A0A3Q0KL62_SCHMA Loading...

LMBR1 domain-containing protein 2

AlphaFold DB , UniProt , Accession A0A3Q0KL62, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,100 aa.

						>A0A3Q0KL62_SCHMA|A0A3Q0KL62
MPNNQLHPAFYASRRQLWATLSTGKISCFWKFIQNYGIGSNCTSLSNIWYVIFTISSILWLLIRAIWRYKEFKIQAYDPRFGNKWDEINTLHFQLASIILSLCLFPIMIYSALCRVGHSANDSIILGKDMLHLQNLLLSFPNLQKLITMNITNIYGNNGSRYSSTALPNSSGITRSREQSSIEEEVLDSFIIKKRGEDFYEQVSNHFKPFSTILYVLITYLFLLPICIMEAEQIKNEAIDPRYVFQSNVDRLFGQSANEKYTTFFMQHIKSRSNQNVNNPLSNDDKLVYENERPFPSHAYPSTPSEISVEYICFVISLFMLTIHYPAPFYFTSRIFSLLFSMYIAMTSVYLLVDVETIAVMYKLNTVGIRDPGGSLVVHIDTNLKYITSWYCVLLNAASLPAMIICLMAIYAYGETKFKEAVTNYAQLLIAGEIPSTNGCSSNKITTRDNLIKGVDYDTTNHNPDSNGTIETMIGEQINLEPNYHESIINLPITLAITTKHWHPPLLNRRNGQIPKRSNTPLPYGQSQNNGSEISTLKRNRGIPLSTSTELTNSVHTLNETTNASSKSTQTRWSRIGLNIIATITFLWTLTTRICLMGSILKCYWKTGLEIALTDTILTLLYMICWLILWFGLSVKTAWRFRLLHNNNYFNSTGQRESYLQKSIFPNGCDNQTFGSPELQQQQIQMNVNGAYPNLWPYVSYPPWIVPGTVITAGLPVGTTGDVQQTNNVVNGLPVGASSGGDSLYGFFPELPNQTQNQSGDMTNPYHTHSRCISLPSGPPTLSEESDITANQQERNDCISNNKYFRPVTTPSLAGSTYLNDNQQTSMELHQPYTTPQNNNLPRSRTIQEIAYSDAYEQFSGQNSSKNRSVPNNASHLNNQRHGVSPIVPEPTYATLATLSKQSIQNNGFRPSSVTPLDSHNKGKVSPTNISRNISYRRPCTRVTFQDIDNNFSGSRAVINDGATGSSDSGVCTNGHGSSIQQNGNYPEKQYPKGKIKPELFSMFEQDVYKTSGIQCATDRSYSSAHIRNDNMLKNNVNNTNNNNNDVEISTDMTSFVMKRNHKPEECISYGNHHDATDNLQRHPHYPHQIDPDDRLCSQV
					

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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	30.4	Very low	37.8	Very low	236 Å²	236	132.5 Å²	132.5	100%	1.163	69%	0.693	S	S	*	*				0	129.4	0	-69.2	162.8	168.3	0	0	107.4
2	P	32.9	Very low	37.9	Very low	121 Å²	121	128.8 Å²	128.8	79%	0.786	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-85.3	160.4	171.5	35.3	-32.8	0	0	0	111.2	N4	P2-N4 PolarHBondContact O-N 3.25Å
3	N	33.1	Very low	38.2	Very low	156 Å²	156	125.3 Å²	125.3	83%	0.834	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-73.4	122.7	-178.9	-59.6	-24.6	0	0	0	111.3
4	N	38.1	Very low	38	Very low	153 Å²	153	133.9 Å²	133.9	82%	0.818	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-77.8	125.8	158.5	-89.2	12.7	0	0	0	108.9	P2	P2-N4 PolarHBondContact O-N 3.25Å
5	Q	38.6	Very low	37.9	Very low	189 Å²	189	138.8 Å²	138.8	88%	0.883	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-69.8	137.1	168.6	-67	170	-30	0	0	109	H7	Q5-H7 PolarHBondContact O-N 3.34Å
6	L	37.9	Very low	37.6	Very low	158 Å²	158	138.1 Å²	138.1	83%	0.827	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-68.6	131.3	174.9	-85.2	85	0	0	0	110.2
7	H	40.3	Very low	37.4	Very low	86 Å²	86	139.1 Å²	139.1	40%	0.398	71%	0.709	S	S	.	*	P	Polyproline II helix	trans	-65	137.6	-175.4	-165	-81.3	0	0	0	111.5	Q5 A9 F10	Q5-H7 PolarHBondContact O-N 3.34Å; H7-A9 PolarHBondContact ND1-N 2.9Å; H7-A9 PolarHBondContact O-N 2.87Å; H7-F10 HydrophobicContact CB-CD2 4.08Å; H7-F10 HydrophobicContact CB-CE2 4.28Å; H7-F10 PolarHBondContact O-N 3.36Å
8	P	43.7	Very low	36.8	Very low	114 Å²	114	142 Å²	142	74%	0.74	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	8.6	-176.5	27.3	-36.6	0	0	0	115.4
9	A	39.2	Very low	36.7	Very low	42 Å²	42	138.4 Å²	138.4	35%	0.347	70%	0.704	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.9	-23.3	168.9	0	0	0	0	0	112.7	H7	H7-A9 PolarHBondContact ND1-N 2.9Å; H7-A9 PolarHBondContact O-N 2.87Å
10	F	37.1	Very low	36.6	Very low	58 Å²	58	137.5 Å²	137.5	25%	0.254	71%	0.706	S	S	.	*			trans	-98.4	125.3	-171.3	-67.2	-81.5	0	0	0	113.2	H7	H7-F10 HydrophobicContact CB-CD2 4.08Å; H7-F10 HydrophobicContact CB-CE2 4.28Å; H7-F10 PolarHBondContact O-N 3.36Å
11	Y	45	Very low	36.4	Very low	145 Å²	145	137.8 Å²	137.8	57%	0.569	71%	0.708	S	S	*	*			trans	-123.9	98	161.9	-91.5	-90.6	0	0	0	109.3	S13 P779	Y11-S13 PolarHBondContact O-N 2.81Å; Y11-P779 WeakPolarHBondContact OH-CB 3.38Å; Y11-P779 WeakPolarHBondContact OH-CG 3.48Å
12	A	38.9	Very low	36.7	Very low	88 Å²	88	132 Å²	132	73%	0.727	69%	0.691	S	S	*	*			trans	-74.5	91.4	175.7	0	0	0	0	0	110.5	R14	A12-R14 PolarHBondContact O-N 3.25Å
13	S	41.4	Very low	36.8	Very low	83 Å²	83	131.8 Å²	131.8	58%	0.58	69%	0.687	S	S	*	*			trans	-66.8	101	173.5	164.8	0	0	0	0	110.4	Y11 R15	Y11-S13 PolarHBondContact O-N 2.81Å; S13-R15 PolarHBondContact O-N 3.37Å
14	R	36.2	Very low	37.1	Very low	246 Å²	246	127.3 Å²	127.3	93%	0.928	68%	0.678	S	S	*	*			trans	-65.7	0.1	-179.6	-124.5	-173.7	-169.7	-153.8	3.3	115.5	A12 Q16	A12-R14 PolarHBondContact O-N 3.25Å; R14-Q16 PolarHBondContact O-N 3.09Å; R14-Q16 VanDerWaalsContact O-N 3.09Å
15	R	35.1	Very low	37.1	Very low	207 Å²	207	130.3 Å²	130.3	78%	0.781	68%	0.684	S	S	*	*			trans	-72.6	96.9	172.8	-75.2	-168	175.9	-163.9	-0.4	110.5	S13 L17	S13-R15 PolarHBondContact O-N 3.37Å; R15-L17 PolarHBondContact O-N 2.93Å
16	Q	33.8	Very low	37.2	Very low	128 Å²	128	126.4 Å²	126.4	60%	0.598	67%	0.668	S	S	*	*			trans	-57.8	117.5	162.1	-69.2	170	-32	0	0	109	R14	R14-Q16 PolarHBondContact O-N 3.09Å; R14-Q16 VanDerWaalsContact O-N 3.09Å
17	L	33.7	Very low	37.9	Very low	155 Å²	155	122.4 Å²	122.4	81%	0.812	65%	0.653	S	S	*	*			trans	-118.3	98.4	170.1	-76.2	173.3	0	0	0	107.7	R15	R15-L17 PolarHBondContact O-N 2.93Å
18	W	27	Very low	38.5	Very low	191 Å²	191	123.8 Å²	123.8	72%	0.723	67%	0.671	S	S	*	*			trans	-62.2	135.5	-179.1	-61.1	87.2	0	0	0	111.1	L491	W18-L491 HydrophobicContact CE3-CD2 4.32Å; W18-L491 HydrophobicContact CH2-CD1 3.98Å; W18-L491 HydrophobicContact CH2-CD2 3.6Å; W18-L491 HydrophobicContact CH2-CG 4.46Å; W18-L491 HydrophobicContact CZ2-CD1 4.38Å; W18-L491 HydrophobicContact CZ2-CD2 4.5Å; W18-L491 HydrophobicContact CZ3-CD2 3.49Å; W18-L491 VanDerWaalsContact CZ3-CD2 3.49Å
19	A	34.5	Very low	38.7	Very low	73 Å²	73	125.5 Å²	125.5	60%	0.603	67%	0.668	S	S	*	*			trans	-147.8	94.7	173.1	0	0	0	0	0	109.6
20	T	35.4	Very low	39.1	Very low	121 Å²	121	126 Å²	126	74%	0.742	66%	0.66	S	S	*	*			trans	-67.8	144.6	171.8	47.8	0	0	0	0	111.1
21	L	33	Very low	39.6	Very low	144 Å²	144	130.1 Å²	130.1	75%	0.754	68%	0.678	S	S	*	*			trans	-71.7	129	170.7	-155.3	78.4	0	0	0	109.4	T23	L21-T23 PolarHBondContact O-N 3.07Å
22	S	36.9	Very low	40	Very low	114 Å²	114	129.6 Å²	129.6	80%	0.797	68%	0.679	S	S	*	*			trans	-87.3	82.4	-176.7	59.2	0	0	0	0	112.3	G24	S22-G24 PolarHBondContact O-N 2.93Å
23	T	34.2	Very low	40.5	Very low	116 Å²	116	127.8 Å²	127.8	71%	0.712	66%	0.657	S	S	*	*			trans	-85.1	77	170.7	40.5	0	0	0	0	111.2	L21	L21-T23 PolarHBondContact O-N 3.07Å
24	G	38.4	Very low	40.9	Very low	63 Å²	63	129.2 Å²	129.2	65%	0.649	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-61.9	144.1	169.3	0	0	0	0	0	111.6	S22 I26	S22-G24 PolarHBondContact O-N 2.93Å; G24-I26 PolarHBondContact O-N 3.3Å
25	K	37.9	Very low	41.3	Very low	216 Å²	216	124 Å²	124	94%	0.939	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-62.4	123.3	177.8	-77.9	-176.8	176.5	178.9	0	110.4
26	I	41.8	Very low	41.9	Very low	107 Å²	107	122.3 Å²	122.3	55%	0.549	64%	0.64	S	S	.	*	P	Polyproline II helix	trans	-64	129.1	179.1	-85.2	160.2	0	0	0	111	G24 W30	G24-I26 PolarHBondContact O-N 3.3Å; I26-W30 HydrophobicContact CB-CB 4.5Å; I26-W30 HydrophobicContact CG1-CB 4.45Å; I26-W30 HydrophobicContact CG1-CG 4.45Å; I26-W30 HydrophobicContact CG2-CB 3.66Å
27	S	52	Low	42.1	Very low	73 Å²	73	119.7 Å²	119.7	51%	0.51	65%	0.647	S	S	.	*	P	Polyproline II helix	trans	-85.1	162.5	173.4	67.1	0	0	0	0	111.6	F29 W30	S27-F29 PolarHBondContact O-N 3.31Å; S27-F29 VanDerWaalsContact O-N 3.1Å; S27-W30 WeakPolarHBondContact O-CB 3.15Å; S27-W30 PolarHBondContact O-N 2.86Å
28	C	53.3	Low	42.8	Very low	116 Å²	116	116.6 Å²	116.6	78%	0.784	63%	0.63	S	S	*	*	H	α-helix	trans	-57.6	-29.5	-176.4	-64.2	0	0	0	0	114.2	W30 K31	C28-W30 VanDerWaalsContact C-N 3.26Å; C28-W30 PolarHBondContact O-N 2.84Å; C28-K31 PolarHBondContact O-N 2.8Å
29	F	48	Very low	44	Very low	150 Å²	150	109.6 Å²	109.6	66%	0.658	62%	0.618	S	S	*	*	H	α-helix	trans	-60.6	-34.4	176.4	-168.9	-107.1	0	0	0	112.6	S27 F32 I33	S27-F29 PolarHBondContact O-N 3.31Å; S27-F29 VanDerWaalsContact O-N 3.1Å; F29-F32 PolarHBondContact O-N 2.86Å; F29-I33 HydrophobicContact CD1-CD1 3.96Å; F29-I33 HydrophobicContact CE1-CD1 3.56Å; F29-I33 HydrophobicContact CZ-CD1 4.23Å; F29-I33 PolarHBondContact O-N 3.19Å
30	W	46.6	Very low	45.3	Very low	52 Å²	52	106.7 Å²	106.7	20%	0.197	59%	0.593	C	S	.	*	H	α-helix	trans	-67	-35.4	178	-110.9	96	0	0	0	112.6	I26 S27 C28 F32 I33 Q34 C42 T43	I26-W30 HydrophobicContact CB-CB 4.5Å; I26-W30 HydrophobicContact CG1-CB 4.45Å; I26-W30 HydrophobicContact CG1-CG 4.45Å; I26-W30 HydrophobicContact CG2-CB 3.66Å; S27-W30 WeakPolarHBondContact O-CB 3.15Å; S27-W30 PolarHBondContact O-N 2.86Å; C28-W30 VanDerWaalsContact C-N 3.26Å; C28-W30 PolarHBondContact O-N 2.84Å; W30-F32 VanDerWaalsContact C-N 3.3Å; W30-F32 PolarHBondContact O-N 3.32Å; W30-I33 PolarHBondContact O-N 3.25Å; W30-Q34 VanDerWaalsContact O-CB 3.24Å; W30-Q34 WeakPolarHBondContact O-CB 3.09Å; W30-Q34 PolarHBondContact O-N 3.41Å; W30-C42 HydrophobicContact CZ2-CB 4.42Å; W30-C42 WeakPolarHBondContact CZ2-O 3.29Å; W30-C42 PolarHBondContact NE1-O 3.26Å; W30-T43 HydrophobicContact CH2-CG2 4.07Å; W30-T43 HydrophobicContact CZ2-CG2 4.13Å
31	K	49.3	Very low	46.6	Very low	145 Å²	145	101.1 Å²	101.1	63%	0.63	56%	0.559	S	S	*	*	H	α-helix	trans	-61.3	-39.1	173.7	-78.8	-166.8	171.2	-168	0	111.9	C28 Q34 N35	C28-K31 PolarHBondContact O-N 2.8Å; K31-Q34 PolarHBondContact O-N 3.12Å; K31-N35 VanDerWaalsContact O-CG 3.26Å; K31-N35 PolarHBondContact O-N 3.43Å; K31-N35 PolarHBondContact O-OD1 3.27Å
32	F	52.3	Low	47.8	Very low	133 Å²	133	95 Å²	95	58%	0.583	53%	0.527	S	S	*	.	H	α-helix	trans	-65	-41.8	-179.8	-165.3	-93.2	0	0	0	112	F29 W30 Y36	F29-F32 PolarHBondContact O-N 2.86Å; W30-F32 VanDerWaalsContact C-N 3.3Å; W30-F32 PolarHBondContact O-N 3.32Å; F32-Y36 HydrophobicContact CE1-CE2 4.12Å; F32-Y36 WeakPolarHBondContact O-CD2 3.35Å
33	I	49.5	Very low	49.1	Very low	50 Å²	50	93.1 Å²	93.1	26%	0.256	51%	0.511	S	S	.	.	H	α-helix	trans	-69.7	-44.1	176	-66.6	174.8	0	0	0	111.3	F29 W30 N35 Y36	F29-I33 HydrophobicContact CD1-CD1 3.96Å; F29-I33 HydrophobicContact CE1-CD1 3.56Å; F29-I33 HydrophobicContact CZ-CD1 4.23Å; F29-I33 PolarHBondContact O-N 3.19Å; W30-I33 PolarHBondContact O-N 3.25Å; I33-N35 PolarHBondContact O-N 2.95Å; I33-Y36 PolarHBondContact O-N 2.98Å; I33-Y36 VanDerWaalsContact O-N 3.12Å
34	Q	49.2	Very low	50.7	Low	113 Å²	113	89.5 Å²	89.5	53%	0.528	49%	0.49	S	S	.	.	H	α-helix	trans	-66	-26	-174.5	-166	167.2	8.6	0	0	113.2	W30 K31 Y36 G37	W30-Q34 VanDerWaalsContact O-CB 3.24Å; W30-Q34 WeakPolarHBondContact O-CB 3.09Å; W30-Q34 PolarHBondContact O-N 3.41Å; K31-Q34 PolarHBondContact O-N 3.12Å; Q34-Y36 PolarHBondContact O-N 3.34Å; Q34-G37 PolarHBondContact O-N 3.4Å
35	N	45.9	Very low	52.4	Low	138 Å²	138	92.4 Å²	92.4	74%	0.738	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-17.9	174.1	-76.6	2.4	0	0	0	114.4	K31 I33 G37	K31-N35 VanDerWaalsContact O-CG 3.26Å; K31-N35 PolarHBondContact O-N 3.43Å; K31-N35 PolarHBondContact O-OD1 3.27Å; I33-N35 PolarHBondContact O-N 2.95Å; N35-G37 VanDerWaalsContact C-N 3.31Å
36	Y	47.1	Very low	54	Low	171 Å²	171	86 Å²	86	67%	0.671	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	5.7	177.5	-76.7	-83.3	0	0	0	114	F32 I33 Q34 I38	F32-Y36 HydrophobicContact CE1-CE2 4.12Å; F32-Y36 WeakPolarHBondContact O-CD2 3.35Å; I33-Y36 PolarHBondContact O-N 2.98Å; I33-Y36 VanDerWaalsContact O-N 3.12Å; Q34-Y36 PolarHBondContact O-N 3.34Å; Y36-I38 PolarHBondContact O-N 3.27Å
37	G	38.2	Very low	55.6	Low	73 Å²	73	82.4 Å²	82.4	75%	0.753	46%	0.455	S	S	*	.			trans	71.6	-11.5	173.9	0	0	0	0	0	116	Q34 N35	Q34-G37 PolarHBondContact O-N 3.4Å; N35-G37 VanDerWaalsContact C-N 3.31Å
38	I	47.6	Very low	57	Low	90 Å²	90	81.7 Å²	81.7	46%	0.462	45%	0.445	S	S	.	.			trans	-82.3	118.9	178.6	-59.1	165.2	0	0	0	109.4	Y36 S40 C114	Y36-I38 PolarHBondContact O-N 3.27Å; I38-S40 PolarHBondContact O-N 3.46Å; I38-S40 VanDerWaalsContact O-N 3.16Å; I38-C114 HydrophobicContact CG2-CB 3.83Å
39	G	53.3	Low	58.6	Low	44 Å²	44	83.9 Å²	83.9	45%	0.454	44%	0.437	S	S	.	.			trans	-66	112.6	176.4	0	0	0	0	0	111.6	R115	G39-R115 VanDerWaalsContact O-CB 3.3Å; G39-R115 WeakPolarHBondContact O-CB 3.17Å; G39-R115 WeakPolarHBondContact O-CG 3.15Å; G39-R115 PolarHBondContact O-N 3.39Å
40	S	61.2	Low	60.4	Low	12 Å²	12	78.2 Å²	78.2	8%	0.084	41%	0.411	C	S	.	.	B	Isolated β-bridge	trans	-82.8	150.8	-177.8	-175.6	0	0	0	0	113.8	I38 C42 L113	I38-S40 PolarHBondContact O-N 3.46Å; I38-S40 VanDerWaalsContact O-N 3.16Å; S40-C42 PolarHBondContact OG-N 2.9Å; S40-L113 VanDerWaalsContact CA-O 3.31Å; S40-L113 WeakPolarHBondContact CA-O 3.29Å; S40-L113 PolarHBondContact OG-O 2.93Å
41	N	62.2	Low	62.3	Low	4 Å²	4	76.3 Å²	76.3	2%	0.021	41%	0.405	C	S	.	.	S	Bend	trans	-85.9	-3.5	171.5	-86	-28.1	0	0	0	114.7	T43 N47 L113 C114 R115 N121 D122	N41-T43 PolarHBondContact O-N 3.49Å; N41-N47 PolarHBondContact O-ND2 3.49Å; N41-L113 PolarHBondContact N-O 3.46Å; N41-C114 PolarHBondContact ND2-O 3.5Å; N41-R115 WeakPolarHBondContact OD1-CG 3.39Å; N41-N121 PolarHBondContact ND2-ND2 2.85Å; N41-D122 PolarHBondContact ND2-OD1 2.98Å; N41-D122 VanDerWaalsContact OD1-CA 3.26Å; N41-D122 WeakPolarHBondContact OD1-CA 3.28Å; N41-D122 WeakPolarHBondContact OD1-CB 3.31Å
42	C	59.7	Low	64.3	Low	14 Å²	14	73.5 Å²	73.5	10%	0.095	40%	0.396	C	S	.	.			trans	-75.5	32.2	-176.8	-67.2	0	0	0	0	114.6	W30 S40 S44 I48	W30-C42 HydrophobicContact CZ2-CB 4.42Å; W30-C42 WeakPolarHBondContact CZ2-O 3.29Å; W30-C42 PolarHBondContact NE1-O 3.26Å; S40-C42 PolarHBondContact OG-N 2.9Å; C42-S44 PolarHBondContact O-N 3.01Å; C42-I48 HydrophobicContact CB-CD1 4.37Å; C42-I48 HydrophobicContact CB-CG1 3.77Å
43	T	63.1	Low	66.2	Low	76 Å²	76	70.9 Å²	70.9	47%	0.466	39%	0.385	S	S	.	.			trans	-73.1	-12.6	-175	53.2	0	0	0	0	114.2	W30 N41	W30-T43 HydrophobicContact CH2-CG2 4.07Å; W30-T43 HydrophobicContact CZ2-CG2 4.13Å; N41-T43 PolarHBondContact O-N 3.49Å
44	S	68.3	Low	68.2	Low	39 Å²	39	68.5 Å²	68.5	27%	0.273	37%	0.373	S	S	.	.	S	Bend	trans	-127.6	152.3	176	74	0	0	0	0	110.8	C42 S46 N47 I48	C42-S44 PolarHBondContact O-N 3.01Å; S44-S46 PolarHBondContact O-N 3.48Å; S44-S46 PolarHBondContact OG-OG 2.9Å; S44-N47 PolarHBondContact O-N 3.26Å; S44-N47 WeakPolarHBondContact OG-CB 3.43Å; S44-N47 PolarHBondContact OG-N 3.26Å; S44-N47 VanDerWaalsContact OG-N 3.16Å; S44-N47 PolarHBondContact OG-OD1 3.5Å; S44-I48 PolarHBondContact O-N 3.13Å
45	L	73.8	Confident	70.2	Confident	125 Å²	125	65.5 Å²	65.5	65%	0.654	36%	0.359	S	S	*	.	H	α-helix	trans	-62.8	-32.2	177.2	-168	70.1	0	0	0	111.9	I48 W49	L45-I48 PolarHBondContact O-N 3.29Å; L45-W49 VanDerWaalsContact O-CD1 3.25Å; L45-W49 PolarHBondContact O-N 3.41Å
46	S	71.3	Confident	72.5	Confident	82 Å²	82	62.5 Å²	62.5	57%	0.573	35%	0.349	S	S	*	.	H	α-helix	trans	-66.5	-38	175.9	52.3	0	0	0	0	112.7	S44 I48 W49 Y50	S44-S46 PolarHBondContact O-N 3.48Å; S44-S46 PolarHBondContact OG-OG 2.9Å; S46-I48 VanDerWaalsContact C-N 3.33Å; S46-W49 PolarHBondContact O-N 2.86Å; S46-Y50 WeakPolarHBondContact O-CB 3.5Å; S46-Y50 PolarHBondContact O-N 3Å
47	N	76.1	Confident	74.8	Confident	31 Å²	31	54.9 Å²	54.9	17%	0.166	32%	0.321	C	S	.	.	H	α-helix	trans	-66	-39.7	177.1	-66.3	12.3	0	0	0	110.3	N41 S44 Y50 V51 S123	N41-N47 PolarHBondContact O-ND2 3.49Å; S44-N47 PolarHBondContact O-N 3.26Å; S44-N47 WeakPolarHBondContact OG-CB 3.43Å; S44-N47 PolarHBondContact OG-N 3.26Å; S44-N47 VanDerWaalsContact OG-N 3.16Å; S44-N47 PolarHBondContact OG-OD1 3.5Å; N47-Y50 PolarHBondContact O-N 3.03Å; N47-V51 VanDerWaalsContact O-CG2 3.32Å; N47-V51 WeakPolarHBondContact O-CG2 3.41Å; N47-V51 PolarHBondContact O-N 3.36Å; N47-S123 PolarHBondContact ND2-OG 2.97Å
48	I	82.1	Confident	77.5	Confident	58 Å²	58	51.5 Å²	51.5	30%	0.297	29%	0.286	S	S	.	.	H	α-helix	trans	-61.1	-47	174.3	-63.4	169.4	0	0	0	111	C42 S44 L45 S46 Y50 V51 I52	C42-I48 HydrophobicContact CB-CD1 4.37Å; C42-I48 HydrophobicContact CB-CG1 3.77Å; S44-I48 PolarHBondContact O-N 3.13Å; L45-I48 PolarHBondContact O-N 3.29Å; S46-I48 VanDerWaalsContact C-N 3.33Å; I48-Y50 PolarHBondContact O-N 2.85Å; I48-V51 PolarHBondContact O-N 3.37Å; I48-I52 HydrophobicContact CG2-CD1 3.82Å; I48-I52 WeakPolarHBondContact O-CG1 3.41Å; I48-I52 PolarHBondContact O-N 2.97Å
49	W	85	Confident	79.7	Confident	162 Å²	162	51.3 Å²	51.3	61%	0.614	29%	0.285	S	S	*	.	H	α-helix	trans	-63.8	-37.5	176.6	-81.9	114.2	0	0	0	113.4	L45 S46 I52 F53	L45-W49 VanDerWaalsContact O-CD1 3.25Å; L45-W49 PolarHBondContact O-N 3.41Å; S46-W49 PolarHBondContact O-N 2.86Å; W49-I52 HydrophobicContact CE3-CG2 4.49Å; W49-I52 PolarHBondContact O-N 3.1Å; W49-F53 VanDerWaalsContact O-CB 3.27Å; W49-F53 WeakPolarHBondContact O-CB 3.38Å; W49-F53 PolarHBondContact O-N 3.31Å
50	Y	86.1	Confident	81.7	Confident	31 Å²	31	56.1 Å²	56.1	12%	0.122	29%	0.29	C	S	.	.	H	α-helix	trans	-61.5	-44.3	173.7	168.6	-91.5	0	0	0	112.1	S46 N47 I48 F53 T54 S211 T212 H324	S46-Y50 WeakPolarHBondContact O-CB 3.5Å; S46-Y50 PolarHBondContact O-N 3Å; N47-Y50 PolarHBondContact O-N 3.03Å; I48-Y50 PolarHBondContact O-N 2.85Å; Y50-F53 PolarHBondContact O-N 2.91Å; Y50-T54 HydrophobicContact CD2-CG2 4.23Å; Y50-T54 HydrophobicContact CE1-CG2 4.27Å; Y50-T54 HydrophobicContact CE2-CG2 3.79Å; Y50-T54 WeakPolarHBondContact O-CB 3.33Å; Y50-T54 WeakPolarHBondContact O-CG2 3.47Å; Y50-T54 PolarHBondContact O-N 2.68Å; Y50-T54 PolarHBondContact O-OG1 2.62Å; Y50-S211 WeakPolarHBondContact CE1-OG 3.49Å; Y50-S211 PolarHBondContact OH-OG 3.41Å; Y50-T212 WeakPolarHBondContact OH-CA 3.34Å; Y50-T212 PolarHBondContact OH-N 3.14Å; Y50-T212 PolarHBondContact OH-OG1 2.8Å; Y50-H324 AromaticContact CD2-CE1 3.52Å; Y50-H324 AromaticContact CE2-CE1 3.72Å; Y50-H324 AromaticContact CE2-ND1 3.85Å
51	V	88	Confident	83.2	Confident	11 Å²	11	55.6 Å²	55.6	7%	0.067	29%	0.286	C	S	.	.	H	α-helix	trans	-61.6	-48.4	174.9	173.6	0	0	0	0	111.1	N47 I48 F53 T54 I55 A112 L113	N47-V51 VanDerWaalsContact O-CG2 3.32Å; N47-V51 WeakPolarHBondContact O-CG2 3.41Å; N47-V51 PolarHBondContact O-N 3.36Å; I48-V51 PolarHBondContact O-N 3.37Å; V51-F53 PolarHBondContact O-N 3.15Å; V51-T54 PolarHBondContact O-N 2.74Å; V51-T54 PolarHBondContact O-OG1 2.87Å; V51-I55 HydrophobicContact CG1-CD1 3.67Å; V51-I55 HydrophobicContact CG1-CG1 4.44Å; V51-I55 WeakPolarHBondContact O-CB 3.39Å; V51-I55 VanDerWaalsContact O-CG1 3.29Å; V51-I55 WeakPolarHBondContact O-CG1 3.02Å; V51-I55 PolarHBondContact O-N 2.91Å; V51-A112 HydrophobicContact CG2-CB 4.02Å; V51-L113 HydrophobicContact CG1-CD2 3.83Å; V51-L113 HydrophobicContact CG1-CG 4.39Å
52	I	90.7	Very high	84.8	Confident	86 Å²	86	56.5 Å²	56.5	44%	0.441	29%	0.291	S	S	.	.	H	α-helix	trans	-60	-46.6	178.6	-68.6	168.2	0	0	0	110.8	I48 W49 S56	I48-I52 HydrophobicContact CG2-CD1 3.82Å; I48-I52 WeakPolarHBondContact O-CG1 3.41Å; I48-I52 PolarHBondContact O-N 2.97Å; W49-I52 HydrophobicContact CE3-CG2 4.49Å; W49-I52 PolarHBondContact O-N 3.1Å; I52-S56 WeakPolarHBondContact O-CB 3.29Å; I52-S56 PolarHBondContact O-N 2.89Å
53	F	91.7	Very high	86.4	Confident	79 Å²	79	58.9 Å²	58.9	35%	0.346	30%	0.302	S	S	.	.	H	α-helix	trans	-62.3	-50.4	179.8	176.3	-98.1	0	0	0	112.3	W49 Y50 V51 I55 S56 S57 Y215 I316	W49-F53 VanDerWaalsContact O-CB 3.27Å; W49-F53 WeakPolarHBondContact O-CB 3.38Å; W49-F53 PolarHBondContact O-N 3.31Å; Y50-F53 PolarHBondContact O-N 2.91Å; V51-F53 PolarHBondContact O-N 3.15Å; F53-I55 PolarHBondContact O-N 3.07Å; F53-S56 PolarHBondContact O-N 2.94Å; F53-S57 VanDerWaalsContact O-CB 3.29Å; F53-S57 WeakPolarHBondContact O-CB 3.46Å; F53-S57 PolarHBondContact O-N 3.29Å; F53-Y215 HydrophobicContact CE1-CE1 4.46Å; F53-I316 HydrophobicContact CE1-CG2 3.81Å; F53-I316 HydrophobicContact CZ-CD1 4.4Å; F53-I316 HydrophobicContact CZ-CG2 3.82Å
54	T	91.2	Very high	87.8	Confident	0 Å²	0	59 Å²	59	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-65.1	-41.1	-177.9	47.4	0	0	0	0	112.6	Y50 V51 I58 Y215	Y50-T54 HydrophobicContact CD2-CG2 4.23Å; Y50-T54 HydrophobicContact CE1-CG2 4.27Å; Y50-T54 HydrophobicContact CE2-CG2 3.79Å; Y50-T54 WeakPolarHBondContact O-CB 3.33Å; Y50-T54 WeakPolarHBondContact O-CG2 3.47Å; Y50-T54 PolarHBondContact O-N 2.68Å; Y50-T54 PolarHBondContact O-OG1 2.62Å; V51-T54 PolarHBondContact O-N 2.74Å; V51-T54 PolarHBondContact O-OG1 2.87Å; T54-I58 WeakPolarHBondContact O-CG1 3.5Å; T54-I58 PolarHBondContact O-N 3.24Å; T54-I58 VanDerWaalsContact O-N 3.11Å; T54-Y215 HydrophobicContact CG2-CD1 4.02Å; T54-Y215 HydrophobicContact CG2-CD2 4.38Å; T54-Y215 HydrophobicContact CG2-CE1 4.25Å; T54-Y215 HydrophobicContact CG2-CG 4.11Å
55	I	92.4	Very high	88.9	Confident	49 Å²	49	57.5 Å²	57.5	25%	0.251	28%	0.283	S	S	.	.	H	α-helix	trans	-66.3	-46.9	175.9	-66.9	177.6	0	0	0	110.9	V51 F53 S57 I58 L59 F105 M108 I109	V51-I55 HydrophobicContact CG1-CD1 3.67Å; V51-I55 HydrophobicContact CG1-CG1 4.44Å; V51-I55 WeakPolarHBondContact O-CB 3.39Å; V51-I55 VanDerWaalsContact O-CG1 3.29Å; V51-I55 WeakPolarHBondContact O-CG1 3.02Å; V51-I55 PolarHBondContact O-N 2.91Å; F53-I55 PolarHBondContact O-N 3.07Å; I55-S57 PolarHBondContact O-N 3.27Å; I55-I58 PolarHBondContact O-N 2.8Å; I55-L59 WeakPolarHBondContact O-CB 3.19Å; I55-L59 PolarHBondContact O-N 3.03Å; I55-F105 HydrophobicContact CG2-CZ 4.24Å; I55-M108 HydrophobicContact CG1-CE 4.48Å; I55-I109 HydrophobicContact CD1-CG1 4.06Å; I55-I109 HydrophobicContact CD1-CG2 4.38Å; I55-I109 HydrophobicContact CG1-CG1 4.08Å
56	S	94	Very high	89.8	Confident	75 Å²	75	55.6 Å²	55.6	52%	0.524	27%	0.273	S	S	.	.	H	α-helix	trans	-62.9	-42.4	179.4	-178	0	0	0	0	112	I52 F53 L59 W60	I52-S56 WeakPolarHBondContact O-CB 3.29Å; I52-S56 PolarHBondContact O-N 2.89Å; F53-S56 PolarHBondContact O-N 2.94Å; S56-L59 PolarHBondContact O-N 3.34Å; S56-W60 WeakPolarHBondContact O-CB 3.31Å; S56-W60 PolarHBondContact O-N 3.03Å
57	S	94.6	Very high	90.8	Very high	12 Å²	12	60.7 Å²	60.7	8%	0.084	28%	0.28	C	S	.	.	H	α-helix	trans	-63.7	-44.3	177.7	-168.2	0	0	0	0	112	F53 I55 W60 L61 Y215 C313	F53-S57 VanDerWaalsContact O-CB 3.29Å; F53-S57 WeakPolarHBondContact O-CB 3.46Å; F53-S57 PolarHBondContact O-N 3.29Å; I55-S57 PolarHBondContact O-N 3.27Å; S57-W60 PolarHBondContact O-N 2.99Å; S57-L61 WeakPolarHBondContact O-CB 3.28Å; S57-L61 WeakPolarHBondContact O-CD1 3.14Å; S57-L61 WeakPolarHBondContact O-CG 3.46Å; S57-L61 PolarHBondContact O-N 3.12Å; S57-Y215 PolarHBondContact OG-OH 3.44Å; S57-C313 PolarHBondContact OG-SG 2.8Å
58	I	94.1	Very high	91.4	Very high	1 Å²	1	61.8 Å²	61.8	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-67.6	-39.7	177.9	-70	165.8	0	0	0	111.3	T54 I55 W60 L61 L62 F105 M108 Y215 I218	T54-I58 WeakPolarHBondContact O-CG1 3.5Å; T54-I58 PolarHBondContact O-N 3.24Å; T54-I58 VanDerWaalsContact O-N 3.11Å; I55-I58 PolarHBondContact O-N 2.8Å; I58-W60 VanDerWaalsContact C-N 3.31Å; I58-W60 PolarHBondContact O-N 2.92Å; I58-L61 PolarHBondContact O-N 3.26Å; I58-L62 WeakPolarHBondContact O-CB 3.17Å; I58-L62 PolarHBondContact O-N 3.22Å; I58-F105 HydrophobicContact CB-CD2 4.12Å; I58-F105 HydrophobicContact CB-CE2 3.75Å; I58-F105 HydrophobicContact CB-CZ 4.4Å; I58-F105 HydrophobicContact CD1-CD2 3.97Å; I58-F105 HydrophobicContact CD1-CE2 4.12Å; I58-F105 HydrophobicContact CG2-CD2 3.56Å; I58-F105 HydrophobicContact CG2-CE2 3.56Å; I58-F105 HydrophobicContact CG2-CG 4.08Å; I58-F105 HydrophobicContact CG2-CZ 4.09Å; I58-M108 HydrophobicContact CD1-CE 3.61Å; I58-Y215 HydrophobicContact CD1-CD2 3.73Å; I58-Y215 HydrophobicContact CD1-CE2 4.3Å; I58-Y215 HydrophobicContact CG1-CD2 3.91Å; I58-Y215 HydrophobicContact CG1-CE2 3.99Å; I58-I218 HydrophobicContact CD1-CB 4.37Å; I58-I218 HydrophobicContact CD1-CD1 3.85Å; I58-I218 HydrophobicContact CD1-CG2 3.9Å; I58-I218 HydrophobicContact CG1-CG2 3.78Å; I58-I218 HydrophobicContact CG2-CG2 4.07Å
59	L	94.3	Very high	91.8	Very high	87 Å²	87	62 Å²	62	46%	0.455	28%	0.279	S	S	.	.	H	α-helix	trans	-61.7	-40.6	176.8	-175.1	61.9	0	0	0	111.6	I55 S56 L62 I63	I55-L59 WeakPolarHBondContact O-CB 3.19Å; I55-L59 PolarHBondContact O-N 3.03Å; S56-L59 PolarHBondContact O-N 3.34Å; L59-L62 PolarHBondContact O-N 3.37Å; L59-I63 HydrophobicContact CD1-CD1 4.49Å; L59-I63 HydrophobicContact CG-CD1 4.23Å; L59-I63 WeakPolarHBondContact O-CD1 3.21Å; L59-I63 VanDerWaalsContact O-CG1 3.28Å; L59-I63 WeakPolarHBondContact O-CG1 3.41Å; L59-I63 PolarHBondContact O-N 2.73Å; L59-I63 VanDerWaalsContact O-N 3.07Å
60	W	95	Very high	92.1	Very high	144 Å²	144	61 Å²	61	55%	0.545	28%	0.279	S	S	.	.	H	α-helix	trans	-64.3	-44.9	174.6	-176.1	-108.8	0	0	0	112.8	S56 S57 I58 I63 R64	S56-W60 WeakPolarHBondContact O-CB 3.31Å; S56-W60 PolarHBondContact O-N 3.03Å; S57-W60 PolarHBondContact O-N 2.99Å; I58-W60 VanDerWaalsContact C-N 3.31Å; I58-W60 PolarHBondContact O-N 2.92Å; W60-I63 PolarHBondContact O-N 2.79Å; W60-R64 PolarHBondContact O-N 3.47Å
61	L	94.3	Very high	92.1	Very high	2 Å²	2	64 Å²	64	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-62.3	-41.4	176.1	-69	165.7	0	0	0	111.8	S57 I58 R64 A65 T219 F222 E310 C313	S57-L61 WeakPolarHBondContact O-CB 3.28Å; S57-L61 WeakPolarHBondContact O-CD1 3.14Å; S57-L61 WeakPolarHBondContact O-CG 3.46Å; S57-L61 PolarHBondContact O-N 3.12Å; I58-L61 PolarHBondContact O-N 3.26Å; L61-R64 PolarHBondContact O-N 2.82Å; L61-A65 WeakPolarHBondContact O-CB 3.38Å; L61-A65 PolarHBondContact O-N 2.83Å; L61-T219 HydrophobicContact CD1-CG2 3.92Å; L61-F222 HydrophobicContact CB-CD2 3.85Å; L61-F222 HydrophobicContact CB-CE2 4.04Å; L61-F222 HydrophobicContact CB-CG 4.37Å; L61-F222 HydrophobicContact CD1-CD2 4.41Å; L61-E310 HydrophobicContact CD2-CB 4.2Å; L61-E310 HydrophobicContact CD2-CG 3.77Å; L61-C313 HydrophobicContact CD1-CB 3.89Å; L61-C313 HydrophobicContact CD2-CB 4.22Å
62	L	94	Very high	92	Very high	22 Å²	22	63.8 Å²	63.8	12%	0.115	29%	0.292	C	S	.	.	H	α-helix	trans	-62.4	-46	176.7	-177.8	69.6	0	0	0	111.7	I58 L59 R64 A65 I66 I98 L102 F222	I58-L62 WeakPolarHBondContact O-CB 3.17Å; I58-L62 PolarHBondContact O-N 3.22Å; L59-L62 PolarHBondContact O-N 3.37Å; L62-R64 PolarHBondContact O-N 3.37Å; L62-A65 PolarHBondContact O-N 3.35Å; L62-I66 HydrophobicContact CD1-CD1 4.37Å; L62-I66 HydrophobicContact CG-CD1 4.1Å; L62-I66 VanDerWaalsContact O-CG1 3.31Å; L62-I66 WeakPolarHBondContact O-CG1 3.36Å; L62-I66 PolarHBondContact O-N 3.34Å; L62-I98 HydrophobicContact CD1-CG2 4.04Å; L62-L102 HydrophobicContact CD1-CD1 4.46Å; L62-L102 HydrophobicContact CD1-CD2 4.08Å; L62-L102 HydrophobicContact CD1-CG 4.16Å; L62-L102 HydrophobicContact CD2-CD2 3.88Å; L62-F222 HydrophobicContact CB-CZ 4.16Å; L62-F222 HydrophobicContact CD1-CE1 4.34Å; L62-F222 HydrophobicContact CD1-CZ 3.98Å
63	I	94.3	Very high	91.8	Very high	65 Å²	65	64.3 Å²	64.3	33%	0.333	29%	0.292	S	S	.	.	H	α-helix	trans	-60.5	-46	176.1	-68.1	163.9	0	0	0	110.3	L59 W60 A65 I66 W67	L59-I63 HydrophobicContact CD1-CD1 4.49Å; L59-I63 HydrophobicContact CG-CD1 4.23Å; L59-I63 WeakPolarHBondContact O-CD1 3.21Å; L59-I63 VanDerWaalsContact O-CG1 3.28Å; L59-I63 WeakPolarHBondContact O-CG1 3.41Å; L59-I63 PolarHBondContact O-N 2.73Å; L59-I63 VanDerWaalsContact O-N 3.07Å; W60-I63 PolarHBondContact O-N 2.79Å; I63-A65 PolarHBondContact O-N 3.16Å; I63-I66 PolarHBondContact O-N 2.96Å; I63-W67 HydrophobicContact CG2-CZ2 4.46Å; I63-W67 PolarHBondContact O-N 3.4Å
64	R	92.4	Very high	91.5	Very high	79 Å²	79	65 Å²	65	30%	0.298	30%	0.298	S	S	.	.	H	α-helix	trans	-61.3	-41.2	174.8	-81.6	-171.7	130.2	-121	-0.9	113	W60 L61 L62 I66 W67 R68 E310	W60-R64 PolarHBondContact O-N 3.47Å; L61-R64 PolarHBondContact O-N 2.82Å; L62-R64 PolarHBondContact O-N 3.37Å; R64-I66 VanDerWaalsContact C-N 3.34Å; R64-I66 PolarHBondContact O-N 2.9Å; R64-W67 PolarHBondContact O-N 2.84Å; R64-R68 VanDerWaalsContact O-CB 3.28Å; R64-R68 WeakPolarHBondContact O-CB 3.47Å; R64-R68 PolarHBondContact O-N 2.92Å; R64-E310 IonicContact CZ-OE1 2.73Å; R64-E310 IonicContact NH1-OE1 3.48Å; R64-E310 PolarHBondContact NH1-OE1 3.13Å; R64-E310 IonicContact NH1-OE2 3.54Å; R64-E310 PolarHBondContact NH1-OE2 3.36Å
65	A	91.7	Very high	91.1	Very high	6 Å²	6	65.4 Å²	65.4	5%	0.05	30%	0.3	C	S	.	.	H	α-helix	trans	-64.9	-37.7	179	0	0	0	0	0	112.3	L61 L62 I63 Y69 Q94 I98 F222	L61-A65 WeakPolarHBondContact O-CB 3.38Å; L61-A65 PolarHBondContact O-N 2.83Å; L62-A65 PolarHBondContact O-N 3.35Å; I63-A65 PolarHBondContact O-N 3.16Å; A65-Y69 VanDerWaalsContact O-CB 3.29Å; A65-Y69 WeakPolarHBondContact O-CB 3.17Å; A65-Y69 PolarHBondContact O-N 3.08Å; A65-Q94 PolarHBondContact O-NE2 3.07Å; A65-Q94 VanDerWaalsContact O-NE2 3.13Å; A65-I98 HydrophobicContact CB-CD1 4.15Å; A65-I98 HydrophobicContact CB-CG1 4.03Å; A65-F222 HydrophobicContact CB-CD1 3.6Å; A65-F222 HydrophobicContact CB-CE1 3.57Å
66	I	92.5	Very high	90.5	Very high	85 Å²	85	63.4 Å²	63.4	44%	0.436	29%	0.291	S	S	.	.	H	α-helix	trans	-68.5	-43.9	174.1	-67	164.3	0	0	0	111	L62 I63 R64 Y69 K70	L62-I66 HydrophobicContact CD1-CD1 4.37Å; L62-I66 HydrophobicContact CG-CD1 4.1Å; L62-I66 VanDerWaalsContact O-CG1 3.31Å; L62-I66 WeakPolarHBondContact O-CG1 3.36Å; L62-I66 PolarHBondContact O-N 3.34Å; I63-I66 PolarHBondContact O-N 2.96Å; R64-I66 VanDerWaalsContact C-N 3.34Å; R64-I66 PolarHBondContact O-N 2.9Å; I66-Y69 PolarHBondContact O-N 3.32Å; I66-K70 PolarHBondContact O-N 3.01Å
67	W	92.1	Very high	89.8	Confident	189 Å²	189	66 Å²	66	72%	0.716	29%	0.29	S	S	*	.	H	α-helix	trans	-63.1	-45.5	176.1	-75.1	18.7	0	0	0	111.6	I63 R64 Y69 K70 E71	I63-W67 HydrophobicContact CG2-CZ2 4.46Å; I63-W67 PolarHBondContact O-N 3.4Å; R64-W67 PolarHBondContact O-N 2.84Å; W67-Y69 VanDerWaalsContact C-N 3.35Å; W67-Y69 PolarHBondContact O-N 3.45Å; W67-K70 PolarHBondContact O-N 3.2Å; W67-E71 WeakPolarHBondContact O-CB 3.38Å; W67-E71 PolarHBondContact O-N 2.94Å
68	R	88.8	Confident	88.9	Confident	55 Å²	55	68.4 Å²	68.4	21%	0.208	30%	0.302	C	S	.	.	H	α-helix	trans	-60.6	-41.7	176.2	-169.1	-171.2	-63.8	-116.8	8.3	112	R64 E71 F72 M229 E310	R64-R68 VanDerWaalsContact O-CB 3.28Å; R64-R68 WeakPolarHBondContact O-CB 3.47Å; R64-R68 PolarHBondContact O-N 2.92Å; R68-E71 PolarHBondContact O-N 3.47Å; R68-F72 WeakPolarHBondContact O-CB 3.14Å; R68-F72 PolarHBondContact O-N 2.87Å; R68-M229 HydrophobicContact CG-CE 4.35Å; R68-M229 HydrophobicContact CG-SD 4.16Å; R68-E310 IonicContact CZ-OE1 3.51Å; R68-E310 IonicContact NH2-OE1 3.46Å; R68-E310 PolarHBondContact NH2-OE1 3.37Å; R68-E310 IonicContact NH2-OE2 2.76Å; R68-E310 PolarHBondContact NH2-OE2 2.83Å; R68-E310 VanDerWaalsContact NH2-OE2 3.12Å
69	Y	90.7	Very high	87.8	Confident	61 Å²	61	73.6 Å²	73.6	24%	0.239	34%	0.336	C	S	.	.	H	α-helix	trans	-62.8	-43	174.1	173.1	-90.4	0	0	0	112.2	A65 I66 W67 K73 L91 Q94 L95	A65-Y69 VanDerWaalsContact O-CB 3.29Å; A65-Y69 WeakPolarHBondContact O-CB 3.17Å; A65-Y69 PolarHBondContact O-N 3.08Å; I66-Y69 PolarHBondContact O-N 3.32Å; W67-Y69 VanDerWaalsContact C-N 3.35Å; W67-Y69 PolarHBondContact O-N 3.45Å; Y69-K73 VanDerWaalsContact O-CB 3.26Å; Y69-K73 WeakPolarHBondContact O-CB 3.48Å; Y69-K73 PolarHBondContact O-N 3.01Å; Y69-L91 HydrophobicContact CD2-CG 4.24Å; Y69-L91 HydrophobicContact CE2-CD1 4.34Å; Y69-L91 HydrophobicContact CE2-CD2 3.57Å; Y69-L91 HydrophobicContact CE2-CG 3.6Å; Y69-L91 WeakPolarHBondContact OH-CD2 3.49Å; Y69-Q94 HydrophobicContact CD2-CB 4.42Å; Y69-Q94 HydrophobicContact CD2-CG 3.85Å; Y69-Q94 HydrophobicContact CG-CG 4.47Å; Y69-L95 HydrophobicContact CE2-CB 4.19Å
70	K	90.3	Very high	86.7	Confident	141 Å²	141	73 Å²	73	61%	0.613	33%	0.327	S	S	*	.	H	α-helix	trans	-62.4	-45.2	174.9	-175.4	-169.5	172.8	-167.5	0	111.4	I66 W67 K73 I74	I66-K70 PolarHBondContact O-N 3.01Å; W67-K70 PolarHBondContact O-N 3.2Å; K70-K73 PolarHBondContact O-N 3.34Å; K70-I74 HydrophobicContact CG-CD1 4.1Å; K70-I74 WeakPolarHBondContact O-CG1 3.39Å; K70-I74 PolarHBondContact O-N 3.01Å
71	E	86.6	Confident	85.4	Confident	96 Å²	96	67.2 Å²	67.2	45%	0.449	31%	0.306	S	S	.	.	H	α-helix	trans	-64.1	-51	-178.7	-174.4	56.8	-148.1	0	0	111.6	W67 R68 K73 I74 Q75	W67-E71 WeakPolarHBondContact O-CB 3.38Å; W67-E71 PolarHBondContact O-N 2.94Å; R68-E71 PolarHBondContact O-N 3.47Å; E71-K73 VanDerWaalsContact C-N 3.27Å; E71-K73 PolarHBondContact O-N 3.33Å; E71-I74 PolarHBondContact O-N 3.46Å; E71-I74 VanDerWaalsContact O-N 3.08Å; E71-Q75 WeakPolarHBondContact O-CG 3.17Å; E71-Q75 PolarHBondContact O-N 3.49Å; E71-Q75 PolarHBondContact OE1-NE2 3.25Å
72	F	85.6	Confident	83.8	Confident	5 Å²	5	68.6 Å²	68.6	2%	0.022	32%	0.321	C	S	.	.	H	α-helix	trans	-57.8	-40	174.3	-174.9	-83.6	0	0	0	111.7	R68 I74 Q75 A76 W85 T90 L91 M229 E232 Q233	R68-F72 WeakPolarHBondContact O-CB 3.14Å; R68-F72 PolarHBondContact O-N 2.87Å; F72-I74 PolarHBondContact O-N 2.97Å; F72-Q75 PolarHBondContact O-N 3.18Å; F72-A76 WeakPolarHBondContact O-CB 3.24Å; F72-A76 PolarHBondContact O-N 3.03Å; F72-W85 HydrophobicContact CE2-CE3 4.47Å; F72-W85 AromaticContact CE2-CZ3 3.98Å; F72-W85 HydrophobicContact CE2-CZ3 3.98Å; F72-W85 HydrophobicContact CZ-CE3 4.06Å; F72-W85 HydrophobicContact CZ-CZ3 4.04Å; F72-T90 HydrophobicContact CE1-CG2 4.07Å; F72-T90 HydrophobicContact CE2-CG2 4.17Å; F72-T90 HydrophobicContact CZ-CG2 3.6Å; F72-L91 HydrophobicContact CD1-CD1 4.47Å; F72-M229 HydrophobicContact CD2-CB 3.89Å; F72-M229 HydrophobicContact CD2-CG 3.85Å; F72-M229 HydrophobicContact CD2-SD 4.5Å; F72-M229 HydrophobicContact CE2-CB 3.98Å; F72-M229 HydrophobicContact CE2-CG 4.01Å; F72-M229 HydrophobicContact CG-CG 4.31Å; F72-E232 HydrophobicContact CE2-CB 4.29Å; F72-E232 HydrophobicContact CZ-CB 4.21Å; F72-Q233 HydrophobicContact CD2-CG 3.86Å; F72-Q233 HydrophobicContact CE2-CG 3.91Å
73	K	87.4	Confident	82.4	Confident	97 Å²	97	75.2 Å²	75.2	42%	0.422	36%	0.357	S	S	.	.	H	α-helix	trans	-63	-38.6	175.9	-169.2	-175.4	178.9	-171.9	0	112.5	Y69 K70 E71 Y77 L91	Y69-K73 VanDerWaalsContact O-CB 3.26Å; Y69-K73 WeakPolarHBondContact O-CB 3.48Å; Y69-K73 PolarHBondContact O-N 3.01Å; K70-K73 PolarHBondContact O-N 3.34Å; E71-K73 VanDerWaalsContact C-N 3.27Å; E71-K73 PolarHBondContact O-N 3.33Å; K73-Y77 HydrophobicContact CD-CE2 4.27Å; K73-Y77 VanDerWaalsContact CE-CE2 3.49Å; K73-Y77 HydrophobicContact CG-CD2 3.87Å; K73-Y77 HydrophobicContact CG-CE2 3.62Å; K73-Y77 WeakPolarHBondContact O-CD2 3.27Å; K73-Y77 PolarHBondContact O-N 3.22Å; K73-L91 HydrophobicContact CB-CD1 4.12Å; K73-L91 HydrophobicContact CG-CD1 4.11Å
74	I	85.3	Confident	81.3	Confident	93 Å²	93	79.9 Å²	79.9	48%	0.477	37%	0.374	S	S	.	.	H	α-helix	trans	-67.1	-44.6	176.5	-69.9	164.1	0	0	0	110.1	K70 E71 F72 A76 Y77 D78	K70-I74 HydrophobicContact CG-CD1 4.1Å; K70-I74 WeakPolarHBondContact O-CG1 3.39Å; K70-I74 PolarHBondContact O-N 3.01Å; E71-I74 PolarHBondContact O-N 3.46Å; E71-I74 VanDerWaalsContact O-N 3.08Å; F72-I74 PolarHBondContact O-N 2.97Å; I74-A76 PolarHBondContact O-N 3.36Å; I74-Y77 PolarHBondContact O-N 3.4Å; I74-D78 PolarHBondContact O-N 3.05Å; I74-D78 VanDerWaalsContact O-N 3.12Å
75	Q	82.1	Confident	80.5	Confident	9 Å²	9	77 Å²	77	4%	0.042	36%	0.364	C	S	.	.	H	α-helix	trans	-65.8	-35.5	-179.7	-66	175	9.6	0	0	113	E71 F72	E71-Q75 WeakPolarHBondContact O-CG 3.17Å; E71-Q75 PolarHBondContact O-N 3.49Å; E71-Q75 PolarHBondContact OE1-NE2 3.25Å; F72-Q75 PolarHBondContact O-N 3.18Å
76	A	80.3	Confident	79.8	Confident	8 Å²	8	79.6 Å²	79.6	7%	0.066	38%	0.376	C	S	.	.	H	α-helix	trans	-68.4	-32.9	176.9	0	0	0	0	0	113.5	F72 I74 W85 E87	F72-A76 WeakPolarHBondContact O-CB 3.24Å; F72-A76 PolarHBondContact O-N 3.03Å; I74-A76 PolarHBondContact O-N 3.36Å; A76-W85 HydrophobicContact CB-CD2 4.16Å; A76-W85 HydrophobicContact CB-CE3 4.41Å; A76-W85 HydrophobicContact CB-CG 4.29Å; A76-E87 HydrophobicContact CB-CG 4.35Å
77	Y	78.8	Confident	78.8	Confident	129 Å²	129	78 Å²	78	51%	0.506	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	2.8	177.9	-63.8	-52.6	0	0	0	114.6	K73 I74 P79 E87	K73-Y77 HydrophobicContact CD-CE2 4.27Å; K73-Y77 VanDerWaalsContact CE-CE2 3.49Å; K73-Y77 HydrophobicContact CG-CD2 3.87Å; K73-Y77 HydrophobicContact CG-CE2 3.62Å; K73-Y77 WeakPolarHBondContact O-CD2 3.27Å; K73-Y77 PolarHBondContact O-N 3.22Å; I74-Y77 PolarHBondContact O-N 3.4Å; Y77-P79 WeakPolarHBondContact O-CD 3.18Å; Y77-E87 WeakPolarHBondContact CE1-OE1 3.42Å; Y77-E87 WeakPolarHBondContact CE1-OE2 3.42Å; Y77-E87 PolarHBondContact OH-OE2 3.06Å
78	D	75.8	Confident	78.2	Confident	63 Å²	63	74.4 Å²	74.4	34%	0.337	36%	0.361	S	S	.	.			trans	-77.8	117.2	171.4	179.5	-8.4	0	0	0	109.3	I74 R80 F81	I74-D78 PolarHBondContact O-N 3.05Å; I74-D78 VanDerWaalsContact O-N 3.12Å; D78-R80 PolarHBondContact O-N 3.14Å; D78-R80 WeakPolarHBondContact OD1-CB 3.47Å; D78-R80 PolarHBondContact OD1-N 3.14Å; D78-F81 HydrophobicContact CB-CD2 3.94Å; D78-F81 HydrophobicContact CB-CE2 4.05Å; D78-F81 PolarHBondContact O-N 2.86Å; D78-F81 WeakPolarHBondContact OD2-CE2 3.42Å
79	P	72.2	Confident	78	Confident	110 Å²	110	75.4 Å²	75.4	71%	0.714	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-59.6	-15.8	-178.3	25.8	-35.7	0	0	0	113.7	Y77 F81 G82	Y77-P79 WeakPolarHBondContact O-CD 3.18Å; P79-F81 PolarHBondContact O-N 3.25Å; P79-G82 PolarHBondContact O-N 3.44Å
80	R	70	Confident	77.8	Confident	73 Å²	73	72.6 Å²	72.6	28%	0.275	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-54.9	-32.5	173.9	178.3	178.4	165.5	-165.6	-7.1	113.9	D78 A299	D78-R80 PolarHBondContact O-N 3.14Å; D78-R80 WeakPolarHBondContact OD1-CB 3.47Å; D78-R80 PolarHBondContact OD1-N 3.14Å; R80-A299 PolarHBondContact NH2-O 3.18Å
81	F	67.6	Low	77.6	Confident	24 Å²	24	66.9 Å²	66.9	11%	0.105	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-101.4	-2.3	-172.3	-54.3	-74.9	0	0	0	114.2	D78 P79 W85 N236 A238 P301	D78-F81 HydrophobicContact CB-CD2 3.94Å; D78-F81 HydrophobicContact CB-CE2 4.05Å; D78-F81 PolarHBondContact O-N 2.86Å; D78-F81 WeakPolarHBondContact OD2-CE2 3.42Å; P79-F81 PolarHBondContact O-N 3.25Å; F81-W85 HydrophobicContact CB-CZ2 3.75Å; F81-W85 HydrophobicContact CG-CZ2 4.18Å; F81-N236 WeakPolarHBondContact CD1-O 3.3Å; F81-A238 HydrophobicContact CD1-CB 4.43Å; F81-A238 HydrophobicContact CE1-CB 4.3Å; F81-P301 HydrophobicContact CE1-CG 4.25Å; F81-P301 HydrophobicContact CZ-CG 3.77Å
82	G	62.2	Low	77.9	Confident	31 Å²	31	67.5 Å²	67.5	32%	0.32	34%	0.338	S	S	.	.			trans	74.7	151.7	173.8	0	0	0	0	0	115.4	P79 K84 W85	P79-G82 PolarHBondContact O-N 3.44Å; G82-K84 PolarHBondContact O-N 2.96Å; G82-W85 PolarHBondContact O-NE1 3.03Å
83	N	63.6	Low	78.1	Confident	161 Å²	161	69.2 Å²	69.2	86%	0.861	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	41.2	-168	-56.4	10	0	0	0	113.8
84	K	70.7	Confident	78.3	Confident	162 Å²	162	64.8 Å²	64.8	70%	0.704	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.7	12	-179.2	-70.4	-173.8	-178.3	174.3	0	114.3	G82	G82-K84 PolarHBondContact O-N 2.96Å
85	W	75.7	Confident	78.6	Confident	20 Å²	20	63.2 Å²	63.2	8%	0.076	32%	0.319	C	S	.	.			trans	-64.1	135.8	173.9	-66.7	87.9	0	0	0	111.5	F72 A76 F81 G82 E87 E232 Q233 N236 A238	F72-W85 HydrophobicContact CE2-CE3 4.47Å; F72-W85 AromaticContact CE2-CZ3 3.98Å; F72-W85 HydrophobicContact CE2-CZ3 3.98Å; F72-W85 HydrophobicContact CZ-CE3 4.06Å; F72-W85 HydrophobicContact CZ-CZ3 4.04Å; A76-W85 HydrophobicContact CB-CD2 4.16Å; A76-W85 HydrophobicContact CB-CE3 4.41Å; A76-W85 HydrophobicContact CB-CG 4.29Å; F81-W85 HydrophobicContact CB-CZ2 3.75Å; F81-W85 HydrophobicContact CG-CZ2 4.18Å; G82-W85 PolarHBondContact O-NE1 3.03Å; W85-E87 HydrophobicContact CB-CG 3.7Å; W85-E87 PolarHBondContact O-N 3.11Å; W85-E232 HydrophobicContact CE3-CB 4.29Å; W85-E232 HydrophobicContact CZ3-CB 4.31Å; W85-Q233 HydrophobicContact CH2-CG 4.3Å; W85-Q233 HydrophobicContact CZ3-CG 4.23Å; W85-N236 HydrophobicContact CD2-CB 4.14Å; W85-N236 HydrophobicContact CE3-CB 4.44Å; W85-N236 HydrophobicContact CH2-CB 3.96Å; W85-N236 HydrophobicContact CZ2-CB 3.61Å; W85-N236 HydrophobicContact CZ3-CB 4.35Å; W85-A238 HydrophobicContact CH2-CB 4.17Å
86	D	76.5	Confident	79.1	Confident	59 Å²	59	65.3 Å²	65.3	32%	0.316	34%	0.337	S	S	.	.			trans	-83.4	60.3	168.3	-166	28	0	0	0	109.9	I88 N89 T90 E232	D86-I88 PolarHBondContact O-N 3.25Å; D86-N89 VanDerWaalsContact CG-ND2 3.31Å; D86-N89 PolarHBondContact OD1-ND2 3.09Å; D86-N89 PolarHBondContact OD2-ND2 3.46Å; D86-T90 PolarHBondContact O-N 3.23Å; D86-T90 PolarHBondContact O-OG1 2.66Å; D86-T90 VanDerWaalsContact O-OG1 3.12Å; D86-E232 PolarHBondContact N-OE2 2.9Å
87	E	72.5	Confident	79.7	Confident	51 Å²	51	65.3 Å²	65.3	24%	0.238	34%	0.337	C	S	.	.	H	α-helix	trans	-54.1	-52.2	-169.8	-63.7	179.3	-155.8	0	0	111.8	A76 Y77 W85 N89 T90 L91	A76-E87 HydrophobicContact CB-CG 4.35Å; Y77-E87 WeakPolarHBondContact CE1-OE1 3.42Å; Y77-E87 WeakPolarHBondContact CE1-OE2 3.42Å; Y77-E87 PolarHBondContact OH-OE2 3.06Å; W85-E87 HydrophobicContact CB-CG 3.7Å; W85-E87 PolarHBondContact O-N 3.11Å; E87-N89 PolarHBondContact O-N 3.13Å; E87-T90 PolarHBondContact O-N 2.86Å; E87-L91 WeakPolarHBondContact O-CB 3.15Å; E87-L91 PolarHBondContact O-N 3.14Å
88	I	80.1	Confident	80.4	Confident	114 Å²	114	59.7 Å²	59.7	59%	0.585	32%	0.316	S	S	*	.	H	α-helix	trans	-56.9	-54.9	-168.9	-65.2	174.7	0	0	0	109.7	D86 H92	D86-I88 PolarHBondContact O-N 3.25Å; I88-H92 WeakPolarHBondContact O-CB 3.26Å; I88-H92 PolarHBondContact O-CD2 3.21Å; I88-H92 VanDerWaalsContact O-CG 3.25Å; I88-H92 PolarHBondContact O-N 3.1Å; I88-H92 VanDerWaalsContact O-N 3.08Å
89	N	84	Confident	81.3	Confident	77 Å²	77	61 Å²	61	41%	0.412	32%	0.322	S	S	.	.	H	α-helix	trans	-65.3	-46.2	-176.3	-63.6	-39.2	0	0	0	111.6	D86 E87 F93 W390	D86-N89 VanDerWaalsContact CG-ND2 3.31Å; D86-N89 PolarHBondContact OD1-ND2 3.09Å; D86-N89 PolarHBondContact OD2-ND2 3.46Å; E87-N89 PolarHBondContact O-N 3.13Å; N89-F93 VanDerWaalsContact O-CB 3.24Å; N89-F93 WeakPolarHBondContact O-CB 3.38Å; N89-F93 PolarHBondContact O-N 3.01Å; N89-W390 HydrophobicContact CB-CZ2 3.95Å
90	T	86.4	Confident	82.3	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.012	31%	0.309	C	S	.	.	H	α-helix	trans	-70.8	-45.9	-174.6	-54.8	0	0	0	0	112.2	F72 D86 E87 F93 Q94 I228 M229	F72-T90 HydrophobicContact CE1-CG2 4.07Å; F72-T90 HydrophobicContact CE2-CG2 4.17Å; F72-T90 HydrophobicContact CZ-CG2 3.6Å; D86-T90 PolarHBondContact O-N 3.23Å; D86-T90 PolarHBondContact O-OG1 2.66Å; D86-T90 VanDerWaalsContact O-OG1 3.12Å; E87-T90 PolarHBondContact O-N 2.86Å; T90-F93 PolarHBondContact O-N 3.18Å; T90-Q94 PolarHBondContact O-N 2.84Å; T90-Q94 VanDerWaalsContact O-N 3.12Å; T90-I228 HydrophobicContact CG2-CG2 3.92Å; T90-M229 HydrophobicContact CG2-CG 3.95Å
91	L	87.2	Confident	83.4	Confident	20 Å²	20	56.5 Å²	56.5	11%	0.105	30%	0.297	C	S	.	.	H	α-helix	trans	-76.5	-36.4	-174.6	-169.7	144.5	0	0	0	111.8	Y69 F72 K73 E87 F93 L95	Y69-L91 HydrophobicContact CD2-CG 4.24Å; Y69-L91 HydrophobicContact CE2-CD1 4.34Å; Y69-L91 HydrophobicContact CE2-CD2 3.57Å; Y69-L91 HydrophobicContact CE2-CG 3.6Å; Y69-L91 WeakPolarHBondContact OH-CD2 3.49Å; F72-L91 HydrophobicContact CD1-CD1 4.47Å; K73-L91 HydrophobicContact CB-CD1 4.12Å; K73-L91 HydrophobicContact CG-CD1 4.11Å; E87-L91 WeakPolarHBondContact O-CB 3.15Å; E87-L91 PolarHBondContact O-N 3.14Å; L91-F93 VanDerWaalsContact C-N 3.32Å; L91-L95 WeakPolarHBondContact O-CB 3.46Å; L91-L95 PolarHBondContact O-N 3.3Å; L91-L95 VanDerWaalsContact O-N 3.11Å
92	H	91.1	Very high	84.7	Confident	110 Å²	110	59.2 Å²	59.2	51%	0.509	31%	0.312	S	S	.	.	H	α-helix	trans	-65.6	-33.3	169.3	-71	-43.7	0	0	0	112.5	I88 L95 A96	I88-H92 WeakPolarHBondContact O-CB 3.26Å; I88-H92 PolarHBondContact O-CD2 3.21Å; I88-H92 VanDerWaalsContact O-CG 3.25Å; I88-H92 PolarHBondContact O-N 3.1Å; I88-H92 VanDerWaalsContact O-N 3.08Å; H92-L95 PolarHBondContact O-N 3.3Å; H92-A96 VanDerWaalsContact O-CB 3.31Å; H92-A96 WeakPolarHBondContact O-CB 3.42Å; H92-A96 PolarHBondContact O-N 2.85Å
93	F	90.7	Very high	86.2	Confident	40 Å²	40	61.2 Å²	61.2	18%	0.175	32%	0.32	C	S	.	.	H	α-helix	trans	-71.9	-41.1	179.7	-170	-91	0	0	0	113.3	N89 T90 L91 L95 A96 S97 L224 P225 I228 W390 L394	N89-F93 VanDerWaalsContact O-CB 3.24Å; N89-F93 WeakPolarHBondContact O-CB 3.38Å; N89-F93 PolarHBondContact O-N 3.01Å; T90-F93 PolarHBondContact O-N 3.18Å; L91-F93 VanDerWaalsContact C-N 3.32Å; F93-L95 VanDerWaalsContact C-N 3.31Å; F93-L95 PolarHBondContact O-N 2.76Å; F93-A96 PolarHBondContact O-N 3.14Å; F93-S97 WeakPolarHBondContact O-CB 3.39Å; F93-S97 PolarHBondContact O-N 3.21Å; F93-S97 PolarHBondContact O-OG 3.34Å; F93-L224 HydrophobicContact CE1-CD2 3.4Å; F93-L224 VanDerWaalsContact CE1-CD2 3.4Å; F93-L224 HydrophobicContact CZ-CD2 3.43Å; F93-L224 VanDerWaalsContact CZ-CD2 3.43Å; F93-P225 HydrophobicContact CD1-CB 4.13Å; F93-P225 HydrophobicContact CD1-CG 4.03Å; F93-P225 HydrophobicContact CE1-CB 4.32Å; F93-P225 HydrophobicContact CE1-CG 3.9Å; F93-I228 HydrophobicContact CD1-CD1 3.69Å; F93-I228 HydrophobicContact CE1-CD1 3.79Å; F93-I228 HydrophobicContact CG-CD1 4.27Å; F93-I228 HydrophobicContact CZ-CD1 4.44Å; F93-W390 HydrophobicContact CB-CH2 3.77Å; F93-W390 HydrophobicContact CD1-CH2 4.36Å; F93-W390 AromaticContact CD2-CH2 3.68Å; F93-W390 HydrophobicContact CD2-CH2 3.68Å; F93-W390 AromaticContact CD2-CZ3 3.66Å; F93-W390 HydrophobicContact CD2-CZ3 3.66Å; F93-W390 HydrophobicContact CE2-CH2 4.38Å; F93-W390 AromaticContact CE2-CZ3 3.95Å; F93-W390 HydrophobicContact CE2-CZ3 3.95Å; F93-W390 AromaticContact CG-CH2 3.67Å; F93-W390 HydrophobicContact CG-CH2 3.67Å; F93-W390 HydrophobicContact CG-CZ3 4.08Å; F93-L394 HydrophobicContact CE2-CD2 4.36Å
94	Q	91.3	Very high	87.6	Confident	5 Å²	5	54.8 Å²	54.8	2%	0.023	29%	0.286	C	S	.	.	H	α-helix	trans	-58.7	-44.5	168.8	173.5	63.2	-3.4	0	0	110.8	A65 Y69 T90 S97 I98 P225 M229	A65-Q94 PolarHBondContact O-NE2 3.07Å; A65-Q94 VanDerWaalsContact O-NE2 3.13Å; Y69-Q94 HydrophobicContact CD2-CB 4.42Å; Y69-Q94 HydrophobicContact CD2-CG 3.85Å; Y69-Q94 HydrophobicContact CG-CG 4.47Å; T90-Q94 PolarHBondContact O-N 2.84Å; T90-Q94 VanDerWaalsContact O-N 3.12Å; Q94-S97 PolarHBondContact O-N 3.42Å; Q94-I98 HydrophobicContact CG-CD1 4.14Å; Q94-I98 WeakPolarHBondContact O-CG1 3.46Å; Q94-I98 PolarHBondContact O-N 3.08Å; Q94-I98 VanDerWaalsContact O-N 3.08Å; Q94-P225 HydrophobicContact CB-CB 4.48Å; Q94-M229 HydrophobicContact CB-CE 4.43Å; Q94-M229 HydrophobicContact CB-SD 4.24Å; Q94-M229 HydrophobicContact CG-CE 4.19Å; Q94-M229 HydrophobicContact CG-SD 4.02Å
95	L	91.9	Very high	88.6	Confident	60 Å²	60	48.6 Å²	48.6	31%	0.314	26%	0.259	S	S	.	.	H	α-helix	trans	-63.6	-45	178	-177	62.9	0	0	0	112.5	Y69 L91 H92 F93 S97 I98 I99	Y69-L95 HydrophobicContact CE2-CB 4.19Å; L91-L95 WeakPolarHBondContact O-CB 3.46Å; L91-L95 PolarHBondContact O-N 3.3Å; L91-L95 VanDerWaalsContact O-N 3.11Å; H92-L95 PolarHBondContact O-N 3.3Å; F93-L95 VanDerWaalsContact C-N 3.31Å; F93-L95 PolarHBondContact O-N 2.76Å; L95-S97 VanDerWaalsContact C-N 3.28Å; L95-S97 PolarHBondContact O-N 3.22Å; L95-I98 PolarHBondContact O-N 2.79Å; L95-I99 HydrophobicContact CD1-CD1 4.25Å; L95-I99 HydrophobicContact CG-CD1 3.92Å; L95-I99 VanDerWaalsContact O-CG1 3.3Å; L95-I99 WeakPolarHBondContact O-CG1 3.43Å; L95-I99 PolarHBondContact O-N 2.98Å
96	A	92.7	Very high	89.4	Confident	52 Å²	52	51.2 Å²	51.2	43%	0.43	28%	0.278	S	S	.	.	H	α-helix	trans	-61.4	-37.1	177.8	0	0	0	0	0	112	H92 F93 I99 L100	H92-A96 VanDerWaalsContact O-CB 3.31Å; H92-A96 WeakPolarHBondContact O-CB 3.42Å; H92-A96 PolarHBondContact O-N 2.85Å; F93-A96 PolarHBondContact O-N 3.14Å; A96-I99 PolarHBondContact O-N 3.16Å; A96-L100 WeakPolarHBondContact O-CB 3.39Å; A96-L100 PolarHBondContact O-N 3.36Å
97	S	92.6	Very high	90	Very high	8 Å²	8	51.5 Å²	51.5	6%	0.056	28%	0.279	C	S	.	.	H	α-helix	trans	-69.3	-40	177.6	-56.9	0	0	0	0	112.1	F93 Q94 L95 S101 L221 P225	F93-S97 WeakPolarHBondContact O-CB 3.39Å; F93-S97 PolarHBondContact O-N 3.21Å; F93-S97 PolarHBondContact O-OG 3.34Å; Q94-S97 PolarHBondContact O-N 3.42Å; L95-S97 VanDerWaalsContact C-N 3.28Å; L95-S97 PolarHBondContact O-N 3.22Å; S97-S101 WeakPolarHBondContact O-CB 3.34Å; S97-S101 PolarHBondContact O-N 2.93Å; S97-L221 WeakPolarHBondContact CB-O 3.39Å; S97-P225 WeakPolarHBondContact OG-CG 3.45Å
98	I	94.1	Very high	90.9	Very high	12 Å²	12	49 Å²	49	6%	0.062	27%	0.268	C	S	.	.	H	α-helix	trans	-62	-46.3	171.2	-67.9	165.2	0	0	0	110.8	L62 A65 Q94 L95 S101 L102 F222	L62-I98 HydrophobicContact CD1-CG2 4.04Å; A65-I98 HydrophobicContact CB-CD1 4.15Å; A65-I98 HydrophobicContact CB-CG1 4.03Å; Q94-I98 HydrophobicContact CG-CD1 4.14Å; Q94-I98 WeakPolarHBondContact O-CG1 3.46Å; Q94-I98 PolarHBondContact O-N 3.08Å; Q94-I98 VanDerWaalsContact O-N 3.08Å; L95-I98 PolarHBondContact O-N 2.79Å; I98-S101 PolarHBondContact O-N 3.22Å; I98-L102 HydrophobicContact CG2-CD1 3.95Å; I98-L102 WeakPolarHBondContact O-CG 3.35Å; I98-L102 PolarHBondContact O-N 3.35Å; I98-F222 HydrophobicContact CG1-CE1 4.26Å
99	I	94.7	Very high	91.3	Very high	90 Å²	90	45.8 Å²	45.8	46%	0.462	25%	0.251	S	S	.	.	H	α-helix	trans	-61.8	-47.5	178.8	-68.6	165.8	0	0	0	110.8	L95 A96 S101 L102 C103	L95-I99 HydrophobicContact CD1-CD1 4.25Å; L95-I99 HydrophobicContact CG-CD1 3.92Å; L95-I99 VanDerWaalsContact O-CG1 3.3Å; L95-I99 WeakPolarHBondContact O-CG1 3.43Å; L95-I99 PolarHBondContact O-N 2.98Å; A96-I99 PolarHBondContact O-N 3.16Å; I99-S101 VanDerWaalsContact C-N 3.33Å; I99-S101 PolarHBondContact O-N 3.12Å; I99-L102 WeakPolarHBondContact O-CB 3.49Å; I99-L102 PolarHBondContact O-N 3.42Å; I99-L102 VanDerWaalsContact O-N 3.07Å; I99-C103 PolarHBondContact O-N 2.72Å; I99-C103 PolarHBondContact O-SG 3.01Å; I99-C103 VanDerWaalsContact O-SG 3.4Å
100	L	93.6	Very high	91.4	Very high	87 Å²	87	48 Å²	48	46%	0.455	26%	0.255	S	S	.	.	H	α-helix	trans	-63.9	-39	179.5	-175.2	57.7	0	0	0	111.7	A96 L102 C103 L104 L221	A96-L100 WeakPolarHBondContact O-CB 3.39Å; A96-L100 PolarHBondContact O-N 3.36Å; L100-L102 VanDerWaalsContact C-N 3.35Å; L100-C103 PolarHBondContact O-N 2.99Å; L100-L104 HydrophobicContact CD1-CD1 4.47Å; L100-L104 HydrophobicContact CG-CD1 4.24Å; L100-L104 VanDerWaalsContact O-CG 3.31Å; L100-L104 WeakPolarHBondContact O-CG 3.48Å; L100-L104 PolarHBondContact O-N 3.35Å; L100-L104 VanDerWaalsContact O-N 3.1Å; L100-L221 HydrophobicContact CB-CD1 4.26Å; L100-L221 HydrophobicContact CD2-CD1 3.75Å; L100-L221 HydrophobicContact CD2-CD2 3.83Å; L100-L221 HydrophobicContact CD2-CG 4.47Å; L100-L221 HydrophobicContact CG-CD1 3.73Å
