A0A5K4FB73_SCHMA Loading...

Voltage-gated hydrogen channel 1

AlphaFold DB , UniProt , Accession A0A5K4FB73, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 960 aa.

						>A0A5K4FB73_SCHMA|A0A5K4FB73
MKSVISECGMQSHISDKTVDSNNPSEAEDYDKFEYNYGWARSRKFLKQLVKDNIDLSLVEYEILRHTKNKKPKTWKQYFLVCLRSNVLQVLMSLLVLLDAGIVISEIVLEIQSLQTYKSNFRTQLEDFRDIICTVMYRTAPEMELPFQCYSDEQELHFRKSSKKLNFTSYNKLMQNQTSPVEHTNHVKIFTEESNFTNPSPRIENTHHFHLNNHLEKDDELLMDMCSFLSHWYKKYEPSIKCFLNSEMNNIIQSIFSNSIPINVASNLTETKNQTSIYLNDKPKIFQLGSQTDLPTIISFLFSTVNSTNFYEHINENELLSHYDNVHNEGFCGDSYLKKRQLGARAMHEASEILHYLSIAITALFFLCVILKLICIGKEFFRDTNEYFDGAIIVASLASDVLYVRYVSETAAAMVVLLLWRIIRIINALMMHKKQQYEFRIAMQKRSRRILGRKMEVIRTEKEMQDKHILALENLLKEMGVSSDTIRKCKPLYKKCTKEQTNNALKSIAALTTGFMGGLVGAPSHVQDVISKYGKSKFSSTQNFAQSTLQQSESLNVLSKYQRQSVPRLVHIQLPGNKRLHNQQMCNNYEKSTNYTFTDRDHISDEIKPPSIVQATGEDNSDFDKLFKRPRAFSLNPQEHWSSLQDKQFQSLLLQSESTTKLTKGLQTMKYLNDADILCEKAEKSSMSIFLRHTSDDTLNETISNYYFANTSKGHQHFLRTLPNIFKKALNINKHKTNILEEEGEINEQDEHNKLVDQKQRKNYLIHGKENFQRTNNSYPHSQTTSTVQEILEVDEMSPICNLNGSNEFMDSQTDIMFMKDNKICSDINKDYMVPSNVVQNKDKHLCQLTNTNDHINDTNIKQSIKSVHNINNNVHNVYNELAVNRKESDEQIWILQPGYIWCQSENQAKLSTKKRKYSATKSPPREKSRTKKIKQVFSRDKTSNKISKALSMKPQSTSS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.5	Very low	34.4	Very low	202 Å²	202	149.5 Å²	149.5	100%	0.995	83%	0.834	S	S	*	*				0	-12.9	0	-138.8	170.3	-166.4	0	0	114.8
2	K	34.2	Very low	33.7	Very low	215 Å²	215	145.4 Å²	145.4	94%	0.935	82%	0.824	S	S	*	*			trans	-90.2	1.8	171.5	-84.7	-167.7	173	-172.5	0	115.1
3	S	38.3	Very low	33.1	Very low	113 Å²	113	147.7 Å²	147.7	79%	0.79	82%	0.823	S	S	*	*	S	Bend	trans	-119	14.1	-167.2	-163.2	0	0	0	0	114.7
4	V	42.5	Very low	33.2	Very low	129 Å²	129	149.3 Å²	149.3	78%	0.782	83%	0.826	S	S	*	*	S	Bend	trans	-129.8	31.8	-173.3	-159.8	0	0	0	0	110.5
5	I	38.7	Very low	32.9	Very low	149 Å²	149	145.5 Å²	145.5	76%	0.764	82%	0.815	S	S	*	*	S	Bend	trans	-119.6	-5.5	-172	-64.2	175.1	0	0	0	111.2
6	S	34.6	Very low	32.6	Very low	117 Å²	117	146.4 Å²	146.4	82%	0.818	82%	0.817	S	S	*	*	S	Bend	trans	-104.3	-4.4	-172.1	-159	0	0	0	0	115.6
7	E	31.3	Very low	32.4	Very low	192 Å²	192	149.2 Å²	149.2	90%	0.897	82%	0.818	S	S	*	*			trans	-133.8	78.1	-173.9	-69.8	-171.6	123	0	0	112.4
8	C	31.9	Very low	32.5	Very low	122 Å²	122	148.6 Å²	148.6	82%	0.824	82%	0.82	S	S	*	*			trans	-160.9	67.1	154	-164.1	0	0	0	0	111.6	M10	C8-M10 PolarHBondContact O-N 3.07Å
9	G	25.4	Very low	32.6	Very low	78 Å²	78	148.3 Å²	148.3	80%	0.804	82%	0.822	S	S	*	*			trans	-84.6	103.3	167.4	0	0	0	0	0	110.9
10	M	32.7	Very low	32.5	Very low	162 Å²	162	148.1 Å²	148.1	80%	0.798	82%	0.82	S	S	*	*			trans	-143.9	137.7	168.7	-93.1	-96.1	68	0	0	109.6	C8	C8-M10 PolarHBondContact O-N 3.07Å
11	Q	28.1	Very low	32.4	Very low	165 Å²	165	146.1 Å²	146.1	77%	0.771	82%	0.817	S	S	*	*			trans	-60.1	150.9	-171	-109	72.9	-4.5	0	0	115
12	S	26.4	Very low	32.1	Very low	101 Å²	101	142.6 Å²	142.6	71%	0.706	80%	0.802	S	S	*	*			trans	-54.9	125.8	158.2	49.1	0	0	0	0	112.8
13	H	26.3	Very low	32.1	Very low	175 Å²	175	137.9 Å²	137.9	81%	0.81	79%	0.787	S	S	*	*			trans	-170.9	81.2	140.1	-114.5	-77.5	0	0	0	112.4
14	I	33.2	Very low	32.1	Very low	170 Å²	170	136.6 Å²	136.6	87%	0.872	78%	0.776	S	S	*	*			trans	-134.7	114.9	154	-60.7	-178	0	0	0	105.5
15	S	29.5	Very low	31.9	Very low	93 Å²	93	134.5 Å²	134.5	65%	0.65	77%	0.767	S	S	*	*			trans	-74.2	136.8	-166.7	-54.8	0	0	0	0	113.4	K17	S15-K17 PolarHBondContact O-N 3.34Å; S15-K17 VanDerWaalsContact O-N 3.14Å
16	D	28.4	Very low	31.8	Very low	159 Å²	159	135 Å²	135	85%	0.85	77%	0.766	S	S	*	*	S	Bend	trans	-59.9	110.3	155	-69.8	-68.4	0	0	0	109.5
17	K	29.4	Very low	32	Very low	194 Å²	194	132.5 Å²	132.5	84%	0.843	75%	0.753	S	S	*	*			trans	169.6	81.9	161.5	-94.8	152.3	-174	-179.8	0	109.9	S15	S15-K17 PolarHBondContact O-N 3.34Å; S15-K17 VanDerWaalsContact O-N 3.14Å
18	T	32.7	Very low	32.3	Very low	138 Å²	138	130.4 Å²	130.4	85%	0.847	74%	0.743	S	S	*	*			trans	177.8	38.8	162.3	22.7	0	0	0	0	112
19	V	34.7	Very low	32.7	Very low	143 Å²	143	130.2 Å²	130.2	87%	0.867	73%	0.733	S	S	*	*	S	Bend	trans	-110.4	111.3	163	178.2	0	0	0	0	105.7	S21	V19-S21 PolarHBondContact O-N 3.04Å
20	D	30.4	Very low	33.3	Very low	145 Å²	145	131.9 Å²	131.9	78%	0.775	72%	0.716	S	S	*	*			trans	-61.2	120.2	-170.2	-60.9	-67.2	0	0	0	111.8	N22	D20-N22 PolarHBondContact O-N 2.98Å
21	S	31	Very low	33.6	Very low	107 Å²	107	130.4 Å²	130.4	75%	0.748	71%	0.712	S	S	*	*			trans	-74	11.2	-176.1	49.2	0	0	0	0	114.7	V19	V19-S21 PolarHBondContact O-N 3.04Å
22	N	34.4	Very low	34.2	Very low	128 Å²	128	127.2 Å²	127.2	68%	0.684	70%	0.695	S	S	*	*	S	Bend	trans	-111.8	19.4	-155.8	-64.3	2.4	0	0	0	114.3	D20	D20-N22 PolarHBondContact O-N 2.98Å
23	N	34.1	Very low	34.7	Very low	115 Å²	115	127.2 Å²	127.2	62%	0.615	68%	0.683	S	S	*	*			trans	-154.2	93.8	165.1	-103.5	-30.1	0	0	0	110.7	S25	N23-S25 VanDerWaalsContact C-N 3.25Å; N23-S25 PolarHBondContact O-N 3.44Å
24	P	39.1	Very low	35.5	Very low	87 Å²	87	124.2 Å²	124.2	57%	0.565	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-31.2	177.1	-23.1	34.2	0	0	0	113.4	E26 A27	P24-E26 PolarHBondContact O-N 3.06Å; P24-A27 PolarHBondContact O-N 3.25Å
25	S	38	Very low	36.2	Very low	85 Å²	85	119.8 Å²	119.8	59%	0.594	64%	0.642	S	S	*	*	H	α-helix	trans	-64.9	-27.1	-168.9	49.5	0	0	0	0	115.9	N23	N23-S25 VanDerWaalsContact C-N 3.25Å; N23-S25 PolarHBondContact O-N 3.44Å
26	E	37	Very low	37.3	Very low	158 Å²	158	119 Å²	119	74%	0.738	63%	0.63	S	S	*	*	H	α-helix	trans	-84.8	-11.6	177.9	-70.5	-155.4	146.7	0	0	113.9	P24 Y30	P24-E26 PolarHBondContact O-N 3.06Å; E26-Y30 WeakPolarHBondContact O-CD2 3.5Å; E26-Y30 WeakPolarHBondContact O-CE2 3.3Å
27	A	37.8	Very low	38.6	Very low	66 Å²	66	112.6 Å²	112.6	55%	0.545	60%	0.595	S	S	.	*	H	α-helix	trans	-91.6	-44.7	-178.9	0	0	0	0	0	112.3	P24 D29 Y30	P24-A27 PolarHBondContact O-N 3.25Å; A27-D29 VanDerWaalsContact C-N 3.34Å; A27-D29 PolarHBondContact O-N 2.96Å; A27-Y30 PolarHBondContact O-N 2.88Å
28	E	37.6	Very low	39.8	Very low	147 Å²	147	106 Å²	106	69%	0.687	58%	0.582	S	S	*	*	H	α-helix	trans	-67.5	-29.8	-169.6	-65.2	-178.5	170.2	0	0	113.8	Y30 D31	E28-Y30 PolarHBondContact O-N 3.06Å; E28-D31 PolarHBondContact O-N 3.42Å
29	D	40.4	Very low	41	Very low	118 Å²	118	102.2 Å²	102.2	63%	0.631	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-10.7	-177.3	-154	35.1	0	0	0	113.6	A27	A27-D29 VanDerWaalsContact C-N 3.34Å; A27-D29 PolarHBondContact O-N 2.96Å
30	Y	37.9	Very low	42.1	Very low	114 Å²	114	95.5 Å²	95.5	45%	0.447	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-23.6	176.7	-72.7	-87.5	0	0	0	114.4	E26 A27 E28 K32	E26-Y30 WeakPolarHBondContact O-CD2 3.5Å; E26-Y30 WeakPolarHBondContact O-CE2 3.3Å; A27-Y30 PolarHBondContact O-N 2.88Å; E28-Y30 PolarHBondContact O-N 3.06Å; Y30-K32 VanDerWaalsContact C-N 3.29Å; Y30-K32 PolarHBondContact O-N 3.16Å
31	D	39.1	Very low	43.5	Very low	131 Å²	131	98.5 Å²	98.5	70%	0.701	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-5.6	-178.2	-84.3	-19	0	0	0	113.1	E28 F33	E28-D31 PolarHBondContact O-N 3.42Å; D31-F33 PolarHBondContact O-N 3.44Å; D31-F33 VanDerWaalsContact O-N 3.15Å
32	K	41.4	Very low	45.1	Very low	98 Å²	98	95.9 Å²	95.9	43%	0.426	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-11.7	178	-167.4	171.7	178.3	-176.5	0	114.7	Y30 D383	Y30-K32 VanDerWaalsContact C-N 3.29Å; Y30-K32 PolarHBondContact O-N 3.16Å; K32-D383 WeakPolarHBondContact CE-OD2 3.45Å; K32-D383 IonicContact NZ-OD1 3.73Å; K32-D383 PolarHBondContact NZ-OD1 3.19Å; K32-D383 IonicContact NZ-OD2 2.73Å; K32-D383 PolarHBondContact NZ-OD2 3.26Å
33	F	37.2	Very low	46.4	Very low	100 Å²	100	100.3 Å²	100.3	44%	0.439	50%	0.501	S	S	.	.	S	Bend	trans	-118.8	110.8	-175.5	-65.6	-76	0	0	0	112.6	D31 Y35	D31-F33 PolarHBondContact O-N 3.44Å; D31-F33 VanDerWaalsContact O-N 3.15Å; F33-Y35 VanDerWaalsContact C-N 3.29Å; F33-Y35 HydrophobicContact CB-CD2 4Å; F33-Y35 HydrophobicContact CB-CE1 4.24Å; F33-Y35 HydrophobicContact CB-CE2 3.48Å; F33-Y35 VanDerWaalsContact CB-CE2 3.48Å; F33-Y35 HydrophobicContact CG-CE2 4.44Å; F33-Y35 WeakPolarHBondContact O-CD2 3.48Å; F33-Y35 PolarHBondContact O-N 3.27Å
34	E	43	Very low	48	Very low	112 Å²	112	103.6 Å²	103.6	52%	0.523	51%	0.51	S	S	.	.			trans	-70.8	79.6	175.4	-164.9	-172	-149	0	0	111.5	N36 Q77	E34-N36 PolarHBondContact O-N 3.46Å; E34-N36 VanDerWaalsContact O-N 3.09Å; E34-Q77 PolarHBondContact OE1-NE2 2.9Å
35	Y	47.1	Very low	49.2	Very low	78 Å²	78	100.8 Å²	100.8	31%	0.306	49%	0.489	S	S	.	.			trans	-69.3	106.5	-177.1	-69.9	-73.9	0	0	0	112.8	F33 Y37	F33-Y35 VanDerWaalsContact C-N 3.29Å; F33-Y35 HydrophobicContact CB-CD2 4Å; F33-Y35 HydrophobicContact CB-CE1 4.24Å; F33-Y35 HydrophobicContact CB-CE2 3.48Å; F33-Y35 VanDerWaalsContact CB-CE2 3.48Å; F33-Y35 HydrophobicContact CG-CE2 4.44Å; F33-Y35 WeakPolarHBondContact O-CD2 3.48Å; F33-Y35 PolarHBondContact O-N 3.27Å; Y35-Y37 VanDerWaalsContact CB-OH 3.3Å; Y35-Y37 WeakPolarHBondContact CB-OH 3.44Å; Y35-Y37 HydrophobicContact CG-CE1 4.27Å; Y35-Y37 AromaticContact CG-CZ 3.92Å; Y35-Y37 WeakPolarHBondContact O-CD2 3.2Å; Y35-Y37 PolarHBondContact O-N 3.23Å
36	N	51.7	Low	50.4	Low	75 Å²	75	99.3 Å²	99.3	40%	0.401	47%	0.474	S	S	.	.			trans	-82.7	93.6	166.6	-175.7	9.7	0	0	0	111.3	E34 G38 W39	E34-N36 PolarHBondContact O-N 3.46Å; E34-N36 VanDerWaalsContact O-N 3.09Å; N36-G38 PolarHBondContact O-N 2.91Å; N36-W39 PolarHBondContact O-NE1 3.24Å
37	Y	55.6	Low	51.9	Low	26 Å²	26	99.8 Å²	99.8	10%	0.102	47%	0.474	C	S	.	.	G	3₁₀ helix	trans	-69.2	16.8	-177.5	-64.4	-66.9	0	0	0	116.6	Y35 W39 A40 I63 H66 F439	Y35-Y37 VanDerWaalsContact CB-OH 3.3Å; Y35-Y37 WeakPolarHBondContact CB-OH 3.44Å; Y35-Y37 HydrophobicContact CG-CE1 4.27Å; Y35-Y37 AromaticContact CG-CZ 3.92Å; Y35-Y37 WeakPolarHBondContact O-CD2 3.2Å; Y35-Y37 PolarHBondContact O-N 3.23Å; Y37-W39 PolarHBondContact O-N 3.12Å; Y37-W39 VanDerWaalsContact O-N 3.09Å; Y37-A40 HydrophobicContact CD1-CB 4.24Å; Y37-A40 WeakPolarHBondContact O-CB 3.37Å; Y37-A40 PolarHBondContact O-N 2.86Å; Y37-I63 HydrophobicContact CG-CG1 4.4Å; Y37-H66 HydrophobicContact CD2-CB 4.29Å; Y37-H66 HydrophobicContact CE2-CB 3.73Å; Y37-H66 AromaticContact CE2-CD2 3.47Å; Y37-H66 VanDerWaalsContact CE2-CD2 3.47Å; Y37-H66 WeakPolarHBondContact CE2-CD2 3.47Å; Y37-H66 AromaticContact CE2-CG 3.67Å; Y37-H66 AromaticContact CZ-CD2 3.71Å; Y37-H66 PolarHBondContact OH-CD2 2.99Å; Y37-H66 VanDerWaalsContact OH-CD2 3.27Å; Y37-H66 PolarHBondContact OH-NE2 2.86Å; Y37-F439 HydrophobicContact CD1-CZ 4.33Å; Y37-F439 HydrophobicContact CE1-CD2 4.39Å; Y37-F439 AromaticContact CE1-CE2 3.56Å; Y37-F439 HydrophobicContact CE1-CE2 3.56Å; Y37-F439 AromaticContact CE1-CZ 3.63Å; Y37-F439 HydrophobicContact CE1-CZ 3.63Å
38	G	56.2	Low	53.1	Low	56 Å²	56	100 Å²	100	58%	0.577	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-54.1	-32.7	-179.8	0	0	0	0	0	114.2	N36	N36-G38 PolarHBondContact O-N 2.91Å
39	W	57.7	Low	54.4	Low	57 Å²	57	93.3 Å²	93.3	22%	0.216	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-78.8	-24.9	175.7	58.3	-90.6	0	0	0	114	N36 Y37 R41 S42 F45 F439	N36-W39 PolarHBondContact O-NE1 3.24Å; Y37-W39 PolarHBondContact O-N 3.12Å; Y37-W39 VanDerWaalsContact O-N 3.09Å; W39-R41 PolarHBondContact O-N 2.97Å; W39-S42 WeakPolarHBondContact O-CB 3.23Å; W39-S42 PolarHBondContact O-N 3.31Å; W39-F45 HydrophobicContact CE3-CD1 4.46Å; W39-F45 HydrophobicContact CE3-CE1 4.41Å; W39-F45 HydrophobicContact CE3-CZ 4.45Å; W39-F45 HydrophobicContact CH2-CZ 4.44Å; W39-F45 HydrophobicContact CZ3-CD1 4.4Å; W39-F45 HydrophobicContact CZ3-CD2 4.23Å; W39-F45 AromaticContact CZ3-CE1 3.95Å; W39-F45 HydrophobicContact CZ3-CE1 3.95Å; W39-F45 AromaticContact CZ3-CE2 3.8Å; W39-F45 HydrophobicContact CZ3-CE2 3.8Å; W39-F45 AromaticContact CZ3-CZ 3.64Å; W39-F45 HydrophobicContact CZ3-CZ 3.64Å; W39-F439 HydrophobicContact CH2-CB 4.06Å; W39-F439 AromaticContact CH2-CD1 3.46Å; W39-F439 HydrophobicContact CH2-CD1 3.46Å; W39-F439 VanDerWaalsContact CH2-CD1 3.46Å; W39-F439 HydrophobicContact CH2-CE1 4.08Å; W39-F439 AromaticContact CH2-CG 3.87Å; W39-F439 HydrophobicContact CH2-CG 3.87Å; W39-F439 HydrophobicContact CZ2-CB 4.49Å; W39-F439 HydrophobicContact CZ2-CD1 4.23Å; W39-F439 HydrophobicContact CZ2-CG 4.3Å; W39-F439 HydrophobicContact CZ3-CD1 4.29Å
40	A	58.3	Low	55.7	Low	3 Å²	3	92.1 Å²	92.1	3%	0.025	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-22	179.6	0	0	0	0	0	112.4	Y37 S42 F45 I63	Y37-A40 HydrophobicContact CD1-CB 4.24Å; Y37-A40 WeakPolarHBondContact O-CB 3.37Å; Y37-A40 PolarHBondContact O-N 2.86Å; A40-S42 VanDerWaalsContact C-N 3.28Å; A40-S42 PolarHBondContact O-N 3.44Å; A40-F45 HydrophobicContact CB-CD1 4.38Å; A40-F45 HydrophobicContact CB-CE1 4.15Å; A40-F45 WeakPolarHBondContact O-CD1 3.29Å; A40-I63 HydrophobicContact CB-CD1 4.38Å
41	R	59.7	Low	57.2	Low	207 Å²	207	93.5 Å²	93.5	78%	0.781	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-2.7	172.4	-155	173.6	-171.6	167.8	6.1	113.7	W39 R43	W39-R41 PolarHBondContact O-N 2.97Å; R41-R43 PolarHBondContact O-N 2.98Å
42	S	63	Low	58.2	Low	52 Å²	52	89.3 Å²	89.3	36%	0.364	42%	0.415	S	S	.	.			trans	-65	127.1	-178.7	177.3	0	0	0	0	111.8	W39 A40 K44 F45 L46	W39-S42 WeakPolarHBondContact O-CB 3.23Å; W39-S42 PolarHBondContact O-N 3.31Å; A40-S42 VanDerWaalsContact C-N 3.28Å; A40-S42 PolarHBondContact O-N 3.44Å; S42-K44 PolarHBondContact O-N 3.48Å; S42-K44 VanDerWaalsContact O-N 3.08Å; S42-K44 PolarHBondContact OG-N 3.37Å; S42-F45 PolarHBondContact O-N 2.96Å; S42-L46 WeakPolarHBondContact O-CB 3.26Å; S42-L46 PolarHBondContact O-N 3.47Å
43	R	63.4	Low	59.1	Low	221 Å²	221	91.6 Å²	91.6	83%	0.834	43%	0.432	S	S	*	.	H	α-helix	trans	-54.7	-29.3	176.1	-68.4	-175.6	-179.4	178.5	1	113.2	R41 K47	R41-R43 PolarHBondContact O-N 2.98Å; R43-K47 WeakPolarHBondContact O-CB 3.47Å; R43-K47 WeakPolarHBondContact O-CG 3.21Å; R43-K47 PolarHBondContact O-N 3Å; R43-K47 VanDerWaalsContact O-N 3.07Å
44	K	67	Low	60.3	Low	185 Å²	185	87.4 Å²	87.4	80%	0.804	41%	0.414	S	S	*	.	H	α-helix	trans	-69.9	-46.4	175.7	-67.8	-174.1	178.2	-177.8	0	111.2	S42 Q48	S42-K44 PolarHBondContact O-N 3.48Å; S42-K44 VanDerWaalsContact O-N 3.08Å; S42-K44 PolarHBondContact OG-N 3.37Å; K44-Q48 PolarHBondContact O-N 3.27Å; K44-Q48 VanDerWaalsContact O-N 3.12Å
45	F	64.7	Low	61.2	Low	27 Å²	27	86 Å²	86	12%	0.118	41%	0.41	C	S	.	.	H	α-helix	trans	-66.2	-42.3	176.6	-178.5	-112.4	0	0	0	111.7	W39 A40 S42 K47 Q48 L49 R440	W39-F45 HydrophobicContact CE3-CD1 4.46Å; W39-F45 HydrophobicContact CE3-CE1 4.41Å; W39-F45 HydrophobicContact CE3-CZ 4.45Å; W39-F45 HydrophobicContact CH2-CZ 4.44Å; W39-F45 HydrophobicContact CZ3-CD1 4.4Å; W39-F45 HydrophobicContact CZ3-CD2 4.23Å; W39-F45 AromaticContact CZ3-CE1 3.95Å; W39-F45 HydrophobicContact CZ3-CE1 3.95Å; W39-F45 AromaticContact CZ3-CE2 3.8Å; W39-F45 HydrophobicContact CZ3-CE2 3.8Å; W39-F45 AromaticContact CZ3-CZ 3.64Å; W39-F45 HydrophobicContact CZ3-CZ 3.64Å; A40-F45 HydrophobicContact CB-CD1 4.38Å; A40-F45 HydrophobicContact CB-CE1 4.15Å; A40-F45 WeakPolarHBondContact O-CD1 3.29Å; S42-F45 PolarHBondContact O-N 2.96Å; F45-K47 PolarHBondContact O-N 3.34Å; F45-Q48 CarbonylContact O-C 3.39Å; F45-Q48 WeakPolarHBondContact O-CA 3.37Å; F45-Q48 WeakPolarHBondContact O-CB 3.43Å; F45-Q48 PolarHBondContact O-N 3.43Å; F45-L49 HydrophobicContact CD1-CD1 3.7Å; F45-L49 HydrophobicContact CD1-CG 4.16Å; F45-L49 HydrophobicContact CE1-CD1 3.38Å; F45-L49 HydrophobicContact CE1-CD2 4.17Å; F45-L49 HydrophobicContact CE1-CG 3.87Å; F45-L49 HydrophobicContact CE2-CD2 4.3Å; F45-L49 HydrophobicContact CE2-CG 4.35Å; F45-L49 HydrophobicContact CZ-CD1 3.94Å; F45-L49 HydrophobicContact CZ-CD2 3.83Å; F45-L49 HydrophobicContact CZ-CG 3.96Å; F45-L49 WeakPolarHBondContact O-CG 3.49Å; F45-L49 PolarHBondContact O-N 2.91Å; F45-R440 HydrophobicContact CE2-CG 3.9Å; F45-R440 HydrophobicContact CZ-CG 4.49Å
46	L	63.4	Low	62.1	Low	55 Å²	55	86 Å²	86	29%	0.288	42%	0.415	S	S	.	.	H	α-helix	trans	-65.7	-38.8	-179.9	-146.5	150.7	0	0	0	111.9	S42 Q48 L49 V50 L56	S42-L46 WeakPolarHBondContact O-CB 3.26Å; S42-L46 PolarHBondContact O-N 3.47Å; L46-Q48 VanDerWaalsContact C-N 3.34Å; L46-Q48 PolarHBondContact O-N 2.97Å; L46-L49 PolarHBondContact O-N 3.25Å; L46-V50 WeakPolarHBondContact O-CG2 3.45Å; L46-V50 PolarHBondContact O-N 2.96Å; L46-V50 VanDerWaalsContact O-N 3.14Å; L46-L56 HydrophobicContact CD1-CD1 4.11Å; L46-L56 HydrophobicContact CD2-CD1 3.86Å; L46-L56 HydrophobicContact CD2-CD2 4.11Å; L46-L56 HydrophobicContact CG-CD1 3.93Å
47	K	66.8	Low	62.8	Low	168 Å²	168	86.2 Å²	86.2	73%	0.73	42%	0.422	S	S	*	.	H	α-helix	trans	-61.7	-38.2	167.7	-80	-174.3	174.2	-166.5	0	112.7	R43 F45 K51	R43-K47 WeakPolarHBondContact O-CB 3.47Å; R43-K47 WeakPolarHBondContact O-CG 3.21Å; R43-K47 PolarHBondContact O-N 3Å; R43-K47 VanDerWaalsContact O-N 3.07Å; F45-K47 PolarHBondContact O-N 3.34Å; K47-K51 WeakPolarHBondContact O-CB 3.48Å; K47-K51 PolarHBondContact O-N 3.43Å
48	Q	63.9	Low	63.3	Low	69 Å²	69	86.3 Å²	86.3	32%	0.322	42%	0.424	S	S	.	.	H	α-helix	trans	-71.2	-36.7	177.6	-170.2	61.3	46.6	0	0	112.3	K44 F45 L46 K51 D52	K44-Q48 PolarHBondContact O-N 3.27Å; K44-Q48 VanDerWaalsContact O-N 3.12Å; F45-Q48 CarbonylContact O-C 3.39Å; F45-Q48 WeakPolarHBondContact O-CA 3.37Å; F45-Q48 WeakPolarHBondContact O-CB 3.43Å; F45-Q48 PolarHBondContact O-N 3.43Å; L46-Q48 VanDerWaalsContact C-N 3.34Å; L46-Q48 PolarHBondContact O-N 2.97Å; Q48-K51 CarbonylContact O-C 3.45Å; Q48-K51 PolarHBondContact O-N 3.23Å; Q48-D52 PolarHBondContact NE2-OD1 3.13Å; Q48-D52 WeakPolarHBondContact O-CB 3.37Å; Q48-D52 PolarHBondContact O-N 3.46Å
49	L	64.2	Low	63.8	Low	7 Å²	7	84 Å²	84	4%	0.037	40%	0.399	C	S	.	.	H	α-helix	trans	-62.7	-40.7	173.6	-72.6	172.3	0	0	0	112.3	F45 L46 D52 N53 I54 V59	F45-L49 HydrophobicContact CD1-CD1 3.7Å; F45-L49 HydrophobicContact CD1-CG 4.16Å; F45-L49 HydrophobicContact CE1-CD1 3.38Å; F45-L49 HydrophobicContact CE1-CD2 4.17Å; F45-L49 HydrophobicContact CE1-CG 3.87Å; F45-L49 HydrophobicContact CE2-CD2 4.3Å; F45-L49 HydrophobicContact CE2-CG 4.35Å; F45-L49 HydrophobicContact CZ-CD1 3.94Å; F45-L49 HydrophobicContact CZ-CD2 3.83Å; F45-L49 HydrophobicContact CZ-CG 3.96Å; F45-L49 WeakPolarHBondContact O-CG 3.49Å; F45-L49 PolarHBondContact O-N 2.91Å; L46-L49 PolarHBondContact O-N 3.25Å; L49-D52 CarbonylContact O-C 3.52Å; L49-D52 PolarHBondContact O-N 2.87Å; L49-N53 PolarHBondContact O-N 3.06Å; L49-N53 VanDerWaalsContact O-N 3.14Å; L49-I54 HydrophobicContact CD2-CB 4.42Å; L49-I54 HydrophobicContact CD2-CD1 3.84Å; L49-I54 PolarHBondContact O-N 3.36Å; L49-V59 HydrophobicContact CD1-CG1 4.36Å; L49-V59 HydrophobicContact CD1-CG2 3.99Å
50	V	67.8	Low	64.1	Low	94 Å²	94	87.1 Å²	87.1	57%	0.57	42%	0.416	S	S	*	.	H	α-helix	trans	-65.7	-39.5	173.4	172.6	0	0	0	0	110.9	L46 D52 N53	L46-V50 WeakPolarHBondContact O-CG2 3.45Å; L46-V50 PolarHBondContact O-N 2.96Å; L46-V50 VanDerWaalsContact O-N 3.14Å; V50-D52 VanDerWaalsContact C-N 3.33Å; V50-N53 PolarHBondContact O-N 3.39Å; V50-N53 VanDerWaalsContact O-N 3.12Å
51	K	70	Confident	64.5	Low	142 Å²	142	93.6 Å²	93.6	62%	0.617	44%	0.441	S	S	*	.	H	α-helix	trans	-65.5	-33.7	172.6	-175	175	177.4	-179.9	0	113	K47 Q48 N53	K47-K51 WeakPolarHBondContact O-CB 3.48Å; K47-K51 PolarHBondContact O-N 3.43Å; Q48-K51 CarbonylContact O-C 3.45Å; Q48-K51 PolarHBondContact O-N 3.23Å; K51-N53 PolarHBondContact O-N 3.26Å
52	D	60.1	Low	64.7	Low	43 Å²	43	84.3 Å²	84.3	23%	0.23	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	4.4	174.3	-66.5	3.3	0	0	0	112.4	Q48 L49 V50 I54 R440 Q444	Q48-D52 PolarHBondContact NE2-OD1 3.13Å; Q48-D52 WeakPolarHBondContact O-CB 3.37Å; Q48-D52 PolarHBondContact O-N 3.46Å; L49-D52 CarbonylContact O-C 3.52Å; L49-D52 PolarHBondContact O-N 2.87Å; V50-D52 VanDerWaalsContact C-N 3.33Å; D52-I54 HydrophobicContact CB-CD1 4.22Å; D52-I54 HydrophobicContact CB-CG1 4.23Å; D52-I54 PolarHBondContact O-N 2.83Å; D52-R440 IonicContact OD1-NH2 2.96Å; D52-R440 IonicContact OD2-CZ 3.32Å; D52-R440 IonicContact OD2-NE 3.18Å; D52-R440 IonicContact OD2-NH2 2.77Å; D52-R440 PolarHBondContact OD2-NH2 3.39Å; D52-Q444 PolarHBondContact OD2-NE2 3.47Å
53	N	59.5	Low	64.8	Low	146 Å²	146	84.5 Å²	84.5	78%	0.781	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	42	-179.6	-159.4	31.3	0	0	0	114.9	L49 V50 K51	L49-N53 PolarHBondContact O-N 3.06Å; L49-N53 VanDerWaalsContact O-N 3.14Å; V50-N53 PolarHBondContact O-N 3.39Å; V50-N53 VanDerWaalsContact O-N 3.12Å; K51-N53 PolarHBondContact O-N 3.26Å
54	I	62.6	Low	64.8	Low	12 Å²	12	78.5 Å²	78.5	6%	0.062	39%	0.387	C	S	.	.			trans	-97.9	122.8	177.8	-59.3	179.9	0	0	0	109.7	L49 D52 L56 V59 Q444	L49-I54 HydrophobicContact CD2-CB 4.42Å; L49-I54 HydrophobicContact CD2-CD1 3.84Å; L49-I54 PolarHBondContact O-N 3.36Å; D52-I54 HydrophobicContact CB-CD1 4.22Å; D52-I54 HydrophobicContact CB-CG1 4.23Å; D52-I54 PolarHBondContact O-N 2.83Å; I54-L56 PolarHBondContact O-N 3.31Å; I54-L56 VanDerWaalsContact O-N 3.16Å; I54-V59 HydrophobicContact CG2-CG2 4.28Å; I54-Q444 HydrophobicContact CD1-CG 3.88Å
55	D	62.5	Low	64.5	Low	83 Å²	83	76.5 Å²	76.5	44%	0.444	37%	0.374	S	S	.	.			trans	-49.9	117.3	175.3	-85	-32.5	0	0	0	110.9	S57 L58 K454	D55-S57 PolarHBondContact O-N 3.5Å; D55-L58 HydrophobicContact CB-CB 4.31Å; D55-L58 WeakPolarHBondContact O-CB 3.42Å; D55-L58 PolarHBondContact O-N 3.19Å; D55-K454 IonicContact OD2-NZ 3.56Å
56	L	65.5	Low	64.1	Low	79 Å²	79	77.7 Å²	77.7	41%	0.414	38%	0.38	S	S	.	.	H	α-helix	trans	-60.6	-32.3	-179	-179	59.8	0	0	0	112.2	L46 I54 L58 V59 E60	L46-L56 HydrophobicContact CD1-CD1 4.11Å; L46-L56 HydrophobicContact CD2-CD1 3.86Å; L46-L56 HydrophobicContact CD2-CD2 4.11Å; L46-L56 HydrophobicContact CG-CD1 3.93Å; I54-L56 PolarHBondContact O-N 3.31Å; I54-L56 VanDerWaalsContact O-N 3.16Å; L56-L58 VanDerWaalsContact C-N 3.26Å; L56-L58 PolarHBondContact O-N 3.49Å; L56-V59 PolarHBondContact O-N 3.24Å; L56-E60 PolarHBondContact O-N 3.46Å
57	S	66.7	Low	63.8	Low	79 Å²	79	78.6 Å²	78.6	55%	0.552	39%	0.388	S	S	*	.	H	α-helix	trans	-64.8	-25.2	175.6	52.7	0	0	0	0	113.7	D55 Y61	D55-S57 PolarHBondContact O-N 3.5Å; S57-Y61 WeakPolarHBondContact O-CB 3.36Å; S57-Y61 PolarHBondContact O-N 3.26Å
58	L	67	Low	63.2	Low	27 Å²	27	79 Å²	79	14%	0.141	39%	0.39	C	S	.	.	H	α-helix	trans	-69.6	-41.6	172.9	179.8	60.3	0	0	0	110.8	D55 L56 Y61 E62 I450	D55-L58 HydrophobicContact CB-CB 4.31Å; D55-L58 WeakPolarHBondContact O-CB 3.42Å; D55-L58 PolarHBondContact O-N 3.19Å; L56-L58 VanDerWaalsContact C-N 3.26Å; L56-L58 PolarHBondContact O-N 3.49Å; L58-Y61 PolarHBondContact O-N 3.49Å; L58-E62 PolarHBondContact O-N 2.7Å; L58-I450 HydrophobicContact CD1-CD1 3.51Å; L58-I450 HydrophobicContact CD2-CD1 3.92Å; L58-I450 HydrophobicContact CG-CD1 4.38Å
59	V	65.3	Low	62.6	Low	8 Å²	8	82.2 Å²	82.2	5%	0.048	41%	0.409	C	S	.	.	H	α-helix	trans	-70.2	-39.3	177	179	0	0	0	0	110.8	L49 I54 L56 E62 I63	L49-V59 HydrophobicContact CD1-CG1 4.36Å; L49-V59 HydrophobicContact CD1-CG2 3.99Å; I54-V59 HydrophobicContact CG2-CG2 4.28Å; L56-V59 PolarHBondContact O-N 3.24Å; V59-E62 PolarHBondContact O-N 2.6Å; V59-I63 HydrophobicContact CG1-CD1 3.91Å; V59-I63 WeakPolarHBondContact O-CB 3.18Å; V59-I63 VanDerWaalsContact O-CG1 3.23Å; V59-I63 WeakPolarHBondContact O-CG1 3.45Å; V59-I63 PolarHBondContact O-N 3.28Å
60	E	65.7	Low	61.9	Low	123 Å²	123	86.6 Å²	86.6	58%	0.575	43%	0.428	S	S	*	.	H	α-helix	trans	-66	-40.7	174.1	-172.1	159	-143	0	0	112.2	L56 I63 L64	L56-E60 PolarHBondContact O-N 3.46Å; E60-I63 PolarHBondContact O-N 3.01Å; E60-L64 VanDerWaalsContact O-CB 3.26Å; E60-L64 WeakPolarHBondContact O-CB 3.35Å; E60-L64 PolarHBondContact O-N 3.09Å
61	Y	66	Low	61.1	Low	138 Å²	138	90.9 Å²	90.9	54%	0.541	44%	0.439	S	S	.	.	H	α-helix	trans	-61.7	-45.9	173.7	179.1	-96.8	0	0	0	112.3	S57 L58 L64 R65	S57-Y61 WeakPolarHBondContact O-CB 3.36Å; S57-Y61 PolarHBondContact O-N 3.26Å; L58-Y61 PolarHBondContact O-N 3.49Å; Y61-L64 PolarHBondContact O-N 3Å; Y61-R65 WeakPolarHBondContact O-CB 3.2Å; Y61-R65 PolarHBondContact O-N 3.1Å
62	E	63.6	Low	60.2	Low	12 Å²	12	89.9 Å²	89.9	6%	0.056	45%	0.447	C	S	.	.	H	α-helix	trans	-64.3	-43.4	178	-157.1	92.7	-109.9	0	0	111.3	L58 V59 L64 R65 H66 M443 R446	L58-E62 PolarHBondContact O-N 2.7Å; V59-E62 PolarHBondContact O-N 2.6Å; E62-L64 VanDerWaalsContact C-N 3.35Å; E62-L64 PolarHBondContact O-N 2.62Å; E62-R65 PolarHBondContact O-N 2.89Å; E62-H66 PolarHBondContact O-CD2 2.77Å; E62-H66 PolarHBondContact O-N 2.91Å; E62-M443 HydrophobicContact CB-CE 3.84Å; E62-M443 HydrophobicContact CG-CE 3.64Å; E62-M443 WeakPolarHBondContact OE2-CE 3.41Å; E62-R446 IonicContact OE1-NH1 3.68Å; E62-R446 PolarHBondContact OE1-NH1 3.06Å; E62-R446 IonicContact OE2-CZ 3.98Å; E62-R446 IonicContact OE2-NH1 3.65Å; E62-R446 PolarHBondContact OE2-NH1 3.02Å
