8	Very high	87.5	Confident	86 Å²	86	49.7 Å²	49.7	45%	0.45	28%	0.275	S	S	.	.	H	α-helix	trans	-61.5	-51.9	178.4	179.9	67.2	0	0	0	111.7	L362 V593 L594 A595 S600 L601	L362-L597 HydrophobicContact CD2-CD2 4.03Å; V593-L597 WeakPolarHBondContact O-CB 3.41Å; V593-L597 PolarHBondContact O-N 3.21Å; L594-L597 PolarHBondContact O-N 3.48Å; A595-L597 VanDerWaalsContact C-N 3.32Å; A595-L597 PolarHBondContact O-N 3.42Å; L597-S600 VanDerWaalsContact O-CB 3.31Å; L597-S600 WeakPolarHBondContact O-CB 3.49Å; L597-S600 PolarHBondContact O-N 3.3Å; L597-S600 VanDerWaalsContact O-N 3.14Å; L597-L601 WeakPolarHBondContact O-CG 3.43Å; L597-L601 PolarHBondContact O-N 3.28Å
598	V	92.3	Very high	86.6	Confident	5 Å²	5	53.7 Å²	53.7	3%	0.03	29%	0.293	C	S	.	.	H	α-helix	trans	-63.5	-48.7	-178.8	171.3	0	0	0	0	110.6	Y358 M359 L594 A595 S600 L601 I602	Y358-V598 HydrophobicContact CD2-CG1 4.43Å; M359-V598 HydrophobicContact CG-CB 4.27Å; M359-V598 HydrophobicContact CG-CG1 4.25Å; M359-V598 HydrophobicContact CG-CG2 4.13Å; M359-V598 HydrophobicContact SD-CB 4.19Å; M359-V598 HydrophobicContact SD-CG2 3.94Å; L594-V598 WeakPolarHBondContact O-CB 3.3Å; L594-V598 WeakPolarHBondContact O-CG2 3.46Å; L594-V598 PolarHBondContact O-N 3.28Å; A595-V598 PolarHBondContact O-N 2.99Å; V598-S600 PolarHBondContact O-N 3.24Å; V598-L601 PolarHBondContact O-N 3.41Å; V598-I602 HydrophobicContact CG1-CD1 3.63Å; V598-I602 WeakPolarHBondContact O-CG1 3.43Å; V598-I602 PolarHBondContact O-N 2.57Å; V598-I602 VanDerWaalsContact O-N 3.15Å
599	L	90.1	Very high	85.9	Confident	2 Å²	2	57 Å²	57	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-63.6	-30	175.7	-72.7	161.1	0	0	0	111.3	M421 A595 L601 I602 L603 K611 V614 S615	M421-L599 HydrophobicContact CE-CD1 4.33Å; M421-L599 HydrophobicContact CE-CD2 3.69Å; M421-L599 HydrophobicContact CE-CG 4.44Å; M421-L599 HydrophobicContact SD-CD2 4.22Å; A595-L599 WeakPolarHBondContact O-CB 3.46Å; A595-L599 WeakPolarHBondContact O-CD1 3.38Å; A595-L599 WeakPolarHBondContact O-CG 3.38Å; A595-L599 PolarHBondContact O-N 3.06Å; L599-L601 VanDerWaalsContact C-N 3.29Å; L599-L601 PolarHBondContact O-N 3.23Å; L599-I602 PolarHBondContact O-N 2.87Å; L599-L603 HydrophobicContact CB-CD1 4.25Å; L599-L603 HydrophobicContact CD2-CD1 3.32Å; L599-L603 HydrophobicContact CG-CD1 4.41Å; L599-L603 WeakPolarHBondContact O-CB 3.3Å; L599-L603 PolarHBondContact O-N 2.91Å; L599-K611 HydrophobicContact CB-CB 4.31Å; L599-K611 HydrophobicContact CB-CG 4.08Å; L599-K611 WeakPolarHBondContact O-CE 3.37Å; L599-V614 HydrophobicContact CD1-CB 3.97Å; L599-V614 HydrophobicContact CD1-CG1 3.71Å; L599-V614 HydrophobicContact CD2-CG1 4.32Å; L599-S615 WeakPolarHBondContact CD1-OG 3.46Å
600	S	89	Confident	85.4	Confident	60 Å²	60	52.8 Å²	52.8	42%	0.42	28%	0.283	S	S	.	.	H	α-helix	trans	-61.4	-39.4	176.1	-165.6	0	0	0	0	112.7	V596 L597 V598 K611	V596-S600 WeakPolarHBondContact O-CA 3.25Å; V596-S600 WeakPolarHBondContact O-CB 3.4Å; V596-S600 PolarHBondContact O-N 3.25Å; L597-S600 VanDerWaalsContact O-CB 3.31Å; L597-S600 WeakPolarHBondContact O-CB 3.49Å; L597-S600 PolarHBondContact O-N 3.3Å; L597-S600 VanDerWaalsContact O-N 3.14Å; V598-S600 PolarHBondContact O-N 3.24Å; S600-K611 VanDerWaalsContact CA-NZ 3.3Å; S600-K611 PolarHBondContact O-NZ 2.98Å
601	L	88.1	Confident	85.1	Confident	143 Å²	143	50.6 Å²	50.6	75%	0.749	27%	0.272	S	S	*	.	H	α-helix	trans	-76.1	-35.4	179.4	-64.2	171.7	0	0	0	112.8	L597 V598 L599	L597-L601 WeakPolarHBondContact O-CG 3.43Å; L597-L601 PolarHBondContact O-N 3.28Å; V598-L601 PolarHBondContact O-N 3.41Å; L599-L601 VanDerWaalsContact C-N 3.29Å; L599-L601 PolarHBondContact O-N 3.23Å
602	I	86.6	Confident	84.8	Confident	36 Å²	36	55.9 Å²	55.9	19%	0.185	29%	0.292	C	S	.	.	H	α-helix	trans	-89.5	-41.5	-173.1	-56.7	169.9	0	0	0	112.2	I351 Q354 Y358 V598 L599	I351-I602 HydrophobicContact CB-CG2 4.17Å; I351-I602 HydrophobicContact CG1-CG2 3.79Å; I351-I602 HydrophobicContact CG2-CG2 4.13Å; Q354-I602 HydrophobicContact CB-CD1 4.09Å; Y358-I602 HydrophobicContact CD2-CD1 4.17Å; V598-I602 HydrophobicContact CG1-CD1 3.63Å; V598-I602 WeakPolarHBondContact O-CG1 3.43Å; V598-I602 PolarHBondContact O-N 2.57Å; V598-I602 VanDerWaalsContact O-N 3.15Å; L599-I602 PolarHBondContact O-N 2.87Å
603	L	83.3	Confident	84.4	Confident	6 Å²	6	53.8 Å²	53.8	3%	0.031	28%	0.283	C	S	.	.	S	Bend	trans	-85.9	141.4	-176.2	-85.1	77.9	0	0	0	112.5	I351 L599 I610 K611	I351-L603 HydrophobicContact CG2-CD1 3.88Å; L599-L603 HydrophobicContact CB-CD1 4.25Å; L599-L603 HydrophobicContact CD2-CD1 3.32Å; L599-L603 HydrophobicContact CG-CD1 4.41Å; L599-L603 WeakPolarHBondContact O-CB 3.3Å; L599-L603 PolarHBondContact O-N 2.91Å; L603-I610 HydrophobicContact CD2-CB 4.15Å; L603-I610 HydrophobicContact CD2-CG2 3.7Å; L603-K611 VanDerWaalsContact CB-CE 3.47Å; L603-K611 HydrophobicContact CB-CG 4.39Å; L603-K611 HydrophobicContact CD2-CG 4.38Å; L603-K611 WeakPolarHBondContact O-CE 3.38Å; L603-K611 PolarHBondContact O-NZ 3.37Å
604	P	77.1	Confident	84.2	Confident	75 Å²	75	49.9 Å²	49.9	49%	0.487	26%	0.26	S	S	.	.			trans	-60.7	149.8	176.3	23.5	-31.2	0	0	0	112.3	S606 S607	P604-S606 PolarHBondContact O-N 2.79Å; P604-S607 PolarHBondContact O-N 2.98Å; P604-S607 VanDerWaalsContact O-N 3.14Å
605	K	69.2	Low	84	Confident	186 Å²	186	49.7 Å²	49.7	81%	0.809	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-19	-175.2	-69.6	-174.8	178.9	179.1	0	114.4	S607 Q608	K605-S607 VanDerWaalsContact C-N 3.26Å; K605-S607 PolarHBondContact O-N 2.72Å; K605-Q608 WeakPolarHBondContact O-CG 3.39Å; K605-Q608 PolarHBondContact O-NE2 3.16Å
606	S	60.9	Low	83.9	Confident	119 Å²	119	49.6 Å²	49.6	83%	0.832	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-18	178.7	-165	0	0	0	0	113.9	P604	P604-S606 PolarHBondContact O-N 2.79Å
607	S	69.4	Low	83.7	Confident	8 Å²	8	48.2 Å²	48.2	6%	0.056	25%	0.249	C	C	.	.			trans	-116.4	54.1	-171	-162.4	0	0	0	0	112.6	P604 K605 I610	P604-S607 PolarHBondContact O-N 2.98Å; P604-S607 VanDerWaalsContact O-N 3.14Å; K605-S607 VanDerWaalsContact C-N 3.26Å; K605-S607 PolarHBondContact O-N 2.72Å; S607-I610 WeakPolarHBondContact OG-CB 3.41Å; S607-I610 WeakPolarHBondContact OG-CD1 3.5Å; S607-I610 WeakPolarHBondContact OG-CG1 3.37Å
608	Q	74.1	Confident	83.6	Confident	91 Å²	91	44.2 Å²	44.2	43%	0.425	23%	0.229	S	C	.	.	H	α-helix	trans	-67	-36	-176.6	-68.1	-67	-17.2	0	0	112.9	K605 I610 K611	K605-Q608 WeakPolarHBondContact O-CG 3.39Å; K605-Q608 PolarHBondContact O-NE2 3.16Å; Q608-I610 VanDerWaalsContact C-N 3.33Å; Q608-I610 PolarHBondContact O-N 2.87Å; Q608-K611 PolarHBondContact O-N 3.26Å
609	Y	80.3	Confident	83.6	Confident	78 Å²	78	44 Å²	44	31%	0.306	23%	0.227	S	C	.	.	H	α-helix	trans	-67.5	-34.5	-178.1	74	-87.4	0	0	0	112.3	K611 W612 I613	Y609-K611 VanDerWaalsContact C-N 3.33Å; Y609-K611 PolarHBondContact O-N 2.98Å; Y609-W612 PolarHBondContact O-N 3.42Å; Y609-I613 HydrophobicContact CD2-CD1 4.01Å; Y609-I613 WeakPolarHBondContact O-CG1 3.46Å; Y609-I613 PolarHBondContact O-N 3.32Å