101	S	93.2	Very high	91.3	Very high	1 Å²	1	48 Å²	48	1%	0.007	25%	0.254	C	S	.	.	H	α-helix	trans	-61.3	-41.3	170.6	-180	0	0	0	0	112.3	S97 I98 I99 C103 L104 F105 I218 F222	S97-S101 WeakPolarHBondContact O-CB 3.34Å; S97-S101 PolarHBondContact O-N 2.93Å; I98-S101 PolarHBondContact O-N 3.22Å; I99-S101 VanDerWaalsContact C-N 3.33Å; I99-S101 PolarHBondContact O-N 3.12Å; S101-C103 VanDerWaalsContact C-N 3.32Å; S101-C103 PolarHBondContact O-N 3.41Å; S101-L104 PolarHBondContact O-N 3.19Å; S101-F105 WeakPolarHBondContact O-CB 3.11Å; S101-F105 PolarHBondContact O-N 3.37Å; S101-I218 WeakPolarHBondContact OG-CG2 3.22Å; S101-F222 WeakPolarHBondContact OG-CE2 3.2Å; S101-F222 VanDerWaalsContact OG-CZ 3.22Å; S101-F222 WeakPolarHBondContact OG-CZ 3.4Å
102	L	93.7	Very high	91	Very high	81 Å²	81	47.4 Å²	47.4	42%	0.424	25%	0.252	S	S	.	.	H	α-helix	trans	-65.7	-33.2	178.5	-78.3	166.7	0	0	0	112.4	L62 I98 I99 L100 P106	L62-L102 HydrophobicContact CD1-CD1 4.46Å; L62-L102 HydrophobicContact CD1-CD2 4.08Å; L62-L102 HydrophobicContact CD1-CG 4.16Å; L62-L102 HydrophobicContact CD2-CD2 3.88Å; I98-L102 HydrophobicContact CG2-CD1 3.95Å; I98-L102 WeakPolarHBondContact O-CG 3.35Å; I98-L102 PolarHBondContact O-N 3.35Å; I99-L102 WeakPolarHBondContact O-CB 3.49Å; I99-L102 PolarHBondContact O-N 3.42Å; I99-L102 VanDerWaalsContact O-N 3.07Å; L100-L102 VanDerWaalsContact C-N 3.35Å; L102-P106 WeakPolarHBondContact O-CD 3.14Å
103	C	94.1	Very high	90.5	Very high	74 Å²	74	45.3 Å²	45.3	50%	0.5	24%	0.244	S	C	.	.	H	α-helix	trans	-69.4	-37.3	172.2	-65.3	0	0	0	0	112.8	I99 L100 S101	I99-C103 PolarHBondContact O-N 2.72Å; I99-C103 PolarHBondContact O-SG 3.01Å; I99-C103 VanDerWaalsContact O-SG 3.4Å; L100-C103 PolarHBondContact O-N 2.99Å; S101-C103 VanDerWaalsContact C-N 3.32Å; S101-C103 PolarHBondContact O-N 3.41Å
104	L	91.9	Very high	89.7	Confident	26 Å²	26	44 Å²	44	14%	0.136	24%	0.24	C	C	.	.	H	α-helix	trans	-78.8	-30.5	-179.1	-67.4	168.1	0	0	0	113.2	L100 S101 I107 M108 L214 L217 I218 L221	L100-L104 HydrophobicContact CD1-CD1 4.47Å; L100-L104 HydrophobicContact CG-CD1 4.24Å; L100-L104 VanDerWaalsContact O-CG 3.31Å; L100-L104 WeakPolarHBondContact O-CG 3.48Å; L100-L104 PolarHBondContact O-N 3.35Å; L100-L104 VanDerWaalsContact O-N 3.1Å; S101-L104 PolarHBondContact O-N 3.19Å; L104-I107 PolarHBondContact O-N 3.4Å; L104-M108 WeakPolarHBondContact O-CB 3.39Å; L104-M108 PolarHBondContact O-N 3.28Å; L104-L214 HydrophobicContact CD2-CD2 4.08Å; L104-L217 HydrophobicContact CD1-CD2 3.69Å; L104-L217 HydrophobicContact CD1-CG 3.96Å; L104-L217 HydrophobicContact CD2-CD2 4.33Å; L104-I218 HydrophobicContact CB-CD1 3.89Å; L104-I218 HydrophobicContact CB-CG1 3.85Å; L104-I218 HydrophobicContact CD1-CG1 4.31Å; L104-L221 HydrophobicContact CD1-CD1 3.72Å
105	F	92.9	Very high	88.5	Confident	32 Å²	32	49.8 Å²	49.8	14%	0.14	26%	0.262	C	S	.	.	H	α-helix	trans	-57.1	-49.2	-176.3	-174	-139.2	0	0	0	115	I55 I58 S101 I107 M108 I109	I55-F105 HydrophobicContact CG2-CZ 4.24Å; I58-F105 HydrophobicContact CB-CD2 4.12Å; I58-F105 HydrophobicContact CB-CE2 3.75Å; I58-F105 HydrophobicContact CB-CZ 4.4Å; I58-F105 HydrophobicContact CD1-CD2 3.97Å; I58-F105 HydrophobicContact CD1-CE2 4.12Å; I58-F105 HydrophobicContact CG2-CD2 3.56Å; I58-F105 HydrophobicContact CG2-CE2 3.56Å; I58-F105 HydrophobicContact CG2-CG 4.08Å; I58-F105 HydrophobicContact CG2-CZ 4.09Å; S101-F105 WeakPolarHBondContact O-CB 3.11Å; S101-F105 PolarHBondContact O-N 3.37Å; F105-I107 VanDerWaalsContact C-N 3.32Å; F105-I107 PolarHBondContact O-N 2.99Å; F105-M108 HydrophobicContact CD2-CE 4.01Å; F105-M108 HydrophobicContact CE2-CE 4.08Å; F105-M108 WeakPolarHBondContact O-CB 3.41Å; F105-M108 PolarHBondContact O-N 2.91Å; F105-I109 HydrophobicContact CD1-CD1 4.09Å; F105-I109 HydrophobicContact CD2-CD1 4.02Å; F105-I109 HydrophobicContact CD2-CG1 4.15Å; F105-I109 HydrophobicContact CE1-CD1 3.88Å; F105-I109 HydrophobicContact CE2-CD1 3.81Å; F105-I109 HydrophobicContact CE2-CG1 4Å; F105-I109 HydrophobicContact CG-CD1 4.18Å; F105-I109 HydrophobicContact CZ-CD1 3.75Å; F105-I109 HydrophobicContact CZ-CG1 4.41Å; F105-I109 WeakPolarHBondContact O-CG1 3.4Å; F105-I109 PolarHBondContact O-N 2.91Å
106	P	91.7	Very high	87.2	Confident	74 Å²	74	48 Å²	48	48%	0.481	25%	0.254	S	S	.	.	H	α-helix	trans	-66.5	-32.8	178	26.4	-34.7	0	0	0	112.7	L102 M108 I109 Y110	L102-P106 WeakPolarHBondContact O-CD 3.14Å; P106-M108 VanDerWaalsContact C-N 3.33Å; P106-I109 PolarHBondContact O-N 3.32Å; P106-Y110 WeakPolarHBondContact O-CB 3.27Å; P106-Y110 PolarHBondContact O-N 3.12Å
107	I	90.2	Very high	85.6	Confident	65 Å²	65	47.4 Å²	47.4	33%	0.333	25%	0.252	S	S	.	.	H	α-helix	trans	-65.5	-40.7	174.3	-53.4	175	0	0	0	109.8	L104 F105 Y110 S111 P209 L214	L104-I107 PolarHBondContact O-N 3.4Å; F105-I107 VanDerWaalsContact C-N 3.32Å; F105-I107 PolarHBondContact O-N 2.99Å; I107-Y110 PolarHBondContact O-N 2.99Å; I107-S111 PolarHBondContact O-N 2.7Å; I107-S111 PolarHBondContact O-OG 3.39Å; I107-P209 HydrophobicContact CG2-CB 3.94Å; I107-P209 HydrophobicContact CG2-CG 4.25Å; I107-L214 HydrophobicContact CB-CD1 4.48Å; I107-L214 HydrophobicContact CG2-CD1 3.97Å
108	M	90.3	Very high	84.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.5	-48.4	175.9	-166	-73.1	-54.7	0	0	111	I55 I58 L104 F105 P106 Y110 S111 A112 S211 L214 I218	I55-M108 HydrophobicContact CG1-CE 4.48Å; I58-M108 HydrophobicContact CD1-CE 3.61Å; L104-M108 WeakPolarHBondContact O-CB 3.39Å; L104-M108 PolarHBondContact O-N 3.28Å; F105-M108 HydrophobicContact CD2-CE 4.01Å; F105-M108 HydrophobicContact CE2-CE 4.08Å; F105-M108 WeakPolarHBondContact O-CB 3.41Å; F105-M108 PolarHBondContact O-N 2.91Å; P106-M108 VanDerWaalsContact C-N 3.33Å; M108-Y110 PolarHBondContact O-N 2.82Å; M108-S111 PolarHBondContact O-N 2.77Å; M108-S111 PolarHBondContact O-OG 3.07Å; M108-A112 WeakPolarHBondContact O-CB 3.46Å; M108-A112 PolarHBondContact O-N 3.01Å; M108-A112 HydrophobicContact SD-CB 4.35Å; M108-S211 PolarHBondContact SD-OG 3.04Å; M108-S211 VanDerWaalsContact SD-OG 3.39Å; M108-L214 HydrophobicContact CB-CB 3.83Å; M108-L214 HydrophobicContact CB-CD1 4.11Å; M108-L214 HydrophobicContact CG-CB 3.63Å; M108-I218 HydrophobicContact CB-CD1 4.24Å; M108-I218 HydrophobicContact CG-CD1 4.5Å
109	I	88.8	Confident	83.1	Confident	46 Å²	46	47.3 Å²	47.3	24%	0.236	25%	0.251	C	S	.	.	H	α-helix	trans	-56	-48.8	175	-68.4	167.6	0	0	0	111.1	I55 F105 P106 S111 A112 L113	I55-I109 HydrophobicContact CD1-CG1 4.06Å; I55-I109 HydrophobicContact CD1-CG2 4.38Å; I55-I109 HydrophobicContact CG1-CG1 4.08Å; F105-I109 HydrophobicContact CD1-CD1 4.09Å; F105-I109 HydrophobicContact CD2-CD1 4.02Å; F105-I109 HydrophobicContact CD2-CG1 4.15Å; F105-I109 HydrophobicContact CE1-CD1 3.88Å; F105-I109 HydrophobicContact CE2-CD1 3.81Å; F105-I109 HydrophobicContact CE2-CG1 4Å; F105-I109 HydrophobicContact CG-CD1 4.18Å; F105-I109 HydrophobicContact CZ-CD1 3.75Å; F105-I109 HydrophobicContact CZ-CG1 4.41Å; F105-I109 WeakPolarHBondContact O-CG1 3.4Å; F105-I109 PolarHBondContact O-N 2.91Å; P106-I109 PolarHBondContact O-N 3.32Å; I109-S111 PolarHBondContact O-N 3.07Å; I109-A112 PolarHBondContact O-N 3.42Å; I109-A112 VanDerWaalsContact O-N 3.17Å; I109-L113 HydrophobicContact CG2-CD1 3.71Å; I109-L113 HydrophobicContact CG2-CG 4.47Å; I109-L113 PolarHBondContact O-N 3.48Å
110	Y	85.9	Confident	81.8	Confident	124 Å²	124	43.5 Å²	43.5	49%	0.486	23%	0.233	S	C	.	.	H	α-helix	trans	-57	-48.3	176.9	175.1	-97.1	0	0	0	111.3	P106 I107 M108 A112 L113 C114	P106-Y110 WeakPolarHBondContact O-CB 3.27Å; P106-Y110 PolarHBondContact O-N 3.12Å; I107-Y110 PolarHBondContact O-N 2.99Å; M108-Y110 PolarHBondContact O-N 2.82Å; Y110-A112 VanDerWaalsContact C-N 3.31Å; Y110-A112 PolarHBondContact O-N 3.48Å; Y110-L113 PolarHBondContact O-N 3.35Å; Y110-C114 HydrophobicContact CD2-CB 4.26Å; Y110-C114 VanDerWaalsContact CD2-SG 3.58Å; Y110-C114 HydrophobicContact CE2-CB 3.99Å; Y110-C114 WeakPolarHBondContact O-CB 3.13Å; Y110-C114 PolarHBondContact O-N 3.02Å; Y110-C114 PolarHBondContact O-SG 3.03Å; Y110-C114 VanDerWaalsContact O-SG 3.4Å
111	S	84	Confident	80.7	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-65.1	-31.4	177.5	66.1	0	0	0	0	113.8	I107 M108 I109 N121 P209 S211	I107-S111 PolarHBondContact O-N 2.7Å; I107-S111 PolarHBondContact O-OG 3.39Å; M108-S111 PolarHBondContact O-N 2.77Å; M108-S111 PolarHBondContact O-OG 3.07Å; I109-S111 PolarHBondContact O-N 3.07Å; S111-N121 PolarHBondContact O-ND2 3.34Å; S111-N121 PolarHBondContact O-OD1 2.98Å; S111-P209 WeakPolarHBondContact CB-O 3.25Å; S111-S211 WeakPolarHBondContact OG-CA 3.1Å
112	A	82.3	Confident	79.5	Confident	8 Å²	8	40.6 Å²	40.6	7%	0.066	22%	0.218	C	C	.	.	H	α-helix	trans	-75.8	-33.9	180	0	0	0	0	0	112.7	V51 M108 I109 Y110	V51-A112 HydrophobicContact CG2-CB 4.02Å; M108-A112 WeakPolarHBondContact O-CB 3.46Å; M108-A112 PolarHBondContact O-N 3.01Å; M108-A112 HydrophobicContact SD-CB 4.35Å; I109-A112 PolarHBondContact O-N 3.42Å; I109-A112 VanDerWaalsContact O-N 3.17Å; Y110-A112 VanDerWaalsContact C-N 3.31Å; Y110-A112 PolarHBondContact O-N 3.48Å
113	L	80.7	Confident	78.2	Confident	66 Å²	66	39.3 Å²	39.3	35%	0.346	22%	0.216	S	C	.	.	H	α-helix	trans	-88.4	-39.6	-178.4	-71	172.1	0	0	0	113.7	S40 N41 V51 I109 Y110	S40-L113 VanDerWaalsContact CA-O 3.31Å; S40-L113 WeakPolarHBondContact CA-O 3.29Å; S40-L113 PolarHBondContact OG-O 2.93Å; N41-L113 PolarHBondContact N-O 3.46Å; V51-L113 HydrophobicContact CG1-CD2 3.83Å; V51-L113 HydrophobicContact CG1-CG 4.39Å; I109-L113 HydrophobicContact CG2-CD1 3.71Å; I109-L113 HydrophobicContact CG2-CG 4.47Å; I109-L113 PolarHBondContact O-N 3.48Å; Y110-L113 PolarHBondContact O-N 3.35Å
114	C	73.5	Confident	76.8	Confident	13 Å²	13	37.1 Å²	37.1	9%	0.088	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-100.7	150.3	-169.9	-52.8	0	0	0	0	111.5	I38 N41 Y110 V116	I38-C114 HydrophobicContact CG2-CB 3.83Å; N41-C114 PolarHBondContact ND2-O 3.5Å; Y110-C114 HydrophobicContact CD2-CB 4.26Å; Y110-C114 VanDerWaalsContact CD2-SG 3.58Å; Y110-C114 HydrophobicContact CE2-CB 3.99Å; Y110-C114 WeakPolarHBondContact O-CB 3.13Å; Y110-C114 PolarHBondContact O-N 3.02Å; Y110-C114 PolarHBondContact O-SG 3.03Å; Y110-C114 VanDerWaalsContact O-SG 3.4Å; C114-V116 PolarHBondContact O-N 3.48Å
115	R	66.7	Low	75.5	Confident	127 Å²	127	38.7 Å²	38.7	48%	0.479	21%	0.207	S	C	.	.			trans	-69.9	118.3	168.3	-82.1	174.4	171	-173.6	-4.1	110.6	G39 N41 D122	G39-R115 VanDerWaalsContact O-CB 3.3Å; G39-R115 WeakPolarHBondContact O-CB 3.17Å; G39-R115 WeakPolarHBondContact O-CG 3.15Å; G39-R115 PolarHBondContact O-N 3.39Å; N41-R115 WeakPolarHBondContact OD1-CG 3.39Å; R115-D122 HydrophobicContact CG-CB 4.48Å
116	V	63.4	Low	74.1	Confident	23 Å²	23	37.3 Å²	37.3	14%	0.139	20%	0.201	C	C	.	.			trans	-97.9	-10.9	-178.6	-178.6	0	0	0	0	111.6	C114 H118 D122 K208 P209	C114-V116 PolarHBondContact O-N 3.48Å; V116-H118 VanDerWaalsContact C-N 3.29Å; V116-D122 PolarHBondContact N-OD1 2.6Å; V116-D122 VanDerWaalsContact N-OD1 3.09Å; V116-D122 PolarHBondContact N-OD2 3.13Å; V116-K208 HydrophobicContact CG1-CB 4.01Å; V116-K208 HydrophobicContact CG1-CG 4.33Å; V116-P209 HydrophobicContact CG1-CG 4.06Å; V116-P209 HydrophobicContact CG2-CG 4.46Å
117	G	60.2	Low	72.3	Confident	38 Å²	38	34 Å²	34	39%	0.392	18%	0.179	S	C	.	.	S	Bend	trans	72.7	24.9	-172.5	0	0	0	0	0	112.6	D122 K208	G117-D122 VanDerWaalsContact CA-OD2 3.23Å; G117-D122 WeakPolarHBondContact CA-OD2 3.35Å; G117-D122 PolarHBondContact N-OD2 3.33Å; G117-K208 PolarHBondContact O-NZ 3.26Å
118	H	68.5	Low	70.7	Confident	14 Å²	14	34.9 Å²	34.9	7%	0.065	18%	0.181	C	C	.	.			trans	-107.7	113.7	170.9	-173.2	-40.7	0	0	0	107.5	V116 A120 N121 D122 K208 Y325 Y411	V116-H118 VanDerWaalsContact C-N 3.29Å; H118-A120 VanDerWaalsContact C-N 3.33Å; H118-A120 PolarHBondContact O-N 2.83Å; H118-N121 HydrophobicContact CB-CB 3.96Å; H118-N121 WeakPolarHBondContact O-CA 3.47Å; H118-N121 WeakPolarHBondContact O-CB 3.28Å; H118-N121 PolarHBondContact O-N 3.49Å; H118-D122 PolarHBondContact N-OD2 3.38Å; H118-D122 PolarHBondContact O-N 3.13Å; H118-K208 HydrophobicContact CB-CB 4.3Å; H118-Y325 AromaticContact CE1-CE2 3.74Å; H118-Y325 AromaticContact NE2-CE2 3.95Å; H118-Y411 AromaticContact CE1-CD1 3.88Å; H118-Y411 AromaticContact CE1-CE1 3.31Å; H118-Y411 WeakPolarHBondContact CE1-CE1 3.3Å; H118-Y411 AromaticContact CE1-CE2 3.8Å; H118-Y411 AromaticContact CE1-CZ 3.3Å; H118-Y411 AromaticContact ND1-CE1 3.87Å; H118-Y411 AromaticContact ND1-CZ 3.66Å; H118-Y411 PolarHBondContact ND1-OH 2.9Å; H118-Y411 AromaticContact NE2-CE1 3.94Å
119	S	65.6	Low	69	Low	5 Å²	5	37.4 Å²	37.4	4%	0.035	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-36.6	-164.4	-50.2	0	0	0	0	114.2	S123 I124 L126 Y411	S119-S123 PolarHBondContact O-N 2.82Å; S119-I124 PolarHBondContact O-N 2.87Å; S119-L126 VanDerWaalsContact CB-CD1 3.41Å; S119-Y411 WeakPolarHBondContact CB-OH 3.43Å; S119-Y411 PolarHBondContact N-OH 2.77Å
120	A	67.1	Low	67.2	Low	10 Å²	10	38.3 Å²	38.3	8%	0.083	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-35.6	170.8	0	0	0	0	0	114.6	H118 F210 Y325 P328 Y411	H118-A120 VanDerWaalsContact C-N 3.33Å; H118-A120 PolarHBondContact O-N 2.83Å; A120-F210 HydrophobicContact CB-CD2 3.92Å; A120-F210 HydrophobicContact CB-CE2 3.49Å; A120-F210 VanDerWaalsContact CB-CE2 3.49Å; A120-F210 HydrophobicContact CB-CZ 4.37Å; A120-Y325 HydrophobicContact CB-CD2 4.07Å; A120-Y325 HydrophobicContact CB-CE2 4.49Å; A120-P328 VanDerWaalsContact CA-CG 3.43Å; A120-P328 HydrophobicContact CB-CG 3.75Å; A120-Y411 HydrophobicContact CB-CE2 3.85Å; A120-Y411 PolarHBondContact N-OH 3.43Å
121	N	71.1	Confident	65.2	Low	21 Å²	21	38.1 Å²	38.1	11%	0.112	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-44.5	178.4	-169.7	80.4	0	0	0	110.6	N41 S111 H118 S123 F210 S211	N41-N121 PolarHBondContact ND2-ND2 2.85Å; S111-N121 PolarHBondContact O-ND2 3.34Å; S111-N121 PolarHBondContact O-OD1 2.98Å; H118-N121 HydrophobicContact CB-CB 3.96Å; H118-N121 WeakPolarHBondContact O-CA 3.47Å; H118-N121 WeakPolarHBondContact O-CB 3.28Å; H118-N121 PolarHBondContact O-N 3.49Å; N121-S123 PolarHBondContact O-N 2.91Å; N121-F210 HydrophobicContact CB-CD2 3.77Å; N121-F210 HydrophobicContact CB-CE2 4.5Å; N121-S211 PolarHBondContact OD1-N 3.41Å
122	D	66.9	Low	63.6	Low	5 Å²	5	41.1 Å²	41.1	3%	0.027	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	9	-171.9	-57.6	-12.1	0	0	0	113	N41 R115 V116 G117 H118 I124	N41-D122 PolarHBondContact ND2-OD1 2.98Å; N41-D122 VanDerWaalsContact OD1-CA 3.26Å; N41-D122 WeakPolarHBondContact OD1-CA 3.28Å; N41-D122 WeakPolarHBondContact OD1-CB 3.31Å; R115-D122 HydrophobicContact CG-CB 4.48Å; V116-D122 PolarHBondContact N-OD1 2.6Å; V116-D122 VanDerWaalsContact N-OD1 3.09Å; V116-D122 PolarHBondContact N-OD2 3.13Å; G117-D122 VanDerWaalsContact CA-OD2 3.23Å; G117-D122 WeakPolarHBondContact CA-OD2 3.35Å; G117-D122 PolarHBondContact N-OD2 3.33Å; H118-D122 PolarHBondContact N-OD2 3.38Å; H118-D122 PolarHBondContact O-N 3.13Å; D122-I124 HydrophobicContact CB-CD1 3.83Å; D122-I124 HydrophobicContact CB-CG1 3.91Å; D122-I124 PolarHBondContact O-N 3.14Å
123	S	66.3	Low	62.3	Low	55 Å²	55	40.9 Å²	40.9	39%	0.385	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	22.3	-175.7	61.5	0	0	0	0	115.3	N47 S119 N121 I125	N47-S123 PolarHBondContact ND2-OG 2.97Å; S119-S123 PolarHBondContact O-N 2.82Å; N121-S123 PolarHBondContact O-N 2.91Å; S123-I125 PolarHBondContact O-N 3.22Å
124	I	64.9	Low	60.9	Low	27 Å²	27	41 Å²	41	14%	0.138	22%	0.215	C	C	.	.			trans	-76.2	123	-177	-62.4	173.7	0	0	0	109.6	S119 D122 L126 D129 H132	S119-I124 PolarHBondContact O-N 2.87Å; D122-I124 HydrophobicContact CB-CD1 3.83Å; D122-I124 HydrophobicContact CB-CG1 3.91Å; D122-I124 PolarHBondContact O-N 3.14Å; I124-L126 HydrophobicContact CG2-CD1 4.42Å; I124-L126 PolarHBondContact O-N 3.36Å; I124-D129 HydrophobicContact CG2-CB 4.24Å; I124-H132 HydrophobicContact CG2-CB 4.14Å
125	I	65.1	Low	60	Low	60 Å²	60	45 Å²	45	31%	0.308	24%	0.236	S	C	.	.			trans	-92.3	104	177.2	-59.4	177.1	0	0	0	108.1	S123 G127 K128 D129 F331	S123-I125 PolarHBondContact O-N 3.22Å; I125-G127 PolarHBondContact O-N 2.6Å; I125-K128 HydrophobicContact CB-CB 4.06Å; I125-K128 HydrophobicContact CB-CD 4.29Å; I125-K128 HydrophobicContact CD1-CD 4.21Å; I125-K128 HydrophobicContact CG2-CB 3.72Å; I125-K128 HydrophobicContact CG2-CD 4.19Å; I125-K128 PolarHBondContact O-N 3.03Å; I125-K128 VanDerWaalsContact O-N 3.09Å; I125-D129 PolarHBondContact N-OD2 3.26Å; I125-D129 PolarHBondContact O-N 3.14Å; I125-D129 VanDerWaalsContact O-N 3.13Å; I125-F331 HydrophobicContact CG2-CB 3.49Å; I125-F331 VanDerWaalsContact CG2-CB 3.49Å; I125-F331 HydrophobicContact CG2-CG 4.23Å
126	L	62.3	Low	59.3	Low	3 Å²	3	40.3 Å²	40.3	2%	0.016	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	141.9	178.4	-87.4	54.2	0	0	0	110.4	S119 I124 K128 P328 F329 F331 T332 F418	S119-L126 VanDerWaalsContact CB-CD1 3.41Å; I124-L126 HydrophobicContact CG2-CD1 4.42Å; I124-L126 PolarHBondContact O-N 3.36Å; L126-K128 PolarHBondContact O-N 3.26Å; L126-P328 HydrophobicContact CD1-CB 4.06Å; L126-P328 PolarHBondContact N-O 3.45Å; L126-F329 HydrophobicContact CD2-CD1 4.24Å; L126-F329 HydrophobicContact CD2-CE1 3.89Å; L126-F331 WeakPolarHBondContact O-CD1 3.28Å; L126-T332 HydrophobicContact CB-CG2 3.52Å; L126-T332 WeakPolarHBondContact O-CG2 3.38Å; L126-F418 HydrophobicContact CB-CD1 4.34Å; L126-F418 HydrophobicContact CB-CD2 4.32Å; L126-F418 HydrophobicContact CB-CE1 4.1Å; L126-F418 HydrophobicContact CB-CE2 4.09Å; L126-F418 HydrophobicContact CB-CG 4.45Å; L126-F418 HydrophobicContact CB-CZ 3.98Å; L126-F418 HydrophobicContact CD2-CB 4.05Å; L126-F418 HydrophobicContact CD2-CD1 3.6Å; L126-F418 HydrophobicContact CD2-CD2 4.33Å; L126-F418 HydrophobicContact CD2-CE1 4.13Å; L126-F418 HydrophobicContact CD2-CG 3.72Å; L126-F418 HydrophobicContact CG-CD1 3.84Å; L126-F418 HydrophobicContact CG-CE1 3.83Å; L126-F418 HydrophobicContact CG-CG 4.26Å; L126-F418 HydrophobicContact CG-CZ 4.23Å
127	G	54.8	Low	58.9	Low	3 Å²	3	39.8 Å²	39.8	3%	0.031	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	72	-17.1	-178.2	0	0	0	0	0	115.8	I125 F331 L644	I125-G127 PolarHBondContact O-N 2.6Å; G127-F331 WeakPolarHBondContact O-CE1 3.43Å; G127-L644 WeakPolarHBondContact O-CB 3.39Å; G127-L644 PolarHBondContact O-N 3.25Å
128	K	56.9	Low	58.2	Low	85 Å²	85	41.6 Å²	41.6	37%	0.37	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-45	174.7	-172.7	-168.9	175.5	-167.3	0	111.9	I125 L126 M130 F331	I125-K128 HydrophobicContact CB-CB 4.06Å; I125-K128 HydrophobicContact CB-CD 4.29Å; I125-K128 HydrophobicContact CD1-CD 4.21Å; I125-K128 HydrophobicContact CG2-CB 3.72Å; I125-K128 HydrophobicContact CG2-CD 4.19Å; I125-K128 PolarHBondContact O-N 3.03Å; I125-K128 VanDerWaalsContact O-N 3.09Å; L126-K128 PolarHBondContact O-N 3.26Å; K128-M130 PolarHBondContact O-N 2.87Å; K128-F331 HydrophobicContact CB-CD1 4.03Å; K128-F331 HydrophobicContact CB-CD2 4.47Å; K128-F331 HydrophobicContact CB-CE1 4.2Å; K128-F331 HydrophobicContact CB-CG 4.18Å; K128-F331 HydrophobicContact CB-CZ 4.49Å
129	D	54.4	Low	57.6	Low	53 Å²	53	44.5 Å²	44.5	28%	0.283	24%	0.239	S	C	.	.			trans	-74.6	94.9	-176.5	-72.6	-49.4	0	0	0	112	I124 I125 L131 H132 L133	I124-D129 HydrophobicContact CG2-CB 4.24Å; I125-D129 PolarHBondContact N-OD2 3.26Å; I125-D129 PolarHBondContact O-N 3.14Å; I125-D129 VanDerWaalsContact O-N 3.13Å; D129-L131 PolarHBondContact O-N 2.96Å; D129-H132 HydrophobicContact CB-CB 4.18Å; D129-H132 PolarHBondContact O-N 3.43Å; D129-H132 VanDerWaalsContact O-N 3.14Å; D129-L133 PolarHBondContact O-N 2.98Å
130	M	51.2	Low	57	Low	64 Å²	64	46.8 Å²	46.8	32%	0.315	25%	0.248	S	C	.	.	H	α-helix	trans	-57.1	-32.8	-175.5	-163.4	-177.1	86.9	0	0	113	K128 L133 Q134 N646 Y649	K128-M130 PolarHBondContact O-N 2.87Å; M130-L133 PolarHBondContact O-N 3.23Å; M130-Q134 WeakPolarHBondContact O-CB 3.29Å; M130-Q134 PolarHBondContact O-N 2.75Å; M130-N646 HydrophobicContact SD-CB 3.97Å; M130-Y649 HydrophobicContact CG-CE1 4.4Å; M130-Y649 HydrophobicContact SD-CE1 4.39Å
131	L	44.2	Very low	56.3	Low	121 Å²	121	49.8 Å²	49.8	63%	0.634	27%	0.267	S	S	*	.	H	α-helix	trans	-72.1	-40.2	179.9	-157.5	159.9	0	0	0	111.7	D129 Q134 N135	D129-L131 PolarHBondContact O-N 2.96Å; L131-Q134 PolarHBondContact O-N 2.94Å; L131-N135 PolarHBondContact O-N 3.25Å; L131-N135 PolarHBondContact O-OD1 2.99Å
132	H	50.2	Low	55.2	Low	62 Å²	62	54.9 Å²	54.9	29%	0.287	29%	0.294	S	S	.	.	H	α-helix	trans	-66.4	-41.5	171.8	-178	-96.1	0	0	0	111.1	I124 D129 N135 L136	I124-H132 HydrophobicContact CG2-CB 4.14Å; D129-H132 HydrophobicContact CB-CB 4.18Å; D129-H132 PolarHBondContact O-N 3.43Å; D129-H132 VanDerWaalsContact O-N 3.14Å; H132-N135 PolarHBondContact O-N 3.4Å; H132-L136 WeakPolarHBondContact O-CB 3.09Å; H132-L136 PolarHBondContact O-N 3.45Å
133	L	54.4	Low	54.4	Low	3 Å²	3	55.4 Å²	55.4	2%	0.016	30%	0.297	C	S	.	.	H	α-helix	trans	-62.1	-41.1	174.3	-178.1	61.8	0	0	0	112.2	D129 M130 L136 L137 V422 Y425 L643 L644	D129-L133 PolarHBondContact O-N 2.98Å; M130-L133 PolarHBondContact O-N 3.23Å; L133-L136 WeakPolarHBondContact O-CB 3.39Å; L133-L136 PolarHBondContact O-N 3.19Å; L133-L137 WeakPolarHBondContact O-CB 3.46Å; L133-L137 PolarHBondContact O-N 3.36Å; L133-V422 HydrophobicContact CD1-CG1 4.01Å; L133-V422 HydrophobicContact CD1-CG2 4Å; L133-Y425 HydrophobicContact CD2-CE1 4.29Å; L133-L643 HydrophobicContact CD1-CD2 4.09Å; L133-L644 WeakPolarHBondContact CD2-O 3.47Å
134	Q	52	Low	53.9	Low	69 Å²	69	58 Å²	58	32%	0.322	30%	0.303	S	S	.	.	H	α-helix	trans	-66.2	-44	178	-179.4	174.9	-0.4	0	0	111.7	M130 L131 L136 L137 L138	M130-Q134 WeakPolarHBondContact O-CB 3.29Å; M130-Q134 PolarHBondContact O-N 2.75Å; L131-Q134 PolarHBondContact O-N 2.94Å; Q134-L136 VanDerWaalsContact C-N 3.3Å; Q134-L136 PolarHBondContact O-N 3.09Å; Q134-L137 PolarHBondContact O-N 3.2Å; Q134-L137 VanDerWaalsContact O-N 3.14Å; Q134-L138 HydrophobicContact CG-CD1 3.89Å; Q134-L138 HydrophobicContact CG-CG 4.35Å; Q134-L138 WeakPolarHBondContact O-CB 3.16Å; Q134-L138 VanDerWaalsContact O-CG 3.3Å; Q134-L138 WeakPolarHBondContact O-CG 3.32Å; Q134-L138 PolarHBondContact O-N 3.45Å
135	N	53.4	Low	53.2	Low	96 Å²	96	61.7 Å²	61.7	51%	0.513	32%	0.318	S	S	.	.	H	α-helix	trans	-62.4	-38.6	174.4	-71.3	0	0	0	0	111.5	L131 H132 S139	L131-N135 PolarHBondContact O-N 3.25Å; L131-N135 PolarHBondContact O-OD1 2.99Å; H132-N135 PolarHBondContact O-N 3.4Å; N135-S139 PolarHBondContact O-N 3.4Å
136	L	53.2	Low	52.5	Low	29 Å²	29	61.7 Å²	61.7	15%	0.152	32%	0.318	C	S	.	.	H	α-helix	trans	-63.8	-42.2	171.8	-120.4	165.4	0	0	0	111.7	H132 L133 Q134 S139 F140 F418 V422	H132-L136 WeakPolarHBondContact O-CB 3.09Å; H132-L136 PolarHBondContact O-N 3.45Å; L133-L136 WeakPolarHBondContact O-CB 3.39Å; L133-L136 PolarHBondContact O-N 3.19Å; Q134-L136 VanDerWaalsContact C-N 3.3Å; Q134-L136 PolarHBondContact O-N 3.09Å; L136-S139 PolarHBondContact O-N 2.97Å; L136-S139 PolarHBondContact O-OG 3.2Å; L136-F140 HydrophobicContact CD2-CE2 4.41Å; L136-F140 HydrophobicContact CD2-CZ 4.21Å; L136-F140 WeakPolarHBondContact O-CD2 3.3Å; L136-F140 WeakPolarHBondContact O-CE2 3.45Å; L136-F418 HydrophobicContact CD1-CE1 4.38Å; L136-V422 HydrophobicContact CB-CG1 4.46Å; L136-V422 HydrophobicContact CD2-CG1 4.45Å
137	L	54.9	Low	51.9	Low	13 Å²	13	63.6 Å²	63.6	7%	0.068	33%	0.328	C	S	.	.	H	α-helix	trans	-66.2	-41.4	178.6	-129.5	80.3	0	0	0	113	L133 Q134 S139 F140 L143 V422 Y425 A426 L429	L133-L137 WeakPolarHBondContact O-CB 3.46Å; L133-L137 PolarHBondContact O-N 3.36Å; Q134-L137 PolarHBondContact O-N 3.2Å; Q134-L137 VanDerWaalsContact O-N 3.14Å; L137-S139 PolarHBondContact O-N 3.32Å; L137-F140 WeakPolarHBondContact O-CD2 3.24Å; L137-F140 PolarHBondContact O-N 3.36Å; L137-L143 HydrophobicContact CD2-CD1 3.86Å; L137-L143 HydrophobicContact CD2-CD2 4.3Å; L137-L143 HydrophobicContact CG-CD1 4.01Å; L137-V422 HydrophobicContact CD1-CG1 4.03Å; L137-Y425 HydrophobicContact CD1-CD1 4Å; L137-Y425 HydrophobicContact CD1-CE1 4.2Å; L137-A426 HydrophobicContact CD1-CB 4.23Å; L137-A426 HydrophobicContact CG-CB 4.47Å; L137-L429 HydrophobicContact CD2-CD1 3.81Å
138	L	45.7	Very low	51.7	Low	76 Å²	76	67.2 Å²	67.2	40%	0.398	35%	0.349	S	S	.	.	H	α-helix	trans	-69.2	-20.8	178.2	-71.4	170.8	0	0	0	112.5	Q134 F140 I147	Q134-L138 HydrophobicContact CG-CD1 3.89Å; Q134-L138 HydrophobicContact CG-CG 4.35Å; Q134-L138 WeakPolarHBondContact O-CB 3.16Å; Q134-L138 VanDerWaalsContact O-CG 3.3Å; Q134-L138 WeakPolarHBondContact O-CG 3.32Å; Q134-L138 PolarHBondContact O-N 3.45Å; L138-F140 PolarHBondContact O-N 3.07Å; L138-I147 HydrophobicContact CD2-CD1 4.21Å
139	S	55.9	Low	51.2	Low	74 Å²	74	68.1 Å²	68.1	52%	0.517	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-6.1	173.4	78.2	0	0	0	0	114.3	N135 L136 L137	N135-S139 PolarHBondContact O-N 3.4Å; L136-S139 PolarHBondContact O-N 2.97Å; L136-S139 PolarHBondContact O-OG 3.2Å; L137-S139 PolarHBondContact O-N 3.32Å
140	F	52	Low	50.7	Low	54 Å²	54	69 Å²	69	24%	0.237	36%	0.361	C	S	.	.			trans	-96.5	110.5	176.9	-59.7	-60.6	0	0	0	111.8	L136 L137 L138 N142 L143 Q144 V422 T423 A426	L136-F140 HydrophobicContact CD2-CE2 4.41Å; L136-F140 HydrophobicContact CD2-CZ 4.21Å; L136-F140 WeakPolarHBondContact O-CD2 3.3Å; L136-F140 WeakPolarHBondContact O-CE2 3.45Å; L137-F140 WeakPolarHBondContact O-CD2 3.24Å; L137-F140 PolarHBondContact O-N 3.36Å; L138-F140 PolarHBondContact O-N 3.07Å; F140-N142 VanDerWaalsContact C-N 3.25Å; F140-N142 PolarHBondContact O-N 3.28Å; F140-N142 VanDerWaalsContact O-N 3.15Å; F140-L143 HydrophobicContact CB-CB 4.44Å; F140-L143 PolarHBondContact O-N 3.45Å; F140-Q144 PolarHBondContact O-N 3.36Å; F140-V422 HydrophobicContact CE2-CG1 4.19Å; F140-T423 HydrophobicContact CE1-CG2 3.61Å; F140-T423 HydrophobicContact CE2-CG2 4.38Å; F140-T423 HydrophobicContact CZ-CG2 3.5Å; F140-A426 HydrophobicContact CD2-CB 4.24Å
141	P	52.5	Low	50.4	Low	73 Å²	73	68.9 Å²	68.9	47%	0.474	36%	0.361	S	S	.	.	H	α-helix	trans	-63.9	-27.7	-171.5	24.6	-34.9	0	0	0	113.5	L143 Q144 K145	P141-L143 VanDerWaalsContact C-N 3.3Å; P141-L143 PolarHBondContact O-N 3.18Å; P141-Q144 PolarHBondContact O-N 3.28Å; P141-K145 WeakPolarHBondContact O-CB 3.24Å; P141-K145 PolarHBondContact O-N 2.92Å
142	N	47.4	Very low	50.3	Low	127 Å²	127	67.2 Å²	67.2	68%	0.679	36%	0.356	S	S	*	.	H	α-helix	trans	-64.7	-35.1	176	-62.9	13.3	0	0	0	112	F140 L146 I430	F140-N142 VanDerWaalsContact C-N 3.25Å; F140-N142 PolarHBondContact O-N 3.28Å; F140-N142 VanDerWaalsContact O-N 3.15Å; N142-L146 PolarHBondContact O-N 3.01Å; N142-I430 HydrophobicContact CB-CD1 4.44Å
143	L	51.1	Low	49.9	Very low	17 Å²	17	70.4 Å²	70.4	9%	0.089	38%	0.375	C	S	.	.	H	α-helix	trans	-79.8	-36.1	179.1	-163.5	143.2	0	0	0	110.5	L137 F140 P141 L146 I147 A426 I430	L137-L143 HydrophobicContact CD2-CD1 3.86Å; L137-L143 HydrophobicContact CD2-CD2 4.3Å; L137-L143 HydrophobicContact CG-CD1 4.01Å; F140-L143 HydrophobicContact CB-CB 4.44Å; F140-L143 PolarHBondContact O-N 3.45Å; P141-L143 VanDerWaalsContact C-N 3.3Å; P141-L143 PolarHBondContact O-N 3.18Å; L143-L146 PolarHBondContact O-N 3.43Å; L143-I147 HydrophobicContact CD2-CD1 3.67Å; L143-I147 HydrophobicContact CD2-CG1 4.36Å; L143-I147 WeakPolarHBondContact O-CG1 3.32Å; L143-I147 PolarHBondContact O-N 2.88Å; L143-A426 HydrophobicContact CD1-CB 4.02Å; L143-I430 HydrophobicContact CB-CD1 4.14Å; L143-I430 HydrophobicContact CD1-CD1 4.3Å; L143-I430 HydrophobicContact CD1-CG1 4.27Å; L143-I430 HydrophobicContact CG-CD1 4.47Å; L143-I430 HydrophobicContact CG-CG1 4.48Å
144	Q	55.3	Low	49.3	Very low	109 Å²	109	76 Å²	76	51%	0.509	40%	0.404	S	S	.	.	H	α-helix	trans	-59	-48.8	169.6	-171.8	-179.4	-2.6	0	0	111.7	F140 P141 L146 I147 T148	F140-Q144 PolarHBondContact O-N 3.36Å; P141-Q144 PolarHBondContact O-N 3.28Å; Q144-L146 VanDerWaalsContact C-N 3.3Å; Q144-L146 PolarHBondContact O-N 2.68Å; Q144-I147 PolarHBondContact O-N 3.5Å; Q144-I147 VanDerWaalsContact O-N 3.15Å; Q144-T148 PolarHBondContact O-N 3.4Å; Q144-T148 PolarHBondContact O-OG1 2.85Å; Q144-T148 VanDerWaalsContact O-OG1 3.12Å
145	K	51	Low	48.7	Very low	104 Å²	104	78.1 Å²	78.1	45%	0.452	41%	0.41	S	S	.	.	H	α-helix	trans	-64	-33.4	179	-163.6	150	-175.1	156	0	112.3	P141 M149 E184	P141-K145 WeakPolarHBondContact O-CB 3.24Å; P141-K145 PolarHBondContact O-N 2.92Å; K145-M149 WeakPolarHBondContact O-CG 3.4Å; K145-M149 PolarHBondContact O-N 3.46Å; K145-M149 VanDerWaalsContact O-N 3.08Å; K145-E184 IonicContact NZ-OE1 2.82Å; K145-E184 PolarHBondContact NZ-OE1 3.14Å; K145-E184 IonicContact NZ-OE2 3.89Å
146	L	49	Very low	48	Very low	60 Å²	60	76.7 Å²	76.7	31%	0.314	42%	0.417	S	S	.	.	H	α-helix	trans	-66.9	-42.3	172.2	-166.1	77.4	0	0	0	112.5	N142 L143 Q144 M149 N150 I430	N142-L146 PolarHBondContact O-N 3.01Å; L143-L146 PolarHBondContact O-N 3.43Å; Q144-L146 VanDerWaalsContact C-N 3.3Å; Q144-L146 PolarHBondContact O-N 2.68Å; L146-M149 PolarHBondContact O-N 3.42Å; L146-N150 PolarHBondContact O-N 2.97Å; L146-I430 HydrophobicContact CD2-CB 4.49Å; L146-I430 HydrophobicContact CD2-CG1 4.13Å; L146-I430 HydrophobicContact CD2-CG2 4.37Å
147	I	51.2	Low	47.2	Very low	44 Å²	44	82.1 Å²	82.1	23%	0.226	45%	0.447	C	S	.	.	H	α-helix	trans	-60.6	-46.5	175	-71.6	170.1	0	0	0	110.3	L138 L143 Q144 M149 N150 I151 F650	L138-I147 HydrophobicContact CD2-CD1 4.21Å; L143-I147 HydrophobicContact CD2-CD1 3.67Å; L143-I147 HydrophobicContact CD2-CG1 4.36Å; L143-I147 WeakPolarHBondContact O-CG1 3.32Å; L143-I147 PolarHBondContact O-N 2.88Å; Q144-I147 PolarHBondContact O-N 3.5Å; Q144-I147 VanDerWaalsContact O-N 3.15Å; I147-M149 VanDerWaalsContact C-N 3.34Å; I147-M149 PolarHBondContact O-N 3.05Å; I147-N150 PolarHBondContact O-N 3.5Å; I147-I151 HydrophobicContact CG2-CD1 3.93Å; I147-I151 WeakPolarHBondContact O-CG1 3.38Å; I147-I151 PolarHBondContact O-N 2.96Å; I147-I151 VanDerWaalsContact O-N 3.07Å; I147-F650 HydrophobicContact CG1-CE1 4.34Å
148	T	49.5	Very low	46	Very low	78 Å²	78	89 Å²	89	48%	0.479	48%	0.483	S	S	.	.	H	α-helix	trans	-60.6	-40.7	177.8	-49.4	0	0	0	0	112.2	Q144 I151 T152	Q144-T148 PolarHBondContact O-N 3.4Å; Q144-T148 PolarHBondContact O-OG1 2.85Å; Q144-T148 VanDerWaalsContact O-OG1 3.12Å; T148-I151 PolarHBondContact O-N 3.41Å; T148-T152 PolarHBondContact O-N 3.12Å; T148-T152 VanDerWaalsContact O-N 3.07Å
149	M	45.9	Very low	45.3	Very low	105 Å²	105	89 Å²	89	52%	0.517	50%	0.502	S	S	.	.	H	α-helix	trans	-68.6	-30.1	177	-75.9	-179.2	165.2	0	0	114.2	K145 L146 I147 T152 N153	K145-M149 WeakPolarHBondContact O-CG 3.4Å; K145-M149 PolarHBondContact O-N 3.46Å; K145-M149 VanDerWaalsContact O-N 3.08Å; L146-M149 PolarHBondContact O-N 3.42Å; I147-M149 VanDerWaalsContact C-N 3.34Å; I147-M149 PolarHBondContact O-N 3.05Å; M149-T152 PolarHBondContact O-OG1 3.48Å; M149-N153 PolarHBondContact O-N 2.93Å; M149-N153 PolarHBondContact O-ND2 3.06Å
150	N	43.9	Very low	44.1	Very low	70 Å²	70	91 Å²	91	37%	0.374	52%	0.516	S	S	.	.	H	α-helix	trans	-72.8	-33.5	171.8	-80.5	-6.3	0	0	0	111.7	L146 I147 I154	L146-N150 PolarHBondContact O-N 2.97Å; I147-N150 PolarHBondContact O-N 3.5Å; N150-I154 WeakPolarHBondContact O-CD1 3.27Å; N150-I154 WeakPolarHBondContact O-CG1 3.26Å; N150-I154 PolarHBondContact O-N 3.11Å
151	I	45.2	Very low	42.9	Very low	62 Å²	62	100 Å²	100	32%	0.318	55%	0.549	S	S	.	.	H	α-helix	trans	-66.3	-48.4	175.5	-68	166.1	0	0	0	110.7	I147 T148 N153 I154 Y155 T653	I147-I151 HydrophobicContact CG2-CD1 3.93Å; I147-I151 WeakPolarHBondContact O-CG1 3.38Å; I147-I151 PolarHBondContact O-N 2.96Å; I147-I151 VanDerWaalsContact O-N 3.07Å; T148-I151 PolarHBondContact O-N 3.41Å; I151-N153 VanDerWaalsContact C-N 3.31Å; I151-N153 PolarHBondContact O-N 3.49Å; I151-I154 PolarHBondContact O-N 3.41Å; I151-Y155 HydrophobicContact CG2-CD2 3.95Å; I151-Y155 HydrophobicContact CG2-CE2 4.06Å; I151-Y155 WeakPolarHBondContact O-CD2 3.47Å; I151-Y155 PolarHBondContact O-N 3.13Å; I151-T653 HydrophobicContact CD1-CG2 4.47Å
152	T	42.2	Very low	41.9	Very low	87 Å²	87	107.2 Å²	107.2	53%	0.534	57%	0.568	S	S	.	*	H	α-helix	trans	-62.2	-35.5	-178.4	53.6	0	0	0	0	113.4	T148 M149 I154 G156	T148-T152 PolarHBondContact O-N 3.12Å; T148-T152 VanDerWaalsContact O-N 3.07Å; M149-T152 PolarHBondContact O-OG1 3.48Å; T152-I154 VanDerWaalsContact C-N 3.3Å; T152-I154 PolarHBondContact O-N 3.16Å; T152-G156 PolarHBondContact O-N 2.86Å; T152-G156 VanDerWaalsContact O-N 3.09Å
153	N	41.9	Very low	41.1	Very low	128 Å²	128	106.8 Å²	106.8	68%	0.684	58%	0.575	S	S	*	*	H	α-helix	trans	-67.5	-24.8	174.4	-85.5	-45.2	0	0	0	114.2	M149 I151	M149-N153 PolarHBondContact O-N 2.93Å; M149-N153 PolarHBondContact O-ND2 3.06Å; I151-N153 VanDerWaalsContact C-N 3.31Å; I151-N153 PolarHBondContact O-N 3.49Å
154	I	41.7	Very low	39.9	Very low	122 Å²	122	111.9 Å²	111.9	63%	0.626	61%	0.612	S	S	*	*	H	α-helix	trans	-80.7	-38.4	179.6	-71.3	168.2	0	0	0	111.1	N150 I151 T152	N150-I154 WeakPolarHBondContact O-CD1 3.27Å; N150-I154 WeakPolarHBondContact O-CG1 3.26Å; N150-I154 PolarHBondContact O-N 3.11Å; I151-I154 PolarHBondContact O-N 3.41Å; T152-I154 VanDerWaalsContact C-N 3.3Å; T152-I154 PolarHBondContact O-N 3.16Å
155	Y	40.8	Very low	38.8	Very low	112 Å²	112	113.3 Å²	113.3	44%	0.439	63%	0.628	S	S	.	*	H	α-helix	trans	-86.8	-16.8	-179.7	-69.9	-80.3	0	0	0	114.3	I151 N157 E657	I151-Y155 HydrophobicContact CG2-CD2 3.95Å; I151-Y155 HydrophobicContact CG2-CE2 4.06Å; I151-Y155 WeakPolarHBondContact O-CD2 3.47Å; I151-Y155 PolarHBondContact O-N 3.13Å; Y155-N157 PolarHBondContact O-N 3.08Å; Y155-N157 VanDerWaalsContact O-N 3.12Å; Y155-E657 VanDerWaalsContact CE1-OE2 3.24Å; Y155-E657 WeakPolarHBondContact CE1-OE2 3.2Å; Y155-E657 VanDerWaalsContact OH-CD 3.28Å; Y155-E657 PolarHBondContact OH-OE1 3.2Å; Y155-E657 PolarHBondContact OH-OE2 2.99Å; Y155-E657 VanDerWaalsContact OH-OE2 3.08Å
156	G	37.8	Very low	37.8	Very low	66 Å²	66	113.2 Å²	113.2	68%	0.68	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-2.1	-174.6	0	0	0	0	0	117.4	T152	T152-G156 PolarHBondContact O-N 2.86Å; T152-G156 VanDerWaalsContact O-N 3.09Å
157	N	36.1	Very low	36.9	Very low	143 Å²	143	118.5 Å²	118.5	77%	0.765	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.3	-3.5	-167.2	-149.4	22.3	0	0	0	115.6	Y155	Y155-N157 PolarHBondContact O-N 3.08Å; Y155-N157 VanDerWaalsContact O-N 3.12Å
158	N	30.9	Very low	36.2	Very low	157 Å²	157	120.9 Å²	120.9	84%	0.84	69%	0.693	S	S	*	*	S	Bend	trans	-123.9	53.9	-173.5	-77.3	-18.1	0	0	0	112.9
159	G	30.7	Very low	35.3	Very low	76 Å²	76	124.5 Å²	124.5	78%	0.784	71%	0.709	S	S	*	*	S	Bend	trans	-173.1	34.8	-174.2	0	0	0	0	0	121.3
160	S	30.2	Very low	34.7	Very low	118 Å²	118	124.2 Å²	124.2	83%	0.825	72%	0.717	S	S	*	*			trans	-159.2	75.7	174	46.9	0	0	0	0	115.5
161	R	27.7	Very low	34.1	Very low	242 Å²	242	126.5 Å²	126.5	91%	0.913	74%	0.739	S	S	*	*			trans	-118.4	29.1	168.5	-82	-159	-173.8	-178	5.7	114.7
162	Y	30.3	Very low	33.4	Very low	225 Å²	225	127.3 Å²	127.3	88%	0.882	76%	0.763	S	S	*	*			trans	-140	94.6	173.2	-72.9	-69.6	0	0	0	112.7
163	S	31.3	Very low	32.8	Very low	118 Å²	118	131.3 Å²	131.3	83%	0.825	78%	0.779	S	S	*	*			trans	165.8	113.6	144.3	-78.5	0	0	0	0	108.9
164	S	26.3	Very low	32.3	Very low	123 Å²	123	131.9 Å²	131.9	86%	0.86	79%	0.787	S	S	*	*			trans	-142.7	75.1	-178.6	-60.5	0	0	0	0	111.1
165	T	30.8	Very low	31.5	Very low	139 Å²	139	137.9 Å²	137.9	85%	0.853	80%	0.802	S	S	*	*			trans	-147.4	151.8	171.8	40.8	0	0	0	0	110.1
166	A	30.6	Very low	31	Very low	102 Å²	102	137.9 Å²	137.9	84%	0.843	82%	0.819	S	S	*	*			trans	77	88.3	175.2	0	0	0	0	0	118.9
167	L	29.6	Very low	30.5	Very low	171 Å²	171	144.7 Å²	144.7	90%	0.895	82%	0.824	S	S	*	*			trans	-138.8	161.8	147.6	-90.2	163.5	0	0	0	105.5
168	P	37.7	Very low	30.1	Very low	94 Å²	94	145.2 Å²	145.2	61%	0.61	82%	0.822	S	S	*	*			cis	-138	-168.9	18.4	43.1	-24.7	0	0	0	115.9
169	N	30.6	Very low	29.9	Very low	154 Å²	154	147.2 Å²	147.2	82%	0.824	83%	0.826	S	S	*	*			trans	75.6	142	160.3	-62.6	-15.6	0	0	0	118.1
170	S	33	Very low	29.8	Very low	99 Å²	99	149.4 Å²	149.4	69%	0.692	83%	0.829	S	S	*	*			cis	-149.8	144.6	-0.1	54.2	0	0	0	0	113.9
171	S	30.2	Very low	29.6	Very low	118 Å²	118	148.9 Å²	148.9	83%	0.825	83%	0.826	S	S	*	*			trans	33.7	122.9	147.7	62.1	0	0	0	0	121.5
172	G	30.7	Very low	29.9	Very low	79 Å²	79	143.4 Å²	143.4	81%	0.814	81%	0.813	S	S	*	*			trans	169.1	96.3	158.9	0	0	0	0	0	115.5	T174	G172-T174 PolarHBondContact O-N 3.37Å
173	I	29.3	Very low	30.1	Very low	172 Å²	172	141 Å²	141	88%	0.882	81%	0.81	S	S	*	*			trans	-70.3	117.8	176.6	-61.1	162.1	0	0	0	110.5
174	T	31.1	Very low	30.4	Very low	140 Å²	140	142.3 Å²	142.3	86%	0.859	80%	0.803	S	S	*	*			trans	-169.6	166.6	139.4	10.1	0	0	0	0	112.1	G172	G172-T174 PolarHBondContact O-N 3.37Å
175	R	26	Very low	31.1	Very low	247 Å²	247	144 Å²	144	93%	0.932	80%	0.798	S	S	*	*			trans	-96.1	110.1	-169.9	-65.3	169.5	173.4	153.1	-6.1	113.2
176	S	29.2	Very low	31.5	Very low	113 Å²	113	141.2 Å²	141.2	79%	0.79	78%	0.78	S	S	*	*			trans	-88.7	132.7	137.6	44.2	0	0	0	0	106.9
177	R	28.7	Very low	31.7	Very low	209 Å²	209	141.7 Å²	141.7	79%	0.789	77%	0.768	S	S	*	*			cis	66.8	126.3	32.8	-168	174.3	170.9	134.2	2.3	112.4
178	E	27.2	Very low	32	Very low	153 Å²	153	139.7 Å²	139.7	72%	0.715	76%	0.758	S	S	*	*			trans	67.3	90.1	-177.4	-71.2	144.6	-133.9	0	0	115.5
179	Q	27.3	Very low	31.9	Very low	199 Å²	199	138.2 Å²	138.2	93%	0.93	75%	0.75	S	S	*	*	S	Bend	trans	169.7	78.4	134.2	-92.5	168.4	5.3	0	0	112
180	S	27.7	Very low	31.9	Very low	122 Å²	122	137.5 Å²	137.5	85%	0.853	74%	0.74	S	S	*	*	S	Bend	trans	-174.2	50.3	164.1	59.8	0	0	0	0	112.7
181	S	26.4	Very low	32.2	Very low	107 Å²	107	139.2 Å²	139.2	75%	0.748	74%	0.74	S	S	*	*	S	Bend	trans	-158.1	45.1	-174.1	66.4	0	0	0	0	114.5
182	I	34	Very low	32.5	Very low	127 Å²	127	140 Å²	140	65%	0.651	73%	0.733	S	S	*	*	S	Bend	trans	-135.4	-31.8	176.7	-62.3	-176.3	0	0	0	112.5	V186	I182-V186 WeakPolarHBondContact O-CG2 3.47Å
183	E	34.1	Very low	32.6	Very low	175 Å²	175	143.1 Å²	143.1	82%	0.818	72%	0.724	S	S	*	*	H	α-helix	trans	-84.5	-24.2	-169.1	-62.5	-171.2	150.3	0	0	116.2
184	E	38.7	Very low	33	Very low	145 Å²	145	141.4 Å²	141.4	68%	0.678	71%	0.71	S	S	*	*	H	α-helix	trans	-73.8	-26.3	173.3	-76.7	-165.5	133.8	0	0	112.5	K145	K145-E184 IonicContact NZ-OE1 2.82Å; K145-E184 PolarHBondContact NZ-OE1 3.14Å; K145-E184 IonicContact NZ-OE2 3.89Å
185	E	39.4	Very low	32.8	Very low	160 Å²	160	145.5 Å²	145.5	75%	0.748	71%	0.71	S	S	*	*	H	α-helix	trans	-88.2	-22	-174	-156.2	164.6	-141.7	0	0	113.4	S189	E185-S189 WeakPolarHBondContact O-CB 3.44Å; E185-S189 PolarHBondContact O-OG 3.37Å
186	V	40.7	Very low	33.1	Very low	80 Å²	80	136.6 Å²	136.6	49%	0.485	70%	0.696	S	S	.	*	H	α-helix	trans	-88.4	-24.8	179	179.5	0	0	0	0	112.7	I182 S189 F190	I182-V186 WeakPolarHBondContact O-CG2 3.47Å; V186-S189 WeakPolarHBondContact CA-OG 3.29Å; V186-S189 PolarHBondContact O-OG 3.12Å; V186-F190 HydrophobicContact CG1-CD2 4.33Å; V186-F190 HydrophobicContact CG1-CE2 4.43Å; V186-F190 VanDerWaalsContact O-CD2 3.29Å; V186-F190 WeakPolarHBondContact O-CD2 3.38Å
187	L	34.8	Very low	33.1	Very low	111 Å²	111	139.2 Å²	139.2	58%	0.581	70%	0.695	S	S	*	*	H	α-helix	trans	-82.8	-44.8	-178.3	-162.7	64	0	0	0	112.8	S189 F190 I191	L187-S189 VanDerWaalsContact C-N 3.28Å; L187-S189 PolarHBondContact O-N 3.34Å; L187-F190 PolarHBondContact O-N 2.84Å; L187-F190 VanDerWaalsContact O-N 3.16Å; L187-I191 HydrophobicContact CD1-CD1 4.36Å; L187-I191 HydrophobicContact CG-CD1 4.21Å; L187-I191 PolarHBondContact O-N 2.84Å; L187-I191 VanDerWaalsContact O-N 3.07Å
188	D	34.8	Very low	33.7	Very low	130 Å²	130	134.1 Å²	134.1	70%	0.695	68%	0.684	S	S	*	*	H	α-helix	trans	-65	-31.8	176.2	-90.1	-0.7	0	0	0	112.1	F190 I192	D188-F190 VanDerWaalsContact C-N 3.3Å; D188-F190 PolarHBondContact O-N 3.12Å; D188-I192 PolarHBondContact O-N 3.04Å
189	S	35.2	Very low	34.7	Very low	63 Å²	63	134.2 Å²	134.2	44%	0.441	68%	0.682	S	S	.	*	H	α-helix	trans	-76.7	-10.9	175.9	57.1	0	0	0	0	114.5	E185 V186 L187 K193	E185-S189 WeakPolarHBondContact O-CB 3.44Å; E185-S189 PolarHBondContact O-OG 3.37Å; V186-S189 WeakPolarHBondContact CA-OG 3.29Å; V186-S189 PolarHBondContact O-OG 3.12Å; L187-S189 VanDerWaalsContact C-N 3.28Å; L187-S189 PolarHBondContact O-N 3.34Å; S189-K193 PolarHBondContact O-N 3.11Å
190	F	30.9	Very low	35.5	Very low	139 Å²	139	133.3 Å²	133.3	61%	0.61	67%	0.671	S	S	*	*	H	α-helix	trans	-103.8	-35.3	176	-92	-104.6	0	0	0	114	V186 L187 D188 K193	V186-F190 HydrophobicContact CG1-CD2 4.33Å; V186-F190 HydrophobicContact CG1-CE2 4.43Å; V186-F190 VanDerWaalsContact O-CD2 3.29Å; V186-F190 WeakPolarHBondContact O-CD2 3.38Å; L187-F190 PolarHBondContact O-N 2.84Å; L187-F190 VanDerWaalsContact O-N 3.16Å; D188-F190 VanDerWaalsContact C-N 3.3Å; D188-F190 PolarHBondContact O-N 3.12Å; F190-K193 PolarHBondContact O-N 3.35Å
191	I	40.2	Very low	36.2	Very low	134 Å²	134	131.5 Å²	131.5	69%	0.687	65%	0.649	S	S	*	*	H	α-helix	trans	-73.8	-29.8	177.7	-66.2	178.3	0	0	0	111.7	L187	L187-I191 HydrophobicContact CD1-CD1 4.36Å; L187-I191 HydrophobicContact CG-CD1 4.21Å; L187-I191 PolarHBondContact O-N 2.84Å; L187-I191 VanDerWaalsContact O-N 3.07Å
192	I	36.6	Very low	37.2	Very low	134 Å²	134	132.5 Å²	132.5	69%	0.687	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.5	53.6	160.6	-43.7	-177	0	0	0	109.4	D188 K194	D188-I192 PolarHBondContact O-N 3.04Å; I192-K194 HydrophobicContact CG2-CB 4.32Å; I192-K194 PolarHBondContact O-N 3.4Å
193	K	32.6	Very low	37.6	Very low	145 Å²	145	129.2 Å²	129.2	63%	0.63	63%	0.628	S	S	*	*			trans	-67	83.5	151.7	-175.7	165.7	-174.4	166.4	0	107.6	S189 F190 R195	S189-K193 PolarHBondContact O-N 3.11Å; F190-K193 PolarHBondContact O-N 3.35Å; K193-R195 PolarHBondContact O-N 3.36Å
194	K	36.6	Very low	38.3	Very low	136 Å²	136	124.1 Å²	124.1	59%	0.591	61%	0.612	S	S	*	*			trans	-64.3	89	175.6	-165.2	175.3	-173.8	-178.9	0	108.5	I192 E201	I192-K194 HydrophobicContact CG2-CB 4.32Å; I192-K194 PolarHBondContact O-N 3.4Å; K194-E201 WeakPolarHBondContact CE-OE2 3.46Å; K194-E201 IonicContact NZ-OE2 3.37Å; K194-E201 PolarHBondContact NZ-OE2 3Å
195	R	28.4	Very low	38.7	Very low	226 Å²	226	122.2 Å²	122.2	85%	0.853	61%	0.606	S	S	*	*			trans	-52.8	142.7	168.4	-131.9	168.6	-175	144.2	-0.6	107.1	K193	K193-R195 PolarHBondContact O-N 3.36Å
196	G	31.7	Very low	39.6	Very low	61 Å²	61	122.1 Å²	122.1	63%	0.629	61%	0.606	S	S	*	*			trans	-61.3	177.1	-175.3	0	0	0	0	0	112.9
197	E	29.6	Very low	40.2	Very low	167 Å²	167	124.6 Å²	124.6	78%	0.78	61%	0.61	S	S	*	*			trans	79.5	133.8	-160.3	-52.8	145.8	-141.6	0	0	111.1
198	D	41	Very low	41.8	Very low	102 Å²	102	123.7 Å²	123.7	55%	0.545	60%	0.601	S	S	.	*			cis	-156.4	172.2	-13.9	-123.7	-11.4	0	0	0	110.6	Y200 E201	D198-Y200 HydrophobicContact CB-CD2 4.28Å; D198-Y200 PolarHBondContact O-N 3.08Å; D198-Y200 VanDerWaalsContact O-N 3.12Å; D198-E201 PolarHBondContact O-N 3.43Å
199	F	49	Very low	43.5	Very low	155 Å²	155	118.2 Å²	118.2	68%	0.68	57%	0.573	S	S	*	*	H	α-helix	trans	-50.8	-34.7	167.9	175.7	-107.7	0	0	0	111.6	E201 Q202 V203	F199-E201 VanDerWaalsContact C-N 3.32Å; F199-E201 PolarHBondContact O-N 3.03Å; F199-Q202 PolarHBondContact O-N 2.8Å; F199-V203 HydrophobicContact CD1-CG2 3.91Å; F199-V203 HydrophobicContact CD2-CG2 4.33Å; F199-V203 HydrophobicContact CE1-CG2 3.54Å; F199-V203 HydrophobicContact CE2-CG2 4Å; F199-V203 HydrophobicContact CG-CG2 4.3Å; F199-V203 HydrophobicContact CZ-CG2 3.59Å; F199-V203 WeakPolarHBondContact O-CG2 3.42Å; F199-V203 PolarHBondContact O-N 2.91Å
200	Y	43.6	Very low	45.7	Very low	181 Å²	181	115.5 Å²	115.5	71%	0.71	55%	0.553	S	S	*	*	H	α-helix	trans	-56.2	-35.8	173.4	-73.1	-76.8	0	0	0	114.7	D198 S204	D198-Y200 HydrophobicContact CB-CD2 4.28Å; D198-Y200 PolarHBondContact O-N 3.08Å; D198-Y200 VanDerWaalsContact O-N 3.12Å; Y200-S204 VanDerWaalsContact O-CB 3.3Å; Y200-S204 WeakPolarHBondContact O-CB 3.48Å; Y200-S204 PolarHBondContact O-N 3.4Å; Y200-S204 PolarHBondContact O-OG 3.07Å
201	E	42.4	Very low	48.3	Very low	83 Å²	83	109 Å²	109	39%	0.388	52%	0.524	S	S	.	.	H	α-helix	trans	-77.1	-32.8	-180	-157.5	-137.4	-135.6	0	0	111.5	K194 D198 F199 S204 N205	K194-E201 WeakPolarHBondContact CE-OE2 3.46Å; K194-E201 IonicContact NZ-OE2 3.37Å; K194-E201 PolarHBondContact NZ-OE2 3Å; D198-E201 PolarHBondContact O-N 3.43Å; F199-E201 VanDerWaalsContact C-N 3.32Å; F199-E201 PolarHBondContact O-N 3.03Å; E201-S204 PolarHBondContact O-OG 2.9Å; E201-S204 VanDerWaalsContact O-OG 3.12Å; E201-N205 PolarHBondContact O-N 3.46Å; E201-N205 PolarHBondContact O-ND2 3.34Å
202	Q	46.7	Very low	50.6	Low	128 Å²	128	102.7 Å²	102.7	60%	0.598	49%	0.492	S	S	*	.	H	α-helix	trans	-69.1	-41.9	171.1	-169	169.7	10.5	0	0	111.1	F199 H206	F199-Q202 PolarHBondContact O-N 2.8Å; Q202-H206 PolarHBondContact O-CD2 3.25Å; Q202-H206 VanDerWaalsContact O-CD2 3.23Å; Q202-H206 PolarHBondContact O-N 3.42Å
203	V	43.4	Very low	53.2	Low	59 Å²	59	97.2 Å²	97.2	36%	0.358	46%	0.464	S	S	.	.	H	α-helix	trans	-64.2	-43.4	175	171.3	0	0	0	0	111.6	F199 N205 H206 F207	F199-V203 HydrophobicContact CD1-CG2 3.91Å; F199-V203 HydrophobicContact CD2-CG2 4.33Å; F199-V203 HydrophobicContact CE1-CG2 3.54Å; F199-V203 HydrophobicContact CE2-CG2 4Å; F199-V203 HydrophobicContact CG-CG2 4.3Å; F199-V203 HydrophobicContact CZ-CG2 3.59Å; F199-V203 WeakPolarHBondContact O-CG2 3.42Å; F199-V203 PolarHBondContact O-N 2.91Å; V203-N205 VanDerWaalsContact C-N 3.31Å; V203-N205 PolarHBondContact O-N 3.11Å; V203-H206 PolarHBondContact O-N 2.9Å; V203-H206 VanDerWaalsContact O-N 3.13Å; V203-F207 HydrophobicContact CG1-CB 4.15Å; V203-F207 VanDerWaalsContact O-CB 3.3Å; V203-F207 WeakPolarHBondContact O-CB 3.27Å; V203-F207 PolarHBondContact O-N 3.17Å
204	S	47.9	Very low	56	Low	68 Å²	68	91.3 Å²	91.3	48%	0.476	44%	0.439	S	S	.	.	H	α-helix	trans	-66.1	-31	-178.5	70.3	0	0	0	0	113.3	Y200 E201 H206	Y200-S204 VanDerWaalsContact O-CB 3.3Å; Y200-S204 WeakPolarHBondContact O-CB 3.48Å; Y200-S204 PolarHBondContact O-N 3.4Å; Y200-S204 PolarHBondContact O-OG 3.07Å; E201-S204 PolarHBondContact O-OG 2.9Å; E201-S204 VanDerWaalsContact O-OG 3.12Å; S204-H206 VanDerWaalsContact C-N 3.35Å
205	N	47.9	Very low	58.7	Low	104 Å²	104	84.8 Å²	84.8	56%	0.556	41%	0.411	S	S	*	.	H	α-helix	trans	-70.7	-28.4	174.2	-83.7	-73	0	0	0	113.2	E201 V203	E201-N205 PolarHBondContact O-N 3.46Å; E201-N205 PolarHBondContact O-ND2 3.34Å; V203-N205 VanDerWaalsContact C-N 3.31Å; V203-N205 PolarHBondContact O-N 3.11Å
206	H	57.1	Low	61.8	Low	159 Å²	159	74.2 Å²	74.2	74%	0.736	37%	0.372	S	S	*	.	H	α-helix	trans	-94.7	-37.3	178.7	-75.4	-63.5	0	0	0	113.8	Q202 V203 S204 K208	Q202-H206 PolarHBondContact O-CD2 3.25Å; Q202-H206 VanDerWaalsContact O-CD2 3.23Å; Q202-H206 PolarHBondContact O-N 3.42Å; V203-H206 PolarHBondContact O-N 2.9Å; V203-H206 VanDerWaalsContact O-N 3.13Å; S204-H206 VanDerWaalsContact C-N 3.35Å; H206-K208 PolarHBondContact O-N 3.21Å
207	F	54.7	Low	64.8	Low	132 Å²	132	73.3 Å²	73.3	58%	0.579	35%	0.352	S	S	*	.			trans	-96.8	94.1	-174.2	-155.9	-95.5	0	0	0	110.1	V203 P209	V203-F207 HydrophobicContact CG1-CB 4.15Å; V203-F207 VanDerWaalsContact O-CB 3.3Å; V203-F207 WeakPolarHBondContact O-CB 3.27Å; V203-F207 PolarHBondContact O-N 3.17Å; F207-P209 VanDerWaalsContact C-CD 3.47Å; F207-P209 WeakPolarHBondContact O-CD 3.37Å
208	K	68.4	Low	67.8	Low	92 Å²	92	65.4 Å²	65.4	40%	0.4	32%	0.315	S	S	.	.			trans	-102.9	82.4	179.6	-69.1	-170.3	173.8	-171.8	0	111.2	V116 G117 H118 H206 F210	V116-K208 HydrophobicContact CG1-CB 4.01Å; V116-K208 HydrophobicContact CG1-CG 4.33Å; G117-K208 PolarHBondContact O-NZ 3.26Å; H118-K208 HydrophobicContact CB-CB 4.3Å; H206-K208 PolarHBondContact O-N 3.21Å; K208-F210 PolarHBondContact O-N 3Å
209	P	70	Confident	70.4	Confident	14 Å²	14	60.6 Å²	60.6	9%	0.091	29%	0.289	C	S	.	.			trans	-60.1	128.4	177.3	25.3	-35.1	0	0	0	110.8	I107 S111 V116 F207 L214	I107-P209 HydrophobicContact CG2-CB 3.94Å; I107-P209 HydrophobicContact CG2-CG 4.25Å; S111-P209 WeakPolarHBondContact CB-O 3.25Å; V116-P209 HydrophobicContact CG1-CG 4.06Å; V116-P209 HydrophobicContact CG2-CG 4.46Å; F207-P209 VanDerWaalsContact C-CD 3.47Å; F207-P209 WeakPolarHBondContact O-CD 3.37Å; P209-L214 HydrophobicContact CB-CD1 3.71Å
210	F	81.1	Confident	72.5	Confident	7 Å²	7	53.5 Å²	53.5	3%	0.031	26%	0.258	C	S	.	.			trans	-108.7	118.3	173.5	165.9	-91	0	0	0	108.7	A120 N121 K208 T212 I213 L214 L321 H324 Y325	A120-F210 HydrophobicContact CB-CD2 3.92Å; A120-F210 HydrophobicContact CB-CE2 3.49Å; A120-F210 VanDerWaalsContact CB-CE2 3.49Å; A120-F210 HydrophobicContact CB-CZ 4.37Å; N121-F210 HydrophobicContact CB-CD2 3.77Å; N121-F210 HydrophobicContact CB-CE2 4.5Å; K208-F210 PolarHBondContact O-N 3Å; F210-T212 VanDerWaalsContact C-N 3.31Å; F210-T212 VanDerWaalsContact CE1-CB 3.42Å; F210-T212 WeakPolarHBondContact CZ-OG1 3.49Å; F210-T212 PolarHBondContact O-N 3.21Å; F210-T212 VanDerWaalsContact O-N 3.17Å; F210-I213 HydrophobicContact CB-CD1 4.14Å; F210-I213 HydrophobicContact CD1-CB 4.04Å; F210-I213 HydrophobicContact CD1-CD1 3.39Å; F210-I213 HydrophobicContact CD1-CG1 3.49Å; F210-I213 VanDerWaalsContact CD1-CG1 3.49Å; F210-I213 HydrophobicContact CE1-CD1 4.12Å; F210-I213 HydrophobicContact CE1-CG1 3.91Å; F210-I213 HydrophobicContact CG-CD1 4.14Å; F210-I213 PolarHBondContact O-N 2.91Å; F210-L214 PolarHBondContact O-N 3.25Å; F210-L321 HydrophobicContact CE1-CD1 3.89Å; F210-H324 HydrophobicContact CZ-CB 4.32Å; F210-Y325 HydrophobicContact CD1-CD2 4.12Å; F210-Y325 HydrophobicContact CD1-CE2 4.17Å; F210-Y325 HydrophobicContact CD2-CD2 4.27Å; F210-Y325 HydrophobicContact CD2-CE2 4.36Å; F210-Y325 AromaticContact CE1-CD2 3.6Å; F210-Y325 HydrophobicContact CE1-CD2 3.6Å; F210-Y325 HydrophobicContact CE1-CE2 4.12Å; F210-Y325 HydrophobicContact CE1-CG 4.39Å; F210-Y325 AromaticContact CE2-CD2 3.88Å; F210-Y325 HydrophobicContact CE2-CD2 3.88Å; F210-Y325 HydrophobicContact CE2-CE2 4.42Å; F210-Y325 HydrophobicContact CG-CD2 4.41Å; F210-Y325 HydrophobicContact CG-CE2 4.27Å; F210-Y325 AromaticContact CZ-CD2 3.51Å; F210-Y325 HydrophobicContact CZ-CD2 3.51Å; F210-Y325 HydrophobicContact CZ-CE2 4.29Å; F210-Y325 HydrophobicContact CZ-CG 4.33Å