63	I	64.8	Low	60	Low	56 Å²	56	94.3 Å²	94.3	29%	0.287	46%	0.464	S	S	.	.	H	α-helix	trans	-59.8	-45.1	173.3	-70.9	168.1	0	0	0	110.6	Y37 A40 V59 E60 H66 T67	Y37-I63 HydrophobicContact CG-CG1 4.4Å; A40-I63 HydrophobicContact CB-CD1 4.38Å; V59-I63 HydrophobicContact CG1-CD1 3.91Å; V59-I63 WeakPolarHBondContact O-CB 3.18Å; V59-I63 VanDerWaalsContact O-CG1 3.23Å; V59-I63 WeakPolarHBondContact O-CG1 3.45Å; V59-I63 PolarHBondContact O-N 3.28Å; E60-I63 PolarHBondContact O-N 3.01Å; I63-H66 CarbonylContact O-C 3.51Å; I63-H66 PolarHBondContact O-N 3.15Å; I63-T67 WeakPolarHBondContact O-CG2 3.29Å; I63-T67 PolarHBondContact O-N 3.3Å; I63-T67 PolarHBondContact O-OG1 3.25Å
64	L	63	Low	60.5	Low	96 Å²	96	91.8 Å²	91.8	50%	0.503	45%	0.454	S	S	.	.	H	α-helix	trans	-63.4	-44.1	-179.7	-167.4	73.1	0	0	0	111.2	E60 Y61 E62 H66 T67 K68	E60-L64 VanDerWaalsContact O-CB 3.26Å; E60-L64 WeakPolarHBondContact O-CB 3.35Å; E60-L64 PolarHBondContact O-N 3.09Å; Y61-L64 PolarHBondContact O-N 3Å; E62-L64 VanDerWaalsContact C-N 3.35Å; E62-L64 PolarHBondContact O-N 2.62Å; L64-H66 VanDerWaalsContact C-N 3.35Å; L64-H66 PolarHBondContact O-N 3.45Å; L64-T67 WeakPolarHBondContact CA-OG1 3.15Å; L64-T67 WeakPolarHBondContact O-CA 3.29Å; L64-T67 PolarHBondContact O-N 2.85Å; L64-T67 PolarHBondContact O-OG1 3.31Å; L64-K68 PolarHBondContact O-N 3.05Å
65	R	61.3	Low	60.8	Low	143 Å²	143	100.7 Å²	100.7	54%	0.54	49%	0.487	S	S	.	.	H	α-helix	trans	-58	-46.3	174.9	-158.8	176	-166.1	-148.3	0.3	111.1	Y61 E62 T67 K68	Y61-R65 WeakPolarHBondContact O-CB 3.2Å; Y61-R65 PolarHBondContact O-N 3.1Å; E62-R65 PolarHBondContact O-N 2.89Å; R65-T67 PolarHBondContact O-N 3.37Å; R65-K68 PolarHBondContact O-N 3.04Å
66	H	55.5	Low	60.9	Low	51 Å²	51	101.1 Å²	101.1	24%	0.236	49%	0.485	C	S	.	.	H	α-helix	trans	-74.5	2.1	172.5	-69.4	-66.4	0	0	0	114.9	Y37 E62 I63 L64 K70	Y37-H66 HydrophobicContact CD2-CB 4.29Å; Y37-H66 HydrophobicContact CE2-CB 3.73Å; Y37-H66 AromaticContact CE2-CD2 3.47Å; Y37-H66 VanDerWaalsContact CE2-CD2 3.47Å; Y37-H66 WeakPolarHBondContact CE2-CD2 3.47Å; Y37-H66 AromaticContact CE2-CG 3.67Å; Y37-H66 AromaticContact CZ-CD2 3.71Å; Y37-H66 PolarHBondContact OH-CD2 2.99Å; Y37-H66 VanDerWaalsContact OH-CD2 3.27Å; Y37-H66 PolarHBondContact OH-NE2 2.86Å; E62-H66 PolarHBondContact O-CD2 2.77Å; E62-H66 PolarHBondContact O-N 2.91Å; I63-H66 CarbonylContact O-C 3.51Å; I63-H66 PolarHBondContact O-N 3.15Å; L64-H66 VanDerWaalsContact C-N 3.35Å; L64-H66 PolarHBondContact O-N 3.45Å; H66-K70 WeakPolarHBondContact O-CD 3.48Å; H66-K70 WeakPolarHBondContact O-CE 3.43Å; H66-K70 WeakPolarHBondContact O-CG 3.42Å; H66-K70 PolarHBondContact O-NZ 3.46Å
67	T	58.1	Low	60.8	Low	75 Å²	75	100.1 Å²	100.1	46%	0.46	48%	0.478	S	S	.	.	H	α-helix	trans	-103	-36.4	166.9	56.7	0	0	0	0	113.1	I63 L64 R65 N69 K70	I63-T67 WeakPolarHBondContact O-CG2 3.29Å; I63-T67 PolarHBondContact O-N 3.3Å; I63-T67 PolarHBondContact O-OG1 3.25Å; L64-T67 WeakPolarHBondContact CA-OG1 3.15Å; L64-T67 WeakPolarHBondContact O-CA 3.29Å; L64-T67 PolarHBondContact O-N 2.85Å; L64-T67 PolarHBondContact O-OG1 3.31Å; R65-T67 PolarHBondContact O-N 3.37Å; T67-N69 VanDerWaalsContact C-N 3.32Å; T67-N69 PolarHBondContact O-N 3.23Å; T67-K70 PolarHBondContact O-N 3.07Å
68	K	53.3	Low	60.7	Low	177 Å²	177	104.3 Å²	104.3	77%	0.77	48%	0.483	S	S	*	.	H	α-helix	trans	-63.4	-34.3	177.1	-83.1	-166.9	170.2	-171.7	0	113.2	L64 R65 K70	L64-K68 PolarHBondContact O-N 3.05Å; R65-K68 PolarHBondContact O-N 3.04Å; K68-K70 VanDerWaalsContact C-N 3.26Å; K68-K70 PolarHBondContact O-N 3.38Å
69	N	52.2	Low	60.6	Low	135 Å²	135	105.7 Å²	105.7	72%	0.722	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	5.6	-179.7	-70.3	14.3	0	0	0	114.2	T67 K71	T67-N69 VanDerWaalsContact C-N 3.32Å; T67-N69 PolarHBondContact O-N 3.23Å; N69-K71 PolarHBondContact O-N 3.28Å
70	K	48.4	Very low	60.6	Low	100 Å²	100	106.8 Å²	106.8	44%	0.435	49%	0.493	S	S	.	.			trans	-87.5	102.9	-175.7	-78	-175.6	164.6	113.2	0	112.5	H66 T67 K68	H66-K70 WeakPolarHBondContact O-CD 3.48Å; H66-K70 WeakPolarHBondContact O-CE 3.43Å; H66-K70 WeakPolarHBondContact O-CG 3.42Å; H66-K70 PolarHBondContact O-NZ 3.46Å; T67-K70 PolarHBondContact O-N 3.07Å; K68-K70 VanDerWaalsContact C-N 3.26Å; K68-K70 PolarHBondContact O-N 3.38Å
71	K	52.2	Low	60.6	Low	184 Å²	184	103.5 Å²	103.5	80%	0.8	48%	0.481	S	S	*	.			trans	-50.8	153.3	160.1	-66.5	179.3	-179.1	177.9	0	110.5	N69 K73	N69-K71 PolarHBondContact O-N 3.28Å; K71-K73 PolarHBondContact O-N 3.32Å
72	P	50.5	Low	60.6	Low	121 Å²	121	99.6 Å²	99.6	79%	0.786	47%	0.474	S	S	*	.			trans	-57.5	137	-177.8	23.4	-34.5	0	0	0	111.7	T74	P72-T74 PolarHBondContact O-N 2.88Å
73	K	55.8	Low	60.7	Low	135 Å²	135	100.1 Å²	100.1	59%	0.587	48%	0.477	S	S	*	.			trans	-76.2	114.8	-172.4	-66.7	-178.9	-179.2	178.4	0	111.9	K71 Q77	K71-K73 PolarHBondContact O-N 3.32Å; K73-Q77 HydrophobicContact CB-CB 4.47Å
74	T	69.9	Low	60.7	Low	93 Å²	93	104 Å²	104	57%	0.571	49%	0.488	S	S	*	.			trans	-61.4	148.9	167.5	-42	0	0	0	0	110.3	P72 K76 Q77 Y78	P72-T74 PolarHBondContact O-N 2.88Å; T74-K76 PolarHBondContact O-N 3.43Å; T74-Q77 WeakPolarHBondContact O-CB 3.46Å; T74-Q77 PolarHBondContact O-N 2.82Å; T74-Y78 PolarHBondContact O-N 3.43Å
75	W	69	Low	61.1	Low	200 Å²	200	101.4 Å²	101.4	76%	0.758	48%	0.477	S	S	*	.	H	α-helix	trans	-48.3	-38.2	177	175.6	57.8	0	0	0	113.3	Q77 Y78 F79	W75-Q77 PolarHBondContact O-N 3.28Å; W75-Y78 WeakPolarHBondContact O-CB 3.44Å; W75-Y78 PolarHBondContact O-N 2.88Å; W75-Y78 VanDerWaalsContact O-N 3.1Å; W75-F79 PolarHBondContact O-N 2.96Å
76	K	65	Low	61.6	Low	91 Å²	91	98.7 Å²	98.7	40%	0.396	47%	0.474	S	S	.	.	H	α-helix	trans	-49.7	-49.3	171.5	-65.9	-166.1	173.2	-155.6	0	113	T74 Y78 F79 L80 I374	T74-K76 PolarHBondContact O-N 3.43Å; K76-Y78 VanDerWaalsContact C-N 3.34Å; K76-Y78 PolarHBondContact O-N 3.46Å; K76-F79 PolarHBondContact O-N 3.15Å; K76-L80 WeakPolarHBondContact O-CG 3.27Å; K76-L80 PolarHBondContact O-N 3.12Å; K76-I374 PolarHBondContact NZ-O 3.25Å
77	Q	63.6	Low	62.4	Low	58 Å²	58	101.3 Å²	101.3	27%	0.271	49%	0.493	S	S	.	.	H	α-helix	trans	-66.1	-33.5	179.6	-78.9	176.8	-33.7	0	0	112.8	E34 K73 T74 W75 V81	E34-Q77 PolarHBondContact OE1-NE2 2.9Å; K73-Q77 HydrophobicContact CB-CB 4.47Å; T74-Q77 WeakPolarHBondContact O-CB 3.46Å; T74-Q77 PolarHBondContact O-N 2.82Å; W75-Q77 PolarHBondContact O-N 3.28Å; Q77-V81 WeakPolarHBondContact O-CB 3.39Å; Q77-V81 VanDerWaalsContact O-CG2 3.24Å; Q77-V81 WeakPolarHBondContact O-CG2 3.43Å; Q77-V81 PolarHBondContact O-N 2.98Å
78	Y	63.7	Low	63	Low	168 Å²	168	100 Å²	100	66%	0.659	48%	0.483	S	S	*	.	H	α-helix	trans	-64.8	-44.3	173.2	-175.4	-90.8	0	0	0	110.9	T74 W75 K76 V81 C82	T74-Y78 PolarHBondContact O-N 3.43Å; W75-Y78 WeakPolarHBondContact O-CB 3.44Å; W75-Y78 PolarHBondContact O-N 2.88Å; W75-Y78 VanDerWaalsContact O-N 3.1Å; K76-Y78 VanDerWaalsContact C-N 3.34Å; K76-Y78 PolarHBondContact O-N 3.46Å; Y78-V81 PolarHBondContact O-N 3.04Å; Y78-C82 PolarHBondContact O-N 3.29Å
79	F	66.5	Low	63.8	Low	55 Å²	55	93.3 Å²	93.3	24%	0.241	45%	0.454	C	S	.	.	H	α-helix	trans	-66.8	-38.7	176.9	-167.7	-101.5	0	0	0	112.5	W75 K76 C82 L83 L371 C375	W75-F79 PolarHBondContact O-N 2.96Å; K76-F79 PolarHBondContact O-N 3.15Å; F79-C82 WeakPolarHBondContact O-CB 3.49Å; F79-C82 PolarHBondContact O-N 3.19Å; F79-L83 HydrophobicContact CD1-CD1 3.52Å; F79-L83 HydrophobicContact CD1-CG 4.08Å; F79-L83 HydrophobicContact CE1-CD1 3.26Å; F79-L83 HydrophobicContact CE1-CD2 4.38Å; F79-L83 HydrophobicContact CE1-CG 3.84Å; F79-L83 HydrophobicContact CZ-CD1 4.13Å; F79-L83 HydrophobicContact CZ-CD2 4.48Å; F79-L83 HydrophobicContact CZ-CG 4.3Å; F79-L83 WeakPolarHBondContact O-CG 3.48Å; F79-L83 PolarHBondContact O-N 3.49Å; F79-L371 HydrophobicContact CE1-CB 3.77Å; F79-L371 HydrophobicContact CE1-CD2 4.3Å; F79-L371 HydrophobicContact CZ-CB 3.98Å; F79-L371 HydrophobicContact CZ-CD2 3.82Å; F79-C375 HydrophobicContact CD1-CB 4.15Å; F79-C375 WeakPolarHBondContact CD1-SG 3.41Å
80	L	65.6	Low	64.8	Low	31 Å²	31	90.8 Å²	90.8	16%	0.162	44%	0.443	C	S	.	.	H	α-helix	trans	-61.1	-42.9	170.6	-70.8	-173	0	0	0	112.7	K76 C82 L83 R84 C375 I376	K76-L80 WeakPolarHBondContact O-CG 3.27Å; K76-L80 PolarHBondContact O-N 3.12Å; L80-C82 PolarHBondContact O-N 2.99Å; L80-L83 PolarHBondContact O-N 2.76Å; L80-R84 VanDerWaalsContact O-CB 3.27Å; L80-R84 WeakPolarHBondContact O-CB 3.24Å; L80-R84 PolarHBondContact O-N 3.46Å; L80-C375 HydrophobicContact CD2-CB 3.49Å; L80-C375 VanDerWaalsContact CD2-CB 3.49Å; L80-C375 HydrophobicContact CG-CB 3.96Å; L80-I376 HydrophobicContact CD1-CG1 4.25Å; L80-I376 HydrophobicContact CD2-CB 4.4Å; L80-I376 HydrophobicContact CD2-CD1 4.37Å; L80-I376 HydrophobicContact CD2-CG1 3.37Å; L80-I376 HydrophobicContact CG-CG1 4.45Å
81	V	64.8	Low	66	Low	54 Å²	54	89.9 Å²	89.9	33%	0.327	44%	0.443	S	S	.	.	H	α-helix	trans	-61.7	-34.6	175.1	162.1	0	0	0	0	111.2	Q77 Y78 S85	Q77-V81 WeakPolarHBondContact O-CB 3.39Å; Q77-V81 VanDerWaalsContact O-CG2 3.24Å; Q77-V81 WeakPolarHBondContact O-CG2 3.43Å; Q77-V81 PolarHBondContact O-N 2.98Å; Y78-V81 PolarHBondContact O-N 3.04Å; V81-S85 PolarHBondContact O-N 3.03Å
82	C	65.7	Low	66.9	Low	57 Å²	57	83 Å²	83	39%	0.385	41%	0.414	S	S	.	.	H	α-helix	trans	-68.5	-53.5	172.3	-160.9	0	0	0	0	111.6	Y78 F79 L80 R84 S85 L88	Y78-C82 PolarHBondContact O-N 3.29Å; F79-C82 WeakPolarHBondContact O-CB 3.49Å; F79-C82 PolarHBondContact O-N 3.19Å; L80-C82 PolarHBondContact O-N 2.99Å; C82-R84 PolarHBondContact O-N 3.42Å; C82-S85 WeakPolarHBondContact O-CB 3.41Å; C82-S85 PolarHBondContact O-N 3.06Å; C82-L88 HydrophobicContact CB-CD1 4.47Å
83	L	65.4	Low	67.9	Low	22 Å²	22	78.7 Å²	78.7	12%	0.115	39%	0.387	C	S	.	.	H	α-helix	trans	-63.8	-22.9	-179.9	-75.3	175.8	0	0	0	115	F79 L80 L88 K372	F79-L83 HydrophobicContact CD1-CD1 3.52Å; F79-L83 HydrophobicContact CD1-CG 4.08Å; F79-L83 HydrophobicContact CE1-CD1 3.26Å; F79-L83 HydrophobicContact CE1-CD2 4.38Å; F79-L83 HydrophobicContact CE1-CG 3.84Å; F79-L83 HydrophobicContact CZ-CD1 4.13Å; F79-L83 HydrophobicContact CZ-CD2 4.48Å; F79-L83 HydrophobicContact CZ-CG 4.3Å; F79-L83 WeakPolarHBondContact O-CG 3.48Å; F79-L83 PolarHBondContact O-N 3.49Å; L80-L83 PolarHBondContact O-N 2.76Å; L83-L88 HydrophobicContact CD2-CD1 4.19Å; L83-K372 VanDerWaalsContact CD1-CA 3.49Å; L83-K372 HydrophobicContact CD1-CB 3.56Å; L83-K372 HydrophobicContact CD1-CD 4.31Å; L83-K372 HydrophobicContact CD1-CG 3.84Å
84	R	66	Low	68.9	Low	139 Å²	139	77.2 Å²	77.2	53%	0.525	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	5.8	172.9	-161	169.2	-177.3	150.7	0.1	112.5	L80 C82	L80-R84 VanDerWaalsContact O-CB 3.27Å; L80-R84 WeakPolarHBondContact O-CB 3.24Å; L80-R84 PolarHBondContact O-N 3.46Å; C82-R84 PolarHBondContact O-N 3.42Å
85	S	70.9	Confident	69.1	Low	40 Å²	40	75.6 Å²	75.6	28%	0.28	37%	0.373	S	S	.	.	S	Bend	trans	-66.4	138.9	169.8	-176.9	0	0	0	0	110.5	V81 C82 V87 L88 Q89	V81-S85 PolarHBondContact O-N 3.03Å; C82-S85 WeakPolarHBondContact O-CB 3.41Å; C82-S85 PolarHBondContact O-N 3.06Å; S85-V87 PolarHBondContact O-N 3.15Å; S85-V87 VanDerWaalsContact O-N 3.1Å; S85-V87 PolarHBondContact OG-N 2.81Å; S85-L88 PolarHBondContact O-N 3.4Å; S85-L88 VanDerWaalsContact O-N 3.16Å; S85-Q89 PolarHBondContact O-N 3.35Å
86	N	71.7	Confident	69.4	Low	87 Å²	87	66.2 Å²	66.2	47%	0.465	34%	0.337	S	S	.	.	H	α-helix	trans	-50.8	-34	169.5	-61.6	-88.7	0	0	0	111.7	Q89 V90 H432	N86-Q89 PolarHBondContact O-N 2.79Å; N86-V90 WeakPolarHBondContact O-CB 3.45Å; N86-V90 WeakPolarHBondContact O-CG2 3.5Å; N86-V90 PolarHBondContact O-N 3.16Å; N86-H432 PolarHBondContact OD1-CE1 3.39Å; N86-H432 VanDerWaalsContact OD1-CE1 3.25Å
87	V	72.7	Confident	69.8	Low	105 Å²	105	66.7 Å²	66.7	64%	0.636	34%	0.344	S	S	*	.	H	α-helix	trans	-67.2	-47.7	-178.9	-176.2	0	0	0	0	111.1	S85 V90 L91	S85-V87 PolarHBondContact O-N 3.15Å; S85-V87 VanDerWaalsContact O-N 3.1Å; S85-V87 PolarHBondContact OG-N 2.81Å; V87-V90 PolarHBondContact O-N 3.48Å; V87-L91 WeakPolarHBondContact O-CB 3.5Å; V87-L91 PolarHBondContact O-N 3.31Å
88	L	69.2	Low	70.4	Confident	47 Å²	47	68.2 Å²	68.2	25%	0.246	35%	0.353	C	S	.	.	H	α-helix	trans	-72.3	-29.8	176.4	-72.3	-165.9	0	0	0	112.5	C82 L83 S85 V90 L91 M92	C82-L88 HydrophobicContact CB-CD1 4.47Å; L83-L88 HydrophobicContact CD2-CD1 4.19Å; S85-L88 PolarHBondContact O-N 3.4Å; S85-L88 VanDerWaalsContact O-N 3.16Å; L88-V90 VanDerWaalsContact C-N 3.34Å; L88-L91 HydrophobicContact CD2-CB 4.36Å; L88-L91 HydrophobicContact CD2-CD2 3.69Å; L88-L91 PolarHBondContact O-N 3.31Å; L88-M92 WeakPolarHBondContact O-CB 3.43Å; L88-M92 WeakPolarHBondContact O-CG 3.4Å; L88-M92 PolarHBondContact O-N 3.06Å
89	Q	70.6	Confident	71.1	Confident	38 Å²	38	60.4 Å²	60.4	18%	0.178	32%	0.323	C	S	.	.	H	α-helix	trans	-65.8	-38	172.6	-165.5	172.4	16.9	0	0	112	S85 N86 S93 A428 L429	S85-Q89 PolarHBondContact O-N 3.35Å; N86-Q89 PolarHBondContact O-N 2.79Å; Q89-S93 WeakPolarHBondContact O-CB 3.4Å; Q89-S93 PolarHBondContact O-N 2.96Å; Q89-A428 VanDerWaalsContact NE2-C 3.27Å; Q89-A428 PolarHBondContact NE2-O 3.44Å; Q89-L429 HydrophobicContact CG-CD2 3.8Å; Q89-L429 HydrophobicContact CG-CG 4.32Å
90	V	73.4	Confident	71.3	Confident	81 Å²	81	58.3 Å²	58.3	49%	0.491	32%	0.316	S	S	.	.	H	α-helix	trans	-70.1	-43	172	169.8	0	0	0	0	111.3	N86 V87 L88 M92 S93 L94	N86-V90 WeakPolarHBondContact O-CB 3.45Å; N86-V90 WeakPolarHBondContact O-CG2 3.5Å; N86-V90 PolarHBondContact O-N 3.16Å; V87-V90 PolarHBondContact O-N 3.48Å; L88-V90 VanDerWaalsContact C-N 3.34Å; V90-M92 PolarHBondContact O-N 3.4Å; V90-S93 CarbonylContact O-C 3.59Å; V90-S93 WeakPolarHBondContact O-CB 3.36Å; V90-S93 PolarHBondContact O-N 3.23Å; V90-S93 VanDerWaalsContact O-N 3.12Å; V90-L94 HydrophobicContact CG1-CD1 3.95Å; V90-L94 HydrophobicContact CG1-CG 4.34Å; V90-L94 WeakPolarHBondContact O-CG 3.42Å; V90-L94 PolarHBondContact O-N 2.95Å
91	L	74.9	Confident	71.7	Confident	82 Å²	82	58.2 Å²	58.2	43%	0.429	32%	0.323	S	S	.	.	H	α-helix	trans	-60.8	-46.1	178.4	-172.4	68.5	0	0	0	111.8	V87 L88 S93 L94 L95	V87-L91 WeakPolarHBondContact O-CB 3.5Å; V87-L91 PolarHBondContact O-N 3.31Å; L88-L91 HydrophobicContact CD2-CB 4.36Å; L88-L91 HydrophobicContact CD2-CD2 3.69Å; L88-L91 PolarHBondContact O-N 3.31Å; L91-S93 VanDerWaalsContact C-N 3.26Å; L91-S93 PolarHBondContact O-N 3.23Å; L91-L94 PolarHBondContact O-N 2.86Å; L91-L94 VanDerWaalsContact O-N 3.17Å; L91-L95 HydrophobicContact CG-CD1 4.14Å; L91-L95 WeakPolarHBondContact O-CB 3.43Å; L91-L95 WeakPolarHBondContact O-CG 3.25Å; L91-L95 PolarHBondContact O-N 2.91Å
92	M	70.3	Confident	72.2	Confident	39 Å²	39	56.5 Å²	56.5	19%	0.192	31%	0.311	C	S	.	.	H	α-helix	trans	-64.3	-31	175.6	-66.3	-68.2	-80.8	0	0	112.1	L88 V90 L95 V96 F365 C368 V369	L88-M92 WeakPolarHBondContact O-CB 3.43Å; L88-M92 WeakPolarHBondContact O-CG 3.4Å; L88-M92 PolarHBondContact O-N 3.06Å; V90-M92 PolarHBondContact O-N 3.4Å; M92-L95 HydrophobicContact SD-CD1 4.38Å; M92-V96 WeakPolarHBondContact O-CG2 3.47Å; M92-V96 PolarHBondContact O-N 3.39Å; M92-F365 HydrophobicContact CE-CD2 3.54Å; M92-F365 HydrophobicContact CE-CE2 3.39Å; M92-F365 HydrophobicContact CE-CG 4.32Å; M92-F365 HydrophobicContact CE-CZ 4.07Å; M92-F365 HydrophobicContact SD-CD2 4.28Å; M92-F365 HydrophobicContact SD-CE2 4.34Å; M92-C368 HydrophobicContact CE-CB 4.01Å; M92-C368 HydrophobicContact SD-CB 4.45Å; M92-V369 HydrophobicContact CE-CG2 4.27Å
93	S	71.9	Confident	72.5	Confident	31 Å²	31	54 Å²	54	22%	0.217	29%	0.294	C	S	.	.	H	α-helix	trans	-72	-35.8	173.1	-168.7	0	0	0	0	112.7	Q89 V90 L91 L97	Q89-S93 WeakPolarHBondContact O-CB 3.4Å; Q89-S93 PolarHBondContact O-N 2.96Å; V90-S93 CarbonylContact O-C 3.59Å; V90-S93 WeakPolarHBondContact O-CB 3.36Å; V90-S93 PolarHBondContact O-N 3.23Å; V90-S93 VanDerWaalsContact O-N 3.12Å; L91-S93 VanDerWaalsContact C-N 3.26Å; L91-S93 PolarHBondContact O-N 3.23Å; S93-L97 WeakPolarHBondContact O-CG 3.32Å; S93-L97 PolarHBondContact O-N 3.5Å
94	L	76.4	Confident	72.8	Confident	103 Å²	103	57.8 Å²	57.8	54%	0.539	31%	0.313	S	S	.	.	H	α-helix	trans	-71.6	-43	175.7	-72.5	169.7	0	0	0	111.3	V90 L91 V96 L97 L98	V90-L94 HydrophobicContact CG1-CD1 3.95Å; V90-L94 HydrophobicContact CG1-CG 4.34Å; V90-L94 WeakPolarHBondContact O-CG 3.42Å; V90-L94 PolarHBondContact O-N 2.95Å; L91-L94 PolarHBondContact O-N 2.86Å; L91-L94 VanDerWaalsContact O-N 3.17Å; L94-V96 VanDerWaalsContact C-N 3.31Å; L94-V96 PolarHBondContact O-N 3.49Å; L94-L97 PolarHBondContact O-N 3.11Å; L94-L98 WeakPolarHBondContact O-CB 3.4Å; L94-L98 PolarHBondContact O-N 3.19Å
95	L	74.8	Confident	73.2	Confident	60 Å²	60	54 Å²	54	31%	0.314	31%	0.308	S	S	.	.	H	α-helix	trans	-59.2	-40.7	176.2	-74.3	168.4	0	0	0	111.9	L91 M92 L98 D99	L91-L95 HydrophobicContact CG-CD1 4.14Å; L91-L95 WeakPolarHBondContact O-CB 3.43Å; L91-L95 WeakPolarHBondContact O-CG 3.25Å; L91-L95 PolarHBondContact O-N 2.91Å; M92-L95 HydrophobicContact SD-CD1 4.38Å; L95-L98 PolarHBondContact O-N 3.4Å; L95-D99 WeakPolarHBondContact O-CB 3.3Å; L95-D99 PolarHBondContact O-N 2.98Å
96	V	73.7	Confident	73.4	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.018	30%	0.295	C	S	.	.	H	α-helix	trans	-72.3	-29.8	177.2	167	0	0	0	0	113.3	M92 L94 L98 A100 F365 R421 I422 I425	M92-V96 WeakPolarHBondContact O-CG2 3.47Å; M92-V96 PolarHBondContact O-N 3.39Å; L94-V96 VanDerWaalsContact C-N 3.31Å; L94-V96 PolarHBondContact O-N 3.49Å; V96-L98 VanDerWaalsContact C-N 3.34Å; V96-A100 VanDerWaalsContact O-CB 3.25Å; V96-A100 WeakPolarHBondContact O-CB 3.34Å; V96-A100 PolarHBondContact O-N 3.19Å; V96-F365 HydrophobicContact CG2-CD2 3.73Å; V96-F365 HydrophobicContact CG2-CE2 3.26Å; V96-F365 HydrophobicContact CG2-CZ 3.8Å; V96-R421 HydrophobicContact CG1-CB 4.29Å; V96-R421 HydrophobicContact CG1-CG 4.05Å; V96-R421 HydrophobicContact CG2-CG 4.26Å; V96-I422 HydrophobicContact CG1-CG1 4.32Å; V96-I425 HydrophobicContact CB-CD1 3.74Å; V96-I425 HydrophobicContact CG1-CD1 3.72Å; V96-I425 HydrophobicContact CG2-CD1 3.81Å
97	L	74.3	Confident	73.4	Confident	100 Å²	100	49.6 Å²	49.6	52%	0.524	28%	0.281	S	S	.	.	H	α-helix	trans	-71.2	-32.2	170.7	-71	168.9	0	0	0	112	S93 L94 G101	S93-L97 WeakPolarHBondContact O-CG 3.32Å; S93-L97 PolarHBondContact O-N 3.5Å; L94-L97 PolarHBondContact O-N 3.11Å; L97-G101 PolarHBondContact O-N 3.2Å
98	L	76.2	Confident	73.3	Confident	91 Å²	91	47.7 Å²	47.7	48%	0.476	27%	0.27	S	S	.	.	H	α-helix	trans	-72.8	-49	176.5	-162.3	167.7	0	0	0	110.8	L94 L95 V96 G101 I102 I361	L94-L98 WeakPolarHBondContact O-CB 3.4Å; L94-L98 PolarHBondContact O-N 3.19Å; L95-L98 PolarHBondContact O-N 3.4Å; V96-L98 VanDerWaalsContact C-N 3.34Å; L98-G101 CarbonylContact O-C 3.55Å; L98-G101 WeakPolarHBondContact O-CA 3.49Å; L98-G101 PolarHBondContact O-N 3.5Å; L98-I102 HydrophobicContact CD2-CD1 3.44Å; L98-I102 VanDerWaalsContact CD2-CD1 3.44Å; L98-I102 HydrophobicContact CD2-CG1 4.04Å; L98-I102 PolarHBondContact O-N 2.86Å; L98-I361 HydrophobicContact CD2-CD1 4.1Å
99	D	77.5	Confident	73.3	Confident	3 Å²	3	47.2 Å²	47.2	2%	0.016	27%	0.267	C	S	.	.	H	α-helix	trans	-53.6	-52.9	173	179.6	74	0	0	0	111.7	L95 G101 I102 V103 I361 T362	L95-D99 WeakPolarHBondContact O-CB 3.3Å; L95-D99 PolarHBondContact O-N 2.98Å; D99-G101 VanDerWaalsContact C-N 3.28Å; D99-G101 PolarHBondContact O-N 3.24Å; D99-I102 PolarHBondContact O-N 3.2Å; D99-V103 PolarHBondContact O-N 2.78Å; D99-I361 HydrophobicContact CB-CG2 3.88Å; D99-T362 PolarHBondContact OD1-OG1 3.43Å
100	A	72.2	Confident	73.4	Confident	11 Å²	11	49 Å²	49	9%	0.091	28%	0.275	C	S	.	.	H	α-helix	trans	-61.8	-35.1	174.2	0	0	0	0	0	112.6	V96 I104	V96-A100 VanDerWaalsContact O-CB 3.25Å; V96-A100 WeakPolarHBondContact O-CB 3.34Å; V96-A100 PolarHBondContact O-N 3.19Å; A100-I104 WeakPolarHBondContact O-CB 3.28Å; A100-I104 WeakPolarHBondContact O-CD1 3.37Å; A100-I104 WeakPolarHBondContact O-CG1 3.37Å; A100-I104 PolarHBondContact O-N 2.86Å
101	G	72.8	Confident	73.2	Confident	30 Å²	30	49.1 Å²	49.1	31%	0.309	27%	0.273	S	S	.	.	H	α-helix	trans	-66.2	-38.8	175.2	0	0	0	0	0	113.3	L97 L98 D99 S105	L97-G101 PolarHBondContact O-N 3.2Å; L98-G101 CarbonylContact O-C 3.55Å; L98-G101 WeakPolarHBondContact O-CA 3.49Å; L98-G101 PolarHBondContact O-N 3.5Å; D99-G101 VanDerWaalsContact C-N 3.28Å; D99-G101 PolarHBondContact O-N 3.24Å; G101-S105 WeakPolarHBondContact O-CB 3.5Å; G101-S105 PolarHBondContact O-N 3.37Å; G101-S105 PolarHBondContact O-OG 3.04Å
102	I	76.7	Confident	73.1	Confident	18 Å²	18	49 Å²	49	9%	0.092	27%	0.27	C	S	.	.	H	α-helix	trans	-66.6	-51.7	173.9	-68.8	170.4	0	0	0	109.7	L98 D99 I104 S105 E106 L354 L357 I361	L98-I102 HydrophobicContact CD2-CD1 3.44Å; L98-I102 VanDerWaalsContact CD2-CD1 3.44Å; L98-I102 HydrophobicContact CD2-CG1 4.04Å; L98-I102 PolarHBondContact O-N 2.86Å; D99-I102 PolarHBondContact O-N 3.2Å; I102-I104 VanDerWaalsContact C-N 3.29Å; I102-I104 PolarHBondContact O-N 3.18Å; I102-S105 CarbonylContact O-C 3.53Å; I102-S105 WeakPolarHBondContact O-CA 3.22Å; I102-S105 WeakPolarHBondContact O-CB 3.19Å; I102-S105 PolarHBondContact O-N 3.1Å; I102-E106 WeakPolarHBondContact O-CB 3.43Å; I102-E106 PolarHBondContact O-N 2.87Å; I102-L354 HydrophobicContact CG2-CB 4.41Å; I102-L354 HydrophobicContact CG2-CD2 4.17Å; I102-L357 HydrophobicContact CD1-CD2 3.79Å; I102-L357 HydrophobicContact CD1-CG 3.99Å; I102-I361 HydrophobicContact CD1-CD1 3.5Å; I102-I361 VanDerWaalsContact CD1-CD1 3.5Å
103	V	71.6	Confident	72.9	Confident	5 Å²	5	47.8 Å²	47.8	3%	0.03	27%	0.265	C	S	.	.	H	α-helix	trans	-62.3	-35.6	-178.8	176.9	0	0	0	0	112	D99 I107 M414 L418	D99-V103 PolarHBondContact O-N 2.78Å; V103-I107 HydrophobicContact CG1-CD1 3.82Å; V103-I107 HydrophobicContact CG1-CG1 4.41Å; V103-I107 WeakPolarHBondContact O-CB 3.48Å; V103-I107 VanDerWaalsContact O-CG1 3.25Å; V103-I107 WeakPolarHBondContact O-CG1 3.47Å; V103-I107 PolarHBondContact O-N 3.14Å; V103-M414 HydrophobicContact CG1-CE 3.86Å; V103-L418 HydrophobicContact CB-CD1 3.99Å; V103-L418 HydrophobicContact CG1-CD1 3.72Å; V103-L418 HydrophobicContact CG2-CD1 4.36Å
104	I	71.7	Confident	72.6	Confident	100 Å²	100	51.9 Å²	51.9	51%	0.513	28%	0.284	S	S	.	.	H	α-helix	trans	-65.4	-39.5	171.6	-71.4	165.9	0	0	0	111	A100 I102 V108	A100-I104 WeakPolarHBondContact O-CB 3.28Å; A100-I104 WeakPolarHBondContact O-CD1 3.37Å; A100-I104 WeakPolarHBondContact O-CG1 3.37Å; A100-I104 PolarHBondContact O-N 2.86Å; I102-I104 VanDerWaalsContact C-N 3.29Å; I102-I104 PolarHBondContact O-N 3.18Å; I104-V108 HydrophobicContact CG2-CG2 4.43Å; I104-V108 WeakPolarHBondContact O-CB 3.45Å; I104-V108 WeakPolarHBondContact O-CG2 3.25Å; I104-V108 PolarHBondContact O-N 3.37Å
105	S	74.9	Confident	72.1	Confident	59 Å²	59	53 Å²	53	41%	0.413	29%	0.287	S	S	.	.	H	α-helix	trans	-68.3	-39.7	177.5	-55.9	0	0	0	0	112.1	G101 I102 V108 L109	G101-S105 WeakPolarHBondContact O-CB 3.5Å; G101-S105 PolarHBondContact O-N 3.37Å; G101-S105 PolarHBondContact O-OG 3.04Å; I102-S105 CarbonylContact O-C 3.53Å; I102-S105 WeakPolarHBondContact O-CA 3.22Å; I102-S105 WeakPolarHBondContact O-CB 3.19Å; I102-S105 PolarHBondContact O-N 3.1Å; S105-V108 PolarHBondContact O-N 3.12Å; S105-L109 WeakPolarHBondContact O-CB 3.42Å; S105-L109 VanDerWaalsContact O-CG 3.3Å; S105-L109 WeakPolarHBondContact O-CG 3.3Å; S105-L109 PolarHBondContact O-N 3.15Å
106	E	73.3	Confident	71.5	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-58.1	-56.3	173.4	-167.9	-176.3	140.7	0	0	110	I102 V108 L109 E110 H355 S358	I102-E106 WeakPolarHBondContact O-CB 3.43Å; I102-E106 PolarHBondContact O-N 2.87Å; E106-V108 VanDerWaalsContact C-N 3.31Å; E106-V108 PolarHBondContact O-N 2.87Å; E106-L109 PolarHBondContact O-N 3.39Å; E106-L109 VanDerWaalsContact O-N 3.11Å; E106-E110 PolarHBondContact O-N 3.48Å; E106-H355 IonicContact OE1-CE1 2.7Å; E106-H355 IonicContact OE1-CG 3.89Å; E106-H355 IonicContact OE1-ND1 2.73Å; E106-H355 PolarHBondContact OE1-ND1 2.95Å; E106-S358 WeakPolarHBondContact OE2-CB 3.48Å; E106-S358 PolarHBondContact OE2-OG 3.32Å
107	I	71.5	Confident	70.7	Confident	34 Å²	34	60 Å²	60	17%	0.174	32%	0.315	C	S	.	.	H	α-helix	trans	-59.6	-37.8	176.5	-68.4	167.9	0	0	0	112	V103 I111 V415	V103-I107 HydrophobicContact CG1-CD1 3.82Å; V103-I107 HydrophobicContact CG1-CG1 4.41Å; V103-I107 WeakPolarHBondContact O-CB 3.48Å; V103-I107 VanDerWaalsContact O-CG1 3.25Å; V103-I107 WeakPolarHBondContact O-CG1 3.47Å; V103-I107 PolarHBondContact O-N 3.14Å; I107-I111 HydrophobicContact CG2-CD1 3.8Å; I107-I111 HydrophobicContact CG2-CG1 4.5Å; I107-I111 WeakPolarHBondContact O-CB 3.46Å; I107-I111 WeakPolarHBondContact O-CD1 3.48Å; I107-I111 WeakPolarHBondContact O-CG1 3.3Å; I107-I111 PolarHBondContact O-N 3.46Å; I107-V415 HydrophobicContact CD1-CG2 4.07Å