610	I	82.8	Confident	83.7	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.1	-41.9	177.3	-62.5	-166	0	0	0	110.5	I412 L603 S607 Q608 W612 I613 V614	I412-I610 WeakPolarHBondContact O-CD1 3.49Å; L603-I610 HydrophobicContact CD2-CB 4.15Å; L603-I610 HydrophobicContact CD2-CG2 3.7Å; S607-I610 WeakPolarHBondContact OG-CB 3.41Å; S607-I610 WeakPolarHBondContact OG-CD1 3.5Å; S607-I610 WeakPolarHBondContact OG-CG1 3.37Å; Q608-I610 VanDerWaalsContact C-N 3.33Å; Q608-I610 PolarHBondContact O-N 2.87Å; I610-W612 VanDerWaalsContact C-N 3.3Å; I610-W612 PolarHBondContact O-N 3.29Å; I610-I613 PolarHBondContact O-N 3.17Å; I610-V614 HydrophobicContact CG2-CG2 3.59Å; I610-V614 VanDerWaalsContact O-CB 3.25Å; I610-V614 WeakPolarHBondContact O-CB 3.33Å; I610-V614 WeakPolarHBondContact O-CG2 3.49Å; I610-V614 PolarHBondContact O-N 2.91Å
611	K	87.6	Confident	83.9	Confident	4 Å²	4	41.1 Å²	41.1	2%	0.017	21%	0.207	C	C	.	.	H	α-helix	trans	-55	-46.5	179.3	-63.4	-179	178.6	179.2	0	111.5	L599 S600 L603 Q608 Y609 S615	L599-K611 HydrophobicContact CB-CB 4.31Å; L599-K611 HydrophobicContact CB-CG 4.08Å; L599-K611 WeakPolarHBondContact O-CE 3.37Å; S600-K611 VanDerWaalsContact CA-NZ 3.3Å; S600-K611 PolarHBondContact O-NZ 2.98Å; L603-K611 VanDerWaalsContact CB-CE 3.47Å; L603-K611 HydrophobicContact CB-CG 4.39Å; L603-K611 HydrophobicContact CD2-CG 4.38Å; L603-K611 WeakPolarHBondContact O-CE 3.38Å; L603-K611 PolarHBondContact O-NZ 3.37Å; Q608-K611 PolarHBondContact O-N 3.26Å; Y609-K611 VanDerWaalsContact C-N 3.33Å; Y609-K611 PolarHBondContact O-N 2.98Å; K611-S615 WeakPolarHBondContact O-CB 3.49Å; K611-S615 PolarHBondContact O-N 3.47Å; K611-S615 PolarHBondContact O-OG 3.36Å
612	W	88.3	Confident	83.9	Confident	112 Å²	112	34.3 Å²	34.3	42%	0.424	17%	0.172	S	C	.	.	H	α-helix	trans	-69.2	-44.4	-179	-66.9	106.5	0	0	0	113.2	F592 V596 Y609 I610 S615 A616 C668	F592-W612 HydrophobicContact CE1-CE3 4.01Å; F592-W612 AromaticContact CE1-CZ3 3.7Å; F592-W612 HydrophobicContact CE1-CZ3 3.7Å; F592-W612 HydrophobicContact CE2-CE3 4.46Å; F592-W612 AromaticContact CZ-CE3 3.53Å; F592-W612 HydrophobicContact CZ-CE3 3.53Å; F592-W612 AromaticContact CZ-CZ3 3.73Å; F592-W612 HydrophobicContact CZ-CZ3 3.73Å; V596-W612 HydrophobicContact CG1-CH2 4.47Å; V596-W612 HydrophobicContact CG2-CE3 3.89Å; V596-W612 HydrophobicContact CG2-CZ3 3.94Å; Y609-W612 PolarHBondContact O-N 3.42Å; I610-W612 VanDerWaalsContact C-N 3.3Å; I610-W612 PolarHBondContact O-N 3.29Å; W612-S615 PolarHBondContact O-N 3.28Å; W612-A616 WeakPolarHBondContact O-CB 3.34Å; W612-A616 PolarHBondContact O-N 2.83Å; W612-C668 HydrophobicContact CB-CB 4.36Å; W612-C668 VanDerWaalsContact CB-SG 3.58Å
613	I	86.9	Confident	83.6	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-66	-47.8	-179.5	-64.9	172.7	0	0	0	110.5	Y414 Y609 I610 S615 A616 G617 W661 C668 V669	Y414-I613 HydrophobicContact CD2-CG2 3.71Å; Y414-I613 HydrophobicContact CE2-CG2 4.14Å; Y414-I613 HydrophobicContact CG-CG2 4.33Å; Y609-I613 HydrophobicContact CD2-CD1 4.01Å; Y609-I613 WeakPolarHBondContact O-CG1 3.46Å; Y609-I613 PolarHBondContact O-N 3.32Å; I610-I613 PolarHBondContact O-N 3.17Å; I613-S615 VanDerWaalsContact C-N 3.34Å; I613-S615 PolarHBondContact O-N 3.01Å; I613-A616 PolarHBondContact O-N 3.21Å; I613-G617 PolarHBondContact O-N 2.75Å; I613-W661 HydrophobicContact CG2-CH2 3.68Å; I613-W661 HydrophobicContact CG2-CZ2 4.43Å; I613-W661 HydrophobicContact CG2-CZ3 3.84Å; I613-W661 WeakPolarHBondContact O-CZ3 3.43Å; I613-C668 HydrophobicContact CG1-CB 4.23Å; I613-V669 HydrophobicContact CD1-CG2 3.87Å
614	V	89	Confident	83.4	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-64.9	-40.4	179.6	177.1	0	0	0	0	110.6	V417 L418 M421 L599 I610 A616 G617 L618	V417-V614 HydrophobicContact CG1-CG1 4.26Å; V417-V614 HydrophobicContact CG1-CG2 4.31Å; L418-V614 HydrophobicContact CB-CG1 4.22Å; L418-V614 HydrophobicContact CB-CG2 4.29Å; L418-V614 HydrophobicContact CD1-CG1 4.11Å; M421-V614 HydrophobicContact CE-CG1 3.1Å; L599-V614 HydrophobicContact CD1-CB 3.97Å; L599-V614 HydrophobicContact CD1-CG1 3.71Å; L599-V614 HydrophobicContact CD2-CG1 4.32Å; I610-V614 HydrophobicContact CG2-CG2 3.59Å; I610-V614 VanDerWaalsContact O-CB 3.25Å; I610-V614 WeakPolarHBondContact O-CB 3.33Å; I610-V614 WeakPolarHBondContact O-CG2 3.49Å; I610-V614 PolarHBondContact O-N 2.91Å; V614-A616 VanDerWaalsContact C-N 3.34Å; V614-A616 PolarHBondContact O-N 3.41Å; V614-G617 PolarHBondContact O-N 3.37Å; V614-L618 HydrophobicContact CG1-CD1 4.14Å; V614-L618 WeakPolarHBondContact O-CG 3.35Å; V614-L618 PolarHBondContact O-N 2.98Å; V614-L618 VanDerWaalsContact O-N 3.08Å
615	S	91.5	Very high	83.8	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-62.9	-39.9	175.1	-61.4	0	0	0	0	112.6	A595 V596 L599 K611 W612 I613 G617 L618 A619	A595-S615 VanDerWaalsContact C-OG 3.29Å; A595-S615 WeakPolarHBondContact CB-OG 3.11Å; V596-S615 WeakPolarHBondContact CA-OG 3.11Å; V596-S615 VanDerWaalsContact CG2-OG 3.28Å; V596-S615 WeakPolarHBondContact CG2-OG 3.35Å; V596-S615 PolarHBondContact N-OG 3.49Å; V596-S615 VanDerWaalsContact N-OG 3.12Å; L599-S615 WeakPolarHBondContact CD1-OG 3.46Å; K611-S615 WeakPolarHBondContact O-CB 3.49Å; K611-S615 PolarHBondContact O-N 3.47Å; K611-S615 PolarHBondContact O-OG 3.36Å; W612-S615 PolarHBondContact O-N 3.28Å; I613-S615 VanDerWaalsContact C-N 3.34Å; I613-S615 PolarHBondContact O-N 3.01Å; S615-G617 VanDerWaalsContact C-N 3.29Å; S615-G617 PolarHBondContact O-N 3.39Å; S615-L618 PolarHBondContact O-N 3.39Å; S615-A619 WeakPolarHBondContact O-CB 3.49Å; S615-A619 PolarHBondContact O-N 3.38Å; S615-A619 VanDerWaalsContact O-N 3.1Å
616	A	90.4	Very high	84.3	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63.8	-35.9	175.8	0	0	0	0	0	112	F592 W612 I613 V614 L618 Q620 L660 A664	F592-A616 HydrophobicContact CE2-CB 4.07Å; W612-A616 WeakPolarHBondContact O-CB 3.34Å; W612-A616 PolarHBondContact O-N 2.83Å; I613-A616 PolarHBondContact O-N 3.21Å; V614-A616 VanDerWaalsContact C-N 3.34Å; V614-A616 PolarHBondContact O-N 3.41Å; A616-L618 VanDerWaalsContact C-N 3.35Å; A616-Q620 PolarHBondContact O-OE1 3.23Å; A616-L660 HydrophobicContact CB-CG 4.26Å; A616-A664 HydrophobicContact CB-CB 3.36Å
617	G	88.1	Confident	85.1	Confident	0 Å²	0	15.5 Å²	15.5	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-74.5	-17.3	174.9	0	0	0	0	0	115	V396 I613 V614 S615 Q620	V396-G617 VanDerWaalsContact CG2-O 3.24Å; V396-G617 WeakPolarHBondContact CG2-O 3.47Å; I613-G617 PolarHBondContact O-N 2.75Å; V614-G617 PolarHBondContact O-N 3.37Å; S615-G617 VanDerWaalsContact C-N 3.29Å; S615-G617 PolarHBondContact O-N 3.39Å; G617-Q620 VanDerWaalsContact O-CD 3.29Å; G617-Q620 PolarHBondContact O-NE2 3.44Å; G617-Q620 PolarHBondContact O-OE1 3.4Å; G617-Q620 VanDerWaalsContact O-OE1 3.14Å