211	S	85.6	Confident	74.9	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.007	23%	0.231	C	C	.	.	H	α-helix	trans	-51.8	-43.6	-167.3	165.2	0	0	0	0	113.4	Y50 M108 S111 N121 I213 L214 Y215	Y50-S211 WeakPolarHBondContact CE1-OG 3.49Å; Y50-S211 PolarHBondContact OH-OG 3.41Å; M108-S211 PolarHBondContact SD-OG 3.04Å; M108-S211 VanDerWaalsContact SD-OG 3.39Å; S111-S211 WeakPolarHBondContact OG-CA 3.1Å; N121-S211 PolarHBondContact OD1-N 3.41Å; S211-I213 PolarHBondContact O-N 3.16Å; S211-L214 PolarHBondContact O-N 3.07Å; S211-Y215 PolarHBondContact O-N 3.34Å
212	T	87.8	Confident	77.3	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.012	21%	0.214	C	C	.	.	H	α-helix	trans	-71.6	-27.6	-172.5	-32.2	0	0	0	0	113.1	Y50 F210 V216 M320 L321	Y50-T212 WeakPolarHBondContact OH-CA 3.34Å; Y50-T212 PolarHBondContact OH-N 3.14Å; Y50-T212 PolarHBondContact OH-OG1 2.8Å; F210-T212 VanDerWaalsContact C-N 3.31Å; F210-T212 VanDerWaalsContact CE1-CB 3.42Å; F210-T212 WeakPolarHBondContact CZ-OG1 3.49Å; F210-T212 PolarHBondContact O-N 3.21Å; F210-T212 VanDerWaalsContact O-N 3.17Å; T212-V216 VanDerWaalsContact O-CG2 3.29Å; T212-V216 WeakPolarHBondContact O-CG2 3.29Å; T212-V216 PolarHBondContact O-N 3.46Å; T212-M320 HydrophobicContact CG2-CB 3.67Å; T212-L321 HydrophobicContact CG2-CB 4.36Å
213	I	91.3	Very high	79.5	Confident	19 Å²	19	36.8 Å²	36.8	10%	0.097	19%	0.187	C	C	.	.	H	α-helix	trans	-71.7	-43.2	172.5	-67.9	154.8	0	0	0	110.4	F210 S211 Y215 V216 L217 L321 Y325 I404 M408	F210-I213 HydrophobicContact CB-CD1 4.14Å; F210-I213 HydrophobicContact CD1-CB 4.04Å; F210-I213 HydrophobicContact CD1-CD1 3.39Å; F210-I213 HydrophobicContact CD1-CG1 3.49Å; F210-I213 VanDerWaalsContact CD1-CG1 3.49Å; F210-I213 HydrophobicContact CE1-CD1 4.12Å; F210-I213 HydrophobicContact CE1-CG1 3.91Å; F210-I213 HydrophobicContact CG-CD1 4.14Å; F210-I213 PolarHBondContact O-N 2.91Å; S211-I213 PolarHBondContact O-N 3.16Å; I213-Y215 PolarHBondContact O-N 3.16Å; I213-V216 PolarHBondContact O-N 2.93Å; I213-L217 WeakPolarHBondContact O-CB 3.41Å; I213-L217 PolarHBondContact O-N 3.5Å; I213-L321 HydrophobicContact CG1-CD1 3.9Å; I213-Y325 HydrophobicContact CD1-CE2 4.3Å; I213-I404 HydrophobicContact CG2-CD1 4.05Å; I213-I404 HydrophobicContact CG2-CG1 4.43Å; I213-I404 HydrophobicContact CG2-CG2 3.7Å; I213-M408 HydrophobicContact CD1-CE 3.28Å; I213-M408 HydrophobicContact CD1-SD 3.37Å; I213-M408 WeakPolarHBondContact CD1-SD 3.46Å; I213-M408 HydrophobicContact CG1-CE 4.15Å
214	L	91.8	Very high	81.7	Confident	21 Å²	21	34.9 Å²	34.9	11%	0.11	18%	0.175	C	C	.	.	H	α-helix	trans	-62.8	-36.7	176.7	-67.1	173.5	0	0	0	110.5	L104 I107 M108 P209 F210 S211 I218	L104-L214 HydrophobicContact CD2-CD2 4.08Å; I107-L214 HydrophobicContact CB-CD1 4.48Å; I107-L214 HydrophobicContact CG2-CD1 3.97Å; M108-L214 HydrophobicContact CB-CB 3.83Å; M108-L214 HydrophobicContact CB-CD1 4.11Å; M108-L214 HydrophobicContact CG-CB 3.63Å; P209-L214 HydrophobicContact CB-CD1 3.71Å; F210-L214 PolarHBondContact O-N 3.25Å; S211-L214 PolarHBondContact O-N 3.07Å; L214-I218 WeakPolarHBondContact O-CB 3.34Å; L214-I218 WeakPolarHBondContact O-CD1 3.5Å; L214-I218 WeakPolarHBondContact O-CG1 3.19Å; L214-I218 PolarHBondContact O-N 3.02Å
215	Y	93.5	Very high	83.7	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-63.2	-47.7	171.3	-178.2	-130	0	0	0	112.4	F53 T54 S57 I58 S211 I213 L217 I218 T219	F53-Y215 HydrophobicContact CE1-CE1 4.46Å; T54-Y215 HydrophobicContact CG2-CD1 4.02Å; T54-Y215 HydrophobicContact CG2-CD2 4.38Å; T54-Y215 HydrophobicContact CG2-CE1 4.25Å; T54-Y215 HydrophobicContact CG2-CG 4.11Å; S57-Y215 PolarHBondContact OG-OH 3.44Å; I58-Y215 HydrophobicContact CD1-CD2 3.73Å; I58-Y215 HydrophobicContact CD1-CE2 4.3Å; I58-Y215 HydrophobicContact CG1-CD2 3.91Å; I58-Y215 HydrophobicContact CG1-CE2 3.99Å; S211-Y215 PolarHBondContact O-N 3.34Å; I213-Y215 PolarHBondContact O-N 3.16Å; Y215-L217 PolarHBondContact O-N 3.23Å; Y215-I218 PolarHBondContact O-N 2.92Å; Y215-T219 HydrophobicContact CD2-CG2 4.05Å; Y215-T219 HydrophobicContact CE2-CG2 3.64Å; Y215-T219 WeakPolarHBondContact O-CG2 3.17Å; Y215-T219 PolarHBondContact O-N 3.4Å; Y215-T219 PolarHBondContact O-OG1 3.42Å; Y215-T219 VanDerWaalsContact O-OG1 3.04Å
216	V	94.1	Very high	85.7	Confident	4 Å²	4	27.1 Å²	27.1	2%	0.024	13%	0.128	C	C	.	.	H	α-helix	trans	-56.2	-49.2	173.9	169.5	0	0	0	0	111.3	T212 I213 I218 T219 Y220 F314 S317 L318 L321	T212-V216 VanDerWaalsContact O-CG2 3.29Å; T212-V216 WeakPolarHBondContact O-CG2 3.29Å; T212-V216 PolarHBondContact O-N 3.46Å; I213-V216 PolarHBondContact O-N 2.93Å; V216-I218 PolarHBondContact O-N 3.45Å; V216-T219 WeakPolarHBondContact CA-OG1 3.36Å; V216-T219 PolarHBondContact O-N 3.36Å; V216-T219 PolarHBondContact O-OG1 2.92Å; V216-Y220 WeakPolarHBondContact O-CB 3.36Å; V216-Y220 PolarHBondContact O-N 2.98Å; V216-F314 HydrophobicContact CG1-CE2 4.08Å; V216-S317 WeakPolarHBondContact CG2-O 3.2Å; V216-S317 WeakPolarHBondContact CG2-OG 3.48Å; V216-L318 HydrophobicContact CG1-CD2 4.02Å; V216-L318 HydrophobicContact CG2-CD2 4.36Å; V216-L321 HydrophobicContact CG2-CB 4.3Å; V216-L321 HydrophobicContact CG2-CD2 4.33Å
217	L	93.8	Very high	87.2	Confident	42 Å²	42	20.1 Å²	20.1	22%	0.22	10%	0.097	C	C	.	.	H	α-helix	trans	-61.4	-43.7	179.3	-177.4	62.1	0	0	0	112.1	L104 I213 Y215 Y220 L221 L400	L104-L217 HydrophobicContact CD1-CD2 3.69Å; L104-L217 HydrophobicContact CD1-CG 3.96Å; L104-L217 HydrophobicContact CD2-CD2 4.33Å; I213-L217 WeakPolarHBondContact O-CB 3.41Å; I213-L217 PolarHBondContact O-N 3.5Å; Y215-L217 PolarHBondContact O-N 3.23Å; L217-Y220 PolarHBondContact O-N 3.24Å; L217-L221 HydrophobicContact CG-CD1 4.31Å; L217-L221 VanDerWaalsContact O-CG 3.28Å; L217-L221 WeakPolarHBondContact O-CG 3.49Å; L217-L221 PolarHBondContact O-N 3.18Å; L217-L400 HydrophobicContact CD1-CD2 3.73Å
218	I	93.7	Very high	88.9	Confident	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-63.3	-46.4	175.4	-73.9	165	0	0	0	111.1	I58 S101 L104 M108 L214 Y215 V216 Y220 L221 F222	I58-I218 HydrophobicContact CD1-CB 4.37Å; I58-I218 HydrophobicContact CD1-CD1 3.85Å; I58-I218 HydrophobicContact CD1-CG2 3.9Å; I58-I218 HydrophobicContact CG1-CG2 3.78Å; I58-I218 HydrophobicContact CG2-CG2 4.07Å; S101-I218 WeakPolarHBondContact OG-CG2 3.22Å; L104-I218 HydrophobicContact CB-CD1 3.89Å; L104-I218 HydrophobicContact CB-CG1 3.85Å; L104-I218 HydrophobicContact CD1-CG1 4.31Å; M108-I218 HydrophobicContact CB-CD1 4.24Å; M108-I218 HydrophobicContact CG-CD1 4.5Å; L214-I218 WeakPolarHBondContact O-CB 3.34Å; L214-I218 WeakPolarHBondContact O-CD1 3.5Å; L214-I218 WeakPolarHBondContact O-CG1 3.19Å; L214-I218 PolarHBondContact O-N 3.02Å; Y215-I218 PolarHBondContact O-N 2.92Å; V216-I218 PolarHBondContact O-N 3.45Å; I218-Y220 VanDerWaalsContact C-N 3.32Å; I218-Y220 PolarHBondContact O-N 3.29Å; I218-L221 PolarHBondContact O-N 2.9Å; I218-F222 HydrophobicContact CG2-CD2 3.95Å; I218-F222 HydrophobicContact CG2-CE2 3.7Å; I218-F222 WeakPolarHBondContact O-CD2 3.08Å; I218-F222 PolarHBondContact O-N 2.86Å; I218-F222 VanDerWaalsContact O-N 3.17Å
219	T	94.4	Very high	89.8	Confident	1 Å²	1	9.7 Å²	9.7	1%	0.006	5%	0.052	C	C	.	.	H	α-helix	trans	-63.1	-37.6	178.2	51	0	0	0	0	112.3	L61 Y215 V216 F222 L223 C313 S317	L61-T219 HydrophobicContact CD1-CG2 3.92Å; Y215-T219 HydrophobicContact CD2-CG2 4.05Å; Y215-T219 HydrophobicContact CE2-CG2 3.64Å; Y215-T219 WeakPolarHBondContact O-CG2 3.17Å; Y215-T219 PolarHBondContact O-N 3.4Å; Y215-T219 PolarHBondContact O-OG1 3.42Å; Y215-T219 VanDerWaalsContact O-OG1 3.04Å; V216-T219 WeakPolarHBondContact CA-OG1 3.36Å; V216-T219 PolarHBondContact O-N 3.36Å; V216-T219 PolarHBondContact O-OG1 2.92Å; T219-F222 PolarHBondContact O-N 2.93Å; T219-L223 WeakPolarHBondContact O-CB 3.47Å; T219-L223 PolarHBondContact O-N 3.26Å; T219-L223 VanDerWaalsContact O-N 3.13Å; T219-C313 HydrophobicContact CG2-CB 4.04Å; T219-S317 PolarHBondContact OG1-OG 3.24Å
220	Y	93.9	Very high	90.6	Very high	7 Å²	7	10.3 Å²	10.3	3%	0.027	5%	0.053	C	C	.	.	H	α-helix	trans	-65.4	-41.3	174.5	-175.4	-98.3	0	0	0	112.6	V216 L217 I218 F222 L223 L224 F314 V355 L400	V216-Y220 WeakPolarHBondContact O-CB 3.36Å; V216-Y220 PolarHBondContact O-N 2.98Å; L217-Y220 PolarHBondContact O-N 3.24Å; I218-Y220 VanDerWaalsContact C-N 3.32Å; I218-Y220 PolarHBondContact O-N 3.29Å; Y220-F222 VanDerWaalsContact C-N 3.31Å; Y220-F222 PolarHBondContact O-N 2.92Å; Y220-L223 PolarHBondContact O-N 2.9Å; Y220-L223 VanDerWaalsContact O-N 3.12Å; Y220-L224 HydrophobicContact CD1-CD1 4.41Å; Y220-L224 HydrophobicContact CE1-CD1 3.53Å; Y220-L224 WeakPolarHBondContact O-CB 3.47Å; Y220-L224 PolarHBondContact O-N 3.27Å; Y220-F314 AromaticContact CD2-CE2 3.92Å; Y220-F314 HydrophobicContact CD2-CE2 3.92Å; Y220-F314 AromaticContact CD2-CZ 3.78Å; Y220-F314 HydrophobicContact CD2-CZ 3.78Å; Y220-F314 HydrophobicContact CG-CE2 4.43Å; Y220-V355 HydrophobicContact CD2-CG2 4.22Å; Y220-V355 HydrophobicContact CE2-CG2 3.57Å; Y220-L400 HydrophobicContact CD1-CD1 3.95Å; Y220-L400 HydrophobicContact CD1-CD2 4.34Å; Y220-L400 HydrophobicContact CD2-CD1 3.54Å; Y220-L400 HydrophobicContact CE1-CB 4.34Å; Y220-L400 HydrophobicContact CE1-CD1 4.13Å; Y220-L400 HydrophobicContact CE2-CD1 3.71Å; Y220-L400 HydrophobicContact CG-CD1 3.64Å
221	L	93.4	Very high	90.8	Very high	25 Å²	25	10 Å²	10	13%	0.131	5%	0.052	C	C	.	.	H	α-helix	trans	-64.7	-31	177.3	-73.9	169.3	0	0	0	113.2	S97 L100 L104 L217 I218 P225	S97-L221 WeakPolarHBondContact CB-O 3.39Å; L100-L221 HydrophobicContact CB-CD1 4.26Å; L100-L221 HydrophobicContact CD2-CD1 3.75Å; L100-L221 HydrophobicContact CD2-CD2 3.83Å; L100-L221 HydrophobicContact CD2-CG 4.47Å; L100-L221 HydrophobicContact CG-CD1 3.73Å; L104-L221 HydrophobicContact CD1-CD1 3.72Å; L217-L221 HydrophobicContact CG-CD1 4.31Å; L217-L221 VanDerWaalsContact O-CG 3.28Å; L217-L221 WeakPolarHBondContact O-CG 3.49Å; L217-L221 PolarHBondContact O-N 3.18Å; I218-L221 PolarHBondContact O-N 2.9Å; L221-P225 WeakPolarHBondContact O-CD 3.25Å
222	F	93.3	Very high	90.8	Very high	7 Å²	7	10.3 Å²	10.3	3%	0.031	5%	0.053	C	C	.	.	H	α-helix	trans	-78.6	-26.1	171.5	-73.2	-57.8	0	0	0	113.7	L61 L62 A65 I98 S101 I218 T219 Y220	L61-F222 HydrophobicContact CB-CD2 3.85Å; L61-F222 HydrophobicContact CB-CE2 4.04Å; L61-F222 HydrophobicContact CB-CG 4.37Å; L61-F222 HydrophobicContact CD1-CD2 4.41Å; L62-F222 HydrophobicContact CB-CZ 4.16Å; L62-F222 HydrophobicContact CD1-CE1 4.34Å; L62-F222 HydrophobicContact CD1-CZ 3.98Å; A65-F222 HydrophobicContact CB-CD1 3.6Å; A65-F222 HydrophobicContact CB-CE1 3.57Å; I98-F222 HydrophobicContact CG1-CE1 4.26Å; S101-F222 WeakPolarHBondContact OG-CE2 3.2Å; S101-F222 VanDerWaalsContact OG-CZ 3.22Å; S101-F222 WeakPolarHBondContact OG-CZ 3.4Å; I218-F222 HydrophobicContact CG2-CD2 3.95Å; I218-F222 HydrophobicContact CG2-CE2 3.7Å; I218-F222 WeakPolarHBondContact O-CD2 3.08Å; I218-F222 PolarHBondContact O-N 2.86Å; I218-F222 VanDerWaalsContact O-N 3.17Å; T219-F222 PolarHBondContact O-N 2.93Å; Y220-F222 VanDerWaalsContact C-N 3.31Å; Y220-F222 PolarHBondContact O-N 2.92Å
223	L	92.3	Very high	90.7	Very high	8 Å²	8	11.2 Å²	11.2	4%	0.042	6%	0.057	C	C	.	.	H	α-helix	trans	-79.1	-41.5	-179.4	179.2	57.6	0	0	0	112.3	T219 Y220 I226 E310 Y311 F314 V355	T219-L223 WeakPolarHBondContact O-CB 3.47Å; T219-L223 PolarHBondContact O-N 3.26Å; T219-L223 VanDerWaalsContact O-N 3.13Å; Y220-L223 PolarHBondContact O-N 2.9Å; Y220-L223 VanDerWaalsContact O-N 3.12Å; L223-I226 HydrophobicContact CD1-CD1 4.23Å; L223-I226 VanDerWaalsContact O-CB 3.25Å; L223-I226 WeakPolarHBondContact O-CB 3.46Å; L223-I226 WeakPolarHBondContact O-CG1 3.5Å; L223-I226 PolarHBondContact O-N 3.33Å; L223-E310 HydrophobicContact CD1-CB 4.44Å; L223-Y311 HydrophobicContact CD1-CD2 4.35Å; L223-Y311 HydrophobicContact CD2-CD2 4.02Å; L223-F314 HydrophobicContact CD2-CB 4.02Å; L223-F314 HydrophobicContact CD2-CD1 3.61Å; L223-F314 HydrophobicContact CD2-CE1 4.25Å; L223-F314 HydrophobicContact CD2-CG 3.91Å; L223-V355 HydrophobicContact CD2-CG1 3.85Å; L223-V355 HydrophobicContact CG-CG1 4.08Å
224	L	90.7	Very high	90.2	Very high	20 Å²	20	10.4 Å²	10.4	11%	0.105	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-38.6	-169.6	-171.3	152.5	0	0	0	115.3	F93 Y220 I226 C227 V393 A397	F93-L224 HydrophobicContact CE1-CD2 3.4Å; F93-L224 VanDerWaalsContact CE1-CD2 3.4Å; F93-L224 HydrophobicContact CZ-CD2 3.43Å; F93-L224 VanDerWaalsContact CZ-CD2 3.43Å; Y220-L224 HydrophobicContact CD1-CD1 4.41Å; Y220-L224 HydrophobicContact CE1-CD1 3.53Å; Y220-L224 WeakPolarHBondContact O-CB 3.47Å; Y220-L224 PolarHBondContact O-N 3.27Å; L224-I226 PolarHBondContact O-N 3.22Å; L224-C227 PolarHBondContact O-SG 3Å; L224-V393 HydrophobicContact CD1-CG1 4.46Å; L224-V393 HydrophobicContact CD2-CG1 3.58Å; L224-V393 HydrophobicContact CG-CG1 4.13Å; L224-A397 HydrophobicContact CD1-CB 3.74Å
225	P	90.1	Very high	89.6	Confident	2 Å²	2	12 Å²	12	1%	0.013	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-19.3	174.5	-25.8	36.1	0	0	0	114.9	F93 Q94 S97 L221 C227 I228 M229	F93-P225 HydrophobicContact CD1-CB 4.13Å; F93-P225 HydrophobicContact CD1-CG 4.03Å; F93-P225 HydrophobicContact CE1-CB 4.32Å; F93-P225 HydrophobicContact CE1-CG 3.9Å; Q94-P225 HydrophobicContact CB-CB 4.48Å; S97-P225 WeakPolarHBondContact OG-CG 3.45Å; L221-P225 WeakPolarHBondContact O-CD 3.25Å; P225-C227 PolarHBondContact O-N 3.21Å; P225-I228 PolarHBondContact O-N 3.33Å; P225-I228 VanDerWaalsContact O-N 3.16Å; P225-M229 HydrophobicContact CB-CE 3.77Å; P225-M229 WeakPolarHBondContact O-CE 3.37Å; P225-M229 PolarHBondContact O-N 3.4Å
226	I	89.6	Confident	88.9	Confident	7 Å²	7	12.9 Å²	12.9	4%	0.036	6%	0.064	C	C	.	.	H	α-helix	trans	-61.7	-44.2	-173.3	-63.4	179	0	0	0	111.1	L223 L224 I228 M229 E230 E310	L223-I226 HydrophobicContact CD1-CD1 4.23Å; L223-I226 VanDerWaalsContact O-CB 3.25Å; L223-I226 WeakPolarHBondContact O-CB 3.46Å; L223-I226 WeakPolarHBondContact O-CG1 3.5Å; L223-I226 PolarHBondContact O-N 3.33Å; L224-I226 PolarHBondContact O-N 3.22Å; I226-I228 PolarHBondContact O-N 3.02Å; I226-M229 PolarHBondContact O-N 3.29Å; I226-E230 HydrophobicContact CG2-CG 4.15Å; I226-E230 WeakPolarHBondContact CG2-OE1 3.38Å; I226-E230 WeakPolarHBondContact O-CB 3.39Å; I226-E230 WeakPolarHBondContact O-CG 3.43Å; I226-E230 PolarHBondContact O-N 3.16Å; I226-E310 HydrophobicContact CD1-CB 3.74Å; I226-E310 HydrophobicContact CD1-CG 3.81Å
227	C	88.3	Confident	87.9	Confident	12 Å²	12	13.9 Å²	13.9	8%	0.081	7%	0.069	C	C	.	.	H	α-helix	trans	-66.9	-25.1	-180	67.5	0	0	0	0	113.1	L224 P225 A231 A359	L224-C227 PolarHBondContact O-SG 3Å; P225-C227 PolarHBondContact O-N 3.21Å; C227-A231 WeakPolarHBondContact O-CB 3.26Å; C227-A231 PolarHBondContact O-N 2.91Å; C227-A359 HydrophobicContact CB-CB 3.52Å
228	I	89.4	Confident	87.1	Confident	1 Å²	1	11.9 Å²	11.9	1%	0.005	6%	0.058	C	C	.	.	H	α-helix	trans	-77	-47.4	176.8	-47.3	-176.7	0	0	0	110.3	T90 F93 P225 I226 A231 E232 Y362 W390 V393	T90-I228 HydrophobicContact CG2-CG2 3.92Å; F93-I228 HydrophobicContact CD1-CD1 3.69Å; F93-I228 HydrophobicContact CE1-CD1 3.79Å; F93-I228 HydrophobicContact CG-CD1 4.27Å; F93-I228 HydrophobicContact CZ-CD1 4.44Å; P225-I228 PolarHBondContact O-N 3.33Å; P225-I228 VanDerWaalsContact O-N 3.16Å; I226-I228 PolarHBondContact O-N 3.02Å; I228-A231 PolarHBondContact O-N 3.47Å; I228-E232 PolarHBondContact O-N 3.34Å; I228-E232 VanDerWaalsContact O-N 3.12Å; I228-Y362 HydrophobicContact CB-CE1 4.19Å; I228-Y362 HydrophobicContact CG1-CE1 4.27Å; I228-Y362 HydrophobicContact CG2-CE1 3.98Å; I228-W390 HydrophobicContact CD1-CH2 3.62Å; I228-W390 HydrophobicContact CD1-CZ2 4.14Å; I228-W390 HydrophobicContact CD1-CZ3 3.85Å; I228-W390 HydrophobicContact CG2-CH2 4.46Å; I228-W390 HydrophobicContact CG2-CZ2 4.03Å; I228-V393 HydrophobicContact CD1-CG1 4.27Å
229	M	88	Confident	86.3	Confident	3 Å²	3	12.1 Å²	12.1	2%	0.015	6%	0.059	C	C	.	.	H	α-helix	trans	-62	-48.4	176.2	-75.3	177.8	-74.4	0	0	111.8	R68 F72 T90 Q94 P225 I226 A231 E232 Q233	R68-M229 HydrophobicContact CG-CE 4.35Å; R68-M229 HydrophobicContact CG-SD 4.16Å; F72-M229 HydrophobicContact CD2-CB 3.89Å; F72-M229 HydrophobicContact CD2-CG 3.85Å; F72-M229 HydrophobicContact CD2-SD 4.5Å; F72-M229 HydrophobicContact CE2-CB 3.98Å; F72-M229 HydrophobicContact CE2-CG 4.01Å; F72-M229 HydrophobicContact CG-CG 4.31Å; T90-M229 HydrophobicContact CG2-CG 3.95Å; Q94-M229 HydrophobicContact CB-CE 4.43Å; Q94-M229 HydrophobicContact CB-SD 4.24Å; Q94-M229 HydrophobicContact CG-CE 4.19Å; Q94-M229 HydrophobicContact CG-SD 4.02Å; P225-M229 HydrophobicContact CB-CE 3.77Å; P225-M229 WeakPolarHBondContact O-CE 3.37Å; P225-M229 PolarHBondContact O-N 3.4Å; I226-M229 PolarHBondContact O-N 3.29Å; M229-A231 VanDerWaalsContact C-N 3.28Å; M229-A231 PolarHBondContact O-N 3.34Å; M229-E232 PolarHBondContact O-N 2.96Å; M229-Q233 WeakPolarHBondContact O-CB 3.38Å; M229-Q233 VanDerWaalsContact O-CG 3.3Å; M229-Q233 WeakPolarHBondContact O-CG 3.26Å; M229-Q233 PolarHBondContact O-N 2.85Å; M229-Q233 PolarHBondContact O-OE1 3.26Å
230	E	86.6	Confident	85.3	Confident	27 Å²	27	13.5 Å²	13.5	13%	0.126	7%	0.067	C	C	.	.	H	α-helix	trans	-61.4	-37.6	178.3	-73.2	177.1	-171.6	0	0	111.6	I226 Q233 I234 K363	I226-E230 HydrophobicContact CG2-CG 4.15Å; I226-E230 WeakPolarHBondContact CG2-OE1 3.38Å; I226-E230 WeakPolarHBondContact O-CB 3.39Å; I226-E230 WeakPolarHBondContact O-CG 3.43Å; I226-E230 PolarHBondContact O-N 3.16Å; E230-Q233 PolarHBondContact O-N 3.06Å; E230-I234 WeakPolarHBondContact O-CD1 3.47Å; E230-I234 WeakPolarHBondContact O-CG1 3.48Å; E230-I234 PolarHBondContact O-N 3.3Å; E230-K363 WeakPolarHBondContact OE2-CE 3.33Å; E230-K363 IonicContact OE2-NZ 3.95Å; E230-K363 PolarHBondContact OE2-NZ 2.91Å
231	A	85.3	Confident	84.2	Confident	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-65.5	-43.6	177.6	0	0	0	0	0	113.3	C227 I228 M229 K235 Y362 K363 T366	C227-A231 WeakPolarHBondContact O-CB 3.26Å; C227-A231 PolarHBondContact O-N 2.91Å; I228-A231 PolarHBondContact O-N 3.47Å; M229-A231 VanDerWaalsContact C-N 3.28Å; M229-A231 PolarHBondContact O-N 3.34Å; A231-K235 VanDerWaalsContact O-CB 3.27Å; A231-K235 WeakPolarHBondContact O-CB 3.45Å; A231-K235 PolarHBondContact O-N 2.79Å; A231-Y362 HydrophobicContact CB-CD1 3.56Å; A231-Y362 HydrophobicContact CB-CE1 3.67Å; A231-K363 HydrophobicContact CB-CG 4.23Å; A231-T366 WeakPolarHBondContact CB-OG1 3.5Å
232	E	85.3	Confident	83.3	Confident	8 Å²	8	16.9 Å²	16.9	4%	0.037	8%	0.079	C	C	.	.	H	α-helix	trans	-69.5	-36.6	173.7	-76.1	-68.7	124.7	0	0	111.9	F72 W85 D86 I228 M229 I234 K235 N236	F72-E232 HydrophobicContact CE2-CB 4.29Å; F72-E232 HydrophobicContact CZ-CB 4.21Å; W85-E232 HydrophobicContact CE3-CB 4.29Å; W85-E232 HydrophobicContact CZ3-CB 4.31Å; D86-E232 PolarHBondContact N-OE2 2.9Å; I228-E232 PolarHBondContact O-N 3.34Å; I228-E232 VanDerWaalsContact O-N 3.12Å; M229-E232 PolarHBondContact O-N 2.96Å; E232-I234 PolarHBondContact O-N 3.3Å; E232-K235 PolarHBondContact O-N 2.9Å; E232-K235 WeakPolarHBondContact OE1-CD 3.43Å; E232-K235 IonicContact OE1-NZ 2.72Å; E232-K235 PolarHBondContact OE1-NZ 3.33Å; E232-K235 IonicContact OE2-NZ 2.66Å; E232-K235 PolarHBondContact OE2-NZ 3.46Å; E232-N236 PolarHBondContact O-N 3.43Å; E232-N236 PolarHBondContact O-ND2 3.17Å
233	Q	85.7	Confident	82.6	Confident	21 Å²	21	19.2 Å²	19.2	10%	0.098	9%	0.088	C	C	.	.	H	α-helix	trans	-63.2	-38.9	174.8	-75.2	172.9	-59.1	0	0	112.5	F72 W85 M229 E230 E237 A238 I239	F72-Q233 HydrophobicContact CD2-CG 3.86Å; F72-Q233 HydrophobicContact CE2-CG 3.91Å; W85-Q233 HydrophobicContact CH2-CG 4.3Å; W85-Q233 HydrophobicContact CZ3-CG 4.23Å; M229-Q233 WeakPolarHBondContact O-CB 3.38Å; M229-Q233 VanDerWaalsContact O-CG 3.3Å; M229-Q233 WeakPolarHBondContact O-CG 3.26Å; M229-Q233 PolarHBondContact O-N 2.85Å; M229-Q233 PolarHBondContact O-OE1 3.26Å; E230-Q233 PolarHBondContact O-N 3.06Å; Q233-E237 PolarHBondContact O-N 3.04Å; Q233-A238 HydrophobicContact CB-CB 4.2Å; Q233-A238 HydrophobicContact CG-CB 4.47Å; Q233-A238 WeakPolarHBondContact O-CA 3.11Å; Q233-A238 WeakPolarHBondContact O-CB 3.37Å; Q233-A238 PolarHBondContact O-N 3.3Å; Q233-I239 HydrophobicContact CB-CD1 3.64Å; Q233-I239 HydrophobicContact CB-CG1 3.99Å; Q233-I239 HydrophobicContact CG-CD1 4.49Å; Q233-I239 PolarHBondContact O-N 3.25Å
234	I	80.5	Confident	81.9	Confident	2 Å²	2	19 Å²	19	1%	0.01	9%	0.086	C	C	.	.	H	α-helix	trans	-71.8	-42.7	174.8	-63.7	160.9	0	0	0	111	E230 E232 N236 E237 I239 P241 V244 K363 V367	E230-I234 WeakPolarHBondContact O-CD1 3.47Å; E230-I234 WeakPolarHBondContact O-CG1 3.48Å; E230-I234 PolarHBondContact O-N 3.3Å; E232-I234 PolarHBondContact O-N 3.3Å; I234-N236 PolarHBondContact O-N 3.03Å; I234-E237 PolarHBondContact O-N 3.2Å; I234-E237 VanDerWaalsContact O-N 3.12Å; I234-I239 HydrophobicContact CD1-CG2 4.43Å; I234-I239 HydrophobicContact CG1-CB 3.72Å; I234-I239 HydrophobicContact CG1-CD1 4.38Å; I234-I239 HydrophobicContact CG1-CG2 3.68Å; I234-P241 HydrophobicContact CG2-CB 4.43Å; I234-V244 HydrophobicContact CD1-CG2 4.47Å; I234-V244 HydrophobicContact CG2-CG2 3.75Å; I234-K363 HydrophobicContact CD1-CD 4.28Å; I234-V367 HydrophobicContact CB-CG2 4.04Å; I234-V367 HydrophobicContact CG2-CG1 3.9Å; I234-V367 HydrophobicContact CG2-CG2 3.91Å
235	K	79.6	Confident	81.3	Confident	54 Å²	54	18.3 Å²	18.3	24%	0.235	8%	0.083	C	C	.	.	H	α-helix	trans	-54.5	-39.4	177.4	172.6	-170	159.5	-157.9	0	112.2	A231 E232 V367 R370	A231-K235 VanDerWaalsContact O-CB 3.27Å; A231-K235 WeakPolarHBondContact O-CB 3.45Å; A231-K235 PolarHBondContact O-N 2.79Å; E232-K235 PolarHBondContact O-N 2.9Å; E232-K235 WeakPolarHBondContact OE1-CD 3.43Å; E232-K235 IonicContact OE1-NZ 2.72Å; E232-K235 PolarHBondContact OE1-NZ 3.33Å; E232-K235 IonicContact OE2-NZ 2.66Å; E232-K235 PolarHBondContact OE2-NZ 3.46Å; K235-V367 HydrophobicContact CB-CG2 4.2Å; K235-R370 PolarHBondContact O-NH1 3.29Å; K235-R370 PolarHBondContact O-NH2 2.84Å
236	N	78.2	Confident	80.8	Confident	20 Å²	20	19.2 Å²	19.2	11%	0.107	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	23.1	-179.2	-51.6	-47.6	0	0	0	113.2	F81 W85 E232 I234 A238	F81-N236 WeakPolarHBondContact CD1-O 3.3Å; W85-N236 HydrophobicContact CD2-CB 4.14Å; W85-N236 HydrophobicContact CE3-CB 4.44Å; W85-N236 HydrophobicContact CH2-CB 3.96Å; W85-N236 HydrophobicContact CZ2-CB 3.61Å; W85-N236 HydrophobicContact CZ3-CB 4.35Å; E232-N236 PolarHBondContact O-N 3.43Å; E232-N236 PolarHBondContact O-ND2 3.17Å; I234-N236 PolarHBondContact O-N 3.03Å; N236-A238 VanDerWaalsContact C-N 3.28Å; N236-A238 PolarHBondContact O-N 3.4Å; N236-A238 VanDerWaalsContact O-N 3.16Å
237	E	74.5	Confident	80.4	Confident	25 Å²	25	19 Å²	19	12%	0.117	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	28	174.5	-59.8	-152.6	136.2	0	0	116.5	Q233 I234 I239 R293 Y300	Q233-E237 PolarHBondContact O-N 3.04Å; I234-E237 PolarHBondContact O-N 3.2Å; I234-E237 VanDerWaalsContact O-N 3.12Å; E237-I239 VanDerWaalsContact C-N 3.33Å; E237-R293 WeakPolarHBondContact OE2-CG 3.46Å; E237-Y300 HydrophobicContact CB-CE1 4.22Å; E237-Y300 VanDerWaalsContact O-CD1 3.29Å; E237-Y300 WeakPolarHBondContact O-CD1 3.29Å
238	A	75.1	Confident	80.1	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.09	C	C	.	.	S	Bend	trans	-80.3	-15.5	167.6	0	0	0	0	0	113	F81 W85 Q233 N236 P301 S302	F81-A238 HydrophobicContact CD1-CB 4.43Å; F81-A238 HydrophobicContact CE1-CB 4.3Å; W85-A238 HydrophobicContact CH2-CB 4.17Å; Q233-A238 HydrophobicContact CB-CB 4.2Å; Q233-A238 HydrophobicContact CG-CB 4.47Å; Q233-A238 WeakPolarHBondContact O-CA 3.11Å; Q233-A238 WeakPolarHBondContact O-CB 3.37Å; Q233-A238 PolarHBondContact O-N 3.3Å; N236-A238 VanDerWaalsContact C-N 3.28Å; N236-A238 PolarHBondContact O-N 3.4Å; N236-A238 VanDerWaalsContact O-N 3.16Å; A238-P301 HydrophobicContact CB-CG 4.27Å; A238-P301 VanDerWaalsContact O-CD 3.29Å; A238-P301 WeakPolarHBondContact O-CD 3.31Å; A238-P301 WeakPolarHBondContact O-CG 3.38Å; A238-S302 PolarHBondContact O-N 2.88Å; A238-S302 PolarHBondContact O-OG 2.91Å
239	I	77.7	Confident	79.5	Confident	4 Å²	4	20.6 Å²	20.6	2%	0.021	9%	0.094	C	C	.	.	S	Bend	trans	-130.9	145.7	174.1	-65.8	172.9	0	0	0	108.5	Q233 I234 E237 Y243 S302 P304	Q233-I239 HydrophobicContact CB-CD1 3.64Å; Q233-I239 HydrophobicContact CB-CG1 3.99Å; Q233-I239 HydrophobicContact CG-CD1 4.49Å; Q233-I239 PolarHBondContact O-N 3.25Å; I234-I239 HydrophobicContact CD1-CG2 4.43Å; I234-I239 HydrophobicContact CG1-CB 3.72Å; I234-I239 HydrophobicContact CG1-CD1 4.38Å; I234-I239 HydrophobicContact CG1-CG2 3.68Å; E237-I239 VanDerWaalsContact C-N 3.33Å; I239-Y243 HydrophobicContact CG2-CD2 3.65Å; I239-Y243 HydrophobicContact CG2-CG 4.22Å; I239-S302 WeakPolarHBondContact CG1-OG 3.35Å; I239-P304 HydrophobicContact CG2-CG 4.12Å
240	D	73.1	Confident	78.7	Confident	30 Å²	30	21 Å²	21	16%	0.16	10%	0.097	C	C	.	.			trans	-59.6	128.4	175.9	-174.8	-35.2	0	0	0	111.2	R242 Y243 Y300	D240-R242 PolarHBondContact O-N 3.43Å; D240-R242 WeakPolarHBondContact OD1-CB 3.46Å; D240-R242 WeakPolarHBondContact OD1-CG 3.48Å; D240-R242 PolarHBondContact OD1-N 3Å; D240-R242 IonicContact OD1-NE 3.37Å; D240-R242 IonicContact OD2-NE 3.67Å; D240-R242 PolarHBondContact OD2-NE 3.44Å; D240-Y243 HydrophobicContact CB-CD2 3.86Å; D240-Y243 HydrophobicContact CB-CE2 3.9Å; D240-Y243 WeakPolarHBondContact O-CD2 3.45Å; D240-Y243 PolarHBondContact O-N 3Å; D240-Y300 HydrophobicContact CB-CD2 3.66Å; D240-Y300 HydrophobicContact CB-CE2 3.76Å; D240-Y300 HydrophobicContact CB-CG 4.14Å
241	P	72.2	Confident	77.7	Confident	8 Å²	8	28.3 Å²	28.3	5%	0.052	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-59.1	-13.8	-179.1	24.3	-36	0	0	0	115.1	I234 Y243 V244 R370	I234-P241 HydrophobicContact CG2-CB 4.43Å; P241-Y243 PolarHBondContact O-N 3.1Å; P241-V244 WeakPolarHBondContact O-CB 3.35Å; P241-V244 VanDerWaalsContact O-CG2 3.24Å; P241-V244 WeakPolarHBondContact O-CG2 3.2Å; P241-V244 PolarHBondContact O-N 3.41Å; P241-R370 HydrophobicContact CB-CB 4.44Å
242	R	73.8	Confident	76.5	Confident	95 Å²	95	35.2 Å²	35.2	36%	0.358	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-61	-27.1	171.4	-64.2	174.9	-146.1	-151.7	-2.6	113.2	D240 V244 N258 Y261	D240-R242 PolarHBondContact O-N 3.43Å; D240-R242 WeakPolarHBondContact OD1-CB 3.46Å; D240-R242 WeakPolarHBondContact OD1-CG 3.48Å; D240-R242 PolarHBondContact OD1-N 3Å; D240-R242 IonicContact OD1-NE 3.37Å; D240-R242 IonicContact OD2-NE 3.67Å; D240-R242 PolarHBondContact OD2-NE 3.44Å; R242-V244 PolarHBondContact O-N 2.95Å; R242-N258 WeakPolarHBondContact CD-OD1 3.33Å; R242-N258 PolarHBondContact NH1-OD1 2.89Å; R242-N258 VanDerWaalsContact NH1-OD1 3.09Å; R242-Y261 HydrophobicContact CB-CD2 4.48Å; R242-Y261 HydrophobicContact CB-CG 4.27Å; R242-Y261 HydrophobicContact CG-CD1 3.8Å; R242-Y261 HydrophobicContact CG-CD2 4.32Å; R242-Y261 HydrophobicContact CG-CE1 3.97Å; R242-Y261 HydrophobicContact CG-CE2 4.47Å; R242-Y261 HydrophobicContact CG-CG 3.99Å
243	Y	78	Confident	75.3	Confident	56 Å²	56	39.1 Å²	39.1	22%	0.22	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-77.8	2.3	179.7	-62.4	-68.8	0	0	0	114.1	I239 D240 P241 F245 Q246 P304	I239-Y243 HydrophobicContact CG2-CD2 3.65Å; I239-Y243 HydrophobicContact CG2-CG 4.22Å; D240-Y243 HydrophobicContact CB-CD2 3.86Å; D240-Y243 HydrophobicContact CB-CE2 3.9Å; D240-Y243 WeakPolarHBondContact O-CD2 3.45Å; D240-Y243 PolarHBondContact O-N 3Å; P241-Y243 PolarHBondContact O-N 3.1Å; Y243-F245 PolarHBondContact O-N 2.99Å; Y243-Q246 HydrophobicContact CD1-CB 4.3Å; Y243-Q246 WeakPolarHBondContact O-CB 3.46Å; Y243-Q246 PolarHBondContact O-N 3.43Å; Y243-Q246 VanDerWaalsContact O-N 3.08Å; Y243-P304 HydrophobicContact CD1-CG 3.88Å; Y243-P304 HydrophobicContact CD2-CG 3.94Å; Y243-P304 HydrophobicContact CE1-CG 4.3Å; Y243-P304 HydrophobicContact CE2-CG 4.36Å; Y243-P304 HydrophobicContact CG-CG 3.68Å
244	V	77.8	Confident	73.9	Confident	3 Å²	3	41.2 Å²	41.2	2%	0.018	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-54.7	-39.6	171.1	167.2	0	0	0	0	111.9	I234 P241 R242 Q246 K363 L364 V367	I234-V244 HydrophobicContact CD1-CG2 4.47Å; I234-V244 HydrophobicContact CG2-CG2 3.75Å; P241-V244 WeakPolarHBondContact O-CB 3.35Å; P241-V244 VanDerWaalsContact O-CG2 3.24Å; P241-V244 WeakPolarHBondContact O-CG2 3.2Å; P241-V244 PolarHBondContact O-N 3.41Å; R242-V244 PolarHBondContact O-N 2.95Å; V244-Q246 VanDerWaalsContact C-N 3.34Å; V244-K363 HydrophobicContact CG1-CB 4.39Å; V244-L364 HydrophobicContact CG1-CD2 3.82Å; V244-L364 HydrophobicContact CG1-CG 3.77Å; V244-V367 HydrophobicContact CG2-CB 4.14Å; V244-V367 HydrophobicContact CG2-CG1 3.96Å; V244-V367 HydrophobicContact CG2-CG2 4.4Å
245	F	77.7	Confident	73	Confident	7 Å²	7	44.4 Å²	44.4	3%	0.031	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-83	-5.2	180	-69.2	-69.8	0	0	0	114.3	Y243 S247 Y261 F264 L364 I369 L609	Y243-F245 PolarHBondContact O-N 2.99Å; F245-S247 PolarHBondContact O-N 3.38Å; F245-Y261 HydrophobicContact CD2-CD2 4.21Å; F245-Y261 HydrophobicContact CE2-CD2 4.15Å; F245-F264 HydrophobicContact CZ-CD1 4.41Å; F245-F264 HydrophobicContact CZ-CG 4.29Å; F245-L364 HydrophobicContact CD1-CD1 4.31Å; F245-L364 HydrophobicContact CE1-CD1 4.12Å; F245-L364 HydrophobicContact CE1-CD2 4.02Å; F245-L364 HydrophobicContact CZ-CD2 4.33Å; F245-I369 HydrophobicContact CE2-CD1 4.39Å; F245-I369 HydrophobicContact CZ-CD1 3.71Å; F245-I369 HydrophobicContact CZ-CG1 4.26Å; F245-L609 HydrophobicContact CD1-CD1 4.27Å
246	Q	79.6	Confident	72.1	Confident	20 Å²	20	44.8 Å²	44.8	9%	0.093	23%	0.228	C	C	.	.			trans	-73.6	124.4	-170.7	-172.6	-167.5	-2.9	0	0	112.7	Y243 V244 D250 A257 S305 K363	Y243-Q246 HydrophobicContact CD1-CB 4.3Å; Y243-Q246 WeakPolarHBondContact O-CB 3.46Å; Y243-Q246 PolarHBondContact O-N 3.43Å; Y243-Q246 VanDerWaalsContact O-N 3.08Å; V244-Q246 VanDerWaalsContact C-N 3.34Å; Q246-D250 WeakPolarHBondContact CA-OD2 3.32Å; Q246-A257 HydrophobicContact CB-CB 4.02Å; Q246-A257 HydrophobicContact CG-CB 4.37Å; Q246-S305 PolarHBondContact NE2-O 2.98Å; Q246-K363 PolarHBondContact O-NZ 3.16Å; Q246-K363 VanDerWaalsContact O-NZ 3.16Å
247	S	82.2	Confident	71.4	Confident	3 Å²	3	44.5 Å²	44.5	2%	0.021	23%	0.228	C	C	.	.			trans	-117.2	148.4	167.3	169.6	0	0	0	0	111.7	F245 V249 D250 E356	F245-S247 PolarHBondContact O-N 3.38Å; S247-V249 PolarHBondContact O-N 3.27Å; S247-V249 VanDerWaalsContact O-N 3.14Å; S247-V249 VanDerWaalsContact OG-CG2 3.24Å; S247-V249 WeakPolarHBondContact OG-CG2 3.48Å; S247-V249 PolarHBondContact OG-N 3.49Å; S247-V249 VanDerWaalsContact OG-N 3.14Å; S247-D250 PolarHBondContact N-OD2 3.18Å; S247-D250 WeakPolarHBondContact O-CB 3.41Å; S247-D250 PolarHBondContact O-N 3.43Å; S247-D250 VanDerWaalsContact O-N 3.1Å; S247-E356 WeakPolarHBondContact CA-OE2 3.44Å; S247-E356 WeakPolarHBondContact CB-OE2 3.4Å; S247-E356 WeakPolarHBondContact OG-CB 3.37Å; S247-E356 PolarHBondContact OG-OE2 2.82Å
248	N	81.2	Confident	70.8	Confident	30 Å²	30	46.6 Å²	46.6	16%	0.16	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-19.8	171.5	-62.2	-82.3	0	0	0	113.1	I307 S308 Y311 E356	N248-I307 WeakPolarHBondContact OD1-CA 3.44Å; N248-S308 PolarHBondContact OD1-N 2.93Å; N248-S308 PolarHBondContact OD1-OG 3.05Å; N248-Y311 HydrophobicContact CB-CD1 3.93Å; N248-Y311 HydrophobicContact CB-CD2 4.33Å; N248-Y311 HydrophobicContact CB-CE1 4.19Å; N248-Y311 HydrophobicContact CB-CG 4.01Å; N248-E356 PolarHBondContact N-OE2 3.38Å; N248-E356 VanDerWaalsContact ND2-CD 3.35Å; N248-E356 PolarHBondContact ND2-OE1 2.8Å; N248-E356 PolarHBondContact ND2-OE2 3.02Å
249	V	77.7	Confident	70.4	Confident	17 Å²	17	51.1 Å²	51.1	10%	0.103	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	0.8	175.9	-64	0	0	0	0	114.8	S247 R251 L252 F253 Y311 E356 I611	S247-V249 PolarHBondContact O-N 3.27Å; S247-V249 VanDerWaalsContact O-N 3.14Å; S247-V249 VanDerWaalsContact OG-CG2 3.24Å; S247-V249 WeakPolarHBondContact OG-CG2 3.48Å; S247-V249 PolarHBondContact OG-N 3.49Å; S247-V249 VanDerWaalsContact OG-N 3.14Å; V249-R251 PolarHBondContact O-N 3.35Å; V249-L252 HydrophobicContact CB-CB 4.44Å; V249-L252 WeakPolarHBondContact O-CA 3.45Å; V249-L252 WeakPolarHBondContact O-CB 3.48Å; V249-L252 PolarHBondContact O-N 3.4Å; V249-F253 HydrophobicContact CB-CE2 4.33Å; V249-F253 HydrophobicContact CG2-CE2 4.04Å; V249-F253 WeakPolarHBondContact O-CD2 3.29Å; V249-Y311 HydrophobicContact CG1-CE1 4.24Å; V249-Y311 VanDerWaalsContact CG1-OH 3.24Å; V249-Y311 WeakPolarHBondContact CG1-OH 3.33Å; V249-E356 HydrophobicContact CG1-CG 4.49Å; V249-E356 HydrophobicContact CG2-CB 4.36Å; V249-E356 HydrophobicContact CG2-CG 4.29Å; V249-I611 HydrophobicContact CG2-CD1 3.52Å; V249-I611 HydrophobicContact CG2-CG1 4.47Å
250	D	70.9	Confident	69.9	Low	11 Å²	11	51.8 Å²	51.8	6%	0.059	26%	0.263	C	S	.	.	H	α-helix	trans	-55.6	-38.3	177.9	-79.1	-31.3	0	0	0	112.5	Q246 S247 L252 F253 G254 K260	Q246-D250 WeakPolarHBondContact CA-OD2 3.32Å; S247-D250 PolarHBondContact N-OD2 3.18Å; S247-D250 WeakPolarHBondContact O-CB 3.41Å; S247-D250 PolarHBondContact O-N 3.43Å; S247-D250 VanDerWaalsContact O-N 3.1Å; D250-L252 PolarHBondContact O-N 3.22Å; D250-F253 CarbonylContact O-C 3.39Å; D250-F253 PolarHBondContact O-N 3.34Å; D250-G254 PolarHBondContact O-N 3.27Å; D250-K260 IonicContact OD1-NZ 3.62Å; D250-K260 PolarHBondContact OD1-NZ 2.92Å
251	R	64.7	Low	69.6	Low	180 Å²	180	51 Å²	51	68%	0.679	26%	0.258	S	S	*	.	H	α-helix	trans	-62.3	-23.3	175.2	-176.8	169.8	173.5	148.6	-1.2	113.8	V249 E306	V249-R251 PolarHBondContact O-N 3.35Å; R251-E306 IonicContact NH1-OE2 2.77Å; R251-E306 PolarHBondContact NH1-OE2 3.48Å
252	L	61.5	Low	69.3	Low	145 Å²	145	53.9 Å²	53.9	76%	0.759	28%	0.276	S	S	*	.	H	α-helix	trans	-74.4	-30.9	174	-158.6	78.5	0	0	0	111.7	V249 D250	V249-L252 HydrophobicContact CB-CB 4.44Å; V249-L252 WeakPolarHBondContact O-CA 3.45Å; V249-L252 WeakPolarHBondContact O-CB 3.48Å; V249-L252 PolarHBondContact O-N 3.4Å; D250-L252 PolarHBondContact O-N 3.22Å
253	F	59.7	Low	69	Low	91 Å²	91	53.1 Å²	53.1	40%	0.399	28%	0.282	S	S	.	.	H	α-helix	trans	-93.7	-2.4	178	-61.9	-76.8	0	0	0	113.4	V249 D250 Q255	V249-F253 HydrophobicContact CB-CE2 4.33Å; V249-F253 HydrophobicContact CG2-CE2 4.04Å; V249-F253 WeakPolarHBondContact O-CD2 3.29Å; D250-F253 CarbonylContact O-C 3.39Å; D250-F253 PolarHBondContact O-N 3.34Å; F253-Q255 VanDerWaalsContact C-N 3.27Å; F253-Q255 PolarHBondContact O-N 3.42Å
254	G	55.9	Low	68.6	Low	64 Å²	64	51.8 Å²	51.8	66%	0.66	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	-4.3	168.1	0	0	0	0	0	116.6	D250	D250-G254 PolarHBondContact O-N 3.27Å
255	Q	61.8	Low	68.1	Low	70 Å²	70	53.5 Å²	53.5	33%	0.327	29%	0.285	S	S	.	.			trans	-95.3	137.3	175.2	-69.4	175.5	6.1	0	0	110.8	F253 K260	F253-Q255 VanDerWaalsContact C-N 3.27Å; F253-Q255 PolarHBondContact O-N 3.42Å; Q255-K260 HydrophobicContact CB-CG 4.14Å
256	S	61.7	Low	67.6	Low	62 Å²	62	60 Å²	60	43%	0.434	32%	0.317	S	S	.	.			trans	-80	152.7	173.5	72.9	0	0	0	0	112.1	N258 E259 K260	S256-N258 PolarHBondContact O-N 2.91Å; S256-E259 PolarHBondContact N-OE2 2.98Å; S256-E259 WeakPolarHBondContact O-CB 3.39Å; S256-E259 PolarHBondContact O-N 3.26Å; S256-E259 VanDerWaalsContact OG-CB 3.28Å; S256-E259 WeakPolarHBondContact OG-CB 3.47Å; S256-E259 PolarHBondContact OG-N 3.07Å; S256-E259 VanDerWaalsContact OG-N 3.13Å; S256-K260 PolarHBondContact O-N 3.48Å
257	A	62.6	Low	67	Low	13 Å²	13	66 Å²	66	11%	0.107	35%	0.345	C	S	.	.	H	α-helix	trans	-60.1	-35	175.2	0	0	0	0	0	112.5	Q246 Y261	Q246-A257 HydrophobicContact CB-CB 4.02Å; Q246-A257 HydrophobicContact CG-CB 4.37Å; A257-Y261 WeakPolarHBondContact O-CB 3.32Å; A257-Y261 PolarHBondContact O-N 2.81Å
258	N	62.4	Low	66.3	Low	69 Å²	69	68.5 Å²	68.5	37%	0.369	36%	0.356	S	S	.	.	H	α-helix	trans	-56.4	-49.5	169.7	-98.8	-56.1	0	0	0	111.3	R242 S256 Y261 T262	R242-N258 WeakPolarHBondContact CD-OD1 3.33Å; R242-N258 PolarHBondContact NH1-OD1 2.89Å; R242-N258 VanDerWaalsContact NH1-OD1 3.09Å; S256-N258 PolarHBondContact O-N 2.91Å; N258-Y261 PolarHBondContact O-N 3.07Å; N258-T262 WeakPolarHBondContact O-CG2 3.38Å; N258-T262 PolarHBondContact O-N 2.93Å; N258-T262 PolarHBondContact O-OG1 3.39Å
259	E	66.1	Low	65.7	Low	95 Å²	95	71.7 Å²	71.7	44%	0.444	37%	0.372	S	S	.	.	H	α-helix	trans	-61.8	-50.9	-178.7	-173	171.7	-156.4	0	0	111.1	S256 Y261 T262 T263	S256-E259 PolarHBondContact N-OE2 2.98Å; S256-E259 WeakPolarHBondContact O-CB 3.39Å; S256-E259 PolarHBondContact O-N 3.26Å; S256-E259 VanDerWaalsContact OG-CB 3.28Å; S256-E259 WeakPolarHBondContact OG-CB 3.47Å; S256-E259 PolarHBondContact OG-N 3.07Å; S256-E259 VanDerWaalsContact OG-N 3.13Å; E259-Y261 VanDerWaalsContact C-N 3.34Å; E259-Y261 PolarHBondContact O-N 3.28Å; E259-T262 WeakPolarHBondContact CA-OG1 3.37Å; E259-T262 PolarHBondContact O-N 3.4Å; E259-T262 VanDerWaalsContact O-N 3.1Å; E259-T262 PolarHBondContact O-OG1 3.06Å; E259-T263 WeakPolarHBondContact O-CG2 3.44Å; E259-T263 PolarHBondContact O-N 3.27Å; E259-T263 PolarHBondContact O-OG1 3.44Å
260	K	67.8	Low	64.8	Low	18 Å²	18	77.7 Å²	77.7	8%	0.078	40%	0.397	C	S	.	.	H	α-helix	trans	-55.3	-44.7	174.9	-69.9	-174.6	177.8	-175.1	0	113.1	D250 Q255 S256 T263 F264	D250-K260 IonicContact OD1-NZ 3.62Å; D250-K260 PolarHBondContact OD1-NZ 2.92Å; Q255-K260 HydrophobicContact CB-CG 4.14Å; S256-K260 PolarHBondContact O-N 3.48Å; K260-T263 PolarHBondContact O-OG1 2.74Å; K260-F264 WeakPolarHBondContact O-CB 3.06Å; K260-F264 PolarHBondContact O-N 3.41Å; K260-F264 VanDerWaalsContact O-N 3.14Å
261	Y	67.1	Low	64.2	Low	13 Å²	13	79.8 Å²	79.8	5%	0.051	41%	0.413	C	S	.	.	H	α-helix	trans	-62	-48.4	175.4	177.6	-87.1	0	0	0	110.8	R242 F245 A257 N258 E259 T263 F265 I369 R370	R242-Y261 HydrophobicContact CB-CD2 4.48Å; R242-Y261 HydrophobicContact CB-CG 4.27Å; R242-Y261 HydrophobicContact CG-CD1 3.8Å; R242-Y261 HydrophobicContact CG-CD2 4.32Å; R242-Y261 HydrophobicContact CG-CE1 3.97Å; R242-Y261 HydrophobicContact CG-CE2 4.47Å; R242-Y261 HydrophobicContact CG-CG 3.99Å; F245-Y261 HydrophobicContact CD2-CD2 4.21Å; F245-Y261 HydrophobicContact CE2-CD2 4.15Å; A257-Y261 WeakPolarHBondContact O-CB 3.32Å; A257-Y261 PolarHBondContact O-N 2.81Å; N258-Y261 PolarHBondContact O-N 3.07Å; E259-Y261 VanDerWaalsContact C-N 3.34Å; E259-Y261 PolarHBondContact O-N 3.28Å; Y261-T263 PolarHBondContact O-N 3.06Å; Y261-F265 WeakPolarHBondContact O-CB 3.47Å; Y261-F265 PolarHBondContact O-N 3.43Å; Y261-I369 HydrophobicContact CE2-CG2 4.43Å; Y261-R370 PolarHBondContact OH-O 2.89Å
262	T	64.9	Low	63.9	Low	70 Å²	70	77.8 Å²	77.8	43%	0.429	41%	0.405	S	S	.	.	H	α-helix	trans	-67.4	-35.7	-178.7	56.9	0	0	0	0	114.1	N258 E259 M266	N258-T262 WeakPolarHBondContact O-CG2 3.38Å; N258-T262 PolarHBondContact O-N 2.93Å; N258-T262 PolarHBondContact O-OG1 3.39Å; E259-T262 WeakPolarHBondContact CA-OG1 3.37Å; E259-T262 PolarHBondContact O-N 3.4Å; E259-T262 VanDerWaalsContact O-N 3.1Å; E259-T262 PolarHBondContact O-OG1 3.06Å; T262-M266 VanDerWaalsContact O-CB 3.31Å; T262-M266 WeakPolarHBondContact O-CB 3.44Å; T262-M266 PolarHBondContact O-N 3.41Å
263	T	67.5	Low	63.7	Low	79 Å²	79	74 Å²	74	49%	0.485	39%	0.391	S	S	.	.	H	α-helix	trans	-70.1	-46.2	177.7	53	0	0	0	0	111.1	E259 K260 Y261 F265 M266 Q267	E259-T263 WeakPolarHBondContact O-CG2 3.44Å; E259-T263 PolarHBondContact O-N 3.27Å; E259-T263 PolarHBondContact O-OG1 3.44Å; K260-T263 PolarHBondContact O-OG1 2.74Å; Y261-T263 PolarHBondContact O-N 3.06Å; T263-F265 VanDerWaalsContact C-N 3.34Å; T263-F265 PolarHBondContact O-N 2.94Å; T263-M266 PolarHBondContact O-N 2.79Å; T263-Q267 VanDerWaalsContact O-CB 3.29Å; T263-Q267 WeakPolarHBondContact O-CB 3.45Å; T263-Q267 PolarHBondContact O-N 3.44Å
264	F	70.3	Confident	63.4	Low	28 Å²	28	74.3 Å²	74.3	12%	0.123	40%	0.397	C	S	.	.	H	α-helix	trans	-58.1	-47.6	172.6	-178.6	-89.1	0	0	0	111.3	F245 K260 M266 Q267 H268 I369 V378	F245-F264 HydrophobicContact CZ-CD1 4.41Å; F245-F264 HydrophobicContact CZ-CG 4.29Å; K260-F264 WeakPolarHBondContact O-CB 3.06Å; K260-F264 PolarHBondContact O-N 3.41Å; K260-F264 VanDerWaalsContact O-N 3.14Å; F264-M266 PolarHBondContact O-N 2.81Å; F264-Q267 PolarHBondContact O-N 2.73Å; F264-H268 HydrophobicContact CE1-CB 4.29Å; F264-H268 AromaticContact CZ-CD2 3.96Å; F264-H268 WeakPolarHBondContact O-CB 3.02Å; F264-H268 PolarHBondContact O-N 3.03Å; F264-I369 HydrophobicContact CD1-CD1 3.9Å; F264-I369 HydrophobicContact CE1-CD1 3.35Å; F264-I369 HydrophobicContact CE1-CG2 4.47Å; F264-I369 HydrophobicContact CZ-CD1 3.74Å; F264-V378 HydrophobicContact CE1-CG2 4.42Å; F264-V378 HydrophobicContact CZ-CG2 4.49Å
265	F	67.7	Low	63.1	Low	38 Å²	38	77.9 Å²	77.9	17%	0.167	40%	0.396	C	S	.	.	H	α-helix	trans	-63	-44.6	-178.2	-165.6	-100.7	0	0	0	112.2	Y261 T263 Q267 H268 I269 D371 P372 V377	Y261-F265 WeakPolarHBondContact O-CB 3.47Å; Y261-F265 PolarHBondContact O-N 3.43Å; T263-F265 VanDerWaalsContact C-N 3.34Å; T263-F265 PolarHBondContact O-N 2.94Å; F265-Q267 PolarHBondContact O-N 2.95Å; F265-H268 PolarHBondContact O-N 3.39Å; F265-I269 HydrophobicContact CD1-CD1 3.78Å; F265-I269 HydrophobicContact CE1-CD1 3.43Å; F265-I269 VanDerWaalsContact CE1-CD1 3.43Å; F265-I269 HydrophobicContact CE1-CG1 4.31Å; F265-I269 HydrophobicContact CZ-CD1 4.16Å; F265-I269 PolarHBondContact O-N 2.95Å; F265-D371 WeakPolarHBondContact CE2-OD1 3.24Å; F265-D371 WeakPolarHBondContact CZ-OD1 3.37Å; F265-P372 HydrophobicContact CE1-CG 4.49Å; F265-P372 VanDerWaalsContact CZ-CD 3.42Å; F265-P372 HydrophobicContact CZ-CG 4.27Å; F265-V377 HydrophobicContact CE2-CG2 4.15Å
266	M	65.5	Low	62.4	Low	144 Å²	144	79.7 Å²	79.7	71%	0.709	41%	0.408	S	S	*	.	H	α-helix	trans	-68.5	-33.6	176.6	-170.4	149.7	75.2	0	0	112.4	T262 T263 F264 K270	T262-M266 VanDerWaalsContact O-CB 3.31Å; T262-M266 WeakPolarHBondContact O-CB 3.44Å; T262-M266 PolarHBondContact O-N 3.41Å; T263-M266 PolarHBondContact O-N 2.79Å; F264-M266 PolarHBondContact O-N 2.81Å; M266-K270 WeakPolarHBondContact O-CB 3.31Å; M266-K270 PolarHBondContact O-N 3.44Å
267	Q	68.1	Low	62	Low	145 Å²	145	82.1 Å²	82.1	68%	0.678	42%	0.42	S	S	*	.	H	α-helix	trans	-65.9	-39.5	171.6	-176.9	171.6	-12.5	0	0	111.8	T263 F264 F265 K270 S271	T263-Q267 VanDerWaalsContact O-CB 3.29Å; T263-Q267 WeakPolarHBondContact O-CB 3.45Å; T263-Q267 PolarHBondContact O-N 3.44Å; F264-Q267 PolarHBondContact O-N 2.73Å; F265-Q267 PolarHBondContact O-N 2.95Å; Q267-K270 PolarHBondContact O-N 2.98Å; Q267-S271 PolarHBondContact O-N 3.17Å; Q267-S271 PolarHBondContact O-OG 3.36Å
268	H	68	Low	61.2	Low	57 Å²	57	87.6 Å²	87.6	26%	0.264	45%	0.447	S	S	.	.	H	α-helix	trans	-73.7	-33.3	178.8	-156.7	-75.1	0	0	0	113.1	F264 F265 S271 R272 V378	F264-H268 HydrophobicContact CE1-CB 4.29Å; F264-H268 AromaticContact CZ-CD2 3.96Å; F264-H268 WeakPolarHBondContact O-CB 3.02Å; F264-H268 PolarHBondContact O-N 3.03Å; F265-H268 PolarHBondContact O-N 3.39Å; H268-S271 WeakPolarHBondContact CA-OG 3.36Å; H268-S271 PolarHBondContact O-OG 3.41Å; H268-R272 WeakPolarHBondContact O-CB 3.39Å; H268-R272 PolarHBondContact O-N 3.29Å; H268-R272 VanDerWaalsContact O-N 3.11Å; H268-V378 WeakPolarHBondContact NE2-CG2 3.46Å
269	I	66.9	Low	60	Low	96 Å²	96	89.6 Å²	89.6	49%	0.492	46%	0.458	S	S	.	.	H	α-helix	trans	-63.5	-44.2	167.2	-74.5	175.8	0	0	0	110.1	F265 S271 R272 S273	F265-I269 HydrophobicContact CD1-CD1 3.78Å; F265-I269 HydrophobicContact CE1-CD1 3.43Å; F265-I269 VanDerWaalsContact CE1-CD1 3.43Å; F265-I269 HydrophobicContact CE1-CG1 4.31Å; F265-I269 HydrophobicContact CZ-CD1 4.16Å; F265-I269 PolarHBondContact O-N 2.95Å; I269-S271 PolarHBondContact O-N 3.41Å; I269-R272 PolarHBondContact O-N 3.36Å; I269-S273 WeakPolarHBondContact O-CB 3.3Å; I269-S273 PolarHBondContact O-N 2.83Å
270	K	60.2	Low	58.9	Low	144 Å²	144	90.5 Å²	90.5	63%	0.626	47%	0.472	S	S	*	.	H	α-helix	trans	-65.1	-37.6	-179.2	-167.6	174.1	-176.6	178.8	0	112.7	M266 Q267 N274	M266-K270 WeakPolarHBondContact O-CB 3.31Å; M266-K270 PolarHBondContact O-N 3.44Å; Q267-K270 PolarHBondContact O-N 2.98Å; K270-N274 VanDerWaalsContact O-CG 3.25Å; K270-N274 PolarHBondContact O-N 3.44Å; K270-N274 PolarHBondContact O-OD1 2.86Å
271	S	58.8	Low	57.4	Low	55 Å²	55	97.3 Å²	97.3	39%	0.385	51%	0.509	S	S	.	.	H	α-helix	trans	-69.6	-45	174.5	60.3	0	0	0	0	112.5	Q267 H268 I269 S273 N274 Q275	Q267-S271 PolarHBondContact O-N 3.17Å; Q267-S271 PolarHBondContact O-OG 3.36Å; H268-S271 WeakPolarHBondContact CA-OG 3.36Å; H268-S271 PolarHBondContact O-OG 3.41Å; I269-S271 PolarHBondContact O-N 3.41Å; S271-S273 PolarHBondContact O-N 2.96Å; S271-N274 PolarHBondContact O-N 2.74Å; S271-Q275 PolarHBondContact O-N 3.24Å; S271-Q275 VanDerWaalsContact O-N 3.09Å
272	R	58.3	Low	55.9	Low	138 Å²	138	100.2 Å²	100.2	52%	0.521	53%	0.531	S	S	.	.	H	α-helix	trans	-64.7	-39	178	-164	175.6	-171.9	177.4	3	112.1	H268 I269 Q275 N276	H268-R272 WeakPolarHBondContact O-CB 3.39Å; H268-R272 PolarHBondContact O-N 3.29Å; H268-R272 VanDerWaalsContact O-N 3.11Å; I269-R272 PolarHBondContact O-N 3.36Å; R272-Q275 PolarHBondContact O-N 3.24Å; R272-N276 PolarHBondContact O-N 2.9Å; R272-N276 PolarHBondContact O-OD1 3.28Å
273	S	55.5	Low	54.5	Low	65 Å²	65	103.6 Å²	103.6	46%	0.455	55%	0.546	S	S	.	.	H	α-helix	trans	-55.7	-51.3	171	179.2	0	0	0	0	111.6	I269 S271 Q275 N276 V277	I269-S273 WeakPolarHBondContact O-CB 3.3Å; I269-S273 PolarHBondContact O-N 2.83Å; S271-S273 PolarHBondContact O-N 2.96Å; S273-Q275 VanDerWaalsContact C-N 3.26Å; S273-Q275 PolarHBondContact O-N 3.38Å; S273-N276 PolarHBondContact O-N 2.96Å; S273-V277 WeakPolarHBondContact O-CG2 3.41Å; S273-V277 PolarHBondContact O-N 3.33Å
274	N	53.7	Low	52.9	Low	98 Å²	98	107.6 Å²	107.6	52%	0.524	57%	0.565	S	S	.	*	H	α-helix	trans	-64.9	-25.2	179.5	-72.1	-1	0	0	0	113.7	K270 S271	K270-N274 VanDerWaalsContact O-CG 3.25Å; K270-N274 PolarHBondContact O-N 3.44Å; K270-N274 PolarHBondContact O-OD1 2.86Å; S271-N274 PolarHBondContact O-N 2.74Å
275	Q	49.9	Very low	51.3	Low	138 Å²	138	113.2 Å²	113.2	65%	0.645	60%	0.596	S	S	*	*	H	α-helix	trans	-76.9	-43.9	173.6	-74.6	-177.4	-41.1	0	0	112.2	S271 R272 S273 V277 N278	S271-Q275 PolarHBondContact O-N 3.24Å; S271-Q275 VanDerWaalsContact O-N 3.09Å; R272-Q275 PolarHBondContact O-N 3.24Å; S273-Q275 VanDerWaalsContact C-N 3.26Å; S273-Q275 PolarHBondContact O-N 3.38Å; Q275-V277 PolarHBondContact O-N 3.43Å; Q275-N278 PolarHBondContact O-N 3.26Å
276	N	47.2	Very low	49.6	Very low	109 Å²	109	120 Å²	120	58%	0.583	63%	0.625	S	S	*	*	H	α-helix	trans	-63.6	-27.3	180	-76.8	20.1	0	0	0	113.3	R272 S273 N278	R272-N276 PolarHBondContact O-N 2.9Å; R272-N276 PolarHBondContact O-OD1 3.28Å; S273-N276 PolarHBondContact O-N 2.96Å; N276-N278 PolarHBondContact O-N 2.96Å
277	V	53	Low	48.1	Very low	112 Å²	112	118.1 Å²	118.1	68%	0.679	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-27.9	173.7	172.1	0	0	0	0	112.5	S273 Q275	S273-V277 WeakPolarHBondContact O-CG2 3.41Å; S273-V277 PolarHBondContact O-N 3.33Å; Q275-V277 PolarHBondContact O-N 3.43Å
278	N	45.4	Very low	46.5	Very low	128 Å²	128	117.1 Å²	117.1	68%	0.684	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-2.7	-175.4	-69.4	-18.7	0	0	0	114.2	Q275 N276	Q275-N278 PolarHBondContact O-N 3.26Å; N276-N278 PolarHBondContact O-N 2.96Å
279	N	38.8	Very low	45	Very low	112 Å²	112	120 Å²	120	60%	0.599	63%	0.63	S	S	*	*			trans	-147.2	90.7	176.8	-108.5	-14.9	0	0	0	111	L281	N279-L281 PolarHBondContact O-N 3.48Å
280	P	42.6	Very low	43.4	Very low	113 Å²	113	123.2 Å²	123.2	73%	0.734	64%	0.644	S	S	*	*	S	Bend	trans	-78.1	8.3	178.2	32.8	-36.4	0	0	0	114
281	L	35.9	Very low	42.2	Very low	162 Å²	162	121.4 Å²	121.4	85%	0.848	64%	0.64	S	S	*	*	S	Bend	trans	-126	47.8	-170.1	-156.7	75.9	0	0	0	113.2	N279	N279-L281 PolarHBondContact O-N 3.48Å
282	S	36.1	Very low	41.6	Very low	74 Å²	74	123.5 Å²	123.5	52%	0.517	64%	0.644	S	S	.	*			trans	-147.9	60.8	170.2	64	0	0	0	0	111.3
283	N	34.3	Very low	41.1	Very low	141 Å²	141	119.9 Å²	119.9	75%	0.754	63%	0.631	S	S	*	*			trans	-90.7	-6.8	178.8	-84	-30.8	0	0	0	114.1
284	D	35.4	Very low	40.9	Very low	163 Å²	163	120.8 Å²	120.8	87%	0.872	64%	0.635	S	S	*	*	S	Bend	trans	-79.2	-22	-178.1	-63.6	-42.4	0	0	0	113.2	K286	D284-K286 PolarHBondContact O-N 2.96Å
285	D	35.1	Very low	40.8	Very low	145 Å²	145	121.6 Å²	121.6	78%	0.775	63%	0.634	S	S	*	*			trans	-74.9	39.9	165.4	-84.4	-30.1	0	0	0	112.2	L287	D285-L287 PolarHBondContact O-N 3.34Å
286	K	34	Very low	40.9	Very low	180 Å²	180	118.8 Å²	118.8	78%	0.783	63%	0.628	S	S	*	*			trans	-75.5	54.1	156.6	-159.9	178.2	-173.7	180	0	109.2	D284 V288	D284-K286 PolarHBondContact O-N 2.96Å; K286-V288 PolarHBondContact O-N 2.76Å
287	L	33.2	Very low	41.3	Very low	105 Å²	105	118.6 Å²	118.6	55%	0.55	64%	0.635	S	S	.	*			trans	-52.7	114.1	174	-161.9	168.2	0	0	0	106.5	D285 Y289	D285-L287 PolarHBondContact O-N 3.34Å; L287-Y289 HydrophobicContact CB-CE2 4.27Å; L287-Y289 HydrophobicContact CD1-CE2 4.49Å; L287-Y289 HydrophobicContact CD2-CD2 4.09Å; L287-Y289 HydrophobicContact CD2-CE2 3.99Å; L287-Y289 HydrophobicContact CG-CE2 4.48Å; L287-Y289 WeakPolarHBondContact O-CD2 3.43Å; L287-Y289 PolarHBondContact O-N 3.48Å
288	V	33.9	Very low	41.5	Very low	124 Å²	124	118.7 Å²	118.7	75%	0.752	63%	0.628	S	S	*	*			trans	-70.6	89.4	-179.3	180	0	0	0	0	107	K286 E290	K286-V288 PolarHBondContact O-N 2.76Å; V288-E290 PolarHBondContact O-N 2.91Å
289	Y	36.4	Very low	42.4	Very low	117 Å²	117	116.5 Å²	116.5	46%	0.459	63%	0.627	S	S	.	*			trans	-64.6	84.2	157.5	-74.2	-87.4	0	0	0	106.6	L287 N291	L287-Y289 HydrophobicContact CB-CE2 4.27Å; L287-Y289 HydrophobicContact CD1-CE2 4.49Å; L287-Y289 HydrophobicContact CD2-CD2 4.09Å; L287-Y289 HydrophobicContact CD2-CE2 3.99Å; L287-Y289 HydrophobicContact CG-CE2 4.48Å; L287-Y289 WeakPolarHBondContact O-CD2 3.43Å; L287-Y289 PolarHBondContact O-N 3.48Å; Y289-N291 PolarHBondContact O-N 2.89Å
290	E	33.7	Very low	43.7	Very low	165 Å²	165	113.9 Å²	113.9	77%	0.771	61%	0.609	S	S	*	*			trans	-45.7	126.1	164	-173	168.9	-134.5	0	0	107.5	V288 E292	V288-E290 PolarHBondContact O-N 2.91Å; E290-E292 PolarHBondContact O-N 3.03Å
291	N	36	Very low	44.9	Very low	105 Å²	105	111.7 Å²	111.7	56%	0.561	60%	0.595	S	S	*	*			trans	-64.4	102.4	-176.2	-75.4	-32.2	0	0	0	108.3	Y289 R293 G373	Y289-N291 PolarHBondContact O-N 2.89Å; N291-R293 PolarHBondContact O-N 3.46Å; N291-G373 PolarHBondContact OD1-O 3.47Å