108	V	72.5	Confident	70	Confident	66 Å²	66	60.1 Å²	60.1	40%	0.4	31%	0.311	S	S	.	.	H	α-helix	trans	-68	-39.1	176.6	165.4	0	0	0	0	111.6	I104 S105 E106 I111 Q112	I104-V108 HydrophobicContact CG2-CG2 4.43Å; I104-V108 WeakPolarHBondContact O-CB 3.45Å; I104-V108 WeakPolarHBondContact O-CG2 3.25Å; I104-V108 PolarHBondContact O-N 3.37Å; S105-V108 PolarHBondContact O-N 3.12Å; E106-V108 VanDerWaalsContact C-N 3.31Å; E106-V108 PolarHBondContact O-N 2.87Å; V108-I111 PolarHBondContact O-N 3.48Å; V108-Q112 WeakPolarHBondContact O-CB 3.28Å; V108-Q112 VanDerWaalsContact O-CG 3.31Å; V108-Q112 WeakPolarHBondContact O-CG 3.49Å; V108-Q112 PolarHBondContact O-N 2.87Å
109	L	69.1	Low	69.2	Low	36 Å²	36	58.5 Å²	58.5	19%	0.188	31%	0.308	C	S	.	.	H	α-helix	trans	-69	-39.2	175.5	-74.4	167	0	0	0	111.9	S105 E106 Q112 S113 L354	S105-L109 WeakPolarHBondContact O-CB 3.42Å; S105-L109 VanDerWaalsContact O-CG 3.3Å; S105-L109 WeakPolarHBondContact O-CG 3.3Å; S105-L109 PolarHBondContact O-N 3.15Å; E106-L109 PolarHBondContact O-N 3.39Å; E106-L109 VanDerWaalsContact O-N 3.11Å; L109-Q112 PolarHBondContact O-N 3.27Å; L109-S113 WeakPolarHBondContact O-CB 3.3Å; L109-S113 PolarHBondContact O-N 3.5Å; L109-S113 PolarHBondContact O-OG 3.46Å; L109-L354 HydrophobicContact CD1-CD1 3.44Å; L109-L354 VanDerWaalsContact CD1-CD1 3.44Å
110	E	72.1	Confident	68.3	Low	75 Å²	75	60.9 Å²	60.9	35%	0.35	32%	0.32	S	S	.	.	H	α-helix	trans	-61.9	-43.5	171.2	-71.2	-170	144.1	0	0	111.9	E106 Q112 S113 L114	E106-E110 PolarHBondContact O-N 3.48Å; E110-Q112 VanDerWaalsContact C-N 3.31Å; E110-Q112 PolarHBondContact O-N 3.33Å; E110-S113 PolarHBondContact O-N 3.44Å; E110-S113 PolarHBondContact O-OG 3.39Å; E110-S113 VanDerWaalsContact O-OG 3.05Å; E110-L114 VanDerWaalsContact O-CB 3.28Å; E110-L114 WeakPolarHBondContact O-CB 3.44Å; E110-L114 VanDerWaalsContact O-CG 3.22Å; E110-L114 WeakPolarHBondContact O-CG 3.41Å; E110-L114 PolarHBondContact O-N 2.95Å
111	I	69.7	Low	67.4	Low	84 Å²	84	65.2 Å²	65.2	43%	0.431	34%	0.337	S	S	.	.	H	α-helix	trans	-63.1	-38.8	175.3	-71.3	166.2	0	0	0	110.8	I107 V108 Q115	I107-I111 HydrophobicContact CG2-CD1 3.8Å; I107-I111 HydrophobicContact CG2-CG1 4.5Å; I107-I111 WeakPolarHBondContact O-CB 3.46Å; I107-I111 WeakPolarHBondContact O-CD1 3.48Å; I107-I111 WeakPolarHBondContact O-CG1 3.3Å; I107-I111 PolarHBondContact O-N 3.46Å; V108-I111 PolarHBondContact O-N 3.48Å; I111-Q115 WeakPolarHBondContact O-CB 3.46Å; I111-Q115 WeakPolarHBondContact O-CG 3.36Å; I111-Q115 PolarHBondContact O-N 2.91Å
112	Q	72.7	Confident	66.6	Low	81 Å²	81	68 Å²	68	38%	0.379	34%	0.339	S	S	.	.	H	α-helix	trans	-70.7	-38.4	176.7	-74.8	178.8	8	0	0	113	V108 L109 E110 Q115 T116	V108-Q112 WeakPolarHBondContact O-CB 3.28Å; V108-Q112 VanDerWaalsContact O-CG 3.31Å; V108-Q112 WeakPolarHBondContact O-CG 3.49Å; V108-Q112 PolarHBondContact O-N 2.87Å; L109-Q112 PolarHBondContact O-N 3.27Å; E110-Q112 VanDerWaalsContact C-N 3.31Å; E110-Q112 PolarHBondContact O-N 3.33Å; Q112-Q115 PolarHBondContact O-N 2.91Å; Q112-T116 WeakPolarHBondContact O-CB 3.18Å; Q112-T116 PolarHBondContact O-N 2.91Å; Q112-T116 PolarHBondContact O-OG1 2.89Å
113	S	66.4	Low	65.9	Low	13 Å²	13	70.4 Å²	70.4	9%	0.091	35%	0.354	C	S	.	.	H	α-helix	trans	-69.1	-41	176	70.1	0	0	0	0	111.1	L109 E110 T116 Y117	L109-S113 WeakPolarHBondContact O-CB 3.3Å; L109-S113 PolarHBondContact O-N 3.5Å; L109-S113 PolarHBondContact O-OG 3.46Å; E110-S113 PolarHBondContact O-N 3.44Å; E110-S113 PolarHBondContact O-OG 3.39Å; E110-S113 VanDerWaalsContact O-OG 3.05Å; S113-T116 WeakPolarHBondContact O-CB 3.23Å; S113-T116 PolarHBondContact O-N 3.01Å; S113-Y117 WeakPolarHBondContact O-CB 3.31Å; S113-Y117 PolarHBondContact O-N 3.45Å
114	L	65.4	Low	64.9	Low	117 Å²	117	75.1 Å²	75.1	61%	0.613	38%	0.376	S	S	*	.	H	α-helix	trans	-63.9	-40.9	172.8	-72.3	169.8	0	0	0	112.8	E110 Y117 K118	E110-L114 VanDerWaalsContact O-CB 3.28Å; E110-L114 WeakPolarHBondContact O-CB 3.44Å; E110-L114 VanDerWaalsContact O-CG 3.22Å; E110-L114 WeakPolarHBondContact O-CG 3.41Å; E110-L114 PolarHBondContact O-N 2.95Å; L114-Y117 PolarHBondContact O-N 3.4Å; L114-K118 PolarHBondContact O-N 2.66Å
115	Q	65.2	Low	64.2	Low	127 Å²	127	73.2 Å²	73.2	59%	0.593	37%	0.367	S	S	*	.	H	α-helix	trans	-65.2	-41.5	173.2	-77.1	176.9	15.1	0	0	111.7	I111 Q112 K118 S119	I111-Q115 WeakPolarHBondContact O-CB 3.46Å; I111-Q115 WeakPolarHBondContact O-CG 3.36Å; I111-Q115 PolarHBondContact O-N 2.91Å; Q112-Q115 PolarHBondContact O-N 2.91Å; Q115-K118 PolarHBondContact O-N 3.48Å; Q115-S119 WeakPolarHBondContact O-CB 3.44Å; Q115-S119 PolarHBondContact O-N 2.83Å
116	T	62.3	Low	63.4	Low	50 Å²	50	74.8 Å²	74.8	31%	0.307	37%	0.367	S	S	.	.	H	α-helix	trans	-60.5	-46.3	174.5	-59.2	0	0	0	0	110.3	Q112 S113 S119 N120	Q112-T116 WeakPolarHBondContact O-CB 3.18Å; Q112-T116 PolarHBondContact O-N 2.91Å; Q112-T116 PolarHBondContact O-OG1 2.89Å; S113-T116 WeakPolarHBondContact O-CB 3.23Å; S113-T116 PolarHBondContact O-N 3.01Å; T116-S119 PolarHBondContact O-N 3.46Å; T116-S119 PolarHBondContact O-OG 3.38Å; T116-N120 WeakPolarHBondContact O-CB 3.39Å; T116-N120 PolarHBondContact O-N 3.38Å
117	Y	56.7	Low	63	Low	159 Å²	159	79.3 Å²	79.3	62%	0.624	39%	0.391	S	S	*	.	H	α-helix	trans	-62.3	-46.5	177	-165	-87	0	0	0	112.1	S113 L114 S119 N120 F121	S113-Y117 WeakPolarHBondContact O-CB 3.31Å; S113-Y117 PolarHBondContact O-N 3.45Å; L114-Y117 PolarHBondContact O-N 3.4Å; Y117-S119 VanDerWaalsContact C-N 3.31Å; Y117-S119 PolarHBondContact O-N 3.03Å; Y117-N120 PolarHBondContact O-N 2.82Å; Y117-F121 WeakPolarHBondContact O-CB 3.25Å; Y117-F121 PolarHBondContact O-N 2.96Å
118	K	59.2	Low	62.3	Low	102 Å²	102	83 Å²	83	44%	0.443	41%	0.407	S	S	.	.	H	α-helix	trans	-62.9	-35.4	175.9	-177.1	159.7	-176.4	160.8	0	112.3	L114 Q115 R122 D218	L114-K118 PolarHBondContact O-N 2.66Å; Q115-K118 PolarHBondContact O-N 3.48Å; K118-R122 PolarHBondContact O-N 2.88Å; K118-D218 WeakPolarHBondContact CE-OD2 3.29Å; K118-D218 IonicContact NZ-OD2 3.45Å; K118-D218 PolarHBondContact NZ-OD2 3.32Å
119	S	60.5	Low	61.5	Low	58 Å²	58	83.5 Å²	83.5	41%	0.406	40%	0.401	S	S	.	.	H	α-helix	trans	-66.7	-45.7	174.5	76.1	0	0	0	0	112	Q115 T116 Y117 F121 R122 T123	Q115-S119 WeakPolarHBondContact O-CB 3.44Å; Q115-S119 PolarHBondContact O-N 2.83Å; T116-S119 PolarHBondContact O-N 3.46Å; T116-S119 PolarHBondContact O-OG 3.38Å; Y117-S119 VanDerWaalsContact C-N 3.31Å; Y117-S119 PolarHBondContact O-N 3.03Å; S119-F121 VanDerWaalsContact C-N 3.33Å; S119-F121 PolarHBondContact O-N 3.42Å; S119-R122 PolarHBondContact O-N 3.13Å; S119-T123 PolarHBondContact O-N 2.78Å; S119-T123 VanDerWaalsContact O-N 3.11Å; S119-T123 PolarHBondContact O-OG1 2.86Å
120	N	58.1	Low	61.2	Low	52 Å²	52	85.7 Å²	85.7	28%	0.278	41%	0.413	S	S	.	.	H	α-helix	trans	-65	-37	178	-174.8	76.5	0	0	0	111.9	T116 Y117 T123 Q124	T116-N120 WeakPolarHBondContact O-CB 3.39Å; T116-N120 PolarHBondContact O-N 3.38Å; Y117-N120 PolarHBondContact O-N 2.82Å; N120-T123 PolarHBondContact O-N 2.9Å; N120-Q124 PolarHBondContact ND2-NE2 3.08Å; N120-Q124 WeakPolarHBondContact O-CG 3.49Å; N120-Q124 PolarHBondContact O-N 3.14Å
121	F	52.7	Low	60.9	Low	102 Å²	102	86.9 Å²	86.9	45%	0.447	42%	0.421	S	S	.	.	H	α-helix	trans	-67.3	-39	175	-169.6	-94.3	0	0	0	112.4	Y117 S119 Q124 L125	Y117-F121 WeakPolarHBondContact O-CB 3.25Å; Y117-F121 PolarHBondContact O-N 2.96Å; S119-F121 VanDerWaalsContact C-N 3.33Å; S119-F121 PolarHBondContact O-N 3.42Å; F121-Q124 PolarHBondContact O-N 3.13Å; F121-L125 WeakPolarHBondContact O-CB 3.41Å; F121-L125 PolarHBondContact O-N 3.19Å
122	R	55.8	Low	60.4	Low	90 Å²	90	84.1 Å²	84.1	34%	0.34	41%	0.407	S	S	.	.	H	α-helix	trans	-60.1	-49.6	171.9	-77.5	-166.3	-171.9	-77.4	-1.7	111.5	K118 S119 Q124 L125 E126 D218	K118-R122 PolarHBondContact O-N 2.88Å; S119-R122 PolarHBondContact O-N 3.13Å; R122-Q124 VanDerWaalsContact C-N 3.33Å; R122-Q124 PolarHBondContact O-N 3.3Å; R122-L125 WeakPolarHBondContact O-CB 3.45Å; R122-L125 PolarHBondContact O-N 2.91Å; R122-L125 VanDerWaalsContact O-N 3.08Å; R122-E126 WeakPolarHBondContact O-CG 3.34Å; R122-E126 PolarHBondContact O-N 3.14Å; R122-D218 IonicContact CZ-OD1 3.21Å; R122-D218 IonicContact CZ-OD2 3.72Å; R122-D218 IonicContact NH1-OD1 2.62Å; R122-D218 PolarHBondContact NH1-OD1 3.43Å; R122-D218 IonicContact NH1-OD2 3.16Å; R122-D218 IonicContact NH2-OD1 2.68Å; R122-D218 PolarHBondContact NH2-OD1 3.38Å; R122-D218 IonicContact NH2-OD2 2.67Å; R122-D218 PolarHBondContact NH2-OD2 3.22Å
123	T	63	Low	59.7	Low	68 Å²	68	81.9 Å²	81.9	42%	0.417	40%	0.4	S	S	.	.	H	α-helix	trans	-59.6	-42.8	178.5	-54.1	0	0	0	0	111.9	S119 N120 L125 E126 D127	S119-T123 PolarHBondContact O-N 2.78Å; S119-T123 VanDerWaalsContact O-N 3.11Å; S119-T123 PolarHBondContact O-OG1 2.86Å; N120-T123 PolarHBondContact O-N 2.9Å; T123-L125 VanDerWaalsContact C-N 3.31Å; T123-L125 PolarHBondContact O-N 2.86Å; T123-E126 PolarHBondContact O-N 2.98Å; T123-D127 WeakPolarHBondContact O-CB 3.38Å; T123-D127 PolarHBondContact O-N 3.12Å
124	Q	50.6	Low	59.4	Low	103 Å²	103	84.9 Å²	84.9	48%	0.481	42%	0.418	S	S	.	.	H	α-helix	trans	-65	-32.5	175.5	-74.2	-179.1	-11.2	0	0	113.3	N120 F121 R122 F128	N120-Q124 PolarHBondContact ND2-NE2 3.08Å; N120-Q124 WeakPolarHBondContact O-CG 3.49Å; N120-Q124 PolarHBondContact O-N 3.14Å; F121-Q124 PolarHBondContact O-N 3.13Å; R122-Q124 VanDerWaalsContact C-N 3.33Å; R122-Q124 PolarHBondContact O-N 3.3Å; Q124-F128 WeakPolarHBondContact O-CB 3.35Å; Q124-F128 PolarHBondContact O-N 3.14Å
125	L	56.3	Low	58.9	Low	61 Å²	61	82.8 Å²	82.8	32%	0.319	41%	0.409	S	S	.	.	H	α-helix	trans	-73.3	-35.6	176	-159.4	73.4	0	0	0	111.7	F121 R122 T123 R129 L221	F121-L125 WeakPolarHBondContact O-CB 3.41Å; F121-L125 PolarHBondContact O-N 3.19Å; R122-L125 WeakPolarHBondContact O-CB 3.45Å; R122-L125 PolarHBondContact O-N 2.91Å; R122-L125 VanDerWaalsContact O-N 3.08Å; T123-L125 VanDerWaalsContact C-N 3.31Å; T123-L125 PolarHBondContact O-N 2.86Å; L125-R129 WeakPolarHBondContact O-CB 3.21Å; L125-R129 PolarHBondContact O-N 2.77Å; L125-L221 HydrophobicContact CD2-CD2 4.17Å
126	E	58.6	Low	58.2	Low	92 Å²	92	77.9 Å²	77.9	43%	0.43	39%	0.387	S	S	.	.	H	α-helix	trans	-67.4	-47.5	173.2	-71.4	162.5	172.2	0	0	111.3	R122 T123 F128 R129 D130	R122-E126 WeakPolarHBondContact O-CG 3.34Å; R122-E126 PolarHBondContact O-N 3.14Å; T123-E126 PolarHBondContact O-N 2.98Å; E126-F128 VanDerWaalsContact C-N 3.31Å; E126-F128 PolarHBondContact O-N 2.85Å; E126-R129 WeakPolarHBondContact O-CB 3.26Å; E126-R129 PolarHBondContact O-N 2.9Å; E126-D130 PolarHBondContact O-N 3.16Å
127	D	64.1	Low	57.8	Low	95 Å²	95	83.6 Å²	83.6	51%	0.508	40%	0.404	S	S	.	.	H	α-helix	trans	-56.7	-44.1	172.5	-74.1	-32.7	0	0	0	111.3	T123 D130 I131	T123-D127 WeakPolarHBondContact O-CB 3.38Å; T123-D127 PolarHBondContact O-N 3.12Å; D127-D130 PolarHBondContact O-N 3.22Å; D127-I131 WeakPolarHBondContact O-CD1 3.4Å; D127-I131 VanDerWaalsContact O-CG1 3.25Å; D127-I131 WeakPolarHBondContact O-CG1 3.37Å; D127-I131 PolarHBondContact O-N 3.49Å
128	F	56.7	Low	57.3	Low	113 Å²	113	86.4 Å²	86.4	50%	0.496	41%	0.413	S	S	.	.	H	α-helix	trans	-67.9	-39.3	-179.5	-174.5	-111.4	0	0	0	112.8	Q124 E126 I131 I132	Q124-F128 WeakPolarHBondContact O-CB 3.35Å; Q124-F128 PolarHBondContact O-N 3.14Å; E126-F128 VanDerWaalsContact C-N 3.31Å; E126-F128 PolarHBondContact O-N 2.85Å; F128-I131 PolarHBondContact O-N 3.31Å; F128-I132 HydrophobicContact CD1-CD1 3.89Å; F128-I132 HydrophobicContact CE1-CD1 3.41Å; F128-I132 VanDerWaalsContact CE1-CD1 3.41Å; F128-I132 HydrophobicContact CE1-CG1 4.43Å; F128-I132 HydrophobicContact CE2-CD1 4.38Å; F128-I132 HydrophobicContact CZ-CD1 3.7Å; F128-I132 HydrophobicContact CZ-CG1 4.41Å; F128-I132 WeakPolarHBondContact O-CG1 3.4Å; F128-I132 PolarHBondContact O-N 2.96Å
129	R	56.5	Low	56.9	Low	76 Å²	76	85.5 Å²	85.5	29%	0.287	42%	0.416	S	S	.	.	H	α-helix	trans	-57.7	-49.7	171.7	178.9	-160.8	67.6	-161.5	-5.2	110.6	L125 E126 I131 I132 C133 M225	L125-R129 WeakPolarHBondContact O-CB 3.21Å; L125-R129 PolarHBondContact O-N 2.77Å; E126-R129 WeakPolarHBondContact O-CB 3.26Å; E126-R129 PolarHBondContact O-N 2.9Å; R129-I131 VanDerWaalsContact C-N 3.32Å; R129-I131 PolarHBondContact O-N 2.99Å; R129-I132 PolarHBondContact O-N 2.95Å; R129-I132 VanDerWaalsContact O-N 3.14Å; R129-C133 PolarHBondContact O-N 3.25Å; R129-C133 PolarHBondContact O-SG 3.22Å; R129-C133 VanDerWaalsContact O-SG 3.36Å; R129-M225 HydrophobicContact CG-CE 4.43Å
130	D	63	Low	56.4	Low	81 Å²	81	83.7 Å²	83.7	43%	0.433	41%	0.405	S	S	.	.	H	α-helix	trans	-68.3	-33.2	-176.2	-72.9	18.2	0	0	0	111.9	E126 D127 T134	E126-D130 PolarHBondContact O-N 3.16Å; D127-D130 PolarHBondContact O-N 3.22Å; D130-T134 WeakPolarHBondContact O-CB 3.5Å; D130-T134 PolarHBondContact O-N 2.9Å; D130-T134 PolarHBondContact O-OG1 3.46Å
131	I	64.8	Low	56	Low	101 Å²	101	86.4 Å²	86.4	52%	0.518	43%	0.426	S	S	.	.	H	α-helix	trans	-62.8	-47.7	168.8	-70.7	164.5	0	0	0	111.1	D127 F128 R129 T134 V135	D127-I131 WeakPolarHBondContact O-CD1 3.4Å; D127-I131 VanDerWaalsContact O-CG1 3.25Å; D127-I131 WeakPolarHBondContact O-CG1 3.37Å; D127-I131 PolarHBondContact O-N 3.49Å; F128-I131 PolarHBondContact O-N 3.31Å; R129-I131 VanDerWaalsContact C-N 3.32Å; R129-I131 PolarHBondContact O-N 2.99Å; I131-T134 PolarHBondContact O-N 3.18Å; I131-V135 HydrophobicContact CG2-CG2 4.41Å; I131-V135 WeakPolarHBondContact O-CG2 3.44Å; I131-V135 PolarHBondContact O-N 3.5Å
132	I	59.3	Low	55.5	Low	26 Å²	26	91.1 Å²	91.1	13%	0.133	45%	0.449	C	S	.	.	H	α-helix	trans	-60.3	-48.3	177.9	-77.1	176.2	0	0	0	111.1	F128 R129 T134 V135 M136 L229	F128-I132 HydrophobicContact CD1-CD1 3.89Å; F128-I132 HydrophobicContact CE1-CD1 3.41Å; F128-I132 VanDerWaalsContact CE1-CD1 3.41Å; F128-I132 HydrophobicContact CE1-CG1 4.43Å; F128-I132 HydrophobicContact CE2-CD1 4.38Å; F128-I132 HydrophobicContact CZ-CD1 3.7Å; F128-I132 HydrophobicContact CZ-CG1 4.41Å; F128-I132 WeakPolarHBondContact O-CG1 3.4Å; F128-I132 PolarHBondContact O-N 2.96Å; R129-I132 PolarHBondContact O-N 2.95Å; R129-I132 VanDerWaalsContact O-N 3.14Å; I132-T134 VanDerWaalsContact C-N 3.27Å; I132-T134 PolarHBondContact O-N 2.92Å; I132-V135 PolarHBondContact O-N 2.82Å; I132-M136 HydrophobicContact CG2-CE 4.03Å; I132-M136 HydrophobicContact CG2-SD 4.49Å; I132-M136 WeakPolarHBondContact O-CG 3.48Å; I132-M136 PolarHBondContact O-N 2.95Å; I132-L229 HydrophobicContact CD1-CD1 4.39Å; I132-L229 HydrophobicContact CD1-CD2 4.41Å
133	C	58.9	Low	54.9	Low	34 Å²	34	90.1 Å²	90.1	23%	0.23	45%	0.449	C	S	.	.	H	α-helix	trans	-56.4	-41.7	176	-68.7	0	0	0	0	111.8	R129 M136 Y137	R129-C133 PolarHBondContact O-N 3.25Å; R129-C133 PolarHBondContact O-SG 3.22Å; R129-C133 VanDerWaalsContact O-SG 3.36Å; C133-M136 PolarHBondContact O-N 3.36Å; C133-Y137 PolarHBondContact O-N 3Å; C133-Y137 VanDerWaalsContact O-N 3.09Å
134	T	59.6	Low	53.9	Low	76 Å²	76	95.8 Å²	95.8	47%	0.466	47%	0.471	S	S	.	.	H	α-helix	trans	-66.7	-41.3	177.2	-58.7	0	0	0	0	112.9	D130 I131 I132 R138	D130-T134 WeakPolarHBondContact O-CB 3.5Å; D130-T134 PolarHBondContact O-N 2.9Å; D130-T134 PolarHBondContact O-OG1 3.46Å; I131-T134 PolarHBondContact O-N 3.18Å; I132-T134 VanDerWaalsContact C-N 3.27Å; I132-T134 PolarHBondContact O-N 2.92Å; T134-R138 PolarHBondContact O-N 2.87Å
135	V	54.5	Low	53.5	Low	72 Å²	72	94.8 Å²	94.8	44%	0.436	47%	0.468	S	S	.	.	H	α-helix	trans	-66.5	-38.2	177.8	168.7	0	0	0	0	111.4	I131 I132 R138 T139	I131-V135 HydrophobicContact CG2-CG2 4.41Å; I131-V135 WeakPolarHBondContact O-CG2 3.44Å; I131-V135 PolarHBondContact O-N 3.5Å; I132-V135 PolarHBondContact O-N 2.82Å; V135-R138 WeakPolarHBondContact O-CB 3.45Å; V135-R138 PolarHBondContact O-N 2.81Å; V135-T139 PolarHBondContact O-N 3.5Å; V135-T139 PolarHBondContact O-OG1 3.44Å
136	M	51.6	Low	52.7	Low	24 Å²	24	94.2 Å²	94.2	12%	0.118	47%	0.468	C	S	.	.	H	α-helix	trans	-68.3	-45.3	177.1	-72.4	-164.6	-61.9	0	0	113.4	I132 C133 R138 T139 A140 F228	I132-M136 HydrophobicContact CG2-CE 4.03Å; I132-M136 HydrophobicContact CG2-SD 4.49Å; I132-M136 WeakPolarHBondContact O-CG 3.48Å; I132-M136 PolarHBondContact O-N 2.95Å; C133-M136 PolarHBondContact O-N 3.36Å; M136-R138 PolarHBondContact O-N 3.44Å; M136-R138 VanDerWaalsContact O-N 3.12Å; M136-T139 WeakPolarHBondContact CA-OG1 3.38Å; M136-T139 PolarHBondContact O-N 3.32Å; M136-T139 PolarHBondContact O-OG1 2.79Å; M136-A140 PolarHBondContact O-N 2.87Å; M136-F228 HydrophobicContact CE-CE1 3.49Å; M136-F228 VanDerWaalsContact CE-CE1 3.49Å; M136-F228 HydrophobicContact CE-CZ 3.46Å; M136-F228 VanDerWaalsContact CE-CZ 3.46Å; M136-F228 HydrophobicContact SD-CE1 3.23Å; M136-F228 WeakPolarHBondContact SD-CE1 3.38Å; M136-F228 HydrophobicContact SD-CZ 3.26Å; M136-F228 WeakPolarHBondContact SD-CZ 3.33Å
137	Y	53.1	Low	51.9	Low	170 Å²	170	98.6 Å²	98.6	67%	0.667	49%	0.486	S	S	*	.	H	α-helix	trans	-57.8	-28	176.1	-171.9	-99.3	0	0	0	112	C133	C133-Y137 PolarHBondContact O-N 3Å; C133-Y137 VanDerWaalsContact O-N 3.09Å
138	R	46.9	Very low	50.9	Low	218 Å²	218	100.2 Å²	100.2	82%	0.823	49%	0.491	S	S	*	.	H	α-helix	trans	-78.7	-25	171.2	-93.8	-170.6	178.5	-175.9	3.3	115.9	T134 V135 M136	T134-R138 PolarHBondContact O-N 2.87Å; V135-R138 WeakPolarHBondContact O-CB 3.45Å; V135-R138 PolarHBondContact O-N 2.81Å; M136-R138 PolarHBondContact O-N 3.44Å; M136-R138 VanDerWaalsContact O-N 3.12Å
139	T	50.2	Low	49.8	Very low	83 Å²	83	97.3 Å²	97.3	51%	0.509	48%	0.484	S	S	.	.	H	α-helix	trans	-105.6	-17.8	-170.9	44	0	0	0	0	114.3	V135 M136	V135-T139 PolarHBondContact O-N 3.5Å; V135-T139 PolarHBondContact O-OG1 3.44Å; M136-T139 WeakPolarHBondContact CA-OG1 3.38Å; M136-T139 PolarHBondContact O-N 3.32Å; M136-T139 PolarHBondContact O-OG1 2.79Å
140	A	50.1	Low	48.9	Very low	20 Å²	20	102 Å²	102	17%	0.165	50%	0.503	C	S	.	.			trans	-143.2	76.8	174.9	0	0	0	0	0	111.9	M136 E142 M143	M136-A140 PolarHBondContact O-N 2.87Å; A140-E142 PolarHBondContact O-N 3.28Å; A140-E142 VanDerWaalsContact O-N 3.11Å; A140-M143 HydrophobicContact CB-CB 4.44Å; A140-M143 PolarHBondContact O-N 3.39Å
141	P	49.3	Very low	47.5	Very low	110 Å²	110	102.4 Å²	102.4	71%	0.714	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-4.4	-174.5	29.5	-36.7	0	0	0	115.3
142	E	43.2	Very low	45.9	Very low	200 Å²	200	105 Å²	105	94%	0.935	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	6.4	-179.5	-61.8	-173.4	143.7	0	0	113.8	A140	A140-E142 PolarHBondContact O-N 3.28Å; A140-E142 VanDerWaalsContact O-N 3.11Å
143	M	43	Very low	44.5	Very low	69 Å²	69	112.7 Å²	112.7	34%	0.34	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-101.2	122.4	-177.3	-161.3	166.8	74.5	0	0	111.7	A140 L145 K235	A140-M143 HydrophobicContact CB-CB 4.44Å; A140-M143 PolarHBondContact O-N 3.39Å; M143-L145 PolarHBondContact O-N 3.22Å; M143-K235 PolarHBondContact SD-NZ 3.01Å; M143-K235 VanDerWaalsContact SD-NZ 3.45Å
144	E	40.7	Very low	43.1	Very low	187 Å²	187	118.8 Å²	118.8	87%	0.874	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-58.8	128.4	168.9	-64	-177.2	143.1	0	0	109.8
145	L	42.7	Very low	41.6	Very low	82 Å²	82	124.4 Å²	124.4	43%	0.429	61%	0.608	S	S	.	*	P	Polyproline II helix	trans	-72.6	138.1	179.4	-85.7	73.1	0	0	0	110.2	M143 C149	M143-L145 PolarHBondContact O-N 3.22Å; L145-C149 HydrophobicContact CB-CB 4.28Å; L145-C149 HydrophobicContact CD2-CB 3.84Å
146	P	40.8	Very low	40.4	Very low	49 Å²	49	128.6 Å²	128.6	32%	0.318	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-58	147.9	170.4	-23	33.6	0	0	0	111.9	Q148 C149 F228	P146-Q148 PolarHBondContact O-N 3.14Å; P146-C149 PolarHBondContact O-N 3.42Å; P146-F228 HydrophobicContact CG-CE2 4.13Å
147	F	40.2	Very low	39.5	Very low	184 Å²	184	135.1 Å²	135.1	81%	0.807	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-53.9	-27	-179.2	-89	-90.4	0	0	0	114	C149 Y150	F147-C149 PolarHBondContact O-N 3.43Å; F147-C149 VanDerWaalsContact O-N 3.08Å; F147-Y150 PolarHBondContact O-N 3.08Å
148	Q	44.7	Very low	38.4	Very low	129 Å²	129	136.7 Å²	136.7	60%	0.603	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-61.7	-11.6	174.3	-72.4	133.3	-53	0	0	114.8	P146 D224	P146-Q148 PolarHBondContact O-N 3.14Å; Q148-D224 PolarHBondContact NE2-OD1 2.97Å; Q148-D224 VanDerWaalsContact NE2-OD1 3.11Å; Q148-D224 PolarHBondContact NE2-OD2 3.46Å
149	C	33.6	Very low	37.4	Very low	53 Å²	53	137.7 Å²	137.7	36%	0.358	67%	0.671	S	S	.	*	G	3₁₀ helix	trans	-85.1	-10.7	170.4	-66.6	0	0	0	0	113.7	L145 P146 F147 S151	L145-C149 HydrophobicContact CB-CB 4.28Å; L145-C149 HydrophobicContact CD2-CB 3.84Å; P146-C149 PolarHBondContact O-N 3.42Å; F147-C149 PolarHBondContact O-N 3.43Å; F147-C149 VanDerWaalsContact O-N 3.08Å; C149-S151 PolarHBondContact O-N 3.12Å
150	Y	35.7	Very low	36.3	Very low	175 Å²	175	143 Å²	143	69%	0.686	69%	0.688	S	S	*	*			trans	-89	100.5	168.3	-74.8	-93.9	0	0	0	109.1	F147	F147-Y150 PolarHBondContact O-N 3.08Å
151	S	35.4	Very low	35.3	Very low	88 Å²	88	146.7 Å²	146.7	62%	0.615	71%	0.712	S	S	*	*			trans	-85.7	134.7	153.2	-63.3	0	0	0	0	108	C149	C149-S151 PolarHBondContact O-N 3.12Å
152	D	29.4	Very low	34.1	Very low	156 Å²	156	147.3 Å²	147.3	83%	0.834	72%	0.719	S	S	*	*	S	Bend	trans	-60.8	157.8	-178.7	-64	-64.8	0	0	0	112.8
153	E	31.4	Very low	33.3	Very low	188 Å²	188	146 Å²	146	88%	0.879	71%	0.71	S	S	*	*	S	Bend	trans	67.1	43.1	171.5	-53.6	-162.4	132.9	0	0	118.6
154	Q	28.7	Very low	32.4	Very low	162 Å²	162	151.7 Å²	151.7	76%	0.757	73%	0.733	S	S	*	*			trans	-151.9	46.8	157.5	-129.8	153.3	109.2	0	0	119.6	L156	Q154-L156 PolarHBondContact O-N 3.49Å
155	E	28.1	Very low	31.7	Very low	194 Å²	194	150.1 Å²	150.1	91%	0.907	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	87	161.3	-77.9	-157	119.2	0	0	112.2
156	L	30.4	Very low	30.7	Very low	159 Å²	159	152.1 Å²	152.1	83%	0.832	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-170.7	-25.8	144.6	-131.6	67.9	0	0	0	115.8	Q154 F158	Q154-L156 PolarHBondContact O-N 3.49Å; L156-F158 PolarHBondContact O-N 3.01Å
157	H	31	Very low	29.9	Very low	161 Å²	161	159 Å²	159	75%	0.745	77%	0.767	S	S	*	*	G	3₁₀ helix	trans	-82.9	-11.1	-155.4	-115.4	-88.6	0	0	0	117.2	R159	H157-R159 VanDerWaalsContact C-N 3.27Å; H157-R159 PolarHBondContact O-N 3.07Å; H157-R159 VanDerWaalsContact O-N 3.14Å
158	F	30.1	Very low	29.2	Very low	203 Å²	203	155.5 Å²	155.5	89%	0.89	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-72.7	-5.7	-169.9	-111	-87.7	0	0	0	116.3	L156	L156-F158 PolarHBondContact O-N 3.01Å
159	R	26.9	Very low	28.2	Very low	239 Å²	239	154.5 Å²	154.5	90%	0.902	77%	0.767	S	S	*	*	G	3₁₀ helix	trans	-94.6	10.4	-167.6	-148	179.4	179.7	179.7	1.6	116.4	H157	H157-R159 VanDerWaalsContact C-N 3.27Å; H157-R159 PolarHBondContact O-N 3.07Å; H157-R159 VanDerWaalsContact O-N 3.14Å
160	K	28	Very low	27.9	Very low	195 Å²	195	162.7 Å²	162.7	85%	0.848	79%	0.792	S	S	*	*	S	Bend	trans	-143.1	0.9	-170.2	-113.6	177.2	-177.8	179.6	0	120	S162	K160-S162 PolarHBondContact O-N 3.47Å
161	S	27.1	Very low	27.4	Very low	97 Å²	97	162.1 Å²	162.1	68%	0.678	80%	0.801	S	S	*	*			trans	-96.8	63.1	-178.2	-159.1	0	0	0	0	113.9	K163	S161-K163 PolarHBondContact O-N 3.01Å
162	S	24.3	Very low	27.1	Very low	123 Å²	123	167.5 Å²	167.5	86%	0.86	81%	0.813	S	S	*	*			trans	-77.1	48.2	174.3	-55.6	0	0	0	0	112.9	K160 K164	K160-S162 PolarHBondContact O-N 3.47Å; S162-K164 PolarHBondContact O-N 2.87Å
163	K	26.4	Very low	26.9	Very low	173 Å²	173	166.5 Å²	166.5	75%	0.752	81%	0.807	S	S	*	*			trans	-74.8	110.8	179.6	-71.7	-170.6	175.3	-173.2	0	110.8	S161 L165	S161-K163 PolarHBondContact O-N 3.01Å; K163-L165 PolarHBondContact O-N 3.42Å
164	K	24.8	Very low	26.8	Very low	188 Å²	188	164.2 Å²	164.2	82%	0.817	80%	0.798	S	S	*	*			trans	-64.7	117	165.6	-80.7	-175.3	173.5	-177.8	0	109.6	S162 N166	S162-K164 PolarHBondContact O-N 2.87Å; K164-N166 PolarHBondContact O-N 3.14Å
165	L	25.2	Very low	26.7	Very low	155 Å²	155	163.4 Å²	163.4	81%	0.812	80%	0.795	S	S	*	*			trans	-77.8	92.8	164.2	-95.7	159.2	0	0	0	109.2	K163 F167	K163-L165 PolarHBondContact O-N 3.42Å; L165-F167 PolarHBondContact O-N 2.82Å
166	N	22.3	Very low	26.7	Very low	124 Å²	124	160.5 Å²	160.5	66%	0.663	79%	0.785	S	S	*	*			trans	-79.6	94.9	170.4	-79.2	4.3	0	0	0	109.8	K164 T168	K164-N166 PolarHBondContact O-N 3.14Å; N166-T168 PolarHBondContact O-N 3Å; N166-T168 VanDerWaalsContact O-N 3.16Å; N166-T168 PolarHBondContact O-OG1 3.4Å
167	F	23.7	Very low	26.6	Very low	194 Å²	194	160.7 Å²	160.7	85%	0.851	78%	0.782	S	S	*	*			trans	-65.9	111.7	161.9	-92.4	-93.1	0	0	0	109	L165	L165-F167 PolarHBondContact O-N 2.82Å
168	T	26	Very low	26.5	Very low	109 Å²	109	158.9 Å²	158.9	67%	0.669	78%	0.782	S	S	*	*			trans	-115.8	104.9	-177.4	-47	0	0	0	0	109.3	N166	N166-T168 PolarHBondContact O-N 3Å; N166-T168 VanDerWaalsContact O-N 3.16Å; N166-T168 PolarHBondContact O-OG1 3.4Å