618	L	91.1	Very high	85.7	Confident	3 Å²	3	15.3 Å²	15.3	2%	0.016	6%	0.064	C	C	.	.	H	α-helix	trans	-101	-7.6	177.4	-67.9	177	0	0	0	113.5	S391 L418 M421 L422 K591 V614 S615 A616 Q620	S391-L618 PolarHBondContact OG-O 2.98Å; S391-L618 VanDerWaalsContact OG-O 3.09Å; L418-L618 HydrophobicContact CD1-CD2 3.7Å; L418-L618 HydrophobicContact CD1-CG 3.71Å; M421-L618 HydrophobicContact CE-CD1 3.61Å; M421-L618 HydrophobicContact SD-CD1 4.06Å; L422-L618 HydrophobicContact CD2-CD2 3.8Å; L422-L618 HydrophobicContact CG-CD2 4.02Å; K591-L618 VanDerWaalsContact CE-O 3.26Å; K591-L618 WeakPolarHBondContact CE-O 3.43Å; K591-L618 PolarHBondContact NZ-O 3.42Å; V614-L618 HydrophobicContact CG1-CD1 4.14Å; V614-L618 WeakPolarHBondContact O-CG 3.35Å; V614-L618 PolarHBondContact O-N 2.98Å; V614-L618 VanDerWaalsContact O-N 3.08Å; S615-L618 PolarHBondContact O-N 3.39Å; A616-L618 VanDerWaalsContact C-N 3.35Å; L618-Q620 VanDerWaalsContact C-N 3.31Å; L618-Q620 PolarHBondContact O-N 3.47Å
619	A	92.6	Very high	86.2	Confident	0 Å²	0	11 Å²	11	0%	0	4%	0.044	C	C	.	.	S	Bend	trans	-72	-25.1	-172	0	0	0	0	0	113.2	V588 K591 F592 S615 L660	V588-A619 HydrophobicContact CG1-CB 4.14Å; K591-A619 WeakPolarHBondContact CD-O 3.08Å; F592-A619 HydrophobicContact CB-CB 3.9Å; F592-A619 HydrophobicContact CD2-CB 4.31Å; S615-A619 WeakPolarHBondContact O-CB 3.49Å; S615-A619 PolarHBondContact O-N 3.38Å; S615-A619 VanDerWaalsContact O-N 3.1Å; A619-L660 HydrophobicContact CB-CD2 3.51Å
620	Q	92	Very high	86.1	Confident	2 Å²	2	8.9 Å²	8.9	1%	0.009	4%	0.041	C	C	.	.	S	Bend	trans	-78.8	152.3	178.4	71.8	-79.3	0.6	0	0	112.9	S391 L395 K591 A616 G617 L618 S653 L654 A657	S391-Q620 WeakPolarHBondContact CA-O 3.48Å; S391-Q620 WeakPolarHBondContact CB-O 3.44Å; L395-Q620 HydrophobicContact CD2-CG 4.46Å; K591-Q620 PolarHBondContact NZ-O 3.26Å; A616-Q620 PolarHBondContact O-OE1 3.23Å; G617-Q620 VanDerWaalsContact O-CD 3.29Å; G617-Q620 PolarHBondContact O-NE2 3.44Å; G617-Q620 PolarHBondContact O-OE1 3.4Å; G617-Q620 VanDerWaalsContact O-OE1 3.14Å; L618-Q620 VanDerWaalsContact C-N 3.31Å; L618-Q620 PolarHBondContact O-N 3.47Å; Q620-S653 VanDerWaalsContact CA-OG 3.29Å; Q620-S653 WeakPolarHBondContact CA-OG 3.45Å; Q620-L654 HydrophobicContact CG-CD2 4.23Å; Q620-A657 HydrophobicContact CB-CB 3.68Å; Q620-A657 HydrophobicContact CG-CB 3.82Å
621	V	91.8	Very high	85.8	Confident	0 Å²	0	11 Å²	11	0%	0	5%	0.049	C	C	.	.	P	Polyproline II helix	trans	-81.1	146.6	174.9	-174.7	0	0	0	0	110.2	L388 L390 V587 K591 S625 T650 S653 L654	L388-V621 HydrophobicContact CD2-CG1 4.31Å; L388-V621 HydrophobicContact CD2-CG2 4.17Å; L390-V621 CarbonylContact O-C 3.55Å; L390-V621 WeakPolarHBondContact O-CA 3.41Å; V587-V621 HydrophobicContact CG1-CG2 3.82Å; K591-V621 HydrophobicContact CD-CG2 4.49Å; V621-S625 WeakPolarHBondContact CG1-OG 3.45Å; V621-T650 HydrophobicContact CB-CG2 4.11Å; V621-T650 HydrophobicContact CG1-CG2 3.85Å; V621-T650 WeakPolarHBondContact CG1-OG1 3.38Å; V621-S653 PolarHBondContact N-OG 3.35Å; V621-L654 WeakPolarHBondContact O-CD2 3.41Å; V621-L654 WeakPolarHBondContact O-CG 3.43Å
622	S	88.2	Confident	85.6	Confident	0 Å²	0	10.8 Å²	10.8	0%	0	5%	0.048	C	C	.	.	P	Polyproline II helix	trans	-78.2	151.7	-178.4	-163	0	0	0	0	113.7	L390 S391 F624 S625 T650	L390-S622 PolarHBondContact O-N 3.11Å; S391-S622 WeakPolarHBondContact O-CB 3.44Å; S391-S622 PolarHBondContact O-OG 3.27Å; S622-F624 PolarHBondContact O-N 3.02Å; S622-F624 VanDerWaalsContact OG-CD2 3.29Å; S622-F624 WeakPolarHBondContact OG-CD2 3.15Å; S622-F624 PolarHBondContact OG-N 3.43Å; S622-S625 VanDerWaalsContact O-CB 3.3Å; S622-S625 WeakPolarHBondContact O-CB 3.46Å; S622-S625 PolarHBondContact O-N 3.5Å; S622-S625 VanDerWaalsContact O-N 3.14Å; S622-S625 PolarHBondContact O-OG 2.99Å; S622-T650 WeakPolarHBondContact O-CG2 3.22Å
623	E	81.2	Confident	85.3	Confident	10 Å²	10	9.4 Å²	9.4	5%	0.047	4%	0.043	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-24.6	164.8	57.6	-101.6	-138.9	0	0	113.7	M297 S392 P394 F561 S625 F626	M297-E623 HydrophobicContact CE-CB 3.77Å; M297-E623 HydrophobicContact CE-CG 4.42Å; S392-E623 VanDerWaalsContact CB-OE2 3.28Å; S392-E623 WeakPolarHBondContact CB-OE2 3.48Å; S392-E623 PolarHBondContact OG-OE2 2.63Å; P394-E623 WeakPolarHBondContact CD-OE1 3.49Å; P394-E623 WeakPolarHBondContact CG-OE1 3.22Å; F561-E623 HydrophobicContact CE1-CB 3.86Å; F561-E623 HydrophobicContact CE1-CG 4.34Å; F561-E623 HydrophobicContact CZ-CB 4.17Å; F561-E623 HydrophobicContact CZ-CG 4.15Å; E623-S625 PolarHBondContact O-N 2.73Å; E623-S625 VanDerWaalsContact O-N 3.14Å; E623-F626 HydrophobicContact CB-CD2 3.93Å; E623-F626 HydrophobicContact CB-CE2 3.97Å; E623-F626 WeakPolarHBondContact O-CB 3.36Å; E623-F626 WeakPolarHBondContact O-CD2 3.47Å; E623-F626 VanDerWaalsContact O-CG 3.25Å; E623-F626 WeakPolarHBondContact O-CG 3.34Å; E623-F626 PolarHBondContact O-N 3.34Å
624	F	80.1	Confident	84.9	Confident	7 Å²	7	17.3 Å²	17.3	3%	0.031	7%	0.073	C	C	.	.	H	α-helix	trans	-64.4	-18.9	177.9	-69.9	-61.1	0	0	0	112.9	T332 L333 V336 L390 D426 L429 S622 F626 V627 L628	T332-F624 HydrophobicContact CG2-CE1 4.19Å; T332-F624 HydrophobicContact CG2-CZ 4.01Å; L333-F624 HydrophobicContact CD2-CD1 4.35Å; L333-F624 HydrophobicContact CD2-CE1 3.67Å; L333-F624 HydrophobicContact CD2-CZ 3.97Å; L333-F624 HydrophobicContact CG-CE1 4.24Å; V336-F624 HydrophobicContact CG2-CZ 4.46Å; L390-F624 HydrophobicContact CD1-CB 4.41Å; D426-F624 WeakPolarHBondContact OD1-CE2 3.46Å; L429-F624 HydrophobicContact CD2-CB 3.37Å; L429-F624 HydrophobicContact CD2-CD1 3.74Å; L429-F624 HydrophobicContact CD2-CD2 3.82Å; L429-F624 HydrophobicContact CD2-CE1 4.48Å; L429-F624 HydrophobicContact CD2-CG 3.37Å; S622-F624 PolarHBondContact O-N 3.02Å; S622-F624 VanDerWaalsContact OG-CD2 3.29Å; S622-F624 WeakPolarHBondContact OG-CD2 3.15Å; S622-F624 PolarHBondContact OG-N 3.43Å; F624-F626 PolarHBondContact O-N 3.11Å; F624-V627 HydrophobicContact CD1-CG2 4.33Å; F624-V627 WeakPolarHBondContact O-CB 3.45Å; F624-V627 PolarHBondContact O-N 2.98Å; F624-V627 VanDerWaalsContact O-N 3.14Å; F624-L628 PolarHBondContact O-N 3.21Å
625	S	85.6	Confident	84.3	Confident	0 Å²	0	19 Å²	19	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-62.5	-24.6	171	-48.3	0	0	0	0	112	C387 V621 S622 E623 G629	C387-S625 PolarHBondContact O-OG 3.43Å; V621-S625 WeakPolarHBondContact CG1-OG 3.45Å; S622-S625 VanDerWaalsContact O-CB 3.3Å; S622-S625 WeakPolarHBondContact O-CB 3.46Å; S622-S625 PolarHBondContact O-N 3.5Å; S622-S625 VanDerWaalsContact O-N 3.14Å; S622-S625 PolarHBondContact O-OG 2.99Å; E623-S625 PolarHBondContact O-N 2.73Å; E623-S625 VanDerWaalsContact O-N 3.14Å; S625-G629 PolarHBondContact O-N 2.85Å