292	E	45.5	Very low	46.4	Very low	100 Å²	100	105.1 Å²	105.1	47%	0.467	56%	0.563	S	S	.	*			trans	-61.5	-0.1	176.2	-77.1	-156.1	131.1	0	0	113.8	E290 P294 R370	E290-E292 PolarHBondContact O-N 3.03Å; E292-P294 WeakPolarHBondContact O-CD 3.23Å; E292-R370 IonicContact OE2-CZ 3.56Å; E292-R370 IonicContact OE2-NE 3.56Å; E292-R370 IonicContact OE2-NH2 2.94Å; E292-R370 PolarHBondContact OE2-NH2 3.45Å
293	R	48.6	Very low	47.9	Very low	61 Å²	61	106.9 Å²	106.9	23%	0.23	57%	0.571	C	S	.	*			trans	-74.8	102.3	166.5	-77.1	172.7	148.6	-134.3	-15.4	110.3	E237 N291 F295 P296 Y300	E237-R293 WeakPolarHBondContact OE2-CG 3.46Å; N291-R293 PolarHBondContact O-N 3.46Å; R293-F295 PolarHBondContact O-N 3.14Å; R293-P296 HydrophobicContact CB-CG 4.1Å; R293-P296 PolarHBondContact NH1-O 2.67Å; R293-Y300 PolarHBondContact NH2-OH 3.29Å
294	P	50.8	Low	49.7	Very low	84 Å²	84	101.2 Å²	101.2	55%	0.545	54%	0.542	S	S	.	.	S	Bend	trans	-61.2	-28.5	169.3	27.6	-36.1	0	0	0	111.6	E292	E292-P294 WeakPolarHBondContact O-CD 3.23Å
295	F	51.7	Low	51.2	Low	115 Å²	115	96.3 Å²	96.3	50%	0.504	52%	0.52	S	S	.	.			trans	-141.3	92.7	-179.9	-59.8	-73.5	0	0	0	112.1	R293 S297	R293-F295 PolarHBondContact O-N 3.14Å; F295-S297 PolarHBondContact O-N 3.4Å
296	P	52.3	Low	52.8	Low	79 Å²	79	95.5 Å²	95.5	51%	0.513	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-1.1	-174.7	-26.3	35.7	0	0	0	117.7	R293	R293-P296 HydrophobicContact CB-CG 4.1Å; R293-P296 PolarHBondContact NH1-O 2.67Å
297	S	54.1	Low	54.9	Low	105 Å²	105	89.9 Å²	89.9	73%	0.734	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.7	-9.2	-166.5	53.9	0	0	0	0	115.7	F295	F295-S297 PolarHBondContact O-N 3.4Å
298	H	58.5	Low	57.4	Low	114 Å²	114	85 Å²	85	53%	0.528	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-85.7	140	-177.5	-81.6	-103.5	0	0	0	112.6
299	A	62.6	Low	60	Low	82 Å²	82	81.1 Å²	81.1	68%	0.678	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-63.9	140.9	174.6	0	0	0	0	0	112	R80	R80-A299 PolarHBondContact NH2-O 3.18Å
300	Y	66.9	Low	62.6	Low	57 Å²	57	75.8 Å²	75.8	22%	0.224	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-61.3	125.7	172.2	-63.4	-72.9	0	0	0	109.7	E237 D240 R293 S302	E237-Y300 HydrophobicContact CB-CE1 4.22Å; E237-Y300 VanDerWaalsContact O-CD1 3.29Å; E237-Y300 WeakPolarHBondContact O-CD1 3.29Å; D240-Y300 HydrophobicContact CB-CD2 3.66Å; D240-Y300 HydrophobicContact CB-CE2 3.76Å; D240-Y300 HydrophobicContact CB-CG 4.14Å; R293-Y300 PolarHBondContact NH2-OH 3.29Å; Y300-S302 VanDerWaalsContact C-N 3.27Å; Y300-S302 PolarHBondContact O-N 3.21Å
301	P	67.6	Low	65.4	Low	67 Å²	67	68.7 Å²	68.7	44%	0.435	39%	0.386	S	S	.	.	S	Bend	trans	-69.1	-24.8	-174.4	30.3	-39.2	0	0	0	113.2	F81 A238	F81-P301 HydrophobicContact CE1-CG 4.25Å; F81-P301 HydrophobicContact CZ-CG 3.77Å; A238-P301 HydrophobicContact CB-CG 4.27Å; A238-P301 VanDerWaalsContact O-CD 3.29Å; A238-P301 WeakPolarHBondContact O-CD 3.31Å; A238-P301 WeakPolarHBondContact O-CG 3.38Å
302	S	67.6	Low	68	Low	25 Å²	25	67.4 Å²	67.4	18%	0.175	38%	0.379	C	S	.	.			trans	-129.6	135	-176.5	66.6	0	0	0	0	112	A238 I239 Y300	A238-S302 PolarHBondContact O-N 2.88Å; A238-S302 PolarHBondContact O-OG 2.91Å; I239-S302 WeakPolarHBondContact CG1-OG 3.35Å; Y300-S302 VanDerWaalsContact C-N 3.27Å; Y300-S302 PolarHBondContact O-N 3.21Å
303	T	67.8	Low	70.3	Confident	110 Å²	110	63.1 Å²	63.1	68%	0.675	36%	0.36	S	S	*	.			trans	-114.6	120.7	170.4	46.9	0	0	0	0	108.1
304	P	71.6	Confident	72.5	Confident	22 Å²	22	60.2 Å²	60.2	14%	0.143	35%	0.349	C	S	.	.			trans	-64.6	139.6	177.4	25.8	-34.1	0	0	0	110.8	I239 Y243	I239-P304 HydrophobicContact CG2-CG 4.12Å; Y243-P304 HydrophobicContact CD1-CG 3.88Å; Y243-P304 HydrophobicContact CD2-CG 3.94Å; Y243-P304 HydrophobicContact CE1-CG 4.3Å; Y243-P304 HydrophobicContact CE2-CG 4.36Å; Y243-P304 HydrophobicContact CG-CG 3.68Å
305	S	67.9	Low	74.6	Confident	60 Å²	60	58.9 Å²	58.9	42%	0.42	34%	0.339	S	S	.	.			trans	-65.7	137.7	176.1	51.8	0	0	0	0	111.2	Q246 I307	Q246-S305 PolarHBondContact NE2-O 2.98Å; S305-I307 PolarHBondContact O-N 3.29Å
306	E	68.4	Low	76.6	Confident	128 Å²	128	56 Å²	56	60%	0.598	33%	0.328	S	S	*	.	S	Bend	trans	-47.5	-40.4	179.2	-69.6	-173.3	179	0	0	113.6	R251	R251-E306 IonicContact NH1-OE2 2.77Å; R251-E306 PolarHBondContact NH1-OE2 3.48Å
307	I	77.7	Confident	78.6	Confident	62 Å²	62	52.2 Å²	52.2	32%	0.318	30%	0.304	S	S	.	.	S	Bend	trans	-134.7	125	176	-53.2	176.6	0	0	0	107.9	N248 S305 I312	N248-I307 WeakPolarHBondContact OD1-CA 3.44Å; S305-I307 PolarHBondContact O-N 3.29Å; I307-I312 HydrophobicContact CG2-CD1 3.86Å; I307-I312 HydrophobicContact CG2-CG1 3.71Å
308	S	86.1	Confident	80.5	Confident	4 Å²	4	47.4 Å²	47.4	3%	0.028	27%	0.27	C	S	.	.			trans	-72.1	138.7	174.4	61.8	0	0	0	0	111.5	N248 E310 Y311 I312	N248-S308 PolarHBondContact OD1-N 2.93Å; N248-S308 PolarHBondContact OD1-OG 3.05Å; S308-E310 WeakPolarHBondContact CB-OE2 3.47Å; S308-E310 PolarHBondContact O-N 3.21Å; S308-Y311 PolarHBondContact O-N 2.92Å; S308-Y311 WeakPolarHBondContact OG-CB 3.38Å; S308-Y311 PolarHBondContact OG-N 3.18Å; S308-I312 PolarHBondContact O-N 3.39Å
309	V	88.3	Confident	82.2	Confident	42 Å²	42	48 Å²	48	26%	0.255	27%	0.271	S	S	.	.	H	α-helix	trans	-65.2	-31.7	178.8	179.4	0	0	0	0	110.4	I312 C313	V309-I312 PolarHBondContact O-N 3.25Å; V309-C313 PolarHBondContact O-N 3.3Å; V309-C313 PolarHBondContact O-SG 3.23Å; V309-C313 VanDerWaalsContact O-SG 3.36Å
310	E	91.2	Very high	83.6	Confident	4 Å²	4	46.3 Å²	46.3	2%	0.019	25%	0.25	C	C	.	.	H	α-helix	trans	-61.5	-43.1	176.2	-59.3	79.3	178.9	0	0	111.2	L61 R64 R68 L223 I226 S308 C313 F314	L61-E310 HydrophobicContact CD2-CB 4.2Å; L61-E310 HydrophobicContact CD2-CG 3.77Å; R64-E310 IonicContact CZ-OE1 2.73Å; R64-E310 IonicContact NH1-OE1 3.48Å; R64-E310 PolarHBondContact NH1-OE1 3.13Å; R64-E310 IonicContact NH1-OE2 3.54Å; R64-E310 PolarHBondContact NH1-OE2 3.36Å; R68-E310 IonicContact CZ-OE1 3.51Å; R68-E310 IonicContact NH2-OE1 3.46Å; R68-E310 PolarHBondContact NH2-OE1 3.37Å; R68-E310 IonicContact NH2-OE2 2.76Å; R68-E310 PolarHBondContact NH2-OE2 2.83Å; R68-E310 VanDerWaalsContact NH2-OE2 3.12Å; L223-E310 HydrophobicContact CD1-CB 4.44Å; I226-E310 HydrophobicContact CD1-CB 3.74Å; I226-E310 HydrophobicContact CD1-CG 3.81Å; S308-E310 WeakPolarHBondContact CB-OE2 3.47Å; S308-E310 PolarHBondContact O-N 3.21Å; E310-C313 PolarHBondContact O-N 3.42Å; E310-F314 PolarHBondContact O-N 3.39Å
311	Y	91.5	Very high	84.8	Confident	16 Å²	16	44.1 Å²	44.1	6%	0.063	24%	0.242	C	C	.	.	H	α-helix	trans	-66.2	-41.2	172.5	-171.3	-96.1	0	0	0	112.2	L223 N248 V249 S308 C313 F314 V315 L352 E356	L223-Y311 HydrophobicContact CD1-CD2 4.35Å; L223-Y311 HydrophobicContact CD2-CD2 4.02Å; N248-Y311 HydrophobicContact CB-CD1 3.93Å; N248-Y311 HydrophobicContact CB-CD2 4.33Å; N248-Y311 HydrophobicContact CB-CE1 4.19Å; N248-Y311 HydrophobicContact CB-CG 4.01Å; V249-Y311 HydrophobicContact CG1-CE1 4.24Å; V249-Y311 VanDerWaalsContact CG1-OH 3.24Å; V249-Y311 WeakPolarHBondContact CG1-OH 3.33Å; S308-Y311 PolarHBondContact O-N 2.92Å; S308-Y311 WeakPolarHBondContact OG-CB 3.38Å; S308-Y311 PolarHBondContact OG-N 3.18Å; Y311-C313 VanDerWaalsContact C-N 3.34Å; Y311-C313 PolarHBondContact O-N 3.44Å; Y311-F314 WeakPolarHBondContact O-CB 3.35Å; Y311-F314 PolarHBondContact O-N 2.93Å; Y311-F314 VanDerWaalsContact O-N 3.14Å; Y311-V315 HydrophobicContact CD1-CG2 3.95Å; Y311-V315 HydrophobicContact CE1-CG2 3.75Å; Y311-V315 WeakPolarHBondContact O-CG2 3.48Å; Y311-V315 PolarHBondContact O-N 3.09Å; Y311-L352 HydrophobicContact CE1-CD2 4.3Å; Y311-L352 HydrophobicContact CE2-CD2 3.89Å; Y311-L352 PolarHBondContact OH-O 3.43Å; Y311-E356 HydrophobicContact CD2-CG 4.47Å; Y311-E356 VanDerWaalsContact CD2-OE1 3.27Å; Y311-E356 WeakPolarHBondContact CD2-OE1 3.37Å; Y311-E356 HydrophobicContact CE2-CG 3.63Å; Y311-E356 VanDerWaalsContact CE2-OE1 3.26Å; Y311-E356 WeakPolarHBondContact CE2-OE1 3.33Å
312	I	92.2	Very high	86	Confident	78 Å²	78	41.7 Å²	41.7	40%	0.4	23%	0.226	S	C	.	.	H	α-helix	trans	-60.6	-43.7	176.2	-62.7	170.1	0	0	0	110.9	I307 S308 V309 F314 V315 I316	I307-I312 HydrophobicContact CG2-CD1 3.86Å; I307-I312 HydrophobicContact CG2-CG1 3.71Å; S308-I312 PolarHBondContact O-N 3.39Å; V309-I312 PolarHBondContact O-N 3.25Å; I312-F314 VanDerWaalsContact C-N 3.32Å; I312-F314 PolarHBondContact O-N 2.87Å; I312-V315 PolarHBondContact O-N 3.33Å; I312-I316 HydrophobicContact CG2-CD1 3.98Å; I312-I316 VanDerWaalsContact O-CG1 3.32Å; I312-I316 WeakPolarHBondContact O-CG1 3.37Å; I312-I316 PolarHBondContact O-N 2.88Å
313	C	93.6	Very high	86.9	Confident	11 Å²	11	44.5 Å²	44.5	7%	0.074	24%	0.238	C	C	.	.	H	α-helix	trans	-63.6	-36.2	175.3	-69.7	0	0	0	0	112.5	S57 L61 T219 V309 E310 Y311 I316 S317	S57-C313 PolarHBondContact OG-SG 2.8Å; L61-C313 HydrophobicContact CD1-CB 3.89Å; L61-C313 HydrophobicContact CD2-CB 4.22Å; T219-C313 HydrophobicContact CG2-CB 4.04Å; V309-C313 PolarHBondContact O-N 3.3Å; V309-C313 PolarHBondContact O-SG 3.23Å; V309-C313 VanDerWaalsContact O-SG 3.36Å; E310-C313 PolarHBondContact O-N 3.42Å; Y311-C313 VanDerWaalsContact C-N 3.34Å; Y311-C313 PolarHBondContact O-N 3.44Å; C313-I316 PolarHBondContact O-N 3.19Å; C313-S317 WeakPolarHBondContact O-CB 3.49Å; C313-S317 PolarHBondContact O-N 2.89Å
314	F	94.6	Very high	87.8	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-67.6	-42.2	174.5	-176.5	-121.7	0	0	0	112.5	V216 Y220 L223 E310 Y311 I312 I316 S317 L318 L351 L352 V355	V216-F314 HydrophobicContact CG1-CE2 4.08Å; Y220-F314 AromaticContact CD2-CE2 3.92Å; Y220-F314 HydrophobicContact CD2-CE2 3.92Å; Y220-F314 AromaticContact CD2-CZ 3.78Å; Y220-F314 HydrophobicContact CD2-CZ 3.78Å; Y220-F314 HydrophobicContact CG-CE2 4.43Å; L223-F314 HydrophobicContact CD2-CB 4.02Å; L223-F314 HydrophobicContact CD2-CD1 3.61Å; L223-F314 HydrophobicContact CD2-CE1 4.25Å; L223-F314 HydrophobicContact CD2-CG 3.91Å; E310-F314 PolarHBondContact O-N 3.39Å; Y311-F314 WeakPolarHBondContact O-CB 3.35Å; Y311-F314 PolarHBondContact O-N 2.93Å; Y311-F314 VanDerWaalsContact O-N 3.14Å; I312-F314 VanDerWaalsContact C-N 3.32Å; I312-F314 PolarHBondContact O-N 2.87Å; F314-I316 VanDerWaalsContact C-N 3.31Å; F314-I316 PolarHBondContact O-N 3.17Å; F314-S317 WeakPolarHBondContact CA-OG 3.39Å; F314-S317 PolarHBondContact O-N 3.29Å; F314-S317 PolarHBondContact O-OG 3.38Å; F314-L318 HydrophobicContact CD1-CD1 4.09Å; F314-L318 HydrophobicContact CD2-CD1 4.44Å; F314-L318 HydrophobicContact CD2-CG 4.46Å; F314-L318 HydrophobicContact CE1-CD1 3.73Å; F314-L318 HydrophobicContact CE2-CD1 4.11Å; F314-L318 HydrophobicContact CE2-CD2 4.44Å; F314-L318 HydrophobicContact CE2-CG 4.22Å; F314-L318 HydrophobicContact CG-CD1 4.43Å; F314-L318 HydrophobicContact CZ-CD1 3.74Å; F314-L318 HydrophobicContact CZ-CG 4.32Å; F314-L318 WeakPolarHBondContact O-CG 3.33Å; F314-L318 PolarHBondContact O-N 2.91Å; F314-L351 HydrophobicContact CZ-CB 4.27Å; F314-L352 HydrophobicContact CD1-CD2 3.67Å; F314-L352 HydrophobicContact CE1-CD2 3.93Å; F314-V355 HydrophobicContact CE1-CG2 4.4Å
315	V	94.7	Very high	88.5	Confident	56 Å²	56	41.2 Å²	41.2	34%	0.339	21%	0.213	S	C	.	.	H	α-helix	trans	-57	-45.5	171.3	172.6	0	0	0	0	110.9	Y311 I312 L318 F319 L352	Y311-V315 HydrophobicContact CD1-CG2 3.95Å; Y311-V315 HydrophobicContact CE1-CG2 3.75Å; Y311-V315 WeakPolarHBondContact O-CG2 3.48Å; Y311-V315 PolarHBondContact O-N 3.09Å; I312-V315 PolarHBondContact O-N 3.33Å; V315-L318 PolarHBondContact O-N 2.84Å; V315-F319 WeakPolarHBondContact O-CB 3.47Å; V315-F319 PolarHBondContact O-N 3.41Å; V315-L352 HydrophobicContact CB-CD2 4.46Å; V315-L352 HydrophobicContact CG2-CD1 4.05Å; V315-L352 HydrophobicContact CG2-CD2 3.48Å; V315-L352 VanDerWaalsContact CG2-CD2 3.48Å; V315-L352 HydrophobicContact CG2-CG 4.44Å
316	I	94.2	Very high	89.4	Confident	54 Å²	54	38.5 Å²	38.5	28%	0.277	19%	0.194	S	C	.	.	H	α-helix	trans	-67.3	-38.7	178.8	-64.4	164.5	0	0	0	111.4	F53 I312 C313 F314 F319 M320	F53-I316 HydrophobicContact CE1-CG2 3.81Å; F53-I316 HydrophobicContact CZ-CD1 4.4Å; F53-I316 HydrophobicContact CZ-CG2 3.82Å; I312-I316 HydrophobicContact CG2-CD1 3.98Å; I312-I316 VanDerWaalsContact O-CG1 3.32Å; I312-I316 WeakPolarHBondContact O-CG1 3.37Å; I312-I316 PolarHBondContact O-N 2.88Å; C313-I316 PolarHBondContact O-N 3.19Å; F314-I316 VanDerWaalsContact C-N 3.31Å; F314-I316 PolarHBondContact O-N 3.17Å; I316-F319 PolarHBondContact O-N 3.4Å; I316-M320 HydrophobicContact CG2-CE 4.49Å; I316-M320 HydrophobicContact CG2-CG 4.37Å; I316-M320 WeakPolarHBondContact O-CB 3.44Å; I316-M320 VanDerWaalsContact O-CG 3.26Å; I316-M320 WeakPolarHBondContact O-CG 3.29Å; I316-M320 PolarHBondContact O-N 3.07Å
317	S	94.1	Very high	90.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-65.6	-39.9	178.9	73.4	0	0	0	0	112	V216 T219 C313 F314 M320 L321	V216-S317 WeakPolarHBondContact CG2-O 3.2Å; V216-S317 WeakPolarHBondContact CG2-OG 3.48Å; T219-S317 PolarHBondContact OG1-OG 3.24Å; C313-S317 WeakPolarHBondContact O-CB 3.49Å; C313-S317 PolarHBondContact O-N 2.89Å; F314-S317 WeakPolarHBondContact CA-OG 3.39Å; F314-S317 PolarHBondContact O-N 3.29Å; F314-S317 PolarHBondContact O-OG 3.38Å; S317-M320 PolarHBondContact O-N 3.21Å; S317-L321 WeakPolarHBondContact O-CB 3.41Å; S317-L321 PolarHBondContact O-N 2.99Å
318	L	94.1	Very high	90.2	Very high	3 Å²	3	31.9 Å²	31.9	2%	0.016	17%	0.17	C	C	.	.	H	α-helix	trans	-67.8	-38.9	173.5	-70.7	174.2	0	0	0	113.2	V216 F314 V315 L321 T322 L351 L352	V216-L318 HydrophobicContact CG1-CD2 4.02Å; V216-L318 HydrophobicContact CG2-CD2 4.36Å; F314-L318 HydrophobicContact CD1-CD1 4.09Å; F314-L318 HydrophobicContact CD2-CD1 4.44Å; F314-L318 HydrophobicContact CD2-CG 4.46Å; F314-L318 HydrophobicContact CE1-CD1 3.73Å; F314-L318 HydrophobicContact CE2-CD1 4.11Å; F314-L318 HydrophobicContact CE2-CD2 4.44Å; F314-L318 HydrophobicContact CE2-CG 4.22Å; F314-L318 HydrophobicContact CG-CD1 4.43Å; F314-L318 HydrophobicContact CZ-CD1 3.74Å; F314-L318 HydrophobicContact CZ-CG 4.32Å; F314-L318 WeakPolarHBondContact O-CG 3.33Å; F314-L318 PolarHBondContact O-N 2.91Å; V315-L318 PolarHBondContact O-N 2.84Å; L318-L321 PolarHBondContact O-N 2.92Å; L318-T322 WeakPolarHBondContact O-CB 3.43Å; L318-T322 PolarHBondContact O-N 3.42Å; L318-T322 PolarHBondContact O-OG1 3.17Å; L318-L351 HydrophobicContact CD2-CD1 4.29Å; L318-L352 HydrophobicContact CD1-CD1 4.17Å; L318-L352 HydrophobicContact CD1-CD2 3.93Å; L318-L352 HydrophobicContact CD1-CG 3.73Å
319	F	93.9	Very high	90	Very high	127 Å²	127	31.7 Å²	31.7	56%	0.557	17%	0.169	S	C	*	.	H	α-helix	trans	-62.6	-44.8	173	-178.9	-100.4	0	0	0	111.7	V315 I316 L321 T322 I323	V315-F319 WeakPolarHBondContact O-CB 3.47Å; V315-F319 PolarHBondContact O-N 3.41Å; I316-F319 PolarHBondContact O-N 3.4Å; F319-L321 PolarHBondContact O-N 2.95Å; F319-T322 WeakPolarHBondContact O-CB 3.47Å; F319-T322 PolarHBondContact O-N 3.02Å; F319-I323 HydrophobicContact CD1-CD1 4.14Å; F319-I323 HydrophobicContact CE1-CD1 3.54Å; F319-I323 HydrophobicContact CE2-CD1 4.16Å; F319-I323 HydrophobicContact CZ-CD1 3.56Å; F319-I323 PolarHBondContact O-N 2.76Å
320	M	91.7	Very high	89.7	Confident	47 Å²	47	35.6 Å²	35.6	23%	0.232	18%	0.179	C	C	.	.	H	α-helix	trans	-60.8	-43.2	174.3	-70.3	-71.5	178.7	0	0	111.6	T212 I316 S317 T322 I323 H324	T212-M320 HydrophobicContact CG2-CB 3.67Å; I316-M320 HydrophobicContact CG2-CE 4.49Å; I316-M320 HydrophobicContact CG2-CG 4.37Å; I316-M320 WeakPolarHBondContact O-CB 3.44Å; I316-M320 VanDerWaalsContact O-CG 3.26Å; I316-M320 WeakPolarHBondContact O-CG 3.29Å; I316-M320 PolarHBondContact O-N 3.07Å; S317-M320 PolarHBondContact O-N 3.21Å; M320-T322 VanDerWaalsContact C-N 3.33Å; M320-T322 PolarHBondContact O-N 3.38Å; M320-I323 PolarHBondContact O-N 3.31Å; M320-H324 WeakPolarHBondContact O-CB 3.42Å; M320-H324 PolarHBondContact O-N 3.2Å
321	L	91.6	Very high	88.7	Confident	10 Å²	10	38.1 Å²	38.1	5%	0.052	19%	0.191	C	C	.	.	H	α-helix	trans	-59.5	-43	176.1	-175.2	69.8	0	0	0	111.8	F210 T212 I213 V216 S317 L318 F319 I323 Y325 I344 L407	F210-L321 HydrophobicContact CE1-CD1 3.89Å; T212-L321 HydrophobicContact CG2-CB 4.36Å; I213-L321 HydrophobicContact CG1-CD1 3.9Å; V216-L321 HydrophobicContact CG2-CB 4.3Å; V216-L321 HydrophobicContact CG2-CD2 4.33Å; S317-L321 WeakPolarHBondContact O-CB 3.41Å; S317-L321 PolarHBondContact O-N 2.99Å; L318-L321 PolarHBondContact O-N 2.92Å; F319-L321 PolarHBondContact O-N 2.95Å; L321-I323 PolarHBondContact O-N 3.45Å; L321-Y325 HydrophobicContact CD1-CG 4.29Å; L321-Y325 VanDerWaalsContact O-CB 3.24Å; L321-Y325 WeakPolarHBondContact O-CB 3.26Å; L321-Y325 PolarHBondContact O-N 2.96Å; L321-I344 HydrophobicContact CD2-CG2 4.12Å; L321-I344 HydrophobicContact CG-CG2 4.01Å; L321-L407 HydrophobicContact CD2-CD1 4.33Å
322	T	92.5	Very high	87.8	Confident	17 Å²	17	37.4 Å²	37.4	10%	0.104	19%	0.188	C	C	.	.	H	α-helix	trans	-60.3	-27.8	179.2	-59.5	0	0	0	0	113.3	L318 F319 M320 P326 S341 A345 S348	L318-T322 WeakPolarHBondContact O-CB 3.43Å; L318-T322 PolarHBondContact O-N 3.42Å; L318-T322 PolarHBondContact O-OG1 3.17Å; F319-T322 WeakPolarHBondContact O-CB 3.47Å; F319-T322 PolarHBondContact O-N 3.02Å; M320-T322 VanDerWaalsContact C-N 3.33Å; M320-T322 PolarHBondContact O-N 3.38Å; T322-P326 WeakPolarHBondContact O-CD 3.23Å; T322-P326 WeakPolarHBondContact O-CG 3.4Å; T322-S341 PolarHBondContact O-OG 3.44Å; T322-A345 HydrophobicContact CG2-CB 3.83Å; T322-S348 PolarHBondContact OG1-OG 2.89Å
323	I	87.9	Confident	87.2	Confident	83 Å²	83	34.3 Å²	34.3	43%	0.426	17%	0.173	S	C	.	.	H	α-helix	trans	-97.7	-52.9	-179.8	-61.8	175.2	0	0	0	111.7	F319 M320 L321 P326 A327	F319-I323 HydrophobicContact CD1-CD1 4.14Å; F319-I323 HydrophobicContact CE1-CD1 3.54Å; F319-I323 HydrophobicContact CE2-CD1 4.16Å; F319-I323 HydrophobicContact CZ-CD1 3.56Å; F319-I323 PolarHBondContact O-N 2.76Å; M320-I323 PolarHBondContact O-N 3.31Å; L321-I323 PolarHBondContact O-N 3.45Å; I323-P326 WeakPolarHBondContact O-CD 3.38Å; I323-A327 WeakPolarHBondContact O-CB 3.41Å; I323-A327 PolarHBondContact O-N 3.45Å
324	H	85.8	Confident	86.8	Confident	63 Å²	63	40.7 Å²	40.7	29%	0.292	20%	0.196	S	C	.	.	H	α-helix	trans	-68	-38.7	-172.1	-77	-160.9	0	0	0	112.9	Y50 F210 M320 A327	Y50-H324 AromaticContact CD2-CE1 3.52Å; Y50-H324 AromaticContact CE2-CE1 3.72Å; Y50-H324 AromaticContact CE2-ND1 3.85Å; F210-H324 HydrophobicContact CZ-CB 4.32Å; M320-H324 WeakPolarHBondContact O-CB 3.42Å; M320-H324 PolarHBondContact O-N 3.2Å; H324-A327 PolarHBondContact O-N 2.9Å
325	Y	87.2	Confident	86.4	Confident	1 Å²	1	46.3 Å²	46.3	0%	0.004	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-39.6	-172.9	-151.7	-130.8	0	0	0	114.8	H118 A120 F210 I213 L321 F340 I344 L407 M408 Y411	H118-Y325 AromaticContact CE1-CE2 3.74Å; H118-Y325 AromaticContact NE2-CE2 3.95Å; A120-Y325 HydrophobicContact CB-CD2 4.07Å; A120-Y325 HydrophobicContact CB-CE2 4.49Å; F210-Y325 HydrophobicContact CD1-CD2 4.12Å; F210-Y325 HydrophobicContact CD1-CE2 4.17Å; F210-Y325 HydrophobicContact CD2-CD2 4.27Å; F210-Y325 HydrophobicContact CD2-CE2 4.36Å; F210-Y325 AromaticContact CE1-CD2 3.6Å; F210-Y325 HydrophobicContact CE1-CD2 3.6Å; F210-Y325 HydrophobicContact CE1-CE2 4.12Å; F210-Y325 HydrophobicContact CE1-CG 4.39Å; F210-Y325 AromaticContact CE2-CD2 3.88Å; F210-Y325 HydrophobicContact CE2-CD2 3.88Å; F210-Y325 HydrophobicContact CE2-CE2 4.42Å; F210-Y325 HydrophobicContact CG-CD2 4.41Å; F210-Y325 HydrophobicContact CG-CE2 4.27Å; F210-Y325 AromaticContact CZ-CD2 3.51Å; F210-Y325 HydrophobicContact CZ-CD2 3.51Å; F210-Y325 HydrophobicContact CZ-CE2 4.29Å; F210-Y325 HydrophobicContact CZ-CG 4.33Å; I213-Y325 HydrophobicContact CD1-CE2 4.3Å; L321-Y325 HydrophobicContact CD1-CG 4.29Å; L321-Y325 VanDerWaalsContact O-CB 3.24Å; L321-Y325 WeakPolarHBondContact O-CB 3.26Å; L321-Y325 PolarHBondContact O-N 2.96Å; Y325-F340 AromaticContact CD1-CE1 3.76Å; Y325-F340 HydrophobicContact CD1-CE1 3.76Å; Y325-F340 HydrophobicContact CD1-CE2 4.42Å; Y325-F340 AromaticContact CD1-CZ 3.44Å; Y325-F340 HydrophobicContact CD1-CZ 3.44Å; Y325-F340 VanDerWaalsContact CD1-CZ 3.44Å; Y325-F340 HydrophobicContact CE1-CE1 4.11Å; Y325-F340 AromaticContact CE1-CZ 3.55Å; Y325-F340 HydrophobicContact CE1-CZ 3.55Å; Y325-F340 HydrophobicContact CG-CE1 4.45Å; Y325-I344 HydrophobicContact CD1-CD1 4.17Å; Y325-L407 HydrophobicContact CE1-CB 4.34Å; Y325-M408 HydrophobicContact CE1-CE 3.61Å; Y325-M408 HydrophobicContact CE2-CE 4.4Å; Y325-M408 VanDerWaalsContact CZ-CE 3.46Å; Y325-M408 WeakPolarHBondContact OH-CE 3.41Å; Y325-M408 PolarHBondContact OH-SD 3.4Å; Y325-Y411 HydrophobicContact CD2-CD2 4.26Å; Y325-Y411 HydrophobicContact CE1-CD2 4.22Å; Y325-Y411 HydrophobicContact CE1-CG 4.18Å; Y325-Y411 AromaticContact CE2-CD2 3.83Å; Y325-Y411 HydrophobicContact CE2-CD2 3.83Å; Y325-Y411 HydrophobicContact CE2-CE2 4.37Å; Y325-Y411 HydrophobicContact CE2-CG 4.06Å; Y325-Y411 AromaticContact CZ-CD2 3.76Å; Y325-Y411 AromaticContact CZ-CG 3.62Å; Y325-Y411 WeakPolarHBondContact OH-CB 3.3Å
326	P	86.5	Confident	86	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.019	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-8.8	173.5	32.6	-36.1	0	0	0	114.7	T322 I323 P328 F329 S337 F340 I344	T322-P326 WeakPolarHBondContact O-CD 3.23Å; T322-P326 WeakPolarHBondContact O-CG 3.4Å; I323-P326 WeakPolarHBondContact O-CD 3.38Å; P326-P328 VanDerWaalsContact C-CD 3.47Å; P326-F329 PolarHBondContact O-N 3.43Å; P326-S337 WeakPolarHBondContact CB-O 3.41Å; P326-S337 PolarHBondContact O-OG 3.2Å; P326-F340 HydrophobicContact CB-CB 4.31Å; P326-F340 HydrophobicContact CB-CD1 3.81Å; P326-F340 HydrophobicContact CB-CG 4.35Å; P326-I344 HydrophobicContact CG-CD1 4.28Å
327	A	83.8	Confident	85.7	Confident	46 Å²	46	41.7 Å²	41.7	38%	0.38	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-41.4	-175.1	0	0	0	0	0	115.4	I323 H324 F329 Y330	I323-A327 WeakPolarHBondContact O-CB 3.41Å; I323-A327 PolarHBondContact O-N 3.45Å; H324-A327 PolarHBondContact O-N 2.9Å; A327-F329 PolarHBondContact O-N 3.18Å; A327-F329 VanDerWaalsContact O-N 3.13Å; A327-Y330 VanDerWaalsContact O-CB 3.29Å; A327-Y330 WeakPolarHBondContact O-CB 3.19Å; A327-Y330 PolarHBondContact O-N 2.93Å
328	P	79.6	Confident	85.5	Confident	5 Å²	5	46.6 Å²	46.6	3%	0.032	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-27	-178	-25.2	35.5	0	0	0	114.1	A120 L126 P326	A120-P328 VanDerWaalsContact CA-CG 3.43Å; A120-P328 HydrophobicContact CB-CG 3.75Å; L126-P328 HydrophobicContact CD1-CB 4.06Å; L126-P328 PolarHBondContact N-O 3.45Å; P326-P328 VanDerWaalsContact C-CD 3.47Å
329	F	82.1	Confident	85.4	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-87.5	-5.7	-179.6	-55.9	-71.6	0	0	0	113.7	L126 P326 A327 F331 T332 S333 F336 Y411 G414 E415	L126-F329 HydrophobicContact CD2-CD1 4.24Å; L126-F329 HydrophobicContact CD2-CE1 3.89Å; P326-F329 PolarHBondContact O-N 3.43Å; A327-F329 PolarHBondContact O-N 3.18Å; A327-F329 VanDerWaalsContact O-N 3.13Å; F329-F331 PolarHBondContact O-N 3.45Å; F329-T332 PolarHBondContact O-N 2.93Å; F329-T332 PolarHBondContact O-OG1 3.49Å; F329-S333 CarbonylContact O-C 3.56Å; F329-S333 PolarHBondContact O-N 3.27Å; F329-F336 HydrophobicContact CB-CD1 3.9Å; F329-F336 HydrophobicContact CB-CE1 4.49Å; F329-F336 HydrophobicContact CD1-CD1 4.15Å; F329-F336 HydrophobicContact CD1-CE1 4.16Å; F329-F336 HydrophobicContact CD2-CD1 4.07Å; F329-F336 AromaticContact CD2-CE1 3.81Å; F329-F336 HydrophobicContact CD2-CE1 3.81Å; F329-F336 HydrophobicContact CE1-CE1 4.36Å; F329-F336 AromaticContact CE2-CE1 4Å; F329-F336 HydrophobicContact CE2-CE1 4Å; F329-F336 AromaticContact CG-CD1 3.77Å; F329-F336 HydrophobicContact CG-CD1 3.77Å; F329-F336 AromaticContact CG-CE1 3.89Å; F329-F336 HydrophobicContact CG-CE1 3.89Å; F329-F336 HydrophobicContact CZ-CE1 4.28Å; F329-Y411 AromaticContact CE2-CD2 3.64Å; F329-Y411 HydrophobicContact CE2-CD2 3.64Å; F329-Y411 AromaticContact CE2-CE2 3.68Å; F329-Y411 HydrophobicContact CE2-CE2 3.68Å; F329-Y411 HydrophobicContact CE2-CG 4.47Å; F329-Y411 HydrophobicContact CZ-CD2 4.1Å; F329-Y411 AromaticContact CZ-CE2 3.97Å; F329-Y411 HydrophobicContact CZ-CE2 3.97Å; F329-G414 VanDerWaalsContact CE1-C 3.46Å; F329-E415 HydrophobicContact CZ-CG 4.37Å
330	Y	80.1	Confident	85.3	Confident	123 Å²	123	44.9 Å²	44.9	48%	0.482	22%	0.221	S	C	.	.	H	α-helix	trans	-62.1	-42.2	-175.8	179.5	-94.8	0	0	0	112.6	A327 R334	A327-Y330 VanDerWaalsContact O-CB 3.29Å; A327-Y330 WeakPolarHBondContact O-CB 3.19Å; A327-Y330 PolarHBondContact O-N 2.93Å; Y330-R334 HydrophobicContact CE2-CG 4.35Å; Y330-R334 VanDerWaalsContact O-CG 3.29Å; Y330-R334 WeakPolarHBondContact O-CG 3.49Å
331	F	71.2	Confident	85.4	Confident	58 Å²	58	44.2 Å²	44.2	25%	0.254	22%	0.221	S	C	.	.	H	α-helix	trans	-71.4	-45.6	177.1	-177.1	-97	0	0	0	111.9	I125 L126 G127 K128 F329 R642	I125-F331 HydrophobicContact CG2-CB 3.49Å; I125-F331 VanDerWaalsContact CG2-CB 3.49Å; I125-F331 HydrophobicContact CG2-CG 4.23Å; L126-F331 WeakPolarHBondContact O-CD1 3.28Å; G127-F331 WeakPolarHBondContact O-CE1 3.43Å; K128-F331 HydrophobicContact CB-CD1 4.03Å; K128-F331 HydrophobicContact CB-CD2 4.47Å; K128-F331 HydrophobicContact CB-CE1 4.2Å; K128-F331 HydrophobicContact CB-CG 4.18Å; K128-F331 HydrophobicContact CB-CZ 4.49Å; F329-F331 PolarHBondContact O-N 3.45Å; F331-R642 HydrophobicContact CE1-CB 4.41Å
332	T	71.9	Confident	85.4	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.006	25%	0.247	C	C	.	.	H	α-helix	trans	-68.9	-46.9	-174.9	65.8	0	0	0	0	111.9	L126 F329 F418 F641 R642	L126-T332 HydrophobicContact CB-CG2 3.52Å; L126-T332 WeakPolarHBondContact O-CG2 3.38Å; F329-T332 PolarHBondContact O-N 2.93Å; F329-T332 PolarHBondContact O-OG1 3.49Å; T332-F418 HydrophobicContact CG2-CD2 3.84Å; T332-F418 HydrophobicContact CG2-CE2 3.68Å; T332-F641 CarbonylContact O-C 3.48Å; T332-F641 WeakPolarHBondContact O-CA 3.31Å; T332-R642 PolarHBondContact O-N 3.43Å
333	S	81	Confident	85.5	Confident	13 Å²	13	49.1 Å²	49.1	9%	0.091	24%	0.244	C	C	.	.			trans	-156	87	-175.3	56	0	0	0	0	111.9	F329 I335 F336 S337 F641	F329-S333 CarbonylContact O-C 3.56Å; F329-S333 PolarHBondContact O-N 3.27Å; S333-I335 PolarHBondContact O-N 3.1Å; S333-F336 PolarHBondContact O-N 3.12Å; S333-F336 WeakPolarHBondContact OG-CB 3.41Å; S333-S337 PolarHBondContact O-N 3.26Å; S333-F641 WeakPolarHBondContact OG-CD1 3.19Å; S333-F641 WeakPolarHBondContact OG-CE1 3.44Å
334	R	83.3	Confident	85.8	Confident	144 Å²	144	45.2 Å²	45.2	54%	0.543	22%	0.223	S	C	.	.	H	α-helix	trans	-44.2	-39.4	177.4	-69	-177.3	175.8	-176.2	-4.1	114.4	Y330 S337 L338	Y330-R334 HydrophobicContact CE2-CG 4.35Å; Y330-R334 VanDerWaalsContact O-CG 3.29Å; Y330-R334 WeakPolarHBondContact O-CG 3.49Å; R334-S337 PolarHBondContact O-N 2.91Å; R334-L338 VanDerWaalsContact O-CB 3.28Å; R334-L338 WeakPolarHBondContact O-CB 3.37Å; R334-L338 PolarHBondContact O-N 3.28Å
335	I	86.6	Confident	86.2	Confident	118 Å²	118	43.8 Å²	43.8	61%	0.605	22%	0.222	S	C	*	.	H	α-helix	trans	-66	-42.3	-178.9	-61.7	169.4	0	0	0	111.7	S333 L339	S333-I335 PolarHBondContact O-N 3.1Å; I335-L339 HydrophobicContact CG2-CD1 3.99Å; I335-L339 WeakPolarHBondContact O-CB 3.31Å; I335-L339 VanDerWaalsContact O-CG 3.29Å; I335-L339 WeakPolarHBondContact O-CG 3.38Å; I335-L339 PolarHBondContact O-N 3.35Å
336	F	86.8	Confident	86.6	Confident	4 Å²	4	46.4 Å²	46.4	2%	0.018	24%	0.235	C	C	.	.	H	α-helix	trans	-67.4	-45.9	176.3	-177.6	-102.3	0	0	0	111	F329 S333 L338 L339 F340 I410 Y413 L633 W639	F329-F336 HydrophobicContact CB-CD1 3.9Å; F329-F336 HydrophobicContact CB-CE1 4.49Å; F329-F336 HydrophobicContact CD1-CD1 4.15Å; F329-F336 HydrophobicContact CD1-CE1 4.16Å; F329-F336 HydrophobicContact CD2-CD1 4.07Å; F329-F336 AromaticContact CD2-CE1 3.81Å; F329-F336 HydrophobicContact CD2-CE1 3.81Å; F329-F336 HydrophobicContact CE1-CE1 4.36Å; F329-F336 AromaticContact CE2-CE1 4Å; F329-F336 HydrophobicContact CE2-CE1 4Å; F329-F336 AromaticContact CG-CD1 3.77Å; F329-F336 HydrophobicContact CG-CD1 3.77Å; F329-F336 AromaticContact CG-CE1 3.89Å; F329-F336 HydrophobicContact CG-CE1 3.89Å; F329-F336 HydrophobicContact CZ-CE1 4.28Å; S333-F336 PolarHBondContact O-N 3.12Å; S333-F336 WeakPolarHBondContact OG-CB 3.41Å; F336-L338 VanDerWaalsContact C-N 3.33Å; F336-L338 PolarHBondContact O-N 3.26Å; F336-L339 PolarHBondContact O-N 3.04Å; F336-F340 VanDerWaalsContact O-CB 3.24Å; F336-F340 WeakPolarHBondContact O-CB 3.24Å; F336-F340 PolarHBondContact O-N 3.27Å; F336-I410 HydrophobicContact CZ-CG2 4.34Å; F336-Y413 HydrophobicContact CE2-CD1 4.13Å; F336-Y413 HydrophobicContact CE2-CE1 4.36Å; F336-Y413 HydrophobicContact CZ-CD1 4.44Å; F336-L633 HydrophobicContact CD2-CD2 4.33Å; F336-L633 HydrophobicContact CE2-CD2 4.08Å; F336-W639 HydrophobicContact CB-CE3 4.29Å; F336-W639 HydrophobicContact CB-CH2 4.13Å; F336-W639 HydrophobicContact CB-CZ3 3.7Å; F336-W639 AromaticContact CD2-CH2 3.75Å; F336-W639 HydrophobicContact CD2-CH2 3.75Å; F336-W639 HydrophobicContact CD2-CZ2 4.05Å; F336-W639 HydrophobicContact CD2-CZ3 4.13Å; F336-W639 HydrophobicContact CG-CH2 4.42Å; F336-W639 HydrophobicContact CG-CZ3 4.38Å
337	S	88.2	Confident	86.9	Confident	9 Å²	9	46.4 Å²	46.4	6%	0.063	24%	0.236	C	C	.	.	H	α-helix	trans	-58.3	-43.2	177.2	-173.8	0	0	0	0	111.9	P326 S333 R334 S341	P326-S337 WeakPolarHBondContact CB-O 3.41Å; P326-S337 PolarHBondContact O-OG 3.2Å; S333-S337 PolarHBondContact O-N 3.26Å; R334-S337 PolarHBondContact O-N 2.91Å; S337-S341 VanDerWaalsContact O-CB 3.31Å; S337-S341 WeakPolarHBondContact O-CB 3.45Å; S337-S341 PolarHBondContact O-N 3.27Å
338	L	90.5	Very high	87.5	Confident	103 Å²	103	44.6 Å²	44.6	54%	0.539	22%	0.22	S	C	.	.	H	α-helix	trans	-66.4	-50	176.3	-172.1	158.5	0	0	0	112.2	R334 F336 F340 S341 M342	R334-L338 VanDerWaalsContact O-CB 3.28Å; R334-L338 WeakPolarHBondContact O-CB 3.37Å; R334-L338 PolarHBondContact O-N 3.28Å; F336-L338 VanDerWaalsContact C-N 3.33Å; F336-L338 PolarHBondContact O-N 3.26Å; L338-F340 VanDerWaalsContact C-N 3.27Å; L338-F340 PolarHBondContact O-N 3.44Å; L338-S341 PolarHBondContact O-N 2.89Å; L338-M342 HydrophobicContact CD2-CE 4.42Å; L338-M342 HydrophobicContact CD2-CG 3.89Å; L338-M342 WeakPolarHBondContact O-CB 3.45Å; L338-M342 VanDerWaalsContact O-CG 3.31Å; L338-M342 WeakPolarHBondContact O-CG 3.27Å; L338-M342 PolarHBondContact O-N 3.38Å
339	L	91.3	Very high	88.1	Confident	91 Å²	91	48.2 Å²	48.2	48%	0.476	24%	0.242	S	C	.	.	H	α-helix	trans	-59.4	-40.1	178	-73.8	170.5	0	0	0	111.8	I335 F336 Y343	I335-L339 HydrophobicContact CG2-CD1 3.99Å; I335-L339 WeakPolarHBondContact O-CB 3.31Å; I335-L339 VanDerWaalsContact O-CG 3.29Å; I335-L339 WeakPolarHBondContact O-CG 3.38Å; I335-L339 PolarHBondContact O-N 3.35Å; F336-L339 PolarHBondContact O-N 3.04Å; L339-Y343 WeakPolarHBondContact O-CB 3.31Å; L339-Y343 PolarHBondContact O-N 3.43Å
340	F	91.1	Very high	88.7	Confident	3 Å²	3	48.3 Å²	48.3	1%	0.013	24%	0.242	C	C	.	.	H	α-helix	trans	-70.1	-42.5	178.4	-171	-149.4	0	0	0	111.9	Y325 P326 F336 L338 Y343 I344 L407 I410 Y411	Y325-F340 AromaticContact CD1-CE1 3.76Å; Y325-F340 HydrophobicContact CD1-CE1 3.76Å; Y325-F340 HydrophobicContact CD1-CE2 4.42Å; Y325-F340 AromaticContact CD1-CZ 3.44Å; Y325-F340 HydrophobicContact CD1-CZ 3.44Å; Y325-F340 VanDerWaalsContact CD1-CZ 3.44Å; Y325-F340 HydrophobicContact CE1-CE1 4.11Å; Y325-F340 AromaticContact CE1-CZ 3.55Å; Y325-F340 HydrophobicContact CE1-CZ 3.55Å; Y325-F340 HydrophobicContact CG-CE1 4.45Å; P326-F340 HydrophobicContact CB-CB 4.31Å; P326-F340 HydrophobicContact CB-CD1 3.81Å; P326-F340 HydrophobicContact CB-CG 4.35Å; F336-F340 VanDerWaalsContact O-CB 3.24Å; F336-F340 WeakPolarHBondContact O-CB 3.24Å; F336-F340 PolarHBondContact O-N 3.27Å; L338-F340 VanDerWaalsContact C-N 3.27Å; L338-F340 PolarHBondContact O-N 3.44Å; F340-Y343 PolarHBondContact O-N 2.93Å; F340-I344 HydrophobicContact CD1-CD1 4.22Å; F340-I344 HydrophobicContact CD2-CD1 3.94Å; F340-I344 HydrophobicContact CD2-CG1 4.16Å; F340-I344 HydrophobicContact CE1-CD1 4.19Å; F340-I344 HydrophobicContact CE2-CD1 3.92Å; F340-I344 HydrophobicContact CE2-CG1 4.11Å; F340-I344 HydrophobicContact CG-CD1 4.1Å; F340-I344 HydrophobicContact CZ-CD1 4.06Å; F340-I344 WeakPolarHBondContact O-CD1 3.45Å; F340-I344 VanDerWaalsContact O-CG1 3.24Å; F340-I344 WeakPolarHBondContact O-CG1 3.45Å; F340-I344 PolarHBondContact O-N 2.83Å; F340-L407 HydrophobicContact CE2-CD2 3.88Å; F340-I410 HydrophobicContact CD2-CB 4.32Å; F340-I410 HydrophobicContact CD2-CG2 3.49Å; F340-I410 VanDerWaalsContact CD2-CG2 3.49Å; F340-I410 HydrophobicContact CE2-CB 3.78Å; F340-I410 HydrophobicContact CE2-CG2 3.43Å; F340-I410 VanDerWaalsContact CE2-CG2 3.43Å; F340-I410 HydrophobicContact CG-CG2 4.22Å; F340-I410 HydrophobicContact CZ-CB 4.33Å; F340-I410 HydrophobicContact CZ-CG2 4.1Å; F340-Y411 HydrophobicContact CE1-CD2 4.31Å
341	S	93.7	Very high	89.4	Confident	34 Å²	34	42.8 Å²	42.8	24%	0.238	22%	0.221	C	C	.	.	H	α-helix	trans	-61.6	-43.9	174.1	-168.3	0	0	0	0	112	T322 S337 L338 Y343 I344 A345	T322-S341 PolarHBondContact O-OG 3.44Å; S337-S341 VanDerWaalsContact O-CB 3.31Å; S337-S341 WeakPolarHBondContact O-CB 3.45Å; S337-S341 PolarHBondContact O-N 3.27Å; L338-S341 PolarHBondContact O-N 2.89Å; S341-Y343 VanDerWaalsContact C-N 3.32Å; S341-Y343 PolarHBondContact O-N 3.06Å; S341-I344 PolarHBondContact O-N 3.41Å; S341-A345 WeakPolarHBondContact O-CB 3.15Å; S341-A345 PolarHBondContact O-N 2.95Å
342	M	93.2	Very high	90.5	Very high	121 Å²	121	41.4 Å²	41.4	60%	0.596	22%	0.216	S	C	*	.	H	α-helix	trans	-60.8	-39.7	175.1	-73.1	-68.7	177.8	0	0	112.4	L338 A345 M346	L338-M342 HydrophobicContact CD2-CE 4.42Å; L338-M342 HydrophobicContact CD2-CG 3.89Å; L338-M342 WeakPolarHBondContact O-CB 3.45Å; L338-M342 VanDerWaalsContact O-CG 3.31Å; L338-M342 WeakPolarHBondContact O-CG 3.27Å; L338-M342 PolarHBondContact O-N 3.38Å; M342-A345 PolarHBondContact O-N 2.85Å; M342-M346 WeakPolarHBondContact O-CB 3.47Å; M342-M346 PolarHBondContact O-N 3.47Å
343	Y	93.9	Very high	91.4	Very high	9 Å²	9	42.4 Å²	42.4	4%	0.035	22%	0.222	C	C	.	.	H	α-helix	trans	-67.9	-40.2	175.9	178.7	-96.5	0	0	0	112.7	L339 F340 S341 M346 T347 L407 I410 Y622 W626 L629	L339-Y343 WeakPolarHBondContact O-CB 3.31Å; L339-Y343 PolarHBondContact O-N 3.43Å; F340-Y343 PolarHBondContact O-N 2.93Å; S341-Y343 VanDerWaalsContact C-N 3.32Å; S341-Y343 PolarHBondContact O-N 3.06Å; Y343-M346 PolarHBondContact O-N 3.34Å; Y343-T347 WeakPolarHBondContact O-CB 3.31Å; Y343-T347 PolarHBondContact O-N 3.27Å; Y343-T347 PolarHBondContact O-OG1 3.24Å; Y343-L407 HydrophobicContact CD1-CD2 3.78Å; Y343-L407 HydrophobicContact CE1-CD2 3.65Å; Y343-L407 HydrophobicContact CE1-CG 4.47Å; Y343-I410 HydrophobicContact CD1-CD1 3.94Å; Y343-I410 HydrophobicContact CE1-CD1 3.62Å; Y343-Y622 HydrophobicContact CE2-CE2 4.02Å; Y343-Y622 AromaticContact CZ-CE2 3.98Å; Y343-Y622 PolarHBondContact OH-OH 2.92Å; Y343-W626 VanDerWaalsContact OH-CD1 3.25Å; Y343-L629 HydrophobicContact CD1-CD1 4.34Å; Y343-L629 HydrophobicContact CD2-CD1 3.62Å; Y343-L629 HydrophobicContact CE2-CD1 4.34Å; Y343-L629 HydrophobicContact CG-CD1 3.61Å
344	I	94.2	Very high	91.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-67	-38.7	174.4	-60	155.9	0	0	0	110.5	L321 Y325 P326 F340 S341 T347 S348 L407	L321-I344 HydrophobicContact CD2-CG2 4.12Å; L321-I344 HydrophobicContact CG-CG2 4.01Å; Y325-I344 HydrophobicContact CD1-CD1 4.17Å; P326-I344 HydrophobicContact CG-CD1 4.28Å; F340-I344 HydrophobicContact CD1-CD1 4.22Å; F340-I344 HydrophobicContact CD2-CD1 3.94Å; F340-I344 HydrophobicContact CD2-CG1 4.16Å; F340-I344 HydrophobicContact CE1-CD1 4.19Å; F340-I344 HydrophobicContact CE2-CD1 3.92Å; F340-I344 HydrophobicContact CE2-CG1 4.11Å; F340-I344 HydrophobicContact CG-CD1 4.1Å; F340-I344 HydrophobicContact CZ-CD1 4.06Å; F340-I344 WeakPolarHBondContact O-CD1 3.45Å; F340-I344 VanDerWaalsContact O-CG1 3.24Å; F340-I344 WeakPolarHBondContact O-CG1 3.45Å; F340-I344 PolarHBondContact O-N 2.83Å; S341-I344 PolarHBondContact O-N 3.41Å; I344-T347 WeakPolarHBondContact O-CB 3.4Å; I344-T347 PolarHBondContact O-N 3.25Å; I344-S348 WeakPolarHBondContact O-CB 3.45Å; I344-S348 PolarHBondContact O-N 2.94Å; I344-S348 PolarHBondContact O-OG 2.89Å; I344-L407 HydrophobicContact CG1-CD2 3.63Å
345	A	94.8	Very high	92.4	Very high	33 Å²	33	35.7 Å²	35.7	27%	0.273	20%	0.196	S	C	.	.	H	α-helix	trans	-62	-46.3	175.3	0	0	0	0	0	111.4	T322 S341 M342 S348 V349	T322-A345 HydrophobicContact CG2-CB 3.83Å; S341-A345 WeakPolarHBondContact O-CB 3.15Å; S341-A345 PolarHBondContact O-N 2.95Å; M342-A345 PolarHBondContact O-N 2.85Å; A345-S348 WeakPolarHBondContact O-CB 3.35Å; A345-S348 PolarHBondContact O-N 2.9Å; A345-S348 VanDerWaalsContact O-N 3.17Å; A345-V349 WeakPolarHBondContact O-CG2 3.18Å; A345-V349 PolarHBondContact O-N 3.45Å
346	M	94.2	Very high	92.6	Very high	56 Å²	56	30.2 Å²	30.2	28%	0.276	17%	0.169	S	C	.	.	H	α-helix	trans	-62.2	-43.8	174.7	-177.3	176.4	-70.9	0	0	112	M342 Y343 S348 V349 Y350 L621 C625	M342-M346 WeakPolarHBondContact O-CB 3.47Å; M342-M346 PolarHBondContact O-N 3.47Å; Y343-M346 PolarHBondContact O-N 3.34Å; M346-S348 PolarHBondContact O-N 2.77Å; M346-V349 PolarHBondContact O-N 3.03Å; M346-Y350 WeakPolarHBondContact O-CB 3.24Å; M346-Y350 PolarHBondContact O-N 3.15Å; M346-L621 HydrophobicContact CE-CD2 3.66Å; M346-L621 HydrophobicContact CG-CD2 4.43Å; M346-L621 HydrophobicContact SD-CD2 3.72Å; M346-C625 HydrophobicContact CE-CB 4.18Å; M346-C625 HydrophobicContact SD-CB 3.45Å; M346-C625 WeakPolarHBondContact SD-CB 3.31Å; M346-C625 VanDerWaalsContact SD-SG 3.65Å
347	T	94.2	Very high	92.7	Very high	4 Å²	4	30.2 Å²	30.2	3%	0.025	17%	0.169	C	C	.	.	H	α-helix	trans	-57.9	-38.7	173.3	-60.1	0	0	0	0	111.6	Y343 I344 L351 M403 L407	Y343-T347 WeakPolarHBondContact O-CB 3.31Å; Y343-T347 PolarHBondContact O-N 3.27Å; Y343-T347 PolarHBondContact O-OG1 3.24Å; I344-T347 WeakPolarHBondContact O-CB 3.4Å; I344-T347 PolarHBondContact O-N 3.25Å; T347-L351 HydrophobicContact CG2-CD1 4.09Å; T347-L351 WeakPolarHBondContact O-CG 3.39Å; T347-L351 PolarHBondContact O-N 3.24Å; T347-M403 HydrophobicContact CG2-CE 3.84Å; T347-L407 HydrophobicContact CG2-CD1 4.45Å
348	S	95	Very high	92.9	Very high	8 Å²	8	30.1 Å²	30.1	6%	0.056	17%	0.167	C	C	.	.	H	α-helix	trans	-69.5	-48.4	179.7	-60.2	0	0	0	0	111.9	T322 I344 A345 M346 Y350 L351 L352	T322-S348 PolarHBondContact OG1-OG 2.89Å; I344-S348 WeakPolarHBondContact O-CB 3.45Å; I344-S348 PolarHBondContact O-N 2.94Å; I344-S348 PolarHBondContact O-OG 2.89Å; A345-S348 WeakPolarHBondContact O-CB 3.35Å; A345-S348 PolarHBondContact O-N 2.9Å; A345-S348 VanDerWaalsContact O-N 3.17Å; M346-S348 PolarHBondContact O-N 2.77Å; S348-Y350 VanDerWaalsContact C-N 3.26Å; S348-Y350 PolarHBondContact O-N 2.83Å; S348-L351 PolarHBondContact O-N 3.47Å; S348-L352 WeakPolarHBondContact O-CB 3.4Å; S348-L352 VanDerWaalsContact O-CG 3.25Å; S348-L352 WeakPolarHBondContact O-CG 3.19Å; S348-L352 PolarHBondContact O-N 3.43Å
349	V	93.9	Very high	92.8	Very high	81 Å²	81	25.8 Å²	25.8	49%	0.491	15%	0.147	S	C	.	.	H	α-helix	trans	-60.9	-38.7	175.8	175.5	0	0	0	0	110.8	A345 M346 L352 V353 L618	A345-V349 WeakPolarHBondContact O-CG2 3.18Å; A345-V349 PolarHBondContact O-N 3.45Å; M346-V349 PolarHBondContact O-N 3.03Å; V349-L352 PolarHBondContact O-N 3.2Å; V349-V353 PolarHBondContact O-N 2.92Å; V349-L618 HydrophobicContact CG1-CD2 4.26Å
350	Y	94.2	Very high	92.7	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.008	12%	0.124	C	C	.	.	H	α-helix	trans	-59.4	-56	174.4	175.8	-127.3	0	0	0	112.6	M346 S348 L352 V353 D354 M403 R593 L618 T619 Y622	M346-Y350 WeakPolarHBondContact O-CB 3.24Å; M346-Y350 PolarHBondContact O-N 3.15Å; S348-Y350 VanDerWaalsContact C-N 3.26Å; S348-Y350 PolarHBondContact O-N 2.83Å; Y350-L352 PolarHBondContact O-N 3.24Å; Y350-V353 PolarHBondContact O-N 2.88Å; Y350-V353 VanDerWaalsContact O-N 3.16Å; Y350-D354 HydrophobicContact CE2-CB 4.38Å; Y350-D354 WeakPolarHBondContact O-CB 3.26Å; Y350-D354 PolarHBondContact O-N 3.07Å; Y350-M403 HydrophobicContact CD1-CE 3.59Å; Y350-M403 HydrophobicContact CE1-CE 3.77Å; Y350-R593 WeakPolarHBondContact OH-CD 3.43Å; Y350-R593 VanDerWaalsContact OH-CZ 3.27Å; Y350-R593 PolarHBondContact OH-NE 3.22Å; Y350-L618 HydrophobicContact CD2-CD2 4.3Å; Y350-L618 HydrophobicContact CD2-CG 3.99Å; Y350-T619 VanDerWaalsContact CE2-OG1 3.24Å; Y350-T619 WeakPolarHBondContact CE2-OG1 3.43Å; Y350-T619 PolarHBondContact OH-OG1 3.42Å; Y350-Y622 HydrophobicContact CD1-CD1 4.19Å; Y350-Y622 HydrophobicContact CD1-CD2 4.41Å; Y350-Y622 HydrophobicContact CD1-CG 4.1Å; Y350-Y622 HydrophobicContact CE1-CD1 4.07Å; Y350-Y622 HydrophobicContact CE1-CE1 4.45Å; Y350-Y622 HydrophobicContact CE1-CG 4.4Å; Y350-Y622 HydrophobicContact CG-CG 4.45Å
351	L	94.3	Very high	92.5	Very high	7 Å²	7	21.6 Å²	21.6	4%	0.037	13%	0.125	C	C	.	.	H	α-helix	trans	-59.6	-31.5	179.1	-70.4	169.8	0	0	0	112.9	F314 L318 T347 S348 V355	F314-L351 HydrophobicContact CZ-CB 4.27Å; L318-L351 HydrophobicContact CD2-CD1 4.29Å; T347-L351 HydrophobicContact CG2-CD1 4.09Å; T347-L351 WeakPolarHBondContact O-CG 3.39Å; T347-L351 PolarHBondContact O-N 3.24Å; S348-L351 PolarHBondContact O-N 3.47Å; L351-V355 WeakPolarHBondContact O-CB 3.24Å; L351-V355 VanDerWaalsContact O-CG2 3.26Å; L351-V355 WeakPolarHBondContact O-CG2 3.43Å; L351-V355 PolarHBondContact O-N 2.94Å
352	L	93.4	Very high	92.2	Very high	28 Å²	28	20.3 Å²	20.3	15%	0.147	12%	0.115	C	C	.	.	H	α-helix	trans	-72.5	-29.4	178.7	-74.5	171.5	0	0	0	114.3	Y311 F314 V315 L318 S348 V349 Y350 E356	Y311-L352 HydrophobicContact CE1-CD2 4.3Å; Y311-L352 HydrophobicContact CE2-CD2 3.89Å; Y311-L352 PolarHBondContact OH-O 3.43Å; F314-L352 HydrophobicContact CD1-CD2 3.67Å; F314-L352 HydrophobicContact CE1-CD2 3.93Å; V315-L352 HydrophobicContact CB-CD2 4.46Å; V315-L352 HydrophobicContact CG2-CD1 4.05Å; V315-L352 HydrophobicContact CG2-CD2 3.48Å; V315-L352 VanDerWaalsContact CG2-CD2 3.48Å; V315-L352 HydrophobicContact CG2-CG 4.44Å; L318-L352 HydrophobicContact CD1-CD1 4.17Å; L318-L352 HydrophobicContact CD1-CD2 3.93Å; L318-L352 HydrophobicContact CD1-CG 3.73Å; S348-L352 WeakPolarHBondContact O-CB 3.4Å; S348-L352 VanDerWaalsContact O-CG 3.25Å; S348-L352 WeakPolarHBondContact O-CG 3.19Å; S348-L352 PolarHBondContact O-N 3.43Å; V349-L352 PolarHBondContact O-N 3.2Å; Y350-L352 PolarHBondContact O-N 3.24Å; L352-E356 WeakPolarHBondContact O-CG 3.24Å
353	V	92.2	Very high	91.9	Very high	22 Å²	22	14.9 Å²	14.9	13%	0.133	9%	0.088	C	C	.	.	H	α-helix	trans	-86.1	-38.9	175.7	173.1	0	0	0	0	111.1	V349 Y350 E356 T357 I611 T614 D615 L618	V349-V353 PolarHBondContact O-N 2.92Å; Y350-V353 PolarHBondContact O-N 2.88Å; Y350-V353 VanDerWaalsContact O-N 3.16Å; V353-E356 PolarHBondContact O-N 3.14Å; V353-T357 WeakPolarHBondContact O-CB 3.46Å; V353-T357 PolarHBondContact O-N 3.25Å; V353-T357 PolarHBondContact O-OG1 3.11Å; V353-I611 HydrophobicContact CG1-CG1 4.43Å; V353-T614 HydrophobicContact CG1-CG2 4.24Å; V353-D615 HydrophobicContact CG1-CB 4.1Å; V353-L618 HydrophobicContact CB-CD2 3.93Å; V353-L618 HydrophobicContact CG1-CD2 4.33Å; V353-L618 HydrophobicContact CG2-CD2 3.89Å
354	D	91.9	Very high	91.4	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-63.3	-49.3	-179.9	162.3	47.7	0	0	0	112.6	Y350 E356 T357 I358 N396 R593	Y350-D354 HydrophobicContact CE2-CB 4.38Å; Y350-D354 WeakPolarHBondContact O-CB 3.26Å; Y350-D354 PolarHBondContact O-N 3.07Å; D354-E356 VanDerWaalsContact C-N 3.26Å; D354-E356 PolarHBondContact O-N 3.23Å; D354-T357 PolarHBondContact O-N 3.08Å; D354-T357 VanDerWaalsContact O-N 3.16Å; D354-I358 WeakPolarHBondContact O-CG1 3.32Å; D354-I358 PolarHBondContact O-N 2.83Å; D354-N396 PolarHBondContact OD1-ND2 3.06Å; D354-N396 VanDerWaalsContact OD2-CG 3.27Å; D354-N396 PolarHBondContact OD2-ND2 3.17Å; D354-N396 PolarHBondContact OD2-OD1 3.36Å; D354-R593 VanDerWaalsContact CG-NH2 3.3Å; D354-R593 IonicContact OD1-CZ 2.74Å; D354-R593 IonicContact OD1-NH1 3.64Å; D354-R593 PolarHBondContact OD1-NH1 3.49Å; D354-R593 IonicContact OD1-NH2 3.74Å; D354-R593 PolarHBondContact OD1-NH2 3.02Å; D354-R593 IonicContact OD2-CZ 2.67Å; D354-R593 IonicContact OD2-NH1 2.62Å; D354-R593 PolarHBondContact OD2-NH1 3.21Å; D354-R593 IonicContact OD2-NH2 2.72Å; D354-R593 PolarHBondContact OD2-NH2 2.87Å
355	V	92.5	Very high	90.8	Very high	16 Å²	16	15.3 Å²	15.3	10%	0.097	9%	0.091	C	C	.	.	H	α-helix	trans	-57.5	-41.9	178.5	169.6	0	0	0	0	111.4	Y220 L223 F314 L351 A359	Y220-V355 HydrophobicContact CD2-CG2 4.22Å; Y220-V355 HydrophobicContact CE2-CG2 3.57Å; L223-V355 HydrophobicContact CD2-CG1 3.85Å; L223-V355 HydrophobicContact CG-CG1 4.08Å; F314-V355 HydrophobicContact CE1-CG2 4.4Å; L351-V355 WeakPolarHBondContact O-CB 3.24Å; L351-V355 VanDerWaalsContact O-CG2 3.26Å; L351-V355 WeakPolarHBondContact O-CG2 3.43Å; L351-V355 PolarHBondContact O-N 2.94Å; V355-A359 VanDerWaalsContact O-CB 3.29Å; V355-A359 WeakPolarHBondContact O-CB 3.37Å; V355-A359 PolarHBondContact O-N 3.43Å
356	E	90.6	Very high	90.1	Very high	4 Å²	4	15.3 Å²	15.3	2%	0.019	9%	0.087	C	C	.	.	H	α-helix	trans	-68.2	-41.6	177.2	-69.5	-59.4	128.3	0	0	112.6	S247 N248 V249 Y311 L352 V353 D354 A359 V360 I611	S247-E356 WeakPolarHBondContact CA-OE2 3.44Å; S247-E356 WeakPolarHBondContact CB-OE2 3.4Å; S247-E356 WeakPolarHBondContact OG-CB 3.37Å; S247-E356 PolarHBondContact OG-OE2 2.82Å; N248-E356 PolarHBondContact N-OE2 3.38Å; N248-E356 VanDerWaalsContact ND2-CD 3.35Å; N248-E356 PolarHBondContact ND2-OE1 2.8Å; N248-E356 PolarHBondContact ND2-OE2 3.02Å; V249-E356 HydrophobicContact CG1-CG 4.49Å; V249-E356 HydrophobicContact CG2-CB 4.36Å; V249-E356 HydrophobicContact CG2-CG 4.29Å; Y311-E356 HydrophobicContact CD2-CG 4.47Å; Y311-E356 VanDerWaalsContact CD2-OE1 3.27Å; Y311-E356 WeakPolarHBondContact CD2-OE1 3.37Å; Y311-E356 HydrophobicContact CE2-CG 3.63Å; Y311-E356 VanDerWaalsContact CE2-OE1 3.26Å; Y311-E356 WeakPolarHBondContact CE2-OE1 3.33Å; L352-E356 WeakPolarHBondContact O-CG 3.24Å; V353-E356 PolarHBondContact O-N 3.14Å; D354-E356 VanDerWaalsContact C-N 3.26Å; D354-E356 PolarHBondContact O-N 3.23Å; E356-A359 PolarHBondContact O-N 3.4Å; E356-V360 PolarHBondContact O-N 3.16Å; E356-I611 HydrophobicContact CB-CD1 3.76Å
357	T	90.6	Very high	89.3	Confident	4 Å²	4	12.8 Å²	12.8	3%	0.025	8%	0.075	C	C	.	.	H	α-helix	trans	-63	-43.9	176.6	-60.7	0	0	0	0	111.3	V353 D354 M361 I600 I611 A612 D615	V353-T357 WeakPolarHBondContact O-CB 3.46Å; V353-T357 PolarHBondContact O-N 3.25Å; V353-T357 PolarHBondContact O-OG1 3.11Å; D354-T357 PolarHBondContact O-N 3.08Å; D354-T357 VanDerWaalsContact O-N 3.16Å; T357-M361 WeakPolarHBondContact O-CB 3.44Å; T357-M361 PolarHBondContact O-N 2.96Å; T357-I600 HydrophobicContact CG2-CG2 4.19Å; T357-I611 PolarHBondContact OG1-O 3.35Å; T357-A612 HydrophobicContact CG2-CB 4.21Å; T357-D615 HydrophobicContact CG2-CB 3.88Å
358	I	90.6	Very high	88.4	Confident	6 Å²	6	12.7 Å²	12.7	3%	0.031	8%	0.075	C	C	.	.	H	α-helix	trans	-69.7	-32.7	176	-66.7	-64.2	0	0	0	111.5	D354 M361 Y362 V393 N396 L596	D354-I358 WeakPolarHBondContact O-CG1 3.32Å; D354-I358 PolarHBondContact O-N 2.83Å; I358-M361 HydrophobicContact CD1-CE 4.42Å; I358-Y362 WeakPolarHBondContact O-CB 3.3Å; I358-Y362 PolarHBondContact O-N 3.27Å; I358-V393 HydrophobicContact CG2-CG2 4.22Å; I358-N396 HydrophobicContact CG1-CB 4.22Å; I358-N396 HydrophobicContact CG2-CB 4.31Å; I358-L596 HydrophobicContact CD1-CD1 4.48Å; I358-L596 HydrophobicContact CD1-CD2 4.12Å
359	A	89.8	Confident	87.4	Confident	13 Å²	13	12.6 Å²	12.6	11%	0.107	7%	0.073	C	C	.	.	H	α-helix	trans	-64.5	-51.1	174	0	0	0	0	0	112.5	C227 V355 E356 Y362 K363	C227-A359 HydrophobicContact CB-CB 3.52Å; V355-A359 VanDerWaalsContact O-CB 3.29Å; V355-A359 WeakPolarHBondContact O-CB 3.37Å; V355-A359 PolarHBondContact O-N 3.43Å; E356-A359 PolarHBondContact O-N 3.4Å; A359-Y362 PolarHBondContact O-N 3.34Å; A359-K363 WeakPolarHBondContact O-CG 3.03Å; A359-K363 PolarHBondContact O-N 2.83Å
360	V	87.6	Confident	86.2	Confident	1 Å²	1	9.7 Å²	9.7	1%	0.006	5%	0.054	C	C	.	.	H	α-helix	trans	-67.6	-38.8	178.2	178.2	0	0	0	0	111.3	E356 Y362 K363 L364 L609	E356-V360 PolarHBondContact O-N 3.16Å; V360-Y362 VanDerWaalsContact C-N 3.32Å; V360-Y362 PolarHBondContact O-N 2.79Å; V360-K363 PolarHBondContact O-N 3.09Å; V360-L364 HydrophobicContact CG1-CD1 4Å; V360-L364 WeakPolarHBondContact O-CB 3.43Å; V360-L364 PolarHBondContact O-N 2.99Å; V360-L609 HydrophobicContact CB-CD2 4.37Å; V360-L609 HydrophobicContact CG1-CD2 3.54Å
361	M	87.2	Confident	84.7	Confident	5 Å²	5	11.3 Å²	11.3	3%	0.025	6%	0.063	C	C	.	.	H	α-helix	trans	-54	-46.1	169.7	167.2	96	76.7	0	0	112.1	T357 I358 L364 N365 I600 C603	T357-M361 WeakPolarHBondContact O-CB 3.44Å; T357-M361 PolarHBondContact O-N 2.96Å; I358-M361 HydrophobicContact CD1-CE 4.42Å; M361-L364 PolarHBondContact O-N 2.84Å; M361-N365 WeakPolarHBondContact CG-ND2 3.36Å; M361-N365 WeakPolarHBondContact O-CB 3.1Å; M361-N365 PolarHBondContact O-N 3.31Å; M361-N365 PolarHBondContact O-ND2 3Å; M361-N365 PolarHBondContact SD-ND2 3.03Å; M361-I600 HydrophobicContact CE-CB 3.89Å; M361-I600 HydrophobicContact CE-CG1 3.29Å; M361-C603 HydrophobicContact SD-CB 4Å
362	Y	88	Confident	83	Confident	7 Å²	7	14.7 Å²	14.7	3%	0.027	9%	0.085	C	C	.	.	H	α-helix	trans	-65.1	-48.8	-176.4	-170.8	-97.2	0	0	0	110.4	I228 A231 I358 A359 V360 L364 N365 T366 S389 W390 V393	I228-Y362 HydrophobicContact CB-CE1 4.19Å; I228-Y362 HydrophobicContact CG1-CE1 4.27Å; I228-Y362 HydrophobicContact CG2-CE1 3.98Å; A231-Y362 HydrophobicContact CB-CD1 3.56Å; A231-Y362 HydrophobicContact CB-CE1 3.67Å; I358-Y362 WeakPolarHBondContact O-CB 3.3Å; I358-Y362 PolarHBondContact O-N 3.27Å; A359-Y362 PolarHBondContact O-N 3.34Å; V360-Y362 VanDerWaalsContact C-N 3.32Å; V360-Y362 PolarHBondContact O-N 2.79Å; Y362-L364 PolarHBondContact O-N 3.35Å; Y362-N365 PolarHBondContact O-N 3.26Å; Y362-N365 VanDerWaalsContact O-N 3.09Å; Y362-T366 HydrophobicContact CD1-CG2 4.17Å; Y362-T366 HydrophobicContact CE1-CG2 3.71Å; Y362-T366 HydrophobicContact CE2-CG2 4.15Å; Y362-T366 PolarHBondContact O-N 3.48Å; Y362-T366 PolarHBondContact O-OG1 3.37Å; Y362-T366 VanDerWaalsContact O-OG1 3.14Å; Y362-S389 WeakPolarHBondContact CD2-O 3.29Å; Y362-W390 PolarHBondContact OH-NE1 3.42Å; Y362-V393 HydrophobicContact CD2-CG2 3.4Å; Y362-V393 VanDerWaalsContact CD2-CG2 3.4Å; Y362-V393 HydrophobicContact CE2-CG2 3.95Å; Y362-V393 HydrophobicContact CG-CG2 3.95Å