169	S	24.4	Very low	26.4	Very low	108 Å²	108	154.4 Å²	154.4	76%	0.755	78%	0.776	S	S	*	*			trans	-69.9	142.5	-174.7	-50.9	0	0	0	0	112.9
170	Y	25.8	Very low	26.5	Very low	226 Å²	226	148.8 Å²	148.8	89%	0.886	77%	0.771	S	S	*	*			trans	-127.6	117.8	163	-102.9	-90	0	0	0	110.1
171	N	26.4	Very low	26.6	Very low	163 Å²	163	145.4 Å²	145.4	87%	0.872	77%	0.766	S	S	*	*			trans	-118.7	119.3	-178.5	-101.2	-29.1	0	0	0	110.4
172	K	28.8	Very low	26.7	Very low	200 Å²	200	148 Å²	148	87%	0.87	77%	0.768	S	S	*	*			trans	-169.1	129.7	173.6	-149.9	169.8	-176.4	-177	0	108.2
173	L	25.3	Very low	26.9	Very low	136 Å²	136	147.9 Å²	147.9	71%	0.712	75%	0.753	S	S	*	*			cis	-161.8	167.8	-10.8	179.7	62.8	0	0	0	107.2
174	M	28.5	Very low	26.9	Very low	140 Å²	140	145 Å²	145	69%	0.69	75%	0.75	S	S	*	*			trans	76.6	140.4	177.2	-44.7	-94.2	75.2	0	0	114.6
175	Q	28.1	Very low	27	Very low	145 Å²	145	144 Å²	144	68%	0.678	75%	0.754	S	S	*	*			cis	171.5	133.9	-39.9	-110.7	-172.5	-15.7	0	0	104.9
176	N	27.4	Very low	27.1	Very low	132 Å²	132	145.5 Å²	145.5	71%	0.706	76%	0.756	S	S	*	*			trans	66.1	136.2	169.7	-56.5	-20.9	0	0	0	116.1
177	Q	28.5	Very low	27.2	Very low	163 Å²	163	146.1 Å²	146.1	76%	0.762	76%	0.764	S	S	*	*			cis	-152.4	154.1	4.4	-120.3	160	11.2	0	0	111.3
178	T	28.6	Very low	27.4	Very low	123 Å²	123	144.7 Å²	144.7	76%	0.755	76%	0.758	S	S	*	*			trans	-1.6	143.9	155.2	49.4	0	0	0	0	119.5
179	S	28.3	Very low	27.4	Very low	109 Å²	109	146.2 Å²	146.2	76%	0.762	76%	0.76	S	S	*	*			cis	-169.1	168.4	6	41.5	0	0	0	0	110.3
180	P	29	Very low	27.5	Very low	121 Å²	121	149 Å²	149	79%	0.786	76%	0.759	S	S	*	*			trans	-97.8	173.3	-159.2	39.2	-37.7	0	0	0	116.2
181	V	29.8	Very low	27.4	Very low	125 Å²	125	144.1 Å²	144.1	76%	0.758	75%	0.753	S	S	*	*				-177	112.2	127.8	147.8	0	0	0	0	112.1
182	E	28.7	Very low	27.5	Very low	152 Å²	152	145.1 Å²	145.1	71%	0.71	75%	0.752	S	S	*	*			trans	50.7	124.7	135.8	-53.6	-172.3	149.8	0	0	125
183	H	28.6	Very low	27.4	Very low	120 Å²	120	144.1 Å²	144.1	56%	0.556	75%	0.751	S	S	*	*				53.5	148.7	124.2	-60.7	-50.9	0	0	0	122.2
184	T	27.5	Very low	27.7	Very low	112 Å²	112	142.9 Å²	142.9	69%	0.687	75%	0.753	S	S	*	*			cis	-153.9	149.8	-2.4	14.1	0	0	0	0	108.8
185	N	25.7	Very low	27.6	Very low	168 Å²	168	144.1 Å²	144.1	90%	0.898	76%	0.763	S	S	*	*			trans	-123.6	115.2	166.8	-89.7	-29.3	0	0	0	111.3
186	H	28.2	Very low	27.9	Very low	185 Å²	185	147.1 Å²	147.1	86%	0.856	77%	0.774	S	S	*	*			trans	-78.3	116.5	171.7	-91.4	-88.2	0	0	0	110.5	K188	H186-K188 PolarHBondContact O-N 2.94Å
187	V	24.7	Very low	28	Very low	137 Å²	137	146.7 Å²	146.7	83%	0.83	78%	0.776	S	S	*	*			trans	-76.1	120.5	165.8	179	0	0	0	0	108.6
188	K	26.8	Very low	28.1	Very low	164 Å²	164	146.4 Å²	146.4	71%	0.713	78%	0.78	S	S	*	*			trans	-120.7	109.9	173.1	-141.5	-177.7	-173	-171	0	108.7	H186 F190	H186-K188 PolarHBondContact O-N 2.94Å; K188-F190 HydrophobicContact CB-CD2 4.49Å; K188-F190 HydrophobicContact CB-CE2 4.1Å; K188-F190 HydrophobicContact CD-CE2 3.99Å; K188-F190 HydrophobicContact CD-CZ 4Å; K188-F190 HydrophobicContact CG-CE2 4.29Å
189	I	25.1	Very low	28.3	Very low	142 Å²	142	145.9 Å²	145.9	73%	0.728	78%	0.779	S	S	*	*			trans	-71	134.9	174.6	-59.3	172.1	0	0	0	107.7	T191	I189-T191 HydrophobicContact CG2-CG2 4.36Å
190	F	26.7	Very low	28.4	Very low	166 Å²	166	146.4 Å²	146.4	73%	0.728	78%	0.783	S	S	*	*			trans	-127	121	175.3	-82.6	-79.8	0	0	0	109.8	K188	K188-F190 HydrophobicContact CB-CD2 4.49Å; K188-F190 HydrophobicContact CB-CE2 4.1Å; K188-F190 HydrophobicContact CD-CE2 3.99Å; K188-F190 HydrophobicContact CD-CZ 4Å; K188-F190 HydrophobicContact CG-CE2 4.29Å
191	T	24.7	Very low	28.7	Very low	123 Å²	123	146.3 Å²	146.3	76%	0.755	78%	0.782	S	S	*	*			trans	-140.5	90.5	178.6	45.8	0	0	0	0	109	I189	I189-T191 HydrophobicContact CG2-CG2 4.36Å
192	E	28	Very low	28.7	Very low	184 Å²	184	151.2 Å²	151.2	86%	0.86	79%	0.787	S	S	*	*			trans	-162.4	116.9	170.9	-101.6	165.9	169.3	0	0	104.4
193	E	27.9	Very low	28.8	Very low	179 Å²	179	150.2 Å²	150.2	84%	0.836	79%	0.785	S	S	*	*			cis	66.8	121	48	-67.6	-126.3	121.5	0	0	115.9
194	S	31.5	Very low	28.9	Very low	110 Å²	110	152 Å²	152	77%	0.769	79%	0.794	S	S	*	*			trans	63.5	79.1	155.3	68.1	0	0	0	0	120.4	F196	S194-F196 PolarHBondContact O-N 3.42Å; S194-F196 VanDerWaalsContact O-N 3.17Å
195	N	26.7	Very low	29	Very low	167 Å²	167	153.6 Å²	153.6	89%	0.893	80%	0.798	S	S	*	*			trans	-74.2	90.8	147.9	-95.7	-40.5	0	0	0	110.3
196	F	33.6	Very low	29	Very low	207 Å²	207	150.9 Å²	150.9	91%	0.908	79%	0.787	S	S	*	*			trans	-157.4	130.2	153.2	-116.1	-72.1	0	0	0	113.2	S194	S194-F196 PolarHBondContact O-N 3.42Å; S194-F196 VanDerWaalsContact O-N 3.17Å
197	T	29.5	Very low	29.1	Very low	123 Å²	123	149.9 Å²	149.9	76%	0.755	78%	0.783	S	S	*	*			trans	-91.4	118.2	-171.4	51.4	0	0	0	0	113.9
198	N	31.5	Very low	29.3	Very low	158 Å²	158	152 Å²	152	85%	0.845	78%	0.784	S	S	*	*				178	142	121.5	-104.9	-39.6	0	0	0	113.1
199	P	31.1	Very low	29.2	Very low	111 Å²	111	153.1 Å²	153.1	72%	0.721	79%	0.789	S	S	*	*			trans	-99.4	127.9	173.8	35.4	-29.5	0	0	0	113.3
200	S	31.7	Very low	29.6	Very low	121 Å²	121	154.2 Å²	154.2	85%	0.846	79%	0.79	S	S	*	*			trans	-173.8	143.7	139	-85.5	0	0	0	0	112
201	P	34.2	Very low	30	Very low	118 Å²	118	151.4 Å²	151.4	77%	0.766	78%	0.782	S	S	*	*			trans	-98.2	160	-174.7	38.1	-35.6	0	0	0	113.6
202	R	29.7	Very low	30.3	Very low	228 Å²	228	151 Å²	151	86%	0.86	78%	0.776	S	S	*	*			trans	-179.2	141.7	132.1	-104.3	167.2	-179	164.5	2.2	115.3
203	I	31.2	Very low	30.7	Very low	131 Å²	131	145.4 Å²	145.4	67%	0.672	75%	0.751	S	S	*	*			trans	81.7	118	143	-68.8	164.6	0	0	0	119.4
204	E	31.6	Very low	31.2	Very low	158 Å²	158	142.9 Å²	142.9	74%	0.738	74%	0.74	S	S	*	*			trans	60.7	118	151.7	-70.8	156.8	-171	0	0	119.5
205	N	28.4	Very low	31.4	Very low	145 Å²	145	143.5 Å²	143.5	78%	0.775	73%	0.733	S	S	*	*				63.3	122.5	72.7	-61.4	-20.5	0	0	0	111.4
206	T	27.3	Very low	32	Very low	111 Å²	111	140.1 Å²	140.1	68%	0.681	71%	0.712	S	S	*	*			cis	-156.7	177.1	27.3	-43.6	0	0	0	0	111
207	H	29.2	Very low	32.4	Very low	164 Å²	164	136.2 Å²	136.2	76%	0.759	70%	0.695	S	S	*	*			trans	84	46.6	162.4	-52.6	-70.6	0	0	0	120.7
208	H	28.9	Very low	33.1	Very low	183 Å²	183	132.1 Å²	132.1	85%	0.847	67%	0.669	S	S	*	*			trans	-128.4	30.3	164.1	-96.4	-76.1	0	0	0	115.3	H210	H208-H210 PolarHBondContact O-N 3.03Å
209	F	25.6	Very low	34	Very low	187 Å²	187	129.7 Å²	129.7	82%	0.82	66%	0.655	S	S	*	*			trans	-77.1	113.3	172.7	-87.7	-99.4	0	0	0	112
210	H	32.4	Very low	35.1	Very low	164 Å²	164	129.4 Å²	129.4	76%	0.759	64%	0.644	S	S	*	*	S	Bend		170	-14.6	127.9	-137.9	-63.8	0	0	0	113.4	H208	H208-H210 PolarHBondContact O-N 3.03Å
211	L	34.9	Very low	36	Very low	108 Å²	108	127.3 Å²	127.3	57%	0.565	62%	0.624	S	S	*	*	S	Bend	trans	-109.1	-22.3	-168.5	-147.8	77.5	0	0	0	115.1
212	N	32.3	Very low	36.8	Very low	114 Å²	114	125.9 Å²	125.9	61%	0.61	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-73.7	-40.7	175.1	-78.2	19.2	0	0	0	111.6	H214 L215 E216	N212-H214 PolarHBondContact O-N 3.5Å; N212-L215 PolarHBondContact O-N 2.89Å; N212-E216 WeakPolarHBondContact O-CB 3.45Å; N212-E216 PolarHBondContact O-N 3.23Å
213	N	35.5	Very low	38	Very low	66 Å²	66	121.4 Å²	121.4	35%	0.353	60%	0.599	S	S	.	*	G	3₁₀ helix	trans	-56.7	2.2	-176.4	-49.4	77.4	0	0	0	115.8	K217	N213-K217 WeakPolarHBondContact O-CD 3.43Å; N213-K217 VanDerWaalsContact O-CG 3.26Å; N213-K217 WeakPolarHBondContact O-CG 3.48Å
214	H	37.6	Very low	39.1	Very low	127 Å²	127	118.3 Å²	118.3	59%	0.588	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-122.3	-8.7	-179.2	-143.8	-35.5	0	0	0	114.3	N212	N212-H214 PolarHBondContact O-N 3.5Å
215	L	37.1	Very low	40	Very low	122 Å²	122	113 Å²	113	64%	0.639	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-45.2	154.9	-94.5	70.3	0	0	0	109.2	N212 K217 D218 D219	N212-L215 PolarHBondContact O-N 2.89Å; L215-K217 PolarHBondContact O-N 3.41Å; L215-K217 VanDerWaalsContact O-N 3.12Å; L215-D218 WeakPolarHBondContact O-CA 3.46Å; L215-D218 WeakPolarHBondContact O-CB 3.23Å; L215-D218 PolarHBondContact O-N 3.49Å; L215-D219 PolarHBondContact O-N 3.03Å
216	E	38	Very low	40.9	Very low	96 Å²	96	109.1 Å²	109.1	45%	0.449	54%	0.543	S	S	.	.	H	α-helix	trans	-50.3	-39.5	177.3	-160.9	161.5	-150.9	0	0	111.5	N212 D218 D219 E220	N212-E216 WeakPolarHBondContact O-CB 3.45Å; N212-E216 PolarHBondContact O-N 3.23Å; E216-D218 PolarHBondContact O-N 2.99Å; E216-D219 PolarHBondContact O-N 3.18Å; E216-E220 VanDerWaalsContact O-CB 3.3Å; E216-E220 WeakPolarHBondContact O-CB 3.42Å; E216-E220 VanDerWaalsContact O-CG 3.23Å; E216-E220 WeakPolarHBondContact O-CG 3.38Å; E216-E220 PolarHBondContact O-N 3.42Å
217	K	42.2	Very low	42.2	Very low	126 Å²	126	107 Å²	107	55%	0.548	53%	0.533	S	S	.	.	H	α-helix	trans	-66.8	-30.3	173.1	-85.5	-174	176.2	-163.3	0	116.5	N213 L215 D219 E220 L221	N213-K217 WeakPolarHBondContact O-CD 3.43Å; N213-K217 VanDerWaalsContact O-CG 3.26Å; N213-K217 WeakPolarHBondContact O-CG 3.48Å; L215-K217 PolarHBondContact O-N 3.41Å; L215-K217 VanDerWaalsContact O-N 3.12Å; K217-D219 VanDerWaalsContact C-N 3.34Å; K217-E220 WeakPolarHBondContact CG-OE2 3.41Å; K217-L221 WeakPolarHBondContact O-CB 3.35Å; K217-L221 PolarHBondContact O-N 2.86Å
218	D	45	Very low	43.2	Very low	37 Å²	37	101.5 Å²	101.5	20%	0.198	51%	0.507	C	S	.	.	H	α-helix	trans	-72.6	-35.2	176	-73.9	-2.4	0	0	0	109.8	K118 R122 L215 E216 L222	K118-D218 WeakPolarHBondContact CE-OD2 3.29Å; K118-D218 IonicContact NZ-OD2 3.45Å; K118-D218 PolarHBondContact NZ-OD2 3.32Å; R122-D218 IonicContact CZ-OD1 3.21Å; R122-D218 IonicContact CZ-OD2 3.72Å; R122-D218 IonicContact NH1-OD1 2.62Å; R122-D218 PolarHBondContact NH1-OD1 3.43Å; R122-D218 IonicContact NH1-OD2 3.16Å; R122-D218 IonicContact NH2-OD1 2.68Å; R122-D218 PolarHBondContact NH2-OD1 3.38Å; R122-D218 IonicContact NH2-OD2 2.67Å; R122-D218 PolarHBondContact NH2-OD2 3.22Å; L215-D218 WeakPolarHBondContact O-CA 3.46Å; L215-D218 WeakPolarHBondContact O-CB 3.23Å; L215-D218 PolarHBondContact O-N 3.49Å; E216-D218 PolarHBondContact O-N 2.99Å; D218-L222 PolarHBondContact O-N 3.48Å
219	D	50	Low	44.2	Very low	106 Å²	106	96 Å²	96	57%	0.567	48%	0.483	S	S	*	.	H	α-helix	trans	-78.5	-41	176.2	-60.2	-45.7	0	0	0	112.3	L215 E216 K217 L221 L222 M223	L215-D219 PolarHBondContact O-N 3.03Å; E216-D219 PolarHBondContact O-N 3.18Å; K217-D219 VanDerWaalsContact C-N 3.34Å; D219-L221 PolarHBondContact O-N 3.04Å; D219-L222 PolarHBondContact O-N 3.02Å; D219-M223 WeakPolarHBondContact O-CB 3.32Å; D219-M223 WeakPolarHBondContact O-CG 3.37Å; D219-M223 PolarHBondContact O-N 3.29Å
220	E	54.2	Low	45.5	Very low	105 Å²	105	90.8 Å²	90.8	49%	0.491	47%	0.47	S	S	.	.	H	α-helix	trans	-56.3	-48.7	173.5	-81.2	175.1	150.6	0	0	111	E216 K217 L222 M223 D224	E216-E220 VanDerWaalsContact O-CB 3.3Å; E216-E220 WeakPolarHBondContact O-CB 3.42Å; E216-E220 VanDerWaalsContact O-CG 3.23Å; E216-E220 WeakPolarHBondContact O-CG 3.38Å; E216-E220 PolarHBondContact O-N 3.42Å; K217-E220 WeakPolarHBondContact CG-OE2 3.41Å; E220-L222 VanDerWaalsContact C-N 3.3Å; E220-L222 PolarHBondContact O-N 3.4Å; E220-M223 PolarHBondContact O-N 3.49Å; E220-D224 WeakPolarHBondContact O-CB 3.37Å; E220-D224 PolarHBondContact O-N 3Å
221	L	51.2	Low	46.6	Very low	78 Å²	78	89 Å²	89	41%	0.408	46%	0.462	S	S	.	.	H	α-helix	trans	-66	-34.9	-177.6	-160.4	158.1	0	0	0	111.4	L125 K217 D219 M225	L125-L221 HydrophobicContact CD2-CD2 4.17Å; K217-L221 WeakPolarHBondContact O-CB 3.35Å; K217-L221 PolarHBondContact O-N 2.86Å; D219-L221 PolarHBondContact O-N 3.04Å; L221-M225 HydrophobicContact CD2-CG 4.24Å; L221-M225 WeakPolarHBondContact O-CB 3.08Å; L221-M225 VanDerWaalsContact O-CG 3.25Å; L221-M225 WeakPolarHBondContact O-CG 3.38Å; L221-M225 PolarHBondContact O-N 3.39Å
222	L	50.5	Low	47.3	Very low	87 Å²	87	86.9 Å²	86.9	46%	0.455	45%	0.446	S	S	.	.	H	α-helix	trans	-74	-37.8	176.1	-153.6	156.5	0	0	0	111.5	D218 D219 E220 C226	D218-L222 PolarHBondContact O-N 3.48Å; D219-L222 PolarHBondContact O-N 3.02Å; E220-L222 VanDerWaalsContact C-N 3.3Å; E220-L222 PolarHBondContact O-N 3.4Å; L222-C226 VanDerWaalsContact O-CB 3.3Å; L222-C226 WeakPolarHBondContact O-CB 3.47Å; L222-C226 PolarHBondContact O-N 3.26Å; L222-C226 PolarHBondContact O-SG 2.97Å; L222-C226 VanDerWaalsContact O-SG 3.37Å
223	M	54.3	Low	47.8	Very low	135 Å²	135	86.9 Å²	86.9	67%	0.665	44%	0.439	S	S	*	.	H	α-helix	trans	-68.7	-39	172.9	-80	-74.4	-78.7	0	0	112.9	D219 E220 C226 S227	D219-M223 WeakPolarHBondContact O-CB 3.32Å; D219-M223 WeakPolarHBondContact O-CG 3.37Å; D219-M223 PolarHBondContact O-N 3.29Å; E220-M223 PolarHBondContact O-N 3.49Å; M223-C226 PolarHBondContact O-N 2.98Å; M223-S227 VanDerWaalsContact O-CB 3.28Å; M223-S227 WeakPolarHBondContact O-CB 3.3Å; M223-S227 PolarHBondContact O-N 3.15Å; M223-S227 PolarHBondContact O-OG 2.94Å
224	D	54	Low	48.7	Very low	65 Å²	65	92 Å²	92	35%	0.348	46%	0.457	S	S	.	.	H	α-helix	trans	-60.7	-53.2	171.6	-96.4	-15.1	0	0	0	109.5	Q148 E220 C226 S227 F228	Q148-D224 PolarHBondContact NE2-OD1 2.97Å; Q148-D224 VanDerWaalsContact NE2-OD1 3.11Å; Q148-D224 PolarHBondContact NE2-OD2 3.46Å; E220-D224 WeakPolarHBondContact O-CB 3.37Å; E220-D224 PolarHBondContact O-N 3Å; D224-C226 VanDerWaalsContact C-N 3.34Å; D224-C226 PolarHBondContact O-N 3.49Å; D224-S227 PolarHBondContact O-N 3.23Å; D224-S227 PolarHBondContact O-OG 3.28Å; D224-F228 WeakPolarHBondContact O-CB 3.47Å; D224-F228 PolarHBondContact O-N 3.4Å
225	M	52	Low	49.4	Very low	48 Å²	48	91.1 Å²	91.1	24%	0.236	45%	0.452	C	S	.	.	H	α-helix	trans	-55.1	-45.8	175	-75.1	-71.7	105.3	0	0	112.3	R129 L221 F228 L229	R129-M225 HydrophobicContact CG-CE 4.43Å; L221-M225 HydrophobicContact CD2-CG 4.24Å; L221-M225 WeakPolarHBondContact O-CB 3.08Å; L221-M225 VanDerWaalsContact O-CG 3.25Å; L221-M225 WeakPolarHBondContact O-CG 3.38Å; L221-M225 PolarHBondContact O-N 3.39Å; M225-F228 PolarHBondContact O-N 2.86Å; M225-L229 VanDerWaalsContact O-CB 3.28Å; M225-L229 WeakPolarHBondContact O-CB 3.42Å; M225-L229 WeakPolarHBondContact O-CD1 3.48Å; M225-L229 WeakPolarHBondContact O-CG 3.4Å; M225-L229 PolarHBondContact O-N 3.47Å
226	C	45.9	Very low	50.1	Low	62 Å²	62	88.3 Å²	88.3	42%	0.419	43%	0.434	S	S	.	.	H	α-helix	trans	-66.7	-41.1	178.8	-80.6	0	0	0	0	113.4	L222 M223 D224 F228 S230	L222-C226 VanDerWaalsContact O-CB 3.3Å; L222-C226 WeakPolarHBondContact O-CB 3.47Å; L222-C226 PolarHBondContact O-N 3.26Å; L222-C226 PolarHBondContact O-SG 2.97Å; L222-C226 VanDerWaalsContact O-SG 3.37Å; M223-C226 PolarHBondContact O-N 2.98Å; D224-C226 VanDerWaalsContact C-N 3.34Å; D224-C226 PolarHBondContact O-N 3.49Å; C226-F228 VanDerWaalsContact C-N 3.35Å; C226-S230 VanDerWaalsContact O-CB 3.23Å; C226-S230 WeakPolarHBondContact O-CB 3.38Å; C226-S230 PolarHBondContact O-N 3.28Å; C226-S230 PolarHBondContact O-OG 2.86Å
227	S	55.8	Low	50.3	Low	66 Å²	66	87 Å²	87	46%	0.462	43%	0.428	S	S	.	.	H	α-helix	trans	-68.7	-37.7	177	76.6	0	0	0	0	111.2	M223 D224 S230 H231	M223-S227 VanDerWaalsContact O-CB 3.28Å; M223-S227 WeakPolarHBondContact O-CB 3.3Å; M223-S227 PolarHBondContact O-N 3.15Å; M223-S227 PolarHBondContact O-OG 2.94Å; D224-S227 PolarHBondContact O-N 3.23Å; D224-S227 PolarHBondContact O-OG 3.28Å; S227-S230 WeakPolarHBondContact O-CB 3.36Å; S227-S230 PolarHBondContact O-N 2.76Å; S227-H231 PolarHBondContact O-N 3.48Å
228	F	50.7	Low	50.6	Low	49 Å²	49	85.9 Å²	85.9	22%	0.215	43%	0.433	C	S	.	.	H	α-helix	trans	-67.1	-50.8	177.8	-175.7	-86.8	0	0	0	111.9	M136 P146 D224 M225 C226 S230 H231 W232	M136-F228 HydrophobicContact CE-CE1 3.49Å; M136-F228 VanDerWaalsContact CE-CE1 3.49Å; M136-F228 HydrophobicContact CE-CZ 3.46Å; M136-F228 VanDerWaalsContact CE-CZ 3.46Å; M136-F228 HydrophobicContact SD-CE1 3.23Å; M136-F228 WeakPolarHBondContact SD-CE1 3.38Å; M136-F228 HydrophobicContact SD-CZ 3.26Å; M136-F228 WeakPolarHBondContact SD-CZ 3.33Å; P146-F228 HydrophobicContact CG-CE2 4.13Å; D224-F228 WeakPolarHBondContact O-CB 3.47Å; D224-F228 PolarHBondContact O-N 3.4Å; M225-F228 PolarHBondContact O-N 2.86Å; C226-F228 VanDerWaalsContact C-N 3.35Å; F228-S230 VanDerWaalsContact C-N 3.27Å; F228-S230 PolarHBondContact O-N 3.25Å; F228-H231 PolarHBondContact O-N 2.92Å; F228-H231 VanDerWaalsContact O-N 3.15Å; F228-W232 PolarHBondContact O-N 3.33Å
229	L	49.8	Very low	50.6	Low	68 Å²	68	88 Å²	88	36%	0.356	45%	0.451	S	S	.	.	H	α-helix	trans	-58.4	-39.3	172.1	-83.8	155.3	0	0	0	111.4	I132 M225 W232 Y233	I132-L229 HydrophobicContact CD1-CD1 4.39Å; I132-L229 HydrophobicContact CD1-CD2 4.41Å; M225-L229 VanDerWaalsContact O-CB 3.28Å; M225-L229 WeakPolarHBondContact O-CB 3.42Å; M225-L229 WeakPolarHBondContact O-CD1 3.48Å; M225-L229 WeakPolarHBondContact O-CG 3.4Å; M225-L229 PolarHBondContact O-N 3.47Å; L229-W232 PolarHBondContact O-N 3.33Å; L229-Y233 VanDerWaalsContact O-CB 3.23Å; L229-Y233 WeakPolarHBondContact O-CB 3.47Å; L229-Y233 PolarHBondContact O-N 2.73Å
230	S	52.7	Low	50.3	Low	77 Å²	77	83.6 Å²	83.6	54%	0.538	43%	0.427	S	S	.	.	H	α-helix	trans	-64.7	-40.1	175.2	-63	0	0	0	0	112.5	C226 S227 F228 K234	C226-S230 VanDerWaalsContact O-CB 3.23Å; C226-S230 WeakPolarHBondContact O-CB 3.38Å; C226-S230 PolarHBondContact O-N 3.28Å; C226-S230 PolarHBondContact O-OG 2.86Å; S227-S230 WeakPolarHBondContact O-CB 3.36Å; S227-S230 PolarHBondContact O-N 2.76Å; F228-S230 VanDerWaalsContact C-N 3.27Å; F228-S230 PolarHBondContact O-N 3.25Å; S230-K234 WeakPolarHBondContact O-CB 3.45Å; S230-K234 PolarHBondContact O-N 3.39Å
231	H	54.8	Low	49.6	Very low	126 Å²	126	84 Å²	84	58%	0.583	43%	0.427	S	S	*	.	H	α-helix	trans	-67.2	-45.5	176	-169.5	103.6	0	0	0	111.3	S227 F228 K234 K235	S227-H231 PolarHBondContact O-N 3.48Å; F228-H231 PolarHBondContact O-N 2.92Å; F228-H231 VanDerWaalsContact O-N 3.15Å; H231-K234 PolarHBondContact O-N 2.73Å; H231-K235 VanDerWaalsContact O-CB 3.26Å; H231-K235 WeakPolarHBondContact O-CB 3.46Å; H231-K235 PolarHBondContact O-N 2.74Å
232	W	49.7	Very low	48.9	Very low	65 Å²	65	85.4 Å²	85.4	25%	0.246	44%	0.442	C	S	.	.	H	α-helix	trans	-62.1	-49.5	178.3	-173.4	79.7	0	0	0	111.7	F228 L229 K234 K235 Y236 I240	F228-W232 PolarHBondContact O-N 3.33Å; L229-W232 PolarHBondContact O-N 3.33Å; W232-K234 VanDerWaalsContact C-N 3.34Å; W232-K234 PolarHBondContact O-N 3.37Å; W232-K235 PolarHBondContact O-N 2.92Å; W232-Y236 AromaticContact CD1-CD2 3.82Å; W232-Y236 HydrophobicContact CG-CD2 4.39Å; W232-Y236 AromaticContact NE1-CD2 3.94Å; W232-Y236 PolarHBondContact O-N 2.88Å; W232-I240 HydrophobicContact CD2-CD1 4.02Å; W232-I240 HydrophobicContact CE3-CD1 3.6Å; W232-I240 HydrophobicContact CH2-CD1 3.62Å; W232-I240 HydrophobicContact CH2-CG1 3.91Å; W232-I240 HydrophobicContact CZ2-CD1 4.01Å; W232-I240 HydrophobicContact CZ2-CG1 4.34Å; W232-I240 HydrophobicContact CZ3-CD1 3.39Å; W232-I240 HydrophobicContact CZ3-CG1 4.13Å
233	Y	43.9	Very low	48.1	Very low	114 Å²	114	87.4 Å²	87.4	45%	0.447	45%	0.447	S	S	.	.	H	α-helix	trans	-57.6	-45.3	176.1	-177.7	-92.3	0	0	0	111.9	L229 K235 E237	L229-Y233 VanDerWaalsContact O-CB 3.23Å; L229-Y233 WeakPolarHBondContact O-CB 3.47Å; L229-Y233 PolarHBondContact O-N 2.73Å; Y233-K235 PolarHBondContact O-N 3.5Å; Y233-E237 HydrophobicContact CE1-CG 4.05Å; Y233-E237 WeakPolarHBondContact O-CA 3.39Å; Y233-E237 WeakPolarHBondContact O-CB 3.5Å; Y233-E237 PolarHBondContact O-N 3.36Å
234	K	54.3	Low	47.2	Very low	172 Å²	172	84.3 Å²	84.3	75%	0.748	43%	0.433	S	S	*	.	H	α-helix	trans	-71.4	-25.3	-179.2	-169.2	174.2	-176.4	179	0	113.9	S230 H231 W232	S230-K234 WeakPolarHBondContact O-CB 3.45Å; S230-K234 PolarHBondContact O-N 3.39Å; H231-K234 PolarHBondContact O-N 2.73Å; W232-K234 VanDerWaalsContact C-N 3.34Å; W232-K234 PolarHBondContact O-N 3.37Å
235	K	52.3	Low	46.6	Very low	109 Å²	109	86.8 Å²	86.8	47%	0.474	45%	0.446	S	S	.	.	H	α-helix	trans	-86.1	-30.9	178.7	-172.1	175.6	176.6	-173.4	0	112.9	M143 H231 W232 Y233	M143-K235 PolarHBondContact SD-NZ 3.01Å; M143-K235 VanDerWaalsContact SD-NZ 3.45Å; H231-K235 VanDerWaalsContact O-CB 3.26Å; H231-K235 WeakPolarHBondContact O-CB 3.46Å; H231-K235 PolarHBondContact O-N 2.74Å; W232-K235 PolarHBondContact O-N 2.92Å; Y233-K235 PolarHBondContact O-N 3.5Å
236	Y	51.9	Low	46.2	Very low	64 Å²	64	88 Å²	88	25%	0.251	46%	0.46	S	S	.	.	H	α-helix	trans	-118.5	12.2	-174	-65.1	-78.7	0	0	0	114.6	W232 P238 S239 I240	W232-Y236 AromaticContact CD1-CD2 3.82Å; W232-Y236 HydrophobicContact CG-CD2 4.39Å; W232-Y236 AromaticContact NE1-CD2 3.94Å; W232-Y236 PolarHBondContact O-N 2.88Å; Y236-P238 VanDerWaalsContact C-N 3.31Å; Y236-P238 VanDerWaalsContact O-N 3.09Å; Y236-S239 PolarHBondContact O-N 3.27Å; Y236-I240 WeakPolarHBondContact O-CB 3.28Å; Y236-I240 WeakPolarHBondContact O-CG1 3.34Å; Y236-I240 PolarHBondContact O-N 3.32Å
237	E	41.2	Very low	46	Very low	69 Å²	69	90.3 Å²	90.3	32%	0.322	46%	0.464	S	S	.	.	H	α-helix	trans	-43.1	-43.5	-178.4	-152.2	-170.2	137.8	0	0	115.1	Y233 K241	Y233-E237 HydrophobicContact CE1-CG 4.05Å; Y233-E237 WeakPolarHBondContact O-CA 3.39Å; Y233-E237 WeakPolarHBondContact O-CB 3.5Å; Y233-E237 PolarHBondContact O-N 3.36Å; E237-K241 HydrophobicContact CG-CD 4.29Å; E237-K241 WeakPolarHBondContact O-CB 3.38Å; E237-K241 WeakPolarHBondContact O-CG 3.49Å; E237-K241 PolarHBondContact O-N 2.91Å; E237-K241 VanDerWaalsContact O-N 3.11Å; E237-K241 WeakPolarHBondContact OE1-CE 3.45Å; E237-K241 IonicContact OE1-NZ 2.79Å; E237-K241 PolarHBondContact OE1-NZ 3.09Å
238	P	48.3	Very low	45.2	Very low	101 Å²	101	91 Å²	91	66%	0.656	46%	0.461	S	S	*	.	H	α-helix	trans	-67.5	-41.9	179.6	-19.5	33.7	0	0	0	113.3	Y236	Y236-P238 VanDerWaalsContact C-N 3.31Å; Y236-P238 VanDerWaalsContact O-N 3.09Å
239	S	44.2	Very low	44.5	Very low	82 Å²	82	91.1 Å²	91.1	57%	0.573	46%	0.464	S	S	*	.	H	α-helix	trans	-73.2	-40.9	-179.9	-53.9	0	0	0	0	111.5	Y236 C242 F243	Y236-S239 PolarHBondContact O-N 3.27Å; S239-C242 PolarHBondContact O-N 2.91Å; S239-F243 PolarHBondContact O-N 3.22Å
240	I	44.6	Very low	44.1	Very low	13 Å²	13	93.1 Å²	93.1	7%	0.067	48%	0.475	C	S	.	.	H	α-helix	trans	-63.8	-41.9	179.3	-71.1	169.7	0	0	0	110.9	W232 Y236 C242 F243 L244	W232-I240 HydrophobicContact CD2-CD1 4.02Å; W232-I240 HydrophobicContact CE3-CD1 3.6Å; W232-I240 HydrophobicContact CH2-CD1 3.62Å; W232-I240 HydrophobicContact CH2-CG1 3.91Å; W232-I240 HydrophobicContact CZ2-CD1 4.01Å; W232-I240 HydrophobicContact CZ2-CG1 4.34Å; W232-I240 HydrophobicContact CZ3-CD1 3.39Å; W232-I240 HydrophobicContact CZ3-CG1 4.13Å; Y236-I240 WeakPolarHBondContact O-CB 3.28Å; Y236-I240 WeakPolarHBondContact O-CG1 3.34Å; Y236-I240 PolarHBondContact O-N 3.32Å; I240-C242 VanDerWaalsContact C-N 3.32Å; I240-C242 PolarHBondContact O-N 2.84Å; I240-F243 PolarHBondContact O-N 3.27Å; I240-F243 VanDerWaalsContact O-N 3.16Å; I240-L244 HydrophobicContact CG2-CD1 3.37Å; I240-L244 HydrophobicContact CG2-CG 3.8Å; I240-L244 WeakPolarHBondContact O-CB 3.39Å; I240-L244 WeakPolarHBondContact O-CG 3.39Å; I240-L244 PolarHBondContact O-N 2.7Å
241	K	38.9	Very low	43.3	Very low	115 Å²	115	93.5 Å²	93.5	50%	0.5	47%	0.47	S	S	.	.	H	α-helix	trans	-63.3	-33.2	179.6	-82.1	174.5	170.3	173.3	0	113.8	E237 N245	E237-K241 HydrophobicContact CG-CD 4.29Å; E237-K241 WeakPolarHBondContact O-CB 3.38Å; E237-K241 WeakPolarHBondContact O-CG 3.49Å; E237-K241 PolarHBondContact O-N 2.91Å; E237-K241 VanDerWaalsContact O-N 3.11Å; E237-K241 WeakPolarHBondContact OE1-CE 3.45Å; E237-K241 IonicContact OE1-NZ 2.79Å; E237-K241 PolarHBondContact OE1-NZ 3.09Å; K241-N245 WeakPolarHBondContact O-CB 3.01Å
242	C	36.3	Very low	42.4	Very low	107 Å²	107	90.7 Å²	90.7	72%	0.723	46%	0.459	S	S	*	.	H	α-helix	trans	-74.1	-33.5	173.7	-68.9	0	0	0	0	112.8	S239 I240	S239-C242 PolarHBondContact O-N 2.91Å; I240-C242 VanDerWaalsContact C-N 3.32Å; I240-C242 PolarHBondContact O-N 2.84Å
243	F	33.7	Very low	41.7	Very low	129 Å²	129	94.1 Å²	94.1	57%	0.566	48%	0.478	S	S	*	.	H	α-helix	trans	-82.4	-42.1	-176.5	-169.7	-98.2	0	0	0	113.3	S239 I240 N245 S246	S239-F243 PolarHBondContact O-N 3.22Å; I240-F243 PolarHBondContact O-N 3.27Å; I240-F243 VanDerWaalsContact O-N 3.16Å; F243-N245 VanDerWaalsContact C-N 3.32Å; F243-N245 PolarHBondContact O-N 2.89Å; F243-S246 PolarHBondContact O-OG 3.28Å; F243-S246 VanDerWaalsContact O-OG 3.07Å
244	L	36.1	Very low	41.3	Very low	69 Å²	69	92.5 Å²	92.5	36%	0.361	48%	0.483	S	S	.	.	H	α-helix	trans	-68.3	-29.9	180	-69.7	-178.5	0	0	0	113.1	I240 S246 M248	I240-L244 HydrophobicContact CG2-CD1 3.37Å; I240-L244 HydrophobicContact CG2-CG 3.8Å; I240-L244 WeakPolarHBondContact O-CB 3.39Å; I240-L244 WeakPolarHBondContact O-CG 3.39Å; I240-L244 PolarHBondContact O-N 2.7Å; L244-S246 VanDerWaalsContact C-N 3.27Å; L244-S246 PolarHBondContact O-N 2.95Å; L244-M248 HydrophobicContact CB-CE 4.32Å; L244-M248 HydrophobicContact CD1-CE 3.85Å; L244-M248 HydrophobicContact CD2-CE 3.98Å; L244-M248 HydrophobicContact CD2-CG 4.44Å; L244-M248 HydrophobicContact CG-CE 4.28Å; L244-M248 VanDerWaalsContact O-CB 3.32Å; L244-M248 WeakPolarHBondContact O-CB 3.13Å; L244-M248 PolarHBondContact O-N 2.73Å