626	F	79.6	Confident	83.8	Confident	2 Å²	2	21.9 Å²	21.9	1%	0.009	12%	0.116	C	C	.	.	H	α-helix	trans	-68.6	-47.8	171.2	-52.9	-40.9	0	0	0	111.6	I301 F561 I564 E623 F624 G629 S630 L647 T650 L654	I301-F626 HydrophobicContact CD1-CE2 4.1Å; I301-F626 HydrophobicContact CD1-CZ 4.39Å; F561-F626 HydrophobicContact CE1-CD2 4.46Å; I564-F626 HydrophobicContact CD1-CB 3.52Å; I564-F626 HydrophobicContact CD1-CD2 3.71Å; I564-F626 HydrophobicContact CD1-CG 3.9Å; I564-F626 HydrophobicContact CG1-CB 4.14Å; I564-F626 HydrophobicContact CG2-CB 4.36Å; I564-F626 HydrophobicContact CG2-CD1 4.45Å; I564-F626 HydrophobicContact CG2-CD2 4.46Å; I564-F626 HydrophobicContact CG2-CG 4.2Å; E623-F626 HydrophobicContact CB-CD2 3.93Å; E623-F626 HydrophobicContact CB-CE2 3.97Å; E623-F626 WeakPolarHBondContact O-CB 3.36Å; E623-F626 WeakPolarHBondContact O-CD2 3.47Å; E623-F626 VanDerWaalsContact O-CG 3.25Å; E623-F626 WeakPolarHBondContact O-CG 3.34Å; E623-F626 PolarHBondContact O-N 3.34Å; F624-F626 PolarHBondContact O-N 3.11Å; F626-G629 PolarHBondContact O-N 3.17Å; F626-S630 WeakPolarHBondContact O-CB 3.35Å; F626-S630 PolarHBondContact O-N 3.37Å; F626-L647 HydrophobicContact CD1-CD1 3.32Å; F626-L647 HydrophobicContact CE1-CD1 3.33Å; F626-L647 HydrophobicContact CE1-CG 4.47Å; F626-L647 HydrophobicContact CG-CD1 4.18Å; F626-L647 HydrophobicContact CZ-CD1 4.18Å; F626-T650 HydrophobicContact CD1-CG2 4.2Å; F626-T650 HydrophobicContact CE1-CG2 3.48Å; F626-T650 VanDerWaalsContact CE1-CG2 3.48Å; F626-T650 HydrophobicContact CE2-CG2 4.32Å; F626-T650 HydrophobicContact CZ-CG2 3.56Å; F626-L654 HydrophobicContact CZ-CD1 4.45Å
627	V	76.8	Confident	83.4	Confident	8 Å²	8	23 Å²	23	5%	0.048	12%	0.122	C	C	.	.	H	α-helix	trans	-57.8	-52.2	177.5	-178.9	0	0	0	0	109.8	V329 F560 F624 S630 R631	V329-V627 HydrophobicContact CG1-CG1 3.86Å; V329-V627 HydrophobicContact CG1-CG2 3.9Å; V329-V627 HydrophobicContact CG2-CG1 4.44Å; V329-V627 HydrophobicContact CG2-CG2 3.75Å; F560-V627 HydrophobicContact CE1-CG2 4.14Å; F560-V627 HydrophobicContact CE2-CG2 3.95Å; F560-V627 HydrophobicContact CZ-CG2 3.31Å; F624-V627 HydrophobicContact CD1-CG2 4.33Å; F624-V627 WeakPolarHBondContact O-CB 3.45Å; F624-V627 PolarHBondContact O-N 2.98Å; F624-V627 VanDerWaalsContact O-N 3.14Å; V627-S630 PolarHBondContact O-N 2.76Å; V627-R631 WeakPolarHBondContact O-CG 3.34Å; V627-R631 PolarHBondContact O-N 3.32Å; V627-R631 VanDerWaalsContact O-N 3.08Å
628	L	81.6	Confident	83.3	Confident	3 Å²	3	23.4 Å²	23.4	2%	0.016	12%	0.124	C	C	.	.	H	α-helix	trans	-61.7	-49.1	179.9	-98.3	62.6	0	0	0	111.2	F383 L390 L429 F432 I433 F624 S630 R631 A632	F383-L628 HydrophobicContact CE2-CB 4.45Å; F383-L628 HydrophobicContact CZ-CB 3.92Å; F383-L628 VanDerWaalsContact CZ-O 3.3Å; F383-L628 WeakPolarHBondContact CZ-O 3.46Å; L390-L628 HydrophobicContact CD1-CD2 3.99Å; L429-L628 HydrophobicContact CD1-CD1 3.26Å; L429-L628 HydrophobicContact CD1-CD2 3.49Å; L429-L628 VanDerWaalsContact CD1-CD2 3.49Å; L429-L628 HydrophobicContact CD1-CG 3.97Å; L429-L628 HydrophobicContact CG-CD1 4.15Å; F432-L628 HydrophobicContact CD1-CD2 3.69Å; F432-L628 HydrophobicContact CE1-CD2 3.85Å; I433-L628 HydrophobicContact CD1-CD1 3.64Å; I433-L628 HydrophobicContact CG1-CD1 3.63Å; I433-L628 HydrophobicContact CG1-CG 4.27Å; F624-L628 PolarHBondContact O-N 3.21Å; L628-S630 VanDerWaalsContact C-N 3.28Å; L628-S630 PolarHBondContact O-N 2.96Å; L628-R631 PolarHBondContact O-N 3.27Å; L628-R631 VanDerWaalsContact O-N 3.14Å; L628-A632 PolarHBondContact O-N 2.98Å
629	G	84.1	Confident	83.2	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-55.6	-44	179.1	0	0	0	0	0	112	S625 F626 R631 A632 R633 I638 Y643	S625-G629 PolarHBondContact O-N 2.85Å; F626-G629 PolarHBondContact O-N 3.17Å; G629-R631 PolarHBondContact O-N 3.34Å; G629-A632 PolarHBondContact O-N 2.59Å; G629-R633 WeakPolarHBondContact O-CB 3.49Å; G629-R633 PolarHBondContact O-N 3.31Å; G629-I638 WeakPolarHBondContact O-CD1 3.3Å; G629-Y643 VanDerWaalsContact C-CD2 3.41Å; G629-Y643 VanDerWaalsContact C-CE2 3.48Å
630	S	78.5	Confident	82.8	Confident	34 Å²	34	31.3 Å²	31.3	24%	0.238	16%	0.162	C	C	.	.	H	α-helix	trans	-61.3	-46	177.5	179.9	0	0	0	0	111.5	F626 V627 L628 R633 R634 Y643	F626-S630 WeakPolarHBondContact O-CB 3.35Å; F626-S630 PolarHBondContact O-N 3.37Å; V627-S630 PolarHBondContact O-N 2.76Å; L628-S630 VanDerWaalsContact C-N 3.28Å; L628-S630 PolarHBondContact O-N 2.96Å; S630-R633 PolarHBondContact O-N 3.26Å; S630-R634 WeakPolarHBondContact O-CG 3.18Å; S630-R634 PolarHBondContact O-N 3.03Å; S630-Y643 VanDerWaalsContact N-CE2 3.33Å
631	R	77.9	Confident	82.5	Confident	44 Å²	44	36.4 Å²	36.4	17%	0.166	19%	0.186	C	C	.	.	H	α-helix	trans	-66.1	-41.5	179	-70.2	-62.7	-173.9	76.7	0.7	113	E326 M436 E524 V627 L628 G629 R633 R634 A635	E326-R631 IonicContact OE1-CZ 3.75Å; E326-R631 IonicContact OE1-NE 3.63Å; E326-R631 PolarHBondContact OE1-NE 2.9Å; E326-R631 VanDerWaalsContact OE1-NE 3.1Å; E326-R631 IonicContact OE1-NH2 3.5Å; E326-R631 PolarHBondContact OE1-NH2 2.71Å; E326-R631 IonicContact OE2-NH2 3.47Å; M436-R631 HydrophobicContact CE-CB 4.14Å; E524-R631 VanDerWaalsContact CD-NH1 3.32Å; E524-R631 IonicContact OE1-CZ 3.76Å; E524-R631 IonicContact OE1-NH1 2.83Å; E524-R631 PolarHBondContact OE1-NH1 3.13Å; E524-R631 IonicContact OE1-NH2 2.67Å; E524-R631 PolarHBondContact OE1-NH2 2.86Å; E524-R631 IonicContact OE2-NH1 2.98Å; E524-R631 PolarHBondContact OE2-NH1 3.37Å; V627-R631 WeakPolarHBondContact O-CG 3.34Å; V627-R631 PolarHBondContact O-N 3.32Å; V627-R631 VanDerWaalsContact O-N 3.08Å; L628-R631 PolarHBondContact O-N 3.27Å; L628-R631 VanDerWaalsContact O-N 3.14Å; G629-R631 PolarHBondContact O-N 3.34Å; R631-R633 VanDerWaalsContact C-N 3.31Å; R631-R633 PolarHBondContact O-N 2.89Å; R631-R634 PolarHBondContact O-N 3.16Å; R631-A635 VanDerWaalsContact O-CB 3.25Å; R631-A635 WeakPolarHBondContact O-CB 3.42Å; R631-A635 PolarHBondContact O-N 3.35Å
632	A	81.8	Confident	82.3	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66	-33.7	174.6	0	0	0	0	0	113.3	F383 L628 G629 A635 G636 I637 I638	F383-A632 HydrophobicContact CD1-CB 3.82Å; F383-A632 HydrophobicContact CD2-CB 4.09Å; F383-A632 HydrophobicContact CE1-CB 3.19Å; F383-A632 HydrophobicContact CE2-CB 3.52Å; F383-A632 HydrophobicContact CG-CB 4.24Å; F383-A632 HydrophobicContact CZ-CB 3.05Å; L628-A632 PolarHBondContact O-N 2.98Å; G629-A632 PolarHBondContact O-N 2.59Å; A632-A635 CarbonylContact O-C 3.52Å; A632-A635 PolarHBondContact O-N 2.96Å; A632-G636 PolarHBondContact O-N 2.86Å; A632-G636 VanDerWaalsContact O-N 3.11Å; A632-I637 HydrophobicContact CB-CB 4.05Å; A632-I637 HydrophobicContact CB-CD1 4.15Å; A632-I637 PolarHBondContact O-N 3.32Å; A632-I638 HydrophobicContact CB-CD1 4.06Å; A632-I638 HydrophobicContact CB-CG1 3.96Å; A632-I638 HydrophobicContact CB-CG2 4.29Å; A632-I638 PolarHBondContact O-N 2.76Å
633	R	83.6	Confident	82.3	Confident	84 Å²	84	38 Å²	38	32%	0.317	19%	0.194	S	C	.	.	H	α-helix	trans	-66	-47.6	173.1	-179.9	-174.7	167.2	-155	-3.9	110.7	H567 G629 S630 R631 A635 G636 I638	H567-R633 PolarHBondContact CE1-NH1 2.92Å; H567-R633 PolarHBondContact ND1-NH1 3.01Å; G629-R633 WeakPolarHBondContact O-CB 3.49Å; G629-R633 PolarHBondContact O-N 3.31Å; S630-R633 PolarHBondContact O-N 3.26Å; R631-R633 VanDerWaalsContact C-N 3.31Å; R631-R633 PolarHBondContact O-N 2.89Å; R633-A635 PolarHBondContact O-N 3.5Å; R633-G636 PolarHBondContact O-N 3.39Å; R633-I638 HydrophobicContact CB-CG1 4.09Å