363	K	86.9	Confident	81.2	Confident	6 Å²	6	15 Å²	15	3%	0.026	9%	0.094	C	C	.	.	H	α-helix	trans	-51.5	-51.7	172.9	-65.2	173.5	-177.3	-175.6	0	111.8	E230 A231 I234 V244 Q246 A359 V360 N365 T366 V367	E230-K363 WeakPolarHBondContact OE2-CE 3.33Å; E230-K363 IonicContact OE2-NZ 3.95Å; E230-K363 PolarHBondContact OE2-NZ 2.91Å; A231-K363 HydrophobicContact CB-CG 4.23Å; I234-K363 HydrophobicContact CD1-CD 4.28Å; V244-K363 HydrophobicContact CG1-CB 4.39Å; Q246-K363 PolarHBondContact O-NZ 3.16Å; Q246-K363 VanDerWaalsContact O-NZ 3.16Å; A359-K363 WeakPolarHBondContact O-CG 3.03Å; A359-K363 PolarHBondContact O-N 2.83Å; V360-K363 PolarHBondContact O-N 3.09Å; K363-N365 VanDerWaalsContact C-N 3.31Å; K363-N365 PolarHBondContact O-N 2.89Å; K363-T366 PolarHBondContact O-N 3Å; K363-T366 PolarHBondContact O-OG1 2.76Å; K363-V367 WeakPolarHBondContact O-CB 3.38Å; K363-V367 WeakPolarHBondContact O-CG2 3.26Å; K363-V367 PolarHBondContact O-N 3.32Å
364	L	83.8	Confident	79.8	Confident	2 Å²	2	14 Å²	14	1%	0.01	9%	0.088	C	C	.	.	H	α-helix	trans	-61.8	-34.1	178.2	-88.9	162.4	0	0	0	113.7	V244 F245 V360 M361 Y362 G368 I369 I380 T607 L609	V244-L364 HydrophobicContact CG1-CD2 3.82Å; V244-L364 HydrophobicContact CG1-CG 3.77Å; F245-L364 HydrophobicContact CD1-CD1 4.31Å; F245-L364 HydrophobicContact CE1-CD1 4.12Å; F245-L364 HydrophobicContact CE1-CD2 4.02Å; F245-L364 HydrophobicContact CZ-CD2 4.33Å; V360-L364 HydrophobicContact CG1-CD1 4Å; V360-L364 WeakPolarHBondContact O-CB 3.43Å; V360-L364 PolarHBondContact O-N 2.99Å; M361-L364 PolarHBondContact O-N 2.84Å; Y362-L364 PolarHBondContact O-N 3.35Å; L364-G368 WeakPolarHBondContact O-CA 3.47Å; L364-G368 PolarHBondContact O-N 2.95Å; L364-I369 HydrophobicContact CD2-CD1 4.12Å; L364-I369 HydrophobicContact CD2-CG1 3.87Å; L364-I380 HydrophobicContact CB-CD1 4.37Å; L364-T607 HydrophobicContact CD1-CG2 4.07Å; L364-T607 HydrophobicContact CD2-CG2 4.12Å; L364-L609 HydrophobicContact CD1-CD2 4.42Å
365	N	81.1	Confident	78.2	Confident	17 Å²	17	15 Å²	15	9%	0.091	10%	0.096	C	C	.	.	H	α-helix	trans	-83.1	-19.6	-179.3	-85.1	-70.3	0	0	0	114.3	M361 Y362 K363 K385	M361-N365 WeakPolarHBondContact CG-ND2 3.36Å; M361-N365 WeakPolarHBondContact O-CB 3.1Å; M361-N365 PolarHBondContact O-N 3.31Å; M361-N365 PolarHBondContact O-ND2 3Å; M361-N365 PolarHBondContact SD-ND2 3.03Å; Y362-N365 PolarHBondContact O-N 3.26Å; Y362-N365 VanDerWaalsContact O-N 3.09Å; K363-N365 VanDerWaalsContact C-N 3.31Å; K363-N365 PolarHBondContact O-N 2.89Å; N365-K385 PolarHBondContact O-NZ 3.41Å; N365-K385 WeakPolarHBondContact OD1-CE 3.33Å
366	T	80	Confident	76.8	Confident	32 Å²	32	16.1 Å²	16.1	20%	0.196	10%	0.101	C	C	.	.	H	α-helix	trans	-99.6	-38.4	178.2	55	0	0	0	0	113.1	A231 Y362 K363	A231-T366 WeakPolarHBondContact CB-OG1 3.5Å; Y362-T366 HydrophobicContact CD1-CG2 4.17Å; Y362-T366 HydrophobicContact CE1-CG2 3.71Å; Y362-T366 HydrophobicContact CE2-CG2 4.15Å; Y362-T366 PolarHBondContact O-N 3.48Å; Y362-T366 PolarHBondContact O-OG1 3.37Å; Y362-T366 VanDerWaalsContact O-OG1 3.14Å; K363-T366 PolarHBondContact O-N 3Å; K363-T366 PolarHBondContact O-OG1 2.76Å
367	V	77.4	Confident	75.4	Confident	4 Å²	4	17.5 Å²	17.5	2%	0.024	11%	0.109	C	C	.	.	H	α-helix	trans	-89.5	-37.1	-179.7	-174.2	0	0	0	0	111.5	I234 K235 V244 K363	I234-V367 HydrophobicContact CB-CG2 4.04Å; I234-V367 HydrophobicContact CG2-CG1 3.9Å; I234-V367 HydrophobicContact CG2-CG2 3.91Å; K235-V367 HydrophobicContact CB-CG2 4.2Å; V244-V367 HydrophobicContact CG2-CB 4.14Å; V244-V367 HydrophobicContact CG2-CG1 3.96Å; V244-V367 HydrophobicContact CG2-CG2 4.4Å; K363-V367 WeakPolarHBondContact O-CB 3.38Å; K363-V367 WeakPolarHBondContact O-CG2 3.26Å; K363-V367 PolarHBondContact O-N 3.32Å
368	G	75.7	Confident	74.1	Confident	1 Å²	1	18.3 Å²	18.3	1%	0.01	12%	0.115	C	C	.	.			trans	66.9	-161.3	-159.2	0	0	0	0	0	111.7	L364 V378	L364-G368 WeakPolarHBondContact O-CA 3.47Å; L364-G368 PolarHBondContact O-N 2.95Å; G368-V378 WeakPolarHBondContact CA-O 3.29Å
369	I	73.2	Confident	72.9	Confident	6 Å²	6	21.7 Å²	21.7	3%	0.031	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	116.6	176.4	-55.9	174.2	0	0	0	108.4	F245 Y261 F264 L364 V377 V378	F245-I369 HydrophobicContact CE2-CD1 4.39Å; F245-I369 HydrophobicContact CZ-CD1 3.71Å; F245-I369 HydrophobicContact CZ-CG1 4.26Å; Y261-I369 HydrophobicContact CE2-CG2 4.43Å; F264-I369 HydrophobicContact CD1-CD1 3.9Å; F264-I369 HydrophobicContact CE1-CD1 3.35Å; F264-I369 HydrophobicContact CE1-CG2 4.47Å; F264-I369 HydrophobicContact CZ-CD1 3.74Å; L364-I369 HydrophobicContact CD2-CD1 4.12Å; L364-I369 HydrophobicContact CD2-CG1 3.87Å; I369-V377 PolarHBondContact O-N 2.99Å; I369-V378 HydrophobicContact CB-CB 4.22Å; I369-V378 HydrophobicContact CD1-CB 4.26Å; I369-V378 HydrophobicContact CG1-CB 4.46Å; I369-V378 PolarHBondContact N-O 3.36Å; I369-V378 PolarHBondContact O-N 3.32Å
370	R	69.2	Low	71.6	Confident	21 Å²	21	22 Å²	22	8%	0.079	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	147	174	-75.3	-177.5	172.1	139.2	-5.4	112.1	K235 P241 Y261 E292 S375 L376	K235-R370 PolarHBondContact O-NH1 3.29Å; K235-R370 PolarHBondContact O-NH2 2.84Å; P241-R370 HydrophobicContact CB-CB 4.44Å; Y261-R370 PolarHBondContact OH-O 2.89Å; E292-R370 IonicContact OE2-CZ 3.56Å; E292-R370 IonicContact OE2-NE 3.56Å; E292-R370 IonicContact OE2-NH2 2.94Å; E292-R370 PolarHBondContact OE2-NH2 3.45Å; R370-S375 CarbonylContact C-O 3.34Å; R370-S375 VanDerWaalsContact CA-O 3.27Å; R370-S375 WeakPolarHBondContact CA-O 3.42Å; R370-L376 HydrophobicContact CG-CB 4.46Å; R370-L376 HydrophobicContact CG-CG 4.22Å
371	D	62.8	Low	70	Confident	36 Å²	36	25 Å²	25	19%	0.193	15%	0.146	C	C	.	.			trans	-63	158.2	164.9	-77.4	-51.5	0	0	0	110.8	F265 G373 G374 S375 V377	F265-D371 WeakPolarHBondContact CE2-OD1 3.24Å; F265-D371 WeakPolarHBondContact CZ-OD1 3.37Å; D371-G373 PolarHBondContact O-N 2.91Å; D371-G373 VanDerWaalsContact O-N 3.07Å; D371-G374 PolarHBondContact O-N 3.4Å; D371-S375 WeakPolarHBondContact CB-O 3.3Å; D371-S375 PolarHBondContact N-O 3.2Å; D371-S375 WeakPolarHBondContact OD2-CB 3.33Å; D371-S375 PolarHBondContact OD2-OG 3.24Å; D371-V377 HydrophobicContact CB-CG2 4.16Å; D371-V377 WeakPolarHBondContact OD1-CG2 3.28Å
372	P	58.3	Low	68.5	Low	78 Å²	78	29 Å²	29	51%	0.506	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-11.4	166.3	27.3	-34.9	0	0	0	113.7	F265	F265-P372 HydrophobicContact CE1-CG 4.49Å; F265-P372 VanDerWaalsContact CZ-CD 3.42Å; F265-P372 HydrophobicContact CZ-CG 4.27Å
373	G	56	Low	66.7	Low	33 Å²	33	35.5 Å²	35.5	34%	0.34	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-8	169.8	0	0	0	0	0	115.2	N291 D371	N291-G373 PolarHBondContact OD1-O 3.47Å; D371-G373 PolarHBondContact O-N 2.91Å; D371-G373 VanDerWaalsContact O-N 3.07Å
374	G	62.9	Low	65	Low	1 Å²	1	39.7 Å²	39.7	1%	0.01	23%	0.228	C	C	.	.	S	Bend	trans	96.2	-21.5	-176.9	0	0	0	0	0	115.2	D371	D371-G374 PolarHBondContact O-N 3.4Å
375	S	58.2	Low	63.8	Low	23 Å²	23	42.1 Å²	42.1	16%	0.161	24%	0.239	C	C	.	.			trans	-52.2	143.7	170.7	148.9	0	0	0	0	112	R370 D371	R370-S375 CarbonylContact C-O 3.34Å; R370-S375 VanDerWaalsContact CA-O 3.27Å; R370-S375 WeakPolarHBondContact CA-O 3.42Å; D371-S375 WeakPolarHBondContact CB-O 3.3Å; D371-S375 PolarHBondContact N-O 3.2Å; D371-S375 WeakPolarHBondContact OD2-CB 3.33Å; D371-S375 PolarHBondContact OD2-OG 3.24Å
376	L	63.7	Low	62.9	Low	38 Å²	38	49.7 Å²	49.7	20%	0.199	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	99.6	-171.9	-156.1	164.3	0	0	0	110.9	R370 H379	R370-L376 HydrophobicContact CG-CB 4.46Å; R370-L376 HydrophobicContact CG-CG 4.22Å; L376-H379 HydrophobicContact CD2-CB 3.79Å
377	V	61.4	Low	62.4	Low	33 Å²	33	50.1 Å²	50.1	20%	0.2	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	-44.9	-169.9	-158.5	0	0	0	0	113.1	F265 I369 D371	F265-V377 HydrophobicContact CE2-CG2 4.15Å; I369-V377 PolarHBondContact O-N 2.99Å; D371-V377 HydrophobicContact CB-CG2 4.16Å; D371-V377 WeakPolarHBondContact OD1-CG2 3.28Å
378	V	63.3	Low	62.5	Low	22 Å²	22	53.9 Å²	53.9	13%	0.133	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	97.8	-175.5	-174.5	0	0	0	0	108.8	F264 H268 G368 I369	F264-V378 HydrophobicContact CE1-CG2 4.42Å; F264-V378 HydrophobicContact CZ-CG2 4.49Å; H268-V378 WeakPolarHBondContact NE2-CG2 3.46Å; G368-V378 WeakPolarHBondContact CA-O 3.29Å; I369-V378 HydrophobicContact CB-CB 4.22Å; I369-V378 HydrophobicContact CD1-CB 4.26Å; I369-V378 HydrophobicContact CG1-CB 4.46Å; I369-V378 PolarHBondContact N-O 3.36Å; I369-V378 PolarHBondContact O-N 3.32Å
379	H	63.5	Low	62.7	Low	76 Å²	76	54.5 Å²	54.5	35%	0.352	30%	0.295	S	S	.	.			trans	-80	139.6	161.3	-156.6	-89.8	0	0	0	109.5	L376 D381 K606	L376-H379 HydrophobicContact CD2-CB 3.79Å; H379-D381 PolarHBondContact O-N 2.75Å; H379-K606 PolarHBondContact O-NZ 3.12Å
380	I	62.5	Low	63.2	Low	20 Å²	20	56.8 Å²	56.8	10%	0.103	30%	0.303	C	S	.	.			trans	-77.4	84.9	160.3	-59.4	178.9	0	0	0	105.8	L364 T382 K385	L364-I380 HydrophobicContact CB-CD1 4.37Å; I380-T382 PolarHBondContact O-N 3.43Å; I380-K385 HydrophobicContact CG2-CG 4.27Å; I380-K385 WeakPolarHBondContact O-CE 3.28Å
381	D	54.3	Low	64.1	Low	64 Å²	64	62.7 Å²	62.7	34%	0.342	33%	0.326	S	S	.	.			trans	-34.6	122.8	-177.3	-171.2	-9.5	0	0	0	112.7	H379 N383 L384	H379-D381 PolarHBondContact O-N 2.75Å; D381-N383 PolarHBondContact O-N 3.05Å; D381-N383 PolarHBondContact OD1-N 3.23Å; D381-N383 PolarHBondContact OD1-ND2 3.4Å; D381-L384 HydrophobicContact CB-CD1 4.14Å; D381-L384 PolarHBondContact O-N 2.91Å
382	T	56.6	Low	65.3	Low	89 Å²	89	61.2 Å²	61.2	55%	0.546	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-60.3	-35.3	-173.1	41.1	0	0	0	0	111.8	I380 L384 K385	I380-T382 PolarHBondContact O-N 3.43Å; T382-L384 PolarHBondContact O-N 2.8Å; T382-L384 VanDerWaalsContact O-N 3.14Å; T382-K385 PolarHBondContact O-N 2.89Å
383	N	49.1	Very low	66.8	Low	144 Å²	144	57.5 Å²	57.5	77%	0.77	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-67.6	-10.8	178.9	-58.3	-58.3	0	0	0	113.4	D381	D381-N383 PolarHBondContact O-N 3.05Å; D381-N383 PolarHBondContact OD1-N 3.23Å; D381-N383 PolarHBondContact OD1-ND2 3.4Å
384	L	53	Low	68.4	Low	94 Å²	94	59.6 Å²	59.6	49%	0.492	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-115.9	8.5	-178.6	-82.9	126.6	0	0	0	113.7	D381 T382 K602	D381-L384 HydrophobicContact CB-CD1 4.14Å; D381-L384 PolarHBondContact O-N 2.91Å; T382-L384 PolarHBondContact O-N 2.8Å; T382-L384 VanDerWaalsContact O-N 3.14Å; L384-K602 PolarHBondContact O-NZ 3.27Å
385	K	58.1	Low	69.7	Low	53 Å²	53	61.5 Å²	61.5	23%	0.23	31%	0.308	C	S	.	.			trans	-83.2	116.6	171.5	-70.4	-178.5	178.3	175	0	110.4	N365 I380 T382 I387	N365-K385 PolarHBondContact O-NZ 3.41Å; N365-K385 WeakPolarHBondContact OD1-CE 3.33Å; I380-K385 HydrophobicContact CG2-CG 4.27Å; I380-K385 WeakPolarHBondContact O-CE 3.28Å; T382-K385 PolarHBondContact O-N 2.89Å; K385-I387 VanDerWaalsContact C-N 3.26Å; K385-I387 PolarHBondContact O-N 3.29Å
386	Y	61.7	Low	71.3	Confident	176 Å²	176	60.6 Å²	60.6	69%	0.69	30%	0.301	S	S	*	.	S	Bend	trans	-66.8	-28.9	174.4	-63.2	-68.1	0	0	0	112.9	K602	Y386-K602 HydrophobicContact CD2-CD 4.37Å; Y386-K602 HydrophobicContact CE2-CD 3.9Å
387	I	70.3	Confident	72.6	Confident	41 Å²	41	60.2 Å²	60.2	21%	0.21	30%	0.303	C	S	.	.	S	Bend	trans	-143.1	136.9	-178	-56.7	178	0	0	0	108.3	K385 Y391 L395 C595	K385-I387 VanDerWaalsContact C-N 3.26Å; K385-I387 PolarHBondContact O-N 3.29Å; I387-Y391 VanDerWaalsContact CG2-CB 3.43Å; I387-Y391 HydrophobicContact CG2-CD2 4.38Å; I387-Y391 HydrophobicContact CG2-CG 4.37Å; I387-L395 HydrophobicContact CD1-CD1 4.04Å; I387-L395 HydrophobicContact CG2-CD1 4.48Å; I387-C595 HydrophobicContact CD1-CB 3.87Å; I387-C595 VanDerWaalsContact CD1-O 3.3Å; I387-C595 WeakPolarHBondContact CD1-O 3.48Å
388	T	78.9	Confident	74	Confident	82 Å²	82	60.4 Å²	60.4	50%	0.503	31%	0.308	S	S	.	.			trans	-62.3	143.5	176.5	-40.5	0	0	0	0	111.6	W390 Y391 C392	T388-W390 PolarHBondContact O-N 2.91Å; T388-W390 VanDerWaalsContact O-N 3.09Å; T388-Y391 PolarHBondContact O-N 3.49Å; T388-C392 PolarHBondContact O-N 3.4Å
389	S	79.8	Confident	75.4	Confident	14 Å²	14	59.3 Å²	59.3	10%	0.098	30%	0.302	C	S	.	.	H	α-helix	trans	-47.8	-43.6	-176.3	-41	0	0	0	0	113.6	Y362 C392	Y362-S389 WeakPolarHBondContact CD2-O 3.29Å; S389-C392 WeakPolarHBondContact O-CB 3.43Å; S389-C392 PolarHBondContact O-N 3.13Å
390	W	84.7	Confident	76.7	Confident	55 Å²	55	55.9 Å²	55.9	21%	0.208	29%	0.286	C	S	.	.	H	α-helix	trans	-60.8	-42.7	177.8	-102.7	105.2	0	0	0	113.6	N89 F93 I228 Y362 T388 C392 V393 L394	N89-W390 HydrophobicContact CB-CZ2 3.95Å; F93-W390 HydrophobicContact CB-CH2 3.77Å; F93-W390 HydrophobicContact CD1-CH2 4.36Å; F93-W390 AromaticContact CD2-CH2 3.68Å; F93-W390 HydrophobicContact CD2-CH2 3.68Å; F93-W390 AromaticContact CD2-CZ3 3.66Å; F93-W390 HydrophobicContact CD2-CZ3 3.66Å; F93-W390 HydrophobicContact CE2-CH2 4.38Å; F93-W390 AromaticContact CE2-CZ3 3.95Å; F93-W390 HydrophobicContact CE2-CZ3 3.95Å; F93-W390 AromaticContact CG-CH2 3.67Å; F93-W390 HydrophobicContact CG-CH2 3.67Å; F93-W390 HydrophobicContact CG-CZ3 4.08Å; I228-W390 HydrophobicContact CD1-CH2 3.62Å; I228-W390 HydrophobicContact CD1-CZ2 4.14Å; I228-W390 HydrophobicContact CD1-CZ3 3.85Å; I228-W390 HydrophobicContact CG2-CH2 4.46Å; I228-W390 HydrophobicContact CG2-CZ2 4.03Å; Y362-W390 PolarHBondContact OH-NE1 3.42Å; T388-W390 PolarHBondContact O-N 2.91Å; T388-W390 VanDerWaalsContact O-N 3.09Å; W390-C392 VanDerWaalsContact C-N 3.27Å; W390-C392 PolarHBondContact O-N 3.09Å; W390-V393 PolarHBondContact O-N 3.13Å; W390-L394 HydrophobicContact CE3-CD1 4.38Å; W390-L394 HydrophobicContact CE3-CG 4.34Å; W390-L394 WeakPolarHBondContact O-CG 3.24Å; W390-L394 PolarHBondContact O-N 3.04Å; W390-L394 VanDerWaalsContact O-N 3.07Å
391	Y	87.7	Confident	78.1	Confident	144 Å²	144	57.4 Å²	57.4	57%	0.565	30%	0.297	S	S	*	.	H	α-helix	trans	-67.2	-27.9	178.6	-67.3	-53.3	0	0	0	112.2	I387 T388 L394 L395	I387-Y391 VanDerWaalsContact CG2-CB 3.43Å; I387-Y391 HydrophobicContact CG2-CD2 4.38Å; I387-Y391 HydrophobicContact CG2-CG 4.37Å; T388-Y391 PolarHBondContact O-N 3.49Å; Y391-L394 HydrophobicContact CD1-CD1 4.26Å; Y391-L394 PolarHBondContact O-N 3Å; Y391-L395 VanDerWaalsContact O-CB 3.26Å; Y391-L395 WeakPolarHBondContact O-CB 3.44Å; Y391-L395 VanDerWaalsContact O-CG 3.23Å; Y391-L395 WeakPolarHBondContact O-CG 3.39Å; Y391-L395 PolarHBondContact O-N 3.46Å
392	C	87.1	Confident	79.9	Confident	5 Å²	5	54.4 Å²	54.4	3%	0.034	28%	0.281	C	S	.	.	H	α-helix	trans	-63.3	-42.3	173.3	-61.9	0	0	0	0	111.8	T388 S389 W390 N396 L596	T388-C392 PolarHBondContact O-N 3.4Å; S389-C392 WeakPolarHBondContact O-CB 3.43Å; S389-C392 PolarHBondContact O-N 3.13Å; W390-C392 VanDerWaalsContact C-N 3.27Å; W390-C392 PolarHBondContact O-N 3.09Å; C392-N396 PolarHBondContact O-N 3.49Å; C392-N396 VanDerWaalsContact O-N 3.13Å; C392-L596 HydrophobicContact CB-CD2 3.91Å
393	V	89.4	Confident	81.6	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.006	26%	0.256	C	S	.	.	H	α-helix	trans	-68	-42.9	176.7	178.3	0	0	0	0	110.9	L224 I228 I358 Y362 W390 N396 A397	L224-V393 HydrophobicContact CD1-CG1 4.46Å; L224-V393 HydrophobicContact CD2-CG1 3.58Å; L224-V393 HydrophobicContact CG-CG1 4.13Å; I228-V393 HydrophobicContact CD1-CG1 4.27Å; I358-V393 HydrophobicContact CG2-CG2 4.22Å; Y362-V393 HydrophobicContact CD2-CG2 3.4Å; Y362-V393 VanDerWaalsContact CD2-CG2 3.4Å; Y362-V393 HydrophobicContact CE2-CG2 3.95Å; Y362-V393 HydrophobicContact CG-CG2 3.95Å; W390-V393 PolarHBondContact O-N 3.13Å; V393-N396 PolarHBondContact O-N 3.37Å; V393-A397 WeakPolarHBondContact O-CB 3.29Å; V393-A397 PolarHBondContact O-N 2.96Å
394	L	90.3	Very high	83.6	Confident	76 Å²	76	44.9 Å²	44.9	40%	0.398	23%	0.226	S	C	.	.	H	α-helix	trans	-65.4	-37.9	177	-66.3	171.6	0	0	0	112.9	F93 W390 Y391 A397 A398	F93-L394 HydrophobicContact CE2-CD2 4.36Å; W390-L394 HydrophobicContact CE3-CD1 4.38Å; W390-L394 HydrophobicContact CE3-CG 4.34Å; W390-L394 WeakPolarHBondContact O-CG 3.24Å; W390-L394 PolarHBondContact O-N 3.04Å; W390-L394 VanDerWaalsContact O-N 3.07Å; Y391-L394 HydrophobicContact CD1-CD1 4.26Å; Y391-L394 PolarHBondContact O-N 3Å; L394-A397 PolarHBondContact O-N 3.27Å; L394-A398 WeakPolarHBondContact O-CB 3.41Å; L394-A398 PolarHBondContact O-N 3.33Å
395	L	90.8	Very high	85.4	Confident	42 Å²	42	44 Å²	44	22%	0.22	22%	0.222	C	C	.	.	H	α-helix	trans	-64.9	-37.9	174.3	-79.5	167.9	0	0	0	111.9	I387 Y391 S399 T592 C595 L596	I387-L395 HydrophobicContact CD1-CD1 4.04Å; I387-L395 HydrophobicContact CG2-CD1 4.48Å; Y391-L395 VanDerWaalsContact O-CB 3.26Å; Y391-L395 WeakPolarHBondContact O-CB 3.44Å; Y391-L395 VanDerWaalsContact O-CG 3.23Å; Y391-L395 WeakPolarHBondContact O-CG 3.39Å; Y391-L395 PolarHBondContact O-N 3.46Å; L395-S399 PolarHBondContact O-N 3.32Å; L395-T592 HydrophobicContact CD2-CG2 4.24Å; L395-C595 HydrophobicContact CD1-CB 3.94Å; L395-L596 HydrophobicContact CB-CD1 4.25Å; L395-L596 HydrophobicContact CB-CD2 4.08Å; L395-L596 HydrophobicContact CB-CG 4.17Å; L395-L596 HydrophobicContact CD1-CD2 4.37Å
396	N	91.4	Very high	87	Confident	4 Å²	4	41.7 Å²	41.7	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-67.8	-48.2	172.7	-168.7	2	0	0	0	111.2	D354 I358 C392 V393 A398 S399 R593 L596	D354-N396 PolarHBondContact OD1-ND2 3.06Å; D354-N396 VanDerWaalsContact OD2-CG 3.27Å; D354-N396 PolarHBondContact OD2-ND2 3.17Å; D354-N396 PolarHBondContact OD2-OD1 3.36Å; I358-N396 HydrophobicContact CG1-CB 4.22Å; I358-N396 HydrophobicContact CG2-CB 4.31Å; C392-N396 PolarHBondContact O-N 3.49Å; C392-N396 VanDerWaalsContact O-N 3.13Å; V393-N396 PolarHBondContact O-N 3.37Å; N396-A398 PolarHBondContact O-N 3.08Å; N396-A398 VanDerWaalsContact O-N 3.16Å; N396-S399 WeakPolarHBondContact O-CB 3.24Å; N396-S399 PolarHBondContact O-N 2.93Å; N396-S399 PolarHBondContact O-OG 3.3Å; N396-S399 PolarHBondContact OD1-OG 3.4Å; N396-R593 PolarHBondContact OD1-NH2 3.42Å; N396-L596 HydrophobicContact CB-CD1 4.42Å
397	A	91.2	Very high	88.4	Confident	29 Å²	29	33.6 Å²	33.6	24%	0.24	18%	0.181	C	C	.	.	H	α-helix	trans	-52.8	-39.1	176.1	0	0	0	0	0	112.5	L224 V393 L394 S399 P401	L224-A397 HydrophobicContact CD1-CB 3.74Å; V393-A397 WeakPolarHBondContact O-CB 3.29Å; V393-A397 PolarHBondContact O-N 2.96Å; L394-A397 PolarHBondContact O-N 3.27Å; A397-S399 VanDerWaalsContact C-N 3.29Å; A397-S399 PolarHBondContact O-N 3.27Å; A397-P401 WeakPolarHBondContact O-CD 3.47Å
398	A	91.3	Very high	89.2	Confident	37 Å²	37	34.2 Å²	34.2	31%	0.306	18%	0.183	S	C	.	.	H	α-helix	trans	-71.8	-16.4	176.6	0	0	0	0	0	114.2	L394 N396 W588	L394-A398 WeakPolarHBondContact O-CB 3.41Å; L394-A398 PolarHBondContact O-N 3.33Å; N396-A398 PolarHBondContact O-N 3.08Å; N396-A398 VanDerWaalsContact O-N 3.16Å; A398-W588 PolarHBondContact O-NE1 2.95Å
399	S	91.2	Very high	89.7	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-79.2	-41.1	179.9	80.7	0	0	0	0	112.6	L395 N396 A397 A402 M403 R593	L395-S399 PolarHBondContact O-N 3.32Å; N396-S399 WeakPolarHBondContact O-CB 3.24Å; N396-S399 PolarHBondContact O-N 2.93Å; N396-S399 PolarHBondContact O-OG 3.3Å; N396-S399 PolarHBondContact OD1-OG 3.4Å; A397-S399 VanDerWaalsContact C-N 3.29Å; A397-S399 PolarHBondContact O-N 3.27Å; S399-A402 WeakPolarHBondContact O-CB 3.29Å; S399-A402 PolarHBondContact O-N 2.83Å; S399-M403 WeakPolarHBondContact O-CG 3.43Å; S399-M403 PolarHBondContact O-N 3.34Å; S399-M403 VanDerWaalsContact O-N 3.08Å; S399-R593 PolarHBondContact OG-NH2 3.43Å
400	L	91.6	Very high	90	Very high	3 Å²	3	30.6 Å²	30.6	2%	0.016	16%	0.16	C	C	.	.	H	α-helix	trans	-57.5	-41.2	-177	173.3	142.6	0	0	0	114.2	L217 Y220 A402 M403 I404	L217-L400 HydrophobicContact CD1-CD2 3.73Å; Y220-L400 HydrophobicContact CD1-CD1 3.95Å; Y220-L400 HydrophobicContact CD1-CD2 4.34Å; Y220-L400 HydrophobicContact CD2-CD1 3.54Å; Y220-L400 HydrophobicContact CE1-CB 4.34Å; Y220-L400 HydrophobicContact CE1-CD1 4.13Å; Y220-L400 HydrophobicContact CE2-CD1 3.71Å; Y220-L400 HydrophobicContact CG-CD1 3.64Å; L400-A402 VanDerWaalsContact C-N 3.33Å; L400-A402 PolarHBondContact O-N 2.97Å; L400-M403 WeakPolarHBondContact O-CB 3.48Å; L400-M403 PolarHBondContact O-N 3.36Å; L400-I404 HydrophobicContact CD2-CD1 3.54Å; L400-I404 HydrophobicContact CD2-CG1 4.49Å; L400-I404 HydrophobicContact CG-CD1 4.07Å; L400-I404 WeakPolarHBondContact O-CG1 3.31Å; L400-I404 PolarHBondContact O-N 3.22Å
401	P	91.1	Very high	90.2	Very high	52 Å²	52	28.4 Å²	28.4	34%	0.338	15%	0.152	S	C	.	.	H	α-helix	trans	-57.2	-41.6	171.8	-28.2	36.3	0	0	0	113.4	A397 I404 I405	A397-P401 WeakPolarHBondContact O-CD 3.47Å; P401-I404 PolarHBondContact O-N 3.45Å; P401-I405 WeakPolarHBondContact O-CD1 3.49Å; P401-I405 VanDerWaalsContact O-CG1 3.22Å; P401-I405 WeakPolarHBondContact O-CG1 3.38Å; P401-I405 PolarHBondContact O-N 3.38Å
402	A	91.8	Very high	90	Very high	1 Å²	1	23 Å²	23	1%	0.008	14%	0.138	C	C	.	.	H	α-helix	trans	-67.1	-38.3	177.5	0	0	0	0	0	111.9	S399 L400 I405 C406 T585 W588 T589	S399-A402 WeakPolarHBondContact O-CB 3.29Å; S399-A402 PolarHBondContact O-N 2.83Å; L400-A402 VanDerWaalsContact C-N 3.33Å; L400-A402 PolarHBondContact O-N 2.97Å; A402-I405 PolarHBondContact O-N 3.17Å; A402-C406 WeakPolarHBondContact O-CB 3.11Å; A402-C406 PolarHBondContact O-N 3.34Å; A402-T585 HydrophobicContact CB-CG2 4.47Å; A402-T585 WeakPolarHBondContact O-CB 3.38Å; A402-W588 HydrophobicContact CB-CB 4.15Å; A402-W588 HydrophobicContact CB-CD2 4.1Å; A402-W588 HydrophobicContact CB-CG 3.76Å; A402-T589 HydrophobicContact CB-CG2 3.76Å
403	M	92.2	Very high	89.9	Confident	4 Å²	4	24.1 Å²	24.1	2%	0.02	14%	0.141	C	C	.	.	H	α-helix	trans	-61.1	-44.4	173.4	-55.4	-75.9	-74.3	0	0	111.3	T347 Y350 S399 L400 C406 L407 T589 Y622	T347-M403 HydrophobicContact CG2-CE 3.84Å; Y350-M403 HydrophobicContact CD1-CE 3.59Å; Y350-M403 HydrophobicContact CE1-CE 3.77Å; S399-M403 WeakPolarHBondContact O-CG 3.43Å; S399-M403 PolarHBondContact O-N 3.34Å; S399-M403 VanDerWaalsContact O-N 3.08Å; L400-M403 WeakPolarHBondContact O-CB 3.48Å; L400-M403 PolarHBondContact O-N 3.36Å; M403-C406 WeakPolarHBondContact O-CB 3.14Å; M403-C406 PolarHBondContact O-N 2.92Å; M403-L407 PolarHBondContact O-N 2.7Å; M403-T589 HydrophobicContact CG-CG2 4.12Å; M403-T589 HydrophobicContact SD-CG2 3.64Å; M403-Y622 HydrophobicContact CE-CD1 4.38Å; M403-Y622 HydrophobicContact CE-CE1 3.61Å; M403-Y622 HydrophobicContact CE-CE2 3.79Å; M403-Y622 WeakPolarHBondContact CE-OH 3.5Å; M403-Y622 HydrophobicContact SD-CE1 3.73Å; M403-Y622 PolarHBondContact SD-OH 2.87Å
404	I	91.9	Very high	89.6	Confident	29 Å²	29	24.1 Å²	24.1	15%	0.149	14%	0.141	C	C	.	.	H	α-helix	trans	-62.9	-49.6	175.4	-70.3	169.9	0	0	0	110.7	I213 L400 P401 C406 L407 M408	I213-I404 HydrophobicContact CG2-CD1 4.05Å; I213-I404 HydrophobicContact CG2-CG1 4.43Å; I213-I404 HydrophobicContact CG2-CG2 3.7Å; L400-I404 HydrophobicContact CD2-CD1 3.54Å; L400-I404 HydrophobicContact CD2-CG1 4.49Å; L400-I404 HydrophobicContact CG-CD1 4.07Å; L400-I404 WeakPolarHBondContact O-CG1 3.31Å; L400-I404 PolarHBondContact O-N 3.22Å; P401-I404 PolarHBondContact O-N 3.45Å; I404-C406 PolarHBondContact O-N 2.82Å; I404-L407 WeakPolarHBondContact O-CA 3.29Å; I404-L407 WeakPolarHBondContact O-CB 3.33Å; I404-L407 PolarHBondContact O-N 3.44Å; I404-L407 VanDerWaalsContact O-N 3.08Å; I404-M408 HydrophobicContact CG2-CE 4.16Å; I404-M408 HydrophobicContact CG2-CG 4.42Å; I404-M408 VanDerWaalsContact O-CE 3.29Å; I404-M408 WeakPolarHBondContact O-CE 3.43Å; I404-M408 WeakPolarHBondContact O-CG 3.46Å; I404-M408 PolarHBondContact O-N 3.11Å
405	I	90.9	Very high	89.1	Confident	77 Å²	77	21.8 Å²	21.8	40%	0.395	13%	0.128	S	C	.	.	H	α-helix	trans	-61.5	-35.3	179.9	-63.7	160	0	0	0	111	P401 A402 M408 A409 I581 T585	P401-I405 WeakPolarHBondContact O-CD1 3.49Å; P401-I405 VanDerWaalsContact O-CG1 3.22Å; P401-I405 WeakPolarHBondContact O-CG1 3.38Å; P401-I405 PolarHBondContact O-N 3.38Å; A402-I405 PolarHBondContact O-N 3.17Å; I405-M408 WeakPolarHBondContact O-CB 3.47Å; I405-M408 PolarHBondContact O-N 2.92Å; I405-A409 PolarHBondContact O-N 3.18Å; I405-I581 HydrophobicContact CG2-CG2 3.89Å; I405-T585 HydrophobicContact CB-CG2 3.7Å; I405-T585 HydrophobicContact CG2-CG2 3.54Å
406	C	91.2	Very high	88.5	Confident	4 Å²	4	21.6 Å²	21.6	3%	0.027	13%	0.129	C	C	.	.	H	α-helix	trans	-62.5	-45.9	173	-167.2	0	0	0	0	112.1	A402 M403 I404 M408 A409 I410 W626	A402-C406 WeakPolarHBondContact O-CB 3.11Å; A402-C406 PolarHBondContact O-N 3.34Å; M403-C406 WeakPolarHBondContact O-CB 3.14Å; M403-C406 PolarHBondContact O-N 2.92Å; I404-C406 PolarHBondContact O-N 2.82Å; C406-M408 VanDerWaalsContact C-N 3.25Å; C406-M408 PolarHBondContact O-N 2.81Å; C406-A409 WeakPolarHBondContact O-CB 3.11Å; C406-A409 PolarHBondContact O-N 3.4Å; C406-I410 WeakPolarHBondContact O-CG1 3Å; C406-I410 PolarHBondContact O-N 3.4Å; C406-I410 VanDerWaalsContact O-N 3.1Å; C406-W626 PolarHBondContact SG-NE1 3.05Å
407	L	91.4	Very high	88	Confident	6 Å²	6	22.1 Å²	22.1	3%	0.031	13%	0.131	C	C	.	.	H	α-helix	trans	-58.8	-36.6	172.2	-73.7	171.9	0	0	0	112.1	L321 Y325 F340 Y343 I344 T347 M403 I404 I410 Y411	L321-L407 HydrophobicContact CD2-CD1 4.33Å; Y325-L407 HydrophobicContact CE1-CB 4.34Å; F340-L407 HydrophobicContact CE2-CD2 3.88Å; Y343-L407 HydrophobicContact CD1-CD2 3.78Å; Y343-L407 HydrophobicContact CE1-CD2 3.65Å; Y343-L407 HydrophobicContact CE1-CG 4.47Å; I344-L407 HydrophobicContact CG1-CD2 3.63Å; T347-L407 HydrophobicContact CG2-CD1 4.45Å; M403-L407 PolarHBondContact O-N 2.7Å; I404-L407 WeakPolarHBondContact O-CA 3.29Å; I404-L407 WeakPolarHBondContact O-CB 3.33Å; I404-L407 PolarHBondContact O-N 3.44Å; I404-L407 VanDerWaalsContact O-N 3.08Å; L407-I410 PolarHBondContact O-N 3.42Å; L407-Y411 PolarHBondContact O-N 3.19Å
408	M	88.3	Confident	87.4	Confident	53 Å²	53	20.9 Å²	20.9	26%	0.261	12%	0.121	S	C	.	.	H	α-helix	trans	-67.5	-39.5	178.4	-58.9	-47.1	88.7	0	0	110.8	I213 Y325 I404 I405 C406 Y411 A412	I213-M408 HydrophobicContact CD1-CE 3.28Å; I213-M408 HydrophobicContact CD1-SD 3.37Å; I213-M408 WeakPolarHBondContact CD1-SD 3.46Å; I213-M408 HydrophobicContact CG1-CE 4.15Å; Y325-M408 HydrophobicContact CE1-CE 3.61Å; Y325-M408 HydrophobicContact CE2-CE 4.4Å; Y325-M408 VanDerWaalsContact CZ-CE 3.46Å; Y325-M408 WeakPolarHBondContact OH-CE 3.41Å; Y325-M408 PolarHBondContact OH-SD 3.4Å; I404-M408 HydrophobicContact CG2-CE 4.16Å; I404-M408 HydrophobicContact CG2-CG 4.42Å; I404-M408 VanDerWaalsContact O-CE 3.29Å; I404-M408 WeakPolarHBondContact O-CE 3.43Å; I404-M408 WeakPolarHBondContact O-CG 3.46Å; I404-M408 PolarHBondContact O-N 3.11Å; I405-M408 WeakPolarHBondContact O-CB 3.47Å; I405-M408 PolarHBondContact O-N 2.92Å; C406-M408 VanDerWaalsContact C-N 3.25Å; C406-M408 PolarHBondContact O-N 2.81Å; M408-Y411 PolarHBondContact O-N 3.34Å; M408-A412 VanDerWaalsContact O-CB 3.27Å; M408-A412 WeakPolarHBondContact O-CB 3.38Å; M408-A412 PolarHBondContact O-N 2.98Å
409	A	87.8	Confident	86.6	Confident	8 Å²	8	23.3 Å²	23.3	7%	0.066	12%	0.124	C	C	.	.	H	α-helix	trans	-63.4	-40	176.2	0	0	0	0	0	112	I405 C406 A412 Y413 I581 A582	I405-A409 PolarHBondContact O-N 3.18Å; C406-A409 WeakPolarHBondContact O-CB 3.11Å; C406-A409 PolarHBondContact O-N 3.4Å; A409-A412 PolarHBondContact O-N 3.29Å; A409-Y413 WeakPolarHBondContact O-CB 3.22Å; A409-Y413 PolarHBondContact O-N 2.93Å; A409-I581 HydrophobicContact CB-CG2 4.45Å; A409-A582 HydrophobicContact CB-CB 4.38Å
410	I	87.7	Confident	85.7	Confident	12 Å²	12	24.5 Å²	24.5	6%	0.062	13%	0.13	C	C	.	.	H	α-helix	trans	-66.9	-43.1	176.3	-61.7	165.6	0	0	0	111.1	F336 F340 Y343 C406 L407 Y413 G414 L629 L633	F336-I410 HydrophobicContact CZ-CG2 4.34Å; F340-I410 HydrophobicContact CD2-CB 4.32Å; F340-I410 HydrophobicContact CD2-CG2 3.49Å; F340-I410 VanDerWaalsContact CD2-CG2 3.49Å; F340-I410 HydrophobicContact CE2-CB 3.78Å; F340-I410 HydrophobicContact CE2-CG2 3.43Å; F340-I410 VanDerWaalsContact CE2-CG2 3.43Å; F340-I410 HydrophobicContact CG-CG2 4.22Å; F340-I410 HydrophobicContact CZ-CB 4.33Å; F340-I410 HydrophobicContact CZ-CG2 4.1Å; Y343-I410 HydrophobicContact CD1-CD1 3.94Å; Y343-I410 HydrophobicContact CE1-CD1 3.62Å; C406-I410 WeakPolarHBondContact O-CG1 3Å; C406-I410 PolarHBondContact O-N 3.4Å; C406-I410 VanDerWaalsContact O-N 3.1Å; L407-I410 PolarHBondContact O-N 3.42Å; I410-Y413 WeakPolarHBondContact O-CB 3.23Å; I410-Y413 PolarHBondContact O-N 2.9Å; I410-G414 PolarHBondContact O-N 2.83Å; I410-L629 HydrophobicContact CD1-CD2 3.95Å; I410-L629 HydrophobicContact CG1-CD2 4.35Å; I410-L633 HydrophobicContact CG2-CD1 4.38Å
411	Y	87.5	Confident	84.8	Confident	10 Å²	10	24.4 Å²	24.4	4%	0.039	13%	0.129	C	C	.	.	H	α-helix	trans	-62.7	-44.2	174.8	177.6	-85.9	0	0	0	111.9	H118 S119 A120 Y325 F329 F340 L407 M408 Y413 G414 E415	H118-Y411 AromaticContact CE1-CD1 3.88Å; H118-Y411 AromaticContact CE1-CE1 3.31Å; H118-Y411 WeakPolarHBondContact CE1-CE1 3.3Å; H118-Y411 AromaticContact CE1-CE2 3.8Å; H118-Y411 AromaticContact CE1-CZ 3.3Å; H118-Y411 AromaticContact ND1-CE1 3.87Å; H118-Y411 AromaticContact ND1-CZ 3.66Å; H118-Y411 PolarHBondContact ND1-OH 2.9Å; H118-Y411 AromaticContact NE2-CE1 3.94Å; S119-Y411 WeakPolarHBondContact CB-OH 3.43Å; S119-Y411 PolarHBondContact N-OH 2.77Å; A120-Y411 HydrophobicContact CB-CE2 3.85Å; A120-Y411 PolarHBondContact N-OH 3.43Å; Y325-Y411 HydrophobicContact CD2-CD2 4.26Å; Y325-Y411 HydrophobicContact CE1-CD2 4.22Å; Y325-Y411 HydrophobicContact CE1-CG 4.18Å; Y325-Y411 AromaticContact CE2-CD2 3.83Å; Y325-Y411 HydrophobicContact CE2-CD2 3.83Å; Y325-Y411 HydrophobicContact CE2-CE2 4.37Å; Y325-Y411 HydrophobicContact CE2-CG 4.06Å; Y325-Y411 AromaticContact CZ-CD2 3.76Å; Y325-Y411 AromaticContact CZ-CG 3.62Å; Y325-Y411 WeakPolarHBondContact OH-CB 3.3Å; F329-Y411 AromaticContact CE2-CD2 3.64Å; F329-Y411 HydrophobicContact CE2-CD2 3.64Å; F329-Y411 AromaticContact CE2-CE2 3.68Å; F329-Y411 HydrophobicContact CE2-CE2 3.68Å; F329-Y411 HydrophobicContact CE2-CG 4.47Å; F329-Y411 HydrophobicContact CZ-CD2 4.1Å; F329-Y411 AromaticContact CZ-CE2 3.97Å; F329-Y411 HydrophobicContact CZ-CE2 3.97Å; F340-Y411 HydrophobicContact CE1-CD2 4.31Å; L407-Y411 PolarHBondContact O-N 3.19Å; M408-Y411 PolarHBondContact O-N 3.34Å; Y411-Y413 PolarHBondContact O-N 3.11Å; Y411-G414 WeakPolarHBondContact O-CA 3.34Å; Y411-G414 PolarHBondContact O-N 2.8Å; Y411-E415 HydrophobicContact CD1-CG 4.48Å; Y411-E415 HydrophobicContact CE1-CG 3.78Å; Y411-E415 WeakPolarHBondContact CE1-OE1 3.36Å; Y411-E415 VanDerWaalsContact CZ-OE1 3.28Å; Y411-E415 PolarHBondContact O-N 3.37Å; Y411-E415 PolarHBondContact OH-OE1 3.45Å
412	A	84.8	Confident	83.8	Confident	31 Å²	31	21.9 Å²	21.9	26%	0.256	11%	0.113	S	C	.	.	H	α-helix	trans	-66.4	-34.3	177.3	0	0	0	0	0	112.9	M408 A409 G414 E415 T416 L578	M408-A412 VanDerWaalsContact O-CB 3.27Å; M408-A412 WeakPolarHBondContact O-CB 3.38Å; M408-A412 PolarHBondContact O-N 2.98Å; A409-A412 PolarHBondContact O-N 3.29Å; A412-G414 VanDerWaalsContact C-N 3.33Å; A412-E415 PolarHBondContact O-N 3.49Å; A412-T416 WeakPolarHBondContact O-CG2 3.44Å; A412-T416 PolarHBondContact O-N 2.99Å; A412-T416 PolarHBondContact O-OG1 3.09Å; A412-L578 HydrophobicContact CB-CD1 4.25Å; A412-L578 HydrophobicContact CB-CD2 3.74Å
413	Y	84.3	Confident	82.7	Confident	27 Å²	27	23.6 Å²	23.6	11%	0.106	12%	0.123	C	C	.	.	H	α-helix	trans	-59.1	-45.1	167.4	175.2	-76.6	0	0	0	110.5	F336 A409 I410 Y411 T416 K417 L633 W639	F336-Y413 HydrophobicContact CE2-CD1 4.13Å; F336-Y413 HydrophobicContact CE2-CE1 4.36Å; F336-Y413 HydrophobicContact CZ-CD1 4.44Å; A409-Y413 WeakPolarHBondContact O-CB 3.22Å; A409-Y413 PolarHBondContact O-N 2.93Å; I410-Y413 WeakPolarHBondContact O-CB 3.23Å; I410-Y413 PolarHBondContact O-N 2.9Å; Y411-Y413 PolarHBondContact O-N 3.11Å; Y413-T416 WeakPolarHBondContact CA-OG1 3.49Å; Y413-T416 PolarHBondContact O-N 3.45Å; Y413-T416 PolarHBondContact O-OG1 2.81Å; Y413-K417 HydrophobicContact CD1-CG 4.19Å; Y413-K417 HydrophobicContact CE1-CG 3.8Å; Y413-K417 WeakPolarHBondContact O-CB 3.17Å; Y413-K417 WeakPolarHBondContact O-CG 3.45Å; Y413-K417 PolarHBondContact O-N 3.04Å; Y413-L633 HydrophobicContact CD1-CD1 4.43Å; Y413-L633 HydrophobicContact CE1-CB 4.48Å; Y413-L633 HydrophobicContact CE1-CD2 4.11Å; Y413-L633 HydrophobicContact CE2-CB 4.38Å; Y413-L633 PolarHBondContact OH-O 3.15Å; Y413-W639 AromaticContact CE1-NE1 3.88Å; Y413-W639 AromaticContact CZ-NE1 3.98Å; Y413-W639 PolarHBondContact OH-NE1 3.15Å; Y413-W639 VanDerWaalsContact OH-NE1 3.16Å
414	G	83.2	Confident	81.6	Confident	1 Å²	1	23.6 Å²	23.6	1%	0.01	12%	0.123	C	C	.	.	H	α-helix	trans	-57.9	-48.7	174.4	0	0	0	0	0	113.1	F329 I410 Y411 A412 K417 F418	F329-G414 VanDerWaalsContact CE1-C 3.46Å; I410-G414 PolarHBondContact O-N 2.83Å; Y411-G414 WeakPolarHBondContact O-CA 3.34Å; Y411-G414 PolarHBondContact O-N 2.8Å; A412-G414 VanDerWaalsContact C-N 3.33Å; G414-K417 PolarHBondContact O-N 3.03Å; G414-F418 PolarHBondContact O-N 2.98Å
415	E	79.9	Confident	80.5	Confident	27 Å²	27	22.2 Å²	22.2	13%	0.126	12%	0.116	C	C	.	.	H	α-helix	trans	-65	-42	177.4	-85.2	-157.9	-165	0	0	113.3	F329 Y411 A412 K417 F418 K419	F329-E415 HydrophobicContact CZ-CG 4.37Å; Y411-E415 HydrophobicContact CD1-CG 4.48Å; Y411-E415 HydrophobicContact CE1-CG 3.78Å; Y411-E415 WeakPolarHBondContact CE1-OE1 3.36Å; Y411-E415 VanDerWaalsContact CZ-OE1 3.28Å; Y411-E415 PolarHBondContact O-N 3.37Å; Y411-E415 PolarHBondContact OH-OE1 3.45Å; A412-E415 PolarHBondContact O-N 3.49Å; E415-K417 VanDerWaalsContact C-N 3.34Å; E415-F418 PolarHBondContact O-N 3.47Å; E415-K419 WeakPolarHBondContact O-CB 3.48Å; E415-K419 WeakPolarHBondContact O-CD 3.22Å; E415-K419 VanDerWaalsContact O-CG 3.28Å; E415-K419 WeakPolarHBondContact O-CG 3.5Å; E415-K419 PolarHBondContact O-N 3.47Å; E415-K419 IonicContact OE2-NZ 2.62Å; E415-K419 PolarHBondContact OE2-NZ 3.36Å
416	T	78.3	Confident	79.4	Confident	39 Å²	39	18.8 Å²	18.8	24%	0.239	10%	0.099	C	C	.	.	H	α-helix	trans	-65.6	-37.9	177.8	51.1	0	0	0	0	111.5	A412 Y413 K419 E420 L578	A412-T416 WeakPolarHBondContact O-CG2 3.44Å; A412-T416 PolarHBondContact O-N 2.99Å; A412-T416 PolarHBondContact O-OG1 3.09Å; Y413-T416 WeakPolarHBondContact CA-OG1 3.49Å; Y413-T416 PolarHBondContact O-N 3.45Å; Y413-T416 PolarHBondContact O-OG1 2.81Å; T416-K419 PolarHBondContact O-N 3.27Å; T416-E420 WeakPolarHBondContact O-CB 3.46Å; T416-E420 PolarHBondContact O-N 2.93Å; T416-L578 HydrophobicContact CG2-CD1 4.16Å
417	K	79.9	Confident	78.2	Confident	14 Å²	14	22.2 Å²	22.2	6%	0.061	12%	0.115	C	C	.	.	H	α-helix	trans	-67.7	-36.3	173.2	-75.8	-71	172.8	-171.8	0	113.2	Y413 G414 E415 E420 A421 T499 T637 F641	Y413-K417 HydrophobicContact CD1-CG 4.19Å; Y413-K417 HydrophobicContact CE1-CG 3.8Å; Y413-K417 WeakPolarHBondContact O-CB 3.17Å; Y413-K417 WeakPolarHBondContact O-CG 3.45Å; Y413-K417 PolarHBondContact O-N 3.04Å; G414-K417 PolarHBondContact O-N 3.03Å; E415-K417 VanDerWaalsContact C-N 3.34Å; K417-E420 WeakPolarHBondContact CD-OE2 3.43Å; K417-E420 IonicContact NZ-OE2 3.22Å; K417-E420 PolarHBondContact NZ-OE2 3.17Å; K417-E420 PolarHBondContact O-N 2.96Å; K417-A421 PolarHBondContact O-N 3.33Å; K417-T499 HydrophobicContact CD-CG2 4.19Å; K417-T499 WeakPolarHBondContact O-CG2 3.49Å; K417-T637 PolarHBondContact NZ-O 3.18Å; K417-F641 VanDerWaalsContact C-CE2 3.47Å; K417-F641 HydrophobicContact CB-CE2 3.89Å; K417-F641 HydrophobicContact CB-CZ 3.78Å; K417-F641 VanDerWaalsContact O-CE2 3.23Å; K417-F641 WeakPolarHBondContact O-CE2 3.4Å
418	F	78.4	Confident	76.8	Confident	4 Å²	4	22.8 Å²	22.8	2%	0.018	12%	0.118	C	C	.	.	H	α-helix	trans	-65	-44.8	171.2	179.7	-105.4	0	0	0	111.7	L126 L136 T332 G414 E415 E420 A421 V422 F641 L643	L126-F418 HydrophobicContact CB-CD1 4.34Å; L126-F418 HydrophobicContact CB-CD2 4.32Å; L126-F418 HydrophobicContact CB-CE1 4.1Å; L126-F418 HydrophobicContact CB-CE2 4.09Å; L126-F418 HydrophobicContact CB-CG 4.45Å; L126-F418 HydrophobicContact CB-CZ 3.98Å; L126-F418 HydrophobicContact CD2-CB 4.05Å; L126-F418 HydrophobicContact CD2-CD1 3.6Å; L126-F418 HydrophobicContact CD2-CD2 4.33Å; L126-F418 HydrophobicContact CD2-CE1 4.13Å; L126-F418 HydrophobicContact CD2-CG 3.72Å; L126-F418 HydrophobicContact CG-CD1 3.84Å; L126-F418 HydrophobicContact CG-CE1 3.83Å; L126-F418 HydrophobicContact CG-CG 4.26Å; L126-F418 HydrophobicContact CG-CZ 4.23Å; L136-F418 HydrophobicContact CD1-CE1 4.38Å; T332-F418 HydrophobicContact CG2-CD2 3.84Å; T332-F418 HydrophobicContact CG2-CE2 3.68Å; G414-F418 PolarHBondContact O-N 2.98Å; E415-F418 PolarHBondContact O-N 3.47Å; F418-E420 VanDerWaalsContact C-N 3.32Å; F418-E420 PolarHBondContact O-N 2.83Å; F418-A421 PolarHBondContact O-N 2.86Å; F418-V422 HydrophobicContact CD1-CG2 4.07Å; F418-V422 HydrophobicContact CE1-CG2 3.59Å; F418-V422 HydrophobicContact CE2-CG2 4.17Å; F418-V422 HydrophobicContact CZ-CG2 3.64Å; F418-V422 WeakPolarHBondContact O-CG2 3.47Å; F418-V422 PolarHBondContact O-N 3.24Å; F418-F641 HydrophobicContact CD2-CG 4.49Å; F418-L643 HydrophobicContact CE2-CG 4.44Å
419	K	74.8	Confident	75.8	Confident	88 Å²	88	22.4 Å²	22.4	38%	0.383	12%	0.117	S	C	.	.	H	α-helix	trans	-59	-41.2	176.3	-71.1	161.9	-169.2	163.4	0	111.7	E415 T416 A421 V422 T423	E415-K419 WeakPolarHBondContact O-CB 3.48Å; E415-K419 WeakPolarHBondContact O-CD 3.22Å; E415-K419 VanDerWaalsContact O-CG 3.28Å; E415-K419 WeakPolarHBondContact O-CG 3.5Å; E415-K419 PolarHBondContact O-N 3.47Å; E415-K419 IonicContact OE2-NZ 2.62Å; E415-K419 PolarHBondContact OE2-NZ 3.36Å; T416-K419 PolarHBondContact O-N 3.27Å; K419-A421 VanDerWaalsContact C-N 3.3Å; K419-A421 PolarHBondContact O-N 2.97Å; K419-V422 PolarHBondContact O-N 3.21Å; K419-T423 PolarHBondContact O-N 3.18Å; K419-T423 PolarHBondContact O-OG1 3.29Å
420	E	72	Confident	74.6	Confident	25 Å²	25	25.5 Å²	25.5	12%	0.117	13%	0.132	C	C	.	.	H	α-helix	trans	-60.7	-33.1	173.9	-177.4	167.6	-117.8	0	0	113.1	T416 K417 F418 T423 N424 T499 R575	T416-E420 WeakPolarHBondContact O-CB 3.46Å; T416-E420 PolarHBondContact O-N 2.93Å; K417-E420 WeakPolarHBondContact CD-OE2 3.43Å; K417-E420 IonicContact NZ-OE2 3.22Å; K417-E420 PolarHBondContact NZ-OE2 3.17Å; K417-E420 PolarHBondContact O-N 2.96Å; F418-E420 VanDerWaalsContact C-N 3.32Å; F418-E420 PolarHBondContact O-N 2.83Å; E420-T423 WeakPolarHBondContact CA-OG1 3.34Å; E420-T423 PolarHBondContact O-OG1 3.5Å; E420-N424 PolarHBondContact O-N 2.9Å; E420-N424 PolarHBondContact O-ND2 3.41Å; E420-N424 PolarHBondContact O-OD1 3.49Å; E420-T499 HydrophobicContact CB-CG2 4.46Å; E420-T499 HydrophobicContact CG-CG2 4.41Å; E420-T499 WeakPolarHBondContact CG-O 3.22Å; E420-R575 IonicContact OE1-CZ 2.63Å; E420-R575 IonicContact OE1-NH1 2.91Å; E420-R575 PolarHBondContact OE1-NH1 2.91Å; E420-R575 IonicContact OE1-NH2 3.12Å; E420-R575 IonicContact OE2-NH1 3.77Å
421	A	72.6	Confident	73.3	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-77.7	-34.4	172.9	0	0	0	0	0	113.3	K417 F418 K419 N424 Y425 T499 F641	K417-A421 PolarHBondContact O-N 3.33Å; F418-A421 PolarHBondContact O-N 2.86Å; K419-A421 VanDerWaalsContact C-N 3.3Å; K419-A421 PolarHBondContact O-N 2.97Å; A421-N424 PolarHBondContact O-N 3.46Å; A421-Y425 WeakPolarHBondContact O-CB 3.39Å; A421-Y425 PolarHBondContact O-N 2.81Å; A421-T499 HydrophobicContact CB-CG2 4.17Å; A421-F641 HydrophobicContact CB-CB 4.29Å; A421-F641 HydrophobicContact CB-CD2 3.65Å; A421-F641 HydrophobicContact CB-CE2 4.46Å; A421-F641 HydrophobicContact CB-CG 4.39Å
422	V	70.6	Confident	71.9	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-66.9	-37.3	174.7	177.4	0	0	0	0	111.2	L133 L136 L137 F140 F418 K419 Y425 A426 L643	L133-V422 HydrophobicContact CD1-CG1 4.01Å; L133-V422 HydrophobicContact CD1-CG2 4Å; L136-V422 HydrophobicContact CB-CG1 4.46Å; L136-V422 HydrophobicContact CD2-CG1 4.45Å; L137-V422 HydrophobicContact CD1-CG1 4.03Å; F140-V422 HydrophobicContact CE2-CG1 4.19Å; F418-V422 HydrophobicContact CD1-CG2 4.07Å; F418-V422 HydrophobicContact CE1-CG2 3.59Å; F418-V422 HydrophobicContact CE2-CG2 4.17Å; F418-V422 HydrophobicContact CZ-CG2 3.64Å; F418-V422 WeakPolarHBondContact O-CG2 3.47Å; F418-V422 PolarHBondContact O-N 3.24Å; K419-V422 PolarHBondContact O-N 3.21Å; V422-Y425 WeakPolarHBondContact O-CB 3.33Å; V422-Y425 PolarHBondContact O-N 2.89Å; V422-A426 PolarHBondContact O-N 3.06Å; V422-L643 HydrophobicContact CG2-CD2 4.09Å
423	T	69.8	Low	70.3	Confident	37 Å²	37	31.5 Å²	31.5	23%	0.227	18%	0.177	C	C	.	.	H	α-helix	trans	-63.5	-42.6	173.4	45.3	0	0	0	0	112.3	F140 K419 E420 Y425 A426 Q427	F140-T423 HydrophobicContact CE1-CG2 3.61Å; F140-T423 HydrophobicContact CE2-CG2 4.38Å; F140-T423 HydrophobicContact CZ-CG2 3.5Å; K419-T423 PolarHBondContact O-N 3.18Å; K419-T423 PolarHBondContact O-OG1 3.29Å; E420-T423 WeakPolarHBondContact CA-OG1 3.34Å; E420-T423 PolarHBondContact O-OG1 3.5Å; T423-Y425 VanDerWaalsContact C-N 3.33Å; T423-Y425 PolarHBondContact O-N 3.18Å; T423-A426 PolarHBondContact O-N 3.04Å; T423-Q427 WeakPolarHBondContact O-CG 3.03Å; T423-Q427 PolarHBondContact O-N 3.49Å
424	N	69	Low	68.8	Low	3 Å²	3	31.3 Å²	31.3	2%	0.016	18%	0.178	C	C	.	.	H	α-helix	trans	-66.5	-36.7	177.9	-60	-11.7	0	0	0	110.9	E420 A421 Q427 L428 I497 T498 T499 K500 H501	E420-N424 PolarHBondContact O-N 2.9Å; E420-N424 PolarHBondContact O-ND2 3.41Å; E420-N424 PolarHBondContact O-OD1 3.49Å; A421-N424 PolarHBondContact O-N 3.46Å; N424-Q427 PolarHBondContact O-N 3.39Å; N424-L428 WeakPolarHBondContact O-CG 3.39Å; N424-L428 PolarHBondContact O-N 3.1Å; N424-I497 HydrophobicContact CB-CG2 4.46Å; N424-T498 PolarHBondContact ND2-O 3.3Å; N424-T499 PolarHBondContact ND2-O 3.23Å; N424-K500 PolarHBondContact ND2-O 3.25Å; N424-H501 PolarHBondContact OD1-ND1 3.12Å
425	Y	68.1	Low	66.8	Low	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.4	-45.2	172.4	175.2	-132.5	0	0	0	112.7	L133 L137 A421 V422 T423 Q427 L428 L429 I434 L495 I497 L643 H645	L133-Y425 HydrophobicContact CD2-CE1 4.29Å; L137-Y425 HydrophobicContact CD1-CD1 4Å; L137-Y425 HydrophobicContact CD1-CE1 4.2Å; A421-Y425 WeakPolarHBondContact O-CB 3.39Å; A421-Y425 PolarHBondContact O-N 2.81Å; V422-Y425 WeakPolarHBondContact O-CB 3.33Å; V422-Y425 PolarHBondContact O-N 2.89Å; T423-Y425 VanDerWaalsContact C-N 3.33Å; T423-Y425 PolarHBondContact O-N 3.18Å; Y425-Q427 VanDerWaalsContact C-N 3.31Å; Y425-Q427 PolarHBondContact O-N 2.96Å; Y425-L428 PolarHBondContact O-N 3.02Å; Y425-L429 HydrophobicContact CD1-CD1 4.28Å; Y425-L429 HydrophobicContact CD2-CD1 4.22Å; Y425-L429 HydrophobicContact CD2-CG 4.32Å; Y425-L429 HydrophobicContact CE1-CD1 3.88Å; Y425-L429 HydrophobicContact CE2-CD1 3.83Å; Y425-L429 HydrophobicContact CE2-CD2 4.44Å; Y425-L429 HydrophobicContact CE2-CG 3.97Å; Y425-L429 HydrophobicContact CG-CD1 4.45Å; Y425-L429 PolarHBondContact O-N 3.41Å; Y425-I434 HydrophobicContact CD2-CD1 4.29Å; Y425-I434 HydrophobicContact CE2-CD1 3.93Å; Y425-L495 HydrophobicContact CE2-CD1 3.99Å; Y425-I497 HydrophobicContact CD2-CD1 3.3Å; Y425-I497 HydrophobicContact CE2-CD1 4.15Å; Y425-I497 HydrophobicContact CG-CD1 3.59Å; Y425-L643 HydrophobicContact CD1-CD2 3.71Å; Y425-L643 HydrophobicContact CE1-CD2 4.32Å; Y425-L643 HydrophobicContact CG-CD2 4.08Å; Y425-H645 AromaticContact CZ-ND1 3.91Å; Y425-H645 WeakPolarHBondContact OH-CB 3.29Å; Y425-H645 PolarHBondContact OH-ND1 2.92Å
426	A	67.5	Low	64.8	Low	5 Å²	5	39.2 Å²	39.2	4%	0.041	23%	0.234	C	C	.	.	H	α-helix	trans	-62.8	-37.3	176.6	0	0	0	0	0	112.1	L137 F140 L143 V422 T423 L429 I430	L137-A426 HydrophobicContact CD1-CB 4.23Å; L137-A426 HydrophobicContact CG-CB 4.47Å; F140-A426 HydrophobicContact CD2-CB 4.24Å; L143-A426 HydrophobicContact CD1-CB 4.02Å; V422-A426 PolarHBondContact O-N 3.06Å; T423-A426 PolarHBondContact O-N 3.04Å; A426-L429 PolarHBondContact O-N 3.45Å; A426-I430 WeakPolarHBondContact O-CD1 3.46Å; A426-I430 VanDerWaalsContact O-CG1 3.27Å; A426-I430 WeakPolarHBondContact O-CG1 3.48Å; A426-I430 PolarHBondContact O-N 3.49Å; A426-I430 VanDerWaalsContact O-N 3.08Å
427	Q	66.7	Low	62.8	Low	76 Å²	76	40.3 Å²	40.3	36%	0.355	24%	0.241	S	C	.	.	H	α-helix	trans	-64	-44.4	173.3	-72.2	169.3	-16.6	0	0	112.2	T423 N424 Y425 L429 I430 A431	T423-Q427 WeakPolarHBondContact O-CG 3.03Å; T423-Q427 PolarHBondContact O-N 3.49Å; N424-Q427 PolarHBondContact O-N 3.39Å; Y425-Q427 VanDerWaalsContact C-N 3.31Å; Y425-Q427 PolarHBondContact O-N 2.96Å; Q427-L429 VanDerWaalsContact C-N 3.34Å; Q427-L429 PolarHBondContact O-N 3.19Å; Q427-I430 PolarHBondContact O-N 3.42Å; Q427-A431 WeakPolarHBondContact O-CB 3.41Å; Q427-A431 PolarHBondContact O-N 3.39Å
428	L	62.6	Low	60.5	Low	19 Å²	19	46.8 Å²	46.8	10%	0.099	28%	0.276	C	S	.	.	H	α-helix	trans	-65.9	-33.7	177.5	-69.8	166.5	0	0	0	113	N424 Y425 G432 W502	N424-L428 WeakPolarHBondContact O-CG 3.39Å; N424-L428 PolarHBondContact O-N 3.1Å; Y425-L428 PolarHBondContact O-N 3.02Å; L428-G432 PolarHBondContact O-N 2.87Å; L428-W502 HydrophobicContact CD2-CD2 4.06Å; L428-W502 HydrophobicContact CD2-CE3 4.37Å; L428-W502 HydrophobicContact CD2-CG 4.3Å
429	L	65.5	Low	58	Low	44 Å²	44	50 Å²	50	23%	0.23	31%	0.31	C	S	.	.	H	α-helix	trans	-63.3	-46.5	170.4	-81.4	166.5	0	0	0	111.8	L137 Y425 A426 Q427 A431 G432 I434	L137-L429 HydrophobicContact CD2-CD1 3.81Å; Y425-L429 HydrophobicContact CD1-CD1 4.28Å; Y425-L429 HydrophobicContact CD2-CD1 4.22Å; Y425-L429 HydrophobicContact CD2-CG 4.32Å; Y425-L429 HydrophobicContact CE1-CD1 3.88Å; Y425-L429 HydrophobicContact CE2-CD1 3.83Å; Y425-L429 HydrophobicContact CE2-CD2 4.44Å; Y425-L429 HydrophobicContact CE2-CG 3.97Å; Y425-L429 HydrophobicContact CG-CD1 4.45Å; Y425-L429 PolarHBondContact O-N 3.41Å; A426-L429 PolarHBondContact O-N 3.45Å; Q427-L429 VanDerWaalsContact C-N 3.34Å; Q427-L429 PolarHBondContact O-N 3.19Å; L429-A431 VanDerWaalsContact C-N 3.3Å; L429-A431 PolarHBondContact O-N 3.34Å; L429-G432 PolarHBondContact O-N 2.94Å; L429-I434 HydrophobicContact CD2-CD1 3.75Å; L429-I434 HydrophobicContact CG-CD1 3.89Å
430	I	63.5	Low	55.7	Low	74 Å²	74	50.8 Å²	50.8	38%	0.379	33%	0.326	S	S	.	.	H	α-helix	trans	-66.1	-33.8	178.3	-66.5	164.2	0	0	0	111.3	N142 L143 L146 A426 Q427 G432	N142-I430 HydrophobicContact CB-CD1 4.44Å; L143-I430 HydrophobicContact CB-CD1 4.14Å; L143-I430 HydrophobicContact CD1-CD1 4.3Å; L143-I430 HydrophobicContact CD1-CG1 4.27Å; L143-I430 HydrophobicContact CG-CD1 4.47Å; L143-I430 HydrophobicContact CG-CG1 4.48Å; L146-I430 HydrophobicContact CD2-CB 4.49Å; L146-I430 HydrophobicContact CD2-CG1 4.13Å; L146-I430 HydrophobicContact CD2-CG2 4.37Å; A426-I430 WeakPolarHBondContact O-CD1 3.46Å; A426-I430 VanDerWaalsContact O-CG1 3.27Å; A426-I430 WeakPolarHBondContact O-CG1 3.48Å; A426-I430 PolarHBondContact O-N 3.49Å; A426-I430 VanDerWaalsContact O-N 3.08Å; Q427-I430 PolarHBondContact O-N 3.42Å; I430-G432 VanDerWaalsContact C-N 3.27Å; I430-G432 PolarHBondContact O-N 2.98Å
431	A	60.8	Low	53.5	Low	46 Å²	46	53.9 Å²	53.9	38%	0.38	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-13.4	178.1	0	0	0	0	0	114.4	Q427 L429 E433 W502	Q427-A431 WeakPolarHBondContact O-CB 3.41Å; Q427-A431 PolarHBondContact O-N 3.39Å; L429-A431 VanDerWaalsContact C-N 3.3Å; L429-A431 PolarHBondContact O-N 3.34Å; A431-E433 VanDerWaalsContact C-N 3.27Å; A431-E433 HydrophobicContact CB-CG 4.18Å; A431-E433 PolarHBondContact O-N 2.93Å; A431-W502 HydrophobicContact CB-CH2 3.64Å; A431-W502 HydrophobicContact CB-CZ3 3.7Å
432	G	57.6	Low	51.4	Low	57 Å²	57	59.1 Å²	59.1	59%	0.588	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	72	14.2	179.9	0	0	0	0	0	115	L428 L429 I430 I434	L428-G432 PolarHBondContact O-N 2.87Å; L429-G432 PolarHBondContact O-N 2.94Å; I430-G432 VanDerWaalsContact C-N 3.27Å; I430-G432 PolarHBondContact O-N 2.98Å; G432-I434 PolarHBondContact O-N 3.33Å
433	E	50.7	Low	49.3	Very low	75 Å²	75	65.6 Å²	65.6	35%	0.35	42%	0.421	S	S	.	.			trans	-75.7	-10.5	-179.9	-62.8	-157.5	142.5	0	0	113.7	A431 W502	A431-E433 VanDerWaalsContact C-N 3.27Å; A431-E433 HydrophobicContact CB-CG 4.18Å; A431-E433 PolarHBondContact O-N 2.93Å; E433-W502 VanDerWaalsContact CD-CZ2 3.45Å; E433-W502 HydrophobicContact CG-CZ2 4.43Å; E433-W502 WeakPolarHBondContact OE1-CZ2 3.35Å; E433-W502 WeakPolarHBondContact OE2-CZ2 3.39Å
434	I	53	Low	47.2	Very low	23 Å²	23	72.3 Å²	72.3	12%	0.118	45%	0.447	C	S	.	.	S	Bend	trans	-87.5	122.7	172.7	-60.7	170.4	0	0	0	107.9	Y425 L429 G432 S436 L495	Y425-I434 HydrophobicContact CD2-CD1 4.29Å; Y425-I434 HydrophobicContact CE2-CD1 3.93Å; L429-I434 HydrophobicContact CD2-CD1 3.75Å; L429-I434 HydrophobicContact CG-CD1 3.89Å; G432-I434 PolarHBondContact O-N 3.33Å; I434-S436 PolarHBondContact O-N 3.48Å; I434-L495 HydrophobicContact CD1-CD1 4.18Å
435	P	41.3	Very low	45.3	Very low	109 Å²	109	79.6 Å²	79.6	71%	0.708	49%	0.485	S	S	*	.			trans	-67.7	108.6	-175.8	26.9	-34.3	0	0	0	111	T437	P435-T437 PolarHBondContact O-N 3.41Å
436	S	39	Very low	43.3	Very low	85 Å²	85	83.9 Å²	83.9	59%	0.594	51%	0.511	S	S	*	.			trans	-60.5	131	165.5	56.4	0	0	0	0	108.9	I434 N438	I434-S436 PolarHBondContact O-N 3.48Å; S436-N438 PolarHBondContact O-N 2.98Å
437	T	36.3	Very low	41.3	Very low	63 Å²	63	89 Å²	89	39%	0.387	54%	0.542	S	S	.	.	S	Bend	trans	-74.1	8.5	-176.3	47.5	0	0	0	0	113.7	P435 G439 N647	P435-T437 PolarHBondContact O-N 3.41Å; T437-G439 PolarHBondContact O-N 2.69Å; T437-N647 PolarHBondContact OG1-ND2 3.45Å
438	N	30.4	Very low	39.3	Very low	149 Å²	149	96 Å²	96	80%	0.797	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	41.1	170.4	-63.7	3.8	0	0	0	111.5	S436	S436-N438 PolarHBondContact O-N 2.98Å
439	G	27.4	Very low	37.5	Very low	72 Å²	72	101.5 Å²	101.5	74%	0.742	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	-3.3	171.6	0	0	0	0	0	113.3	T437	T437-G439 PolarHBondContact O-N 2.69Å
440	C	25.7	Very low	35.7	Very low	105 Å²	105	106.8 Å²	106.8	71%	0.709	62%	0.623	S	S	*	*	S	Bend	trans	-64.3	134.6	161.4	-168.2	0	0	0	0	108.1	S442	C440-S442 PolarHBondContact O-N 3.17Å; C440-S442 VanDerWaalsContact O-N 3.12Å
441	S	26.1	Very low	34.1	Very low	90 Å²	90	110.3 Å²	110.3	63%	0.629	64%	0.642	S	S	*	*			trans	-57.1	120.9	178.7	47.8	0	0	0	0	109.8	N443	S441-N443 PolarHBondContact O-N 3.14Å