245	N	42	Very low	40.2	Very low	118 Å²	118	89.6 Å²	89.6	63%	0.631	47%	0.474	S	S	*	.	H	α-helix	trans	-72.6	-18.7	-175.3	-157.4	29.6	0	0	0	113.4	K241 F243 N249	K241-N245 WeakPolarHBondContact O-CB 3.01Å; F243-N245 VanDerWaalsContact C-N 3.32Å; F243-N245 PolarHBondContact O-N 2.89Å; N245-N249 PolarHBondContact O-ND2 3.16Å; N245-N249 PolarHBondContact OD1-ND2 3.31Å
246	S	44.2	Very low	39.3	Very low	74 Å²	74	91.5 Å²	91.5	52%	0.517	48%	0.483	S	S	.	.	H	α-helix	trans	-91.1	-41.8	173.8	56.5	0	0	0	0	113.2	F243 L244 N250	F243-S246 PolarHBondContact O-OG 3.28Å; F243-S246 VanDerWaalsContact O-OG 3.07Å; L244-S246 VanDerWaalsContact C-N 3.27Å; L244-S246 PolarHBondContact O-N 2.95Å; S246-N250 PolarHBondContact O-ND2 3.28Å; S246-N250 VanDerWaalsContact O-ND2 3.11Å
247	E	40.2	Very low	38.3	Very low	110 Å²	110	92.8 Å²	92.8	51%	0.514	50%	0.501	S	S	.	.	H	α-helix	trans	-94	-41.8	-175.6	-65.8	-149.6	141.5	0	0	114.4	N249 N250 I251	E247-N249 VanDerWaalsContact C-N 3.28Å; E247-N249 PolarHBondContact O-N 3.32Å; E247-N250 PolarHBondContact O-N 3.05Å; E247-N250 VanDerWaalsContact O-N 3.11Å; E247-I251 PolarHBondContact O-N 3.24Å
248	M	38.8	Very low	37.9	Very low	79 Å²	79	97 Å²	97	39%	0.389	53%	0.526	S	S	.	.	H	α-helix	trans	-70	-25.3	-170.3	-127.1	-141.4	-58.3	0	0	113.2	L244 N250 I251 I252	L244-M248 HydrophobicContact CB-CE 4.32Å; L244-M248 HydrophobicContact CD1-CE 3.85Å; L244-M248 HydrophobicContact CD2-CE 3.98Å; L244-M248 HydrophobicContact CD2-CG 4.44Å; L244-M248 HydrophobicContact CG-CE 4.28Å; L244-M248 VanDerWaalsContact O-CB 3.32Å; L244-M248 WeakPolarHBondContact O-CB 3.13Å; L244-M248 PolarHBondContact O-N 2.73Å; M248-N250 VanDerWaalsContact C-N 3.28Å; M248-N250 PolarHBondContact O-N 3.46Å; M248-I251 PolarHBondContact O-N 2.94Å; M248-I252 HydrophobicContact CG-CD1 4.49Å; M248-I252 WeakPolarHBondContact O-CB 3.24Å; M248-I252 VanDerWaalsContact O-CG1 3.3Å; M248-I252 WeakPolarHBondContact O-CG1 3.47Å; M248-I252 PolarHBondContact O-N 3.24Å; M248-I252 HydrophobicContact SD-CD1 3.81Å; M248-I252 HydrophobicContact SD-CG1 4.21Å
249	N	36.4	Very low	37.1	Very low	52 Å²	52	96.5 Å²	96.5	28%	0.278	53%	0.525	S	S	.	.	H	α-helix	trans	-62	-33.7	173.9	-75.2	-42.3	0	0	0	112.7	N245 E247 Q253	N245-N249 PolarHBondContact O-ND2 3.16Å; N245-N249 PolarHBondContact OD1-ND2 3.31Å; E247-N249 VanDerWaalsContact C-N 3.28Å; E247-N249 PolarHBondContact O-N 3.32Å; N249-Q253 WeakPolarHBondContact O-CG 3.49Å; N249-Q253 PolarHBondContact O-N 3.28Å
250	N	40.8	Very low	36.6	Very low	111 Å²	111	100.2 Å²	100.2	59%	0.594	54%	0.537	S	S	*	.	H	α-helix	trans	-73.9	-35.5	174.5	-63.7	-59.8	0	0	0	112	S246 E247 M248 S254	S246-N250 PolarHBondContact O-ND2 3.28Å; S246-N250 VanDerWaalsContact O-ND2 3.11Å; E247-N250 PolarHBondContact O-N 3.05Å; E247-N250 VanDerWaalsContact O-N 3.11Å; M248-N250 VanDerWaalsContact C-N 3.28Å; M248-N250 PolarHBondContact O-N 3.46Å; N250-S254 PolarHBondContact O-N 3.26Å
251	I	36.6	Very low	35.9	Very low	84 Å²	84	105.1 Å²	105.1	43%	0.431	57%	0.569	S	S	.	*	H	α-helix	trans	-74.2	-40.4	-179.5	-61.1	170.9	0	0	0	111.1	E247 M248 S254 I255	E247-I251 PolarHBondContact O-N 3.24Å; M248-I251 PolarHBondContact O-N 2.94Å; I251-S254 PolarHBondContact O-N 3.46Å; I251-S254 PolarHBondContact O-OG 3.15Å; I251-I255 HydrophobicContact CG2-CD1 3.88Å; I251-I255 WeakPolarHBondContact O-CG1 3.42Å; I251-I255 PolarHBondContact O-N 2.65Å
252	I	36.6	Very low	35.6	Very low	68 Å²	68	107.5 Å²	107.5	35%	0.349	59%	0.586	S	S	.	*	H	α-helix	trans	-66.2	-39.4	177.2	-68.4	167.6	0	0	0	110.7	M248 S254 I255 F256	M248-I252 HydrophobicContact CG-CD1 4.49Å; M248-I252 WeakPolarHBondContact O-CB 3.24Å; M248-I252 VanDerWaalsContact O-CG1 3.3Å; M248-I252 WeakPolarHBondContact O-CG1 3.47Å; M248-I252 PolarHBondContact O-N 3.24Å; M248-I252 HydrophobicContact SD-CD1 3.81Å; M248-I252 HydrophobicContact SD-CG1 4.21Å; I252-S254 PolarHBondContact O-N 2.83Å; I252-I255 PolarHBondContact O-N 2.92Å; I252-F256 HydrophobicContact CG2-CD2 4.04Å; I252-F256 HydrophobicContact CG2-CE2 4.45Å; I252-F256 WeakPolarHBondContact O-CD2 3.37Å; I252-F256 PolarHBondContact O-N 2.96Å
253	Q	34.8	Very low	35.1	Very low	137 Å²	137	109.8 Å²	109.8	64%	0.64	59%	0.591	S	S	*	*	H	α-helix	trans	-63.2	-39.4	174.6	-76.5	-173.9	4	0	0	112.9	N249 I255 S257	N249-Q253 WeakPolarHBondContact O-CG 3.49Å; N249-Q253 PolarHBondContact O-N 3.28Å; Q253-I255 PolarHBondContact O-N 2.89Å; Q253-S257 PolarHBondContact O-N 3.27Å; Q253-S257 PolarHBondContact O-OG 3.4Å
254	S	34.3	Very low	34.9	Very low	79 Å²	79	110.8 Å²	110.8	55%	0.552	61%	0.607	S	S	*	*	H	α-helix	trans	-69.7	-32	179.8	71.7	0	0	0	0	113.2	N250 I251 I252	N250-S254 PolarHBondContact O-N 3.26Å; I251-S254 PolarHBondContact O-N 3.46Å; I251-S254 PolarHBondContact O-OG 3.15Å; I252-S254 PolarHBondContact O-N 2.83Å
255	I	32	Very low	34.4	Very low	112 Å²	112	111.6 Å²	111.6	57%	0.574	62%	0.624	S	S	*	*	H	α-helix	trans	-75.6	-41.6	179.9	-67.7	169	0	0	0	112.1	I251 I252 Q253	I251-I255 HydrophobicContact CG2-CD1 3.88Å; I251-I255 WeakPolarHBondContact O-CG1 3.42Å; I251-I255 PolarHBondContact O-N 2.65Å; I252-I255 PolarHBondContact O-N 2.92Å; Q253-I255 PolarHBondContact O-N 2.89Å
256	F	32.4	Very low	33.8	Very low	148 Å²	148	110.9 Å²	110.9	65%	0.649	63%	0.628	S	S	*	*	H	α-helix	trans	-89.5	1	-173.9	-76.9	-82.5	0	0	0	115.5	I252 N258	I252-F256 HydrophobicContact CG2-CD2 4.04Å; I252-F256 HydrophobicContact CG2-CE2 4.45Å; I252-F256 WeakPolarHBondContact O-CD2 3.37Å; I252-F256 PolarHBondContact O-N 2.96Å; F256-N258 PolarHBondContact O-N 3.08Å
257	S	32.8	Very low	32.9	Very low	92 Å²	92	114.3 Å²	114.3	64%	0.643	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-2.9	-178.2	-71	0	0	0	0	115.7	Q253	Q253-S257 PolarHBondContact O-N 3.27Å; Q253-S257 PolarHBondContact O-OG 3.4Å
258	N	30.9	Very low	32.1	Very low	158 Å²	158	116.8 Å²	116.8	85%	0.845	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	18.7	-171.7	-78.1	-31.8	0	0	0	115.3	F256	F256-N258 PolarHBondContact O-N 3.08Å
259	S	32.5	Very low	31.4	Very low	90 Å²	90	119.4 Å²	119.4	63%	0.629	68%	0.677	S	S	*	*	S	Bend	trans	-131.1	138.4	177.4	53.4	0	0	0	0	113.3
260	I	34.1	Very low	30.8	Very low	159 Å²	159	126 Å²	126	82%	0.815	71%	0.706	S	S	*	*			trans	-70.9	137.4	-165.8	-60.6	166.2	0	0	0	112.5
261	P	30.1	Very low	30.2	Very low	116 Å²	116	127.4 Å²	127.4	75%	0.753	72%	0.719	S	S	*	*			trans	-82.9	155.6	-178.6	33.9	-37.1	0	0	0	114.3
262	I	31	Very low	29.6	Very low	165 Å²	165	132.5 Å²	132.5	85%	0.846	74%	0.738	S	S	*	*			trans	-135.2	128.9	169.6	-61	-179.2	0	0	0	109.5
263	N	26	Very low	29.1	Very low	156 Å²	156	135.9 Å²	135.9	83%	0.834	76%	0.757	S	S	*	*			trans	-87.7	129.7	178.2	-72.6	-33.4	0	0	0	112.7
264	V	30.4	Very low	28.7	Very low	150 Å²	150	138.5 Å²	138.5	91%	0.909	77%	0.769	S	S	*	*			trans	-145.6	145.4	138.2	-178.5	0	0	0	0	107.3
265	A	26.3	Very low	28.2	Very low	86 Å²	86	140.3 Å²	140.3	71%	0.711	78%	0.777	S	S	*	*			trans	-115.2	169	-171.7	0	0	0	0	0	114.3
266	S	27.8	Very low	27.8	Very low	103 Å²	103	140.6 Å²	140.6	72%	0.72	79%	0.789	S	S	*	*			trans	91.2	125.5	155.3	77	0	0	0	0	120.4
267	N	26.8	Very low	27.5	Very low	145 Å²	145	140.2 Å²	140.2	78%	0.775	79%	0.792	S	S	*	*			trans	73.3	74.8	139.3	-57.7	-0.3	0	0	0	120.2
268	L	21.7	Very low	27.1	Very low	162 Å²	162	146 Å²	146	85%	0.848	80%	0.801	S	S	*	*				10.6	117.3	116.3	-176.5	74.4	0	0	0	117
269	T	25.5	Very low	26.9	Very low	135 Å²	135	147 Å²	147	83%	0.828	81%	0.806	S	S	*	*			trans	-162.1	136.3	139.1	2.2	0	0	0	0	110.2	T271	T269-T271 PolarHBondContact O-N 3.33Å
270	E	24.3	Very low	26.6	Very low	190 Å²	190	148.5 Å²	148.5	89%	0.888	81%	0.807	S	S	*	*			trans	-74	122.1	177.4	-63.2	177.4	99.1	0	0	111.3
271	T	26.5	Very low	26.5	Very low	140 Å²	140	148.9 Å²	148.9	86%	0.859	81%	0.811	S	S	*	*			trans	-140.7	143.7	149.8	44	0	0	0	0	110.1	T269	T269-T271 PolarHBondContact O-N 3.33Å
272	K	24.5	Very low	26.4	Very low	192 Å²	192	151 Å²	151	84%	0.835	81%	0.808	S	S	*	*			trans	-75.5	131.9	176.4	-64	169.1	179.9	171.3	0	109.4
273	N	25.6	Very low	26.3	Very low	138 Å²	138	148.7 Å²	148.7	74%	0.738	80%	0.804	S	S	*	*			trans	147.9	140.2	135.9	-73.1	-21.9	0	0	0	112.6
274	Q	26.6	Very low	26.3	Very low	192 Å²	192	151.3 Å²	151.3	90%	0.897	81%	0.808	S	S	*	*			trans	32.3	92.5	152.9	-63.8	178.9	-48.8	0	0	118.8
275	T	24.9	Very low	26.2	Very low	118 Å²	118	151.6 Å²	151.6	72%	0.724	80%	0.802	S	S	*	*			trans	-137.8	102.2	159.8	35.7	0	0	0	0	111.8	I277	T275-I277 HydrophobicContact CG2-CD1 4.31Å
276	S	22.8	Very low	26.3	Very low	117 Å²	117	157 Å²	157	82%	0.818	81%	0.81	S	S	*	*			trans	-81.1	112.4	163.4	44.2	0	0	0	0	109.1
277	I	25.7	Very low	26.2	Very low	140 Å²	140	161.4 Å²	161.4	72%	0.718	82%	0.819	S	S	*	*			trans	-128.6	131.4	-176.9	-61.6	179.6	0	0	0	110.1	T275	T275-I277 HydrophobicContact CG2-CD1 4.31Å
278	Y	24.3	Very low	26.3	Very low	213 Å²	213	162.6 Å²	162.6	84%	0.835	83%	0.825	S	S	*	*			trans	-84.2	140.6	177.4	-63.6	-107.8	0	0	0	110
279	L	28.1	Very low	26.5	Very low	181 Å²	181	157.8 Å²	157.8	95%	0.948	82%	0.815	S	S	*	*			trans	-99.2	147	162.7	-86.1	166	0	0	0	110.4
280	N	26.1	Very low	26.6	Very low	121 Å²	121	156.7 Å²	156.7	65%	0.647	81%	0.812	S	S	*	*			trans	-146.6	78.4	-155.5	180	15.7	0	0	0	110.7
281	D	30.6	Very low	26.7	Very low	167 Å²	167	156.5 Å²	156.5	89%	0.893	81%	0.811	S	S	*	*			trans	-80.5	122.6	173.2	-85.4	-48.9	0	0	0	111.1
282	K	28.2	Very low	26.9	Very low	160 Å²	160	155.8 Å²	155.8	70%	0.696	81%	0.807	S	S	*	*			trans	-104.5	132.9	176.8	-67.7	-180	179.5	176.4	0	110.5
283	P	29.2	Very low	27.1	Very low	116 Å²	116	153.2 Å²	153.2	75%	0.753	80%	0.803	S	S	*	*			trans	-63.4	141.1	161.2	28.8	-33.2	0	0	0	109.7	I285	P283-I285 PolarHBondContact O-N 3.5Å
284	K	25.4	Very low	27.1	Very low	211 Å²	211	154.7 Å²	154.7	92%	0.917	81%	0.809	S	S	*	*			trans	-74.5	114.8	-179.7	-68.4	173.8	-179.3	171.2	0	110.2
285	I	29.3	Very low	27.4	Very low	156 Å²	156	149.9 Å²	149.9	80%	0.8	80%	0.795	S	S	*	*			trans	-115	138.7	163.5	-62.9	179.3	0	0	0	108.1	P283 Q287	P283-I285 PolarHBondContact O-N 3.5Å; I285-Q287 PolarHBondContact O-N 3.25Å
286	F	28.3	Very low	27.9	Very low	201 Å²	201	149 Å²	149	88%	0.882	79%	0.79	S	S	*	*			trans	-55.6	132	-172.9	-91.2	-110.9	0	0	0	113.1
287	Q	25.3	Very low	28.5	Very low	194 Å²	194	149.5 Å²	149.5	91%	0.907	78%	0.782	S	S	*	*			trans	-79.7	121	152.6	-74	-176	-32.8	0	0	108.6	I285	I285-Q287 PolarHBondContact O-N 3.25Å
288	L	28.3	Very low	28.9	Very low	171 Å²	171	149.1 Å²	149.1	90%	0.895	78%	0.78	S	S	*	*			trans	-120.5	127.6	154.3	-169.5	65.5	0	0	0	107.4
289	G	26.9	Very low	29.4	Very low	61 Å²	61	143.1 Å²	143.1	63%	0.629	77%	0.769	S	S	*	*			trans	-79.2	154.4	-169.6	0	0	0	0	0	114.1
290	S	27.2	Very low	29.6	Very low	112 Å²	112	142.1 Å²	142.1	78%	0.783	76%	0.757	S	S	*	*	S	Bend	trans	42.5	112.2	148.8	57.8	0	0	0	0	119.5
291	Q	27.8	Very low	29.8	Very low	185 Å²	185	142.5 Å²	142.5	86%	0.864	76%	0.759	S	S	*	*			trans	65.2	87.1	131	-170.7	179	67.2	0	0	117.5
292	T	29	Very low	29.8	Very low	125 Å²	125	142.1 Å²	142.1	77%	0.767	75%	0.749	S	S	*	*			trans	-166.4	138.5	132	10.5	0	0	0	0	112.8
293	D	29.1	Very low	30	Very low	139 Å²	139	138.1 Å²	138.1	74%	0.743	74%	0.742	S	S	*	*			trans	44.2	128.8	149.7	-53.4	-23.1	0	0	0	123.3	P295	D293-P295 VanDerWaalsContact O-CD 3.29Å; D293-P295 WeakPolarHBondContact O-CD 3.46Å
294	L	26.5	Very low	30.2	Very low	168 Å²	168	137.3 Å²	137.3	88%	0.88	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	69.8	-172.4	-170.2	84.9	0	0	0	114.1
295	P	32.1	Very low	30.5	Very low	92 Å²	92	133.3 Å²	133.3	60%	0.597	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.6	-18.2	153	37.1	-26.1	0	0	0	115.4	D293 I297	D293-P295 VanDerWaalsContact O-CD 3.29Å; D293-P295 WeakPolarHBondContact O-CD 3.46Å; P295-I297 PolarHBondContact O-N 3.21Å
296	T	35.9	Very low	30.4	Very low	100 Å²	100	132.6 Å²	132.6	61%	0.613	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-29.5	-160.1	-46.7	0	0	0	0	114.7	I298 S299	T296-I298 PolarHBondContact O-N 3.27Å; T296-I298 VanDerWaalsContact O-N 3.1Å; T296-S299 PolarHBondContact O-N 3.34Å
297	I	34.7	Very low	30.4	Very low	127 Å²	127	127.2 Å²	127.2	65%	0.651	71%	0.713	S	S	*	*	H	α-helix	trans	-57.8	-32	-172.1	-61.6	174.2	0	0	0	112.6	P295 S299 F300	P295-I297 PolarHBondContact O-N 3.21Å; I297-S299 VanDerWaalsContact C-N 3.3Å; I297-S299 PolarHBondContact O-N 3.47Å; I297-F300 PolarHBondContact O-N 3.41Å
298	I	34.7	Very low	30.5	Very low	132 Å²	132	124.2 Å²	124.2	68%	0.677	71%	0.708	S	S	*	*	H	α-helix	trans	-70.8	-24.8	-179.2	-63.1	175.4	0	0	0	112.1	T296	T296-I298 PolarHBondContact O-N 3.27Å; T296-I298 VanDerWaalsContact O-N 3.1Å
299	S	35.6	Very low	30.6	Very low	87 Å²	87	123 Å²	123	61%	0.608	70%	0.702	S	S	*	*	H	α-helix	trans	-78.2	-29.3	176.9	-61	0	0	0	0	112.8	T296 I297 F302	T296-S299 PolarHBondContact O-N 3.34Å; I297-S299 VanDerWaalsContact C-N 3.3Å; I297-S299 PolarHBondContact O-N 3.47Å; S299-F302 PolarHBondContact O-N 3.14Å
300	F	30.5	Very low	30.6	Very low	160 Å²	160	129.4 Å²	129.4	70%	0.702	71%	0.713	S	S	*	*	H	α-helix	trans	-71.4	-32.3	-177	-157.8	-95.5	0	0	0	112.6	I297 F302 S303 T304	I297-F300 PolarHBondContact O-N 3.41Å; F300-F302 VanDerWaalsContact C-N 3.27Å; F300-F302 PolarHBondContact O-N 2.81Å; F300-S303 PolarHBondContact O-OG 3.07Å; F300-T304 PolarHBondContact O-OG1 3.42Å
301	L	30.7	Very low	30.6	Very low	128 Å²	128	135 Å²	135	67%	0.67	72%	0.719	S	S	*	*	H	α-helix	trans	-75.8	-8.8	178.7	-69.8	170.4	0	0	0	114.3
302	F	31.6	Very low	30.6	Very low	160 Å²	160	134.6 Å²	134.6	70%	0.702	72%	0.717	S	S	*	*	H	α-helix	trans	-113.3	-6.4	-178.3	-87.2	-80	0	0	0	114.6	S299 F300	S299-F302 PolarHBondContact O-N 3.14Å; F300-F302 VanDerWaalsContact C-N 3.27Å; F300-F302 PolarHBondContact O-N 2.81Å
303	S	32.8	Very low	30.5	Very low	76 Å²	76	136.8 Å²	136.8	53%	0.531	72%	0.718	S	S	.	*	H	α-helix	trans	-86.6	-27.8	178.4	57.6	0	0	0	0	113.9	F300 V305	F300-S303 PolarHBondContact O-OG 3.07Å; S303-V305 PolarHBondContact O-N 3.39Å; S303-V305 VanDerWaalsContact O-N 3.15Å
304	T	32.7	Very low	30.6	Very low	99 Å²	99	138.1 Å²	138.1	61%	0.607	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-69.7	-11.3	-171.5	-23.2	0	0	0	0	114.8	F300 N306	F300-T304 PolarHBondContact O-OG1 3.42Å; T304-N306 VanDerWaalsContact C-N 3.28Å; T304-N306 PolarHBondContact O-N 3.35Å
305	V	32	Very low	30.6	Very low	127 Å²	127	135.9 Å²	135.9	77%	0.77	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-87.7	8.2	-172.3	-163.2	0	0	0	0	112.6	S303	S303-V305 PolarHBondContact O-N 3.39Å; S303-V305 VanDerWaalsContact O-N 3.15Å
306	N	26.8	Very low	30.5	Very low	141 Å²	141	140.2 Å²	140.2	75%	0.754	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-114.1	9.5	-174	-139.9	42.1	0	0	0	114.6	T304 T308	T304-N306 VanDerWaalsContact C-N 3.28Å; T304-N306 PolarHBondContact O-N 3.35Å; N306-T308 VanDerWaalsContact C-N 3.3Å; N306-T308 PolarHBondContact O-N 3.09Å
307	S	27.9	Very low	30.2	Very low	88 Å²	88	142.5 Å²	142.5	62%	0.615	73%	0.733	S	S	*	*			trans	-84.6	57.9	-177.2	-63.8	0	0	0	0	113.7	N309	S307-N309 PolarHBondContact O-N 2.81Å
308	T	28.5	Very low	30.2	Very low	131 Å²	131	145.1 Å²	145.1	80%	0.804	74%	0.742	S	S	*	*			trans	-75.7	59	162.5	54.3	0	0	0	0	110.2	N306	N306-T308 VanDerWaalsContact C-N 3.3Å; N306-T308 PolarHBondContact O-N 3.09Å
309	N	28.9	Very low	30.1	Very low	146 Å²	146	146.8 Å²	146.8	78%	0.781	75%	0.752	S	S	*	*			trans	-159.1	46.6	-175	-94	-22.7	0	0	0	111.3	S307	S307-N309 PolarHBondContact O-N 2.81Å
310	F	28.1	Very low	29.9	Very low	194 Å²	194	150.4 Å²	150.4	85%	0.851	76%	0.763	S	S	*	*			trans	-132.1	56.4	170.7	-118.8	-87	0	0	0	109.9
311	Y	26.7	Very low	29.8	Very low	230 Å²	230	147.9 Å²	147.9	90%	0.902	77%	0.766	S	S	*	*	S	Bend	trans	-144.9	31.9	179.4	-122.6	-82	0	0	0	112.3
312	E	27.2	Very low	29.7	Very low	176 Å²	176	150 Å²	150	82%	0.822	77%	0.772	S	S	*	*	S	Bend	trans	-146.5	161.2	171.3	-97.2	177.1	152	0	0	108.7
313	H	27.7	Very low	29.5	Very low	171 Å²	171	153.6 Å²	153.6	79%	0.792	78%	0.782	S	S	*	*			trans	64.8	60.4	179.1	-75.7	-69.5	0	0	0	118.3
314	I	31.3	Very low	29.5	Very low	167 Å²	167	155.8 Å²	155.8	86%	0.856	79%	0.788	S	S	*	*	S	Bend		-123.9	129.3	128.5	-60.9	-177.1	0	0	0	106.8
315	N	26.6	Very low	29.4	Very low	121 Å²	121	158.1 Å²	158.1	65%	0.647	80%	0.797	S	S	*	*			trans	-73.1	128	-171.7	-76	-18.1	0	0	0	112.2	N317	N315-N317 PolarHBondContact O-N 3.48Å
316	E	30.6	Very low	29.5	Very low	183 Å²	183	158.4 Å²	158.4	86%	0.855	80%	0.799	S	S	*	*	G	3₁₀ helix	trans	-72.9	-4.2	169.9	-61.4	-167.1	124	0	0	113.6	E318	E316-E318 PolarHBondContact O-N 3.34Å
317	N	29.7	Very low	29.5	Very low	149 Å²	149	160.6 Å²	160.6	80%	0.797	80%	0.804	S	S	*	*	G	3₁₀ helix	trans	-88.3	10	-166.7	-69.2	-22.8	0	0	0	116.1	N315	N315-N317 PolarHBondContact O-N 3.48Å
318	E	33.7	Very low	29.7	Very low	181 Å²	181	164.1 Å²	164.1	85%	0.846	82%	0.816	S	S	*	*	G	3₁₀ helix	trans	-123.1	4	-179.9	-151.2	170.2	-170.8	0	0	113.9	E316	E316-E318 PolarHBondContact O-N 3.34Å
319	L	33.1	Very low	29.8	Very low	167 Å²	167	167.2 Å²	167.2	87%	0.874	82%	0.821	S	S	*	*	S	Bend	trans	-109.9	16.7	-179	-148.5	79.7	0	0	0	114.3
320	L	29.9	Very low	29.8	Very low	163 Å²	163	163.4 Å²	163.4	85%	0.853	82%	0.816	S	S	*	*	S	Bend	trans	-135.4	32.1	-169.7	-145.6	82.5	0	0	0	115.5
321	S	28.5	Very low	30	Very low	107 Å²	107	161.8 Å²	161.8	75%	0.748	81%	0.81	S	S	*	*	S	Bend	trans	-146.1	46.4	-178	69.4	0	0	0	0	116
322	H	30.3	Very low	30.4	Very low	174 Å²	174	155.7 Å²	155.7	81%	0.806	80%	0.799	S	S	*	*			trans	-148.5	38.2	158.9	-149.5	-60.1	0	0	0	114.2	D324	H322-D324 PolarHBondContact O-N 3.38Å
323	Y	26.9	Very low	31.1	Very low	234 Å²	234	149 Å²	149	92%	0.918	78%	0.777	S	S	*	*			trans	-79.3	100.1	157	-113.1	-91.9	0	0	0	108
324	D	32.5	Very low	31.8	Very low	123 Å²	123	145.6 Å²	145.6	66%	0.658	77%	0.765	S	S	*	*			trans	179.5	148.3	136.2	-99.1	-13.4	0	0	0	112	H322	H322-D324 PolarHBondContact O-N 3.38Å
325	N	30.3	Very low	32.6	Very low	147 Å²	147	140.8 Å²	140.8	79%	0.786	75%	0.746	S	S	*	*			trans	54.4	89.2	166.1	-60.5	-57.5	0	0	0	118
326	V	33.3	Very low	33.6	Very low	134 Å²	134	142.3 Å²	142.3	81%	0.812	74%	0.744	S	S	*	*				-167.9	128.1	102.7	147.5	0	0	0	0	109.2
327	H	28.6	Very low	34.2	Very low	187 Å²	187	137.9 Å²	137.9	87%	0.866	73%	0.726	S	S	*	*			trans	-71.3	126.9	167.9	-83.8	-78.4	0	0	0	110.5
328	N	31.8	Very low	35.1	Very low	161 Å²	161	138.1 Å²	138.1	86%	0.861	72%	0.72	S	S	*	*			trans	-158.6	151.2	141.9	-102	-49.4	0	0	0	110.3
329	E	29.3	Very low	36	Very low	196 Å²	196	137.3 Å²	137.3	92%	0.916	71%	0.713	S	S	*	*			trans	-90.6	145.8	-162	-57.9	-174.1	141.5	0	0	114.6
330	G	28.6	Very low	36.9	Very low	66 Å²	66	138.7 Å²	138.7	68%	0.68	71%	0.707	S	S	*	*			trans	97.5	71.1	143.8	0	0	0	0	0	118.3
331	F	32.6	Very low	38	Very low	161 Å²	161	135 Å²	135	71%	0.706	69%	0.685	S	S	*	*			trans	-140.5	81.8	152.2	-139.1	-91.5	0	0	0	113.3	G333 D334	F331-G333 VanDerWaalsContact C-N 3.31Å; F331-G333 PolarHBondContact O-N 3.35Å; F331-D334 HydrophobicContact CD1-CB 4.46Å; F331-D334 WeakPolarHBondContact CD1-OD2 3.48Å; F331-D334 WeakPolarHBondContact CE1-OD1 3.26Å; F331-D334 WeakPolarHBondContact CE1-OD2 3.46Å
332	C	34.8	Very low	39.1	Very low	101 Å²	101	135.5 Å²	135.5	68%	0.682	68%	0.679	S	S	*	*			trans	-93.4	28.8	179	-158.6	0	0	0	0	113	Y336	C332-Y336 WeakPolarHBondContact O-CD2 3.32Å; C332-Y336 VanDerWaalsContact O-CE2 3.26Å; C332-Y336 WeakPolarHBondContact O-CE2 3.48Å
333	G	41.9	Very low	40.5	Very low	35 Å²	35	128.9 Å²	128.9	36%	0.361	66%	0.657	S	S	.	*	S	Bend	trans	-103.6	-50.5	-178	0	0	0	0	0	114.2	F331 S335 Y336 L337	F331-G333 VanDerWaalsContact C-N 3.31Å; F331-G333 PolarHBondContact O-N 3.35Å; G333-S335 VanDerWaalsContact C-N 3.28Å; G333-S335 PolarHBondContact O-N 3.29Å; G333-Y336 PolarHBondContact O-N 3.02Å; G333-L337 PolarHBondContact O-N 3.46Å
334	D	44	Very low	42	Very low	100 Å²	100	119 Å²	119	54%	0.535	62%	0.624	S	S	.	*	H	α-helix	trans	-61.2	-31.9	-167.8	-67.5	-33	0	0	0	114.4	F331 Y336 L337 K338	F331-D334 HydrophobicContact CD1-CB 4.46Å; F331-D334 WeakPolarHBondContact CD1-OD2 3.48Å; F331-D334 WeakPolarHBondContact CE1-OD1 3.26Å; F331-D334 WeakPolarHBondContact CE1-OD2 3.46Å; D334-Y336 VanDerWaalsContact C-N 3.28Å; D334-Y336 PolarHBondContact O-N 3.3Å; D334-L337 PolarHBondContact O-N 3.43Å; D334-K338 WeakPolarHBondContact O-CB 3.4Å; D334-K338 PolarHBondContact O-N 3.18Å
335	S	48.3	Very low	43.5	Very low	66 Å²	66	121 Å²	121	46%	0.462	62%	0.623	S	S	.	*	H	α-helix	trans	-62.6	-33	-178.8	52.6	0	0	0	0	112.9	G333 K339	G333-S335 VanDerWaalsContact C-N 3.28Å; G333-S335 PolarHBondContact O-N 3.29Å; S335-K339 WeakPolarHBondContact O-CB 3.39Å; S335-K339 VanDerWaalsContact O-CG 3.32Å; S335-K339 WeakPolarHBondContact O-CG 3.27Å; S335-K339 PolarHBondContact O-N 3.37Å
336	Y	46	Very low	45.2	Very low	153 Å²	153	116.6 Å²	116.6	60%	0.6	61%	0.607	S	S	*	*	H	α-helix	trans	-81.3	-43.7	177.6	-56.2	-76.9	0	0	0	111.8	C332 G333 D334 K339 R340	C332-Y336 WeakPolarHBondContact O-CD2 3.32Å; C332-Y336 VanDerWaalsContact O-CE2 3.26Å; C332-Y336 WeakPolarHBondContact O-CE2 3.48Å; G333-Y336 PolarHBondContact O-N 3.02Å; D334-Y336 VanDerWaalsContact C-N 3.28Å; D334-Y336 PolarHBondContact O-N 3.3Å; Y336-K339 PolarHBondContact O-N 2.94Å; Y336-R340 PolarHBondContact O-N 2.8Å
337	L	44.3	Very low	46.7	Very low	90 Å²	90	113.1 Å²	113.1	47%	0.471	58%	0.582	S	S	.	*	H	α-helix	trans	-68.5	-42.9	-178.7	-157.5	156.5	0	0	0	110.7	G333 D334 K339 R340 Q341	G333-L337 PolarHBondContact O-N 3.46Å; D334-L337 PolarHBondContact O-N 3.43Å; L337-K339 PolarHBondContact O-N 2.66Å; L337-R340 PolarHBondContact O-N 3.1Å; L337-Q341 HydrophobicContact CD2-CG 4.1Å; L337-Q341 VanDerWaalsContact CD2-NE2 3.33Å; L337-Q341 WeakPolarHBondContact O-CG 3.42Å; L337-Q341 PolarHBondContact O-N 2.86Å
338	K	48.5	Very low	48.5	Very low	155 Å²	155	109 Å²	109	67%	0.674	56%	0.563	S	S	*	*	H	α-helix	trans	-63.4	-39	172.9	-166.6	171	-175.8	175.8	0	112	D334 Q341 L342	D334-K338 WeakPolarHBondContact O-CB 3.4Å; D334-K338 PolarHBondContact O-N 3.18Å; K338-Q341 PolarHBondContact O-N 3.06Å; K338-L342 VanDerWaalsContact O-CB 3.32Å; K338-L342 WeakPolarHBondContact O-CB 3.35Å; K338-L342 PolarHBondContact O-N 3.32Å
339	K	52.4	Low	50.4	Low	164 Å²	164	107.1 Å²	107.1	71%	0.713	55%	0.549	S	S	*	.	H	α-helix	trans	-62.3	-44.4	172.4	-87.4	-175.5	174.5	-173.7	0	112.5	S335 Y336 L337 L342 G343	S335-K339 WeakPolarHBondContact O-CB 3.39Å; S335-K339 VanDerWaalsContact O-CG 3.32Å; S335-K339 WeakPolarHBondContact O-CG 3.27Å; S335-K339 PolarHBondContact O-N 3.37Å; Y336-K339 PolarHBondContact O-N 2.94Å; L337-K339 PolarHBondContact O-N 2.66Å; K339-L342 PolarHBondContact O-N 3.17Å; K339-G343 PolarHBondContact O-N 3.26Å
340	R	52.3	Low	52.4	Low	195 Å²	195	99.7 Å²	99.7	74%	0.736	52%	0.521	S	S	*	.	H	α-helix	trans	-63.3	-43.2	176	-77.7	-175.1	172.5	179.9	-1.3	112.3	Y336 L337 G343 A344	Y336-R340 PolarHBondContact O-N 2.8Å; L337-R340 PolarHBondContact O-N 3.1Å; R340-G343 PolarHBondContact O-N 3.23Å; R340-A344 PolarHBondContact O-N 3.41Å
341	Q	52.1	Low	54.3	Low	85 Å²	85	97.2 Å²	97.2	40%	0.397	49%	0.493	S	S	.	.	H	α-helix	trans	-67.9	-35.8	176.8	-72.9	-174.7	-5	0	0	113.2	L337 K338 A344 R345	L337-Q341 HydrophobicContact CD2-CG 4.1Å; L337-Q341 VanDerWaalsContact CD2-NE2 3.33Å; L337-Q341 WeakPolarHBondContact O-CG 3.42Å; L337-Q341 PolarHBondContact O-N 2.86Å; K338-Q341 PolarHBondContact O-N 3.06Å; Q341-A344 PolarHBondContact O-N 3.39Å; Q341-R345 PolarHBondContact O-N 2.9Å
342	L	51.5	Low	56.2	Low	119 Å²	119	95.6 Å²	95.6	62%	0.623	49%	0.488	S	S	*	.	H	α-helix	trans	-66.6	-41.4	174.8	-150.8	75.2	0	0	0	111	K338 K339 R345 A346	K338-L342 VanDerWaalsContact O-CB 3.32Å; K338-L342 WeakPolarHBondContact O-CB 3.35Å; K338-L342 PolarHBondContact O-N 3.32Å; K339-L342 PolarHBondContact O-N 3.17Å; L342-R345 PolarHBondContact O-N 2.81Å; L342-A346 WeakPolarHBondContact O-CB 3.49Å; L342-A346 PolarHBondContact O-N 2.71Å
343	G	60.7	Low	58.3	Low	34 Å²	34	96.4 Å²	96.4	35%	0.351	48%	0.484	S	S	.	.	H	α-helix	trans	-59.3	-44.7	171.9	0	0	0	0	0	112.7	K339 R340 R345 A346 M347	K339-G343 PolarHBondContact O-N 3.26Å; R340-G343 PolarHBondContact O-N 3.23Å; G343-R345 PolarHBondContact O-N 3.15Å; G343-A346 PolarHBondContact O-N 2.98Å; G343-M347 WeakPolarHBondContact O-CB 3.34Å; G343-M347 VanDerWaalsContact O-CG 3.31Å; G343-M347 WeakPolarHBondContact O-CG 3.4Å; G343-M347 PolarHBondContact O-N 3Å