634	R	77.3	Confident	82.6	Confident	166 Å²	166	38.2 Å²	38.2	63%	0.626	20%	0.196	S	C	*	.	H	α-helix	trans	-58.8	-37.3	175.2	-73.6	179.3	63.8	-174.1	0.3	111.9	E326 S630 R631 G636	E326-R634 IonicContact OE1-NH1 3.29Å; E326-R634 PolarHBondContact OE1-NH1 3.37Å; E326-R634 IonicContact OE2-NH1 2.62Å; S630-R634 WeakPolarHBondContact O-CG 3.18Å; S630-R634 PolarHBondContact O-N 3.03Å; R631-R634 PolarHBondContact O-N 3.16Å; R634-G636 VanDerWaalsContact C-N 3.27Å; R634-G636 PolarHBondContact O-N 2.85Å
635	A	76.8	Confident	83	Confident	36 Å²	36	40.3 Å²	40.3	30%	0.298	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-5	175.9	0	0	0	0	0	114.9	M436 I440 R631 A632 R633 I637	M436-A635 HydrophobicContact CE-CB 4.13Å; I440-A635 HydrophobicContact CD1-CB 3.46Å; I440-A635 VanDerWaalsContact CD1-CB 3.46Å; I440-A635 HydrophobicContact CG1-CB 4.33Å; R631-A635 VanDerWaalsContact O-CB 3.25Å; R631-A635 WeakPolarHBondContact O-CB 3.42Å; R631-A635 PolarHBondContact O-N 3.35Å; A632-A635 CarbonylContact O-C 3.52Å; A632-A635 PolarHBondContact O-N 2.96Å; R633-A635 PolarHBondContact O-N 3.5Å; A635-I637 VanDerWaalsContact C-N 3.27Å; A635-I637 HydrophobicContact CB-CD1 4.25Å; A635-I637 HydrophobicContact CB-CG1 4.05Å; A635-I637 PolarHBondContact O-N 2.84Å
636	G	80.3	Confident	83.2	Confident	60 Å²	60	40.7 Å²	40.7	62%	0.619	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.9	15	-178.1	0	0	0	0	0	115.3	A632 R633 R634	A632-G636 PolarHBondContact O-N 2.86Å; A632-G636 VanDerWaalsContact O-N 3.11Å; R633-G636 PolarHBondContact O-N 3.39Å; R634-G636 VanDerWaalsContact C-N 3.27Å; R634-G636 PolarHBondContact O-N 2.85Å
637	I	82.4	Confident	83.5	Confident	25 Å²	25	40.7 Å²	40.7	13%	0.128	21%	0.21	C	C	.	.	S	Bend	trans	-72	-40.9	176.4	-57.4	175.2	0	0	0	110.6	F383 M436 I440 A632 A635	F383-I637 HydrophobicContact CB-CG2 4.15Å; F383-I637 HydrophobicContact CD2-CD1 4.41Å; F383-I637 HydrophobicContact CG-CG2 4.19Å; M436-I637 HydrophobicContact CE-CD1 4.46Å; M436-I637 HydrophobicContact CG-CD1 3.85Å; M436-I637 HydrophobicContact SD-CD1 4.09Å; I440-I637 HydrophobicContact CD1-CD1 3.94Å; I440-I637 HydrophobicContact CD1-CG1 4.24Å; I440-I637 HydrophobicContact CG1-CD1 3.49Å; I440-I637 VanDerWaalsContact CG1-CD1 3.49Å; I440-I637 HydrophobicContact CG1-CG1 3.63Å; A632-I637 HydrophobicContact CB-CB 4.05Å; A632-I637 HydrophobicContact CB-CD1 4.15Å; A632-I637 PolarHBondContact O-N 3.32Å; A635-I637 VanDerWaalsContact C-N 3.27Å; A635-I637 HydrophobicContact CB-CD1 4.25Å; A635-I637 HydrophobicContact CB-CG1 4.05Å; A635-I637 PolarHBondContact O-N 2.84Å
638	I	86.9	Confident	84	Confident	8 Å²	8	40.7 Å²	40.7	4%	0.041	21%	0.21	C	C	.	.	S	Bend	trans	-120.4	144.8	-177.9	67.7	175.5	0	0	0	110.5	Q380 F383 G629 A632 R633 V642 Y643 I646	Q380-I638 HydrophobicContact CG-CG2 4.2Å; F383-I638 HydrophobicContact CD1-CG2 3.73Å; F383-I638 HydrophobicContact CE1-CD1 4.25Å; F383-I638 HydrophobicContact CE1-CG2 4.15Å; G629-I638 WeakPolarHBondContact O-CD1 3.3Å; A632-I638 HydrophobicContact CB-CD1 4.06Å; A632-I638 HydrophobicContact CB-CG1 3.96Å; A632-I638 HydrophobicContact CB-CG2 4.29Å; A632-I638 PolarHBondContact O-N 2.76Å; R633-I638 HydrophobicContact CB-CG1 4.09Å; I638-V642 HydrophobicContact CB-CB 4.33Å; I638-V642 HydrophobicContact CB-CG1 4.07Å; I638-V642 HydrophobicContact CG2-CG1 4.26Å; I638-Y643 HydrophobicContact CD1-CD2 4.36Å; I638-I646 HydrophobicContact CD1-CD1 4.08Å
639	S	87.6	Confident	84.4	Confident	52 Å²	52	40.7 Å²	40.7	36%	0.364	21%	0.21	S	C	.	.			trans	-73.6	166.1	172.7	80.8	0	0	0	0	111.2	E641 V642 Y643	S639-E641 VanDerWaalsContact C-N 3.27Å; S639-E641 WeakPolarHBondContact CB-OE2 3.27Å; S639-E641 PolarHBondContact O-N 2.81Å; S639-E641 PolarHBondContact OG-OE2 3.5Å; S639-V642 PolarHBondContact O-N 3.41Å; S639-V642 PolarHBondContact OG-N 3.21Å; S639-Y643 PolarHBondContact O-N 3.42Å
640	R	84.4	Confident	84.6	Confident	116 Å²	116	40.7 Å²	40.7	44%	0.438	21%	0.21	S	C	.	.	H	α-helix	trans	-61.1	-38.5	178.4	-179.5	-178.9	173.6	-163.1	-2.4	111.7	Y643 L644	R640-Y643 WeakPolarHBondContact O-CB 3.45Å; R640-Y643 PolarHBondContact O-N 3.02Å; R640-L644 HydrophobicContact CG-CD1 4.37Å; R640-L644 WeakPolarHBondContact O-CG 3.16Å; R640-L644 PolarHBondContact O-N 3.16Å
641	E	86	Confident	84.9	Confident	110 Å²	110	40.7 Å²	40.7	51%	0.514	21%	0.209	S	C	.	.	H	α-helix	trans	-64.2	-44	-179.2	-55.6	69.9	-147	0	0	110.3	S639 Y643 L644 L645	S639-E641 VanDerWaalsContact C-N 3.27Å; S639-E641 WeakPolarHBondContact CB-OE2 3.27Å; S639-E641 PolarHBondContact O-N 2.81Å; S639-E641 PolarHBondContact OG-OE2 3.5Å; E641-Y643 VanDerWaalsContact C-N 3.35Å; E641-L644 PolarHBondContact O-N 3.29Å; E641-L645 WeakPolarHBondContact O-CG 3.48Å; E641-L645 PolarHBondContact O-N 3.24Å
642	V	88.5	Confident	85.4	Confident	28 Å²	28	40.8 Å²	40.8	17%	0.17	21%	0.212	C	C	.	.	H	α-helix	trans	-65.7	-39.8	176.4	173.7	0	0	0	0	111.1	I384 I638 S639 L645 I646	I384-V642 HydrophobicContact CD1-CG1 3.71Å; I384-V642 HydrophobicContact CG1-CG1 4.12Å; I638-V642 HydrophobicContact CB-CB 4.33Å; I638-V642 HydrophobicContact CB-CG1 4.07Å; I638-V642 HydrophobicContact CG2-CG1 4.26Å; S639-V642 PolarHBondContact O-N 3.41Å; S639-V642 PolarHBondContact OG-N 3.21Å; V642-L645 PolarHBondContact O-N 3.4Å; V642-I646 HydrophobicContact CG1-CD1 4.05Å; V642-I646 HydrophobicContact CG1-CG1 4.45Å; V642-I646 VanDerWaalsContact O-CG1 3.31Å; V642-I646 WeakPolarHBondContact O-CG1 3.34Å; V642-I646 PolarHBondContact O-N 2.72Å
643	Y	87.6	Confident	85.8	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.016	21%	0.212	C	C	.	.	H	α-helix	trans	-58.9	-46.4	173.1	174.1	-112.7	0	0	0	112	H567 G629 S630 I638 S639 R640 E641 L645 I646 L647	H567-Y643 HydrophobicContact CB-CE1 4.01Å; G629-Y643 VanDerWaalsContact C-CD2 3.41Å; G629-Y643 VanDerWaalsContact C-CE2 3.48Å; S630-Y643 VanDerWaalsContact N-CE2 3.33Å; I638-Y643 HydrophobicContact CD1-CD2 4.36Å; S639-Y643 PolarHBondContact O-N 3.42Å; R640-Y643 WeakPolarHBondContact O-CB 3.45Å; R640-Y643 PolarHBondContact O-N 3.02Å; E641-Y643 VanDerWaalsContact C-N 3.35Å; Y643-L645 VanDerWaalsContact C-N 3.33Å; Y643-L645 PolarHBondContact O-N 2.94Å; Y643-I646 PolarHBondContact O-N 3.16Å; Y643-L647 HydrophobicContact CE1-CD2 4.33Å; Y643-L647 VanDerWaalsContact O-CB 3.27Å; Y643-L647 WeakPolarHBondContact O-CB 3.43Å; Y643-L647 PolarHBondContact O-N 3.36Å
644	L	86.7	Confident	85.9	Confident	16 Å²	16	36.9 Å²	36.9	8%	0.084	20%	0.198	C	C	.	.	H	α-helix	trans	-63	-37.5	176.8	-69.1	174.9	0	0	0	112.5	H567 F569 F572 R640 E641 L647 S648	H567-L644 WeakPolarHBondContact O-CD2 3.44Å; F569-L644 HydrophobicContact CD2-CD1 4.29Å; F569-L644 HydrophobicContact CD2-CD2 4.15Å; F572-L644 HydrophobicContact CD1-CB 4.28Å; F572-L644 HydrophobicContact CE1-CB 3.94Å; F572-L644 HydrophobicContact CZ-CB 4.44Å; R640-L644 HydrophobicContact CG-CD1 4.37Å; R640-L644 WeakPolarHBondContact O-CG 3.16Å; R640-L644 PolarHBondContact O-N 3.16Å; E641-L644 PolarHBondContact O-N 3.29Å; L644-L647 HydrophobicContact CD2-CD2 4.48Å; L644-S648 VanDerWaalsContact O-CB 3.26Å; L644-S648 WeakPolarHBondContact O-CB 2.97Å; L644-S648 PolarHBondContact O-N 3.08Å; L644-S648 PolarHBondContact O-OG 3.3Å