442	S	28	Very low	32.5	Very low	110 Å²	110	116.3 Å²	116.3	77%	0.769	67%	0.665	S	S	*	*			trans	-61.1	94.8	159.3	178.7	0	0	0	0	106.8	C440 K444	C440-S442 PolarHBondContact O-N 3.17Å; C440-S442 VanDerWaalsContact O-N 3.12Å; S442-K444 VanDerWaalsContact C-N 3.35Å; S442-K444 PolarHBondContact O-N 2.78Å
443	N	26.6	Very low	31.3	Very low	135 Å²	135	121.9 Å²	121.9	72%	0.722	67%	0.673	S	S	*	*			trans	-56.3	108.3	162.8	-91.2	-12.2	0	0	0	105.2	S441 I445	S441-N443 PolarHBondContact O-N 3.14Å; N443-I445 PolarHBondContact O-N 2.72Å
444	K	26.3	Very low	30.1	Very low	179 Å²	179	121.8 Å²	121.8	78%	0.778	69%	0.693	S	S	*	*			trans	-64.8	90.2	170.1	-70	-176.3	176.4	-178.8	0	107	S442 T446	S442-K444 VanDerWaalsContact C-N 3.35Å; S442-K444 PolarHBondContact O-N 2.78Å; K444-T446 HydrophobicContact CB-CG2 4.09Å; K444-T446 PolarHBondContact O-N 2.99Å
445	I	29.1	Very low	29.1	Very low	156 Å²	156	127.4 Å²	127.4	80%	0.8	73%	0.728	S	S	*	*			trans	-64.3	78.7	149	-58.1	177.5	0	0	0	104.7	N443 T447	N443-I445 PolarHBondContact O-N 2.72Å; I445-T447 VanDerWaalsContact C-N 3.3Å; I445-T447 PolarHBondContact O-N 2.87Å
446	T	25.1	Very low	28.5	Very low	89 Å²	89	129.3 Å²	129.3	55%	0.546	73%	0.732	S	S	.	*			trans	-64.2	101.9	160	50.1	0	0	0	0	105.2	K444 R448	K444-T446 HydrophobicContact CB-CG2 4.09Å; K444-T446 PolarHBondContact O-N 2.99Å; T446-R448 VanDerWaalsContact C-N 3.29Å; T446-R448 PolarHBondContact O-N 3.05Å
447	T	26.1	Very low	27.8	Very low	113 Å²	113	135.7 Å²	135.7	69%	0.693	75%	0.745	S	S	*	*			trans	-52.2	102.6	155.6	36.4	0	0	0	0	106.2	I445 D449	I445-T447 VanDerWaalsContact C-N 3.3Å; I445-T447 PolarHBondContact O-N 2.87Å; T447-D449 PolarHBondContact O-N 2.96Å
448	R	25.4	Very low	27.4	Very low	224 Å²	224	139.5 Å²	139.5	85%	0.845	76%	0.763	S	S	*	*			trans	-86.9	35	-165.5	-156.5	178.9	173.4	120.2	-2	111.3	T446 N450	T446-R448 VanDerWaalsContact C-N 3.29Å; T446-R448 PolarHBondContact O-N 3.05Å; R448-N450 VanDerWaalsContact C-N 3.27Å; R448-N450 PolarHBondContact O-N 3.37Å
449	D	24.5	Very low	27.3	Very low	133 Å²	133	137.4 Å²	137.4	71%	0.711	76%	0.755	S	S	*	*			trans	-77	78.1	179	-61.6	-47.5	0	0	0	109.7	T447	T447-D449 PolarHBondContact O-N 2.96Å
450	N	26	Very low	27.3	Very low	156 Å²	156	139.3 Å²	139.3	83%	0.834	75%	0.753	S	S	*	*			trans	-171.1	77.7	151.4	-97.1	-45.3	0	0	0	110.8	R448	R448-N450 VanDerWaalsContact C-N 3.27Å; R448-N450 PolarHBondContact O-N 3.37Å
451	L	30.9	Very low	27.4	Very low	148 Å²	148	140.8 Å²	140.8	78%	0.775	75%	0.754	S	S	*	*			trans	-139.9	51.7	153.3	-163.1	64.1	0	0	0	111.4	K453	L451-K453 HydrophobicContact CD1-CB 4.42Å; L451-K453 HydrophobicContact CD1-CD 4.32Å; L451-K453 HydrophobicContact CD1-CG 4.2Å; L451-K453 PolarHBondContact O-N 2.92Å
452	I	27.8	Very low	27.4	Very low	171 Å²	171	145.1 Å²	145.1	88%	0.877	76%	0.764	S	S	*	*			trans	-75.4	84.5	154.3	-57.1	178.7	0	0	0	106.6
453	K	32	Very low	27.3	Very low	174 Å²	174	146.8 Å²	146.8	76%	0.757	76%	0.764	S	S	*	*			trans	-102.5	121	155.9	-93.7	-169.3	169.6	-171.3	0	106.7	L451	L451-K453 HydrophobicContact CD1-CB 4.42Å; L451-K453 HydrophobicContact CD1-CD 4.32Å; L451-K453 HydrophobicContact CD1-CG 4.2Å; L451-K453 PolarHBondContact O-N 2.92Å
454	G	26.2	Very low	27.9	Very low	73 Å²	73	144.6 Å²	144.6	75%	0.753	76%	0.757	S	S	*	*			trans	-62.1	139.7	175.7	0	0	0	0	0	111.1
455	V	30.9	Very low	27.9	Very low	141 Å²	141	142.9 Å²	142.9	86%	0.855	76%	0.756	S	S	*	*			trans	-131.9	121.8	158	179.6	0	0	0	0	104.4
456	D	28.5	Very low	27.9	Very low	149 Å²	149	140.4 Å²	140.4	80%	0.797	75%	0.753	S	S	*	*			trans	-70.9	167.3	-179.9	-62.8	-74.2	0	0	0	111.6
457	Y	25	Very low	27.8	Very low	220 Å²	220	144.1 Å²	144.1	86%	0.863	77%	0.769	S	S	*	*			trans	-59.6	135.8	170.6	-65.4	-102	0	0	0	109.9
458	D	28	Very low	28	Very low	143 Å²	143	142.6 Å²	142.6	77%	0.765	78%	0.776	S	S	*	*				-169.7	161.5	100.5	-118.9	-33.4	0	0	0	116.5
459	T	28	Very low	27.9	Very low	104 Å²	104	138.1 Å²	138.1	64%	0.638	77%	0.774	S	S	*	*			trans	58.9	117.1	152.1	51.9	0	0	0	0	124.5
460	T	28	Very low	28	Very low	113 Å²	113	140.2 Å²	140.2	69%	0.693	78%	0.783	S	S	*	*			trans	81.6	125.9	131.8	55.7	0	0	0	0	123.4
461	N	26.3	Very low	28.1	Very low	136 Å²	136	140.4 Å²	140.4	73%	0.727	78%	0.779	S	S	*	*			trans	52.7	123.1	137.5	-49.5	-7	0	0	0	118.5
462	H	27.7	Very low	27.9	Very low	181 Å²	181	139.1 Å²	139.1	84%	0.838	78%	0.778	S	S	*	*			cis	-158	171.2	35.2	-110.6	-68.7	0	0	0	112.7
463	N	25	Very low	27.9	Very low	144 Å²	144	138 Å²	138	77%	0.77	77%	0.771	S	S	*	*			trans	-157.3	155.9	168.7	-151.9	28.2	0	0	0	107.1
464	P	38.9	Very low	27.6	Very low	89 Å²	89	137.4 Å²	137.4	58%	0.578	77%	0.774	S	S	*	*			cis	-127.2	-155	-15.2	28.9	-4.4	0	0	0	112.3
465	D	26.7	Very low	27.6	Very low	144 Å²	144	137.4 Å²	137.4	77%	0.77	77%	0.774	S	S	*	*			trans	100.6	129.2	147	-62.2	-23.8	0	0	0	123.7
466	S	28.5	Very low	27.5	Very low	103 Å²	103	138.5 Å²	138.5	72%	0.72	77%	0.77	S	S	*	*			trans	86.4	93.9	151	69.9	0	0	0	0	122.1
467	N	24.5	Very low	27.2	Very low	167 Å²	167	140.2 Å²	140.2	89%	0.893	77%	0.773	S	S	*	*				51.7	109.5	122.2	-57.2	-6.9	0	0	0	121.1
468	G	28.4	Very low	27.4	Very low	82 Å²	82	135.5 Å²	135.5	85%	0.845	76%	0.761	S	S	*	*			trans	-148	102.8	156.3	0	0	0	0	0	111.1
469	T	23.5	Very low	27.2	Very low	130 Å²	130	136.3 Å²	136.3	80%	0.798	77%	0.766	S	S	*	*			trans	-85.6	135.2	-176.7	46.2	0	0	0	0	112.8
470	I	28	Very low	27.3	Very low	176 Å²	176	138.7 Å²	138.7	90%	0.903	77%	0.774	S	S	*	*			trans	-129.2	128.1	152.8	-63.1	-177.3	0	0	0	107.5
471	E	26.5	Very low	27.1	Very low	160 Å²	160	139.1 Å²	139.1	75%	0.748	77%	0.768	S	S	*	*			trans	-97.1	175.7	-175.9	-57.3	175.5	112.5	0	0	111.6
472	T	28.6	Very low	27.1	Very low	121 Å²	121	138.9 Å²	138.9	74%	0.742	77%	0.773	S	S	*	*			trans	72.1	141.8	162.9	72.6	0	0	0	0	117.7
473	M	27.5	Very low	27	Very low	149 Å²	149	134.7 Å²	134.7	73%	0.734	76%	0.758	S	S	*	*			cis	-156.9	134.5	-9.9	-116.6	-175.4	-68.8	0	0	112.4
474	I	25.3	Very low	27	Very low	160 Å²	160	136.7 Å²	136.7	82%	0.821	76%	0.756	S	S	*	*			trans	61.8	131.9	138.8	-63	165.5	0	0	0	121.2
475	G	26.5	Very low	26.4	Very low	73 Å²	73	140.1 Å²	140.1	75%	0.753	76%	0.764	S	S	*	*			trans	113.2	116.8	156.2	0	0	0	0	0	114.6
476	E	27.2	Very low	26.5	Very low	165 Å²	165	141.6 Å²	141.6	77%	0.771	77%	0.766	S	S	*	*			cis	-150.2	136.9	-4.6	-176.9	178.7	179	0	0	109	I478	E476-I478 HydrophobicContact CG-CG1 4.14Å; E476-I478 PolarHBondContact O-N 3.48Å
477	Q	23.5	Very low	26.6	Very low	185 Å²	185	141 Å²	141	86%	0.864	76%	0.761	S	S	*	*			trans	-86.4	106.5	172.2	-83	-175.2	-44.8	0	0	110.2
478	I	29.4	Very low	26.9	Very low	121 Å²	121	138.2 Å²	138.2	62%	0.621	75%	0.745	S	S	*	*			trans	-105.4	106.7	167.2	-58.6	-177.8	0	0	0	109	E476 L480	E476-I478 HydrophobicContact CG-CG1 4.14Å; E476-I478 PolarHBondContact O-N 3.48Å; I478-L480 HydrophobicContact CG2-CD1 3.71Å; I478-L480 PolarHBondContact O-N 2.97Å
479	N	23.6	Very low	27.3	Very low	160 Å²	160	138.9 Å²	138.9	86%	0.856	73%	0.728	S	S	*	*			trans	-65.9	119.5	163.7	-70.8	-59.4	0	0	0	108.7
480	L	29.3	Very low	28	Very low	153 Å²	153	136.9 Å²	136.9	80%	0.801	71%	0.713	S	S	*	*			trans	-111.7	122.7	164	-120.9	73.9	0	0	0	108.7	I478	I478-L480 HydrophobicContact CG2-CD1 3.71Å; I478-L480 PolarHBondContact O-N 2.97Å
481	E	23.7	Very low	28.4	Very low	123 Å²	123	131.1 Å²	131.1	58%	0.575	68%	0.684	S	S	*	*			trans	-60.9	137.4	174.1	-80	-165.8	86.4	0	0	111.5	N483	E481-N483 HydrophobicContact CB-CB 4.16Å; E481-N483 PolarHBondContact O-N 3.04Å; E481-N483 PolarHBondContact OE1-ND2 2.79Å
482	P	27	Very low	29.5	Very low	130 Å²	130	126.5 Å²	126.5	84%	0.844	67%	0.667	S	S	*	*	S	Bend	trans	-80.8	45.4	165.4	36.4	-35.7	0	0	0	111.3
483	N	25	Very low	30.6	Very low	94 Å²	94	124.8 Å²	124.8	50%	0.503	65%	0.653	S	S	.	*			trans	-123.1	170.4	-179.4	-79.6	-44.4	0	0	0	111.9	E481 H485	E481-N483 HydrophobicContact CB-CB 4.16Å; E481-N483 PolarHBondContact O-N 3.04Å; E481-N483 PolarHBondContact OE1-ND2 2.79Å; N483-H485 PolarHBondContact O-N 3.48Å
484	Y	26	Very low	31.8	Very low	186 Å²	186	120.1 Å²	120.1	73%	0.729	63%	0.633	S	S	*	*	S	Bend	trans	66.5	-19.8	174.9	-58.3	-75.3	0	0	0	119	S487	Y484-S487 PolarHBondContact O-OG 2.75Å
485	H	26.3	Very low	33.4	Very low	161 Å²	161	113.6 Å²	113.6	75%	0.745	60%	0.599	S	S	*	*	S	Bend	trans	-83.3	-18.3	-171.8	-124.1	-57.1	0	0	0	116.6	N483	N483-H485 PolarHBondContact O-N 3.48Å
486	E	27.9	Very low	35.1	Very low	175 Å²	175	111.9 Å²	111.9	82%	0.818	58%	0.579	S	S	*	*	S	Bend	trans	-88.4	-19.7	-178.8	-65	-165.1	128.4	0	0	114.7	I488	E486-I488 VanDerWaalsContact C-N 3.31Å; E486-I488 PolarHBondContact O-N 3.13Å
487	S	30.3	Very low	36.6	Very low	89 Å²	89	104.6 Å²	104.6	62%	0.622	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-13.5	-169.8	60.4	0	0	0	0	115.1	Y484	Y484-S487 PolarHBondContact O-OG 2.75Å
488	I	32.6	Very low	38.6	Very low	109 Å²	109	97.8 Å²	97.8	56%	0.559	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-20.9	-171.6	-60.2	177.2	0	0	0	112.6	E486 N490	E486-I488 VanDerWaalsContact C-N 3.31Å; E486-I488 PolarHBondContact O-N 3.13Å; I488-N490 PolarHBondContact O-N 3.41Å
489	I	35.5	Very low	40.3	Very low	96 Å²	96	92.2 Å²	92.2	49%	0.492	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-22	-164.6	-61.7	176.4	0	0	0	113.4
490	N	37.8	Very low	41.8	Very low	88 Å²	88	90.3 Å²	90.3	47%	0.471	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	17.5	-172.7	-71	-24.4	0	0	0	115.1	I488	I488-N490 PolarHBondContact O-N 3.41Å
491	L	37.5	Very low	42.8	Very low	56 Å²	56	88.2 Å²	88.2	29%	0.293	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-81.5	136.1	-177.6	-73	168	0	0	0	112.8	W18 I493	W18-L491 HydrophobicContact CE3-CD2 4.32Å; W18-L491 HydrophobicContact CH2-CD1 3.98Å; W18-L491 HydrophobicContact CH2-CD2 3.6Å; W18-L491 HydrophobicContact CH2-CG 4.46Å; W18-L491 HydrophobicContact CZ2-CD1 4.38Å; W18-L491 HydrophobicContact CZ2-CD2 4.5Å; W18-L491 HydrophobicContact CZ3-CD2 3.49Å; W18-L491 VanDerWaalsContact CZ3-CD2 3.49Å; L491-I493 PolarHBondContact O-N 2.8Å
492	P	49.1	Very low	43.7	Very low	62 Å²	62	84.8 Å²	84.8	40%	0.403	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-71.8	125.6	-176.3	27.6	-34	0	0	0	112.6	L644 H645 N646	P492-L644 HydrophobicContact CB-CD1 4.22Å; P492-L644 HydrophobicContact CB-CD2 3.89Å; P492-L644 HydrophobicContact CB-CG 3.89Å; P492-L644 HydrophobicContact CG-CD2 4.34Å; P492-H645 CarbonylContact C-O 3.59Å; P492-H645 WeakPolarHBondContact CA-O 3.4Å; P492-N646 HydrophobicContact CB-CB 4.39Å
493	I	51.2	Low	44.4	Very low	86 Å²	86	86.1 Å²	86.1	44%	0.441	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	137	-179.1	-58.7	174.8	0	0	0	109.3	L491 L495 H645	L491-I493 PolarHBondContact O-N 2.8Å; I493-L495 HydrophobicContact CG2-CD2 4.34Å; I493-H645 PolarHBondContact N-O 3.28Å; I493-H645 PolarHBondContact O-N 3.36Å
494	T	54.2	Low	45	Very low	51 Å²	51	85.6 Å²	85.6	31%	0.313	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	112.3	171.2	-57.4	0	0	0	0	110.2	R642 L643	T494-R642 HydrophobicContact CG2-CB 4.08Å; T494-R642 HydrophobicContact CG2-CG 4.48Å; T494-L643 CarbonylContact C-O 3.52Å; T494-L643 WeakPolarHBondContact CA-O 3.49Å
495	L	58.3	Low	45.3	Very low	22 Å²	22	81.1 Å²	81.1	12%	0.115	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	141.4	174.3	-66.3	174.2	0	0	0	110.4	Y425 I434 I493 I497 R642 L643 H645	Y425-L495 HydrophobicContact CE2-CD1 3.99Å; I434-L495 HydrophobicContact CD1-CD1 4.18Å; I493-L495 HydrophobicContact CG2-CD2 4.34Å; L495-I497 HydrophobicContact CB-CD1 4.09Å; L495-I497 HydrophobicContact CB-CG1 4.1Å; L495-R642 WeakPolarHBondContact O-CA 3.24Å; L495-L643 PolarHBondContact N-O 3.31Å; L495-L643 PolarHBondContact O-N 3.12Å; L495-H645 HydrophobicContact CD1-CB 3.81Å; L495-H645 HydrophobicContact CG-CB 4.19Å
496	A	61.4	Low	45.6	Very low	38 Å²	38	81.7 Å²	81.7	31%	0.314	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	115.1	172.8	0	0	0	0	0	109.1	F641	A496-F641 WeakPolarHBondContact CA-O 3.49Å
497	I	59.3	Low	45.9	Very low	12 Å²	12	81.2 Å²	81.2	6%	0.062	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	141.9	-166.6	-55.5	-177.6	0	0	0	109.3	N424 Y425 L495 R640 F641 L643	N424-I497 HydrophobicContact CB-CG2 4.46Å; Y425-I497 HydrophobicContact CD2-CD1 3.3Å; Y425-I497 HydrophobicContact CE2-CD1 4.15Å; Y425-I497 HydrophobicContact CG-CD1 3.59Å; L495-I497 HydrophobicContact CB-CD1 4.09Å; L495-I497 HydrophobicContact CB-CG1 4.1Å; I497-R640 WeakPolarHBondContact O-CA 3.4Å; I497-F641 PolarHBondContact N-O 3.04Å; I497-F641 PolarHBondContact O-N 3.29Å; I497-L643 HydrophobicContact CB-CD1 4.24Å; I497-L643 HydrophobicContact CD1-CD1 4.38Å; I497-L643 HydrophobicContact CD1-CD2 4.45Å; I497-L643 HydrophobicContact CG1-CD1 4.45Å
498	T	65.1	Low	45.9	Very low	41 Å²	41	84.2 Å²	84.2	25%	0.252	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	151.7	-174.6	98.5	0	0	0	0	112	N424 K500 W639 R640	N424-T498 PolarHBondContact ND2-O 3.3Å; T498-K500 VanDerWaalsContact C-N 3.29Å; T498-K500 PolarHBondContact O-N 2.83Å; T498-K500 PolarHBondContact OG1-N 2.91Å; T498-W639 WeakPolarHBondContact CA-O 3.35Å; T498-R640 HydrophobicContact CG2-CG 4.29Å
499	T	64.5	Low	45.7	Very low	4 Å²	4	89.9 Å²	89.9	3%	0.025	46%	0.463	C	S	.	.	S	Bend	trans	-77.7	-4.8	176.1	60.4	0	0	0	0	114.7	K417 E420 A421 N424 H501 A638 W639 F641	K417-T499 HydrophobicContact CD-CG2 4.19Å; K417-T499 WeakPolarHBondContact O-CG2 3.49Å; E420-T499 HydrophobicContact CB-CG2 4.46Å; E420-T499 HydrophobicContact CG-CG2 4.41Å; E420-T499 WeakPolarHBondContact CG-O 3.22Å; A421-T499 HydrophobicContact CB-CG2 4.17Å; N424-T499 PolarHBondContact ND2-O 3.23Å; T499-H501 PolarHBondContact O-N 3.34Å; T499-A638 WeakPolarHBondContact OG1-CA 3.44Å; T499-W639 HydrophobicContact CG2-CB 4.05Å; T499-W639 PolarHBondContact N-O 3.43Å; T499-W639 PolarHBondContact OG1-N 2.99Å; T499-F641 HydrophobicContact CG2-CD2 3.9Å; T499-F641 HydrophobicContact CG2-CE2 3.58Å
500	K	55.7	Low	45.4	Very low	121 Å²	121	96.7 Å²	96.7	53%	0.526	48%	0.482	S	S	.	.	S	Bend	trans	-68.2	125	172.6	-74.3	-164.8	173.1	-167.2	0	109.1	N424 T498 W502 A638	N424-K500 PolarHBondContact ND2-O 3.25Å; T498-K500 VanDerWaalsContact C-N 3.29Å; T498-K500 PolarHBondContact O-N 2.83Å; T498-K500 PolarHBondContact OG1-N 2.91Å; K500-W502 PolarHBondContact O-N 2.93Å; K500-A638 HydrophobicContact CG-CB 4.14Å
501	H	49.9	Very low	45	Very low	109 Å²	109	100.5 Å²	100.5	51%	0.505	50%	0.503	S	S	.	.			trans	-53.4	138.8	171.6	-90.4	10.8	0	0	0	110.6	N424 T499	N424-H501 PolarHBondContact OD1-ND1 3.12Å; T499-H501 PolarHBondContact O-N 3.34Å
502	W	42.6	Very low	44.5	Very low	51 Å²	51	101.7 Å²	101.7	19%	0.193	53%	0.528	C	S	.	.			trans	-105.6	125.5	175.4	-179.4	85.9	0	0	0	108.6	L428 A431 E433 K500 P504	L428-W502 HydrophobicContact CD2-CD2 4.06Å; L428-W502 HydrophobicContact CD2-CE3 4.37Å; L428-W502 HydrophobicContact CD2-CG 4.3Å; A431-W502 HydrophobicContact CB-CH2 3.64Å; A431-W502 HydrophobicContact CB-CZ3 3.7Å; E433-W502 VanDerWaalsContact CD-CZ2 3.45Å; E433-W502 HydrophobicContact CG-CZ2 4.43Å; E433-W502 WeakPolarHBondContact OE1-CZ2 3.35Å; E433-W502 WeakPolarHBondContact OE2-CZ2 3.39Å; K500-W502 PolarHBondContact O-N 2.93Å; W502-P504 HydrophobicContact CE3-CB 4.4Å; W502-P504 VanDerWaalsContact CH2-CA 3.47Å; W502-P504 HydrophobicContact CH2-CB 3.59Å; W502-P504 HydrophobicContact CZ2-CB 4.4Å; W502-P504 HydrophobicContact CZ3-CB 3.58Å; W502-P504 HydrophobicContact CZ3-CG 4.23Å
503	H	42	Very low	43.7	Very low	157 Å²	157	107.4 Å²	107.4	73%	0.727	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-97.4	127.3	168.4	-71.6	-86.6	0	0	0	107.8
504	P	38.5	Very low	42.7	Very low	84 Å²	84	109.8 Å²	109.8	55%	0.545	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-60.4	136.2	173.5	23.8	-32.1	0	0	0	109.7	W502 L506	W502-P504 HydrophobicContact CE3-CB 4.4Å; W502-P504 VanDerWaalsContact CH2-CA 3.47Å; W502-P504 HydrophobicContact CH2-CB 3.59Å; W502-P504 HydrophobicContact CZ2-CB 4.4Å; W502-P504 HydrophobicContact CZ3-CB 3.58Å; W502-P504 HydrophobicContact CZ3-CG 4.23Å; P504-L506 PolarHBondContact O-N 3.48Å
505	P	32.1	Very low	41.6	Very low	92 Å²	92	113.6 Å²	113.6	60%	0.597	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-60.2	128.7	170	26.3	-32.9	0	0	0	108.4	L507	P505-L507 PolarHBondContact O-N 3.04Å
506	L	33.4	Very low	40.3	Very low	172 Å²	172	122 Å²	122	90%	0.901	62%	0.623	S	S	*	*			trans	-57.8	110	176.9	-74.9	170.7	0	0	0	108.8	P504 N508	P504-L506 PolarHBondContact O-N 3.48Å; L506-N508 PolarHBondContact O-N 3.46Å
507	L	33.1	Very low	38.9	Very low	165 Å²	165	131 Å²	131	86%	0.864	65%	0.649	S	S	*	*			trans	-79.4	52.8	-168.5	-149.4	154.1	0	0	0	111.3	P505 R509	P505-L507 PolarHBondContact O-N 3.04Å; L507-R509 PolarHBondContact O-N 3.11Å
508	N	30.1	Very low	37.3	Very low	152 Å²	152	135.1 Å²	135.1	81%	0.813	68%	0.679	S	S	*	*			trans	-80.9	61.4	-172.3	-166.8	10.8	0	0	0	111.5	L506	L506-N508 PolarHBondContact O-N 3.46Å
509	R	29	Very low	35.8	Very low	229 Å²	229	141 Å²	141	86%	0.864	71%	0.709	S	S	*	*			trans	-146.6	51.7	177	-145	179.7	-164.6	-155.3	4.1	115.9	L507	L507-R509 PolarHBondContact O-N 3.11Å
510	R	28.3	Very low	34.2	Very low	238 Å²	238	147.3 Å²	147.3	90%	0.898	75%	0.747	S	S	*	*			trans	-169.2	95.4	140.2	-107.4	162.4	-174.2	177.1	1.3	113.3
511	N	29.4	Very low	33.2	Very low	169 Å²	169	147.2 Å²	147.2	90%	0.904	76%	0.759	S	S	*	*				-152.7	128.2	124.1	-98	-25.7	0	0	0	107.8
512	G	28.4	Very low	32.2	Very low	81 Å²	81	150.3 Å²	150.3	84%	0.835	78%	0.778	S	S	*	*			trans	-96.9	108.2	-172.6	0	0	0	0	0	111.8
513	Q	30.5	Very low	31.7	Very low	181 Å²	181	153 Å²	153	85%	0.846	80%	0.802	S	S	*	*			trans	-145.3	108.8	164.9	-103.6	175.2	5.7	0	0	111.8
514	I	32.1	Very low	31	Very low	136 Å²	136	156.4 Å²	156.4	70%	0.697	81%	0.81	S	S	*	*			trans	45.8	102.5	144.2	-48.5	172.5	0	0	0	117.1	K516	I514-K516 PolarHBondContact O-N 2.87Å; I514-K516 VanDerWaalsContact O-N 3.09Å
515	P	29.6	Very low	30.7	Very low	131 Å²	131	155.4 Å²	155.4	85%	0.851	82%	0.816	S	S	*	*			trans	-75.2	99	171.6	31.3	-33.3	0	0	0	111.5	R517	P515-R517 PolarHBondContact O-N 3.18Å; P515-R517 VanDerWaalsContact O-N 3.1Å
516	K	32.3	Very low	30.6	Very low	198 Å²	198	159.6 Å²	159.6	86%	0.861	83%	0.827	S	S	*	*			trans	-77.9	94.3	166.5	-84.7	-168.9	174.3	-177.7	0	110.8	I514	I514-K516 PolarHBondContact O-N 2.87Å; I514-K516 VanDerWaalsContact O-N 3.09Å
517	R	30.3	Very low	30.2	Very low	227 Å²	227	156 Å²	156	86%	0.857	82%	0.817	S	S	*	*			trans	0.7	129.3	157.6	-152.4	178.2	-163.6	175.3	3.5	117.1	P515	P515-R517 PolarHBondContact O-N 3.18Å; P515-R517 VanDerWaalsContact O-N 3.1Å
518	S	27.6	Very low	30	Very low	99 Å²	99	155.8 Å²	155.8	69%	0.692	81%	0.811	S	S	*	*			trans	-44.6	151.2	162.4	53.8	0	0	0	0	114.7
519	N	31.8	Very low	29.9	Very low	166 Å²	166	154.3 Å²	154.3	89%	0.888	80%	0.803	S	S	*	*			trans	-143.1	127.8	149.9	-95.7	-15.7	0	0	0	110
520	T	31.8	Very low	29.9	Very low	135 Å²	135	150.9 Å²	150.9	83%	0.828	80%	0.802	S	S	*	*			trans	-85.8	153.5	167.3	41.3	0	0	0	0	110.7
521	P	34.5	Very low	30	Very low	120 Å²	120	142.6 Å²	142.6	78%	0.779	79%	0.791	S	S	*	*			trans	-90.6	141.8	-171.8	34.7	-34.7	0	0	0	114.2
522	L	28.8	Very low	30	Very low	173 Å²	173	139.8 Å²	139.8	91%	0.906	78%	0.784	S	S	*	*			trans	-146	162	158.4	-82.5	-176.6	0	0	0	110.3
523	P	32.3	Very low	30	Very low	107 Å²	107	143.5 Å²	143.5	70%	0.695	78%	0.78	S	S	*	*			trans	-112.7	-166.8	-154.2	42.9	-36.2	0	0	0	116.3
524	Y	27.8	Very low	30.1	Very low	229 Å²	229	141.9 Å²	141.9	90%	0.898	78%	0.775	S	S	*	*			trans	73.7	139.3	-176	-89.8	-103.9	0	0	0	116.2
525	G	30.8	Very low	29.9	Very low	64 Å²	64	139.7 Å²	139.7	66%	0.66	77%	0.773	S	S	*	*			cis	176.2	145.8	-10.9	0	0	0	0	0	115.5
526	Q	29.9	Very low	30.1	Very low	180 Å²	180	140.1 Å²	140.1	84%	0.841	77%	0.773	S	S	*	*			trans	58.2	132.4	156.5	-67.8	-179.5	-41.5	0	0	123.6
527	S	27	Very low	29.9	Very low	97 Å²	97	137.9 Å²	137.9	68%	0.678	77%	0.769	S	S	*	*			trans	69.6	147.2	142.6	-86.8	0	0	0	0	121.3
528	Q	28.2	Very low	30	Very low	159 Å²	159	135.6 Å²	135.6	74%	0.743	77%	0.766	S	S	*	*			cis	-166.3	171.9	-15.6	-135.2	169.6	-12.1	0	0	111.6
529	N	28.3	Very low	30.2	Very low	121 Å²	121	141.8 Å²	141.8	65%	0.647	77%	0.774	S	S	*	*			trans	74.7	151.7	157.4	-59.8	-18.5	0	0	0	119.7
530	N	28.1	Very low	30.1	Very low	158 Å²	158	140.7 Å²	140.7	85%	0.845	77%	0.768	S	S	*	*			cis	-169.7	157.9	-38.7	-107.7	-4.7	0	0	0	110.9
531	G	31.6	Very low	30.2	Very low	64 Å²	64	146.4 Å²	146.4	66%	0.66	77%	0.774	S	S	*	*			trans	116.3	116.4	166.7	0	0	0	0	0	113.6
532	S	28.3	Very low	30.1	Very low	109 Å²	109	144.4 Å²	144.4	76%	0.762	78%	0.775	S	S	*	*			cis	81.8	132.5	46.5	79.2	0	0	0	0	113
533	E	28	Very low	30.3	Very low	160 Å²	160	143.5 Å²	143.5	75%	0.748	77%	0.77	S	S	*	*			cis	-170.5	169.7	3.8	-126.5	169.7	-137	0	0	111.7
534	I	32.6	Very low	30.3	Very low	146 Å²	146	144 Å²	144	75%	0.749	77%	0.773	S	S	*	*			trans	64.2	146.4	150.4	-69.7	165.8	0	0	0	118.7
535	S	27.7	Very low	30.3	Very low	91 Å²	91	140 Å²	140	64%	0.636	77%	0.767	S	S	*	*			cis	-171	161.1	-31.7	72.8	0	0	0	0	109.3
536	T	34.1	Very low	30.4	Very low	139 Å²	139	142.8 Å²	142.8	85%	0.853	78%	0.776	S	S	*	*			trans	175.2	109.9	135.1	26.9	0	0	0	0	116.1
537	L	29.8	Very low	30.3	Very low	151 Å²	151	140 Å²	140	79%	0.791	77%	0.772	S	S	*	*			trans	23.1	134.9	141.5	-108.9	74.6	0	0	0	125.4
538	K	32.3	Very low	30.4	Very low	180 Å²	180	141.2 Å²	141.2	78%	0.783	78%	0.78	S	S	*	*				89.9	111.5	123.7	-159.8	-176.1	-138.7	169.9	0	120.4
539	R	31	Very low	30.4	Very low	229 Å²	229	140.4 Å²	140.4	86%	0.864	79%	0.786	S	S	*	*				175.5	104	100.2	-163.2	172.4	-153.6	151.8	1.6	115.8
540	N	30	Very low	30.4	Very low	143 Å²	143	143.6 Å²	143.6	77%	0.765	80%	0.797	S	S	*	*			trans	22.8	121.6	149.3	-50	10.4	0	0	0	122.5
541	R	32.9	Very low	30.5	Very low	254 Å²	254	144.4 Å²	144.4	96%	0.958	80%	0.8	S	S	*	*				177.1	135.8	102.1	-98.7	178.2	169.5	166.4	-3.2	112.6
542	G	32.4	Very low	30.3	Very low	78 Å²	78	146.9 Å²	146.9	80%	0.804	80%	0.803	S	S	*	*			trans	110.7	100.8	162.8	0	0	0	0	0	117.4
543	I	32.9	Very low	30.4	Very low	155 Å²	155	149.9 Å²	149.9	80%	0.795	81%	0.81	S	S	*	*			trans	-150.6	151.3	176.2	-73.7	-179	0	0	0	104.6	L545	I543-L545 HydrophobicContact CG2-CB 4.49Å
544	P	32.8	Very low	30.3	Very low	116 Å²	116	147 Å²	147	75%	0.753	81%	0.808	S	S	*	*			cis	-115.3	172.2	22.8	7.7	19.1	0	0	0	114.7
545	L	28.2	Very low	30.1	Very low	146 Å²	146	146 Å²	146	76%	0.764	81%	0.808	S	S	*	*			cis	78.2	97.1	18.6	-163.4	80.2	0	0	0	117.2	I543	I543-L545 HydrophobicContact CG2-CB 4.49Å
546	S	31.9	Very low	30.2	Very low	123 Å²	123	150 Å²	150	86%	0.86	82%	0.817	S	S	*	*			trans	-131.6	149.1	153	55.6	0	0	0	0	110
547	T	27.6	Very low	29.9	Very low	122 Å²	122	149 Å²	149	75%	0.748	81%	0.811	S	S	*	*			trans	-121.5	133.9	-168.2	49.9	0	0	0	0	111.9
548	S	29.9	Very low	30.1	Very low	121 Å²	121	150.6 Å²	150.6	85%	0.846	82%	0.819	S	S	*	*			trans	-161.1	142.6	140.9	51.1	0	0	0	0	111
549	T	28.2	Very low	29.9	Very low	142 Å²	142	148.5 Å²	148.5	87%	0.871	82%	0.816	S	S	*	*			trans	-104.7	128.5	165	47.9	0	0	0	0	107.9
550	E	28.7	Very low	29.6	Very low	189 Å²	189	145 Å²	145	88%	0.883	81%	0.81	S	S	*	*			trans	-142.1	140.5	163.8	-142.4	163	-138	0	0	110.2
551	L	29	Very low	29.9	Very low	174 Å²	174	145.2 Å²	145.2	91%	0.911	82%	0.816	S	S	*	*			trans	-113.9	61.8	-156.5	-166.5	85.6	0	0	0	112.4
552	T	27.6	Very low	29.7	Very low	117 Å²	117	138.3 Å²	138.3	72%	0.718	80%	0.802	S	S	*	*			trans	-143.3	112.1	171.2	39.6	0	0	0	0	111.2
553	N	31.6	Very low	29.5	Very low	171 Å²	171	142 Å²	142	91%	0.914	80%	0.804	S	S	*	*			trans	-164.2	136.1	140.2	-101.5	-39.5	0	0	0	111
554	S	26	Very low	29.3	Very low	99 Å²	99	139.3 Å²	139.3	69%	0.692	80%	0.804	S	S	*	*			trans	-91.3	166.4	171.1	55	0	0	0	0	110.3
555	V	26.8	Very low	29.1	Very low	126 Å²	126	137.1 Å²	137.1	76%	0.764	79%	0.792	S	S	*	*			trans	49.9	104.6	165.4	-174.5	0	0	0	0	116
556	H	31	Very low	29.4	Very low	176 Å²	176	134.8 Å²	134.8	82%	0.815	79%	0.788	S	S	*	*				-152.5	138.8	124.9	-122	-78.4	0	0	0	112.3
557	T	28.5	Very low	29.7	Very low	118 Å²	118	136.6 Å²	136.6	72%	0.724	78%	0.781	S	S	*	*			trans	-66.9	134.6	166	39.3	0	0	0	0	109.5	N559	T557-N559 PolarHBondContact O-N 2.9Å; T557-N559 VanDerWaalsContact O-N 3.1Å
558	L	32.9	Very low	30.2	Very low	184 Å²	184	134.4 Å²	134.4	96%	0.963	77%	0.77	S	S	*	*			trans	-65.6	111.1	178	-83.6	167.7	0	0	0	110.4
559	N	27.5	Very low	30.6	Very low	135 Å²	135	131.9 Å²	131.9	72%	0.722	75%	0.749	S	S	*	*			trans	-128.1	156	170.5	-146.5	14.3	0	0	0	108	T557	T557-N559 PolarHBondContact O-N 2.9Å; T557-N559 VanDerWaalsContact O-N 3.1Å
560	E	26.5	Very low	31.2	Very low	156 Å²	156	131.7 Å²	131.7	73%	0.729	74%	0.739	S	S	*	*			trans	64.5	71.9	169	-53.2	-168.5	174.2	0	0	118	T562	E560-T562 PolarHBondContact O-N 2.83Å
561	T	36.2	Very low	32.2	Very low	147 Å²	147	125.9 Å²	125.9	90%	0.902	72%	0.716	S	S	*	*			trans	-77.5	108.7	137.9	37.9	0	0	0	0	109.5
562	T	27.3	Very low	33.1	Very low	109 Å²	109	127.1 Å²	127.1	67%	0.669	71%	0.709	S	S	*	*	S	Bend	trans	-37	162.1	177.3	44.1	0	0	0	0	118.4	E560	E560-T562 PolarHBondContact O-N 2.83Å
563	N	28.2	Very low	34.1	Very low	156 Å²	156	130.4 Å²	130.4	83%	0.834	71%	0.708	S	S	*	*	S	Bend	trans	93.5	23.8	162.5	-51.7	-25.5	0	0	0	119.9
564	A	28.8	Very low	35.8	Very low	98 Å²	98	125 Å²	125	81%	0.81	68%	0.684	S	S	*	*	S	Bend	trans	-142.8	2.6	166.5	0	0	0	0	0	116.1
565	S	28.3	Very low	37.7	Very low	71 Å²	71	124.2 Å²	124.2	50%	0.497	67%	0.666	S	S	.	*			trans	-94.6	-1.6	-158.5	48.6	0	0	0	0	117.3	K567	S565-K567 PolarHBondContact O-N 2.87Å
566	S	35.4	Very low	39.9	Very low	97 Å²	97	122.4 Å²	122.4	68%	0.678	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	-21.3	-167.7	57.7	0	0	0	0	116.4
567	K	38.8	Very low	42.2	Very low	161 Å²	161	115.1 Å²	115.1	70%	0.7	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	-22.6	-175.3	-70.5	-176.9	177.2	177.8	0	115.2	S565	S565-K567 PolarHBondContact O-N 2.87Å
568	S	37.7	Very low	44.6	Very low	76 Å²	76	110.8 Å²	110.8	53%	0.531	60%	0.596	S	S	.	*	H	α-helix	trans	-76.3	-41.3	-178.3	55.3	0	0	0	0	112.4	Q570 T571	S568-Q570 VanDerWaalsContact C-N 3.35Å; S568-Q570 PolarHBondContact O-N 2.88Å; S568-T571 PolarHBondContact O-N 2.89Å; S568-T571 PolarHBondContact O-OG1 2.74Å
569	T	38.2	Very low	47	Very low	67 Å²	67	104.6 Å²	104.6	41%	0.411	56%	0.563	S	S	.	*	H	α-helix	trans	-56.1	-44	179.8	52	0	0	0	0	112.6	T571 R572 W573	T569-T571 PolarHBondContact O-N 3.16Å; T569-R572 WeakPolarHBondContact O-CA 3.19Å; T569-R572 WeakPolarHBondContact O-CB 3.27Å; T569-R572 PolarHBondContact O-N 2.96Å; T569-W573 VanDerWaalsContact O-CD1 3.23Å; T569-W573 PolarHBondContact O-N 2.85Å; T569-W573 VanDerWaalsContact O-N 3.07Å
570	Q	41.1	Very low	49.8	Very low	139 Å²	139	102.2 Å²	102.2	65%	0.65	55%	0.55	S	S	*	.	H	α-helix	trans	-57.3	-34.6	-178	-159.2	172.3	14.7	0	0	112.6	S568 R572 S574	S568-Q570 VanDerWaalsContact C-N 3.35Å; S568-Q570 PolarHBondContact O-N 2.88Å; Q570-R572 VanDerWaalsContact C-N 3.32Å; Q570-R572 PolarHBondContact O-N 2.75Å; Q570-S574 WeakPolarHBondContact O-CB 3.42Å; Q570-S574 PolarHBondContact O-N 3.17Å
571	T	49.3	Very low	52.7	Low	67 Å²	67	98.5 Å²	98.5	41%	0.411	53%	0.534	S	S	.	.	H	α-helix	trans	-72.5	-22.8	175.9	78.1	0	0	0	0	113.6	S568 T569 R575	S568-T571 PolarHBondContact O-N 2.89Å; S568-T571 PolarHBondContact O-OG1 2.74Å; T569-T571 PolarHBondContact O-N 3.16Å; T571-R575 PolarHBondContact O-NE 3.37Å; T571-R575 PolarHBondContact OG1-NH2 3.06Å; T571-R575 VanDerWaalsContact OG1-NH2 3.16Å
572	R	47.4	Very low	55.2	Low	199 Å²	199	92 Å²	92	75%	0.751	50%	0.495	S	S	*	.	H	α-helix	trans	-83.7	-43.5	178.5	-153.3	177.8	-169.6	-173.8	3.1	110	T569 Q570 R575 I576	T569-R572 WeakPolarHBondContact O-CA 3.19Å; T569-R572 WeakPolarHBondContact O-CB 3.27Å; T569-R572 PolarHBondContact O-N 2.96Å; Q570-R572 VanDerWaalsContact C-N 3.32Å; Q570-R572 PolarHBondContact O-N 2.75Å; R572-R575 PolarHBondContact O-N 3.16Å; R572-I576 PolarHBondContact O-N 3.39Å
573	W	49.5	Very low	58.1	Low	186 Å²	186	89.5 Å²	89.5	71%	0.705	48%	0.48	S	S	*	.	H	α-helix	trans	-60.9	-41	172.1	-70.6	111.8	0	0	0	112.7	T569 R575 I576 G577	T569-W573 VanDerWaalsContact O-CD1 3.23Å; T569-W573 PolarHBondContact O-N 2.85Å; T569-W573 VanDerWaalsContact O-N 3.07Å; W573-R575 VanDerWaalsContact C-N 3.33Å; W573-R575 PolarHBondContact O-N 2.9Å; W573-I576 HydrophobicContact CE3-CG2 3.99Å; W573-I576 HydrophobicContact CZ3-CG2 4.49Å; W573-I576 PolarHBondContact O-N 2.99Å; W573-G577 PolarHBondContact O-N 3.23Å
574	S	65.5	Low	61.2	Low	57 Å²	57	86.7 Å²	86.7	40%	0.399	46%	0.464	S	S	.	.	H	α-helix	trans	-58.7	-41.9	174.9	173.5	0	0	0	0	112.9	Q570 G577 L578	Q570-S574 WeakPolarHBondContact O-CB 3.42Å; Q570-S574 PolarHBondContact O-N 3.17Å; S574-G577 PolarHBondContact O-N 3.49Å; S574-L578 PolarHBondContact O-N 2.95Å; S574-L578 VanDerWaalsContact O-N 3.12Å
575	R	66.8	Low	64.2	Low	84 Å²	84	82.4 Å²	82.4	32%	0.317	43%	0.428	S	S	.	.	H	α-helix	trans	-68.8	-39.9	177.3	-76.7	177.4	-85.9	-171.7	-3.6	112.5	E420 T571 R572 W573 N579	E420-R575 IonicContact OE1-CZ 2.63Å; E420-R575 IonicContact OE1-NH1 2.91Å; E420-R575 PolarHBondContact OE1-NH1 2.91Å; E420-R575 IonicContact OE1-NH2 3.12Å; E420-R575 IonicContact OE2-NH1 3.77Å; T571-R575 PolarHBondContact O-NE 3.37Å; T571-R575 PolarHBondContact OG1-NH2 3.06Å; T571-R575 VanDerWaalsContact OG1-NH2 3.16Å; R572-R575 PolarHBondContact O-N 3.16Å; W573-R575 VanDerWaalsContact C-N 3.33Å; W573-R575 PolarHBondContact O-N 2.9Å; R575-N579 PolarHBondContact O-N 2.97Å
576	I	73.6	Confident	67.3	Low	87 Å²	87	80.5 Å²	80.5	45%	0.446	41%	0.411	S	S	.	.	H	α-helix	trans	-65.9	-40.2	175	-128.3	70.2	0	0	0	111.1	R572 W573 N579 I580	R572-I576 PolarHBondContact O-N 3.39Å; W573-I576 HydrophobicContact CE3-CG2 3.99Å; W573-I576 HydrophobicContact CZ3-CG2 4.49Å; W573-I576 PolarHBondContact O-N 2.99Å; I576-N579 PolarHBondContact O-N 3.43Å; I576-I580 HydrophobicContact CG2-CD1 4.03Å; I576-I580 VanDerWaalsContact O-CG1 3.28Å; I576-I580 WeakPolarHBondContact O-CG1 3.39Å; I576-I580 PolarHBondContact O-N 3.31Å
577	G	78	Confident	70	Confident	24 Å²	24	80.9 Å²	80.9	25%	0.247	40%	0.404	C	S	.	.	H	α-helix	trans	-62.6	-44.3	178.4	0	0	0	0	0	113.5	W573 S574 N579 I580 I581	W573-G577 PolarHBondContact O-N 3.23Å; S574-G577 PolarHBondContact O-N 3.49Å; G577-N579 VanDerWaalsContact C-N 3.34Å; G577-N579 PolarHBondContact O-N 3Å; G577-I580 PolarHBondContact O-N 3.45Å; G577-I581 VanDerWaalsContact O-CG1 3.27Å; G577-I581 WeakPolarHBondContact O-CG1 3.45Å; G577-I581 PolarHBondContact O-N 3.15Å
578	L	80.2	Confident	72.7	Confident	27 Å²	27	79.2 Å²	79.2	14%	0.141	39%	0.394	C	S	.	.	H	α-helix	trans	-61.2	-41.6	175.7	-73.7	173.9	0	0	0	112.2	A412 T416 S574 I581 A582	A412-L578 HydrophobicContact CB-CD1 4.25Å; A412-L578 HydrophobicContact CB-CD2 3.74Å; T416-L578 HydrophobicContact CG2-CD1 4.16Å; S574-L578 PolarHBondContact O-N 2.95Å; S574-L578 VanDerWaalsContact O-N 3.12Å; L578-I581 PolarHBondContact O-N 3.32Å; L578-A582 WeakPolarHBondContact O-CB 3.11Å; L578-A582 PolarHBondContact O-N 3.44Å
579	N	81.9	Confident	75.3	Confident	53 Å²	53	75.8 Å²	75.8	28%	0.283	37%	0.37	S	S	.	.	H	α-helix	trans	-66.6	-40.5	176	-76.4	11.7	0	0	0	111.9	R575 I576 G577 A582 T583	R575-N579 PolarHBondContact O-N 2.97Å; I576-N579 PolarHBondContact O-N 3.43Å; G577-N579 VanDerWaalsContact C-N 3.34Å; G577-N579 PolarHBondContact O-N 3Å; N579-A582 PolarHBondContact O-N 2.96Å; N579-T583 PolarHBondContact O-N 3.36Å; N579-T583 PolarHBondContact O-OG1 3.35Å
580	I	87	Confident	78	Confident	85 Å²	85	75.4 Å²	75.4	44%	0.436	37%	0.365	S	S	.	.	H	α-helix	trans	-61.4	-47.6	175.7	-71.6	166.1	0	0	0	110.7	I576 G577 A582 T583 I584	I576-I580 HydrophobicContact CG2-CD1 4.03Å; I576-I580 VanDerWaalsContact O-CG1 3.28Å; I576-I580 WeakPolarHBondContact O-CG1 3.39Å; I576-I580 PolarHBondContact O-N 3.31Å; G577-I580 PolarHBondContact O-N 3.45Å; I580-A582 VanDerWaalsContact C-N 3.31Å; I580-A582 PolarHBondContact O-N 2.79Å; I580-T583 WeakPolarHBondContact CA-OG1 3.25Å; I580-T583 PolarHBondContact O-N 2.9Å; I580-T583 VanDerWaalsContact O-N 3.15Å; I580-T583 PolarHBondContact O-OG1 3.01Å; I580-I584 HydrophobicContact CG2-CD1 3.68Å; I580-I584 HydrophobicContact CG2-CG1 4.39Å; I580-I584 WeakPolarHBondContact O-CG1 3.5Å; I580-I584 PolarHBondContact O-N 2.93Å
581	I	88.2	Confident	80.5	Confident	78 Å²	78	72.4 Å²	72.4	40%	0.4	36%	0.356	S	S	.	.	H	α-helix	trans	-58.4	-42.9	176.1	-68.6	162.8	0	0	0	111	I405 A409 G577 L578 I584 T585	I405-I581 HydrophobicContact CG2-CG2 3.89Å; A409-I581 HydrophobicContact CB-CG2 4.45Å; G577-I581 VanDerWaalsContact O-CG1 3.27Å; G577-I581 WeakPolarHBondContact O-CG1 3.45Å; G577-I581 PolarHBondContact O-N 3.15Å; L578-I581 PolarHBondContact O-N 3.32Å; I581-I584 PolarHBondContact O-N 3.31Å; I581-T585 PolarHBondContact O-N 3.24Å; I581-T585 PolarHBondContact O-OG1 2.91Å; I581-T585 VanDerWaalsContact O-OG1 3.05Å
582	A	87.2	Confident	82.5	Confident	10 Å²	10	69.7 Å²	69.7	8%	0.083	34%	0.34	C	S	.	.	H	α-helix	trans	-62.7	-43.3	175.5	0	0	0	0	0	112.1	A409 L578 N579 I580 I584 T585 F586 W626	A409-A582 HydrophobicContact CB-CB 4.38Å; L578-A582 WeakPolarHBondContact O-CB 3.11Å; L578-A582 PolarHBondContact O-N 3.44Å; N579-A582 PolarHBondContact O-N 2.96Å; I580-A582 VanDerWaalsContact C-N 3.31Å; I580-A582 PolarHBondContact O-N 2.79Å; A582-I584 PolarHBondContact O-N 3.02Å; A582-T585 WeakPolarHBondContact CA-OG1 3.47Å; A582-T585 PolarHBondContact O-N 3.21Å; A582-T585 PolarHBondContact O-OG1 3.4Å; A582-F586 WeakPolarHBondContact O-CB 3.41Å; A582-F586 PolarHBondContact O-N 2.85Å; A582-W626 HydrophobicContact CB-CZ2 4.2Å; A582-W626 WeakPolarHBondContact O-CZ2 3.16Å
583	T	89.5	Confident	84.6	Confident	57 Å²	57	60.8 Å²	60.8	35%	0.35	31%	0.306	S	S	.	.	H	α-helix	trans	-67.7	-33.4	176.5	51.3	0	0	0	0	113.4	N579 I580 L587 W626 W630	N579-T583 PolarHBondContact O-N 3.36Å; N579-T583 PolarHBondContact O-OG1 3.35Å; I580-T583 WeakPolarHBondContact CA-OG1 3.25Å; I580-T583 PolarHBondContact O-N 2.9Å; I580-T583 VanDerWaalsContact O-N 3.15Å; I580-T583 PolarHBondContact O-OG1 3.01Å; T583-L587 WeakPolarHBondContact O-CB 3.25Å; T583-L587 PolarHBondContact O-N 3.42Å; T583-W626 HydrophobicContact CG2-CH2 4.38Å; T583-W630 HydrophobicContact CG2-CZ2 4.4Å
584	I	92.9	Very high	86.6	Confident	98 Å²	98	57.3 Å²	57.3	50%	0.503	30%	0.3	S	S	.	.	H	α-helix	trans	-69.2	-42.6	175.6	-69.4	167.7	0	0	0	110.4	I580 I581 A582 L587 W588	I580-I584 HydrophobicContact CG2-CD1 3.68Å; I580-I584 HydrophobicContact CG2-CG1 4.39Å; I580-I584 WeakPolarHBondContact O-CG1 3.5Å; I580-I584 PolarHBondContact O-N 2.93Å; I581-I584 PolarHBondContact O-N 3.31Å; A582-I584 PolarHBondContact O-N 3.02Å; I584-L587 PolarHBondContact O-N 2.85Å; I584-W588 WeakPolarHBondContact O-CB 2.95Å; I584-W588 PolarHBondContact O-N 3.49Å
585	T	92	Very high	87.8	Confident	7 Å²	7	57.1 Å²	57.1	4%	0.043	30%	0.298	C	S	.	.	H	α-helix	trans	-65.4	-38.8	175.6	47.9	0	0	0	0	112.2	A402 I405 I581 A582 W588 T589	A402-T585 HydrophobicContact CB-CG2 4.47Å; A402-T585 WeakPolarHBondContact O-CB 3.38Å; I405-T585 HydrophobicContact CB-CG2 3.7Å; I405-T585 HydrophobicContact CG2-CG2 3.54Å; I581-T585 PolarHBondContact O-N 3.24Å; I581-T585 PolarHBondContact O-OG1 2.91Å; I581-T585 VanDerWaalsContact O-OG1 3.05Å; A582-T585 WeakPolarHBondContact CA-OG1 3.47Å; A582-T585 PolarHBondContact O-N 3.21Å; A582-T585 PolarHBondContact O-OG1 3.4Å; T585-W588 WeakPolarHBondContact O-CB 3.48Å; T585-W588 PolarHBondContact O-N 3.38Å; T585-T589 WeakPolarHBondContact O-CG2 3.47Å; T585-T589 PolarHBondContact O-N 3.14Å; T585-T589 PolarHBondContact O-OG1 3.2Å
586	F	92.2	Very high	88.9	Confident	31 Å²	31	53.1 Å²	53.1	14%	0.136	28%	0.283	C	S	.	.	H	α-helix	trans	-63	-43.8	172.3	179.5	-101.1	0	0	0	112.8	A582 W588 T589 L590 M623 W626 L627	A582-F586 WeakPolarHBondContact O-CB 3.41Å; A582-F586 PolarHBondContact O-N 2.85Å; F586-W588 VanDerWaalsContact C-N 3.33Å; F586-W588 PolarHBondContact O-N 2.88Å; F586-T589 WeakPolarHBondContact CA-OG1 3.47Å; F586-T589 PolarHBondContact O-N 3.43Å; F586-T589 PolarHBondContact O-OG1 3.29Å; F586-L590 HydrophobicContact CE1-CD2 4.27Å; F586-L590 WeakPolarHBondContact O-CB 3.23Å; F586-L590 PolarHBondContact O-N 3.25Å; F586-M623 HydrophobicContact CD2-CE 3.7Å; F586-M623 HydrophobicContact CD2-SD 4.16Å; F586-M623 HydrophobicContact CE1-CE 4.32Å; F586-M623 HydrophobicContact CE2-CB 4.31Å; F586-M623 HydrophobicContact CE2-CE 3.24Å; F586-M623 HydrophobicContact CE2-SD 3.74Å; F586-M623 HydrophobicContact CG-CE 4.43Å; F586-M623 HydrophobicContact CZ-CE 3.6Å; F586-W626 HydrophobicContact CB-CD2 4.14Å; F586-W626 HydrophobicContact CB-CE3 4.28Å; F586-W626 HydrophobicContact CB-CH2 3.75Å; F586-W626 HydrophobicContact CB-CZ2 3.56Å; F586-W626 HydrophobicContact CB-CZ3 4.1Å; F586-W626 HydrophobicContact CD1-CE3 4.28Å; F586-W626 HydrophobicContact CD1-CZ3 4.11Å; F586-W626 HydrophobicContact CD2-CB 4.17Å; F586-W626 AromaticContact CD2-CD2 3.22Å; F586-W626 HydrophobicContact CD2-CD2 3.22Å; F586-W626 AromaticContact CD2-CE2 3.71Å; F586-W626 AromaticContact CD2-CE3 3.33Å; F586-W626 HydrophobicContact CD2-CE3 3.33Å; F586-W626 AromaticContact CD2-CG 3.55Å; F586-W626 HydrophobicContact CD2-CG 3.55Å; F586-W626 HydrophobicContact CD2-CH2 4.37Å; F586-W626 HydrophobicContact CD2-CZ2 4.28Å; F586-W626 AromaticContact CD2-CZ3 3.92Å; F586-W626 HydrophobicContact CD2-CZ3 3.92Å; F586-W626 HydrophobicContact CE1-CE3 4.47Å; F586-W626 HydrophobicContact CE2-CB 4.03Å; F586-W626 AromaticContact CE2-CD2 3.73Å; F586-W626 HydrophobicContact CE2-CD2 3.73Å; F586-W626 AromaticContact CE2-CE3 3.55Å; F586-W626 HydrophobicContact CE2-CE3 3.55Å; F586-W626 AromaticContact CE2-CG 3.9Å; F586-W626 HydrophobicContact CE2-CG 3.9Å; F586-W626 HydrophobicContact CE2-CZ3 4.32Å; F586-W626 AromaticContact CG-CD2 3.84Å; F586-W626 HydrophobicContact CG-CD2 3.84Å; F586-W626 AromaticContact CG-CE2 3.98Å; F586-W626 AromaticContact CG-CE3 3.71Å; F586-W626 HydrophobicContact CG-CE3 3.71Å; F586-W626 AromaticContact CG-CH2 3.98Å; F586-W626 HydrophobicContact CG-CH2 3.98Å; F586-W626 HydrophobicContact CG-CZ2 4.08Å; F586-W626 AromaticContact CG-CZ3 3.78Å; F586-W626 HydrophobicContact CG-CZ3 3.78Å; F586-W626 HydrophobicContact CZ-CE3 4.13Å; F586-L627 HydrophobicContact CE1-CD2 4.35Å; F586-L627 HydrophobicContact CE2-CG 4.43Å; F586-L627 HydrophobicContact CZ-CD1 4.32Å; F586-L627 HydrophobicContact CZ-CD2 4.06Å; F586-L627 HydrophobicContact CZ-CG 4.05Å
587	L	94.1	Very high	89.5	Confident	105 Å²	105	51.3 Å²	51.3	55%	0.55	27%	0.273	S	S	.	.	H	α-helix	trans	-66.2	-36.4	178.1	-175.1	60.7	0	0	0	111.8	T583 I584 L590 T591	T583-L587 WeakPolarHBondContact O-CB 3.25Å; T583-L587 PolarHBondContact O-N 3.42Å; I584-L587 PolarHBondContact O-N 2.85Å; L587-L590 HydrophobicContact CD1-CD2 4.47Å; L587-T591 WeakPolarHBondContact O-CB 3.09Å; L587-T591 PolarHBondContact O-N 3.47Å; L587-T591 PolarHBondContact O-OG1 2.56Å
588	W	95	Very high	89.9	Confident	126 Å²	126	51.9 Å²	51.9	48%	0.477	28%	0.279	S	S	.	.	H	α-helix	trans	-60.2	-53.8	170.9	-177.5	-45.7	0	0	0	110.7	A398 A402 I584 T585 F586 L590 T591 T592	A398-W588 PolarHBondContact O-NE1 2.95Å; A402-W588 HydrophobicContact CB-CB 4.15Å; A402-W588 HydrophobicContact CB-CD2 4.1Å; A402-W588 HydrophobicContact CB-CG 3.76Å; I584-W588 WeakPolarHBondContact O-CB 2.95Å; I584-W588 PolarHBondContact O-N 3.49Å; T585-W588 WeakPolarHBondContact O-CB 3.48Å; T585-W588 PolarHBondContact O-N 3.38Å; F586-W588 VanDerWaalsContact C-N 3.33Å; F586-W588 PolarHBondContact O-N 2.88Å; W588-L590 PolarHBondContact O-N 2.93Å; W588-T591 PolarHBondContact O-N 2.62Å; W588-T592 PolarHBondContact O-N 3.01Å; W588-T592 PolarHBondContact O-OG1 3.01Å
589	T	92.8	Very high	90.2	Very high	4 Å²	4	51.4 Å²	51.4	3%	0.025	28%	0.278	C	S	.	.	H	α-helix	trans	-61.5	-45.7	-179.7	55.4	0	0	0	0	110.8	A402 M403 T585 F586 T591 T592 R593	A402-T589 HydrophobicContact CB-CG2 3.76Å; M403-T589 HydrophobicContact CG-CG2 4.12Å; M403-T589 HydrophobicContact SD-CG2 3.64Å; T585-T589 WeakPolarHBondContact O-CG2 3.47Å; T585-T589 PolarHBondContact O-N 3.14Å; T585-T589 PolarHBondContact O-OG1 3.2Å; F586-T589 WeakPolarHBondContact CA-OG1 3.47Å; F586-T589 PolarHBondContact O-N 3.43Å; F586-T589 PolarHBondContact O-OG1 3.29Å; T589-T591 VanDerWaalsContact C-N 3.34Å; T589-T591 PolarHBondContact O-N 2.78Å; T589-T592 PolarHBondContact O-N 3.3Å; T589-T592 PolarHBondContact O-OG1 3.28Å; T589-R593 WeakPolarHBondContact O-CB 3.42Å; T589-R593 VanDerWaalsContact O-CG 3.24Å; T589-R593 WeakPolarHBondContact O-CG 3.39Å; T589-R593 PolarHBondContact O-N 2.89Å
590	L	93.3	Very high	90.4	Very high	60 Å²	60	49 Å²	49	31%	0.314	27%	0.265	S	S	.	.	H	α-helix	trans	-54.3	-47.2	174.6	-177	60.5	0	0	0	112.3	F586 L587 W588 R593 I594 M623	F586-L590 HydrophobicContact CE1-CD2 4.27Å; F586-L590 WeakPolarHBondContact O-CB 3.23Å; F586-L590 PolarHBondContact O-N 3.25Å; L587-L590 HydrophobicContact CD1-CD2 4.47Å; W588-L590 PolarHBondContact O-N 2.93Å; L590-R593 PolarHBondContact O-N 3.09Å; L590-I594 HydrophobicContact CD1-CD1 3.88Å; L590-I594 HydrophobicContact CD1-CG1 4.21Å; L590-I594 HydrophobicContact CG-CD1 3.81Å; L590-I594 VanDerWaalsContact O-CG1 3.29Å; L590-I594 WeakPolarHBondContact O-CG1 3.46Å; L590-I594 PolarHBondContact O-N 3.04Å; L590-M623 HydrophobicContact CB-CE 3.53Å; L590-M623 HydrophobicContact CD1-CE 3.75Å; L590-M623 HydrophobicContact CG-CE 4.19Å
591	T	93.1	Very high	90.4	Very high	76 Å²	76	48.5 Å²	48.5	47%	0.466	26%	0.263	S	S	.	.	H	α-helix	trans	-62.9	-50.6	179.3	-55	0	0	0	0	111.1	L587 W588 T589 R593 I594 C595	L587-T591 WeakPolarHBondContact O-CB 3.09Å; L587-T591 PolarHBondContact O-N 3.47Å; L587-T591 PolarHBondContact O-OG1 2.56Å; W588-T591 PolarHBondContact O-N 2.62Å; T589-T591 VanDerWaalsContact C-N 3.34Å; T589-T591 PolarHBondContact O-N 2.78Å; T591-R593 VanDerWaalsContact C-N 3.25Å; T591-R593 PolarHBondContact O-N 3Å; T591-I594 PolarHBondContact O-N 2.86Å; T591-C595 PolarHBondContact O-N 2.74Å; T591-C595 VanDerWaalsContact O-N 3.17Å; T591-C595 PolarHBondContact O-SG 3.37Å; T591-C595 VanDerWaalsContact O-SG 3.38Å
592	T	92	Very high	90.1	Very high	10 Å²	10	47.4 Å²	47.4	6%	0.061	26%	0.255	C	S	.	.	H	α-helix	trans	-58.1	-38.3	177.3	56.7	0	0	0	0	112.2	L395 W588 T589 L596	L395-T592 HydrophobicContact CD2-CG2 4.24Å; W588-T592 PolarHBondContact O-N 3.01Å; W588-T592 PolarHBondContact O-OG1 3.01Å; T589-T592 PolarHBondContact O-N 3.3Å; T589-T592 PolarHBondContact O-OG1 3.28Å; T592-L596 WeakPolarHBondContact O-CG 3.39Å; T592-L596 PolarHBondContact O-N 2.97Å; T592-L596 VanDerWaalsContact O-N 3.14Å
593	R	92.1	Very high	89.8	Confident	12 Å²	12	47.2 Å²	47.2	5%	0.045	25%	0.253	C	S	.	.	H	α-helix	trans	-77.2	-35.6	-178.8	-62.3	-62.1	165.8	171.4	-0.7	113.5	Y350 D354 N396 S399 T589 L590 T591 C595 L596 M597 T619	Y350-R593 WeakPolarHBondContact OH-CD 3.43Å; Y350-R593 VanDerWaalsContact OH-CZ 3.27Å; Y350-R593 PolarHBondContact OH-NE 3.22Å; D354-R593 VanDerWaalsContact CG-NH2 3.3Å; D354-R593 IonicContact OD1-CZ 2.74Å; D354-R593 IonicContact OD1-NH1 3.64Å; D354-R593 PolarHBondContact OD1-NH1 3.49Å; D354-R593 IonicContact OD1-NH2 3.74Å; D354-R593 PolarHBondContact OD1-NH2 3.02Å; D354-R593 IonicContact OD2-CZ 2.67Å; D354-R593 IonicContact OD2-NH1 2.62Å; D354-R593 PolarHBondContact OD2-NH1 3.21Å; D354-R593 IonicContact OD2-NH2 2.72Å; D354-R593 PolarHBondContact OD2-NH2 2.87Å; N396-R593 PolarHBondContact OD1-NH2 3.42Å; S399-R593 PolarHBondContact OG-NH2 3.43Å; T589-R593 WeakPolarHBondContact O-CB 3.42Å; T589-R593 VanDerWaalsContact O-CG 3.24Å; T589-R593 WeakPolarHBondContact O-CG 3.39Å; T589-R593 PolarHBondContact O-N 2.89Å; L590-R593 PolarHBondContact O-N 3.09Å; T591-R593 VanDerWaalsContact C-N 3.25Å; T591-R593 PolarHBondContact O-N 3Å; R593-C595 VanDerWaalsContact C-N 3.3Å; R593-C595 PolarHBondContact O-N 2.92Å; R593-L596 PolarHBondContact O-N 2.86Å; R593-M597 VanDerWaalsContact O-CB 3.26Å; R593-M597 WeakPolarHBondContact O-CB 3.47Å; R593-M597 PolarHBondContact O-N 3.44Å; R593-T619 HydrophobicContact CB-CG2 4.11Å; R593-T619 HydrophobicContact CG-CG2 4.26Å
594	I	90.9	Very high	89.6	Confident	112 Å²	112	48.1 Å²	48.1	57%	0.574	25%	0.251	S	S	*	.	H	α-helix	trans	-58.6	-43.7	170.3	-71.9	166.5	0	0	0	110.6	L590 T591 L596	L590-I594 HydrophobicContact CD1-CD1 3.88Å; L590-I594 HydrophobicContact CD1-CG1 4.21Å; L590-I594 HydrophobicContact CG-CD1 3.81Å; L590-I594 VanDerWaalsContact O-CG1 3.29Å; L590-I594 WeakPolarHBondContact O-CG1 3.46Å; L590-I594 PolarHBondContact O-N 3.04Å; T591-I594 PolarHBondContact O-N 2.86Å; I594-L596 PolarHBondContact O-N 2.87Å
595	C	90.1	Very high	89.1	Confident	53 Å²	53	53 Å²	53	36%	0.358	26%	0.263	S	S	.	.	H	α-helix	trans	-62.3	-41.2	176.3	-66	0	0	0	0	112.9	I387 L395 T591 R593	I387-C595 HydrophobicContact CD1-CB 3.87Å; I387-C595 VanDerWaalsContact CD1-O 3.3Å; I387-C595 WeakPolarHBondContact CD1-O 3.48Å; L395-C595 HydrophobicContact CD1-CB 3.94Å; T591-C595 PolarHBondContact O-N 2.74Å; T591-C595 VanDerWaalsContact O-N 3.17Å; T591-C595 PolarHBondContact O-SG 3.37Å; T591-C595 VanDerWaalsContact O-SG 3.38Å; R593-C595 VanDerWaalsContact C-N 3.3Å; R593-C595 PolarHBondContact O-N 2.92Å
596	L	89.9	Confident	88.5	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-75.1	-37.3	179.7	-69.9	170.5	0	0	0	113.2	I358 C392 L395 N396 T592 R593 I594 G598 S599 I600	I358-L596 HydrophobicContact CD1-CD1 4.48Å; I358-L596 HydrophobicContact CD1-CD2 4.12Å; C392-L596 HydrophobicContact CB-CD2 3.91Å; L395-L596 HydrophobicContact CB-CD1 4.25Å; L395-L596 HydrophobicContact CB-CD2 4.08Å; L395-L596 HydrophobicContact CB-CG 4.17Å; L395-L596 HydrophobicContact CD1-CD2 4.37Å; N396-L596 HydrophobicContact CB-CD1 4.42Å; T592-L596 WeakPolarHBondContact O-CG 3.39Å; T592-L596 PolarHBondContact O-N 2.97Å; T592-L596 VanDerWaalsContact O-N 3.14Å; R593-L596 PolarHBondContact O-N 2.86Å; I594-L596 PolarHBondContact O-N 2.87Å; L596-G598 VanDerWaalsContact C-N 3.31Å; L596-G598 PolarHBondContact O-N 3.26Å; L596-S599 WeakPolarHBondContact O-CA 3.28Å; L596-S599 WeakPolarHBondContact O-CB 3.47Å; L596-S599 PolarHBondContact O-N 2.96Å; L596-I600 HydrophobicContact CB-CD1 3.91Å; L596-I600 WeakPolarHBondContact O-CG1 3.49Å; L596-I600 PolarHBondContact O-N 3.35Å
597	M	88	Confident	87.7	Confident	49 Å²	49	56.6 Å²	56.6	24%	0.241	28%	0.28	C	S	.	.	H	α-helix	trans	-55	-42.1	-172.3	-165.3	75	152.7	0	0	112.9	R593 S599 I600 L601 T616 L620	R593-M597 VanDerWaalsContact O-CB 3.26Å; R593-M597 WeakPolarHBondContact O-CB 3.47Å; R593-M597 PolarHBondContact O-N 3.44Å; M597-S599 VanDerWaalsContact C-N 3.29Å; M597-S599 PolarHBondContact O-N 3.31Å; M597-I600 PolarHBondContact O-N 2.98Å; M597-L601 VanDerWaalsContact O-CB 3.31Å; M597-L601 WeakPolarHBondContact O-CB 3.48Å; M597-L601 PolarHBondContact O-N 3.48Å; M597-T616 HydrophobicContact CE-CG2 3.96Å; M597-T616 HydrophobicContact SD-CG2 3.51Å; M597-T616 VanDerWaalsContact SD-CG2 3.51Å; M597-L620 HydrophobicContact CE-CD1 4.27Å; M597-L620 HydrophobicContact CE-CG 4.2Å
598	G	85.4	Confident	86.8	Confident	36 Å²	36	53.9 Å²	53.9	37%	0.371	28%	0.277	S	S	.	.	H	α-helix	trans	-62.7	-34.2	177.9	0	0	0	0	0	113.3	L596 K602	L596-G598 VanDerWaalsContact C-N 3.31Å; L596-G598 PolarHBondContact O-N 3.26Å; G598-K602 WeakPolarHBondContact O-CB 3.48Å; G598-K602 PolarHBondContact O-N 3.17Å
599	S	86.4	Confident	86.1	Confident	17 Å²	17	48.6 Å²	48.6	12%	0.119	26%	0.258	C	S	.	.	H	α-helix	trans	-76.3	-41.3	174.3	-61.5	0	0	0	0	111.9	L596 M597 K602 C603	L596-S599 WeakPolarHBondContact O-CA 3.28Å; L596-S599 WeakPolarHBondContact O-CB 3.47Å; L596-S599 PolarHBondContact O-N 2.96Å; M597-S599 VanDerWaalsContact C-N 3.29Å; M597-S599 PolarHBondContact O-N 3.31Å; S599-K602 PolarHBondContact O-N 3.39Å; S599-C603 WeakPolarHBondContact O-CB 3.38Å; S599-C603 PolarHBondContact O-N 3.37Å
600	I	87.4	Confident	85.7	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-64.1	-49.6	-179	-61.6	158.7	0	0	0	109.8	T357 M361 L596 M597 K602 C603 Y604 A612 D615 T616	T357-I600 HydrophobicContact CG2-CG2 4.19Å; M361-I600 HydrophobicContact CE-CB 3.89Å; M361-I600 HydrophobicContact CE-CG1 3.29Å; L596-I600 HydrophobicContact CB-CD1 3.91Å; L596-I600 WeakPolarHBondContact O-CG1 3.49Å; L596-I600 PolarHBondContact O-N 3.35Å; M597-I600 PolarHBondContact O-N 2.98Å; I600-K602 PolarHBondContact O-N 2.86Å; I600-C603 WeakPolarHBondContact O-CB 3.27Å; I600-C603 PolarHBondContact O-N 3.22Å; I600-Y604 PolarHBondContact O-N 2.95Å; I600-A612 HydrophobicContact CG2-CB 3.83Å; I600-D615 WeakPolarHBondContact CD1-OD2 3.45Å; I600-T616 HydrophobicContact CB-CG2 4.28Å; I600-T616 HydrophobicContact CG2-CG2 3.65Å
601	L	86.2	Confident	85.4	Confident	75 Å²	75	50.7 Å²	50.7	39%	0.393	27%	0.266	S	S	.	.	H	α-helix	trans	-63.2	-42.1	179.1	-161.6	71.2	0	0	0	111.1	M597 C603 Y604 W605	M597-L601 VanDerWaalsContact O-CB 3.31Å; M597-L601 WeakPolarHBondContact O-CB 3.48Å; M597-L601 PolarHBondContact O-N 3.48Å; L601-C603 VanDerWaalsContact C-N 3.32Å; L601-C603 PolarHBondContact O-N 2.94Å; L601-Y604 WeakPolarHBondContact O-CB 3.34Å; L601-Y604 PolarHBondContact O-N 2.93Å; L601-W605 PolarHBondContact O-N 3.28Å
602	K	82.3	Confident	85.1	Confident	56 Å²	56	47.2 Å²	47.2	24%	0.243	25%	0.245	C	C	.	.	H	α-helix	trans	-66.4	-31.7	177.4	-169	171	-167.6	169.6	0	113.1	L384 Y386 G598 S599 I600 K606	L384-K602 PolarHBondContact O-NZ 3.27Å; Y386-K602 HydrophobicContact CD2-CD 4.37Å; Y386-K602 HydrophobicContact CE2-CD 3.9Å; G598-K602 WeakPolarHBondContact O-CB 3.48Å; G598-K602 PolarHBondContact O-N 3.17Å; S599-K602 PolarHBondContact O-N 3.39Å; I600-K602 PolarHBondContact O-N 2.86Å; K602-K606 PolarHBondContact O-N 3.05Å
603	C	81	Confident	84.9	Confident	5 Å²	5	49.7 Å²	49.7	3%	0.034	26%	0.257	C	S	.	.	H	α-helix	trans	-63.9	-51.1	169.8	-170	0	0	0	0	110.2	M361 S599 I600 L601 W605 K606 T607	M361-C603 HydrophobicContact SD-CB 4Å; S599-C603 WeakPolarHBondContact O-CB 3.38Å; S599-C603 PolarHBondContact O-N 3.37Å; I600-C603 WeakPolarHBondContact O-CB 3.27Å; I600-C603 PolarHBondContact O-N 3.22Å; L601-C603 VanDerWaalsContact C-N 3.32Å; L601-C603 PolarHBondContact O-N 2.94Å; C603-W605 PolarHBondContact O-N 3.39Å; C603-K606 PolarHBondContact O-N 3.39Å; C603-T607 PolarHBondContact O-N 3.44Å; C603-T607 PolarHBondContact O-OG1 3.29Å