344	A	59.2	Low	59.6	Low	26 Å²	26	96.6 Å²	96.6	22%	0.215	48%	0.477	C	S	.	.	H	α-helix	trans	-61.9	-40.9	177	0	0	0	0	0	112.8	R340 Q341 M347 H348	R340-A344 PolarHBondContact O-N 3.41Å; Q341-A344 PolarHBondContact O-N 3.39Å; A344-M347 PolarHBondContact O-N 2.93Å; A344-H348 PolarHBondContact O-CD2 2.69Å; A344-H348 VanDerWaalsContact O-CD2 3.27Å; A344-H348 PolarHBondContact O-N 3.21Å; A344-H348 VanDerWaalsContact O-N 3.07Å
345	R	63.5	Low	60.9	Low	166 Å²	166	94.7 Å²	94.7	63%	0.626	47%	0.465	S	S	*	.	H	α-helix	trans	-65.4	-47.7	175.2	-70.3	-176.9	-174.3	-167.5	1.4	112	Q341 L342 G343 M347 H348 E349	Q341-R345 PolarHBondContact O-N 2.9Å; L342-R345 PolarHBondContact O-N 2.81Å; G343-R345 PolarHBondContact O-N 3.15Å; R345-M347 VanDerWaalsContact C-N 3.25Å; R345-M347 PolarHBondContact O-N 2.95Å; R345-H348 PolarHBondContact O-N 2.99Å; R345-H348 VanDerWaalsContact O-N 3.08Å; R345-E349 PolarHBondContact O-N 3.49Å
346	A	65.9	Low	62.2	Low	55 Å²	55	99.5 Å²	99.5	46%	0.455	47%	0.474	S	S	.	.	H	α-helix	trans	-60.9	-33.7	176.1	0	0	0	0	0	112.6	L342 G343 A350	L342-A346 WeakPolarHBondContact O-CB 3.49Å; L342-A346 PolarHBondContact O-N 2.71Å; G343-A346 PolarHBondContact O-N 2.98Å; A346-A350 WeakPolarHBondContact O-CB 3.39Å; A346-A350 PolarHBondContact O-N 3.16Å
347	M	63.8	Low	63.6	Low	60 Å²	60	96 Å²	96	30%	0.296	47%	0.465	S	S	.	.	H	α-helix	trans	-66.5	-41.2	172.5	-78.9	174.4	158.2	0	0	112.5	G343 A344 R345 S351	G343-M347 WeakPolarHBondContact O-CB 3.34Å; G343-M347 VanDerWaalsContact O-CG 3.31Å; G343-M347 WeakPolarHBondContact O-CG 3.4Å; G343-M347 PolarHBondContact O-N 3Å; A344-M347 PolarHBondContact O-N 2.93Å; R345-M347 VanDerWaalsContact C-N 3.25Å; R345-M347 PolarHBondContact O-N 2.95Å; M347-S351 WeakPolarHBondContact O-CB 3.33Å; M347-S351 PolarHBondContact O-N 2.83Å
348	H	66.8	Low	64.9	Low	102 Å²	102	92 Å²	92	47%	0.472	45%	0.445	S	S	.	.	H	α-helix	trans	-66	-47.2	174.7	-84.1	-73.4	0	0	0	112.1	A344 R345 A350 S351 E352	A344-H348 PolarHBondContact O-CD2 2.69Å; A344-H348 VanDerWaalsContact O-CD2 3.27Å; A344-H348 PolarHBondContact O-N 3.21Å; A344-H348 VanDerWaalsContact O-N 3.07Å; R345-H348 PolarHBondContact O-N 2.99Å; R345-H348 VanDerWaalsContact O-N 3.08Å; H348-A350 VanDerWaalsContact C-N 3.32Å; H348-A350 PolarHBondContact O-N 3.25Å; H348-S351 WeakPolarHBondContact O-CB 3.45Å; H348-S351 PolarHBondContact O-N 2.89Å; H348-S351 VanDerWaalsContact O-N 3.07Å; H348-E352 PolarHBondContact O-N 2.74Å
349	E	72.1	Confident	66.1	Low	121 Å²	121	87.7 Å²	87.7	57%	0.565	43%	0.428	S	S	*	.	H	α-helix	trans	-59.4	-41.6	176.3	-69.9	168.3	-158.3	0	0	111.6	R345 I353	R345-E349 PolarHBondContact O-N 3.49Å; E349-I353 WeakPolarHBondContact O-CD1 3.24Å; E349-I353 WeakPolarHBondContact O-CG1 3.45Å; E349-I353 PolarHBondContact O-N 3.02Å
350	A	70.5	Confident	67.2	Low	39 Å²	39	82.5 Å²	82.5	32%	0.322	42%	0.416	S	S	.	.	H	α-helix	trans	-65.3	-37.9	173.3	0	0	0	0	0	112.7	A346 H348 I353 L354	A346-A350 WeakPolarHBondContact O-CB 3.39Å; A346-A350 PolarHBondContact O-N 3.16Å; H348-A350 VanDerWaalsContact C-N 3.32Å; H348-A350 PolarHBondContact O-N 3.25Å; A350-I353 PolarHBondContact O-N 3.39Å; A350-L354 WeakPolarHBondContact O-CB 3.46Å; A350-L354 VanDerWaalsContact O-CG 3.26Å; A350-L354 WeakPolarHBondContact O-CG 3.22Å; A350-L354 PolarHBondContact O-N 2.81Å
351	S	68.2	Low	68.2	Low	14 Å²	14	74.7 Å²	74.7	10%	0.098	39%	0.389	C	S	.	.	H	α-helix	trans	-64.9	-42.7	177.9	-155.5	0	0	0	0	111.7	M347 H348 I353 L354 H355	M347-S351 WeakPolarHBondContact O-CB 3.33Å; M347-S351 PolarHBondContact O-N 2.83Å; H348-S351 WeakPolarHBondContact O-CB 3.45Å; H348-S351 PolarHBondContact O-N 2.89Å; H348-S351 VanDerWaalsContact O-N 3.07Å; S351-I353 PolarHBondContact O-N 3.17Å; S351-L354 PolarHBondContact O-N 3.01Å; S351-H355 WeakPolarHBondContact O-CB 3.46Å; S351-H355 PolarHBondContact O-N 3.05Å
352	E	73.3	Confident	69.1	Low	127 Å²	127	72.3 Å²	72.3	59%	0.593	38%	0.38	S	S	*	.	H	α-helix	trans	-61.3	-43.8	175	-70	-175.6	177.3	0	0	111.7	H348 H355 Y356	H348-E352 PolarHBondContact O-N 2.74Å; E352-H355 PolarHBondContact O-N 3.46Å; E352-Y356 WeakPolarHBondContact O-CD2 3.31Å; E352-Y356 PolarHBondContact O-N 3.15Å
353	I	78.3	Confident	70	Confident	118 Å²	118	69.1 Å²	69.1	61%	0.605	37%	0.371	S	S	*	.	H	α-helix	trans	-64.1	-41.4	177.5	-66.7	166.3	0	0	0	111.3	E349 A350 S351 L357	E349-I353 WeakPolarHBondContact O-CD1 3.24Å; E349-I353 WeakPolarHBondContact O-CG1 3.45Å; E349-I353 PolarHBondContact O-N 3.02Å; A350-I353 PolarHBondContact O-N 3.39Å; S351-I353 PolarHBondContact O-N 3.17Å; I353-L357 WeakPolarHBondContact O-CB 3.41Å; I353-L357 PolarHBondContact O-N 3.25Å
354	L	69.7	Low	70.5	Confident	40 Å²	40	71.9 Å²	71.9	21%	0.209	38%	0.377	C	S	.	.	H	α-helix	trans	-66.9	-39.4	177	-71.7	168	0	0	0	112.1	I102 L109 A350 S351 L357 S358	I102-L354 HydrophobicContact CG2-CB 4.41Å; I102-L354 HydrophobicContact CG2-CD2 4.17Å; L109-L354 HydrophobicContact CD1-CD1 3.44Å; L109-L354 VanDerWaalsContact CD1-CD1 3.44Å; A350-L354 WeakPolarHBondContact O-CB 3.46Å; A350-L354 VanDerWaalsContact O-CG 3.26Å; A350-L354 WeakPolarHBondContact O-CG 3.22Å; A350-L354 PolarHBondContact O-N 2.81Å; S351-L354 PolarHBondContact O-N 3.01Å; L354-L357 WeakPolarHBondContact O-CB 3.46Å; L354-L357 PolarHBondContact O-N 3.34Å; L354-L357 VanDerWaalsContact O-N 3.16Å; L354-S358 PolarHBondContact O-N 3.11Å; L354-S358 PolarHBondContact O-OG 3.42Å
355	H	71.5	Confident	71	Confident	59 Å²	59	72.2 Å²	72.2	27%	0.273	37%	0.374	S	S	.	.	H	α-helix	trans	-62.3	-44.4	175.3	-171.4	75.8	0	0	0	112.4	E106 S351 E352 L357 S358 I359	E106-H355 IonicContact OE1-CE1 2.7Å; E106-H355 IonicContact OE1-CG 3.89Å; E106-H355 IonicContact OE1-ND1 2.73Å; E106-H355 PolarHBondContact OE1-ND1 2.95Å; S351-H355 WeakPolarHBondContact O-CB 3.46Å; S351-H355 PolarHBondContact O-N 3.05Å; E352-H355 PolarHBondContact O-N 3.46Å; H355-L357 VanDerWaalsContact C-N 3.29Å; H355-L357 PolarHBondContact O-N 2.99Å; H355-S358 PolarHBondContact O-OG 3.49Å; H355-I359 WeakPolarHBondContact NE2-CD1 3.44Å; H355-I359 WeakPolarHBondContact O-CB 3.38Å; H355-I359 VanDerWaalsContact O-CG1 3.3Å; H355-I359 WeakPolarHBondContact O-CG1 3.38Å; H355-I359 PolarHBondContact O-N 2.99Å; H355-I359 VanDerWaalsContact O-N 3.09Å
356	Y	75.5	Confident	71.3	Confident	167 Å²	167	68.2 Å²	68.2	66%	0.655	36%	0.361	S	S	*	.	H	α-helix	trans	-65.3	-33.4	173.3	-76.3	-60	0	0	0	112.5	E352 A360	E352-Y356 WeakPolarHBondContact O-CD2 3.31Å; E352-Y356 PolarHBondContact O-N 3.15Å; Y356-A360 VanDerWaalsContact O-CB 3.3Å; Y356-A360 WeakPolarHBondContact O-CB 3.4Å; Y356-A360 PolarHBondContact O-N 2.85Å
357	L	74.9	Confident	71.7	Confident	80 Å²	80	69.9 Å²	69.9	42%	0.419	36%	0.362	S	S	.	.	H	α-helix	trans	-72.1	-42.2	177.5	-175.4	62	0	0	0	112.6	I102 I353 L354 H355 A360 I361	I102-L357 HydrophobicContact CD1-CD2 3.79Å; I102-L357 HydrophobicContact CD1-CG 3.99Å; I353-L357 WeakPolarHBondContact O-CB 3.41Å; I353-L357 PolarHBondContact O-N 3.25Å; L354-L357 WeakPolarHBondContact O-CB 3.46Å; L354-L357 PolarHBondContact O-N 3.34Å; L354-L357 VanDerWaalsContact O-N 3.16Å; H355-L357 VanDerWaalsContact C-N 3.29Å; H355-L357 PolarHBondContact O-N 2.99Å; L357-A360 PolarHBondContact O-N 2.89Å; L357-I361 HydrophobicContact CD1-CD1 4.04Å; L357-I361 HydrophobicContact CD1-CG1 4.43Å; L357-I361 HydrophobicContact CG-CD1 3.94Å; L357-I361 VanDerWaalsContact O-CG1 3.31Å; L357-I361 WeakPolarHBondContact O-CG1 3.35Å; L357-I361 PolarHBondContact O-N 3.27Å
358	S	73.2	Confident	71.9	Confident	7 Å²	7	69.2 Å²	69.2	5%	0.049	36%	0.362	C	S	.	.	H	α-helix	trans	-63.7	-45.4	175.9	59.6	0	0	0	0	110.9	E106 L354 H355 A360 I361 T362	E106-S358 WeakPolarHBondContact OE2-CB 3.48Å; E106-S358 PolarHBondContact OE2-OG 3.32Å; L354-S358 PolarHBondContact O-N 3.11Å; L354-S358 PolarHBondContact O-OG 3.42Å; H355-S358 PolarHBondContact O-OG 3.49Å; S358-A360 PolarHBondContact O-N 3.3Å; S358-I361 PolarHBondContact O-N 3.1Å; S358-T362 WeakPolarHBondContact O-CB 3.45Å; S358-T362 PolarHBondContact O-N 2.81Å
359	I	72.6	Confident	72	Confident	63 Å²	63	66 Å²	66	32%	0.323	35%	0.35	S	S	.	.	H	α-helix	trans	-57.7	-45.1	172.5	-70.3	171	0	0	0	111.7	H355 T362 A363	H355-I359 WeakPolarHBondContact NE2-CD1 3.44Å; H355-I359 WeakPolarHBondContact O-CB 3.38Å; H355-I359 VanDerWaalsContact O-CG1 3.3Å; H355-I359 WeakPolarHBondContact O-CG1 3.38Å; H355-I359 PolarHBondContact O-N 2.99Å; H355-I359 VanDerWaalsContact O-N 3.09Å; I359-T362 PolarHBondContact O-N 2.85Å; I359-A363 VanDerWaalsContact O-CB 3.27Å; I359-A363 WeakPolarHBondContact O-CB 3.36Å; I359-A363 PolarHBondContact O-N 3.16Å
360	A	76.3	Confident	72	Confident	55 Å²	55	62.7 Å²	62.7	46%	0.455	34%	0.335	S	S	.	.	H	α-helix	trans	-64	-41.4	-179.9	0	0	0	0	0	112.7	Y356 L357 S358 L364	Y356-A360 VanDerWaalsContact O-CB 3.3Å; Y356-A360 WeakPolarHBondContact O-CB 3.4Å; Y356-A360 PolarHBondContact O-N 2.85Å; L357-A360 PolarHBondContact O-N 2.89Å; S358-A360 PolarHBondContact O-N 3.3Å; A360-L364 WeakPolarHBondContact O-CB 3.19Å; A360-L364 PolarHBondContact O-N 3.37Å
361	I	72.8	Confident	72	Confident	32 Å²	32	63.9 Å²	63.9	16%	0.164	34%	0.336	C	S	.	.	H	α-helix	trans	-68.8	-44.8	177.8	-67.8	164	0	0	0	110.7	L98 D99 I102 L357 S358 A363 L364 F365	L98-I361 HydrophobicContact CD2-CD1 4.1Å; D99-I361 HydrophobicContact CB-CG2 3.88Å; I102-I361 HydrophobicContact CD1-CD1 3.5Å; I102-I361 VanDerWaalsContact CD1-CD1 3.5Å; L357-I361 HydrophobicContact CD1-CD1 4.04Å; L357-I361 HydrophobicContact CD1-CG1 4.43Å; L357-I361 HydrophobicContact CG-CD1 3.94Å; L357-I361 VanDerWaalsContact O-CG1 3.31Å; L357-I361 WeakPolarHBondContact O-CG1 3.35Å; L357-I361 PolarHBondContact O-N 3.27Å; S358-I361 PolarHBondContact O-N 3.1Å; I361-A363 PolarHBondContact O-N 2.98Å; I361-L364 PolarHBondContact O-N 2.91Å; I361-F365 WeakPolarHBondContact O-CB 3.48Å; I361-F365 PolarHBondContact O-N 3.23Å
362	T	70.1	Confident	71.9	Confident	35 Å²	35	67.9 Å²	67.9	22%	0.215	35%	0.352	C	S	.	.	H	α-helix	trans	-61.4	-41.2	175.4	-83	0	0	0	0	111.8	D99 S358 I359 F365 F366	D99-T362 PolarHBondContact OD1-OG1 3.43Å; S358-T362 WeakPolarHBondContact O-CB 3.45Å; S358-T362 PolarHBondContact O-N 2.81Å; I359-T362 PolarHBondContact O-N 2.85Å; T362-F365 PolarHBondContact O-N 2.82Å; T362-F366 WeakPolarHBondContact O-CB 3.38Å; T362-F366 PolarHBondContact O-N 3.15Å
363	A	70.8	Confident	71.8	Confident	52 Å²	52	66.5 Å²	66.5	43%	0.43	35%	0.348	S	S	.	.	H	α-helix	trans	-64.5	-42	175.3	0	0	0	0	0	112.6	I359 I361 F366 L367	I359-A363 VanDerWaalsContact O-CB 3.27Å; I359-A363 WeakPolarHBondContact O-CB 3.36Å; I359-A363 PolarHBondContact O-N 3.16Å; I361-A363 PolarHBondContact O-N 2.98Å; A363-F366 PolarHBondContact O-N 3.17Å; A363-L367 PolarHBondContact O-N 2.86Å
364	L	72.1	Confident	71.5	Confident	91 Å²	91	65.5 Å²	65.5	48%	0.476	34%	0.343	S	S	.	.	H	α-helix	trans	-64	-42.1	174.7	-178.2	64.5	0	0	0	111.7	A360 I361 L367 C368	A360-L364 WeakPolarHBondContact O-CB 3.19Å; A360-L364 PolarHBondContact O-N 3.37Å; I361-L364 PolarHBondContact O-N 2.91Å; L364-L367 PolarHBondContact O-N 3.32Å; L364-C368 PolarHBondContact O-N 3.17Å; L364-C368 PolarHBondContact O-SG 3.38Å
365	F	69	Low	71.3	Confident	34 Å²	34	64.4 Å²	64.4	15%	0.149	34%	0.338	C	S	.	.	H	α-helix	trans	-61.7	-45.9	175.3	-177.8	-86.8	0	0	0	111.3	M92 V96 I361 T362 C368 V369 R421	M92-F365 HydrophobicContact CE-CD2 3.54Å; M92-F365 HydrophobicContact CE-CE2 3.39Å; M92-F365 HydrophobicContact CE-CG 4.32Å; M92-F365 HydrophobicContact CE-CZ 4.07Å; M92-F365 HydrophobicContact SD-CD2 4.28Å; M92-F365 HydrophobicContact SD-CE2 4.34Å; V96-F365 HydrophobicContact CG2-CD2 3.73Å; V96-F365 HydrophobicContact CG2-CE2 3.26Å; V96-F365 HydrophobicContact CG2-CZ 3.8Å; I361-F365 WeakPolarHBondContact O-CB 3.48Å; I361-F365 PolarHBondContact O-N 3.23Å; T362-F365 PolarHBondContact O-N 2.82Å; F365-C368 PolarHBondContact O-N 3.21Å; F365-V369 HydrophobicContact CD1-CG2 4.05Å; F365-V369 HydrophobicContact CE1-CG2 3.66Å; F365-V369 HydrophobicContact CZ-CG2 4.07Å; F365-V369 WeakPolarHBondContact O-CG2 3.4Å; F365-V369 PolarHBondContact O-N 3.26Å; F365-R421 HydrophobicContact CZ-CG 4.44Å
366	F	69.9	Low	71	Confident	81 Å²	81	64.1 Å²	64.1	36%	0.355	34%	0.338	S	S	.	.	H	α-helix	trans	-57.7	-50.4	175.2	170.6	-140	0	0	0	111.2	T362 A363 C368 V369 I370 L397	T362-F366 WeakPolarHBondContact O-CB 3.38Å; T362-F366 PolarHBondContact O-N 3.15Å; A363-F366 PolarHBondContact O-N 3.17Å; F366-C368 VanDerWaalsContact C-N 3.31Å; F366-C368 PolarHBondContact O-N 3.34Å; F366-V369 CarbonylContact O-C 3.55Å; F366-V369 WeakPolarHBondContact O-CA 3.41Å; F366-V369 WeakPolarHBondContact O-CB 3.4Å; F366-V369 PolarHBondContact O-N 3.45Å; F366-I370 HydrophobicContact CD1-CD1 4.11Å; F366-I370 HydrophobicContact CD2-CD1 3.87Å; F366-I370 HydrophobicContact CD2-CG1 3.66Å; F366-I370 HydrophobicContact CE1-CD1 3.69Å; F366-I370 HydrophobicContact CE1-CG1 4.46Å; F366-I370 HydrophobicContact CE2-CD1 3.4Å; F366-I370 HydrophobicContact CE2-CG1 3.23Å; F366-I370 HydrophobicContact CG-CD1 4.2Å; F366-I370 HydrophobicContact CG-CG1 4.42Å; F366-I370 HydrophobicContact CZ-CD1 3.31Å; F366-I370 HydrophobicContact CZ-CG1 3.71Å; F366-I370 WeakPolarHBondContact O-CG1 3.02Å; F366-I370 PolarHBondContact O-N 2.81Å; F366-L397 HydrophobicContact CB-CD1 4.19Å; F366-L397 HydrophobicContact CD1-CD1 3.72Å; F366-L397 HydrophobicContact CD2-CD1 3.39Å; F366-L397 HydrophobicContact CD2-CD2 3.82Å; F366-L397 HydrophobicContact CD2-CG 4.17Å; F366-L397 HydrophobicContact CE1-CD1 3.86Å; F366-L397 HydrophobicContact CE1-CD2 4.35Å; F366-L397 HydrophobicContact CE2-CD1 3.56Å; F366-L397 HydrophobicContact CE2-CD2 3.16Å; F366-L397 HydrophobicContact CE2-CG 3.94Å; F366-L397 HydrophobicContact CG-CD1 3.48Å; F366-L397 VanDerWaalsContact CG-CD1 3.48Å; F366-L397 HydrophobicContact CZ-CD1 3.78Å; F366-L397 HydrophobicContact CZ-CD2 3.47Å; F366-L397 VanDerWaalsContact CZ-CD2 3.47Å; F366-L397 HydrophobicContact CZ-CG 4.21Å
367	L	73.9	Confident	70.6	Confident	91 Å²	91	57.5 Å²	57.5	48%	0.476	32%	0.321	S	S	.	.	H	α-helix	trans	-56.5	-44.4	177.7	-176.6	61.2	0	0	0	111.8	A363 L364 V369 I370 L371	A363-L367 PolarHBondContact O-N 2.86Å; L364-L367 PolarHBondContact O-N 3.32Å; L367-V369 VanDerWaalsContact C-N 3.29Å; L367-V369 PolarHBondContact O-N 3.16Å; L367-I370 HydrophobicContact CD1-CD1 4.48Å; L367-I370 PolarHBondContact O-N 2.87Å; L367-L371 HydrophobicContact CD1-CD1 3.59Å; L367-L371 HydrophobicContact CG-CD1 3.93Å; L367-L371 WeakPolarHBondContact O-CD1 3.35Å; L367-L371 PolarHBondContact O-N 3.03Å
368	C	69.1	Low	69.8	Low	45 Å²	45	62.8 Å²	62.8	30%	0.304	34%	0.34	S	S	.	.	H	α-helix	trans	-61	-35.8	174.8	-67.2	0	0	0	0	113	M92 L364 F365 F366 K372	M92-C368 HydrophobicContact CE-CB 4.01Å; M92-C368 HydrophobicContact SD-CB 4.45Å; L364-C368 PolarHBondContact O-N 3.17Å; L364-C368 PolarHBondContact O-SG 3.38Å; F365-C368 PolarHBondContact O-N 3.21Å; F366-C368 VanDerWaalsContact C-N 3.31Å; F366-C368 PolarHBondContact O-N 3.34Å; C368-K372 WeakPolarHBondContact O-CB 3.5Å; C368-K372 PolarHBondContact O-N 3.45Å; C368-K372 VanDerWaalsContact O-N 3.08Å
369	V	69	Low	69.2	Low	34 Å²	34	69.6 Å²	69.6	21%	0.206	37%	0.372	C	S	.	.	H	α-helix	trans	-72.4	-38	175.2	170.6	0	0	0	0	112.1	M92 F365 F366 L367 K372 L373 I393	M92-V369 HydrophobicContact CE-CG2 4.27Å; F365-V369 HydrophobicContact CD1-CG2 4.05Å; F365-V369 HydrophobicContact CE1-CG2 3.66Å; F365-V369 HydrophobicContact CZ-CG2 4.07Å; F365-V369 WeakPolarHBondContact O-CG2 3.4Å; F365-V369 PolarHBondContact O-N 3.26Å; F366-V369 CarbonylContact O-C 3.55Å; F366-V369 WeakPolarHBondContact O-CA 3.41Å; F366-V369 WeakPolarHBondContact O-CB 3.4Å; F366-V369 PolarHBondContact O-N 3.45Å; L367-V369 VanDerWaalsContact C-N 3.29Å; L367-V369 PolarHBondContact O-N 3.16Å; V369-K372 WeakPolarHBondContact O-CB 3.48Å; V369-K372 PolarHBondContact O-N 3.22Å; V369-L373 PolarHBondContact O-N 3.47Å; V369-I393 HydrophobicContact CG1-CG2 3.78Å
370	I	70.8	Confident	68.5	Low	52 Å²	52	68.9 Å²	68.9	27%	0.267	37%	0.366	S	S	.	.	H	α-helix	trans	-60.2	-51.5	172.3	-60.4	166.4	0	0	0	110.1	F366 L367 K372 L373 I374	F366-I370 HydrophobicContact CD1-CD1 4.11Å; F366-I370 HydrophobicContact CD2-CD1 3.87Å; F366-I370 HydrophobicContact CD2-CG1 3.66Å; F366-I370 HydrophobicContact CE1-CD1 3.69Å; F366-I370 HydrophobicContact CE1-CG1 4.46Å; F366-I370 HydrophobicContact CE2-CD1 3.4Å; F366-I370 HydrophobicContact CE2-CG1 3.23Å; F366-I370 HydrophobicContact CG-CD1 4.2Å; F366-I370 HydrophobicContact CG-CG1 4.42Å; F366-I370 HydrophobicContact CZ-CD1 3.31Å; F366-I370 HydrophobicContact CZ-CG1 3.71Å; F366-I370 WeakPolarHBondContact O-CG1 3.02Å; F366-I370 PolarHBondContact O-N 2.81Å; L367-I370 HydrophobicContact CD1-CD1 4.48Å; L367-I370 PolarHBondContact O-N 2.87Å; I370-K372 PolarHBondContact O-N 3.43Å; I370-L373 WeakPolarHBondContact O-CB 3.41Å; I370-L373 PolarHBondContact O-N 3.32Å; I370-I374 HydrophobicContact CG2-CD1 3.55Å; I370-I374 HydrophobicContact CG2-CG1 4.11Å; I370-I374 WeakPolarHBondContact O-CG1 3.33Å; I370-I374 PolarHBondContact O-N 3.26Å
371	L	70.9	Confident	67.6	Low	65 Å²	65	73.5 Å²	73.5	34%	0.34	38%	0.376	S	S	.	.	H	α-helix	trans	-60.3	-35.6	-180	-89.5	78	0	0	0	111.1	F79 L367 C375	F79-L371 HydrophobicContact CE1-CB 3.77Å; F79-L371 HydrophobicContact CE1-CD2 4.3Å; F79-L371 HydrophobicContact CZ-CB 3.98Å; F79-L371 HydrophobicContact CZ-CD2 3.82Å; L367-L371 HydrophobicContact CD1-CD1 3.59Å; L367-L371 HydrophobicContact CG-CD1 3.93Å; L367-L371 WeakPolarHBondContact O-CD1 3.35Å; L367-L371 PolarHBondContact O-N 3.03Å; L371-C375 WeakPolarHBondContact O-CB 3.45Å; L371-C375 PolarHBondContact O-N 2.8Å; L371-C375 VanDerWaalsContact O-N 3.11Å; L371-C375 PolarHBondContact O-SG 2.88Å
372	K	67.2	Low	66.8	Low	98 Å²	98	81.9 Å²	81.9	43%	0.426	41%	0.406	S	S	.	.	H	α-helix	trans	-61.7	-47.9	171.8	-177.7	162.7	-179.7	175.9	0	112.2	L83 C368 V369 I370 C375 I376	L83-K372 VanDerWaalsContact CD1-CA 3.49Å; L83-K372 HydrophobicContact CD1-CB 3.56Å; L83-K372 HydrophobicContact CD1-CD 4.31Å; L83-K372 HydrophobicContact CD1-CG 3.84Å; C368-K372 WeakPolarHBondContact O-CB 3.5Å; C368-K372 PolarHBondContact O-N 3.45Å; C368-K372 VanDerWaalsContact O-N 3.08Å; V369-K372 WeakPolarHBondContact O-CB 3.48Å; V369-K372 PolarHBondContact O-N 3.22Å; I370-K372 PolarHBondContact O-N 3.43Å; K372-C375 PolarHBondContact O-N 2.97Å; K372-I376 HydrophobicContact CG-CD1 4.37Å; K372-I376 WeakPolarHBondContact O-CG1 3.22Å; K372-I376 PolarHBondContact O-N 3.36Å
373	L	69.7	Low	66.3	Low	97 Å²	97	82.7 Å²	82.7	51%	0.508	41%	0.409	S	S	.	.	H	α-helix	trans	-61.3	-49.4	177.5	-167.3	75.9	0	0	0	111.9	V369 I370 C375 I376 G377	V369-L373 PolarHBondContact O-N 3.47Å; I370-L373 WeakPolarHBondContact O-CB 3.41Å; I370-L373 PolarHBondContact O-N 3.32Å; L373-C375 PolarHBondContact O-N 3.46Å; L373-I376 PolarHBondContact O-N 3.37Å; L373-G377 PolarHBondContact O-N 2.83Å
374	I	71.7	Confident	65.6	Low	98 Å²	98	85.9 Å²	85.9	50%	0.503	42%	0.423	S	S	.	.	H	α-helix	trans	-60.7	-31.5	-179.4	-70	178.1	0	0	0	112.6	K76 I370	K76-I374 PolarHBondContact NZ-O 3.25Å; I370-I374 HydrophobicContact CG2-CD1 3.55Å; I370-I374 HydrophobicContact CG2-CG1 4.11Å; I370-I374 WeakPolarHBondContact O-CG1 3.33Å; I370-I374 PolarHBondContact O-N 3.26Å
375	C	66.3	Low	64.8	Low	17 Å²	17	88.1 Å²	88.1	12%	0.115	44%	0.436	C	S	.	.	H	α-helix	trans	-78.9	-29.3	-179.5	-71.7	0	0	0	0	113.7	F79 L80 L371 K372 L373	F79-C375 HydrophobicContact CD1-CB 4.15Å; F79-C375 WeakPolarHBondContact CD1-SG 3.41Å; L80-C375 HydrophobicContact CD2-CB 3.49Å; L80-C375 VanDerWaalsContact CD2-CB 3.49Å; L80-C375 HydrophobicContact CG-CB 3.96Å; L371-C375 WeakPolarHBondContact O-CB 3.45Å; L371-C375 PolarHBondContact O-N 2.8Å; L371-C375 VanDerWaalsContact O-N 3.11Å; L371-C375 PolarHBondContact O-SG 2.88Å; K372-C375 PolarHBondContact O-N 2.97Å; L373-C375 PolarHBondContact O-N 3.46Å
376	I	65.3	Low	64.6	Low	52 Å²	52	90.1 Å²	90.1	27%	0.267	45%	0.446	S	S	.	.	H	α-helix	trans	-84.7	-34	175.5	-42.6	163.3	0	0	0	110.7	L80 K372 L373 F380	L80-I376 HydrophobicContact CD1-CG1 4.25Å; L80-I376 HydrophobicContact CD2-CB 4.4Å; L80-I376 HydrophobicContact CD2-CD1 4.37Å; L80-I376 HydrophobicContact CD2-CG1 3.37Å; L80-I376 HydrophobicContact CG-CG1 4.45Å; K372-I376 HydrophobicContact CG-CD1 4.37Å; K372-I376 WeakPolarHBondContact O-CG1 3.22Å; K372-I376 PolarHBondContact O-N 3.36Å; L373-I376 PolarHBondContact O-N 3.37Å; I376-F380 HydrophobicContact CB-CD2 3.94Å; I376-F380 HydrophobicContact CB-CE2 3.98Å; I376-F380 HydrophobicContact CD1-CD2 4.35Å; I376-F380 HydrophobicContact CD1-CE2 3.53Å; I376-F380 HydrophobicContact CD1-CZ 4.25Å; I376-F380 HydrophobicContact CG1-CE2 4.32Å; I376-F380 HydrophobicContact CG2-CD2 3.62Å; I376-F380 HydrophobicContact CG2-CE2 3.7Å
377	G	66.6	Low	64.3	Low	28 Å²	28	93 Å²	93	29%	0.289	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	68.4	-145.4	165	0	0	0	0	0	114.9	L373 E379	L373-G377 PolarHBondContact O-N 2.83Å; G377-E379 PolarHBondContact O-N 3.5Å
378	K	58.8	Low	63.8	Low	191 Å²	191	95.3 Å²	95.3	83%	0.83	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-67.8	-15.1	-167.2	-74.9	-169	175.4	-174.1	0	115.2	F380 F381	K378-F380 PolarHBondContact O-N 3.23Å; K378-F381 PolarHBondContact O-N 2.91Å; K378-F381 VanDerWaalsContact O-N 3.17Å
379	E	61.2	Low	63.7	Low	151 Å²	151	96.3 Å²	96.3	71%	0.706	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-65.4	-29.6	-176.6	-64.2	-178.3	168	0	0	112.3	G377 F381 R382	G377-E379 PolarHBondContact O-N 3.5Å; E379-F381 PolarHBondContact O-N 3.17Å; E379-F381 VanDerWaalsContact O-N 3.09Å; E379-R382 PolarHBondContact O-N 3.17Å; E379-R382 VanDerWaalsContact O-N 3.15Å
380	F	57.5	Low	63.6	Low	48 Å²	48	95.3 Å²	95.3	21%	0.211	46%	0.46	C	S	.	.	G	3₁₀ helix	trans	-55.8	-22.5	172.8	-108.2	-100	0	0	0	114.8	I376 K378 R382 E386	I376-F380 HydrophobicContact CB-CD2 3.94Å; I376-F380 HydrophobicContact CB-CE2 3.98Å; I376-F380 HydrophobicContact CD1-CD2 4.35Å; I376-F380 HydrophobicContact CD1-CE2 3.53Å; I376-F380 HydrophobicContact CD1-CZ 4.25Å; I376-F380 HydrophobicContact CG1-CE2 4.32Å; I376-F380 HydrophobicContact CG2-CD2 3.62Å; I376-F380 HydrophobicContact CG2-CE2 3.7Å; K378-F380 PolarHBondContact O-N 3.23Å; F380-R382 VanDerWaalsContact C-N 3.31Å; F380-R382 PolarHBondContact O-N 2.87Å; F380-E386 HydrophobicContact CD1-CB 3.79Å; F380-E386 HydrophobicContact CE1-CB 3.89Å
381	F	56.3	Low	63.4	Low	151 Å²	151	94.5 Å²	94.5	66%	0.662	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-85.9	2.8	-178.5	-69.6	-84.4	0	0	0	113.8	K378 E379 Y387	K378-F381 PolarHBondContact O-N 2.91Å; K378-F381 VanDerWaalsContact O-N 3.17Å; E379-F381 PolarHBondContact O-N 3.17Å; E379-F381 VanDerWaalsContact O-N 3.09Å; F381-Y387 HydrophobicContact CD1-CD2 4.17Å; F381-Y387 AromaticContact CE1-CD2 3.76Å; F381-Y387 HydrophobicContact CE1-CD2 3.76Å; F381-Y387 AromaticContact CE1-CE2 3.96Å; F381-Y387 HydrophobicContact CE1-CE2 3.96Å
382	R	57.7	Low	63.2	Low	208 Å²	208	92.8 Å²	92.8	79%	0.785	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-84.1	-24.6	174.1	-72.8	-176.7	68.7	-179.5	0.9	114	E379 F380	E379-R382 PolarHBondContact O-N 3.17Å; E379-R382 VanDerWaalsContact O-N 3.15Å; F380-R382 VanDerWaalsContact C-N 3.31Å; F380-R382 PolarHBondContact O-N 2.87Å
383	D	57.8	Low	63.2	Low	52 Å²	52	91 Å²	91	28%	0.278	45%	0.447	S	S	.	.			trans	-118.7	116.5	-176.4	-77.9	-23.6	0	0	0	111.8	K32 N385 E386 Y387	K32-D383 WeakPolarHBondContact CE-OD2 3.45Å; K32-D383 IonicContact NZ-OD1 3.73Å; K32-D383 PolarHBondContact NZ-OD1 3.19Å; K32-D383 IonicContact NZ-OD2 2.73Å; K32-D383 PolarHBondContact NZ-OD2 3.26Å; D383-N385 PolarHBondContact O-N 2.86Å; D383-N385 VanDerWaalsContact O-N 3.1Å; D383-E386 HydrophobicContact CB-CB 4.29Å; D383-E386 HydrophobicContact CB-CG 3.96Å; D383-E386 PolarHBondContact O-N 3.37Å; D383-Y387 PolarHBondContact O-N 3.12Å
384	T	57.9	Low	63.1	Low	120 Å²	120	90.4 Å²	90.4	74%	0.736	45%	0.447	S	S	*	.	H	α-helix	trans	-53.7	-35.1	-178.2	-44	0	0	0	0	113.1	F388	T384-F388 PolarHBondContact O-N 3.48Å
385	N	55.2	Low	62.8	Low	138 Å²	138	88.7 Å²	88.7	74%	0.738	45%	0.447	S	S	*	.	H	α-helix	trans	-70.7	-32	179.2	-64	-12.7	0	0	0	112.5	D383 D389	D383-N385 PolarHBondContact O-N 2.86Å; D383-N385 VanDerWaalsContact O-N 3.1Å; N385-D389 WeakPolarHBondContact O-CB 3.45Å; N385-D389 PolarHBondContact O-N 2.89Å; N385-D389 VanDerWaalsContact O-N 3.14Å
386	E	63.5	Low	62.8	Low	76 Å²	76	88.7 Å²	88.7	36%	0.355	45%	0.448	S	S	.	.	H	α-helix	trans	-78	-33.1	178.4	-61.5	-161.8	150.2	0	0	111.6	F380 D383 D389 G390	F380-E386 HydrophobicContact CD1-CB 3.79Å; F380-E386 HydrophobicContact CE1-CB 3.89Å; D383-E386 HydrophobicContact CB-CB 4.29Å; D383-E386 HydrophobicContact CB-CG 3.96Å; D383-E386 PolarHBondContact O-N 3.37Å; E386-D389 WeakPolarHBondContact O-CB 3.31Å; E386-D389 PolarHBondContact O-N 3.39Å; E386-G390 PolarHBondContact O-N 2.72Å