645	L	88.8	Confident	86.2	Confident	50 Å²	50	32.9 Å²	32.9	26%	0.262	19%	0.188	S	C	.	.	H	α-helix	trans	-63.9	-48.9	173.9	-73.8	170.5	0	0	0	111.5	F572 E641 V642 Y643 L647 S648 V649	F572-L645 HydrophobicContact CE1-CD2 4.3Å; F572-L645 HydrophobicContact CZ-CD2 3.96Å; F572-L645 HydrophobicContact CZ-CG 4.23Å; E641-L645 WeakPolarHBondContact O-CG 3.48Å; E641-L645 PolarHBondContact O-N 3.24Å; V642-L645 PolarHBondContact O-N 3.4Å; Y643-L645 VanDerWaalsContact C-N 3.33Å; Y643-L645 PolarHBondContact O-N 2.94Å; L645-L647 VanDerWaalsContact C-N 3.33Å; L645-L647 PolarHBondContact O-N 2.98Å; L645-S648 PolarHBondContact O-N 3.36Å; L645-V649 WeakPolarHBondContact O-CB 3.15Å; L645-V649 WeakPolarHBondContact O-CG2 3.39Å; L645-V649 PolarHBondContact O-N 2.85Å
646	I	89.8	Confident	86.7	Confident	9 Å²	9	34.4 Å²	34.4	5%	0.046	19%	0.191	C	C	.	.	H	α-helix	trans	-59.7	-45.9	178.2	-66	168.8	0	0	0	110.7	I384 I638 V642 Y643 V649 T650	I384-I646 HydrophobicContact CG1-CD1 4.15Å; I638-I646 HydrophobicContact CD1-CD1 4.08Å; V642-I646 HydrophobicContact CG1-CD1 4.05Å; V642-I646 HydrophobicContact CG1-CG1 4.45Å; V642-I646 VanDerWaalsContact O-CG1 3.31Å; V642-I646 WeakPolarHBondContact O-CG1 3.34Å; V642-I646 PolarHBondContact O-N 2.72Å; Y643-I646 PolarHBondContact O-N 3.16Å; I646-V649 PolarHBondContact O-N 2.85Å; I646-T650 VanDerWaalsContact O-CB 3.3Å; I646-T650 WeakPolarHBondContact O-CB 3.41Å; I646-T650 PolarHBondContact O-N 3.19Å; I646-T650 PolarHBondContact O-OG1 3.34Å
647	L	86.2	Confident	87	Confident	2 Å²	2	31.7 Å²	31.7	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-58.1	-49.5	178.1	175.7	56.5	0	0	0	111.3	I564 V568 F626 Y643 L644 L645 T650 T651	I564-L647 HydrophobicContact CG2-CD1 3.34Å; I564-L647 HydrophobicContact CG2-CD2 4.41Å; V568-L647 HydrophobicContact CG2-CD1 4.33Å; V568-L647 HydrophobicContact CG2-CD2 3.52Å; V568-L647 HydrophobicContact CG2-CG 3.99Å; F626-L647 HydrophobicContact CD1-CD1 3.32Å; F626-L647 HydrophobicContact CE1-CD1 3.33Å; F626-L647 HydrophobicContact CE1-CG 4.47Å; F626-L647 HydrophobicContact CG-CD1 4.18Å; F626-L647 HydrophobicContact CZ-CD1 4.18Å; Y643-L647 HydrophobicContact CE1-CD2 4.33Å; Y643-L647 VanDerWaalsContact O-CB 3.27Å; Y643-L647 WeakPolarHBondContact O-CB 3.43Å; Y643-L647 PolarHBondContact O-N 3.36Å; L644-L647 HydrophobicContact CD2-CD2 4.48Å; L645-L647 VanDerWaalsContact C-N 3.33Å; L645-L647 PolarHBondContact O-N 2.98Å; L647-T650 PolarHBondContact O-N 3.09Å; L647-T651 WeakPolarHBondContact O-CB 3.35Å; L647-T651 PolarHBondContact O-N 3.44Å; L647-T651 PolarHBondContact O-OG1 2.88Å
648	S	86.9	Confident	87	Confident	8 Å²	8	31.4 Å²	31.4	6%	0.056	16%	0.162	C	C	.	.	H	α-helix	trans	-66.7	-41.6	179.8	-55.3	0	0	0	0	112	L644 L645 T651 L652	L644-S648 VanDerWaalsContact O-CB 3.26Å; L644-S648 WeakPolarHBondContact O-CB 2.97Å; L644-S648 PolarHBondContact O-N 3.08Å; L644-S648 PolarHBondContact O-OG 3.3Å; L645-S648 PolarHBondContact O-N 3.36Å; S648-T651 PolarHBondContact O-N 3.07Å; S648-L652 PolarHBondContact O-N 3.07Å
649	V	90.9	Very high	86.9	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.012	18%	0.184	C	C	.	.	H	α-helix	trans	-63.4	-45.2	178.8	167.6	0	0	0	0	110.9	L388 L580 L583 T584 V587 L645 I646 T651 L652 S653	L388-V649 HydrophobicContact CD2-CG1 4.15Å; L580-V649 HydrophobicContact CD1-CB 4.45Å; L580-V649 HydrophobicContact CD1-CG2 3.65Å; L583-V649 HydrophobicContact CB-CG2 4.14Å; L583-V649 HydrophobicContact CD2-CG2 3.4Å; L583-V649 VanDerWaalsContact CD2-CG2 3.4Å; L583-V649 HydrophobicContact CG-CG2 3.62Å; T584-V649 HydrophobicContact CG2-CB 4.03Å; T584-V649 HydrophobicContact CG2-CG1 3.97Å; T584-V649 HydrophobicContact CG2-CG2 4.06Å; V587-V649 HydrophobicContact CG2-CG1 4.42Å; L645-V649 WeakPolarHBondContact O-CB 3.15Å; L645-V649 WeakPolarHBondContact O-CG2 3.39Å; L645-V649 PolarHBondContact O-N 2.85Å; I646-V649 PolarHBondContact O-N 2.85Å; V649-T651 VanDerWaalsContact C-N 3.34Å; V649-T651 PolarHBondContact O-N 3.07Å; V649-L652 PolarHBondContact O-N 2.89Å; V649-S653 WeakPolarHBondContact O-CB 3.49Å; V649-S653 PolarHBondContact O-N 3.21Å
650	T	88.8	Confident	86.8	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.6	-44.7	179.1	-57.3	0	0	0	0	110.7	V621 S622 F626 I646 L647 L652 S653 L654	V621-T650 HydrophobicContact CB-CG2 4.11Å; V621-T650 HydrophobicContact CG1-CG2 3.85Å; V621-T650 WeakPolarHBondContact CG1-OG1 3.38Å; S622-T650 WeakPolarHBondContact O-CG2 3.22Å; F626-T650 HydrophobicContact CD1-CG2 4.2Å; F626-T650 HydrophobicContact CE1-CG2 3.48Å; F626-T650 VanDerWaalsContact CE1-CG2 3.48Å; F626-T650 HydrophobicContact CE2-CG2 4.32Å; F626-T650 HydrophobicContact CZ-CG2 3.56Å; I646-T650 VanDerWaalsContact O-CB 3.3Å; I646-T650 WeakPolarHBondContact O-CB 3.41Å; I646-T650 PolarHBondContact O-N 3.19Å; I646-T650 PolarHBondContact O-OG1 3.34Å; L647-T650 PolarHBondContact O-N 3.09Å; T650-L652 PolarHBondContact O-N 3.46Å; T650-S653 WeakPolarHBondContact O-CB 3.47Å; T650-S653 PolarHBondContact O-N 2.94Å; T650-L654 HydrophobicContact CG2-CD1 4.17Å; T650-L654 VanDerWaalsContact O-CG 3.31Å; T650-L654 WeakPolarHBondContact O-CG 3.44Å; T650-L654 PolarHBondContact O-N 2.95Å
651	T	84	Confident	86.8	Confident	35 Å²	35	28.5 Å²	28.5	22%	0.215	16%	0.159	C	C	.	.	H	α-helix	trans	-61.4	-47.3	-179.7	-56.4	0	0	0	0	111.7	F298 L647 S648 V649 L654 L655	F298-T651 HydrophobicContact CD1-CG2 4.24Å; F298-T651 HydrophobicContact CE1-CG2 3.88Å; F298-T651 WeakPolarHBondContact CE1-O 3.32Å; L647-T651 WeakPolarHBondContact O-CB 3.35Å; L647-T651 PolarHBondContact O-N 3.44Å; L647-T651 PolarHBondContact O-OG1 2.88Å; S648-T651 PolarHBondContact O-N 3.07Å; V649-T651 VanDerWaalsContact C-N 3.34Å; V649-T651 PolarHBondContact O-N 3.07Å; T651-L654 PolarHBondContact O-N 3.25Å; T651-L655 PolarHBondContact O-N 2.98Å; T651-L655 VanDerWaalsContact O-N 3.09Å
652	L	87.6	Confident	86.6	Confident	46 Å²	46	31.9 Å²	31.9	24%	0.241	17%	0.167	C	C	.	.	H	α-helix	trans	-70.1	-34.1	177.1	-75.4	170.2	0	0	0	113	L580 T584 S648 V649 T650 L655 L656	L580-L652 HydrophobicContact CB-CD1 4.5Å; L580-L652 HydrophobicContact CD1-CD1 4.16Å; L580-L652 HydrophobicContact CD2-CD1 3.29Å; L580-L652 HydrophobicContact CD2-CG 4.46Å; L580-L652 HydrophobicContact CG-CD1 3.35Å; T584-L652 HydrophobicContact CG2-CB 3.54Å; T584-L652 HydrophobicContact CG2-CD1 3.87Å; T584-L652 HydrophobicContact CG2-CG 4.39Å; S648-L652 PolarHBondContact O-N 3.07Å; V649-L652 PolarHBondContact O-N 2.89Å; T650-L652 PolarHBondContact O-N 3.46Å; L652-L655 HydrophobicContact CD2-CD2 4.35Å; L652-L655 WeakPolarHBondContact O-CB 3.46Å; L652-L655 PolarHBondContact O-N 3.07Å; L652-L656 WeakPolarHBondContact O-CB 3.49Å; L652-L656 PolarHBondContact O-N 3.15Å