604	Y	84.6	Confident	84.8	Confident	76 Å²	76	51.2 Å²	51.2	30%	0.298	27%	0.268	S	S	.	.	H	α-helix	trans	-55.1	-48.3	176	172.7	-105.3	0	0	0	112.9	I600 L601 K606 T607 G608 L609 L613	I600-Y604 PolarHBondContact O-N 2.95Å; L601-Y604 WeakPolarHBondContact O-CB 3.34Å; L601-Y604 PolarHBondContact O-N 2.93Å; Y604-K606 PolarHBondContact O-N 3.26Å; Y604-K606 VanDerWaalsContact O-N 3.17Å; Y604-T607 PolarHBondContact O-N 2.86Å; Y604-G608 WeakPolarHBondContact O-CA 3.3Å; Y604-G608 PolarHBondContact O-N 3.05Å; Y604-L609 WeakPolarHBondContact CD2-O 3.4Å; Y604-L613 HydrophobicContact CD2-CB 3.92Å; Y604-L613 HydrophobicContact CE1-CD1 3.86Å; Y604-L613 HydrophobicContact CE2-CB 3.83Å; Y604-L613 HydrophobicContact CE2-CD1 4.01Å; Y604-L613 HydrophobicContact CG-CB 4.38Å
605	W	83	Confident	84.9	Confident	200 Å²	200	45.9 Å²	45.9	76%	0.758	24%	0.241	S	C	*	.	H	α-helix	trans	-60.3	-25.4	177.4	-80.1	104	0	0	0	114.1	L601 C603	L601-W605 PolarHBondContact O-N 3.28Å; C603-W605 PolarHBondContact O-N 3.39Å
606	K	77.7	Confident	85	Confident	97 Å²	97	44 Å²	44	42%	0.422	23%	0.228	S	C	.	.	H	α-helix	trans	-91.1	-27.5	176.2	-87.9	-161.3	166.4	-164.4	0	114.3	H379 K602 C603 Y604	H379-K606 PolarHBondContact O-NZ 3.12Å; K602-K606 PolarHBondContact O-N 3.05Å; C603-K606 PolarHBondContact O-N 3.39Å; Y604-K606 PolarHBondContact O-N 3.26Å; Y604-K606 VanDerWaalsContact O-N 3.17Å
607	T	76	Confident	85.2	Confident	18 Å²	18	48.6 Å²	48.6	11%	0.11	25%	0.251	C	S	.	.	H	α-helix	trans	-115.8	-18.7	-170	61.9	0	0	0	0	114.9	L364 C603 Y604 L609	L364-T607 HydrophobicContact CD1-CG2 4.07Å; L364-T607 HydrophobicContact CD2-CG2 4.12Å; C603-T607 PolarHBondContact O-N 3.44Å; C603-T607 PolarHBondContact O-OG1 3.29Å; Y604-T607 PolarHBondContact O-N 2.86Å; T607-L609 PolarHBondContact O-N 3.26Å; T607-L609 VanDerWaalsContact OG1-CB 3.3Å; T607-L609 WeakPolarHBondContact OG1-CB 3.41Å; T607-L609 PolarHBondContact OG1-N 3.39Å
608	G	76.7	Confident	85.4	Confident	48 Å²	48	47.6 Å²	47.6	50%	0.495	25%	0.247	S	C	.	.			trans	70	10.8	-170.9	0	0	0	0	0	114.4	Y604 E610	Y604-G608 WeakPolarHBondContact O-CA 3.3Å; Y604-G608 PolarHBondContact O-N 3.05Å; G608-E610 PolarHBondContact O-N 3.27Å; G608-E610 VanDerWaalsContact O-N 3.13Å
609	L	79.7	Confident	85.8	Confident	15 Å²	15	46.3 Å²	46.3	8%	0.079	23%	0.232	C	C	.	.			trans	-70.3	107.4	-167.3	-173.6	71.8	0	0	0	113.4	F245 V360 L364 Y604 T607 I611 A612	F245-L609 HydrophobicContact CD1-CD1 4.27Å; V360-L609 HydrophobicContact CB-CD2 4.37Å; V360-L609 HydrophobicContact CG1-CD2 3.54Å; L364-L609 HydrophobicContact CD1-CD2 4.42Å; Y604-L609 WeakPolarHBondContact CD2-O 3.4Å; T607-L609 PolarHBondContact O-N 3.26Å; T607-L609 VanDerWaalsContact OG1-CB 3.3Å; T607-L609 WeakPolarHBondContact OG1-CB 3.41Å; T607-L609 PolarHBondContact OG1-N 3.39Å; L609-I611 VanDerWaalsContact C-N 3.26Å; L609-I611 HydrophobicContact CD2-CG2 3.68Å; L609-I611 HydrophobicContact CG-CG2 3.89Å; L609-I611 PolarHBondContact O-N 2.65Å; L609-I611 VanDerWaalsContact O-N 3.11Å; L609-A612 WeakPolarHBondContact O-CB 3.14Å; L609-A612 PolarHBondContact O-N 3.08Å; L609-A612 VanDerWaalsContact O-N 3.07Å
610	E	83.4	Confident	86.2	Confident	99 Å²	99	50.3 Å²	50.3	46%	0.463	25%	0.251	S	S	.	.	H	α-helix	trans	-53.6	-32.4	-175.6	-61.6	178.3	170.5	0	0	115.2	G608 A612 L613 T614	G608-E610 PolarHBondContact O-N 3.27Å; G608-E610 VanDerWaalsContact O-N 3.13Å; E610-A612 VanDerWaalsContact C-N 3.31Å; E610-A612 PolarHBondContact O-N 3.07Å; E610-L613 PolarHBondContact O-N 3.22Å; E610-T614 WeakPolarHBondContact O-CB 3.38Å; E610-T614 PolarHBondContact O-N 3.44Å; E610-T614 PolarHBondContact O-OG1 3.48Å
611	I	86.9	Confident	86.5	Confident	8 Å²	8	53.9 Å²	53.9	4%	0.041	27%	0.27	C	S	.	.	H	α-helix	trans	-64.1	-36.5	179.8	-151.9	179.5	0	0	0	111.8	V249 V353 E356 T357 L609 T614 D615	V249-I611 HydrophobicContact CG2-CD1 3.52Å; V249-I611 HydrophobicContact CG2-CG1 4.47Å; V353-I611 HydrophobicContact CG1-CG1 4.43Å; E356-I611 HydrophobicContact CB-CD1 3.76Å; T357-I611 PolarHBondContact OG1-O 3.35Å; L609-I611 VanDerWaalsContact C-N 3.26Å; L609-I611 HydrophobicContact CD2-CG2 3.68Å; L609-I611 HydrophobicContact CG-CG2 3.89Å; L609-I611 PolarHBondContact O-N 2.65Å; L609-I611 VanDerWaalsContact O-N 3.11Å; I611-T614 WeakPolarHBondContact O-CB 3.48Å; I611-T614 PolarHBondContact O-N 3.2Å; I611-D615 PolarHBondContact O-N 3.45Å
612	A	87	Confident	86.9	Confident	4 Å²	4	50.5 Å²	50.5	3%	0.033	25%	0.252	C	S	.	.	H	α-helix	trans	-69.1	-40.4	178.9	0	0	0	0	0	111.3	T357 I600 L609 E610 T614 D615 T616	T357-A612 HydrophobicContact CG2-CB 4.21Å; I600-A612 HydrophobicContact CG2-CB 3.83Å; L609-A612 WeakPolarHBondContact O-CB 3.14Å; L609-A612 PolarHBondContact O-N 3.08Å; L609-A612 VanDerWaalsContact O-N 3.07Å; E610-A612 VanDerWaalsContact C-N 3.31Å; E610-A612 PolarHBondContact O-N 3.07Å; A612-T614 VanDerWaalsContact C-N 3.35Å; A612-D615 PolarHBondContact O-N 2.81Å; A612-T616 WeakPolarHBondContact O-CG2 3.37Å; A612-T616 PolarHBondContact O-N 3.28Å
613	L	88.7	Confident	87.4	Confident	61 Å²	61	48.7 Å²	48.7	32%	0.319	25%	0.245	S	C	.	.	H	α-helix	trans	-63.3	-42.4	171.5	177.6	138	0	0	0	111.1	Y604 E610 D615 T616 I617	Y604-L613 HydrophobicContact CD2-CB 3.92Å; Y604-L613 HydrophobicContact CE1-CD1 3.86Å; Y604-L613 HydrophobicContact CE2-CB 3.83Å; Y604-L613 HydrophobicContact CE2-CD1 4.01Å; Y604-L613 HydrophobicContact CG-CB 4.38Å; E610-L613 PolarHBondContact O-N 3.22Å; L613-D615 PolarHBondContact O-N 3.47Å; L613-T616 PolarHBondContact O-N 3.04Å; L613-T616 PolarHBondContact O-OG1 2.83Å; L613-I617 HydrophobicContact CD2-CD1 3.58Å; L613-I617 HydrophobicContact CG-CD1 4.1Å; L613-I617 WeakPolarHBondContact O-CG1 3.39Å; L613-I617 PolarHBondContact O-N 2.79Å
614	T	90	Very high	88	Confident	45 Å²	45	53 Å²	53	28%	0.276	27%	0.267	S	S	.	.	H	α-helix	trans	-58.6	-45.7	176.6	-55.5	0	0	0	0	111.6	V353 E610 I611 A612 I617 L618	V353-T614 HydrophobicContact CG1-CG2 4.24Å; E610-T614 WeakPolarHBondContact O-CB 3.38Å; E610-T614 PolarHBondContact O-N 3.44Å; E610-T614 PolarHBondContact O-OG1 3.48Å; I611-T614 WeakPolarHBondContact O-CB 3.48Å; I611-T614 PolarHBondContact O-N 3.2Å; A612-T614 VanDerWaalsContact C-N 3.35Å; T614-I617 PolarHBondContact O-N 3.44Å; T614-L618 VanDerWaalsContact O-CB 3.23Å; T614-L618 WeakPolarHBondContact O-CB 3.48Å; T614-L618 PolarHBondContact O-N 2.94Å
615	D	91.9	Very high	88.5	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63.8	-42.1	176.1	-179.5	60.8	0	0	0	113	V353 T357 I600 I611 A612 L613 I617 L618 T619	V353-D615 HydrophobicContact CG1-CB 4.1Å; T357-D615 HydrophobicContact CG2-CB 3.88Å; I600-D615 WeakPolarHBondContact CD1-OD2 3.45Å; I611-D615 PolarHBondContact O-N 3.45Å; A612-D615 PolarHBondContact O-N 2.81Å; L613-D615 PolarHBondContact O-N 3.47Å; D615-I617 VanDerWaalsContact C-N 3.34Å; D615-I617 PolarHBondContact O-N 3.46Å; D615-L618 PolarHBondContact O-N 3.12Å; D615-T619 VanDerWaalsContact O-CB 3.29Å; D615-T619 WeakPolarHBondContact O-CB 3.32Å; D615-T619 PolarHBondContact O-N 3.08Å; D615-T619 PolarHBondContact O-OG1 3.38Å
616	T	92.4	Very high	88.9	Confident	12 Å²	12	42 Å²	42	7%	0.074	23%	0.229	C	C	.	.	H	α-helix	trans	-61.2	-40.8	176.1	59.9	0	0	0	0	112.8	M597 I600 A612 L613 L620	M597-T616 HydrophobicContact CE-CG2 3.96Å; M597-T616 HydrophobicContact SD-CG2 3.51Å; M597-T616 VanDerWaalsContact SD-CG2 3.51Å; I600-T616 HydrophobicContact CB-CG2 4.28Å; I600-T616 HydrophobicContact CG2-CG2 3.65Å; A612-T616 WeakPolarHBondContact O-CG2 3.37Å; A612-T616 PolarHBondContact O-N 3.28Å; L613-T616 PolarHBondContact O-N 3.04Å; L613-T616 PolarHBondContact O-OG1 2.83Å; T616-L620 WeakPolarHBondContact O-CG 3.46Å; T616-L620 PolarHBondContact O-N 3.37Å
617	I	93.7	Very high	89.6	Confident	98 Å²	98	41.4 Å²	41.4	50%	0.503	23%	0.231	S	C	.	.	H	α-helix	trans	-68.3	-44.2	175.8	-67.1	171.2	0	0	0	110.6	L613 T614 D615 L620 L621	L613-I617 HydrophobicContact CD2-CD1 3.58Å; L613-I617 HydrophobicContact CG-CD1 4.1Å; L613-I617 WeakPolarHBondContact O-CG1 3.39Å; L613-I617 PolarHBondContact O-N 2.79Å; T614-I617 PolarHBondContact O-N 3.44Å; D615-I617 VanDerWaalsContact C-N 3.34Å; D615-I617 PolarHBondContact O-N 3.46Å; I617-L620 PolarHBondContact O-N 2.79Å; I617-L621 WeakPolarHBondContact O-CB 3.18Å; I617-L621 PolarHBondContact O-N 3.37Å
618	L	93.7	Very high	90.3	Very high	28 Å²	28	45.9 Å²	45.9	15%	0.147	25%	0.252	C	S	.	.	H	α-helix	trans	-69	-35.1	-177.7	-170.2	58.1	0	0	0	112.1	V349 Y350 V353 T614 D615 L621 Y622	V349-L618 HydrophobicContact CG1-CD2 4.26Å; Y350-L618 HydrophobicContact CD2-CD2 4.3Å; Y350-L618 HydrophobicContact CD2-CG 3.99Å; V353-L618 HydrophobicContact CB-CD2 3.93Å; V353-L618 HydrophobicContact CG1-CD2 4.33Å; V353-L618 HydrophobicContact CG2-CD2 3.89Å; T614-L618 VanDerWaalsContact O-CB 3.23Å; T614-L618 WeakPolarHBondContact O-CB 3.48Å; T614-L618 PolarHBondContact O-N 2.94Å; D615-L618 PolarHBondContact O-N 3.12Å; L618-L621 HydrophobicContact CD1-CD2 4.47Å; L618-L621 PolarHBondContact O-N 3.34Å; L618-Y622 VanDerWaalsContact O-CB 3.31Å; L618-Y622 WeakPolarHBondContact O-CB 3.5Å; L618-Y622 PolarHBondContact O-N 3.5Å
619	T	93.7	Very high	90.9	Very high	9 Å²	9	45.1 Å²	45.1	6%	0.055	24%	0.237	C	C	.	.	H	α-helix	trans	-58.6	-50.7	169.5	-67.2	0	0	0	0	110.7	Y350 R593 D615 L621 Y622 M623	Y350-T619 VanDerWaalsContact CE2-OG1 3.24Å; Y350-T619 WeakPolarHBondContact CE2-OG1 3.43Å; Y350-T619 PolarHBondContact OH-OG1 3.42Å; R593-T619 HydrophobicContact CB-CG2 4.11Å; R593-T619 HydrophobicContact CG-CG2 4.26Å; D615-T619 VanDerWaalsContact O-CB 3.29Å; D615-T619 WeakPolarHBondContact O-CB 3.32Å; D615-T619 PolarHBondContact O-N 3.08Å; D615-T619 PolarHBondContact O-OG1 3.38Å; T619-L621 PolarHBondContact O-N 3.05Å; T619-Y622 PolarHBondContact O-N 3.29Å; T619-M623 VanDerWaalsContact O-CG 3.27Å; T619-M623 WeakPolarHBondContact O-CG 3.43Å; T619-M623 PolarHBondContact O-N 3.04Å
620	L	93.6	Very high	91.3	Very high	100 Å²	100	48.6 Å²	48.6	52%	0.524	25%	0.249	S	C	.	.	H	α-helix	trans	-60.9	-45.2	178.1	-70.7	170.8	0	0	0	111.6	M597 T616 I617 M623 I624	M597-L620 HydrophobicContact CE-CD1 4.27Å; M597-L620 HydrophobicContact CE-CG 4.2Å; T616-L620 WeakPolarHBondContact O-CG 3.46Å; T616-L620 PolarHBondContact O-N 3.37Å; I617-L620 PolarHBondContact O-N 2.79Å; L620-M623 PolarHBondContact O-N 2.76Å; L620-I624 VanDerWaalsContact O-CG1 3.28Å; L620-I624 WeakPolarHBondContact O-CG1 3.44Å; L620-I624 PolarHBondContact O-N 3.29Å
621	L	94.2	Very high	91.4	Very high	78 Å²	78	50.2 Å²	50.2	41%	0.408	26%	0.255	S	S	.	.	H	α-helix	trans	-63	-42.3	178.7	-175.5	145.5	0	0	0	112.2	M346 I617 L618 T619 I624 C625	M346-L621 HydrophobicContact CE-CD2 3.66Å; M346-L621 HydrophobicContact CG-CD2 4.43Å; M346-L621 HydrophobicContact SD-CD2 3.72Å; I617-L621 WeakPolarHBondContact O-CB 3.18Å; I617-L621 PolarHBondContact O-N 3.37Å; L618-L621 HydrophobicContact CD1-CD2 4.47Å; L618-L621 PolarHBondContact O-N 3.34Å; T619-L621 PolarHBondContact O-N 3.05Å; L621-I624 PolarHBondContact O-N 3.46Å; L621-C625 WeakPolarHBondContact O-CB 3.46Å; L621-C625 PolarHBondContact O-N 3.24Å; L621-C625 PolarHBondContact O-SG 3.47Å
622	Y	94.5	Very high	91.3	Very high	3 Å²	3	51.5 Å²	51.5	1%	0.012	27%	0.27	C	S	.	.	H	α-helix	trans	-60.2	-46.2	175.1	170.8	-101.9	0	0	0	111.5	Y343 Y350 M403 L618 T619 I624 C625 W626	Y343-Y622 HydrophobicContact CE2-CE2 4.02Å; Y343-Y622 AromaticContact CZ-CE2 3.98Å; Y343-Y622 PolarHBondContact OH-OH 2.92Å; Y350-Y622 HydrophobicContact CD1-CD1 4.19Å; Y350-Y622 HydrophobicContact CD1-CD2 4.41Å; Y350-Y622 HydrophobicContact CD1-CG 4.1Å; Y350-Y622 HydrophobicContact CE1-CD1 4.07Å; Y350-Y622 HydrophobicContact CE1-CE1 4.45Å; Y350-Y622 HydrophobicContact CE1-CG 4.4Å; Y350-Y622 HydrophobicContact CG-CG 4.45Å; M403-Y622 HydrophobicContact CE-CD1 4.38Å; M403-Y622 HydrophobicContact CE-CE1 3.61Å; M403-Y622 HydrophobicContact CE-CE2 3.79Å; M403-Y622 WeakPolarHBondContact CE-OH 3.5Å; M403-Y622 HydrophobicContact SD-CE1 3.73Å; M403-Y622 PolarHBondContact SD-OH 2.87Å; L618-Y622 VanDerWaalsContact O-CB 3.31Å; L618-Y622 WeakPolarHBondContact O-CB 3.5Å; L618-Y622 PolarHBondContact O-N 3.5Å; T619-Y622 PolarHBondContact O-N 3.29Å; Y622-I624 PolarHBondContact O-N 3.21Å; Y622-C625 PolarHBondContact O-N 3.08Å; Y622-W626 PolarHBondContact O-N 3.47Å
623	M	93.4	Very high	91.1	Very high	19 Å²	19	52.5 Å²	52.5	9%	0.094	27%	0.274	C	S	.	.	H	α-helix	trans	-67.6	-35.3	-179.9	-61.8	-61.1	-85.9	0	0	112.5	F586 L590 T619 L620 W626 L627	F586-M623 HydrophobicContact CD2-CE 3.7Å; F586-M623 HydrophobicContact CD2-SD 4.16Å; F586-M623 HydrophobicContact CE1-CE 4.32Å; F586-M623 HydrophobicContact CE2-CB 4.31Å; F586-M623 HydrophobicContact CE2-CE 3.24Å; F586-M623 HydrophobicContact CE2-SD 3.74Å; F586-M623 HydrophobicContact CG-CE 4.43Å; F586-M623 HydrophobicContact CZ-CE 3.6Å; L590-M623 HydrophobicContact CB-CE 3.53Å; L590-M623 HydrophobicContact CD1-CE 3.75Å; L590-M623 HydrophobicContact CG-CE 4.19Å; T619-M623 VanDerWaalsContact O-CG 3.27Å; T619-M623 WeakPolarHBondContact O-CG 3.43Å; T619-M623 PolarHBondContact O-N 3.04Å; L620-M623 PolarHBondContact O-N 2.76Å; M623-W626 WeakPolarHBondContact O-CB 3.35Å; M623-L627 WeakPolarHBondContact O-CG 3.34Å; M623-L627 PolarHBondContact O-N 2.91Å
624	I	94.2	Very high	90.7	Very high	96 Å²	96	51.5 Å²	51.5	49%	0.492	27%	0.273	S	S	.	.	H	α-helix	trans	-65.6	-44.8	171.9	-68	168.7	0	0	0	110.7	L620 L621 Y622 W626 L627 I628	L620-I624 VanDerWaalsContact O-CG1 3.28Å; L620-I624 WeakPolarHBondContact O-CG1 3.44Å; L620-I624 PolarHBondContact O-N 3.29Å; L621-I624 PolarHBondContact O-N 3.46Å; Y622-I624 PolarHBondContact O-N 3.21Å; I624-W626 VanDerWaalsContact C-N 3.32Å; I624-W626 PolarHBondContact O-N 3.35Å; I624-L627 PolarHBondContact O-N 3.4Å; I624-I628 HydrophobicContact CG2-CD1 3.81Å; I624-I628 HydrophobicContact CG2-CG1 4.49Å; I624-I628 WeakPolarHBondContact O-CG1 3.47Å; I624-I628 PolarHBondContact O-N 3.02Å
625	C	93.3	Very high	90.2	Very high	35 Å²	35	53.9 Å²	53.9	24%	0.236	29%	0.287	C	S	.	.	H	α-helix	trans	-68.1	-31.2	178.8	-67.5	0	0	0	0	112.6	M346 L621 Y622 I628 L629	M346-C625 HydrophobicContact CE-CB 4.18Å; M346-C625 HydrophobicContact SD-CB 3.45Å; M346-C625 WeakPolarHBondContact SD-CB 3.31Å; M346-C625 VanDerWaalsContact SD-SG 3.65Å; L621-C625 WeakPolarHBondContact O-CB 3.46Å; L621-C625 PolarHBondContact O-N 3.24Å; L621-C625 PolarHBondContact O-SG 3.47Å; Y622-C625 PolarHBondContact O-N 3.08Å; C625-I628 PolarHBondContact O-N 3.24Å; C625-L629 WeakPolarHBondContact O-CB 3.4Å; C625-L629 PolarHBondContact O-N 2.89Å
626	W	93.1	Very high	89.6	Confident	8 Å²	8	58.7 Å²	58.7	3%	0.03	31%	0.308	C	S	.	.	H	α-helix	trans	-58.8	-50.4	168.6	-170.9	100.8	0	0	0	111.3	Y343 C406 A582 T583 F586 Y622 M623 I624 I628 L629 W630	Y343-W626 VanDerWaalsContact OH-CD1 3.25Å; C406-W626 PolarHBondContact SG-NE1 3.05Å; A582-W626 HydrophobicContact CB-CZ2 4.2Å; A582-W626 WeakPolarHBondContact O-CZ2 3.16Å; T583-W626 HydrophobicContact CG2-CH2 4.38Å; F586-W626 HydrophobicContact CB-CD2 4.14Å; F586-W626 HydrophobicContact CB-CE3 4.28Å; F586-W626 HydrophobicContact CB-CH2 3.75Å; F586-W626 HydrophobicContact CB-CZ2 3.56Å; F586-W626 HydrophobicContact CB-CZ3 4.1Å; F586-W626 HydrophobicContact CD1-CE3 4.28Å; F586-W626 HydrophobicContact CD1-CZ3 4.11Å; F586-W626 HydrophobicContact CD2-CB 4.17Å; F586-W626 AromaticContact CD2-CD2 3.22Å; F586-W626 HydrophobicContact CD2-CD2 3.22Å; F586-W626 AromaticContact CD2-CE2 3.71Å; F586-W626 AromaticContact CD2-CE3 3.33Å; F586-W626 HydrophobicContact CD2-CE3 3.33Å; F586-W626 AromaticContact CD2-CG 3.55Å; F586-W626 HydrophobicContact CD2-CG 3.55Å; F586-W626 HydrophobicContact CD2-CH2 4.37Å; F586-W626 HydrophobicContact CD2-CZ2 4.28Å; F586-W626 AromaticContact CD2-CZ3 3.92Å; F586-W626 HydrophobicContact CD2-CZ3 3.92Å; F586-W626 HydrophobicContact CE1-CE3 4.47Å; F586-W626 HydrophobicContact CE2-CB 4.03Å; F586-W626 AromaticContact CE2-CD2 3.73Å; F586-W626 HydrophobicContact CE2-CD2 3.73Å; F586-W626 AromaticContact CE2-CE3 3.55Å; F586-W626 HydrophobicContact CE2-CE3 3.55Å; F586-W626 AromaticContact CE2-CG 3.9Å; F586-W626 HydrophobicContact CE2-CG 3.9Å; F586-W626 HydrophobicContact CE2-CZ3 4.32Å; F586-W626 AromaticContact CG-CD2 3.84Å; F586-W626 HydrophobicContact CG-CD2 3.84Å; F586-W626 AromaticContact CG-CE2 3.98Å; F586-W626 AromaticContact CG-CE3 3.71Å; F586-W626 HydrophobicContact CG-CE3 3.71Å; F586-W626 AromaticContact CG-CH2 3.98Å; F586-W626 HydrophobicContact CG-CH2 3.98Å; F586-W626 HydrophobicContact CG-CZ2 4.08Å; F586-W626 AromaticContact CG-CZ3 3.78Å; F586-W626 HydrophobicContact CG-CZ3 3.78Å; F586-W626 HydrophobicContact CZ-CE3 4.13Å; Y622-W626 PolarHBondContact O-N 3.47Å; M623-W626 WeakPolarHBondContact O-CB 3.35Å; I624-W626 VanDerWaalsContact C-N 3.32Å; I624-W626 PolarHBondContact O-N 3.35Å; W626-I628 PolarHBondContact O-N 3.16Å; W626-L629 PolarHBondContact O-N 3.03Å; W626-W630 HydrophobicContact CD2-CB 4.46Å; W626-W630 HydrophobicContact CE3-CB 3.95Å; W626-W630 HydrophobicContact CE3-CG 4.44Å; W626-W630 HydrophobicContact CH2-CB 3.91Å; W626-W630 AromaticContact CH2-CD1 3.32Å; W626-W630 HydrophobicContact CH2-CD2 4.37Å; W626-W630 AromaticContact CH2-CG 3.61Å; W626-W630 HydrophobicContact CH2-CG 3.61Å; W626-W630 AromaticContact CH2-NE1 3.93Å; W626-W630 HydrophobicContact CZ2-CB 4.41Å; W626-W630 AromaticContact CZ2-CD1 3.9Å; W626-W630 HydrophobicContact CZ2-CG 4.36Å; W626-W630 HydrophobicContact CZ3-CB 3.67Å; W626-W630 AromaticContact CZ3-CD1 3.88Å; W626-W630 HydrophobicContact CZ3-CD2 4.28Å; W626-W630 AromaticContact CZ3-CG 3.67Å; W626-W630 HydrophobicContact CZ3-CG 3.67Å; W626-W630 WeakPolarHBondContact O-CB 3.28Å; W626-W630 PolarHBondContact O-N 3.19Å
627	L	91.4	Very high	88.5	Confident	86 Å²	86	62.6 Å²	62.6	45%	0.45	33%	0.332	S	S	.	.	H	α-helix	trans	-62.7	-41.3	179.4	-71.2	167.1	0	0	0	111.9	F586 M623 I624 W630 F631	F586-L627 HydrophobicContact CE1-CD2 4.35Å; F586-L627 HydrophobicContact CE2-CG 4.43Å; F586-L627 HydrophobicContact CZ-CD1 4.32Å; F586-L627 HydrophobicContact CZ-CD2 4.06Å; F586-L627 HydrophobicContact CZ-CG 4.05Å; M623-L627 WeakPolarHBondContact O-CG 3.34Å; M623-L627 PolarHBondContact O-N 2.91Å; I624-L627 PolarHBondContact O-N 3.4Å; L627-W630 PolarHBondContact O-N 3.26Å; L627-F631 VanDerWaalsContact O-CB 3.25Å; L627-F631 WeakPolarHBondContact O-CB 3.27Å; L627-F631 PolarHBondContact O-N 3.44Å
628	I	91.9	Very high	87.3	Confident	111 Å²	111	59.7 Å²	59.7	57%	0.569	32%	0.322	S	S	*	.	H	α-helix	trans	-63.2	-44.2	175.6	-67.8	167.5	0	0	0	111.1	I624 C625 W626 G632	I624-I628 HydrophobicContact CG2-CD1 3.81Å; I624-I628 HydrophobicContact CG2-CG1 4.49Å; I624-I628 WeakPolarHBondContact O-CG1 3.47Å; I624-I628 PolarHBondContact O-N 3.02Å; C625-I628 PolarHBondContact O-N 3.24Å; W626-I628 PolarHBondContact O-N 3.16Å; I628-G632 PolarHBondContact O-N 2.62Å
629	L	89	Confident	86.3	Confident	32 Å²	32	58.9 Å²	58.9	17%	0.168	32%	0.317	C	S	.	.	H	α-helix	trans	-65	-47	176.9	-179.5	148.5	0	0	0	111.2	Y343 I410 C625 W626 F631 G632 L633	Y343-L629 HydrophobicContact CD1-CD1 4.34Å; Y343-L629 HydrophobicContact CD2-CD1 3.62Å; Y343-L629 HydrophobicContact CE2-CD1 4.34Å; Y343-L629 HydrophobicContact CG-CD1 3.61Å; I410-L629 HydrophobicContact CD1-CD2 3.95Å; I410-L629 HydrophobicContact CG1-CD2 4.35Å; C625-L629 WeakPolarHBondContact O-CB 3.4Å; C625-L629 PolarHBondContact O-N 2.89Å; W626-L629 PolarHBondContact O-N 3.03Å; L629-F631 PolarHBondContact O-N 2.85Å; L629-G632 PolarHBondContact O-N 2.9Å; L629-L633 HydrophobicContact CD2-CD1 3.61Å; L629-L633 HydrophobicContact CD2-CG 4.11Å; L629-L633 HydrophobicContact CG-CD1 4.35Å; L629-L633 HydrophobicContact CG-CG 4.43Å; L629-L633 WeakPolarHBondContact O-CG 3.39Å; L629-L633 PolarHBondContact O-N 3.46Å
630	W	87.1	Confident	85.2	Confident	89 Å²	89	66 Å²	66	34%	0.337	34%	0.343	S	S	.	.	H	α-helix	trans	-60.8	-44.4	179.2	-179.2	91.3	0	0	0	111.7	T583 W626 L627 S634	T583-W630 HydrophobicContact CG2-CZ2 4.4Å; W626-W630 HydrophobicContact CD2-CB 4.46Å; W626-W630 HydrophobicContact CE3-CB 3.95Å; W626-W630 HydrophobicContact CE3-CG 4.44Å; W626-W630 HydrophobicContact CH2-CB 3.91Å; W626-W630 AromaticContact CH2-CD1 3.32Å; W626-W630 HydrophobicContact CH2-CD2 4.37Å; W626-W630 AromaticContact CH2-CG 3.61Å; W626-W630 HydrophobicContact CH2-CG 3.61Å; W626-W630 AromaticContact CH2-NE1 3.93Å; W626-W630 HydrophobicContact CZ2-CB 4.41Å; W626-W630 AromaticContact CZ2-CD1 3.9Å; W626-W630 HydrophobicContact CZ2-CG 4.36Å; W626-W630 HydrophobicContact CZ3-CB 3.67Å; W626-W630 AromaticContact CZ3-CD1 3.88Å; W626-W630 HydrophobicContact CZ3-CD2 4.28Å; W626-W630 AromaticContact CZ3-CG 3.67Å; W626-W630 HydrophobicContact CZ3-CG 3.67Å; W626-W630 WeakPolarHBondContact O-CB 3.28Å; W626-W630 PolarHBondContact O-N 3.19Å; L627-W630 PolarHBondContact O-N 3.26Å; W630-S634 VanDerWaalsContact O-CB 3.25Å; W630-S634 WeakPolarHBondContact O-CB 3.46Å; W630-S634 PolarHBondContact O-N 3.04Å; W630-S634 PolarHBondContact O-OG 3.07Å
631	F	85.8	Confident	84.2	Confident	133 Å²	133	61.3 Å²	61.3	58%	0.583	32%	0.319	S	S	*	.	H	α-helix	trans	-63.2	-45.8	174.5	-176.7	-101.2	0	0	0	111.4	L627 L629 L633 S634 V635	L627-F631 VanDerWaalsContact O-CB 3.25Å; L627-F631 WeakPolarHBondContact O-CB 3.27Å; L627-F631 PolarHBondContact O-N 3.44Å; L629-F631 PolarHBondContact O-N 2.85Å; F631-L633 PolarHBondContact O-N 3.01Å; F631-S634 PolarHBondContact O-N 3.22Å; F631-V635 HydrophobicContact CD1-CG2 4.18Å; F631-V635 HydrophobicContact CD2-CG2 4.15Å; F631-V635 HydrophobicContact CE1-CG2 3.86Å; F631-V635 HydrophobicContact CE2-CG2 3.82Å; F631-V635 HydrophobicContact CG-CG2 4.33Å; F631-V635 HydrophobicContact CZ-CG2 3.67Å; F631-V635 WeakPolarHBondContact O-CG2 3.41Å; F631-V635 PolarHBondContact O-N 3.4Å
632	G	84.8	Confident	83	Confident	35 Å²	35	63.6 Å²	63.6	36%	0.361	32%	0.322	S	S	.	.	H	α-helix	trans	-60	-43.1	177.3	0	0	0	0	0	113.7	I628 L629 K636	I628-G632 PolarHBondContact O-N 2.62Å; L629-G632 PolarHBondContact O-N 2.9Å; G632-K636 WeakPolarHBondContact O-CB 3.48Å; G632-K636 PolarHBondContact O-N 3.07Å; G632-K636 VanDerWaalsContact O-N 3.11Å
633	L	83.1	Confident	81.7	Confident	24 Å²	24	63.5 Å²	63.5	13%	0.126	32%	0.321	C	S	.	.	H	α-helix	trans	-71.6	-28.3	175.4	-65.7	-172.1	0	0	0	112.8	F336 I410 Y413 L629 F631 W639	F336-L633 HydrophobicContact CD2-CD2 4.33Å; F336-L633 HydrophobicContact CE2-CD2 4.08Å; I410-L633 HydrophobicContact CG2-CD1 4.38Å; Y413-L633 HydrophobicContact CD1-CD1 4.43Å; Y413-L633 HydrophobicContact CE1-CB 4.48Å; Y413-L633 HydrophobicContact CE1-CD2 4.11Å; Y413-L633 HydrophobicContact CE2-CB 4.38Å; Y413-L633 PolarHBondContact OH-O 3.15Å; L629-L633 HydrophobicContact CD2-CD1 3.61Å; L629-L633 HydrophobicContact CD2-CG 4.11Å; L629-L633 HydrophobicContact CG-CD1 4.35Å; L629-L633 HydrophobicContact CG-CG 4.43Å; L629-L633 WeakPolarHBondContact O-CG 3.39Å; L629-L633 PolarHBondContact O-N 3.46Å; F631-L633 PolarHBondContact O-N 3.01Å; L633-W639 HydrophobicContact CD2-CH2 4.22Å; L633-W639 HydrophobicContact CD2-CZ2 3.66Å
634	S	79.7	Confident	80	Confident	40 Å²	40	64.3 Å²	64.3	28%	0.28	33%	0.326	S	S	.	.	H	α-helix	trans	-76.7	-48.3	178.2	-63.1	0	0	0	0	112.3	W630 F631	W630-S634 VanDerWaalsContact O-CB 3.25Å; W630-S634 WeakPolarHBondContact O-CB 3.46Å; W630-S634 PolarHBondContact O-N 3.04Å; W630-S634 PolarHBondContact O-OG 3.07Å; F631-S634 PolarHBondContact O-N 3.22Å
635	V	80.8	Confident	78.2	Confident	95 Å²	95	60.2 Å²	60.2	58%	0.576	31%	0.305	S	S	*	.	H	α-helix	trans	-67.6	-36.9	178.1	175	0	0	0	0	111.2	F631 T637	F631-V635 HydrophobicContact CD1-CG2 4.18Å; F631-V635 HydrophobicContact CD2-CG2 4.15Å; F631-V635 HydrophobicContact CE1-CG2 3.86Å; F631-V635 HydrophobicContact CE2-CG2 3.82Å; F631-V635 HydrophobicContact CG-CG2 4.33Å; F631-V635 HydrophobicContact CZ-CG2 3.67Å; F631-V635 WeakPolarHBondContact O-CG2 3.41Å; F631-V635 PolarHBondContact O-N 3.4Å; V635-T637 PolarHBondContact O-N 3.38Å
636	K	77.8	Confident	76.4	Confident	101 Å²	101	59.4 Å²	59.4	44%	0.439	30%	0.298	S	S	.	.			trans	-80.4	68	-179.5	-161.3	179.6	-176.1	72.8	0	112.5	G632 A638 W639	G632-K636 WeakPolarHBondContact O-CB 3.48Å; G632-K636 PolarHBondContact O-N 3.07Å; G632-K636 VanDerWaalsContact O-N 3.11Å; K636-A638 VanDerWaalsContact C-N 3.25Å; K636-A638 PolarHBondContact O-N 3.4Å; K636-W639 HydrophobicContact CB-CZ2 4.44Å; K636-W639 HydrophobicContact CD-CD2 4.23Å; K636-W639 HydrophobicContact CD-CE3 4.31Å; K636-W639 HydrophobicContact CD-CH2 3.75Å; K636-W639 HydrophobicContact CD-CZ2 3.64Å; K636-W639 HydrophobicContact CD-CZ3 4.08Å; K636-W639 HydrophobicContact CG-CZ2 4.3Å; K636-W639 PolarHBondContact O-NE1 3.34Å; K636-W639 VanDerWaalsContact O-NE1 3.09Å
637	T	69.6	Low	74	Confident	95 Å²	95	61.4 Å²	61.4	58%	0.583	31%	0.309	S	S	*	.			trans	-59	-33.5	178.2	57.3	0	0	0	0	113.7	K417 V635	K417-T637 PolarHBondContact NZ-O 3.18Å; V635-T637 PolarHBondContact O-N 3.38Å
638	A	69	Low	71.5	Confident	36 Å²	36	59.3 Å²	59.3	30%	0.298	30%	0.299	S	S	.	.			trans	-106.6	121.1	-176.2	0	0	0	0	0	112.9	T499 K500 K636	T499-A638 WeakPolarHBondContact OG1-CA 3.44Å; K500-A638 HydrophobicContact CG-CB 4.14Å; K636-A638 VanDerWaalsContact C-N 3.25Å; K636-A638 PolarHBondContact O-N 3.4Å
639	W	73.2	Confident	69.2	Low	11 Å²	11	56.5 Å²	56.5	4%	0.042	28%	0.281	C	S	.	.			trans	-110.7	153.8	172.3	-68.1	83.4	0	0	0	110.7	F336 Y413 T498 T499 L633 K636 F641	F336-W639 HydrophobicContact CB-CE3 4.29Å; F336-W639 HydrophobicContact CB-CH2 4.13Å; F336-W639 HydrophobicContact CB-CZ3 3.7Å; F336-W639 AromaticContact CD2-CH2 3.75Å; F336-W639 HydrophobicContact CD2-CH2 3.75Å; F336-W639 HydrophobicContact CD2-CZ2 4.05Å; F336-W639 HydrophobicContact CD2-CZ3 4.13Å; F336-W639 HydrophobicContact CG-CH2 4.42Å; F336-W639 HydrophobicContact CG-CZ3 4.38Å; Y413-W639 AromaticContact CE1-NE1 3.88Å; Y413-W639 AromaticContact CZ-NE1 3.98Å; Y413-W639 PolarHBondContact OH-NE1 3.15Å; Y413-W639 VanDerWaalsContact OH-NE1 3.16Å; T498-W639 WeakPolarHBondContact CA-O 3.35Å; T499-W639 HydrophobicContact CG2-CB 4.05Å; T499-W639 PolarHBondContact N-O 3.43Å; T499-W639 PolarHBondContact OG1-N 2.99Å; L633-W639 HydrophobicContact CD2-CH2 4.22Å; L633-W639 HydrophobicContact CD2-CZ2 3.66Å; K636-W639 HydrophobicContact CB-CZ2 4.44Å; K636-W639 HydrophobicContact CD-CD2 4.23Å; K636-W639 HydrophobicContact CD-CE3 4.31Å; K636-W639 HydrophobicContact CD-CH2 3.75Å; K636-W639 HydrophobicContact CD-CZ2 3.64Å; K636-W639 HydrophobicContact CD-CZ3 4.08Å; K636-W639 HydrophobicContact CG-CZ2 4.3Å; K636-W639 PolarHBondContact O-NE1 3.34Å; K636-W639 VanDerWaalsContact O-NE1 3.09Å; W639-F641 HydrophobicContact CB-CD2 4.19Å; W639-F641 HydrophobicContact CB-CE2 3.58Å; W639-F641 HydrophobicContact CB-CZ 3.89Å; W639-F641 HydrophobicContact CG-CE2 4.43Å; W639-F641 HydrophobicContact CG-CZ 4.36Å
640	R	70.6	Confident	66.8	Low	160 Å²	160	60.2 Å²	60.2	60%	0.604	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.5	119	171.5	-68.5	-176.1	176.7	179	-2.1	107.8	I497 T498	I497-R640 WeakPolarHBondContact O-CA 3.4Å; T498-R640 HydrophobicContact CG2-CG 4.29Å
641	F	71.3	Confident	64.3	Low	1 Å²	1	62 Å²	62	0%	0.004	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	144.3	178.6	-65.2	-75.2	0	0	0	110.9	T332 S333 K417 F418 A421 A496 I497 T499 W639 L643	T332-F641 CarbonylContact O-C 3.48Å; T332-F641 WeakPolarHBondContact O-CA 3.31Å; S333-F641 WeakPolarHBondContact OG-CD1 3.19Å; S333-F641 WeakPolarHBondContact OG-CE1 3.44Å; K417-F641 VanDerWaalsContact C-CE2 3.47Å; K417-F641 HydrophobicContact CB-CE2 3.89Å; K417-F641 HydrophobicContact CB-CZ 3.78Å; K417-F641 VanDerWaalsContact O-CE2 3.23Å; K417-F641 WeakPolarHBondContact O-CE2 3.4Å; F418-F641 HydrophobicContact CD2-CG 4.49Å; A421-F641 HydrophobicContact CB-CB 4.29Å; A421-F641 HydrophobicContact CB-CD2 3.65Å; A421-F641 HydrophobicContact CB-CE2 4.46Å; A421-F641 HydrophobicContact CB-CG 4.39Å; A496-F641 WeakPolarHBondContact CA-O 3.49Å; I497-F641 PolarHBondContact N-O 3.04Å; I497-F641 PolarHBondContact O-N 3.29Å; T499-F641 HydrophobicContact CG2-CD2 3.9Å; T499-F641 HydrophobicContact CG2-CE2 3.58Å; W639-F641 HydrophobicContact CB-CD2 4.19Å; W639-F641 HydrophobicContact CB-CE2 3.58Å; W639-F641 HydrophobicContact CB-CZ 3.89Å; W639-F641 HydrophobicContact CG-CE2 4.43Å; W639-F641 HydrophobicContact CG-CZ 4.36Å; F641-L643 HydrophobicContact CB-CD1 4.13Å
642	R	69.1	Low	62	Low	125 Å²	125	58.3 Å²	58.3	47%	0.472	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	130.5	173.6	-64.3	176.9	177.8	-179.4	-2.4	110.5	F331 T332 T494 L495	F331-R642 HydrophobicContact CE1-CB 4.41Å; T332-R642 PolarHBondContact O-N 3.43Å; T494-R642 HydrophobicContact CG2-CB 4.08Å; T494-R642 HydrophobicContact CG2-CG 4.48Å; L495-R642 WeakPolarHBondContact O-CA 3.24Å
643	L	66.8	Low	59.7	Low	1 Å²	1	59.9 Å²	59.9	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	144.9	176.9	-71.4	80.6	0	0	0	109.5	L133 F418 V422 Y425 T494 L495 I497 F641	L133-L643 HydrophobicContact CD1-CD2 4.09Å; F418-L643 HydrophobicContact CE2-CG 4.44Å; V422-L643 HydrophobicContact CG2-CD2 4.09Å; Y425-L643 HydrophobicContact CD1-CD2 3.71Å; Y425-L643 HydrophobicContact CE1-CD2 4.32Å; Y425-L643 HydrophobicContact CG-CD2 4.08Å; T494-L643 CarbonylContact C-O 3.52Å; T494-L643 WeakPolarHBondContact CA-O 3.49Å; L495-L643 PolarHBondContact N-O 3.31Å; L495-L643 PolarHBondContact O-N 3.12Å; I497-L643 HydrophobicContact CB-CD1 4.24Å; I497-L643 HydrophobicContact CD1-CD1 4.38Å; I497-L643 HydrophobicContact CD1-CD2 4.45Å; I497-L643 HydrophobicContact CG1-CD1 4.45Å; F641-L643 HydrophobicContact CB-CD1 4.13Å
644	L	58.8	Low	57.3	Low	37 Å²	37	60.8 Å²	60.8	19%	0.194	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	134.2	171.6	-154.2	81.2	0	0	0	110.7	G127 L133 P492	G127-L644 WeakPolarHBondContact O-CB 3.39Å; G127-L644 PolarHBondContact O-N 3.25Å; L133-L644 WeakPolarHBondContact CD2-O 3.47Å; P492-L644 HydrophobicContact CB-CD1 4.22Å; P492-L644 HydrophobicContact CB-CD2 3.89Å; P492-L644 HydrophobicContact CB-CG 3.89Å; P492-L644 HydrophobicContact CG-CD2 4.34Å
645	H	56.3	Low	55.1	Low	9 Å²	9	65.8 Å²	65.8	4%	0.042	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	136.2	180	168.6	84	0	0	0	110.2	Y425 P492 I493 L495 N647	Y425-H645 AromaticContact CZ-ND1 3.91Å; Y425-H645 WeakPolarHBondContact OH-CB 3.29Å; Y425-H645 PolarHBondContact OH-ND1 2.92Å; P492-H645 CarbonylContact C-O 3.59Å; P492-H645 WeakPolarHBondContact CA-O 3.4Å; I493-H645 PolarHBondContact N-O 3.28Å; I493-H645 PolarHBondContact O-N 3.36Å; L495-H645 HydrophobicContact CD1-CB 3.81Å; L495-H645 HydrophobicContact CG-CB 4.19Å; H645-N647 PolarHBondContact NE2-OD1 2.88Å
646	N	54.5	Low	52.8	Low	18 Å²	18	71 Å²	71	10%	0.096	35%	0.349	C	S	.	.			trans	-137.7	129.3	-178.3	-177.9	-16.3	0	0	0	109.4	M130 P492 N648 Y649	M130-N646 HydrophobicContact SD-CB 3.97Å; P492-N646 HydrophobicContact CB-CB 4.39Å; N646-N648 PolarHBondContact O-N 3.12Å; N646-N648 VanDerWaalsContact O-N 3.16Å; N646-N648 PolarHBondContact OD1-N 3Å; N646-N648 VanDerWaalsContact OD1-N 3.17Å; N646-Y649 WeakPolarHBondContact O-CD2 3.45Å; N646-Y649 WeakPolarHBondContact O-CE2 3.42Å
647	N	43.2	Very low	50.5	Low	50 Å²	50	71 Å²	71	27%	0.267	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-68.7	-12	-175.2	-92.6	-21.3	0	0	0	114.7	T437 H645 Y649	T437-N647 PolarHBondContact OG1-ND2 3.45Å; H645-N647 PolarHBondContact NE2-OD1 2.88Å; N647-Y649 PolarHBondContact O-N 3.39Å
648	N	39.7	Very low	48.6	Very low	43 Å²	43	70.9 Å²	70.9	23%	0.23	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-71.3	8.3	-178.9	-80.2	-29.2	0	0	0	116	N646 F650	N646-N648 PolarHBondContact O-N 3.12Å; N646-N648 VanDerWaalsContact O-N 3.16Å; N646-N648 PolarHBondContact OD1-N 3Å; N646-N648 VanDerWaalsContact OD1-N 3.17Å; N648-F650 PolarHBondContact O-N 3.16Å
649	Y	42.3	Very low	46.6	Very low	51 Å²	51	77.4 Å²	77.4	20%	0.2	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-61.1	-24	179.3	-68.5	-56.2	0	0	0	114.8	M130 N646 N647	M130-Y649 HydrophobicContact CG-CE1 4.4Å; M130-Y649 HydrophobicContact SD-CE1 4.39Å; N646-Y649 WeakPolarHBondContact O-CD2 3.45Å; N646-Y649 WeakPolarHBondContact O-CE2 3.42Å; N647-Y649 PolarHBondContact O-N 3.39Å
650	F	39.2	Very low	44.4	Very low	111 Å²	111	83.6 Å²	83.6	49%	0.487	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-20.2	-177.4	-71.7	-75.7	0	0	0	115.3	I147 N648 T653	I147-F650 HydrophobicContact CG1-CE1 4.34Å; N648-F650 PolarHBondContact O-N 3.16Å; F650-T653 PolarHBondContact O-OG1 3.45Å
651	N	34.2	Very low	42.3	Very low	125 Å²	125	85 Å²	85	67%	0.668	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-14.5	-173.8	-75.1	0.4	0	0	0	114.2	T653	N651-T653 VanDerWaalsContact C-N 3.33Å; N651-T653 PolarHBondContact O-N 3.23Å
652	S	37.1	Very low	40.2	Very low	57 Å²	57	94.6 Å²	94.6	40%	0.399	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-10.3	-175.2	58.9	0	0	0	0	114.9
653	T	37.8	Very low	38	Very low	67 Å²	67	92.8 Å²	92.8	41%	0.411	47%	0.468	S	S	.	.	S	Bend	trans	-78.7	-34.6	174.8	44.8	0	0	0	0	112.7	I151 F650 N651 Q655 R656	I151-T653 HydrophobicContact CD1-CG2 4.47Å; F650-T653 PolarHBondContact O-OG1 3.45Å; N651-T653 VanDerWaalsContact C-N 3.33Å; N651-T653 PolarHBondContact O-N 3.23Å; T653-Q655 VanDerWaalsContact C-N 3.27Å; T653-Q655 PolarHBondContact O-N 3.48Å; T653-R656 PolarHBondContact O-N 2.79Å
654	G	33	Very low	36.3	Very low	44 Å²	44	101.1 Å²	101.1	45%	0.454	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-17.5	-176.7	0	0	0	0	0	115.5
655	Q	33.6	Very low	34.7	Very low	145 Å²	145	107.9 Å²	107.9	68%	0.678	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	2.9	177.2	-79.9	-166.9	-27.2	0	0	114.6	T653 E657 Y659	T653-Q655 VanDerWaalsContact C-N 3.27Å; T653-Q655 PolarHBondContact O-N 3.48Å; Q655-E657 VanDerWaalsContact C-N 3.35Å; Q655-Y659 WeakPolarHBondContact O-CE2 3.35Å
656	R	32.6	Very low	33.7	Very low	203 Å²	203	112.3 Å²	112.3	77%	0.766	57%	0.568	S	S	*	*	S	Bend	trans	-75.7	-20.1	175.8	-93.5	-170.9	166.5	-161.7	-4.7	114.3	T653	T653-R656 PolarHBondContact O-N 2.79Å
657	E	29.1	Very low	32.3	Very low	101 Å²	101	119.2 Å²	119.2	47%	0.472	61%	0.605	S	S	.	*	G	3₁₀ helix	trans	-85.9	-19	-172.3	-60.8	-169.1	154.7	0	0	113.8	Y155 Q655 Y659 L660	Y155-E657 VanDerWaalsContact CE1-OE2 3.24Å; Y155-E657 WeakPolarHBondContact CE1-OE2 3.2Å; Y155-E657 VanDerWaalsContact OH-CD 3.28Å; Y155-E657 PolarHBondContact OH-OE1 3.2Å; Y155-E657 PolarHBondContact OH-OE2 2.99Å; Y155-E657 VanDerWaalsContact OH-OE2 3.08Å; Q655-E657 VanDerWaalsContact C-N 3.35Å; E657-Y659 PolarHBondContact O-N 3.01Å; E657-L660 PolarHBondContact O-N 3.41Å
658	S	28.7	Very low	31.6	Very low	94 Å²	94	120.5 Å²	120.5	66%	0.657	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-58.9	-11.2	173.2	-49.4	0	0	0	0	114.3
659	Y	28.1	Very low	31	Very low	172 Å²	172	124 Å²	124	68%	0.675	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-115.1	1.4	-178.3	-51.3	-78.1	0	0	0	113.4	Q655 E657	Q655-Y659 WeakPolarHBondContact O-CE2 3.35Å; E657-Y659 PolarHBondContact O-N 3.01Å
660	L	27	Very low	30.2	Very low	141 Å²	141	128.5 Å²	128.5	74%	0.738	68%	0.684	S	S	*	*	S	Bend	trans	-111.8	5.2	-176.5	-86.5	165.8	0	0	0	114.5	E657 K662	E657-L660 PolarHBondContact O-N 3.41Å; L660-K662 PolarHBondContact O-N 2.92Å
661	Q	26.9	Very low	29.7	Very low	190 Å²	190	129.1 Å²	129.1	89%	0.888	69%	0.693	S	S	*	*			trans	-100.4	51.5	177.7	-159.1	168.2	6.1	0	0	113.1
662	K	26.1	Very low	29.3	Very low	202 Å²	202	131.1 Å²	131.1	88%	0.878	70%	0.698	S	S	*	*			trans	-146.7	49.5	173.5	-155.8	-174	175.3	179.3	0	115	L660	L660-K662 PolarHBondContact O-N 2.92Å
663	S	24.2	Very low	28.8	Very low	88 Å²	88	135.5 Å²	135.5	62%	0.615	72%	0.723	S	S	*	*			trans	-158.2	87.6	165	58.6	0	0	0	0	113.4
664	I	29.7	Very low	28.1	Very low	176 Å²	176	143 Å²	143	90%	0.903	75%	0.75	S	S	*	*			trans	-125.5	127.4	151.5	-61.1	-178.2	0	0	0	106
665	F	26.8	Very low	27.8	Very low	179 Å²	179	144.1 Å²	144.1	79%	0.785	76%	0.762	S	S	*	*			trans	-87.5	-176.4	-171.6	-60.1	-93.3	0	0	0	111.2
666	P	33.4	Very low	27.4	Very low	102 Å²	102	142.7 Å²	142.7	66%	0.662	77%	0.768	S	S	*	*			cis	-136.3	-175.4	-1.1	38.4	-18.7	0	0	0	116.3
667	N	25.4	Very low	27.1	Very low	162 Å²	162	139 Å²	139	87%	0.866	77%	0.77	S	S	*	*			trans	112.3	139	154.7	-60.7	-18.5	0	0	0	117.5
668	G	29.8	Very low	27	Very low	78 Å²	78	142 Å²	142	80%	0.804	78%	0.784	S	S	*	*			trans	117.4	117.6	179.2	0	0	0	0	0	111.9
669	C	25.7	Very low	26.8	Very low	117 Å²	117	145.3 Å²	145.3	79%	0.791	79%	0.794	S	S	*	*			trans	-97.9	169.6	-176.1	-60.9	0	0	0	0	113.1
670	D	26.9	Very low	26.7	Very low	144 Å²	144	143.7 Å²	143.7	77%	0.77	79%	0.792	S	S	*	*			trans	108.5	119.8	144.6	-60.2	-28.8	0	0	0	120.9
671	N	26.9	Very low	26.7	Very low	124 Å²	124	145.3 Å²	145.3	66%	0.663	80%	0.796	S	S	*	*			trans	75.1	104.3	148.8	-67.5	-48	0	0	0	122.5
672	Q	26.5	Very low	26.6	Very low	167 Å²	167	142.8 Å²	142.8	78%	0.78	78%	0.784	S	S	*	*				64.9	92.5	124.4	-60.3	175.9	47	0	0	119.7
673	T	27.4	Very low	26.5	Very low	150 Å²	150	141 Å²	141	92%	0.92	78%	0.779	S	S	*	*				-161.8	152.7	120.4	3.8	0	0	0	0	111.8
674	F	23.2	Very low	26.6	Very low	223 Å²	223	143.1 Å²	143.1	98%	0.978	78%	0.782	S	S	*	*			trans	-76.7	127.7	172.1	-99.7	-109.4	0	0	0	110.4
675	G	25.4	Very low	26.4	Very low	69 Å²	69	143.4 Å²	143.4	71%	0.711	78%	0.78	S	S	*	*			trans	-172.4	96.9	175.3	0	0	0	0	0	112.2
676	S	25.7	Very low	26.3	Very low	115 Å²	115	141 Å²	141	80%	0.804	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-67.4	125.2	174.4	-55.3	0	0	0	0	109.9	E678	S676-E678 PolarHBondContact O-N 2.89Å
677	P	27.2	Very low	25.8	Very low	126 Å²	126	142.1 Å²	142.1	82%	0.818	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-66.8	125.3	178.1	26.6	-33.2	0	0	0	110.2	L679	P677-L679 PolarHBondContact O-N 3.38Å
678	E	25.2	Very low	25.9	Very low	162 Å²	162	140.5 Å²	140.5	76%	0.757	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-59.7	129.6	179.6	-61.7	-175	134	0	0	110.7	S676 Q680	S676-E678 PolarHBondContact O-N 2.89Å; E678-Q680 PolarHBondContact O-N 3.24Å
679	L	25.2	Very low	25.6	Very low	164 Å²	164	144 Å²	144	86%	0.859	77%	0.769	S	S	*	*			trans	-76.1	65.8	171	-160.4	88.5	0	0	0	109.8	P677 Q681	P677-L679 PolarHBondContact O-N 3.38Å; L679-Q681 PolarHBondContact O-N 3.21Å
680	Q	25.6	Very low	25.6	Very low	139 Å²	139	141.7 Å²	141.7	65%	0.65	77%	0.765	S	S	*	*			trans	-67.2	92	-175.2	-167.7	176.4	92.1	0	0	109.8	E678 Q682	E678-Q680 PolarHBondContact O-N 3.24Å; Q680-Q682 VanDerWaalsContact C-N 3.28Å; Q680-Q682 PolarHBondContact O-N 3.45Å
681	Q	27	Very low	25.4	Very low	175 Å²	175	139.9 Å²	139.9	82%	0.818	77%	0.77	S	S	*	*			trans	-71.5	81.7	-174	-168.3	174.7	79.4	0	0	110.3	L679 Q683	L679-Q681 PolarHBondContact O-N 3.21Å; Q681-Q683 PolarHBondContact O-N 3.36Å
682	Q	25.3	Very low	25.4	Very low	137 Å²	137	143 Å²	143	64%	0.64	77%	0.774	S	S	*	*			trans	-56.3	108	-179.4	-76	-174.1	-17.1	0	0	110.8	Q680	Q680-Q682 VanDerWaalsContact C-N 3.28Å; Q680-Q682 PolarHBondContact O-N 3.45Å
683	Q	24.9	Very low	25.4	Very low	164 Å²	164	140.8 Å²	140.8	77%	0.766	77%	0.773	S	S	*	*			trans	-65	134.6	164.8	-66.7	179.9	-22.9	0	0	108.4	Q681 Q685	Q681-Q683 PolarHBondContact O-N 3.36Å; Q683-Q685 PolarHBondContact O-N 3.24Å
684	I	26.4	Very low	25.4	Very low	133 Å²	133	140 Å²	140	68%	0.682	76%	0.763	S	S	*	*			trans	-65.1	101.1	176.8	-61.4	174.4	0	0	0	108.4	M686	I684-M686 PolarHBondContact O-N 3.39Å; I684-M686 VanDerWaalsContact O-N 3.11Å
685	Q	23.7	Very low	25.6	Very low	181 Å²	181	136.6 Å²	136.6	85%	0.846	76%	0.755	S	S	*	*			trans	-72.3	99.2	176.7	-73.2	-175	-37.2	0	0	110.2	Q683 N687	Q683-Q685 PolarHBondContact O-N 3.24Å; Q685-N687 VanDerWaalsContact C-N 3.31Å; Q685-N687 PolarHBondContact O-N 3.12Å; Q685-N687 VanDerWaalsContact O-N 3.11Å
686	M	24.8	Very low	25.5	Very low	128 Å²	128	144.1 Å²	144.1	63%	0.631	76%	0.762	S	S	*	*			trans	-77.4	88.7	158	-70.3	-171.5	177.8	0	0	108.6	I684 V688	I684-M686 PolarHBondContact O-N 3.39Å; I684-M686 VanDerWaalsContact O-N 3.11Å; M686-V688 PolarHBondContact O-N 3.09Å
687	N	24.2	Very low	25.8	Very low	126 Å²	126	142.6 Å²	142.6	67%	0.674	75%	0.749	S	S	*	*			trans	-71.3	106.4	175	178.7	21.4	0	0	0	110.3	Q685 N689	Q685-N687 VanDerWaalsContact C-N 3.31Å; Q685-N687 PolarHBondContact O-N 3.12Å; Q685-N687 VanDerWaalsContact O-N 3.11Å; N687-N689 PolarHBondContact OD1-ND2 3.42Å
688	V	27.6	Very low	25.8	Very low	128 Å²	128	146.4 Å²	146.4	78%	0.776	75%	0.749	S	S	*	*			trans	-132.2	84.2	173	-172.8	0	0	0	0	109.2	M686	M686-V688 PolarHBondContact O-N 3.09Å
689	N	23.6	Very low	25.9	Very low	152 Å²	152	143.7 Å²	143.7	81%	0.813	74%	0.743	S	S	*	*			trans	-78.1	116.2	168.7	-71.4	-37.3	0	0	0	109.5	N687	N687-N689 PolarHBondContact OD1-ND2 3.42Å
690	G	24.6	Very low	25.9	Very low	68 Å²	68	140.6 Å²	140.6	70%	0.701	74%	0.735	S	S	*	*			trans	179.8	113.2	175.6	0	0	0	0	0	114.9
691	A	23.6	Very low	25.9	Very low	106 Å²	106	143.9 Å²	143.9	88%	0.876	74%	0.743	S	S	*	*			trans	38.6	104.2	159.4	0	0	0	0	0	119.9
692	Y	25.3	Very low	25.7	Very low	191 Å²	191	139.8 Å²	139.8	75%	0.749	73%	0.732	S	S	*	*			trans	-65.6	161.4	157.7	-83.8	-71.3	0	0	0	111.8
693	P	28.5	Very low	25.8	Very low	119 Å²	119	139 Å²	139	77%	0.773	74%	0.738	S	S	*	*			cis	-141.7	166	47.2	39.5	-19.6	0	0	0	119.6
694	N	27.3	Very low	25.8	Very low	133 Å²	133	141.9 Å²	141.9	71%	0.711	74%	0.742	S	S	*	*			trans	-71.8	139.7	173.3	-54.2	-54.2	0	0	0	111.6
695	L	26.5	Very low	25.8	Very low	152 Å²	152	142 Å²	142	80%	0.796	74%	0.743	S	S	*	*			trans	-147.1	26.2	170.9	-147.4	85.8	0	0	0	116.2
696	W	24.2	Very low	25.9	Very low	228 Å²	228	140.3 Å²	140.3	86%	0.864	75%	0.745	S	S	*	*			trans	-136.8	68.4	167.8	-84.4	79.2	0	0	0	113
697	P	31.5	Very low	26.1	Very low	82 Å²	82	139.7 Å²	139.7	53%	0.532	75%	0.75	S	S	.	*			trans	-86	147.3	155.9	35.5	-30.1	0	0	0	110.2	V699	P697-V699 PolarHBondContact O-N 3.07Å
698	Y	27.4	Very low	26.3	Very low	206 Å²	206	137.4 Å²	137.4	81%	0.808	76%	0.756	S	S	*	*	S	Bend	trans	-79.8	79.3	156.3	-83.8	-65.8	0	0	0	109.2
699	V	26.1	Very low	26.3	Very low	105 Å²	105	137.9 Å²	137.9	64%	0.636	76%	0.76	S	S	*	*			trans	60	107.6	174.6	-169.8	0	0	0	0	115.3	P697 Y701	P697-V699 PolarHBondContact O-N 3.07Å; V699-Y701 HydrophobicContact CG1-CE2 4.16Å
700	S	26.8	Very low	26.4	Very low	100 Å²	100	136.8 Å²	136.8	70%	0.699	76%	0.758	S	S	*	*			trans	-141	135.1	155	-65.6	0	0	0	0	107.7
701	Y	25	Very low	26.6	Very low	207 Å²	207	140.5 Å²	140.5	81%	0.812	76%	0.761	S	S	*	*			trans	-73.6	153.6	-163.4	-74.7	-95	0	0	0	113.3	V699	V699-Y701 HydrophobicContact CG1-CE2 4.16Å
702	P	23.1	Very low	26.6	Very low	90 Å²	90	141.4 Å²	141.4	58%	0.584	76%	0.755	S	S	*	*			trans	-71	133.2	179	28.8	-34.4	0	0	0	111.4	W704	P702-W704 PolarHBondContact O-N 3.08Å; P702-W704 VanDerWaalsContact O-N 3.13Å
703	P	27.5	Very low	26.7	Very low	120 Å²	120	137.4 Å²	137.4	78%	0.779	76%	0.761	S	S	*	*			trans	-83.9	86.5	178.6	33.1	-34.1	0	0	0	111.3	I705	P703-I705 PolarHBondContact O-N 2.72Å; P703-I705 VanDerWaalsContact O-N 3.15Å
704	W	24.5	Very low	26.6	Very low	224 Å²	224	135 Å²	135	85%	0.848	76%	0.758	S	S	*	*			trans	-85	53.2	166.9	45.6	-76.9	0	0	0	111.5	P702	P702-W704 PolarHBondContact O-N 3.08Å; P702-W704 VanDerWaalsContact O-N 3.13Å
705	I	26.7	Very low	26.5	Very low	137 Å²	137	136.4 Å²	136.4	70%	0.703	77%	0.765	S	S	*	*			trans	-129.1	110.6	162.6	-66.2	89.6	0	0	0	108.5	P703	P703-I705 PolarHBondContact O-N 2.72Å; P703-I705 VanDerWaalsContact O-N 3.15Å
706	V	25.7	Very low	26.8	Very low	144 Å²	144	134.9 Å²	134.9	87%	0.873	76%	0.764	S	S	*	*			trans	-122.6	117.9	155.9	169.3	0	0	0	0	104.4
707	P	28.5	Very low	26.9	Very low	116 Å²	116	130.1 Å²	130.1	75%	0.753	76%	0.76	S	S	*	*				-144.6	170.4	104.7	38.8	-24.7	0	0	0	113.9
708	G	29.3	Very low	26.9	Very low	77 Å²	77	129.9 Å²	129.9	79%	0.794	77%	0.773	S	S	*	*			trans	124.5	59.2	163.2	0	0	0	0	0	116.9
709	T	27	Very low	26.9	Very low	139 Å²	139	125.6 Å²	125.6	85%	0.853	77%	0.768	S	S	*	*			trans	-70.9	142.1	160.2	46.8	0	0	0	0	111.4
710	V	26.5	Very low	27.1	Very low	128 Å²	128	127.7 Å²	127.7	78%	0.776	78%	0.781	S	S	*	*			trans	-174.1	108.9	139.1	137.5	0	0	0	0	111.6
711	I	27.5	Very low	27.2	Very low	147 Å²	147	126.1 Å²	126.1	75%	0.754	78%	0.781	S	S	*	*			trans	26	158.3	131.5	11	171.1	0	0	0	121.5
712	T	24.3	Very low	27.3	Very low	125 Å²	125	124.2 Å²	124.2	77%	0.767	79%	0.785	S	S	*	*			cis	-155.1	146.4	7.7	-35.8	0	0	0	0	112.6
713	A	27.7	Very low	27.3	Very low	106 Å²	106	126.3 Å²	126.3	88%	0.876	80%	0.795	S	S	*	*			trans	177	140.1	137.2	0	0	0	0	0	109.3
714	G	26.6	Very low	27.3	Very low	68 Å²	68	129.2 Å²	129.2	70%	0.701	80%	0.799	S	S	*	*			cis	162.7	107.5	-6	0	0	0	0	0	109.7
715	L	25.4	Very low	27.3	Very low	163 Å²	163	126.5 Å²	126.5	85%	0.853	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-83.8	150.5	-176.2	-82.7	85.7	0	0	0	113.1
716	P	31.4	Very low	27.3	Very low	120 Å²	120	125.8 Å²	125.8	78%	0.779	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-85.1	153.5	144.2	35.3	-30.2	0	0	0	111.3
717	V	26.9	Very low	27.1	Very low	128 Å²	128	125.5 Å²	125.5	78%	0.776	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-99.8	146.1	-167.6	174.3	0	0	0	0	112.8	T719	V717-T719 HydrophobicContact CG1-CG2 3.74Å
718	G	30.6	Very low	27.1	Very low	78 Å²	78	127.5 Å²	127.5	80%	0.804	80%	0.795	S	S	*	*			trans	-132.5	133	158.3	0	0	0	0	0	109.9
719	T	27.6	Very low	26.8	Very low	116 Å²	116	129.5 Å²	129.5	71%	0.712	79%	0.792	S	S	*	*			trans	-115.6	123.1	-169.8	50.8	0	0	0	0	113.1	V717	V717-T719 HydrophobicContact CG1-CG2 3.74Å
720	T	30.5	Very low	27	Very low	148 Å²	148	129.4 Å²	129.4	91%	0.908	79%	0.791	S	S	*	*			trans	164.7	154.9	136.8	37.9	0	0	0	0	110.3
721	G	28.7	Very low	27	Very low	67 Å²	67	130.4 Å²	130.4	69%	0.691	79%	0.792	S	S	*	*			trans	98.5	89.8	155.5	0	0	0	0	0	117.1
722	D	27.1	Very low	26.9	Very low	168 Å²	168	126.8 Å²	126.8	90%	0.898	79%	0.791	S	S	*	*			trans	46	126.6	139.8	-52.4	-23.7	0	0	0	122.1
723	V	24	Very low	26.9	Very low	133 Å²	133	129 Å²	129	81%	0.806	80%	0.797	S	S	*	*			trans	-92.3	125.1	167.8	175	0	0	0	0	109.7
724	Q	27.7	Very low	26.9	Very low	181 Å²	181	129.1 Å²	129.1	85%	0.846	79%	0.789	S	S	*	*			trans	-121.5	115.3	158.6	-102.9	-173.5	-3.4	0	0	111.1
725	Q	23.5	Very low	26.9	Very low	168 Å²	168	133 Å²	133	79%	0.785	80%	0.799	S	S	*	*			trans	-82.9	119	164	-70	178.3	-34.6	0	0	109
726	T	26.8	Very low	27	Very low	122 Å²	122	128.4 Å²	128.4	75%	0.748	79%	0.791	S	S	*	*			trans	-104.4	97.5	164.1	54.6	0	0	0	0	109.5
727	N	21.7	Very low	26.7	Very low	138 Å²	138	128.1 Å²	128.1	74%	0.738	80%	0.798	S	S	*	*			trans	-62	137.8	164	-68.4	-48.4	0	0	0	109.1
728	N	27.6	Very low	26.7	Very low	157 Å²	157	127.8 Å²	127.8	84%	0.84	80%	0.801	S	S	*	*			trans	-142.9	107.1	156.4	-106.7	-29.9	0	0	0	109.8
729	V	24	Very low	26.5	Very low	120 Å²	120	130.4 Å²	130.4	73%	0.727	81%	0.807	S	S	*	*			trans	-96.8	122.8	172.8	174.3	0	0	0	0	107.6
730	V	30.3	Very low	26.5	Very low	137 Å²	137	128.4 Å²	128.4	83%	0.83	81%	0.81	S	S	*	*			trans	-127.2	131.4	165.2	-178.1	0	0	0	0	108.2
731	N	26.7	Very low	26.4	Very low	149 Å²	149	124.6 Å²	124.6	80%	0.797	80%	0.8	S	S	*	*			trans	-89.5	145.4	-167.9	-70.9	-49.2	0	0	0	113.4
732	G	24.9	Very low	26.1	Very low	70 Å²	70	129.6 Å²	129.6	72%	0.722	81%	0.811	S	S	*	*				90.6	91.6	124	0	0	0	0	0	118.9
733	L	25.7	Very low	26.3	Very low	173 Å²	173	126.9 Å²	126.9	91%	0.906	81%	0.805	S	S	*	*			trans	-147.6	122.4	137.4	-148.6	77.3	0	0	0	111
734	P	27.2	Very low	26.5	Very low	108 Å²	108	128.3 Å²	128.3	70%	0.701	81%	0.808	S	S	*	*			trans	-96.7	-171.4	173.8	38.2	-33.5	0	0	0	112.1
735	V	27.6	Very low	26.3	Very low	150 Å²	150	130.4 Å²	130.4	91%	0.909	81%	0.809	S	S	*	*			trans	76.2	132.1	-179.9	-168.2	0	0	0	0	113.5
736	G	26.9	Very low	26.5	Very low	66 Å²	66	125.5 Å²	125.5	68%	0.68	80%	0.804	S	S	*	*			cis	-179.3	153	-6	0	0	0	0	0	111.2
737	A	23.7	Very low	26.4	Very low	113 Å²	113	129.1 Å²	129.1	93%	0.934	81%	0.81	S	S	*	*			trans	-87.6	131.9	-178.3	0	0	0	0	0	111.9
738	S	27.3	Very low	26.5	Very low	121 Å²	121	129.3 Å²	129.3	85%	0.846	81%	0.805	S	S	*	*			trans	-142.4	140.2	169.8	59.3	0	0	0	0	111.6
739	S	26.1	Very low	26.8	Very low	133 Å²	133	127.6 Å²	127.6	93%	0.93	80%	0.802	S	S	*	*			trans	-90.1	150	-178.5	-176.7	0	0	0	0	111.7
740	G	27.6	Very low	26.8	Very low	75 Å²	75	130.8 Å²	130.8	77%	0.773	81%	0.809	S	S	*	*			trans	150.1	128.7	173.3	0	0	0	0	0	111
741	G	28.5	Very low	26.7	Very low	68 Å²	68	132 Å²	132	70%	0.701	81%	0.809	S	S	*	*			cis	152.6	122.1	2.2	0	0	0	0	0	107.4	S743	G741-S743 PolarHBondContact O-N 2.94Å
742	D	24.3	Very low	26.8	Very low	171 Å²	171	130.7 Å²	130.7	91%	0.914	81%	0.809	S	S	*	*			trans	-64.4	134.8	-179.2	-86	-53.5	0	0	0	110.7
743	S	30	Very low	26.8	Very low	111 Å²	111	134.6 Å²	134.6	78%	0.776	81%	0.814	S	S	*	*			trans	-145.9	115.7	170.6	-76.3	0	0	0	0	109.9	G741	G741-S743 PolarHBondContact O-N 2.94Å
744	L	28	Very low	26.9	Very low	163 Å²	163	134.7 Å²	134.7	85%	0.853	81%	0.809	S	S	*	*	S	Bend	trans	-86.5	110.8	179.1	-149.2	78.1	0	0	0	107.8
745	Y	24.8	Very low	26.9	Very low	225 Å²	225	135.2 Å²	135.2	88%	0.882	81%	0.811	S	S	*	*	S	Bend	trans	71.6	139.8	-175	-60.5	-98.8	0	0	0	116.1
746	G	26.5	Very low	27	Very low	66 Å²	66	135.5 Å²	135.5	68%	0.68	80%	0.802	S	S	*	*			trans	127.7	108.7	-174.5	0	0	0	0	0	109.6
747	F	24.8	Very low	27	Very low	197 Å²	197	138.1 Å²	138.1	86%	0.864	80%	0.801	S	S	*	*				75.7	149.7	70.1	-91.4	-103.9	0	0	0	115.3
748	F	24	Very low	27.2	Very low	143 Å²	143	140.7 Å²	140.7	63%	0.627	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-64.8	147.6	-160.6	-59.7	-101.8	0	0	0	114.2
749	P	33.9	Very low	27.2	Very low	120 Å²	120	140.1 Å²	140.1	78%	0.779	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-80.7	116	160.2	32.3	-29.5	0	0	0	110.3
750	E	23.2	Very low	27.3	Very low	187 Å²	187	137.2 Å²	137.2	87%	0.874	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-70.2	148.2	156.7	-64.7	172.7	114.4	0	0	109.3
751	L	29.1	Very low	27.3	Very low	162 Å²	162	141.9 Å²	141.9	85%	0.848	79%	0.788	S	S	*	*			trans	-118.3	118	168.5	-131.5	78.2	0	0	0	108.9
752	P	29	Very low	27.3	Very low	122 Å²	122	146.3 Å²	146.3	79%	0.792	79%	0.792	S	S	*	*			trans	-77.8	146.1	-178.7	30.6	-34.2	0	0	0	112.3
753	N	25.2	Very low	27.5	Very low	152 Å²	152	142.9 Å²	142.9	81%	0.813	78%	0.778	S	S	*	*			trans	-78.7	147.8	172.6	-67.4	-54.1	0	0	0	111.6
754	Q	28.4	Very low	27.4	Very low	175 Å²	175	141.2 Å²	141.2	82%	0.818	76%	0.76	S	S	*	*				-179.4	128.2	114.4	-100.5	171.4	10.5	0	0	114