387	Y	64.7	Low	62.8	Low	140 Å²	140	87.9 Å²	87.9	55%	0.549	44%	0.443	S	S	.	.	H	α-helix	trans	-64.6	-42.5	169.9	177.9	-99.6	0	0	0	112.2	F381 D383 D389 G390 A391	F381-Y387 HydrophobicContact CD1-CD2 4.17Å; F381-Y387 AromaticContact CE1-CD2 3.76Å; F381-Y387 HydrophobicContact CE1-CD2 3.76Å; F381-Y387 AromaticContact CE1-CE2 3.96Å; F381-Y387 HydrophobicContact CE1-CE2 3.96Å; D383-Y387 PolarHBondContact O-N 3.12Å; Y387-D389 VanDerWaalsContact C-N 3.31Å; Y387-D389 PolarHBondContact O-N 2.75Å; Y387-G390 CarbonylContact O-C 3.59Å; Y387-G390 PolarHBondContact O-N 2.91Å; Y387-A391 HydrophobicContact CE1-CB 4.25Å; Y387-A391 WeakPolarHBondContact O-CB 3.47Å; Y387-A391 PolarHBondContact O-N 3.19Å
388	F	63.6	Low	62.8	Low	140 Å²	140	88.8 Å²	88.8	61%	0.614	45%	0.449	S	S	*	.	H	α-helix	trans	-62.6	-39.9	176	-170.9	-112	0	0	0	111.7	T384 G390 A391 I392	T384-F388 PolarHBondContact O-N 3.48Å; F388-G390 VanDerWaalsContact C-N 3.31Å; F388-G390 PolarHBondContact O-N 3.07Å; F388-A391 PolarHBondContact O-N 3.15Å; F388-I392 HydrophobicContact CD1-CD1 3.71Å; F388-I392 HydrophobicContact CE1-CD1 3.53Å; F388-I392 HydrophobicContact CE1-CG1 4.44Å; F388-I392 HydrophobicContact CG-CD1 4.37Å; F388-I392 HydrophobicContact CZ-CD1 4.04Å; F388-I392 WeakPolarHBondContact O-CB 3.44Å; F388-I392 WeakPolarHBondContact O-CD1 3.44Å; F388-I392 VanDerWaalsContact O-CG1 3.31Å; F388-I392 WeakPolarHBondContact O-CG1 3.46Å; F388-I392 PolarHBondContact O-N 3.17Å
389	D	66.2	Low	63	Low	67 Å²	67	81.8 Å²	81.8	36%	0.358	42%	0.423	S	S	.	.	H	α-helix	trans	-57.5	-41.7	172.8	-157.4	81	0	0	0	112.2	N385 E386 Y387 I393 R424	N385-D389 WeakPolarHBondContact O-CB 3.45Å; N385-D389 PolarHBondContact O-N 2.89Å; N385-D389 VanDerWaalsContact O-N 3.14Å; E386-D389 WeakPolarHBondContact O-CB 3.31Å; E386-D389 PolarHBondContact O-N 3.39Å; Y387-D389 VanDerWaalsContact C-N 3.31Å; Y387-D389 PolarHBondContact O-N 2.75Å; D389-I393 WeakPolarHBondContact O-CG1 3.29Å; D389-R424 PolarHBondContact O-NH2 3.32Å; D389-R424 IonicContact OD1-CZ 2.89Å; D389-R424 IonicContact OD1-NH1 2.72Å; D389-R424 PolarHBondContact OD1-NH1 3.17Å; D389-R424 IonicContact OD1-NH2 2.66Å; D389-R424 PolarHBondContact OD1-NH2 3.46Å; D389-R424 IonicContact OD2-CZ 2.7Å; D389-R424 IonicContact OD2-NH1 2.75Å; D389-R424 IonicContact OD2-NH2 3.88Å; D389-R424 PolarHBondContact OD2-NH2 3.37Å
390	G	66.2	Low	63.1	Low	13 Å²	13	75.5 Å²	75.5	13%	0.134	40%	0.395	C	S	.	.	H	α-helix	trans	-72	-42.4	174.3	0	0	0	0	0	114.5	E386 Y387 F388 I392 I393 V394	E386-G390 PolarHBondContact O-N 2.72Å; Y387-G390 CarbonylContact O-C 3.59Å; Y387-G390 PolarHBondContact O-N 2.91Å; F388-G390 VanDerWaalsContact C-N 3.31Å; F388-G390 PolarHBondContact O-N 3.07Å; G390-I392 VanDerWaalsContact C-N 3.28Å; G390-I392 PolarHBondContact O-N 3.38Å; G390-I393 WeakPolarHBondContact O-CB 3.15Å; G390-I393 PolarHBondContact O-N 3.39Å; G390-V394 PolarHBondContact O-N 3.42Å
391	A	66.7	Low	63.4	Low	34 Å²	34	77.3 Å²	77.3	28%	0.281	41%	0.41	S	S	.	.	H	α-helix	trans	-61.7	-38.3	178.6	0	0	0	0	0	111.6	Y387 F388 I393 V394 A395	Y387-A391 HydrophobicContact CE1-CB 4.25Å; Y387-A391 WeakPolarHBondContact O-CB 3.47Å; Y387-A391 PolarHBondContact O-N 3.19Å; F388-A391 PolarHBondContact O-N 3.15Å; A391-I393 VanDerWaalsContact C-N 3.31Å; A391-I393 PolarHBondContact O-N 3.11Å; A391-V394 PolarHBondContact O-N 3.24Å; A391-A395 WeakPolarHBondContact O-CB 3.4Å; A391-A395 PolarHBondContact O-N 2.99Å
392	I	66.5	Low	63.8	Low	29 Å²	29	74.7 Å²	74.7	15%	0.149	40%	0.402	C	S	.	.	H	α-helix	trans	-58.5	-41.4	171.2	-75.5	166.1	0	0	0	111.8	F388 G390 A395 S396 W420	F388-I392 HydrophobicContact CD1-CD1 3.71Å; F388-I392 HydrophobicContact CE1-CD1 3.53Å; F388-I392 HydrophobicContact CE1-CG1 4.44Å; F388-I392 HydrophobicContact CG-CD1 4.37Å; F388-I392 HydrophobicContact CZ-CD1 4.04Å; F388-I392 WeakPolarHBondContact O-CB 3.44Å; F388-I392 WeakPolarHBondContact O-CD1 3.44Å; F388-I392 VanDerWaalsContact O-CG1 3.31Å; F388-I392 WeakPolarHBondContact O-CG1 3.46Å; F388-I392 PolarHBondContact O-N 3.17Å; G390-I392 VanDerWaalsContact C-N 3.28Å; G390-I392 PolarHBondContact O-N 3.38Å; I392-A395 PolarHBondContact O-N 3.02Å; I392-S396 PolarHBondContact O-N 3.18Å; I392-S396 PolarHBondContact O-OG 3.28Å; I392-W420 HydrophobicContact CD1-CZ2 4.27Å; I392-W420 HydrophobicContact CG2-CZ2 3.67Å
393	I	67	Low	63.9	Low	62 Å²	62	66.2 Å²	66.2	32%	0.318	37%	0.37	S	S	.	.	H	α-helix	trans	-66.6	-41.9	179.2	-67.6	164.4	0	0	0	110.6	V369 D389 G390 A391 A395 S396 L397	V369-I393 HydrophobicContact CG1-CG2 3.78Å; D389-I393 WeakPolarHBondContact O-CG1 3.29Å; G390-I393 WeakPolarHBondContact O-CB 3.15Å; G390-I393 PolarHBondContact O-N 3.39Å; A391-I393 VanDerWaalsContact C-N 3.31Å; A391-I393 PolarHBondContact O-N 3.11Å; I393-A395 VanDerWaalsContact C-N 3.34Å; I393-S396 WeakPolarHBondContact CA-OG 3.46Å; I393-S396 PolarHBondContact O-N 2.91Å; I393-S396 PolarHBondContact O-OG 3.21Å; I393-L397 WeakPolarHBondContact O-CB 3.4Å; I393-L397 PolarHBondContact O-N 3.2Å
394	V	67.6	Low	63.8	Low	84 Å²	84	68.1 Å²	68.1	51%	0.509	38%	0.384	S	S	.	.	H	α-helix	trans	-65.5	-37.1	175.5	177.5	0	0	0	0	111.4	G390 A391 L397 A398	G390-V394 PolarHBondContact O-N 3.42Å; A391-V394 PolarHBondContact O-N 3.24Å; V394-L397 PolarHBondContact O-N 3.4Å; V394-A398 WeakPolarHBondContact O-CB 3.38Å; V394-A398 PolarHBondContact O-N 3.25Å
395	A	66.1	Low	63.7	Low	62 Å²	62	72.4 Å²	72.4	51%	0.512	39%	0.386	S	S	.	.	H	α-helix	trans	-66.7	-43.5	175.6	0	0	0	0	0	112.5	A391 I392 I393 A398 S399	A391-A395 WeakPolarHBondContact O-CB 3.4Å; A391-A395 PolarHBondContact O-N 2.99Å; I392-A395 PolarHBondContact O-N 3.02Å; I393-A395 VanDerWaalsContact C-N 3.34Å; A395-A398 PolarHBondContact O-N 3.18Å; A395-S399 PolarHBondContact O-N 3.13Å; A395-S399 VanDerWaalsContact O-N 3.15Å
396	S	67.1	Low	63.9	Low	17 Å²	17	73 Å²	73	12%	0.119	38%	0.379	C	S	.	.	H	α-helix	trans	-60.5	-46.3	173.5	43.4	0	0	0	0	111.6	I392 I393 A398 S399 D400	I392-S396 PolarHBondContact O-N 3.18Å; I392-S396 PolarHBondContact O-OG 3.28Å; I393-S396 WeakPolarHBondContact CA-OG 3.46Å; I393-S396 PolarHBondContact O-N 2.91Å; I393-S396 PolarHBondContact O-OG 3.21Å; S396-A398 PolarHBondContact O-N 2.99Å; S396-S399 PolarHBondContact O-N 2.95Å; S396-S399 VanDerWaalsContact O-N 3.15Å; S396-D400 PolarHBondContact O-N 3.13Å
397	L	65.6	Low	63.7	Low	34 Å²	34	75 Å²	75	18%	0.178	40%	0.396	C	S	.	.	H	α-helix	trans	-57	-47.7	175.2	167	72.2	0	0	0	112.7	F366 I393 V394 S399 D400 V401	F366-L397 HydrophobicContact CB-CD1 4.19Å; F366-L397 HydrophobicContact CD1-CD1 3.72Å; F366-L397 HydrophobicContact CD2-CD1 3.39Å; F366-L397 HydrophobicContact CD2-CD2 3.82Å; F366-L397 HydrophobicContact CD2-CG 4.17Å; F366-L397 HydrophobicContact CE1-CD1 3.86Å; F366-L397 HydrophobicContact CE1-CD2 4.35Å; F366-L397 HydrophobicContact CE2-CD1 3.56Å; F366-L397 HydrophobicContact CE2-CD2 3.16Å; F366-L397 HydrophobicContact CE2-CG 3.94Å; F366-L397 HydrophobicContact CG-CD1 3.48Å; F366-L397 VanDerWaalsContact CG-CD1 3.48Å; F366-L397 HydrophobicContact CZ-CD1 3.78Å; F366-L397 HydrophobicContact CZ-CD2 3.47Å; F366-L397 VanDerWaalsContact CZ-CD2 3.47Å; F366-L397 HydrophobicContact CZ-CG 4.21Å; I393-L397 WeakPolarHBondContact O-CB 3.4Å; I393-L397 PolarHBondContact O-N 3.2Å; V394-L397 PolarHBondContact O-N 3.4Å; L397-S399 PolarHBondContact O-N 3.44Å; L397-D400 WeakPolarHBondContact O-CB 3.48Å; L397-D400 PolarHBondContact O-N 2.93Å; L397-V401 HydrophobicContact CD1-CG2 3.95Å; L397-V401 HydrophobicContact CG-CG2 4.47Å; L397-V401 WeakPolarHBondContact O-CG2 3.48Å; L397-V401 PolarHBondContact O-N 3.29Å
398	A	65.5	Low	63.2	Low	48 Å²	48	73.9 Å²	73.9	40%	0.397	41%	0.409	S	S	.	.	H	α-helix	trans	-59.6	-35.9	-179.3	0	0	0	0	0	110.8	V394 A395 S396 L402	V394-A398 WeakPolarHBondContact O-CB 3.38Å; V394-A398 PolarHBondContact O-N 3.25Å; A395-A398 PolarHBondContact O-N 3.18Å; S396-A398 PolarHBondContact O-N 2.99Å; A398-L402 WeakPolarHBondContact O-CB 3.41Å; A398-L402 WeakPolarHBondContact O-CD1 3.25Å; A398-L402 WeakPolarHBondContact O-CG 3.42Å; A398-L402 PolarHBondContact O-N 3.2Å
399	S	63.8	Low	63.2	Low	43 Å²	43	75.8 Å²	75.8	30%	0.301	42%	0.42	S	S	.	.	H	α-helix	trans	-76.3	-36.3	175.9	-151.8	0	0	0	0	113.3	A395 S396 L397 V401 L402 Y403 L417	A395-S399 PolarHBondContact O-N 3.13Å; A395-S399 VanDerWaalsContact O-N 3.15Å; S396-S399 PolarHBondContact O-N 2.95Å; S396-S399 VanDerWaalsContact O-N 3.15Å; L397-S399 PolarHBondContact O-N 3.44Å; S399-V401 VanDerWaalsContact C-N 3.28Å; S399-V401 PolarHBondContact O-N 3.11Å; S399-L402 PolarHBondContact O-N 2.98Å; S399-Y403 PolarHBondContact O-N 3.28Å; S399-L417 VanDerWaalsContact OG-CD1 3.22Å; S399-L417 WeakPolarHBondContact OG-CD1 3.41Å
400	D	63.5	Low	63	Low	19 Å²	19	74.2 Å²	74.2	10%	0.102	41%	0.413	C	S	.	.	H	α-helix	trans	-58	-40.3	170.1	-60.8	-26.7	0	0	0	110.9	S396 L397 Y403 R421	S396-D400 PolarHBondContact O-N 3.13Å; L397-D400 WeakPolarHBondContact O-CB 3.48Å; L397-D400 PolarHBondContact O-N 2.93Å; D400-Y403 WeakPolarHBondContact O-CB 3.18Å; D400-R421 IonicContact OD1-NH2 2.72Å; D400-R421 PolarHBondContact OD1-NH2 3.3Å; D400-R421 IonicContact OD2-CZ 2.68Å; D400-R421 IonicContact OD2-NH1 3.66Å; D400-R421 PolarHBondContact OD2-NH1 3.33Å; D400-R421 VanDerWaalsContact OD2-NH1 3.16Å; D400-R421 IonicContact OD2-NH2 3.39Å; D400-R421 PolarHBondContact OD2-NH2 3.08Å
401	V	63.4	Low	62.9	Low	87 Å²	87	75.6 Å²	75.6	53%	0.527	42%	0.423	S	S	.	.	H	α-helix	trans	-80.3	-33	-178.5	173.1	0	0	0	0	112.5	L397 S399 Y403	L397-V401 HydrophobicContact CD1-CG2 3.95Å; L397-V401 HydrophobicContact CG-CG2 4.47Å; L397-V401 WeakPolarHBondContact O-CG2 3.48Å; L397-V401 PolarHBondContact O-N 3.29Å; S399-V401 VanDerWaalsContact C-N 3.28Å; S399-V401 PolarHBondContact O-N 3.11Å; V401-Y403 VanDerWaalsContact C-N 3.32Å
402	L	64.9	Low	62.9	Low	95 Å²	95	76.6 Å²	76.6	50%	0.497	43%	0.431	S	S	.	.	H	α-helix	trans	-69.6	-28.5	176	-78.9	167.6	0	0	0	112.7	A398 S399 V404 R405 Y406	A398-L402 WeakPolarHBondContact O-CB 3.41Å; A398-L402 WeakPolarHBondContact O-CD1 3.25Å; A398-L402 WeakPolarHBondContact O-CG 3.42Å; A398-L402 PolarHBondContact O-N 3.2Å; S399-L402 PolarHBondContact O-N 2.98Å; L402-V404 VanDerWaalsContact C-N 3.25Å; L402-V404 PolarHBondContact O-N 3.33Å; L402-R405 PolarHBondContact O-N 3.25Å; L402-Y406 HydrophobicContact CD2-CE2 4.38Å
403	Y	58.9	Low	62.8	Low	31 Å²	31	77.3 Å²	77.3	12%	0.122	44%	0.441	C	S	.	.	H	α-helix	trans	-49.9	-45.7	174.1	172.4	-112.2	0	0	0	112.3	S399 D400 V401 R405 Y406 T410 M414	S399-Y403 PolarHBondContact O-N 3.28Å; D400-Y403 WeakPolarHBondContact O-CB 3.18Å; V401-Y403 VanDerWaalsContact C-N 3.32Å; Y403-R405 PolarHBondContact O-N 3.26Å; Y403-Y406 PolarHBondContact O-N 2.97Å; Y403-T410 WeakPolarHBondContact CD2-OG1 3.31Å; Y403-M414 HydrophobicContact CD1-CE 3.77Å; Y403-M414 HydrophobicContact CD1-CG 4.22Å; Y403-M414 HydrophobicContact CD1-SD 3.61Å; Y403-M414 HydrophobicContact CD2-CE 4.42Å; Y403-M414 HydrophobicContact CD2-CG 3.31Å; Y403-M414 HydrophobicContact CD2-SD 3.81Å; Y403-M414 HydrophobicContact CE1-CE 3.53Å; Y403-M414 HydrophobicContact CE1-CG 4.38Å; Y403-M414 HydrophobicContact CE1-SD 3.98Å; Y403-M414 HydrophobicContact CE2-CE 4.25Å; Y403-M414 HydrophobicContact CE2-CG 3.54Å; Y403-M414 HydrophobicContact CE2-SD 4.2Å; Y403-M414 HydrophobicContact CG-CE 4.21Å; Y403-M414 HydrophobicContact CG-CG 3.7Å; Y403-M414 HydrophobicContact CG-SD 3.52Å; Y403-M414 VanDerWaalsContact CG-SD 3.52Å
404	V	56.4	Low	62.6	Low	92 Å²	92	75.2 Å²	75.2	56%	0.558	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-11.7	-179.6	-172	0	0	0	0	113.6	L402	L402-V404 VanDerWaalsContact C-N 3.25Å; L402-V404 PolarHBondContact O-N 3.33Å
405	R	55.6	Low	62.7	Low	210 Å²	210	74.2 Å²	74.2	79%	0.792	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.1	-9.5	177.1	-69.5	-169.9	173.8	-158.8	-1.6	115.5	L402 Y403	L402-R405 PolarHBondContact O-N 3.25Å; Y403-R405 PolarHBondContact O-N 3.26Å
406	Y	58.5	Low	62.8	Low	151 Å²	151	75.8 Å²	75.8	59%	0.592	43%	0.427	S	S	*	.			trans	-137.5	72.3	-169.5	-70.4	-74.8	0	0	0	111.5	L402 Y403 S408 T410	L402-Y406 HydrophobicContact CD2-CE2 4.38Å; Y403-Y406 PolarHBondContact O-N 2.97Å; Y406-S408 PolarHBondContact O-N 3.48Å; Y406-T410 WeakPolarHBondContact O-CB 3.41Å; Y406-T410 WeakPolarHBondContact O-CG2 3.35Å; Y406-T410 PolarHBondContact O-OG1 3.12Å
407	V	59	Low	62.7	Low	116 Å²	116	76.3 Å²	76.3	70%	0.703	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-39	-165.8	179.2	0	0	0	0	114.8
408	S	56	Low	62.9	Low	118 Å²	118	75.5 Å²	75.5	83%	0.825	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-42.3	-162.3	-160.8	0	0	0	0	115.9	Y406	Y406-S408 PolarHBondContact O-N 3.48Å
409	E	62.4	Low	63.2	Low	180 Å²	180	77.8 Å²	77.8	84%	0.841	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-12.3	-169.8	-63.9	-177.9	-174	0	0	114
410	T	62	Low	63.9	Low	34 Å²	34	80.8 Å²	80.8	21%	0.209	43%	0.434	C	S	.	.			trans	-93.1	-10.4	-163.4	57	0	0	0	0	114.6	Y403 Y406 A412 A413 M414	Y403-T410 WeakPolarHBondContact CD2-OG1 3.31Å; Y406-T410 WeakPolarHBondContact O-CB 3.41Å; Y406-T410 WeakPolarHBondContact O-CG2 3.35Å; Y406-T410 PolarHBondContact O-OG1 3.12Å; T410-A412 PolarHBondContact O-N 3.47Å; T410-A413 WeakPolarHBondContact O-CA 3.48Å; T410-A413 WeakPolarHBondContact O-CB 3.38Å; T410-A413 PolarHBondContact O-N 3.14Å; T410-M414 PolarHBondContact O-N 3.46Å
411	A	64.1	Low	64.1	Low	42 Å²	42	81 Å²	81	35%	0.347	43%	0.434	S	S	.	.	H	α-helix	trans	-56.7	-33.1	179.5	0	0	0	0	0	113.1	M414 V415	A411-M414 WeakPolarHBondContact O-CB 3.35Å; A411-V415 PolarHBondContact O-N 3.02Å
412	A	66.1	Low	64.5	Low	55 Å²	55	79.4 Å²	79.4	46%	0.455	42%	0.421	S	S	.	.	H	α-helix	trans	-69.1	-35.2	172.9	0	0	0	0	0	112.8	T410 V416	T410-A412 PolarHBondContact O-N 3.47Å; A412-V416 WeakPolarHBondContact O-CG2 3.45Å; A412-V416 PolarHBondContact O-N 3.46Å
413	A	64.2	Low	64.9	Low	44 Å²	44	78.6 Å²	78.6	36%	0.364	42%	0.417	S	S	.	.	H	α-helix	trans	-71.3	-41.3	176.5	0	0	0	0	0	111.5	T410 V415 V416 L417	T410-A413 WeakPolarHBondContact O-CA 3.48Å; T410-A413 WeakPolarHBondContact O-CB 3.38Å; T410-A413 PolarHBondContact O-N 3.14Å; A413-V415 PolarHBondContact O-N 2.96Å; A413-V416 PolarHBondContact O-N 3.4Å; A413-V416 VanDerWaalsContact O-N 3.09Å; A413-L417 HydrophobicContact CB-CD1 4.42Å; A413-L417 VanDerWaalsContact O-CD1 3.31Å; A413-L417 WeakPolarHBondContact O-CD1 3.44Å; A413-L417 VanDerWaalsContact O-CG 3.23Å; A413-L417 WeakPolarHBondContact O-CG 3.42Å; A413-L417 PolarHBondContact O-N 2.83Å
414	M	64.6	Low	65.5	Low	18 Å²	18	78.9 Å²	78.9	9%	0.089	42%	0.418	C	S	.	.	H	α-helix	trans	-46.8	-54.7	172.6	-85.3	-81.5	-79.8	0	0	112.1	V103 Y403 T410 A411 V416 L417 L418	V103-M414 HydrophobicContact CG1-CE 3.86Å; Y403-M414 HydrophobicContact CD1-CE 3.77Å; Y403-M414 HydrophobicContact CD1-CG 4.22Å; Y403-M414 HydrophobicContact CD1-SD 3.61Å; Y403-M414 HydrophobicContact CD2-CE 4.42Å; Y403-M414 HydrophobicContact CD2-CG 3.31Å; Y403-M414 HydrophobicContact CD2-SD 3.81Å; Y403-M414 HydrophobicContact CE1-CE 3.53Å; Y403-M414 HydrophobicContact CE1-CG 4.38Å; Y403-M414 HydrophobicContact CE1-SD 3.98Å; Y403-M414 HydrophobicContact CE2-CE 4.25Å; Y403-M414 HydrophobicContact CE2-CG 3.54Å; Y403-M414 HydrophobicContact CE2-SD 4.2Å; Y403-M414 HydrophobicContact CG-CE 4.21Å; Y403-M414 HydrophobicContact CG-CG 3.7Å; Y403-M414 HydrophobicContact CG-SD 3.52Å; Y403-M414 VanDerWaalsContact CG-SD 3.52Å; T410-M414 PolarHBondContact O-N 3.46Å; A411-M414 WeakPolarHBondContact O-CB 3.35Å; M414-V416 VanDerWaalsContact C-N 3.31Å; M414-V416 PolarHBondContact O-N 3.23Å; M414-L417 PolarHBondContact O-N 3.36Å; M414-L417 VanDerWaalsContact O-N 3.15Å; M414-L418 WeakPolarHBondContact O-CG 3.47Å; M414-L418 PolarHBondContact O-N 3.19Å
415	V	68.4	Low	66.2	Low	62 Å²	62	75.8 Å²	75.8	38%	0.376	40%	0.398	S	S	.	.	H	α-helix	trans	-60.3	-39.9	-179.5	177.9	0	0	0	0	111.7	I107 A411 A413 L419	I107-V415 HydrophobicContact CD1-CG2 4.07Å; A411-V415 PolarHBondContact O-N 3.02Å; A413-V415 PolarHBondContact O-N 2.96Å; V415-L419 HydrophobicContact CG1-CD1 4.09Å; V415-L419 WeakPolarHBondContact O-CB 3.41Å; V415-L419 VanDerWaalsContact O-CG 3.24Å; V415-L419 WeakPolarHBondContact O-CG 3.3Å; V415-L419 PolarHBondContact O-N 2.98Å
416	V	68.2	Low	67.1	Low	95 Å²	95	70.3 Å²	70.3	58%	0.576	38%	0.383	S	S	*	.	H	α-helix	trans	-66.9	-37.8	177.2	174.6	0	0	0	0	112.1	A412 A413 M414 W420	A412-V416 WeakPolarHBondContact O-CG2 3.45Å; A412-V416 PolarHBondContact O-N 3.46Å; A413-V416 PolarHBondContact O-N 3.4Å; A413-V416 VanDerWaalsContact O-N 3.09Å; M414-V416 VanDerWaalsContact C-N 3.31Å; M414-V416 PolarHBondContact O-N 3.23Å; V416-W420 WeakPolarHBondContact O-CB 3.27Å; V416-W420 PolarHBondContact O-N 3.36Å
417	L	65.9	Low	67.6	Low	29 Å²	29	66.5 Å²	66.5	15%	0.152	37%	0.373	C	S	.	.	H	α-helix	trans	-70.8	-38.6	178	-65.6	155.6	0	0	0	111.9	S399 A413 M414 W420 R421	S399-L417 VanDerWaalsContact OG-CD1 3.22Å; S399-L417 WeakPolarHBondContact OG-CD1 3.41Å; A413-L417 HydrophobicContact CB-CD1 4.42Å; A413-L417 VanDerWaalsContact O-CD1 3.31Å; A413-L417 WeakPolarHBondContact O-CD1 3.44Å; A413-L417 VanDerWaalsContact O-CG 3.23Å; A413-L417 WeakPolarHBondContact O-CG 3.42Å; A413-L417 PolarHBondContact O-N 2.83Å; M414-L417 PolarHBondContact O-N 3.36Å; M414-L417 VanDerWaalsContact O-N 3.15Å; L417-W420 WeakPolarHBondContact O-CB 3.48Å; L417-W420 PolarHBondContact O-N 3.29Å; L417-R421 PolarHBondContact O-N 3.4Å
418	L	69	Low	68.1	Low	16 Å²	16	63.4 Å²	63.4	8%	0.084	36%	0.359	C	S	.	.	H	α-helix	trans	-64.9	-44.9	173	-68.5	170.1	0	0	0	111.4	V103 M414 W420 R421 I422	V103-L418 HydrophobicContact CB-CD1 3.99Å; V103-L418 HydrophobicContact CG1-CD1 3.72Å; V103-L418 HydrophobicContact CG2-CD1 4.36Å; M414-L418 WeakPolarHBondContact O-CG 3.47Å; M414-L418 PolarHBondContact O-N 3.19Å; L418-W420 VanDerWaalsContact C-N 3.28Å; L418-W420 PolarHBondContact O-N 2.99Å; L418-R421 VanDerWaalsContact O-CB 3.3Å; L418-R421 WeakPolarHBondContact O-CB 3.4Å; L418-R421 PolarHBondContact O-N 2.98Å; L418-R421 VanDerWaalsContact O-N 3.13Å; L418-I422 PolarHBondContact O-N 3.27Å
419	L	72.3	Confident	68.6	Low	97 Å²	97	60.8 Å²	60.8	51%	0.508	34%	0.336	S	S	.	.	H	α-helix	trans	-59.2	-39.6	172.2	-73.7	169.1	0	0	0	111.9	V415 I422 I423	V415-L419 HydrophobicContact CG1-CD1 4.09Å; V415-L419 WeakPolarHBondContact O-CB 3.41Å; V415-L419 VanDerWaalsContact O-CG 3.24Å; V415-L419 WeakPolarHBondContact O-CG 3.3Å; V415-L419 PolarHBondContact O-N 2.98Å; L419-I422 WeakPolarHBondContact O-CB 3.32Å; L419-I422 PolarHBondContact O-N 2.85Å; L419-I423 WeakPolarHBondContact O-CG1 3.29Å; L419-I423 PolarHBondContact O-N 2.95Å; L419-I423 VanDerWaalsContact O-N 3.15Å
420	W	77.5	Confident	69	Low	105 Å²	105	56.6 Å²	56.6	40%	0.398	32%	0.317	S	S	.	.	H	α-helix	trans	-62.6	-42.1	173.9	-175.5	-107.8	0	0	0	112.1	I392 V416 L417 L418 I422 I423 R424	I392-W420 HydrophobicContact CD1-CZ2 4.27Å; I392-W420 HydrophobicContact CG2-CZ2 3.67Å; V416-W420 WeakPolarHBondContact O-CB 3.27Å; V416-W420 PolarHBondContact O-N 3.36Å; L417-W420 WeakPolarHBondContact O-CB 3.48Å; L417-W420 PolarHBondContact O-N 3.29Å; L418-W420 VanDerWaalsContact C-N 3.28Å; L418-W420 PolarHBondContact O-N 2.99Å; W420-I422 PolarHBondContact O-N 3.24Å; W420-I423 HydrophobicContact CE3-CD1 4.33Å; W420-I423 PolarHBondContact O-N 3.06Å; W420-I423 VanDerWaalsContact O-N 3.12Å; W420-R424 HydrophobicContact CD2-CG 4.35Å; W420-R424 HydrophobicContact CG-CG 4.29Å; W420-R424 WeakPolarHBondContact O-CG 3.39Å; W420-R424 PolarHBondContact O-N 3.49Å
421	R	68.8	Low	69.3	Low	25 Å²	25	59.8 Å²	59.8	9%	0.094	33%	0.331	C	S	.	.	H	α-helix	trans	-54.1	-41.3	174.9	-153.3	-175	-53.2	-84.7	-13.3	111.4	V96 F365 D400 L417 L418 R424 I425	V96-R421 HydrophobicContact CG1-CB 4.29Å; V96-R421 HydrophobicContact CG1-CG 4.05Å; V96-R421 HydrophobicContact CG2-CG 4.26Å; F365-R421 HydrophobicContact CZ-CG 4.44Å; D400-R421 IonicContact OD1-NH2 2.72Å; D400-R421 PolarHBondContact OD1-NH2 3.3Å; D400-R421 IonicContact OD2-CZ 2.68Å; D400-R421 IonicContact OD2-NH1 3.66Å; D400-R421 PolarHBondContact OD2-NH1 3.33Å; D400-R421 VanDerWaalsContact OD2-NH1 3.16Å; D400-R421 IonicContact OD2-NH2 3.39Å; D400-R421 PolarHBondContact OD2-NH2 3.08Å; L417-R421 PolarHBondContact O-N 3.4Å; L418-R421 VanDerWaalsContact O-CB 3.3Å; L418-R421 WeakPolarHBondContact O-CB 3.4Å; L418-R421 PolarHBondContact O-N 2.98Å; L418-R421 VanDerWaalsContact O-N 3.13Å; R421-R424 PolarHBondContact O-N 3.15Å; R421-I425 WeakPolarHBondContact O-CD1 3.44Å; R421-I425 VanDerWaalsContact O-CG1 3.31Å; R421-I425 WeakPolarHBondContact O-CG1 3.22Å; R421-I425 PolarHBondContact O-N 3.42Å; R421-I425 VanDerWaalsContact O-N 3.12Å
422	I	71.9	Confident	69.3	Low	52 Å²	52	59 Å²	59	27%	0.267	32%	0.32	S	S	.	.	H	α-helix	trans	-64.4	-48.9	176	-62	169.4	0	0	0	111.4	V96 L418 L419 W420 R424 I425 I426	V96-I422 HydrophobicContact CG1-CG1 4.32Å; L418-I422 PolarHBondContact O-N 3.27Å; L419-I422 WeakPolarHBondContact O-CB 3.32Å; L419-I422 PolarHBondContact O-N 2.85Å; W420-I422 PolarHBondContact O-N 3.24Å; I422-R424 VanDerWaalsContact C-N 3.29Å; I422-R424 PolarHBondContact O-N 3.09Å; I422-I425 PolarHBondContact O-N 2.97Å; I422-I425 VanDerWaalsContact O-N 3.14Å; I422-I426 HydrophobicContact CG2-CD1 3.89Å; I422-I426 WeakPolarHBondContact O-CG1 3.4Å; I422-I426 PolarHBondContact O-N 3.4Å
423	I	73.2	Confident	69.3	Low	78 Å²	78	62.1 Å²	62.1	40%	0.4	32%	0.323	S	S	.	.	H	α-helix	trans	-57.6	-42.8	178	-65.3	166.7	0	0	0	111	L419 W420 I425 I426 N427	L419-I423 WeakPolarHBondContact O-CG1 3.29Å; L419-I423 PolarHBondContact O-N 2.95Å; L419-I423 VanDerWaalsContact O-N 3.15Å; W420-I423 HydrophobicContact CE3-CD1 4.33Å; W420-I423 PolarHBondContact O-N 3.06Å; W420-I423 VanDerWaalsContact O-N 3.12Å; I423-I425 PolarHBondContact O-N 2.89Å; I423-I426 PolarHBondContact O-N 2.99Å; I423-N427 PolarHBondContact O-N 3.1Å; I423-N427 PolarHBondContact O-ND2 3.04Å
424	R	71.6	Confident	69.8	Low	38 Å²	38	64.9 Å²	64.9	14%	0.143	33%	0.327	C	S	.	.	H	α-helix	trans	-62.6	-40.2	177.9	-62.6	-75.1	-68.5	137.4	14	111.9	D389 W420 R421 I422 N427 A428	D389-R424 PolarHBondContact O-NH2 3.32Å; D389-R424 IonicContact OD1-CZ 2.89Å; D389-R424 IonicContact OD1-NH1 2.72Å; D389-R424 PolarHBondContact OD1-NH1 3.17Å; D389-R424 IonicContact OD1-NH2 2.66Å; D389-R424 PolarHBondContact OD1-NH2 3.46Å; D389-R424 IonicContact OD2-CZ 2.7Å; D389-R424 IonicContact OD2-NH1 2.75Å; D389-R424 IonicContact OD2-NH2 3.88Å; D389-R424 PolarHBondContact OD2-NH2 3.37Å; W420-R424 HydrophobicContact CD2-CG 4.35Å; W420-R424 HydrophobicContact CG-CG 4.29Å; W420-R424 WeakPolarHBondContact O-CG 3.39Å; W420-R424 PolarHBondContact O-N 3.49Å; R421-R424 PolarHBondContact O-N 3.15Å; I422-R424 VanDerWaalsContact C-N 3.29Å; I422-R424 PolarHBondContact O-N 3.09Å; R424-N427 PolarHBondContact O-N 3.47Å; R424-A428 PolarHBondContact O-N 2.68Å
425	I	70.3	Confident	69.7	Low	27 Å²	27	66.3 Å²	66.3	14%	0.138	33%	0.334	C	S	.	.	H	α-helix	trans	-67	-42.9	175.9	-69.2	163.7	0	0	0	111.6	V96 R421 I422 I423 N427 A428 L429	V96-I425 HydrophobicContact CB-CD1 3.74Å; V96-I425 HydrophobicContact CG1-CD1 3.72Å; V96-I425 HydrophobicContact CG2-CD1 3.81Å; R421-I425 WeakPolarHBondContact O-CD1 3.44Å; R421-I425 VanDerWaalsContact O-CG1 3.31Å; R421-I425 WeakPolarHBondContact O-CG1 3.22Å; R421-I425 PolarHBondContact O-N 3.42Å; R421-I425 VanDerWaalsContact O-N 3.12Å; I422-I425 PolarHBondContact O-N 2.97Å; I422-I425 VanDerWaalsContact O-N 3.14Å; I423-I425 PolarHBondContact O-N 2.89Å; I425-N427 VanDerWaalsContact C-N 3.34Å; I425-N427 PolarHBondContact O-N 3.34Å; I425-A428 PolarHBondContact O-N 3.37Å; I425-L429 HydrophobicContact CG2-CD1 3.96Å; I425-L429 WeakPolarHBondContact O-CG 3.33Å; I425-L429 PolarHBondContact O-N 3.3Å
426	I	74.3	Confident	69.6	Low	95 Å²	95	65.4 Å²	65.4	49%	0.487	33%	0.325	S	S	.	.	H	α-helix	trans	-60.1	-44.9	175.5	-67.7	168	0	0	0	110.5	I422 I423 A428 L429 M430	I422-I426 HydrophobicContact CG2-CD1 3.89Å; I422-I426 WeakPolarHBondContact O-CG1 3.4Å; I422-I426 PolarHBondContact O-N 3.4Å; I423-I426 PolarHBondContact O-N 2.99Å; I426-A428 PolarHBondContact O-N 3.06Å; I426-L429 PolarHBondContact O-N 3.16Å; I426-M430 WeakPolarHBondContact O-CB 3.22Å; I426-M430 PolarHBondContact O-N 3.11Å
427	N	70	Confident	69.7	Low	71 Å²	71	66.3 Å²	66.3	38%	0.38	32%	0.319	S	S	.	.	H	α-helix	trans	-62.4	-41.1	176.3	-74.5	-23.6	0	0	0	112.4	I423 R424 I425 L429 M430 M431	I423-N427 PolarHBondContact O-N 3.1Å; I423-N427 PolarHBondContact O-ND2 3.04Å; R424-N427 PolarHBondContact O-N 3.47Å; I425-N427 VanDerWaalsContact C-N 3.34Å; I425-N427 PolarHBondContact O-N 3.34Å; N427-L429 PolarHBondContact O-N 3.1Å; N427-M430 PolarHBondContact O-N 3.2Å; N427-M431 WeakPolarHBondContact O-CB 3.5Å; N427-M431 PolarHBondContact O-N 2.85Å