653	S	90.9	Very high	86.5	Confident	1 Å²	1	33 Å²	33	1%	0.007	18%	0.179	C	C	.	.	H	α-helix	trans	-61.6	-45.1	174.5	-178.2	0	0	0	0	111.4	V588 Q620 V621 V649 T650 L655 L656 A657	V588-S653 VanDerWaalsContact CG2-OG 3.32Å; V588-S653 WeakPolarHBondContact CG2-OG 3.39Å; Q620-S653 VanDerWaalsContact CA-OG 3.29Å; Q620-S653 WeakPolarHBondContact CA-OG 3.45Å; V621-S653 PolarHBondContact N-OG 3.35Å; V649-S653 WeakPolarHBondContact O-CB 3.49Å; V649-S653 PolarHBondContact O-N 3.21Å; T650-S653 WeakPolarHBondContact O-CB 3.47Å; T650-S653 PolarHBondContact O-N 2.94Å; S653-L655 VanDerWaalsContact C-N 3.31Å; S653-L655 PolarHBondContact O-N 3.36Å; S653-L656 PolarHBondContact O-N 3.34Å; S653-A657 PolarHBondContact O-N 3.25Å; S653-A657 VanDerWaalsContact O-N 3.1Å
654	L	85.8	Confident	86.2	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-63.5	-36.5	174.3	-69.6	169.2	0	0	0	111.8	M297 F298 L395 Q620 V621 F626 T650 T651 L656 A657 P658	M297-L654 HydrophobicContact CE-CD1 3.78Å; F298-L654 HydrophobicContact CE1-CB 4.11Å; F298-L654 HydrophobicContact CE2-CB 4.13Å; F298-L654 HydrophobicContact CZ-CB 3.33Å; F298-L654 HydrophobicContact CZ-CD1 4.33Å; F298-L654 HydrophobicContact CZ-CG 4.47Å; L395-L654 HydrophobicContact CD2-CB 4.4Å; L395-L654 HydrophobicContact CD2-CD2 3.67Å; Q620-L654 HydrophobicContact CG-CD2 4.23Å; V621-L654 WeakPolarHBondContact O-CD2 3.41Å; V621-L654 WeakPolarHBondContact O-CG 3.43Å; F626-L654 HydrophobicContact CZ-CD1 4.45Å; T650-L654 HydrophobicContact CG2-CD1 4.17Å; T650-L654 VanDerWaalsContact O-CG 3.31Å; T650-L654 WeakPolarHBondContact O-CG 3.44Å; T650-L654 PolarHBondContact O-N 2.95Å; T651-L654 PolarHBondContact O-N 3.25Å; L654-L656 VanDerWaalsContact C-N 3.32Å; L654-L656 PolarHBondContact O-N 3.13Å; L654-A657 WeakPolarHBondContact O-CB 3.37Å; L654-A657 PolarHBondContact O-N 2.95Å; L654-P658 VanDerWaalsContact O-CD 3.32Å; L654-P658 WeakPolarHBondContact O-CD 3.4Å
655	L	84.2	Confident	85.9	Confident	82 Å²	82	34.8 Å²	34.8	43%	0.429	19%	0.19	S	C	.	.	H	α-helix	trans	-66.3	-34.4	175.9	-173	66.7	0	0	0	112.2	L294 T651 L652 S653 P658	L294-L655 HydrophobicContact CD1-CD1 3.82Å; L294-L655 HydrophobicContact CD2-CD1 3.41Å; L294-L655 VanDerWaalsContact CD2-CD1 3.41Å; L294-L655 HydrophobicContact CG-CD1 4.27Å; T651-L655 PolarHBondContact O-N 2.98Å; T651-L655 VanDerWaalsContact O-N 3.09Å; L652-L655 HydrophobicContact CD2-CD2 4.35Å; L652-L655 WeakPolarHBondContact O-CB 3.46Å; L652-L655 PolarHBondContact O-N 3.07Å; S653-L655 VanDerWaalsContact C-N 3.31Å; S653-L655 PolarHBondContact O-N 3.36Å; L655-P658 WeakPolarHBondContact O-CD 3.4Å
656	L	86.6	Confident	85.3	Confident	68 Å²	68	37.9 Å²	37.9	36%	0.356	21%	0.212	S	C	.	.	H	α-helix	trans	-76.7	-23.4	177.8	-172.1	62.6	0	0	0	112.8	V588 L652 S653 L654 A659 L660	V588-L656 HydrophobicContact CB-CD2 4.47Å; V588-L656 HydrophobicContact CG1-CD2 4.16Å; V588-L656 HydrophobicContact CG2-CD2 4.36Å; L652-L656 WeakPolarHBondContact O-CB 3.49Å; L652-L656 PolarHBondContact O-N 3.15Å; S653-L656 PolarHBondContact O-N 3.34Å; L654-L656 VanDerWaalsContact C-N 3.32Å; L654-L656 PolarHBondContact O-N 3.13Å; L656-A659 PolarHBondContact O-N 3.14Å; L656-L660 PolarHBondContact O-N 3.01Å; L656-L660 VanDerWaalsContact O-N 3.09Å
657	A	86.2	Confident	84.6	Confident	2 Å²	2	46.4 Å²	46.4	2%	0.017	25%	0.248	C	C	.	.	H	α-helix	trans	-59.9	-44.8	-172.1	0	0	0	0	0	114.8	L395 F399 Q620 S653 L654 A659 L660 W661	L395-A657 HydrophobicContact CD2-CB 3.78Å; F399-A657 HydrophobicContact CE2-CB 4.31Å; F399-A657 HydrophobicContact CZ-CB 4.4Å; Q620-A657 HydrophobicContact CB-CB 3.68Å; Q620-A657 HydrophobicContact CG-CB 3.82Å; S653-A657 PolarHBondContact O-N 3.25Å; S653-A657 VanDerWaalsContact O-N 3.1Å; L654-A657 WeakPolarHBondContact O-CB 3.37Å; L654-A657 PolarHBondContact O-N 2.95Å; A657-A659 VanDerWaalsContact C-N 3.28Å; A657-A659 PolarHBondContact O-N 2.9Å; A657-L660 PolarHBondContact O-N 2.96Å; A657-W661 WeakPolarHBondContact O-CB 3.45Å; A657-W661 PolarHBondContact O-N 3.38Å
658	P	82.6	Confident	83.8	Confident	20 Å²	20	47.7 Å²	47.7	13%	0.13	26%	0.257	C	S	.	.	H	α-helix	trans	-60.7	-36.7	177.7	-19.9	29.4	0	0	0	112.9	F399 L654 L655 R662	F399-P658 HydrophobicContact CE1-CB 3.96Å; F399-P658 HydrophobicContact CE1-CG 4.01Å; F399-P658 HydrophobicContact CZ-CB 3.93Å; F399-P658 HydrophobicContact CZ-CG 3.74Å; L654-P658 VanDerWaalsContact O-CD 3.32Å; L654-P658 WeakPolarHBondContact O-CD 3.4Å; L655-P658 WeakPolarHBondContact O-CD 3.4Å; P658-R662 WeakPolarHBondContact O-CB 3.23Å; P658-R662 VanDerWaalsContact O-CG 3.31Å; P658-R662 WeakPolarHBondContact O-CG 3.35Å; P658-R662 PolarHBondContact O-N 3.07Å
659	A	85.1	Confident	82.7	Confident	59 Å²	59	49.7 Å²	49.7	49%	0.488	27%	0.269	S	S	.	.	H	α-helix	trans	-68.1	-44.7	177.8	0	0	0	0	0	111	L656 A657 R662 A663	L656-A659 PolarHBondContact O-N 3.14Å; A657-A659 VanDerWaalsContact C-N 3.28Å; A657-A659 PolarHBondContact O-N 2.9Å; A659-R662 PolarHBondContact O-N 3.26Å; A659-A663 WeakPolarHBondContact O-CB 3.42Å; A659-A663 PolarHBondContact O-N 2.89Å
660	L	86.1	Confident	81	Confident	46 Å²	46	54.2 Å²	54.2	24%	0.241	30%	0.299	C	S	.	.	H	α-helix	trans	-62.2	-43.9	176.6	-174	65.8	0	0	0	111.8	V588 A616 A619 L656 A657 A663 A664	V588-L660 HydrophobicContact CG1-CD2 4Å; A616-L660 HydrophobicContact CB-CG 4.26Å; A619-L660 HydrophobicContact CB-CD2 3.51Å; L656-L660 PolarHBondContact O-N 3.01Å; L656-L660 VanDerWaalsContact O-N 3.09Å; A657-L660 PolarHBondContact O-N 2.96Å; L660-A663 PolarHBondContact O-N 3.39Å; L660-A664 WeakPolarHBondContact O-CB 3.4Å; L660-A664 PolarHBondContact O-N 2.99Å
661	W	83.9	Confident	78.9	Confident	9 Å²	9	65.5 Å²	65.5	3%	0.034	34%	0.341	C	S	.	.	H	α-helix	trans	-61.2	-48.5	177.2	-179.4	-100.8	0	0	0	112.3	F399 L400 Y414 L418 I613 A657 A663 A664 I665	F399-W661 HydrophobicContact CB-CD2 4.07Å; F399-W661 HydrophobicContact CB-CG 4.21Å; F399-W661 HydrophobicContact CB-CZ2 4.12Å; F399-W661 HydrophobicContact CD2-CB 4.06Å; F399-W661 AromaticContact CD2-CD2 3.96Å; F399-W661 HydrophobicContact CD2-CD2 3.96Å; F399-W661 HydrophobicContact CD2-CE3 4.39Å; F399-W661 AromaticContact CD2-CG 3.8Å; F399-W661 HydrophobicContact CD2-CG 3.8Å; F399-W661 HydrophobicContact CE2-CB 4.1Å; F399-W661 HydrophobicContact CE2-CG 4.34Å; F399-W661 AromaticContact CG-CD1 3.9Å; F399-W661 HydrophobicContact CG-CD2 4.25Å; F399-W661 AromaticContact CG-CG 4Å; F399-W661 HydrophobicContact CG-CG 4Å; L400-W661 HydrophobicContact CD1-CH2 3.72Å; L400-W661 HydrophobicContact CD1-CZ2 3.89Å; Y414-W661 HydrophobicContact CE2-CH2 4.38Å; L418-W661 HydrophobicContact CD2-CH2 3.82Å; L418-W661 HydrophobicContact CD2-CZ3 3.69Å; I613-W661 HydrophobicContact CG2-CH2 3.68Å; I613-W661 HydrophobicContact CG2-CZ2 4.43Å; I613-W661 HydrophobicContact CG2-CZ3 3.84Å; I613-W661 WeakPolarHBondContact O-CZ3 3.43Å; A657-W661 WeakPolarHBondContact O-CB 3.45Å; A657-W661 PolarHBondContact O-N 3.38Å; W661-A663 VanDerWaalsContact C-N 3.33Å; W661-A663 PolarHBondContact O-N 3.32Å; W661-A664 PolarHBondContact O-N 3.09Å; W661-I665 HydrophobicContact CD2-CD1 4.29Å; W661-I665 HydrophobicContact CG-CD1 4.49Å; W661-I665 HydrophobicContact CZ2-CD1 3.75Å; W661-I665 HydrophobicContact CZ2-CG1 4.41Å; W661-I665 PolarHBondContact O-N 3.04Å; W661-I665 VanDerWaalsContact CE2-CD1 3.43Å