755	T	26.8	Very low	27.6	Very low	119 Å²	119	137.8 Å²	137.8	73%	0.73	75%	0.747	S	S	*	*			trans	33.2	148.9	132.1	58.6	0	0	0	0	121.3
756	Q	29.1	Very low	27.5	Very low	156 Å²	156	137.2 Å²	137.2	73%	0.729	75%	0.745	S	S	*	*			cis	-167.4	146.2	29.6	-147.1	176.8	4.5	0	0	112.3
757	N	27.3	Very low	27.5	Very low	122 Å²	122	142.6 Å²	142.6	65%	0.652	75%	0.752	S	S	*	*			trans	57.8	149.9	159	-63.9	-9.7	0	0	0	118.3
758	Q	26.5	Very low	27.6	Very low	167 Å²	167	138.8 Å²	138.8	78%	0.78	75%	0.745	S	S	*	*			cis	-168.4	173.7	-2.4	-109.3	163.9	-8.4	0	0	106.5
759	S	28.6	Very low	27.7	Very low	109 Å²	109	141.2 Å²	141.2	76%	0.762	76%	0.758	S	S	*	*			cis	-167.6	147	-3.3	42.8	0	0	0	0	109.9
760	G	27.9	Very low	27.3	Very low	72 Å²	72	140.2 Å²	140.2	74%	0.742	75%	0.754	S	S	*	*			trans	82.6	145.6	171.6	0	0	0	0	0	115.4
761	D	27.5	Very low	27.4	Very low	173 Å²	173	142.1 Å²	142.1	93%	0.925	75%	0.753	S	S	*	*			cis	-150.7	163.2	-11.1	-126.8	-32.2	0	0	0	110.6
762	M	27.7	Very low	27.1	Very low	161 Å²	161	140.5 Å²	140.5	79%	0.793	75%	0.754	S	S	*	*			trans	-119.1	111.4	-150.7	-152.9	166.6	70.7	0	0	118
763	T	29	Very low	27.1	Very low	99 Å²	99	141.1 Å²	141.1	61%	0.607	75%	0.749	S	S	*	*			trans	60.3	143.5	143.9	62.2	0	0	0	0	122.3
764	N	27.3	Very low	27	Very low	75 Å²	75	138.9 Å²	138.9	40%	0.401	75%	0.745	S	S	.	*				-156	152.8	106	-128.1	34.5	0	0	0	117.5	S812	N764-S812 VanDerWaalsContact CG-OG 3.32Å; N764-S812 PolarHBondContact ND2-O 3.27Å; N764-S812 PolarHBondContact ND2-OG 3.27Å; N764-S812 WeakPolarHBondContact OD1-CB 3.43Å; N764-S812 PolarHBondContact OD1-OG 3.03Å
765	P	32.4	Very low	26.8	Very low	91 Å²	91	138 Å²	138	59%	0.591	75%	0.746	S	S	*	*			trans	-118.2	169	-169.1	43.1	-33.3	0	0	0	115.9
766	Y	24.3	Very low	26.7	Very low	214 Å²	214	138.2 Å²	138.2	84%	0.839	75%	0.749	S	S	*	*			trans	-130.3	156.8	146.3	-88.5	-91	0	0	0	109.4
767	H	25.7	Very low	26.5	Very low	179 Å²	179	135.1 Å²	135.1	83%	0.829	74%	0.744	S	S	*	*			trans	56.3	104.7	178.3	-72.5	-79.6	0	0	0	118.4
768	T	26.6	Very low	26.5	Very low	116 Å²	116	132.5 Å²	132.5	71%	0.712	75%	0.747	S	S	*	*			trans	-163.7	133.9	137.7	11.5	0	0	0	0	110.8
769	H	26.2	Very low	26.6	Very low	195 Å²	195	128.7 Å²	128.7	90%	0.903	74%	0.736	S	S	*	*			trans	-159	52.7	154.4	-93.8	-31.2	0	0	0	111.1	R771	H769-R771 PolarHBondContact O-N 2.97Å
770	S	25.9	Very low	26.9	Very low	99 Å²	99	129.5 Å²	129.5	69%	0.692	74%	0.739	S	S	*	*			trans	-65.7	112	159.1	38.9	0	0	0	0	109	C772	S770-C772 PolarHBondContact O-N 2.63Å; S770-C772 VanDerWaalsContact O-N 3.08Å
771	R	25.4	Very low	26.9	Very low	226 Å²	226	131.3 Å²	131.3	85%	0.853	74%	0.735	S	S	*	*			trans	-77.6	91.8	177.1	-74.6	-172.6	177.9	-176.7	-0.3	111.1	H769 I773	H769-R771 PolarHBondContact O-N 2.97Å; R771-I773 HydrophobicContact CB-CG1 4.41Å; R771-I773 PolarHBondContact O-N 3.15Å
772	C	23.5	Very low	26.9	Very low	128 Å²	128	130.1 Å²	130.1	87%	0.865	73%	0.728	S	S	*	*			trans	-70.5	114.6	153.8	-75.1	0	0	0	0	108.6	S770	S770-C772 PolarHBondContact O-N 2.63Å; S770-C772 VanDerWaalsContact O-N 3.08Å
773	I	27.5	Very low	26.7	Very low	135 Å²	135	127.2 Å²	127.2	69%	0.692	72%	0.724	S	S	*	*			trans	-110	112.3	171.6	-67.8	174	0	0	0	107.9	R771	R771-I773 HydrophobicContact CB-CG1 4.41Å; R771-I773 PolarHBondContact O-N 3.15Å
774	S	23	Very low	26.6	Very low	105 Å²	105	130.3 Å²	130.3	73%	0.734	73%	0.732	S	S	*	*			trans	-71.1	142	163.7	51.8	0	0	0	0	110.9
775	L	24.4	Very low	26.5	Very low	158 Å²	158	135.4 Å²	135.4	83%	0.827	75%	0.753	S	S	*	*			trans	155.4	156.4	158.3	-89	160.3	0	0	0	108.8
776	P	25.9	Very low	26.3	Very low	122 Å²	122	135.9 Å²	135.9	79%	0.792	76%	0.759	S	S	*	*			cis	-120.9	-179.3	-47.9	33.6	-17.7	0	0	0	111.5
777	S	23.8	Very low	26.3	Very low	91 Å²	91	134.4 Å²	134.4	64%	0.636	77%	0.765	S	S	*	*			trans	-106.2	132.5	-176.7	56.5	0	0	0	0	114.3
778	G	27.6	Very low	26.6	Very low	68 Å²	68	133.1 Å²	133.1	70%	0.701	76%	0.763	S	S	*	*			trans	140.6	127.7	160.2	0	0	0	0	0	115.6
779	P	29.6	Very low	26.5	Very low	87 Å²	87	133.8 Å²	133.8	57%	0.565	77%	0.767	S	S	*	*			trans	-101.5	132.4	173.1	36.5	-31.1	0	0	0	112.7	Y11	Y11-P779 WeakPolarHBondContact OH-CB 3.38Å; Y11-P779 WeakPolarHBondContact OH-CG 3.48Å
780	P	33.4	Very low	26.7	Very low	125 Å²	125	129.1 Å²	129.1	81%	0.812	76%	0.762	S	S	*	*			trans	-83	151.3	168.2	33.3	-33.1	0	0	0	111.8
781	T	28.9	Very low	26.9	Very low	110 Å²	110	131.7 Å²	131.7	68%	0.675	77%	0.768	S	S	*	*			trans	-128	108.9	168.5	52.9	0	0	0	0	111.4
782	L	26.3	Very low	27	Very low	148 Å²	148	130.3 Å²	130.3	78%	0.775	77%	0.771	S	S	*	*			trans	59.9	96	160.9	-57.6	173.6	0	0	0	117.3
783	S	24.5	Very low	27.2	Very low	101 Å²	101	133.2 Å²	133.2	71%	0.706	77%	0.773	S	S	*	*			trans	-150.9	150.8	143	-110.8	0	0	0	0	109.8
784	E	27.1	Very low	27.1	Very low	163 Å²	163	135 Å²	135	76%	0.762	78%	0.778	S	S	*	*			trans	42.6	106.8	149.5	-69.2	135.8	162.9	0	0	121.5
785	E	25	Very low	27.2	Very low	182 Å²	182	139.6 Å²	139.6	85%	0.85	78%	0.779	S	S	*	*				33.9	101.7	103.5	-144.6	72.9	-157.9	0	0	118.3
786	S	27.7	Very low	27.2	Very low	102 Å²	102	138.3 Å²	138.3	71%	0.713	77%	0.773	S	S	*	*			trans	166.4	81.3	138.7	43.4	0	0	0	0	113.7	I788	S786-I788 VanDerWaalsContact C-N 3.29Å; S786-I788 PolarHBondContact O-N 2.89Å
787	D	25	Very low	27.2	Very low	182 Å²	182	138.8 Å²	138.8	97%	0.973	77%	0.769	S	S	*	*			trans	-75.9	79	164.7	-90.6	-40	0	0	0	110.7
788	I	31.2	Very low	27.2	Very low	153 Å²	153	139.4 Å²	139.4	79%	0.785	77%	0.772	S	S	*	*			trans	-104.6	111.8	164.3	-59.3	-177	0	0	0	108.9	S786 A790	S786-I788 VanDerWaalsContact C-N 3.29Å; S786-I788 PolarHBondContact O-N 2.89Å; I788-A790 PolarHBondContact O-N 2.76Å
789	T	25.3	Very low	27.3	Very low	129 Å²	129	143.4 Å²	143.4	79%	0.791	78%	0.776	S	S	*	*			trans	-66.7	115.1	179.9	49.8	0	0	0	0	112.4
790	A	30.5	Very low	27.1	Very low	98 Å²	98	143.4 Å²	143.4	81%	0.81	78%	0.778	S	S	*	*			trans	-106.2	137.2	158.5	0	0	0	0	0	109.4	I788	I788-A790 PolarHBondContact O-N 2.76Å
791	N	29.3	Very low	26.8	Very low	153 Å²	153	144.9 Å²	144.9	82%	0.818	78%	0.779	S	S	*	*			trans	-80.7	151.6	-162.2	-71.3	-62.5	0	0	0	114.6
792	Q	28.1	Very low	26.6	Very low	196 Å²	196	146.8 Å²	146.8	92%	0.916	79%	0.785	S	S	*	*			trans	-65.5	140.5	160	-68.4	-179.6	-28.8	0	0	110
793	Q	26.5	Very low	26.7	Very low	190 Å²	190	147.8 Å²	147.8	89%	0.888	78%	0.783	S	S	*	*			trans	-117	95	179.5	-171	171.4	-4.2	0	0	111.4
794	E	25.9	Very low	26.9	Very low	171 Å²	171	152 Å²	152	80%	0.799	79%	0.785	S	S	*	*			trans	-101.9	152.2	143	-55.2	-168.9	155.4	0	0	106.3
795	R	25.7	Very low	26.8	Very low	203 Å²	203	154 Å²	154	77%	0.766	79%	0.791	S	S	*	*			cis	-162.8	143.9	20.8	-162.6	167.9	176.9	178.3	1.9	110.8
796	N	24.4	Very low	26.8	Very low	131 Å²	131	156.5 Å²	156.5	70%	0.701	79%	0.793	S	S	*	*			trans	62.5	153.9	169.4	-65.9	10	0	0	0	115.3
797	D	26.5	Very low	26.9	Very low	131 Å²	131	156.3 Å²	156.3	70%	0.701	79%	0.789	S	S	*	*			cis	-148.6	149.9	25	-114.7	-45.5	0	0	0	114.5
798	C	23.8	Very low	26.9	Very low	105 Å²	105	154 Å²	154	71%	0.709	78%	0.782	S	S	*	*			trans	60.7	150.9	142.4	-72.3	0	0	0	0	125.3
799	I	28.5	Very low	26.7	Very low	152 Å²	152	151.4 Å²	151.4	78%	0.779	77%	0.773	S	S	*	*			trans	83.7	99.5	154.8	-64.3	149.2	0	0	0	119.9
800	S	25.6	Very low	26.7	Very low	87 Å²	87	151.3 Å²	151.3	61%	0.608	77%	0.772	S	S	*	*			trans	33.5	134.6	141.5	74.1	0	0	0	0	121.3
801	N	27.8	Very low	26.5	Very low	155 Å²	155	152.5 Å²	152.5	83%	0.829	77%	0.772	S	S	*	*				-156.7	165.6	56.6	-100.6	-59.4	0	0	0	115.2
802	N	24.1	Very low	26.2	Very low	151 Å²	151	148.2 Å²	148.2	81%	0.807	75%	0.754	S	S	*	*			trans	-107.2	173.6	-179.1	-86.6	-50.7	0	0	0	113.2
803	K	27.9	Very low	26.2	Very low	169 Å²	169	146.2 Å²	146.2	74%	0.735	75%	0.749	S	S	*	*			trans	87.9	140	172.8	-51.7	165.3	170	-174.2	0	113.9
804	Y	29	Very low	26.2	Very low	189 Å²	189	141.5 Å²	141.5	74%	0.741	74%	0.742	S	S	*	*			cis	-127.8	164.7	-0.8	-61.2	-92.6	0	0	0	108.3
805	F	26.2	Very low	26.2	Very low	204 Å²	204	137 Å²	137	90%	0.895	74%	0.741	S	S	*	*			cis	-134.4	-176.2	27.8	-114.4	-93.9	0	0	0	113.4
806	R	24.2	Very low	26.2	Very low	236 Å²	236	132 Å²	132	89%	0.891	74%	0.738	S	S	*	*			trans	-136.6	-178.1	-169.3	-116	-153.8	168.5	-169.8	-0.2	112.2
807	P	29.8	Very low	26.2	Very low	97 Å²	97	131.2 Å²	131.2	63%	0.63	74%	0.737	S	S	*	*			trans	-127.6	-171.9	-137.6	46.6	-31.3	0	0	0	115.7
808	V	26	Very low	26.2	Very low	135 Å²	135	134.6 Å²	134.6	82%	0.818	74%	0.742	S	S	*	*			trans	-143.3	96.1	160.6	-175.7	0	0	0	0	106.7
809	T	27	Very low	26.4	Very low	98 Å²	98	137 Å²	137	60%	0.601	75%	0.747	S	S	*	*				44.9	109.5	91.7	62.1	0	0	0	0	114.2
810	T	23.4	Very low	26.3	Very low	126 Å²	126	135 Å²	135	77%	0.773	74%	0.738	S	S	*	*				52.6	147.1	63.9	74.8	0	0	0	0	114.4
811	P	27.6	Very low	26.4	Very low	124 Å²	124	137.5 Å²	137.5	81%	0.805	74%	0.744	S	S	*	*			cis	-128.6	-150.5	6.4	44.1	-27.3	0	0	0	111.6
812	S	23.3	Very low	26.4	Very low	62 Å²	62	135.9 Å²	135.9	43%	0.434	74%	0.736	S	S	.	*			trans	-159	153.5	176.7	34.5	0	0	0	0	108.6	N764	N764-S812 VanDerWaalsContact CG-OG 3.32Å; N764-S812 PolarHBondContact ND2-O 3.27Å; N764-S812 PolarHBondContact ND2-OG 3.27Å; N764-S812 WeakPolarHBondContact OD1-CB 3.43Å; N764-S812 PolarHBondContact OD1-OG 3.03Å
813	L	28.2	Very low	26.8	Very low	155 Å²	155	137 Å²	137	81%	0.812	74%	0.736	S	S	*	*			trans	-160.3	154.9	-179.9	-161.5	67.3	0	0	0	110.2
814	A	24.8	Very low	26.9	Very low	91 Å²	91	137 Å²	137	75%	0.752	74%	0.738	S	S	*	*			trans	-109.4	157	179.5	0	0	0	0	0	112.2
815	G	26.6	Very low	26.9	Very low	75 Å²	75	133.9 Å²	133.9	77%	0.773	74%	0.74	S	S	*	*			trans	164.6	108.2	167.5	0	0	0	0	0	117.7
816	S	25.5	Very low	27	Very low	100 Å²	100	129.8 Å²	129.8	70%	0.699	74%	0.736	S	S	*	*			trans	46	109.5	147.3	-168.3	0	0	0	0	121.8
817	T	23.9	Very low	27.1	Very low	113 Å²	113	126.8 Å²	126.8	69%	0.693	73%	0.734	S	S	*	*			trans	-4.8	142.7	132.9	43.8	0	0	0	0	120.2
818	Y	27.6	Very low	26.9	Very low	202 Å²	202	130.1 Å²	130.1	79%	0.792	74%	0.741	S	S	*	*				-169.3	133.7	112.8	-95	-62.2	0	0	0	113.1
819	L	27.3	Very low	26.9	Very low	157 Å²	157	130.3 Å²	130.3	82%	0.822	74%	0.737	S	S	*	*			trans	51.8	162	151.5	-60.7	160.5	0	0	0	120.5
820	N	25.8	Very low	26.9	Very low	108 Å²	108	134.5 Å²	134.5	58%	0.578	75%	0.749	S	S	*	*			cis	-175	137.7	-39.9	176.7	39.7	0	0	0	107.4
821	D	28.3	Very low	27.1	Very low	141 Å²	141	137.2 Å²	137.2	75%	0.754	75%	0.754	S	S	*	*			trans	-171.9	101	140.9	-108.7	-30.9	0	0	0	115.1
822	N	28.3	Very low	27.5	Very low	120 Å²	120	136.3 Å²	136.3	64%	0.642	75%	0.748	S	S	*	*				36.7	120.2	125.8	-63.5	-57.7	0	0	0	122.2
823	Q	31.8	Very low	27.6	Very low	175 Å²	175	143.7 Å²	143.7	82%	0.818	77%	0.768	S	S	*	*				-152.5	117.5	127.2	-116.5	177.9	18.5	0	0	112
824	Q	30.3	Very low	27.6	Very low	168 Å²	168	143 Å²	143	79%	0.785	77%	0.77	S	S	*	*			trans	46	138.5	144.3	-60.7	171.9	-11.5	0	0	119.8
825	T	29.6	Very low	27.6	Very low	125 Å²	125	145 Å²	145	77%	0.767	77%	0.773	S	S	*	*			cis	-170.5	165.5	-1.6	18.5	0	0	0	0	106
826	S	28.2	Very low	28.2	Very low	117 Å²	117	146.7 Å²	146.7	82%	0.818	77%	0.77	S	S	*	*			cis	-155	-165.5	6.1	-117.1	0	0	0	0	109.7
827	M	26.1	Very low	28.5	Very low	174 Å²	174	150 Å²	150	86%	0.857	78%	0.775	S	S	*	*			trans	-107.4	159.7	-170.5	-65.5	176.7	173.9	0	0	116.9
828	E	24.7	Very low	28.7	Very low	166 Å²	166	150.6 Å²	150.6	78%	0.776	77%	0.773	S	S	*	*			trans	68	121.4	139.1	-81.9	-173.2	125.1	0	0	125.5
829	L	25.8	Very low	28.9	Very low	140 Å²	140	147.2 Å²	147.2	73%	0.733	77%	0.769	S	S	*	*				63.9	111.8	117.7	-162.6	79.4	0	0	0	121.3
830	H	27.7	Very low	29.1	Very low	185 Å²	185	146 Å²	146	86%	0.856	76%	0.763	S	S	*	*				-163.6	171.4	129	-111.9	62.3	0	0	0	113.9
831	Q	28.6	Very low	29.6	Very low	184 Å²	184	148 Å²	148	86%	0.86	77%	0.773	S	S	*	*			trans	-104.2	175.1	-168.5	-97.8	-170.5	-9	0	0	114.6
832	P	34.7	Very low	30.1	Very low	105 Å²	105	146.7 Å²	146.7	68%	0.682	77%	0.772	S	S	*	*			trans	-104.9	-175	-151.8	41.3	-39.1	0	0	0	117.8
833	Y	26.3	Very low	30.2	Very low	217 Å²	217	152 Å²	152	85%	0.851	78%	0.783	S	S	*	*			trans	100.3	113.7	169.3	-72.6	-79.1	0	0	0	118.8
834	T	27.6	Very low	30.1	Very low	140 Å²	140	148.3 Å²	148.3	86%	0.859	78%	0.777	S	S	*	*				-178.4	174	110.3	27.6	0	0	0	0	112.1
835	T	25.2	Very low	30.2	Very low	133 Å²	133	150.7 Å²	150.7	82%	0.816	78%	0.779	S	S	*	*			trans	-131	-157	-169.2	48.2	0	0	0	0	111.2
836	P	38.1	Very low	29.9	Very low	110 Å²	110	150.2 Å²	150.2	71%	0.714	78%	0.776	S	S	*	*				-123.4	177.9	-74.9	37.1	-22	0	0	0	114.2
837	Q	33	Very low	30	Very low	171 Å²	171	151.1 Å²	151.1	80%	0.799	77%	0.77	S	S	*	*				170.4	143.5	127.8	-96	-169.3	17.7	0	0	118
838	N	28.6	Very low	29.9	Very low	124 Å²	124	149.2 Å²	149.2	66%	0.663	76%	0.759	S	S	*	*			trans	37.8	129.4	143.7	-67.5	-16.2	0	0	0	124.9
839	N	31.4	Very low	30	Very low	132 Å²	132	148 Å²	148	71%	0.706	75%	0.754	S	S	*	*				-173.5	126.1	97.5	-97.8	-36.5	0	0	0	115.2
840	N	32.1	Very low	30	Very low	130 Å²	130	148.4 Å²	148.4	70%	0.695	76%	0.755	S	S	*	*			trans	57.8	143.1	137.7	-53.6	-25	0	0	0	121.9
841	L	34.7	Very low	29.9	Very low	151 Å²	151	143.4 Å²	143.4	79%	0.791	75%	0.746	S	S	*	*			cis	-154.7	-171.5	-5.3	-133.7	79.1	0	0	0	108.5
842	P	38.7	Very low	29.8	Very low	113 Å²	113	145.2 Å²	145.2	73%	0.734	75%	0.746	S	S	*	*			trans	-134.3	-171.6	-133.8	40.7	-18.1	0	0	0	117.3
843	R	30.1	Very low	29.4	Very low	231 Å²	231	144.2 Å²	144.2	87%	0.872	74%	0.742	S	S	*	*				172.9	110.1	124.1	-174.4	169	-165	158.3	3.3	116.3
844	S	30.7	Very low	29.5	Very low	98 Å²	98	140.8 Å²	140.8	69%	0.685	74%	0.738	S	S	*	*			trans	58.4	154.3	147.7	-55.5	0	0	0	0	121.3
845	R	31.4	Very low	29.6	Very low	219 Å²	219	138.6 Å²	138.6	83%	0.826	73%	0.734	S	S	*	*			cis	-167.6	130.2	-18.1	-98.3	-179.8	179.2	174.2	-0.9	104.6
846	T	25.1	Very low	29.7	Very low	115 Å²	115	142.7 Å²	142.7	71%	0.706	74%	0.736	S	S	*	*				56	134.7	69.5	67.7	0	0	0	0	114.2
847	I	28.5	Very low	29.3	Very low	135 Å²	135	143.9 Å²	143.9	69%	0.692	73%	0.732	S	S	*	*			cis	-167.7	169.8	11.7	-122.7	170.8	0	0	0	111.6
848	Q	26	Very low	29.2	Very low	134 Å²	134	141.4 Å²	141.4	63%	0.626	72%	0.721	S	S	*	*			trans	7	168.1	156.3	-68.4	153.6	-89	0	0	122.8
849	E	25.4	Very low	29.4	Very low	142 Å²	142	143.8 Å²	143.8	66%	0.664	73%	0.726	S	S	*	*			cis	-167.1	162.7	9.2	-127.5	159.2	-161.6	0	0	116.5
850	I	27.2	Very low	29.4	Very low	147 Å²	147	142.9 Å²	142.9	75%	0.754	73%	0.73	S	S	*	*			trans	44.6	124.2	137.6	-77.9	168.9	0	0	0	125.3
851	A	25.1	Very low	29.4	Very low	81 Å²	81	139.9 Å²	139.9	67%	0.669	73%	0.729	S	S	*	*			trans	67.3	121.8	135.5	0	0	0	0	0	127.8
852	Y	25.6	Very low	29.3	Very low	222 Å²	222	141.6 Å²	141.6	87%	0.871	73%	0.733	S	S	*	*				56.8	120.5	125.4	-80.3	-89.2	0	0	0	126.3
853	S	26.4	Very low	29	Very low	84 Å²	84	143.1 Å²	143.1	59%	0.587	74%	0.735	S	S	*	*				74.5	107.4	129.3	-75.3	0	0	0	0	126.2
854	D	28	Very low	29.2	Very low	145 Å²	145	136.4 Å²	136.4	78%	0.775	72%	0.723	S	S	*	*				78	124.8	104.2	-56.9	-35.5	0	0	0	125.8
855	A	30.5	Very low	29.4	Very low	94 Å²	94	136.3 Å²	136.3	78%	0.777	72%	0.723	S	S	*	*				73.2	136.8	127.1	0	0	0	0	0	123.7
856	Y	27.1	Very low	29.5	Very low	219 Å²	219	134.8 Å²	134.8	86%	0.859	72%	0.722	S	S	*	*			trans	-159.5	141	163.9	-118.4	-104	0	0	0	105.6
857	E	29.6	Very low	29.8	Very low	134 Å²	134	136.4 Å²	136.4	63%	0.626	73%	0.727	S	S	*	*			cis	-149.1	-141.3	-10.4	-146.4	-150.4	128.7	0	0	106.4
858	Q	31.3	Very low	30	Very low	120 Å²	120	140.7 Å²	140.7	56%	0.561	73%	0.734	S	S	*	*			cis	-153.3	157	4.3	-166.3	149.4	86.7	0	0	109.7
859	F	32.4	Very low	30.3	Very low	174 Å²	174	139.1 Å²	139.1	76%	0.763	74%	0.738	S	S	*	*			trans	67.7	157.6	175.5	-50.4	-72.7	0	0	0	115.9
860	S	31.7	Very low	30.9	Very low	113 Å²	113	138.8 Å²	138.8	79%	0.79	75%	0.745	S	S	*	*			cis	-168.3	144	-32.3	55.9	0	0	0	0	108.9
861	G	32	Very low	31.6	Very low	66 Å²	66	136.4 Å²	136.4	68%	0.68	74%	0.739	S	S	*	*			cis	173.9	174.6	-7.4	0	0	0	0	0	111.6
862	Q	33.2	Very low	32.1	Very low	187 Å²	187	138.8 Å²	138.8	87%	0.874	74%	0.741	S	S	*	*			trans	64.7	124.5	179	-57.2	-175	12.1	0	0	114.4
863	N	31.2	Very low	32.4	Very low	146 Å²	146	135 Å²	135	78%	0.781	74%	0.736	S	S	*	*			cis	-151.7	172.3	14.6	-113.1	-43.7	0	0	0	109.2
864	S	34.2	Very low	32.7	Very low	89 Å²	89	135.3 Å²	135.3	62%	0.622	74%	0.743	S	S	*	*			cis	-159.5	-178.9	11	130.5	0	0	0	0	111.2
865	S	34.8	Very low	32.9	Very low	97 Å²	97	133.3 Å²	133.3	68%	0.678	74%	0.741	S	S	*	*			trans	70.4	83.7	152.2	50.6	0	0	0	0	121.6
866	K	33.4	Very low	33.1	Very low	187 Å²	187	136.7 Å²	136.7	81%	0.813	74%	0.74	S	S	*	*				83.1	119.4	123.3	-71.6	176.8	177.7	176.9	0	121.9
867	N	32.5	Very low	33.5	Very low	149 Å²	149	132.6 Å²	132.6	80%	0.797	73%	0.732	S	S	*	*			trans	81.8	140.8	146.7	-54.4	-15.4	0	0	0	118.8
868	R	32.5	Very low	33.5	Very low	224 Å²	224	131.7 Å²	131.7	85%	0.845	73%	0.732	S	S	*	*			cis	-171.8	132.4	-19.9	-167.5	-179.6	-172.5	177.4	1.8	110.9
869	S	31.6	Very low	33.6	Very low	101 Å²	101	131.5 Å²	131.5	71%	0.706	74%	0.735	S	S	*	*			trans	64.3	141.1	167.8	28.1	0	0	0	0	119.5
870	V	38.8	Very low	33.6	Very low	135 Å²	135	129.5 Å²	129.5	82%	0.818	73%	0.728	S	S	*	*			cis	79.5	135.8	2.4	-168.4	0	0	0	0	116.3
871	P	42.2	Very low	33.5	Very low	97 Å²	97	133.1 Å²	133.1	63%	0.63	72%	0.724	S	S	*	*			cis	-142	-178.6	-18.9	38.6	-18.8	0	0	0	117.6
872	N	35.4	Very low	33.5	Very low	132 Å²	132	137.8 Å²	137.8	71%	0.706	73%	0.728	S	S	*	*				154.3	139.4	120.8	-87.9	-28.6	0	0	0	119.8
873	N	32	Very low	33.3	Very low	143 Å²	143	132 Å²	132	77%	0.765	72%	0.719	S	S	*	*			trans	60	134.5	144.8	-60.7	-13.6	0	0	0	122
874	A	33.1	Very low	33.4	Very low	90 Å²	90	131.6 Å²	131.6	74%	0.744	72%	0.721	S	S	*	*			cis	97.4	143.4	33.4	0	0	0	0	0	113.6
875	S	32.3	Very low	33.3	Very low	103 Å²	103	132.4 Å²	132.4	72%	0.72	73%	0.727	S	S	*	*			cis	-169.7	-157.2	-5.2	52.6	0	0	0	0	112
876	H	34.3	Very low	33.6	Very low	164 Å²	164	133.6 Å²	133.6	76%	0.759	73%	0.732	S	S	*	*			trans	82.3	152.2	177	-80.5	-114.9	0	0	0	118.9
877	L	34.6	Very low	33.5	Very low	134 Å²	134	132.9 Å²	132.9	70%	0.702	74%	0.735	S	S	*	*			cis	159.3	157.1	-25.6	-121.1	75	0	0	0	106.6
878	N	30.6	Very low	33.4	Very low	114 Å²	114	132.1 Å²	132.1	61%	0.61	74%	0.736	S	S	*	*			cis	-165.3	-175.7	-1.8	-154.7	-6	0	0	0	111.6
879	N	32.5	Very low	33.4	Very low	117 Å²	117	127.1 Å²	127.1	63%	0.626	73%	0.733	S	S	*	*			trans	90.2	119.7	157.8	-60.5	-17.7	0	0	0	117.9
880	Q	33.1	Very low	33.2	Very low	131 Å²	131	130.6 Å²	130.6	61%	0.612	74%	0.737	S	S	*	*				93.9	140.5	52.1	-77.7	-177	69.6	0	0	112.3
881	R	29.3	Very low	32.8	Very low	189 Å²	189	130.4 Å²	130.4	71%	0.713	74%	0.739	S	S	*	*			cis	-168	164.1	5.5	-129.4	172	-178	-171.9	2	114.7
882	H	32.2	Very low	32.2	Very low	164 Å²	164	130.9 Å²	130.9	76%	0.759	74%	0.74	S	S	*	*			trans	86.7	136.1	146.5	-71.4	-33.9	0	0	0	124.3
883	G	29.8	Very low	31.8	Very low	67 Å²	67	135.2 Å²	135.2	69%	0.691	75%	0.748	S	S	*	*			trans	126.6	120.8	-176.3	0	0	0	0	0	111.8
884	V	32.8	Very low	31.6	Very low	137 Å²	137	132.3 Å²	132.3	83%	0.83	74%	0.744	S	S	*	*			cis	79.7	122.1	7.2	-167.9	0	0	0	0	114.4
885	S	32.5	Very low	31.4	Very low	106 Å²	106	133.9 Å²	133.9	74%	0.741	74%	0.744	S	S	*	*			cis	-160.8	164.4	-6.7	46.6	0	0	0	0	112.6
886	P	41	Very low	31.1	Very low	121 Å²	121	136.8 Å²	136.8	79%	0.786	75%	0.751	S	S	*	*			trans	-106	162.6	-168	40	-35.8	0	0	0	117.3
887	I	30.7	Very low	30.8	Very low	172 Å²	172	132.8 Å²	132.8	88%	0.882	75%	0.746	S	S	*	*			trans	-167.4	162.1	154.6	-104.3	154.9	0	0	0	110.7
888	V	29.9	Very low	30.6	Very low	134 Å²	134	132.2 Å²	132.2	81%	0.812	75%	0.749	S	S	*	*			trans	-124.8	134.6	-173.1	166	0	0	0	0	109.4
889	P	33.1	Very low	30.4	Very low	119 Å²	119	134.2 Å²	134.2	77%	0.773	76%	0.758	S	S	*	*				-152.7	176.1	98.8	39.9	-20.1	0	0	0	117.4
890	E	26.2	Very low	30.2	Very low	173 Å²	173	134 Å²	134	81%	0.808	77%	0.766	S	S	*	*			trans	-74.4	166	173.8	-56	-176.8	136.7	0	0	114
891	P	32.2	Very low	30.1	Very low	131 Å²	131	137.9 Å²	137.9	85%	0.851	78%	0.781	S	S	*	*				-139.5	175.3	123.8	39.1	-27.6	0	0	0	115.3
892	T	27.7	Very low	30	Very low	107 Å²	107	138.1 Å²	138.1	66%	0.656	79%	0.79	S	S	*	*			trans	-119.2	167.9	-161.3	-29.5	0	0	0	0	114.4
893	Y	27.9	Very low	29.9	Very low	224 Å²	224	135.6 Å²	135.6	88%	0.878	79%	0.791	S	S	*	*			trans	72	140.9	167.4	-65.3	-74.7	0	0	0	116.6
894	A	28.3	Very low	30	Very low	81 Å²	81	138.7 Å²	138.7	67%	0.669	79%	0.79	S	S	*	*			cis	-167.2	151.7	29	0	0	0	0	0	114.4
895	T	29.3	Very low	30	Very low	123 Å²	123	139.8 Å²	139.8	76%	0.755	79%	0.786	S	S	*	*			trans	67.1	106.4	140.2	-50.1	0	0	0	0	122.5
896	L	26.1	Very low	29.9	Very low	165 Å²	165	140.1 Å²	140.1	86%	0.864	78%	0.78	S	S	*	*				28.8	138.7	124.2	-60.1	160.5	0	0	0	119.2
897	A	27.3	Very low	29.5	Very low	79 Å²	79	141.5 Å²	141.5	65%	0.653	78%	0.78	S	S	*	*			cis	-167.4	-178.9	33.3	0	0	0	0	0	115.6
898	T	29.6	Very low	29.5	Very low	123 Å²	123	136.1 Å²	136.1	76%	0.755	77%	0.767	S	S	*	*			trans	69.5	101	150.6	50.6	0	0	0	0	122.9
899	L	27.3	Very low	29.6	Very low	155 Å²	155	138.9 Å²	138.9	81%	0.812	77%	0.769	S	S	*	*				78.1	128.8	126.3	-90.7	98	0	0	0	124.5
900	S	28.8	Very low	29.5	Very low	112 Å²	112	143.9 Å²	143.9	78%	0.783	77%	0.772	S	S	*	*			trans	82.5	124.7	142.7	75.7	0	0	0	0	119.9
901	K	29.9	Very low	29.7	Very low	213 Å²	213	140.9 Å²	140.9	93%	0.926	77%	0.768	S	S	*	*			trans	-122.2	134.3	157.5	-101.5	-175.8	173.8	179.4	0	108.2
902	Q	28.3	Very low	29.5	Very low	195 Å²	195	139.9 Å²	139.9	91%	0.911	76%	0.764	S	S	*	*			trans	-88.6	158.5	172.1	-65.7	174.7	-33	0	0	111.3
903	S	29.5	Very low	29.8	Very low	110 Å²	110	140.8 Å²	140.8	77%	0.769	78%	0.775	S	S	*	*			trans	-165.9	140.4	158.8	74.5	0	0	0	0	106.1
904	I	32	Very low	30.1	Very low	132 Å²	132	136.2 Å²	136.2	68%	0.677	77%	0.77	S	S	*	*			cis	-151.6	132.8	26.8	-82.2	-170.7	0	0	0	110.7
905	Q	32.6	Very low	30.3	Very low	161 Å²	161	139 Å²	139	75%	0.752	78%	0.778	S	S	*	*			trans	61	158.2	150	-68.4	170.4	5.5	0	0	120.7
906	N	31.3	Very low	30.6	Very low	113 Å²	113	138.3 Å²	138.3	60%	0.604	78%	0.776	S	S	*	*			cis	-149.7	151.1	-2	-123	-16.4	0	0	0	112.7
907	N	31.2	Very low	30.9	Very low	149 Å²	149	137.4 Å²	137.4	80%	0.797	77%	0.771	S	S	*	*			trans	40.8	127.2	153.1	-55.9	-24.3	0	0	0	121.2
908	G	31.9	Very low	31.1	Very low	59 Å²	59	140.2 Å²	140.2	61%	0.608	78%	0.776	S	S	*	*			cis	161.1	167.1	-4.2	0	0	0	0	0	113.1
909	F	30.9	Very low	31.2	Very low	193 Å²	193	138.6 Å²	138.6	85%	0.846	77%	0.769	S	S	*	*			trans	61.8	140.5	175.3	-64.7	-97.2	0	0	0	116.3
910	R	30.4	Very low	31.6	Very low	223 Å²	223	139.2 Å²	139.2	84%	0.842	77%	0.768	S	S	*	*			cis	-156.8	147.4	-5.6	-141.2	177	-164.8	-175.7	5	107.7
911	P	31.6	Very low	31.7	Very low	111 Å²	111	140.2 Å²	140.2	72%	0.721	76%	0.764	S	S	*	*			trans	-99.1	158.7	-169.9	37.4	-36.2	0	0	0	116.4
912	S	27.5	Very low	32	Very low	109 Å²	109	139.5 Å²	139.5	76%	0.762	76%	0.761	S	S	*	*			trans	56.2	121.9	144	62.5	0	0	0	0	122.2
913	S	34.7	Very low	32.1	Very low	126 Å²	126	133.9 Å²	133.9	88%	0.881	76%	0.755	S	S	*	*				-148.2	159.1	128.6	60.5	0	0	0	0	109.8
914	V	33	Very low	32.4	Very low	128 Å²	128	138.2 Å²	138.2	78%	0.776	76%	0.761	S	S	*	*			trans	-140	127.7	-167.8	175.7	0	0	0	0	110.9
915	T	33.7	Very low	32.6	Very low	139 Å²	139	138.1 Å²	138.1	85%	0.853	77%	0.766	S	S	*	*			trans	174.9	147.8	136.4	24	0	0	0	0	111.4
916	P	34.2	Very low	32.4	Very low	109 Å²	109	135.6 Å²	135.6	71%	0.708	77%	0.766	S	S	*	*			trans	-119.2	156	174.2	39.8	-30	0	0	0	114.3
917	L	33.1	Very low	32.8	Very low	146 Å²	146	135.6 Å²	135.6	76%	0.764	77%	0.772	S	S	*	*				-175.4	146.9	127.4	-122.9	66	0	0	0	112.6
918	D	31.9	Very low	32.7	Very low	139 Å²	139	134 Å²	134	74%	0.743	77%	0.768	S	S	*	*			trans	46.9	150	149.6	-60	-19	0	0	0	123.9
919	S	30.9	Very low	32.4	Very low	88 Å²	88	138 Å²	138	62%	0.615	78%	0.775	S	S	*	*			cis	-167.7	147.7	-27.3	63.4	0	0	0	0	110.6
920	H	35.6	Very low	32.5	Very low	168 Å²	168	136.8 Å²	136.8	78%	0.778	78%	0.776	S	S	*	*			trans	167.6	127.7	139.4	-95.2	-52.6	0	0	0	114.2
921	N	32.3	Very low	32.2	Very low	133 Å²	133	131 Å²	131	71%	0.711	77%	0.769	S	S	*	*			trans	27.4	131.6	139.3	-71.2	-35.5	0	0	0	120.2
922	K	35.5	Very low	32.1	Very low	198 Å²	198	136.9 Å²	136.9	86%	0.861	78%	0.777	S	S	*	*			cis	-171.5	137.9	45.4	-131.7	164.6	-172.2	176.3	0	113.3
923	G	31.3	Very low	31.9	Very low	77 Å²	77	139.5 Å²	139.5	79%	0.794	78%	0.783	S	S	*	*			trans	85.5	134.9	162.4	0	0	0	0	0	116.3
924	K	35.2	Very low	31.7	Very low	202 Å²	202	140.5 Å²	140.5	88%	0.878	78%	0.777	S	S	*	*			cis	-139.3	139.3	4.3	-89.5	-178.6	174.6	177.7	0	111.4
925	V	35.2	Very low	31.4	Very low	129 Å²	129	139.4 Å²	139.4	78%	0.782	77%	0.774	S	S	*	*			trans	44.2	100.9	153.9	-165	0	0	0	0	116.4
926	S	29.6	Very low	31.1	Very low	109 Å²	109	143.8 Å²	143.8	76%	0.762	78%	0.777	S	S	*	*				83.7	141	54.2	-56.3	0	0	0	0	115
927	P	39.2	Very low	30.7	Very low	112 Å²	112	149.7 Å²	149.7	73%	0.727	79%	0.785	S	S	*	*			trans	-135.9	-167.3	-149	33.6	-9.5	0	0	0	116
928	T	28.6	Very low	30.4	Very low	115 Å²	115	154.4 Å²	154.4	71%	0.706	79%	0.793	S	S	*	*			trans	118.9	138.4	146.1	68.5	0	0	0	0	119.1
929	N	25.4	Very low	30.3	Very low	144 Å²	144	153.3 Å²	153.3	77%	0.77	79%	0.794	S	S	*	*			trans	57.4	111.7	150.7	-58.5	-15.1	0	0	0	120.7
930	I	32.9	Very low	30.1	Very low	168 Å²	168	155.4 Å²	155.4	86%	0.862	81%	0.807	S	S	*	*				-164.6	160.9	101.8	-96.8	158.9	0	0	0	109.9
931	S	25.2	Very low	29.8	Very low	100 Å²	100	154 Å²	154	70%	0.699	81%	0.81	S	S	*	*			trans	-67.9	154.7	-170.5	56.2	0	0	0	0	115.8
932	R	29.1	Very low	29.6	Very low	235 Å²	235	158.6 Å²	158.6	89%	0.887	82%	0.817	S	S	*	*				-168.8	140.7	128.3	-104.1	157.4	-167.5	-175.6	3.9	113.2
933	N	24.1	Very low	29.2	Very low	164 Å²	164	154.7 Å²	154.7	88%	0.877	81%	0.81	S	S	*	*			trans	-68.2	138.7	162.7	-71.6	-39.7	0	0	0	109.8
934	I	29.4	Very low	29	Very low	148 Å²	148	156.8 Å²	156.8	76%	0.759	81%	0.808	S	S	*	*			trans	-130.1	107.3	157.9	-62	-177.2	0	0	0	108.3
935	S	26.9	Very low	28.4	Very low	104 Å²	104	156 Å²	156	73%	0.727	80%	0.804	S	S	*	*			trans	-86.8	137	165	48.2	0	0	0	0	109.5	R937	S935-R937 PolarHBondContact O-N 3.1Å; S935-R937 VanDerWaalsContact O-N 3.07Å
936	Y	27.5	Very low	28	Very low	231 Å²	231	157.9 Å²	157.9	91%	0.906	81%	0.805	S	S	*	*			trans	-74.9	99	178.7	-82.2	-86.4	0	0	0	111.5
937	R	26	Very low	27.8	Very low	234 Å²	234	158.2 Å²	158.2	88%	0.883	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-100.9	129.2	155.1	-87.4	-169.1	172.1	-163	-0.5	109.7	S935	S935-R937 PolarHBondContact O-N 3.1Å; S935-R937 VanDerWaalsContact O-N 3.07Å
938	R	27.5	Very low	27.3	Very low	244 Å²	244	160.8 Å²	160.8	92%	0.921	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-78.1	131.9	163.2	-69.3	-179.5	175.6	177.6	-2.3	108.7
939	P	30	Very low	27.3	Very low	117 Å²	117	161 Å²	161	76%	0.76	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-84.5	151.6	176.2	33.8	-33.9	0	0	0	111.8
940	C	25.3	Very low	27.5	Very low	132 Å²	132	161.8 Å²	161.8	89%	0.892	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-84.9	146.4	159.5	-56.8	0	0	0	0	109.3
941	T	30.8	Very low	27.2	Very low	139 Å²	139	160.4 Å²	160.4	85%	0.853	80%	0.799	S	S	*	*			trans	-117.8	132	160.7	42.9	0	0	0	0	110.1
942	R	26.8	Very low	27.5	Very low	228 Å²	228	165.9 Å²	165.9	86%	0.86	81%	0.811	S	S	*	*			trans	-98.5	134.3	-179.3	-175.2	-173.6	-162	164.9	4	107.5	T944	R942-T944 PolarHBondContact O-N 3.45Å
943	V	26.6	Very low	27.4	Very low	116 Å²	116	160.1 Å²	160.1	70%	0.703	81%	0.807	S	S	*	*			trans	-80.7	121.2	176.5	178.8	0	0	0	0	109.7	F945	V943-F945 HydrophobicContact CG1-CD2 3.64Å; V943-F945 HydrophobicContact CG1-CE2 3.41Å; V943-F945 VanDerWaalsContact CG1-CE2 3.41Å; V943-F945 HydrophobicContact CG1-CZ 4.18Å
944	T	27.1	Very low	27.6	Very low	122 Å²	122	155.9 Å²	155.9	75%	0.748	80%	0.801	S	S	*	*			trans	-139.8	118.7	163.7	46.7	0	0	0	0	106.9	R942	R942-T944 PolarHBondContact O-N 3.45Å
945	F	23.6	Very low	27.6	Very low	184 Å²	184	154.5 Å²	154.5	81%	0.807	81%	0.805	S	S	*	*			trans	-104	125.5	175.5	-71.8	-74.4	0	0	0	109.6	V943	V943-F945 HydrophobicContact CG1-CD2 3.64Å; V943-F945 HydrophobicContact CG1-CE2 3.41Å; V943-F945 VanDerWaalsContact CG1-CE2 3.41Å; V943-F945 HydrophobicContact CG1-CZ 4.18Å
946	Q	25.8	Very low	27.5	Very low	169 Å²	169	161.4 Å²	161.4	79%	0.79	82%	0.815	S	S	*	*			trans	-158.1	150	162.2	-161.3	80.1	40.7	0	0	108.5
947	D	25.6	Very low	27.6	Very low	116 Å²	116	154.5 Å²	154.5	62%	0.62	81%	0.806	S	S	*	*			trans	64.6	101.3	163.7	-51.4	-34.5	0	0	0	120.4
948	I	29.9	Very low	27.6	Very low	167 Å²	167	150 Å²	150	86%	0.856	80%	0.804	S	S	*	*				-118.8	108.8	129.1	-64.8	178.3	0	0	0	106.4
949	D	28.2	Very low	27.7	Very low	118 Å²	118	145.5 Å²	145.5	63%	0.631	80%	0.797	S	S	*	*			trans	-69.4	145.3	173.1	-83.7	-48.7	0	0	0	112
950	N	28.7	Very low	27.5	Very low	161 Å²	161	147.4 Å²	147.4	86%	0.861	80%	0.801	S	S	*	*			trans	-150.1	112.5	150.8	-105	-48	0	0	0	109.7
951	N	28	Very low	27.6	Very low	140 Å²	140	148.5 Å²	148.5	75%	0.749	80%	0.798	S	S	*	*			trans	-79.6	131.9	-175	-79.8	-72.7	0	0	0	112.3
952	F	29.6	Very low	27.6	Very low	215 Å²	215	145.2 Å²	145.2	94%	0.943	79%	0.791	S	S	*	*			trans	-149.3	146.2	143.1	-118.5	-80.3	0	0	0	110.6
953	S	27.6	Very low	27.6	Very low	114 Å²	114	138.9 Å²	138.9	80%	0.797	79%	0.788	S	S	*	*			trans	-106.2	143	-162.1	56.9	0	0	0	0	114.6
954	G	29.3	Very low	27.8	Very low	74 Å²	74	140.5 Å²	140.5	76%	0.763	80%	0.798	S	S	*	*			trans	174.6	86.5	166.6	0	0	0	0	0	119.5
955	S	28.1	Very low	27.8	Very low	120 Å²	120	138.1 Å²	138.1	84%	0.839	80%	0.797	S	S	*	*			trans	56.3	103.7	138.5	-59.5	0	0	0	0	124
956	R	25	Very low	28	Very low	249 Å²	249	135.1 Å²	135.1	94%	0.94	80%	0.8	S	S	*	*				82.9	155.2	115.8	-150.6	176.1	-167.1	-170	4.2	120.9
957	A	29.7	Very low	28.1	Very low	85 Å²	85	133.1 Å²	133.1	70%	0.702	80%	0.804	S	S	*	*			trans	73.9	126.5	-175.8	0	0	0	0	0	114.1
958	V	25.4	Very low	28.2	Very low	139 Å²	139	134.6 Å²	134.6	84%	0.842	81%	0.812	S	S	*	*			cis	72.8	88.1	15.3	-164.1	0	0	0	0	115.6
959	I	31.3	Very low	28.1	Very low	151 Å²	151	132.2 Å²	132.2	77%	0.774	81%	0.81	S	S	*	*			trans	-134.9	142.8	144	-62.6	-177.9	0	0	0	106
960	N	25.2	Very low	28.3	Very low	157 Å²	157	130.1 Å²	130.1	84%	0.84	82%	0.816	S	S	*	*			trans	-149.6	98.8	178.3	-162.6	59	0	0	0	110.5
961	D	28.3	Very low	28.3	Very low	155 Å²	155	128.9 Å²	128.9	83%	0.829	82%	0.815	S	S	*	*			trans	-140.8	153	173.8	-73.8	-61.6	0	0	0	106.7
962	G	29.6	Very low	28.4	Very low	69 Å²	69	127.6 Å²	127.6	71%	0.711	82%	0.815	S	S	*	*			cis	-169.9	160.4	-1.7	0	0	0	0	0	108.6
963	A	26.3	Very low	28.4	Very low	96 Å²	96	122.8 Å²	122.8	79%	0.793	80%	0.803	S	S	*	*			trans	-63.5	171.6	-161.2	0	0	0	0	0	117.9
964	T	31.4	Very low	28.7	Very low	149 Å²	149	125 Å²	125	91%	0.914	81%	0.806	S	S	*	*			trans	93.9	130.8	175.5	72	0	0	0	0	116.3
965	G	28	Very low	28.5	Very low	72 Å²	72	124.8 Å²	124.8	74%	0.742	80%	0.804	S	S	*	*			cis	175.9	153.3	-10.3	0	0	0	0	0	113.7
966	S	28	Very low	28.5	Very low	122 Å²	122	129 Å²	129	85%	0.853	81%	0.81	S	S	*	*			trans	71.1	110.7	178.3	-159.1	0	0	0	0	117.3
967	S	26.3	Very low	28.7	Very low	126 Å²	126	120.5 Å²	120.5	88%	0.881	80%	0.8	S	S	*	*			trans	-142.6	137.5	155.3	-60.5	0	0	0	0	106.4
968	D	28.3	Very low	28.8	Very low	147 Å²	147	121.6 Å²	121.6	79%	0.786	80%	0.802	S	S	*	*			trans	-139.5	99	171.9	-167.4	3.6	0	0	0	110.8
969	S	28.7	Very low	29	Very low	117 Å²	117	120.1 Å²	120.1	82%	0.818	80%	0.799	S	S	*	*			trans	-156.7	126.4	162.8	60.7	0	0	0	0	109.5
970	G	30.8	Very low	28.9	Very low	74 Å²	74	120 Å²	120	76%	0.763	80%	0.798	S	S	*	*			trans	88.8	69.3	169.9	0	0	0	0	0	116.3	C972	G970-C972 PolarHBondContact O-N 3.1Å; G970-C972 VanDerWaalsContact O-N 3.15Å
971	V	29.4	Very low	29.3	Very low	136 Å²	136	120.2 Å²	120.2	82%	0.824	79%	0.794	S	S	*	*			trans	-68.3	108.9	161.3	176.9	0	0	0	0	109.7
972	C	29.7	Very low	29.5	Very low	113 Å²	113	120 Å²	120	76%	0.764	79%	0.788	S	S	*	*			trans	-135.3	95.4	163.3	-84.7	0	0	0	0	110.2	G970	G970-C972 PolarHBondContact O-N 3.1Å; G970-C972 VanDerWaalsContact O-N 3.15Å
973	T	31.2	Very low	29.5	Very low	113 Å²	113	124 Å²	124	69%	0.693	79%	0.793	S	S	*	*			trans	52.6	120.2	151.9	57.7	0	0	0	0	120.2
974	N	32.1	Very low	29.9	Very low	161 Å²	161	122.8 Å²	122.8	86%	0.861	79%	0.79	S	S	*	*			trans	66.8	94.7	141.4	-51.2	-7	0	0	0	117.6
975	G	26.7	Very low	29.8	Very low	69 Å²	69	122.3 Å²	122.3	71%	0.711	78%	0.782	S	S	*	*			trans	-100.9	166	157.8	0	0	0	0	0	112.1
976	H	28.3	Very low	30	Very low	209 Å²	209	129.4 Å²	129.4	97%	0.968	79%	0.787	S	S	*	*			trans	-170.1	152.2	148.4	-113.6	10.7	0	0	0	112.9
977	G	27.3	Very low	30.2	Very low	71 Å²	71	128.8 Å²	128.8	73%	0.732	78%	0.781	S	S	*	*			trans	116.9	86.3	144.6	0	0	0	0	0	119.4
978	S	32.1	Very low	30.3	Very low	107 Å²	107	130.1 Å²	130.1	75%	0.748	77%	0.773	S	S	*	*				179.9	108.5	129.8	33.5	0	0	0	0	108.6
979	S	30	Very low	30.5	Very low	109 Å²	109	132.9 Å²	132.9	76%	0.762	78%	0.778	S	S	*	*				66.9	142.9	74.1	72.7	0	0	0	0	112.3
980	I	29.6	Very low	30.5	Very low	148 Å²	148	133 Å²	133	76%	0.759	77%	0.766	S	S	*	*			cis	-156.7	141.5	42.5	-70.9	161.5	0	0	0	110.6
981	Q	32.9	Very low	30.4	Very low	161 Å²	161	138.9 Å²	138.9	75%	0.752	77%	0.766	S	S	*	*				-170.7	126.5	124.7	-121.9	165.3	-16.2	0	0	114.7
982	Q	32.9	Very low	30.8	Very low	151 Å²	151	137 Å²	137	71%	0.706	76%	0.756	S	S	*	*			trans	36.1	145.2	140.3	-66.7	170.1	-12.9	0	0	120.7
983	N	29.9	Very low	30.6	Very low	152 Å²	152	141.4 Å²	141.4	81%	0.813	76%	0.763	S	S	*	*			cis	-160.5	154.8	8.7	-122.1	-5.4	0	0	0	110.1
984	G	33.7	Very low	30.6	Very low	71 Å²	71	140 Å²	140	73%	0.732	77%	0.77	S	S	*	*			trans	168.8	135.6	171.4	0	0	0	0	0	115
985	N	30.7	Very low	30.3	Very low	139 Å²	139	142 Å²	142	74%	0.743	77%	0.772	S	S	*	*			trans	-94.5	139.6	-173.5	-62.6	-21.6	0	0	0	112.9
986	Y	31	Very low	30.5	Very low	221 Å²	221	146 Å²	146	87%	0.867	78%	0.775	S	S	*	*				174.8	158	104.1	-90.8	-71.2	0	0	0	109.8
987	P	33.3	Very low	30.5	Very low	109 Å²	109	145.4 Å²	145.4	71%	0.708	77%	0.77	S	S	*	*			trans	-111.4	173.2	-152.1	43.2	-40	0	0	0	117
988	E	28.2	Very low	30.7	Very low	155 Å²	155	147.5 Å²	147.5	72%	0.724	77%	0.77	S	S	*	*			trans	68.8	102.5	142.2	-165.9	163.3	-122	0	0	120.2
989	K	31	Very low	30.4	Very low	205 Å²	205	151.4 Å²	151.4	89%	0.891	78%	0.777	S	S	*	*				-153.7	137.7	117.2	-114.1	166.1	-171.5	172.6	0	113.4
990	Q	28.9	Very low	30.3	Very low	120 Å²	120	153.2 Å²	153.2	56%	0.561	78%	0.777	S	S	*	*			trans	-80.5	174.5	165.9	-52.4	137.5	-16.6	0	0	108.2
991	Y	30.2	Very low	30.3	Very low	197 Å²	197	154.7 Å²	154.7	77%	0.773	78%	0.779	S	S	*	*			cis	-160.4	-176.2	34.5	-106.8	-44.7	0	0	0	110.2
992	P	36	Very low	30	Very low	95 Å²	95	152.9 Å²	152.9	62%	0.617	78%	0.784	S	S	*	*			trans	-136.6	-170	-137.7	46.3	-27.2	0	0	0	116.5
993	K	26.8	Very low	29.9	Very low	206 Å²	206	152.5 Å²	152.5	90%	0.896	78%	0.783	S	S	*	*			trans	59.4	110	154.2	-71	172.3	-178.7	174.2	0	118.3
994	G	29.8	Very low	29.9	Very low	83 Å²	83	153.9 Å²	153.9	86%	0.856	78%	0.783	S	S	*	*			trans	-149.8	100.9	157.6	0	0	0	0	0	111.8
995	K	27.2	Very low	29.4	Very low	205 Å²	205	158.5 Å²	158.5	89%	0.891	79%	0.785	S	S	*	*			trans	-85.5	141.6	167.9	-67	177.7	175.5	-179.3	0	108.9
996	I	29.8	Very low	29.2	Very low	153 Å²	153	159 Å²	159	79%	0.785	78%	0.783	S	S	*	*				174	126.3	117.3	-91.7	158.9	0	0	0	111.8
997	K	28.1	Very low	29	Very low	195 Å²	195	155 Å²	155	85%	0.848	78%	0.777	S	S	*	*			trans	47.6	143.4	156.1	-66.9	-179.2	177.1	-172	0	122
998	P	31.6	Very low	29	Very low	115 Å²	115	155.2 Å²	155.2	75%	0.747	78%	0.776	S	S	*	*			trans	-90.7	157.7	166.4	38.4	-33.8	0	0	0	112.3
999	E	26	Very low	29	Very low	189 Å²	189	157.9 Å²	157.9	88%	0.883	78%	0.781	S	S	*	*			trans	-176.2	107.3	132.7	-106.6	169.5	-130.7	0	0	110.9
1000	L	28.3	Very low	28.9	Very low	148 Å²	148	158 Å²	158	78%	0.775	78%	0.781	S	S	*	*			trans	179.9	140.5	157.6	-121.4	78.4	0	0	0	104.5
1001	F	31	Very low	29	Very low	179 Å²	179	158.8 Å²	158.8	79%	0.785	79%	0.794	S	S	*	*			cis	-124	137.2	15.3	-70	-110.1	0	0	0	112
1002	S	26.1	Very low	28.9	Very low	123 Å²	123	155 Å²	155	86%	0.86	80%	0.797	S	S	*	*			trans	-115.2	143.5	140.5	53.8	0	0	0	0	107
1003	M	30.1	Very low	28.5	Very low	142 Å²	142	153.7 Å²	153.7	70%	0.7	80%	0.8	S	S	*	*			trans	-141.2	137.6	-179.3	-159.7	175.5	-174.1	0	0	109.6
1004	F	29.8	Very low	28.7	Very low	182 Å²	182	151.1 Å²	151.1	80%	0.798	80%	0.795	S	S	*	*			trans	70.8	86.7	-178.3	-53.1	-71.4	0	0	0	117
1005	E	24.3	Very low	28.7	Very low	167 Å²	167	155.6 Å²	155.6	78%	0.78	79%	0.793	S	S	*	*				-137.8	-175.7	117.1	-163.4	141	-142.6	0	0	109.5
1006	Q	26.7	Very low	28.8	Very low	149 Å²	149	151.4 Å²	151.4	70%	0.696	79%	0.789	S	S	*	*			trans	-66.3	176.8	-160.9	-57.6	133.4	25.9	0	0	113.6
1007	D	26.7	Very low	28.8	Very low	139 Å²	139	148.1 Å²	148.1	74%	0.743	78%	0.784	S	S	*	*			cis	-170.9	-178.2	31.3	-161.1	8.1	0	0	0	114.1
1008	V	31.6	Very low	29.1	Very low	112 Å²	112	145.6 Å²	145.6	68%	0.679	79%	0.785	S	S	*	*			trans	89.1	122.1	156.8	-161.5	0	0	0	0	121
1009	Y	28.6	Very low	29	Very low	212 Å²	212	147.3 Å²	147.3	83%	0.831	79%	0.788	S	S	*	*			trans	-30.2	142.4	157	-59.1	-103.4	0	0	0	118.4
1010	K	30	Very low	29.3	Very low	208 Å²	208	150.6 Å²	150.6	90%	0.904	79%	0.793	S	S	*	*				-174.1	158.8	89.2	-123.2	172.6	-177.5	174.7	0	113.6
1011	T	30	Very low	29.4	Very low	135 Å²	135	148.6 Å²	148.6	83%	0.828	79%	0.791	S	S	*	*			trans	-79.7	158.6	-178.2	-41.3	0	0	0	0	113
1012	S	27.8	Very low	29.6	Very low	118 Å²	118	151.3 Å²	151.3	83%	0.825	80%	0.797	S	S	*	*			trans	-70.5	160.2	-169.7	51.7	0	0	0	0	117.2
1013	G	28.6	Very low	30	Very low	67 Å²	67	150.8 Å²	150.8	69%	0.691	79%	0.794	S	S	*	*			trans	-173.2	115.3	162.5	0	0	0	0	0	116.2
1014	I	30.5	Very low	30.1	Very low	153 Å²	153	149 Å²	149	79%	0.785	80%	0.796	S	S	*	*			trans	84.3	106.8	146.2	-57.5	173.2	0	0	0	119.9
1015	Q	29.3	Very low	30.4	Very low	176 Å²	176	144 Å²	144	82%	0.822	79%	0.788	S	S	*	*			trans	42.7	144.3	131.9	-54	172.9	-53.1	0	0	120.5
1016	C	30.2	Very low	30.8	Very low	118 Å²	118	143.8 Å²	143.8	80%	0.797	79%	0.786	S	S	*	*			cis	-135.3	146.6	24.8	-73.7	0	0	0	0	110.8
1017	A	29	Very low	31.1	Very low	83 Å²	83	143.3 Å²	143.3	69%	0.686	79%	0.787	S	S	*	*			cis	80.9	106.3	47.3	0	0	0	0	0	114.6
1018	T	35.6	Very low	31.5	Very low	143 Å²	143	147.3 Å²	147.3	88%	0.877	79%	0.792	S	S	*	*			trans	-142.4	110.1	162.3	52.5	0	0	0	0	109
1019	D	29.4	Very low	31.4	Very low	151 Å²	151	148.2 Å²	148.2	81%	0.807	79%	0.793	S	S	*	*			trans	-81.3	157.3	-176.3	-69	-64.4	0	0	0	114.3
1020	R	32.1	Very low	31.6	Very low	258 Å²	258	144.7 Å²	144.7	97%	0.974	79%	0.788	S	S	*	*			trans	-151	112.6	140.2	-111.4	176	-169.5	-175.2	3.2	110.6
1021	S	29.5	Very low	31.7	Very low	105 Å²	105	141.3 Å²	141.3	73%	0.734	78%	0.78	S	S	*	*			trans	-108.4	167.3	179.3	54.4	0	0	0	0	111.6
1022	Y	35.3	Very low	31.7	Very low	236 Å²	236	143 Å²	143	93%	0.925	78%	0.78	S	S	*	*			trans	-129.2	149.8	165.7	-103	-84.6	0	0	0	110.5
1023	S	34.3	Very low	31.8	Very low	113 Å²	113	143.5 Å²	143.5	79%	0.79	77%	0.773	S	S	*	*			trans	-42.5	162.4	-179	-98.8	0	0	0	0	116.9
1024	S	33.3	Very low	31.8	Very low	105 Å²	105	148.3 Å²	148.3	73%	0.734	78%	0.775	S	S	*	*			cis	-159.7	146.8	37	-157.3	0	0	0	0	116.2
1025	A	34.6	Very low	31.8	Very low	76 Å²	76	147.6 Å²	147.6	63%	0.628	77%	0.773	S	S	*	*			trans	39.9	145.5	145.3	0	0	0	0	0	121.4
1026	H	33.8	Very low	31.7	Very low	162 Å²	162	146.1 Å²	146.1	75%	0.75	77%	0.771	S	S	*	*			cis	-148.5	142.5	35.6	-103	-90.5	0	0	0	114
1027	I	33.5	Very low	31.9	Very low	139 Å²	139	145.7 Å²	145.7	71%	0.713	77%	0.765	S	S	*	*				36.1	128.6	121.6	-61.2	-172.2	0	0	0	117.4
1028	R	34.8	Very low	32	Very low	223 Å²	223	148.3 Å²	148.3	84%	0.842	77%	0.767	S	S	*	*			cis	-155.4	162.8	26.1	-152.2	177.3	179.7	141.4	-2	112.9
1029	N	29.4	Very low	31.7	Very low	131 Å²	131	148.5 Å²	148.5	70%	0.701	76%	0.762	S	S	*	*			trans	-73	170.7	159.1	-56.9	-8.9	0	0	0	110.1
1030	D	33.5	Very low	31.7	Very low	138 Å²	138	146.8 Å²	146.8	74%	0.738	76%	0.758	S	S	*	*				-159.8	175.9	52.1	-87.8	-60.8	0	0	0	114.4
1031	N	30.8	Very low	31.5	Very low	138 Å²	138	141.7 Å²	141.7	74%	0.738	75%	0.75	S	S	*	*			trans	-94.9	147.4	-165.3	-50.6	-87	0	0	0	114.5
1032	M	30.5	Very low	31.5	Very low	169 Å²	169	142.8 Å²	142.8	83%	0.833	75%	0.748	S	S	*	*				163.9	152.7	102.8	-89.8	-136.7	162.5	0	0	117
1033	L	30	Very low	31.4	Very low	129 Å²	129	139.6 Å²	139.6	68%	0.675	75%	0.747	S	S	*	*			trans	83.7	122.3	147.7	-113.7	71.8	0	0	0	122.8
1034	K	27.9	Very low	31.3	Very low	168 Å²	168	140.5 Å²	140.5	73%	0.73	74%	0.742	S	S	*	*			trans	52.9	109.3	143.1	-76.7	173.9	-176.4	179.7	0	118.1
1035	N	31.5	Very low	31.3	Very low	139 Å²	139	143 Å²	143	74%	0.743	75%	0.748	S	S	*	*				-173	136.9	58.5	-82.9	-34.7	0	0	0	107.8
1036	N	27.5	Very low	31.3	Very low	145 Å²	145	146.4 Å²	146.4	78%	0.775	76%	0.755	S	S	*	*				95.1	143.5	59.3	-162.7	22.4	0	0	0	113.2
1037	V	33.8	Very low	31.1	Very low	109 Å²	109	144.5 Å²	144.5	66%	0.661	76%	0.755	S	S	*	*			trans	94.9	96.3	171.1	-169.4	0	0	0	0	119.3
1038	N	30.1	Very low	30.9	Very low	137 Å²	137	147.4 Å²	147.4	73%	0.733	77%	0.765	S	S	*	*			trans	69.1	103.5	136.6	-60.2	6.8	0	0	0	124
1039	N	30.4	Very low	30.7	Very low	147 Å²	147	143.3 Å²	143.3	79%	0.786	76%	0.759	S	S	*	*				152.5	139.3	119.3	-81.5	-11.1	0	0	0	109.5
1040	T	29.6	Very low	30.8	Very low	116 Å²	116	142.9 Å²	142.9	71%	0.712	77%	0.766	S	S	*	*			cis	-158.9	151.3	-0.3	6.7	0	0	0	0	108
1041	N	28.3	Very low	30.6	Very low	150 Å²	150	142.1 Å²	142.1	80%	0.802	77%	0.767	S	S	*	*			trans	-175.5	139.4	137.1	-99.1	-17.1	0	0	0	114.5
1042	N	29.9	Very low	30.6	Very low	129 Å²	129	143 Å²	143	69%	0.69	77%	0.771	S	S	*	*			trans	14.7	132.8	152.3	-54.5	-4.3	0	0	0	121
1043	N	31.2	Very low	30.5	Very low	169 Å²	169	143.6 Å²	143.6	90%	0.904	77%	0.774	S	S	*	*			trans	-109.1	146.7	132.6	-96.4	-22.3	0	0	0	108.8
1044	N	32.8	Very low	30.4	Very low	131 Å²	131	143.9 Å²	143.9	70%	0.701	78%	0.782	S	S	*	*			trans	-82.7	165.3	179	-56.2	-38.4	0	0	0	111.3
1045	N	34.2	Very low	30.5	Very low	158 Å²	158	141.1 Å²	141.1	85%	0.845	78%	0.783	S	S	*	*			trans	-142.4	95.4	147.3	-92.2	-23	0	0	0	107.9
1046	D	33	Very low	30.2	Very low	148 Å²	148	145.2 Å²	145.2	79%	0.791	80%	0.795	S	S	*	*			trans	35.3	132.6	146.9	-51.4	-22.2	0	0	0	121.6
1047	V	29.7	Very low	30.3	Very low	122 Å²	122	144 Å²	144	74%	0.739	79%	0.793	S	S	*	*			trans	-126.9	115.4	173	169.6	0	0	0	0	108.3	I1049	V1047-I1049 HydrophobicContact CG1-CD1 3.85Å; V1047-I1049 HydrophobicContact CG1-CG1 3.72Å
1048	E	31.1	Very low	29.9	Very low	199 Å²	199	147 Å²	147	93%	0.93	80%	0.801	S	S	*	*			trans	-99.3	127.2	159.9	-72.2	-161.7	137.9	0	0	109.6
1049	I	30.7	Very low	29.8	Very low	138 Å²	138	150.4 Å²	150.4	71%	0.708	81%	0.81	S	S	*	*			trans	-107.9	122.1	177.3	-75.3	159.1	0	0	0	108.3	V1047 T1051	V1047-I1049 HydrophobicContact CG1-CD1 3.85Å; V1047-I1049 HydrophobicContact CG1-CG1 3.72Å; I1049-T1051 HydrophobicContact CG2-CG2 3.8Å
1050	S	29.5	Very low	29.5	Very low	122 Å²	122	153.3 Å²	153.3	85%	0.853	81%	0.809	S	S	*	*			trans	-107.2	126.1	159.2	50.3	0	0	0	0	108.8
1051	T	30.5	Very low	29.4	Very low	122 Å²	122	153.5 Å²	153.5	75%	0.748	81%	0.806	S	S	*	*			trans	-103.6	119.3	178.4	50	0	0	0	0	110.2	I1049	I1049-T1051 HydrophobicContact CG2-CG2 3.8Å
1052	D	30.1	Very low	29.6	Very low	156 Å²	156	154.2 Å²	154.2	83%	0.834	81%	0.805	S	S	*	*			trans	-148.9	130.8	160.3	-121.2	-29.7	0	0	0	110.1
1053	M	28.9	Very low	29.3	Very low	181 Å²	181	156 Å²	156	89%	0.892	81%	0.806	S	S	*	*			trans	-160.7	65.6	-166.3	-115.3	-78.2	-128.7	0	0	113.4
1054	T	28.2	Very low	29.3	Very low	136 Å²	136	153.6 Å²	153.6	83%	0.834	80%	0.8	S	S	*	*			trans	-142.1	72.3	171.4	46.2	0	0	0	0	114
1055	S	30	Very low	28.9	Very low	110 Å²	110	154.7 Å²	154.7	77%	0.769	80%	0.8	S	S	*	*			trans	-152.4	114.5	157.2	58.2	0	0	0	0	113.9	V1057	S1055-V1057 PolarHBondContact O-N 3.09Å
1056	F	24.8	Very low	28.7	Very low	224 Å²	224	155.7 Å²	155.7	98%	0.982	80%	0.8	S	S	*	*			trans	-86.9	92	166.2	-97.6	-94.2	0	0	0	109.3
1057	V	29	Very low	28.4	Very low	121 Å²	121	154.7 Å²	154.7	73%	0.733	80%	0.803	S	S	*	*			trans	-136	110.4	172.5	-179.3	0	0	0	0	111.5	S1055	S1055-V1057 PolarHBondContact O-N 3.09Å
1058	M	25.6	Very low	28.5	Very low	170 Å²	170	157.2 Å²	157.2	84%	0.837	81%	0.811	S	S	*	*			trans	31.3	95.4	138.4	-152.5	77.1	157.6	0	0	117.4
1059	K	27.5	Very low	28.1	Very low	209 Å²	209	152.9 Å²	152.9	91%	0.909	80%	0.802	S	S	*	*			trans	-109	118.7	164.4	-151.8	169.8	-170.8	176.8	0	111.5
1060	R	25.7	Very low	28.2	Very low	208 Å²	208	157.2 Å²	157.2	79%	0.785	81%	0.812	S	S	*	*			trans	-112.4	150.6	179.6	-153.5	-176.8	-171	158.1	1.2	108.2
1061	N	27.3	Very low	28.4	Very low	120 Å²	120	154.8 Å²	154.8	64%	0.642	81%	0.806	S	S	*	*			trans	69.7	156.3	179.8	-40.3	-12.3	0	0	0	113.4
1062	H	31.1	Very low	28.2	Very low	166 Å²	166	156.7 Å²	156.7	77%	0.769	81%	0.811	S	S	*	*			cis	-131.7	154.7	10.8	-96.3	-83.4	0	0	0	112.7
1063	K	23.4	Very low	28.4	Very low	167 Å²	167	157.9 Å²	157.9	73%	0.726	81%	0.812	S	S	*	*			trans	-71.5	145.1	150.2	-73.2	-177.9	170.9	-171.1	0	109.5	E1065	K1063-E1065 IonicContact NZ-OE1 2.7Å
1064	P	31.7	Very low	28.6	Very low	118 Å²	118	156.6 Å²	156.6	77%	0.766	80%	0.803	S	S	*	*			trans	-95.2	160	134	34.9	-28.6	0	0	0	110.6
1065	E	25.7	Very low	28.9	Very low	153 Å²	153	156.8 Å²	156.8	72%	0.715	80%	0.799	S	S	*	*			trans	-104.6	-159.2	166.4	-63.1	-175.2	149.6	0	0	108.5	K1063	K1063-E1065 IonicContact NZ-OE1 2.7Å
1066	E	30	Very low	29.1	Very low	180 Å²	180	155.4 Å²	155.4	84%	0.841	79%	0.794	S	S	*	*			trans	71.8	111.5	-175	-50.9	-178.6	163.3	0	0	113.6
1067	C	26.3	Very low	29.5	Very low	127 Å²	127	150.4 Å²	150.4	86%	0.858	78%	0.782	S	S	*	*			cis	67.2	73.5	47.6	-52.9	0	0	0	0	113.4	S1069	C1067-S1069 PolarHBondContact O-N 3.36Å
1068	I	31.1	Very low	29.8	Very low	175 Å²	175	150.9 Å²	150.9	90%	0.897	78%	0.78	S	S	*	*			trans	-75.6	106.2	166	-59.6	176.6	0	0	0	108.7
1069	S	23.8	Very low	30	Very low	107 Å²	107	149.3 Å²	149.3	75%	0.748	78%	0.776	S	S	*	*			trans	-141.8	108.4	165.4	-167.2	0	0	0	0	110.1	C1067	C1067-S1069 PolarHBondContact O-N 3.36Å
1070	Y	32.7	Very low	30.4	Very low	230 Å²	230	145.7 Å²	145.7	90%	0.902	77%	0.766	S	S	*	*			trans	-145.1	136.1	169.9	-80.1	-90.3	0	0	0	106.5
1071	G	32.4	Very low	30.9	Very low	71 Å²	71	144 Å²	144	73%	0.732	77%	0.767	S	S	*	*			cis	-164	166.8	-6.5	0	0	0	0	0	110.7
1072	N	26	Very low	31	Very low	162 Å²	162	148.5 Å²	148.5	87%	0.866	77%	0.774	S	S	*	*			trans	-74.6	144.9	-177.2	-70.4	-24.1	0	0	0	112.7
1073	H	35.5	Very low	31	Very low	181 Å²	181	148.2 Å²	148.2	84%	0.838	77%	0.773	S	S	*	*			trans	-142.8	145.1	148.3	-101.4	-82.3	0	0	0	110.7
1074	H	33.7	Very low	31.8	Very low	153 Å²	153	145 Å²	145	71%	0.708	77%	0.77	S	S	*	*			trans	-21.6	149.7	159.5	-67.5	-77.4	0	0	0	117.2
1075	D	33.4	Very low	31.8	Very low	140 Å²	140	148.8 Å²	148.8	75%	0.749	78%	0.776	S	S	*	*			cis	-163.7	173.3	6.6	-114.1	-20	0	0	0	113
1076	A	34	Very low	32	Very low	81 Å²	81	152 Å²	152	67%	0.669	78%	0.783	S	S	*	*			trans	77	125.6	150.2	0	0	0	0	0	123.3
1077	T	34	Very low	32.5	Very low	119 Å²	119	147.9 Å²	147.9	73%	0.73	77%	0.773	S	S	*	*			trans	70	109	140.6	50.4	0	0	0	0	122.8
1078	D	33.9	Very low	33	Very low	131 Å²	131	149.4 Å²	149.4	70%	0.701	77%	0.767	S	S	*	*				74.8	117	121.7	-63.9	-7.8	0	0	0	123.4
1079	N	31.3	Very low	33.2	Very low	138 Å²	138	147.7 Å²	147.7	74%	0.738	76%	0.755	S	S	*	*			trans	56.9	136.2	130.6	-56.4	-51.4	0	0	0	119.5
1080	L	35	Very low	33.7	Very low	133 Å²	133	149.1 Å²	149.1	70%	0.696	75%	0.753	S	S	*	*			cis	-163.8	142.2	39.5	-167.3	72.7	0	0	0	113.7
1081	Q	35.6	Very low	33.7	Very low	173 Å²	173	145 Å²	145	81%	0.808	75%	0.746	S	S	*	*			trans	61.8	166.4	154.3	-81.9	170.9	-31.9	0	0	122.5
1082	R	29.7	Very low	34	Very low	213 Å²	213	146.3 Å²	146.3	80%	0.804	74%	0.742	S	S	*	*			trans	-138	167.7	-174.9	-50.2	-179.5	-172.6	173.7	2.6	111.5
1083	H	30.8	Very low	34.4	Very low	161 Å²	161	146.1 Å²	146.1	75%	0.745	74%	0.741	S	S	*	*			trans	83.1	155	145.1	-75.4	-42	0	0	0	119.9
1084	P	40.3	Very low	34.4	Very low	100 Å²	100	143.3 Å²	143.3	65%	0.649	73%	0.732	S	S	*	*			trans	-131.8	-179.7	-137.4	44.8	-30.7	0	0	0	115.3
1085	H	32.7	Very low	34.6	Very low	196 Å²	196	146.6 Å²	146.6	91%	0.907	74%	0.738	S	S	*	*			trans	-149.8	152.9	152.7	-96.4	-73.5	0	0	0	113.5
1086	Y	29.9	Very low	34.7	Very low	220 Å²	220	147.4 Å²	147.4	86%	0.863	74%	0.742	S	S	*	*			trans	-110.4	-177.2	169.8	-99.6	-76.1	0	0	0	108
1087	P	41.2	Very low	34.7	Very low	95 Å²	95	149 Å²	149	62%	0.617	75%	0.747	S	S	*	*			cis	-131	-150.8	-18.5	36.4	-16.6	0	0	0	113.4
1088	H	36.1	Very low	35	Very low	159 Å²	159	148.8 Å²	148.8	74%	0.736	75%	0.75	S	S	*	*			trans	94.7	145.7	170.6	-63.7	-86.5	0	0	0	117.4
1089	Q	34.7	Very low	35.2	Very low	138 Å²	138	151.6 Å²	151.6	65%	0.645	76%	0.759	S	S	*	*			cis	-177.2	125.3	-18.3	167.4	176.8	-16.1	0	0	111.2
1090	I	33.8	Very low	35.7	Very low	137 Å²	137	155.5 Å²	155.5	70%	0.703	79%	0.788	S	S	*	*			trans	63.9	147.1	156.5	-66	173.9	0	0	0	115.8
1091	D	32.7	Very low	35.7	Very low	144 Å²	144	156.7 Å²	156.7	77%	0.77	79%	0.792	S	S	*	*			cis	-140.6	-178.3	3.3	-123.2	-16.4	0	0	0	109.4
1092	P	39.9	Very low	35.7	Very low	99 Å²	99	155.8 Å²	155.8	64%	0.643	79%	0.791	S	S	*	*			trans	-95.8	-171.3	-177.5	40.2	-37.6	0	0	0	115.6
1093	D	34.5	Very low	36.1	Very low	157 Å²	157	152.6 Å²	152.6	84%	0.84	79%	0.791	S	S	*	*			trans	93.3	144.2	165.6	-63.7	-15.6	0	0	0	120.4
1094	D	35.3	Very low	36.4	Very low	123 Å²	123	152.1 Å²	152.1	66%	0.658	79%	0.793	S	S	*	*			trans	63.3	85.1	159.7	-125.7	38.6	0	0	0	120
1095	R	36.9	Very low	36.1	Very low	222 Å²	222	155.4 Å²	155.4	84%	0.838	80%	0.802	S	S	*	*				172.1	161.7	96.1	-93.2	161.7	-163.9	-153.3	-0.8	118.3
1096	L	36.9	Very low	36.4	Very low	156 Å²	156	152.7 Å²	152.7	82%	0.817	80%	0.795	S	S	*	*			trans	-65	146.6	177.2	-96.1	63.7	0	0	0	115.5
1097	C	33.7	Very low	36.8	Very low	116 Å²	116	147.9 Å²	147.9	78%	0.784	79%	0.791	S	S	*	*			trans	55.9	108	139.4	-59.4	0	0	0	0	121
1098	S	41.2	Very low	36.5	Very low	114 Å²	114	151.9 Å²	151.9	80%	0.797	80%	0.804	S	S	*	*				-156.9	133.3	118.5	54.2	0	0	0	0	113
1099	Q	37.7	Very low	36.5	Very low	189 Å²	189	151.3 Å²	151.3	88%	0.883	81%	0.81	S	S	*	*			trans	28.2	111.7	151.9	-62.6	172.2	-20.1	0	0	119.7
1100	V	41	Very low	36.7	Very low	221 Å²	221	152.5 Å²	152.5	100%	1.339	83%	0.825	S	S	*	*				-161.7	0	91.2	149.6	0	0	0	0	109.2

Retrieved 1,100 of 1,100 residues in 1423 ms (Link to these results)

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