662	R	82.4	Confident	76.9	Confident	181 Å²	181	68.1 Å²	68.1	68%	0.683	36%	0.359	S	S	*	.	H	α-helix	trans	-60.9	-41.2	176.3	-74.2	178.5	-178.5	177.2	3.3	111.9	P658 A659 T666	P658-R662 WeakPolarHBondContact O-CB 3.23Å; P658-R662 VanDerWaalsContact O-CG 3.31Å; P658-R662 WeakPolarHBondContact O-CG 3.35Å; P658-R662 PolarHBondContact O-N 3.07Å; A659-R662 PolarHBondContact O-N 3.26Å; R662-T666 PolarHBondContact O-N 3.22Å; R662-T666 PolarHBondContact O-OG1 2.71Å; R662-T666 WeakPolarHBondContact O-CG2 3.48Å; R662-T666 VanDerWaalsContact O-CG2 3.25Å; R662-T666 WeakPolarHBondContact O-CB 3.49Å
663	A	84.7	Confident	74.6	Confident	53 Å²	53	74.9 Å²	74.9	44%	0.438	39%	0.389	S	S	.	.	H	α-helix	trans	-63.5	-40.6	176.1	0	0	0	0	0	112.1	A659 L660 W661 T666 K667	A659-A663 WeakPolarHBondContact O-CB 3.42Å; A659-A663 PolarHBondContact O-N 2.89Å; L660-A663 PolarHBondContact O-N 3.39Å; W661-A663 VanDerWaalsContact C-N 3.33Å; W661-A663 PolarHBondContact O-N 3.32Å; A663-T666 PolarHBondContact O-OG1 2.98Å; A663-T666 VanDerWaalsContact O-OG1 3.12Å; A663-K667 WeakPolarHBondContact O-CB 3.49Å; A663-K667 PolarHBondContact O-N 3.26Å
664	A	82.3	Confident	72.2	Confident	13 Å²	13	86.3 Å²	86.3	11%	0.107	43%	0.432	C	S	.	.	H	α-helix	trans	-66.4	-46.8	177.9	0	0	0	0	0	112.2	A616 L660 W661 K667 C668	A616-A664 HydrophobicContact CB-CB 3.36Å; L660-A664 WeakPolarHBondContact O-CB 3.4Å; L660-A664 PolarHBondContact O-N 2.99Å; W661-A664 PolarHBondContact O-N 3.09Å; A664-K667 PolarHBondContact O-N 2.97Å; A664-C668 VanDerWaalsContact O-SG 3.38Å; A664-C668 PolarHBondContact O-SG 3.26Å; A664-C668 WeakPolarHBondContact O-CB 3.3Å; A664-C668 PolarHBondContact O-N 3.02Å
665	I	79.3	Confident	69.9	Low	43 Å²	43	97.7 Å²	97.7	22%	0.221	48%	0.475	C	S	.	.	H	α-helix	trans	-62.5	-48.5	178.4	-72.2	-173.7	0	0	0	111.4	W661 K667 V669	W661-I665 HydrophobicContact CD2-CD1 4.29Å; W661-I665 HydrophobicContact CG-CD1 4.49Å; W661-I665 HydrophobicContact CZ2-CD1 3.75Å; W661-I665 HydrophobicContact CZ2-CG1 4.41Å; W661-I665 PolarHBondContact O-N 3.04Å; W661-I665 VanDerWaalsContact CE2-CD1 3.43Å; I665-K667 VanDerWaalsContact C-N 3.26Å; I665-K667 PolarHBondContact O-N 2.99Å; I665-V669 HydrophobicContact CG2-CG2 4.01Å; I665-V669 WeakPolarHBondContact O-CB 2.84Å; I665-V669 WeakPolarHBondContact O-CG2 3.49Å; I665-V669 PolarHBondContact O-N 3.46Å; I665-V669 VanDerWaalsContact O-N 3.11Å
666	T	76.5	Confident	67.7	Low	116 Å²	116	98.6 Å²	98.6	71%	0.712	49%	0.488	S	S	*	.	H	α-helix	trans	-63.6	-31.6	-176.2	49.5	0	0	0	0	113.1	R662 A663	R662-T666 PolarHBondContact O-N 3.22Å; R662-T666 PolarHBondContact O-OG1 2.71Å; R662-T666 WeakPolarHBondContact O-CG2 3.48Å; R662-T666 VanDerWaalsContact O-CG2 3.25Å; R662-T666 WeakPolarHBondContact O-CB 3.49Å; A663-T666 PolarHBondContact O-OG1 2.98Å; A663-T666 VanDerWaalsContact O-OG1 3.12Å
667	K	76	Confident	65.7	Low	187 Å²	187	101.1 Å²	101.1	81%	0.813	51%	0.512	S	S	*	.	H	α-helix	trans	-91.7	-33.4	-177.4	-163.2	175.2	-177.2	-179.7	0	113.7	A663 A664 I665	A663-K667 WeakPolarHBondContact O-CB 3.49Å; A663-K667 PolarHBondContact O-N 3.26Å; A664-K667 PolarHBondContact O-N 2.97Å; I665-K667 VanDerWaalsContact C-N 3.26Å; I665-K667 PolarHBondContact O-N 2.99Å
668	C	68.7	Low	63.4	Low	30 Å²	30	110.5 Å²	110.5	20%	0.203	57%	0.569	C	S	.	*	H	α-helix	trans	-103.4	-18.7	-170	-56.8	0	0	0	0	114.4	W612 I613 A664 P670	W612-C668 HydrophobicContact CB-CB 4.36Å; W612-C668 VanDerWaalsContact CB-SG 3.58Å; I613-C668 HydrophobicContact CG1-CB 4.23Å; A664-C668 VanDerWaalsContact O-SG 3.38Å; A664-C668 PolarHBondContact O-SG 3.26Å; A664-C668 WeakPolarHBondContact O-CB 3.3Å; A664-C668 PolarHBondContact O-N 3.02Å; C668-P670 WeakPolarHBondContact O-CD 3.27Å
669	V	64.2	Low	62.5	Low	49 Å²	49	115.1 Å²	115.1	30%	0.297	59%	0.591	S	S	.	*	S	Bend	trans	-80.2	117.3	175.5	178.5	0	0	0	0	108.9	I613 I665 R671	I613-V669 HydrophobicContact CD1-CG2 3.87Å; I665-V669 HydrophobicContact CG2-CG2 4.01Å; I665-V669 WeakPolarHBondContact O-CB 2.84Å; I665-V669 WeakPolarHBondContact O-CG2 3.49Å; I665-V669 PolarHBondContact O-N 3.46Å; I665-V669 VanDerWaalsContact O-N 3.11Å; V669-R671 PolarHBondContact O-N 3.19Å
670	P	54.6	Low	61.3	Low	98 Å²	98	118 Å²	118	64%	0.636	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-59.1	125.9	175	21.7	-29.6	0	0	0	109.5	C668	C668-P670 WeakPolarHBondContact O-CD 3.27Å
671	R	45.5	Very low	59.9	Low	237 Å²	237	122 Å²	122	89%	0.894	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-58.7	128.9	170.6	-85.5	-179.8	171.6	162.1	-1.8	107.4	V669 E673	V669-R671 PolarHBondContact O-N 3.19Å; R671-E673 PolarHBondContact O-N 3.22Å
672	P	42.7	Very low	58.5	Low	90 Å²	90	128.6 Å²	128.6	58%	0.584	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-57.7	129.4	169.3	23.6	-30.1	0	0	0	107.5	R674	P672-R674 PolarHBondContact O-N 3.22Å
673	E	39.3	Very low	57	Low	188 Å²	188	125.4 Å²	125.4	88%	0.879	65%	0.648	S	S	*	*			trans	-44.5	118.3	172.5	-82.9	172.7	149	0	0	108.1	R671 R675	R671-E673 PolarHBondContact O-N 3.22Å; E673-R675 VanDerWaalsContact C-N 3.27Å; E673-R675 PolarHBondContact O-N 3.39Å
674	R	38.6	Very low	55.1	Low	241 Å²	241	130.2 Å²	130.2	91%	0.909	66%	0.663	S	S	*	*			trans	-58.7	99.7	168.2	-175.2	-173.1	-94.3	-175.9	-8.4	104.3	P672 S676	P672-R674 PolarHBondContact O-N 3.22Å; R674-S676 PolarHBondContact O-N 3.28Å
675	R	38.8	Very low	53.2	Low	239 Å²	239	138.6 Å²	138.6	90%	0.902	70%	0.702	S	S	*	*			trans	-46.1	106.4	171.8	-96.3	-178.5	174.3	171.4	-2.6	106.3	E673 S677	E673-R675 VanDerWaalsContact C-N 3.27Å; E673-R675 PolarHBondContact O-N 3.39Å; R675-S677 VanDerWaalsContact C-N 3.32Å; R675-S677 PolarHBondContact O-N 3.06Å
676	S	38.3	Very low	51.2	Low	101 Å²	101	145.9 Å²	145.9	71%	0.706	74%	0.739	S	S	*	*			trans	-65	100.1	167.2	47.7	0	0	0	0	105.6	R674 T678	R674-S676 PolarHBondContact O-N 3.28Å; S676-T678 VanDerWaalsContact C-N 3.29Å; S676-T678 PolarHBondContact O-N 2.81Å
677	S	43.7	Very low	49.1	Very low	122 Å²	122	148.4 Å²	148.4	85%	0.853	74%	0.741	S	S	*	*			trans	-66.7	95.3	161.4	52.5	0	0	0	0	107.3	R675	R675-S677 VanDerWaalsContact C-N 3.32Å; R675-S677 PolarHBondContact O-N 3.06Å
678	T	38.4	Very low	46.6	Very low	199 Å²	199	144.9 Å²	144.9	100%	1.221	74%	0.735	S	S	*	*			trans	-109.2	0	153.9	35.9	0	0	0	0	108	S676	S676-T678 VanDerWaalsContact C-N 3.29Å; S676-T678 PolarHBondContact O-N 2.81Å

Retrieved 678 of 678 residues in 162.6 ms (Link to these results)

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