428	A	68.6	Low	70	Confident	50 Å²	50	69.6 Å²	69.6	41%	0.413	33%	0.334	S	S	.	.	H	α-helix	trans	-66	-35.5	175.1	0	0	0	0	0	113.1	Q89 R424 I425 I426 H432	Q89-A428 VanDerWaalsContact NE2-C 3.27Å; Q89-A428 PolarHBondContact NE2-O 3.44Å; R424-A428 PolarHBondContact O-N 2.68Å; I425-A428 PolarHBondContact O-N 3.37Å; I426-A428 PolarHBondContact O-N 3.06Å; A428-H432 PolarHBondContact O-N 3.03Å
429	L	67.1	Low	70	Confident	63 Å²	63	69.8 Å²	69.8	33%	0.33	33%	0.334	S	S	.	.	H	α-helix	trans	-68.4	-44.3	173.1	-77.8	163.6	0	0	0	111.3	Q89 I425 I426 N427 H432 K433	Q89-L429 HydrophobicContact CG-CD2 3.8Å; Q89-L429 HydrophobicContact CG-CG 4.32Å; I425-L429 HydrophobicContact CG2-CD1 3.96Å; I425-L429 WeakPolarHBondContact O-CG 3.33Å; I425-L429 PolarHBondContact O-N 3.3Å; I426-L429 PolarHBondContact O-N 3.16Å; N427-L429 PolarHBondContact O-N 3.1Å; L429-H432 PolarHBondContact O-N 2.71Å; L429-K433 PolarHBondContact O-N 3.07Å
430	M	70.3	Confident	69.9	Low	93 Å²	93	68.5 Å²	68.5	46%	0.458	32%	0.322	S	S	.	.	H	α-helix	trans	-62.9	-42.4	177.2	-177.8	171.2	62.8	0	0	111.7	I426 N427 H432 K433 K434	I426-M430 WeakPolarHBondContact O-CB 3.22Å; I426-M430 PolarHBondContact O-N 3.11Å; N427-M430 PolarHBondContact O-N 3.2Å; M430-H432 VanDerWaalsContact C-N 3.35Å; M430-H432 PolarHBondContact O-N 3.34Å; M430-K433 CarbonylContact O-C 3.59Å; M430-K433 WeakPolarHBondContact O-CB 3.35Å; M430-K433 PolarHBondContact O-N 3.01Å; M430-K433 VanDerWaalsContact O-N 3.15Å; M430-K434 PolarHBondContact O-N 3.12Å
431	M	69.2	Low	69.8	Low	100 Å²	100	66.5 Å²	66.5	49%	0.493	32%	0.319	S	S	.	.	H	α-helix	trans	-63.1	-40	176.7	-174.9	54.3	161.8	0	0	111.9	N427 K433 K434 Q435	N427-M431 WeakPolarHBondContact O-CB 3.5Å; N427-M431 PolarHBondContact O-N 2.85Å; M431-K433 VanDerWaalsContact C-N 3.33Å; M431-K433 PolarHBondContact O-N 3.34Å; M431-K434 PolarHBondContact O-N 3.15Å; M431-K434 HydrophobicContact SD-CD 4.39Å; M431-Q435 WeakPolarHBondContact O-CG 3.18Å; M431-Q435 PolarHBondContact O-N 3.27Å
432	H	64.2	Low	70.1	Confident	27 Å²	27	67 Å²	67	13%	0.125	33%	0.328	C	S	.	.	H	α-helix	trans	-64.5	-36.2	173.6	-178.2	-141.6	0	0	0	112.4	N86 A428 L429 M430 Q436	N86-H432 PolarHBondContact OD1-CE1 3.39Å; N86-H432 VanDerWaalsContact OD1-CE1 3.25Å; A428-H432 PolarHBondContact O-N 3.03Å; L429-H432 PolarHBondContact O-N 2.71Å; M430-H432 VanDerWaalsContact C-N 3.35Å; M430-H432 PolarHBondContact O-N 3.34Å; H432-Q436 PolarHBondContact CE1-NE2 2.98Å; H432-Q436 VanDerWaalsContact CE1-NE2 3.27Å; H432-Q436 PolarHBondContact NE2-NE2 3.04Å; H432-Q436 WeakPolarHBondContact O-CG 3.43Å; H432-Q436 PolarHBondContact O-N 3.23Å
433	K	66.9	Low	70.1	Confident	119 Å²	119	64.8 Å²	64.8	52%	0.517	32%	0.317	S	S	.	.	H	α-helix	trans	-67.8	-42.4	171.8	-70.9	-67.6	-176.3	178.6	0	112.7	L429 M430 M431 Q435 Q436 Y437	L429-K433 PolarHBondContact O-N 3.07Å; M430-K433 CarbonylContact O-C 3.59Å; M430-K433 WeakPolarHBondContact O-CB 3.35Å; M430-K433 PolarHBondContact O-N 3.01Å; M430-K433 VanDerWaalsContact O-N 3.15Å; M431-K433 VanDerWaalsContact C-N 3.33Å; M431-K433 PolarHBondContact O-N 3.34Å; K433-Q435 VanDerWaalsContact C-N 3.33Å; K433-Q435 PolarHBondContact O-N 2.95Å; K433-Q436 WeakPolarHBondContact O-CB 3.24Å; K433-Q436 PolarHBondContact O-N 3.47Å; K433-Q436 VanDerWaalsContact O-N 3.11Å; K433-Y437 VanDerWaalsContact O-CD2 3.26Å; K433-Y437 WeakPolarHBondContact O-CD2 3.36Å; K433-Y437 PolarHBondContact O-N 2.87Å
434	K	73	Confident	69.8	Low	103 Å²	103	64.3 Å²	64.3	45%	0.448	31%	0.313	S	S	.	.	H	α-helix	trans	-56.2	-47.8	175	-174.2	177.9	178.8	-178.6	0	110.7	M430 M431 Q436 Y437 E438	M430-K434 PolarHBondContact O-N 3.12Å; M431-K434 PolarHBondContact O-N 3.15Å; M431-K434 HydrophobicContact SD-CD 4.39Å; K434-Q436 VanDerWaalsContact C-N 3.27Å; K434-Q436 PolarHBondContact O-N 3.45Å; K434-Y437 PolarHBondContact O-N 2.72Å; K434-E438 WeakPolarHBondContact CE-OE1 3.17Å; K434-E438 HydrophobicContact CG-CG 4.12Å; K434-E438 WeakPolarHBondContact O-CG 3.3Å; K434-E438 PolarHBondContact O-N 3.26Å
435	Q	63.1	Low	70	Confident	47 Å²	47	68.1 Å²	68.1	22%	0.22	33%	0.331	C	S	.	.	H	α-helix	trans	-56.6	-36.3	176.3	-72.9	169.2	-2.8	0	0	113.2	M431 K433 F439	M431-Q435 WeakPolarHBondContact O-CG 3.18Å; M431-Q435 PolarHBondContact O-N 3.27Å; K433-Q435 VanDerWaalsContact C-N 3.33Å; K433-Q435 PolarHBondContact O-N 2.95Å; Q435-F439 WeakPolarHBondContact O-CB 3.32Å; Q435-F439 PolarHBondContact O-N 3.23Å; Q435-F439 VanDerWaalsContact O-N 3.14Å
436	Q	65.7	Low	70	Confident	43 Å²	43	70 Å²	70	20%	0.201	34%	0.336	C	S	.	.	H	α-helix	trans	-68.7	-35.4	175.1	-68.4	174	7.7	0	0	112.6	H432 K433 K434 R440	H432-Q436 PolarHBondContact CE1-NE2 2.98Å; H432-Q436 VanDerWaalsContact CE1-NE2 3.27Å; H432-Q436 PolarHBondContact NE2-NE2 3.04Å; H432-Q436 WeakPolarHBondContact O-CG 3.43Å; H432-Q436 PolarHBondContact O-N 3.23Å; K433-Q436 WeakPolarHBondContact O-CB 3.24Å; K433-Q436 PolarHBondContact O-N 3.47Å; K433-Q436 VanDerWaalsContact O-N 3.11Å; K434-Q436 VanDerWaalsContact C-N 3.27Å; K434-Q436 PolarHBondContact O-N 3.45Å; Q436-R440 WeakPolarHBondContact O-CG 3.42Å; Q436-R440 PolarHBondContact O-N 3.36Å
437	Y	70.2	Confident	69.6	Low	115 Å²	115	66.8 Å²	66.8	45%	0.451	32%	0.322	S	S	.	.	H	α-helix	trans	-74.3	-46.9	175.9	-71.5	-62.4	0	0	0	112.6	K433 K434 F439 R440 I441	K433-Y437 VanDerWaalsContact O-CD2 3.26Å; K433-Y437 WeakPolarHBondContact O-CD2 3.36Å; K433-Y437 PolarHBondContact O-N 2.87Å; K434-Y437 PolarHBondContact O-N 2.72Å; Y437-F439 VanDerWaalsContact C-N 3.28Å; Y437-F439 PolarHBondContact O-N 3.21Å; Y437-R440 WeakPolarHBondContact O-CB 3.25Å; Y437-R440 PolarHBondContact O-N 2.68Å; Y437-R440 VanDerWaalsContact O-N 3.08Å; Y437-I441 WeakPolarHBondContact O-CG1 3.3Å; Y437-I441 PolarHBondContact O-N 3.33Å
438	E	72.3	Confident	69.7	Low	98 Å²	98	72.6 Å²	72.6	46%	0.458	34%	0.338	S	S	.	.	H	α-helix	trans	-57.4	-42.1	177.2	-64.2	-64.1	176.3	0	0	111.2	K434 R440 I441 A442	K434-E438 WeakPolarHBondContact CE-OE1 3.17Å; K434-E438 HydrophobicContact CG-CG 4.12Å; K434-E438 WeakPolarHBondContact O-CG 3.3Å; K434-E438 PolarHBondContact O-N 3.26Å; E438-R440 PolarHBondContact O-N 2.67Å; E438-I441 PolarHBondContact O-N 3Å; E438-A442 WeakPolarHBondContact O-CB 3.4Å; E438-A442 PolarHBondContact O-N 3.37Å
439	F	70.3	Confident	70	Confident	19 Å²	19	76.7 Å²	76.7	8%	0.083	34%	0.343	C	S	.	.	H	α-helix	trans	-63.4	-40.3	175.7	-174.2	-93.2	0	0	0	113.1	Y37 W39 Q435 Y437 A442 M443	Y37-F439 HydrophobicContact CD1-CZ 4.33Å; Y37-F439 HydrophobicContact CE1-CD2 4.39Å; Y37-F439 AromaticContact CE1-CE2 3.56Å; Y37-F439 HydrophobicContact CE1-CE2 3.56Å; Y37-F439 AromaticContact CE1-CZ 3.63Å; Y37-F439 HydrophobicContact CE1-CZ 3.63Å; W39-F439 HydrophobicContact CH2-CB 4.06Å; W39-F439 AromaticContact CH2-CD1 3.46Å; W39-F439 HydrophobicContact CH2-CD1 3.46Å; W39-F439 VanDerWaalsContact CH2-CD1 3.46Å; W39-F439 HydrophobicContact CH2-CE1 4.08Å; W39-F439 AromaticContact CH2-CG 3.87Å; W39-F439 HydrophobicContact CH2-CG 3.87Å; W39-F439 HydrophobicContact CZ2-CB 4.49Å; W39-F439 HydrophobicContact CZ2-CD1 4.23Å; W39-F439 HydrophobicContact CZ2-CG 4.3Å; W39-F439 HydrophobicContact CZ3-CD1 4.29Å; Q435-F439 WeakPolarHBondContact O-CB 3.32Å; Q435-F439 PolarHBondContact O-N 3.23Å; Q435-F439 VanDerWaalsContact O-N 3.14Å; Y437-F439 VanDerWaalsContact C-N 3.28Å; Y437-F439 PolarHBondContact O-N 3.21Å; F439-A442 PolarHBondContact O-N 3.16Å; F439-M443 HydrophobicContact CD1-CG 4.13Å; F439-M443 HydrophobicContact CE1-CE 4.19Å; F439-M443 HydrophobicContact CE1-CG 3.65Å; F439-M443 HydrophobicContact CE2-CE 4.07Å; F439-M443 HydrophobicContact CE2-CG 4.45Å; F439-M443 HydrophobicContact CZ-CE 3.49Å; F439-M443 VanDerWaalsContact CZ-CE 3.49Å; F439-M443 HydrophobicContact CZ-CG 3.84Å; F439-M443 WeakPolarHBondContact O-CB 3.43Å; F439-M443 PolarHBondContact O-N 3.31Å
440	R	69.5	Low	70.3	Confident	70 Å²	70	76.3 Å²	76.3	26%	0.264	34%	0.341	S	S	.	.	H	α-helix	trans	-62.6	-43.4	174.4	-77.1	-177.9	70.8	-150	1.4	111.4	F45 D52 Q436 Y437 E438 M443 Q444	F45-R440 HydrophobicContact CE2-CG 3.9Å; F45-R440 HydrophobicContact CZ-CG 4.49Å; D52-R440 IonicContact OD1-NH2 2.96Å; D52-R440 IonicContact OD2-CZ 3.32Å; D52-R440 IonicContact OD2-NE 3.18Å; D52-R440 IonicContact OD2-NH2 2.77Å; D52-R440 PolarHBondContact OD2-NH2 3.39Å; Q436-R440 WeakPolarHBondContact O-CG 3.42Å; Q436-R440 PolarHBondContact O-N 3.36Å; Y437-R440 WeakPolarHBondContact O-CB 3.25Å; Y437-R440 PolarHBondContact O-N 2.68Å; Y437-R440 VanDerWaalsContact O-N 3.08Å; E438-R440 PolarHBondContact O-N 2.67Å; R440-M443 PolarHBondContact O-N 3.08Å; R440-Q444 WeakPolarHBondContact O-CG 3.26Å; R440-Q444 PolarHBondContact O-N 3.25Å
441	I	75.1	Confident	70.2	Confident	63 Å²	63	77.4 Å²	77.4	32%	0.323	35%	0.348	S	S	.	.	H	α-helix	trans	-64.7	-43.5	177.8	-66.6	165.4	0	0	0	110.3	Y437 E438 M443 Q444 K445	Y437-I441 WeakPolarHBondContact O-CG1 3.3Å; Y437-I441 PolarHBondContact O-N 3.33Å; E438-I441 PolarHBondContact O-N 3Å; I441-M443 PolarHBondContact O-N 3.41Å; I441-Q444 PolarHBondContact O-N 3.29Å; I441-K445 HydrophobicContact CG2-CD 3.99Å; I441-K445 HydrophobicContact CG2-CG 4.48Å; I441-K445 WeakPolarHBondContact O-CB 3.39Å; I441-K445 VanDerWaalsContact O-CG 3.28Å; I441-K445 WeakPolarHBondContact O-CG 3.42Å; I441-K445 PolarHBondContact O-N 2.88Å
442	A	75.8	Confident	70.5	Confident	35 Å²	35	74.6 Å²	74.6	29%	0.289	34%	0.344	S	S	.	.	H	α-helix	trans	-61	-43.2	175.3	0	0	0	0	0	112.1	E438 F439 K445 R446	E438-A442 WeakPolarHBondContact O-CB 3.4Å; E438-A442 PolarHBondContact O-N 3.37Å; F439-A442 PolarHBondContact O-N 3.16Å; A442-K445 PolarHBondContact O-N 2.92Å; A442-R446 WeakPolarHBondContact O-CB 3.21Å; A442-R446 WeakPolarHBondContact O-CG 3.39Å; A442-R446 PolarHBondContact O-N 2.91Å
443	M	70.9	Confident	71	Confident	6 Å²	6	81.9 Å²	81.9	3%	0.03	37%	0.371	C	S	.	.	H	α-helix	trans	-65.7	-42.7	175.9	-83.5	-66.9	172	0	0	112.9	E62 F439 R440 I441 K445 R446 S447	E62-M443 HydrophobicContact CB-CE 3.84Å; E62-M443 HydrophobicContact CG-CE 3.64Å; E62-M443 WeakPolarHBondContact OE2-CE 3.41Å; F439-M443 HydrophobicContact CD1-CG 4.13Å; F439-M443 HydrophobicContact CE1-CE 4.19Å; F439-M443 HydrophobicContact CE1-CG 3.65Å; F439-M443 HydrophobicContact CE2-CE 4.07Å; F439-M443 HydrophobicContact CE2-CG 4.45Å; F439-M443 HydrophobicContact CZ-CE 3.49Å; F439-M443 VanDerWaalsContact CZ-CE 3.49Å; F439-M443 HydrophobicContact CZ-CG 3.84Å; F439-M443 WeakPolarHBondContact O-CB 3.43Å; F439-M443 PolarHBondContact O-N 3.31Å; R440-M443 PolarHBondContact O-N 3.08Å; I441-M443 PolarHBondContact O-N 3.41Å; M443-K445 PolarHBondContact O-N 3.16Å; M443-R446 PolarHBondContact O-N 3.47Å; M443-S447 WeakPolarHBondContact O-CB 3.45Å; M443-S447 PolarHBondContact O-N 3.39Å
444	Q	66.9	Low	71.4	Confident	68 Å²	68	81 Å²	81	32%	0.318	37%	0.367	S	S	.	.	H	α-helix	trans	-63.7	-39.9	174	-72.7	177.5	-4.8	0	0	111.7	D52 I54 R440 I441 R448	D52-Q444 PolarHBondContact OD2-NE2 3.47Å; I54-Q444 HydrophobicContact CD1-CG 3.88Å; R440-Q444 WeakPolarHBondContact O-CG 3.26Å; R440-Q444 PolarHBondContact O-N 3.25Å; I441-Q444 PolarHBondContact O-N 3.29Å; Q444-R448 WeakPolarHBondContact O-CG 3.34Å; Q444-R448 PolarHBondContact O-N 3.04Å
445	K	76.6	Confident	71.4	Confident	119 Å²	119	82.1 Å²	82.1	52%	0.517	38%	0.376	S	S	.	.	H	α-helix	trans	-62.5	-45.8	172.5	-74.3	172.4	178.6	176.6	0	111.7	I441 A442 M443 R448 R449	I441-K445 HydrophobicContact CG2-CD 3.99Å; I441-K445 HydrophobicContact CG2-CG 4.48Å; I441-K445 WeakPolarHBondContact O-CB 3.39Å; I441-K445 VanDerWaalsContact O-CG 3.28Å; I441-K445 WeakPolarHBondContact O-CG 3.42Å; I441-K445 PolarHBondContact O-N 2.88Å; A442-K445 PolarHBondContact O-N 2.92Å; M443-K445 PolarHBondContact O-N 3.16Å; K445-R448 PolarHBondContact O-N 3.41Å; K445-R449 WeakPolarHBondContact O-CG 3.45Å; K445-R449 PolarHBondContact O-N 3.18Å
446	R	70.9	Confident	72.1	Confident	65 Å²	65	84.7 Å²	84.7	25%	0.245	39%	0.387	C	S	.	.	H	α-helix	trans	-63.5	-44.2	177.1	-75.2	-178.2	-179.2	-161.7	0.2	111.9	E62 A442 M443 R448 R449 I450	E62-R446 IonicContact OE1-NH1 3.68Å; E62-R446 PolarHBondContact OE1-NH1 3.06Å; E62-R446 IonicContact OE2-CZ 3.98Å; E62-R446 IonicContact OE2-NH1 3.65Å; E62-R446 PolarHBondContact OE2-NH1 3.02Å; A442-R446 WeakPolarHBondContact O-CB 3.21Å; A442-R446 WeakPolarHBondContact O-CG 3.39Å; A442-R446 PolarHBondContact O-N 2.91Å; M443-R446 PolarHBondContact O-N 3.47Å; R446-R448 PolarHBondContact O-N 3.45Å; R446-R449 PolarHBondContact O-N 2.79Å; R446-I450 WeakPolarHBondContact O-CG1 3.31Å; R446-I450 PolarHBondContact O-N 2.94Å
447	S	65.2	Low	72.9	Confident	28 Å²	28	87 Å²	87	20%	0.196	41%	0.405	C	S	.	.	H	α-helix	trans	-58.4	-47.3	174.8	-178.4	0	0	0	0	112.1	M443 R449 I450 L451	M443-S447 WeakPolarHBondContact O-CB 3.45Å; M443-S447 PolarHBondContact O-N 3.39Å; S447-R449 PolarHBondContact O-N 3.22Å; S447-I450 PolarHBondContact O-N 3.17Å; S447-L451 PolarHBondContact O-N 3.1Å
448	R	71.7	Confident	73.3	Confident	193 Å²	193	86.7 Å²	86.7	73%	0.728	41%	0.409	S	S	*	.	H	α-helix	trans	-59.6	-40.9	174.5	-72.7	173.9	-176.2	-110.6	4.3	113.1	Q444 K445 R446 I450 L451 G452	Q444-R448 WeakPolarHBondContact O-CG 3.34Å; Q444-R448 PolarHBondContact O-N 3.04Å; K445-R448 PolarHBondContact O-N 3.41Å; R446-R448 PolarHBondContact O-N 3.45Å; R448-I450 PolarHBondContact O-N 3.42Å; R448-L451 PolarHBondContact O-N 3.02Å; R448-G452 PolarHBondContact O-N 3.14Å
449	R	75.1	Confident	73.9	Confident	136 Å²	136	88.3 Å²	88.3	51%	0.513	41%	0.411	S	S	.	.	H	α-helix	trans	-61.3	-42.2	174.3	-68.8	172.6	-170	173.8	0.4	112.2	K445 R446 S447 G452 R453	K445-R449 WeakPolarHBondContact O-CG 3.45Å; K445-R449 PolarHBondContact O-N 3.18Å; R446-R449 PolarHBondContact O-N 2.79Å; S447-R449 PolarHBondContact O-N 3.22Å; R449-G452 PolarHBondContact O-N 3.02Å; R449-R453 WeakPolarHBondContact O-CG 3.49Å; R449-R453 PolarHBondContact O-N 2.97Å
450	I	74.5	Confident	74.5	Confident	56 Å²	56	90 Å²	90	29%	0.287	42%	0.423	S	S	.	.	H	α-helix	trans	-67.7	-41.5	178.9	-67.9	165.9	0	0	0	110.8	L58 R446 S447 R448 R453 K454	L58-I450 HydrophobicContact CD1-CD1 3.51Å; L58-I450 HydrophobicContact CD2-CD1 3.92Å; L58-I450 HydrophobicContact CG-CD1 4.38Å; R446-I450 WeakPolarHBondContact O-CG1 3.31Å; R446-I450 PolarHBondContact O-N 2.94Å; S447-I450 PolarHBondContact O-N 3.17Å; R448-I450 PolarHBondContact O-N 3.42Å; I450-R453 PolarHBondContact O-N 3.4Å; I450-K454 HydrophobicContact CG2-CD 4.28Å; I450-K454 WeakPolarHBondContact O-CG 3.33Å; I450-K454 PolarHBondContact O-N 2.89Å
451	L	67.6	Low	75.1	Confident	116 Å²	116	89.3 Å²	89.3	61%	0.607	42%	0.423	S	S	*	.	H	α-helix	trans	-64.8	-40.4	174.8	-174.8	60.4	0	0	0	111.9	S447 R448 K454 M455	S447-L451 PolarHBondContact O-N 3.1Å; R448-L451 PolarHBondContact O-N 3.02Å; L451-K454 PolarHBondContact O-N 3.39Å; L451-M455 WeakPolarHBondContact O-CB 3.17Å; L451-M455 PolarHBondContact O-N 2.96Å
452	G	75.3	Confident	75.3	Confident	40 Å²	40	92 Å²	92	41%	0.412	43%	0.432	S	S	.	.	H	α-helix	trans	-60.2	-46	173.6	0	0	0	0	0	112.9	R448 R449 K454 M455 E456	R448-G452 PolarHBondContact O-N 3.14Å; R449-G452 PolarHBondContact O-N 3.02Å; G452-K454 PolarHBondContact O-N 3.42Å; G452-M455 WeakPolarHBondContact O-CB 3.3Å; G452-M455 PolarHBondContact O-N 3.34Å; G452-E456 PolarHBondContact O-N 2.87Å
453	R	75	Confident	75.8	Confident	181 Å²	181	93.7 Å²	93.7	68%	0.683	43%	0.434	S	S	*	.	H	α-helix	trans	-61.6	-42.4	173.9	-71.8	177.1	-176.6	156.3	-3	112.6	R449 I450 M455 E456 V457	R449-R453 WeakPolarHBondContact O-CG 3.49Å; R449-R453 PolarHBondContact O-N 2.97Å; I450-R453 PolarHBondContact O-N 3.4Å; R453-M455 VanDerWaalsContact C-N 3.32Å; R453-M455 PolarHBondContact O-N 3.34Å; R453-E456 PolarHBondContact O-N 3.09Å; R453-V457 WeakPolarHBondContact O-CG2 3.5Å; R453-V457 PolarHBondContact O-N 3.32Å
454	K	76	Confident	76.4	Confident	101 Å²	101	98.8 Å²	98.8	44%	0.439	46%	0.46	S	S	.	.	H	α-helix	trans	-60.3	-41.8	174.4	-74.4	170.4	176.9	174.9	0	111.3	D55 I450 L451 G452 I458	D55-K454 IonicContact OD2-NZ 3.56Å; I450-K454 HydrophobicContact CG2-CD 4.28Å; I450-K454 WeakPolarHBondContact O-CG 3.33Å; I450-K454 PolarHBondContact O-N 2.89Å; L451-K454 PolarHBondContact O-N 3.39Å; G452-K454 PolarHBondContact O-N 3.42Å; K454-I458 WeakPolarHBondContact O-CD1 3.49Å; K454-I458 VanDerWaalsContact O-CG1 3.28Å; K454-I458 WeakPolarHBondContact O-CG1 3.44Å; K454-I458 PolarHBondContact O-N 3.49Å
455	M	71.2	Confident	77.1	Confident	126 Å²	126	99.9 Å²	99.9	62%	0.621	46%	0.464	S	S	*	.	H	α-helix	trans	-62.9	-41.8	175.8	-172.2	66.4	-171.2	0	0	111.7	L451 G452 R453 I458 R459	L451-M455 WeakPolarHBondContact O-CB 3.17Å; L451-M455 PolarHBondContact O-N 2.96Å; G452-M455 WeakPolarHBondContact O-CB 3.3Å; G452-M455 PolarHBondContact O-N 3.34Å; R453-M455 VanDerWaalsContact C-N 3.32Å; R453-M455 PolarHBondContact O-N 3.34Å; M455-I458 PolarHBondContact O-N 2.85Å; M455-R459 VanDerWaalsContact O-CB 3.25Å; M455-R459 WeakPolarHBondContact O-CB 3.44Å; M455-R459 PolarHBondContact O-N 2.95Å
456	E	79.2	Confident	77.5	Confident	100 Å²	100	97.2 Å²	97.2	47%	0.467	46%	0.456	S	S	.	.	H	α-helix	trans	-71.9	-34	-180	-161.8	56.7	-147	0	0	113.1	G452 R453 R459 T460	G452-E456 PolarHBondContact O-N 2.87Å; R453-E456 PolarHBondContact O-N 3.09Å; E456-R459 PolarHBondContact O-N 3.39Å; E456-T460 WeakPolarHBondContact O-CB 3.35Å; E456-T460 WeakPolarHBondContact O-CG2 3.44Å; E456-T460 PolarHBondContact O-N 2.78Å; E456-T460 PolarHBondContact O-OG1 3.37Å
457	V	81.1	Confident	78.3	Confident	93 Å²	93	100.5 Å²	100.5	56%	0.564	47%	0.472	S	S	*	.	H	α-helix	trans	-64.8	-46.8	170.5	172.1	0	0	0	0	110.9	R453 R459 T460 E461	R453-V457 WeakPolarHBondContact O-CG2 3.5Å; R453-V457 PolarHBondContact O-N 3.32Å; V457-R459 VanDerWaalsContact C-N 3.26Å; V457-R459 PolarHBondContact O-N 2.76Å; V457-T460 WeakPolarHBondContact CA-OG1 3.44Å; V457-T460 PolarHBondContact O-N 3.03Å; V457-T460 PolarHBondContact O-OG1 2.93Å; V457-T460 VanDerWaalsContact O-OG1 3.13Å; V457-E461 WeakPolarHBondContact O-CB 3.47Å; V457-E461 PolarHBondContact O-N 3.21Å
458	I	80	Confident	79.3	Confident	107 Å²	107	105.8 Å²	105.8	55%	0.549	49%	0.493	S	S	.	.	H	α-helix	trans	-63.6	-35.1	175.8	-68.2	166.2	0	0	0	111.1	K454 M455 K462	K454-I458 WeakPolarHBondContact O-CD1 3.49Å; K454-I458 VanDerWaalsContact O-CG1 3.28Å; K454-I458 WeakPolarHBondContact O-CG1 3.44Å; K454-I458 PolarHBondContact O-N 3.49Å; M455-I458 PolarHBondContact O-N 2.85Å; I458-K462 VanDerWaalsContact O-CB 3.3Å; I458-K462 WeakPolarHBondContact O-CB 3.4Å; I458-K462 PolarHBondContact O-N 3.4Å
459	R	83.5	Confident	79.8	Confident	133 Å²	133	99.9 Å²	99.9	50%	0.502	48%	0.475	S	S	.	.	H	α-helix	trans	-65.5	-51.9	175.7	-175.8	-173.2	178.7	117.3	16.7	111.5	M455 E456 V457 K462 E463	M455-R459 VanDerWaalsContact O-CB 3.25Å; M455-R459 WeakPolarHBondContact O-CB 3.44Å; M455-R459 PolarHBondContact O-N 2.95Å; E456-R459 PolarHBondContact O-N 3.39Å; V457-R459 VanDerWaalsContact C-N 3.26Å; V457-R459 PolarHBondContact O-N 2.76Å; R459-K462 WeakPolarHBondContact O-CB 3.42Å; R459-K462 PolarHBondContact O-N 2.93Å; R459-E463 IonicContact CZ-OE1 2.86Å; R459-E463 VanDerWaalsContact CZ-OE1 3.32Å; R459-E463 IonicContact NE-OE1 2.74Å; R459-E463 PolarHBondContact NE-OE1 3.3Å; R459-E463 IonicContact NH2-OE1 3.82Å; R459-E463 PolarHBondContact NH2-OE1 3.4Å; R459-E463 WeakPolarHBondContact O-CG 3.25Å; R459-E463 PolarHBondContact O-N 3.13Å
460	T	83.2	Confident	80.3	Confident	55 Å²	55	98 Å²	98	34%	0.337	48%	0.475	S	S	.	.	H	α-helix	trans	-66.5	-37.7	-179.4	46.7	0	0	0	0	111.8	E456 V457 E463 M464	E456-T460 WeakPolarHBondContact O-CB 3.35Å; E456-T460 WeakPolarHBondContact O-CG2 3.44Å; E456-T460 PolarHBondContact O-N 2.78Å; E456-T460 PolarHBondContact O-OG1 3.37Å; V457-T460 WeakPolarHBondContact CA-OG1 3.44Å; V457-T460 PolarHBondContact O-N 3.03Å; V457-T460 PolarHBondContact O-OG1 2.93Å; V457-T460 VanDerWaalsContact O-OG1 3.13Å; T460-E463 PolarHBondContact O-N 3.39Å; T460-M464 VanDerWaalsContact O-CG 3.31Å; T460-M464 WeakPolarHBondContact O-CG 3.39Å; T460-M464 PolarHBondContact O-N 2.89Å
461	E	82.4	Confident	80.8	Confident	55 Å²	55	97.8 Å²	97.8	26%	0.257	48%	0.482	S	S	.	.	H	α-helix	trans	-60.4	-46.5	170.1	-172	-176.9	175.5	0	0	111.2	V457 E463 M464 Q465	V457-E461 WeakPolarHBondContact O-CB 3.47Å; V457-E461 PolarHBondContact O-N 3.21Å; E461-E463 PolarHBondContact O-N 2.93Å; E461-M464 WeakPolarHBondContact O-CB 3.3Å; E461-M464 PolarHBondContact O-N 2.93Å; E461-Q465 WeakPolarHBondContact O-CG 3.25Å; E461-Q465 PolarHBondContact O-N 2.95Å; E461-Q465 PolarHBondContact OE1-NE2 2.94Å
462	K	80.2	Confident	81.5	Confident	118 Å²	118	97.3 Å²	97.3	51%	0.513	48%	0.479	S	S	.	.	H	α-helix	trans	-60.2	-44.4	175.1	-171.1	-163.8	174.5	-88	0	111.7	I458 R459 M464 Q465 D466	I458-K462 VanDerWaalsContact O-CB 3.3Å; I458-K462 WeakPolarHBondContact O-CB 3.4Å; I458-K462 PolarHBondContact O-N 3.4Å; R459-K462 WeakPolarHBondContact O-CB 3.42Å; R459-K462 PolarHBondContact O-N 2.93Å; K462-M464 VanDerWaalsContact C-N 3.28Å; K462-M464 PolarHBondContact O-N 2.94Å; K462-Q465 PolarHBondContact O-N 3.3Å; K462-D466 IonicContact NZ-OD1 3.88Å; K462-D466 IonicContact NZ-OD2 2.66Å; K462-D466 PolarHBondContact NZ-OD2 2.97Å; K462-D466 WeakPolarHBondContact O-CB 3.35Å; K462-D466 PolarHBondContact O-N 2.97Å
463	E	84.9	Confident	81.8	Confident	72 Å²	72	96.6 Å²	96.6	34%	0.336	47%	0.465	S	S	.	.	H	α-helix	trans	-67.2	-27.3	178.6	-72.2	-179.7	-168.3	0	0	112.3	R459 T460 E461 K467	R459-E463 IonicContact CZ-OE1 2.86Å; R459-E463 VanDerWaalsContact CZ-OE1 3.32Å; R459-E463 IonicContact NE-OE1 2.74Å; R459-E463 PolarHBondContact NE-OE1 3.3Å; R459-E463 IonicContact NH2-OE1 3.82Å; R459-E463 PolarHBondContact NH2-OE1 3.4Å; R459-E463 WeakPolarHBondContact O-CG 3.25Å; R459-E463 PolarHBondContact O-N 3.13Å; T460-E463 PolarHBondContact O-N 3.39Å; E461-E463 PolarHBondContact O-N 2.93Å; E463-K467 WeakPolarHBondContact O-CB 3.47Å; E463-K467 WeakPolarHBondContact O-CD 3.3Å; E463-K467 WeakPolarHBondContact O-CG 3.13Å; E463-K467 PolarHBondContact O-N 2.93Å
464	M	83.5	Confident	82.1	Confident	113 Å²	113	91.6 Å²	91.6	56%	0.557	45%	0.452	S	S	*	.	H	α-helix	trans	-72	-45.1	167.7	-69.7	176.1	-169.7	0	0	111.9	T460 E461 K462 D466 K467 H468	T460-M464 VanDerWaalsContact O-CG 3.31Å; T460-M464 WeakPolarHBondContact O-CG 3.39Å; T460-M464 PolarHBondContact O-N 2.89Å; E461-M464 WeakPolarHBondContact O-CB 3.3Å; E461-M464 PolarHBondContact O-N 2.93Å; K462-M464 VanDerWaalsContact C-N 3.28Å; K462-M464 PolarHBondContact O-N 2.94Å; M464-D466 PolarHBondContact O-N 2.76Å; M464-K467 WeakPolarHBondContact O-CB 3.3Å; M464-K467 PolarHBondContact O-N 2.95Å; M464-H468 PolarHBondContact O-CD2 3.16Å; M464-H468 PolarHBondContact O-N 3.49Å
465	Q	82.2	Confident	82.4	Confident	90 Å²	90	91.4 Å²	91.4	42%	0.421	46%	0.455	S	S	.	.	H	α-helix	trans	-61.4	-43.9	176.1	-69.4	178.6	18	0	0	111.5	E461 K462 K467 H468 I469	E461-Q465 WeakPolarHBondContact O-CG 3.25Å; E461-Q465 PolarHBondContact O-N 2.95Å; E461-Q465 PolarHBondContact OE1-NE2 2.94Å; K462-Q465 PolarHBondContact O-N 3.3Å; Q465-K467 VanDerWaalsContact C-N 3.33Å; Q465-K467 PolarHBondContact O-N 3.21Å; Q465-H468 PolarHBondContact O-N 3.4Å; Q465-I469 WeakPolarHBondContact O-CB 3.47Å; Q465-I469 WeakPolarHBondContact O-CD1 3.27Å; Q465-I469 VanDerWaalsContact O-CG1 3.24Å; Q465-I469 WeakPolarHBondContact O-CG1 3.34Å; Q465-I469 PolarHBondContact O-N 3.04Å
466	D	85.6	Confident	82.8	Confident	64 Å²	64	87.5 Å²	87.5	34%	0.342	44%	0.437	S	S	.	.	H	α-helix	trans	-61	-39.2	174.6	-74.5	-30.8	0	0	0	111.3	K462 M464 L470	K462-D466 IonicContact NZ-OD1 3.88Å; K462-D466 IonicContact NZ-OD2 2.66Å; K462-D466 PolarHBondContact NZ-OD2 2.97Å; K462-D466 WeakPolarHBondContact O-CB 3.35Å; K462-D466 PolarHBondContact O-N 2.97Å; M464-D466 PolarHBondContact O-N 2.76Å; D466-L470 WeakPolarHBondContact O-CB 3.47Å; D466-L470 VanDerWaalsContact O-CG 3.3Å; D466-L470 WeakPolarHBondContact O-CG 3.32Å; D466-L470 PolarHBondContact O-N 3.43Å
467	K	87.6	Confident	82.8	Confident	134 Å²	134	87.4 Å²	87.4	58%	0.583	44%	0.435	S	S	*	.	H	α-helix	trans	-66.9	-42	173.3	-75	167.4	-171.6	173	0	112.9	E463 M464 Q465 I469 L470 A471	E463-K467 WeakPolarHBondContact O-CB 3.47Å; E463-K467 WeakPolarHBondContact O-CD 3.3Å; E463-K467 WeakPolarHBondContact O-CG 3.13Å; E463-K467 PolarHBondContact O-N 2.93Å; M464-K467 WeakPolarHBondContact O-CB 3.3Å; M464-K467 PolarHBondContact O-N 2.95Å; Q465-K467 VanDerWaalsContact C-N 3.33Å; Q465-K467 PolarHBondContact O-N 3.21Å; K467-I469 VanDerWaalsContact C-N 3.34Å; K467-L470 PolarHBondContact O-N 3.02Å; K467-A471 WeakPolarHBondContact O-CB 3.32Å; K467-A471 PolarHBondContact O-N 2.9Å
468	H	85.6	Confident	82.7	Confident	138 Å²	138	90.2 Å²	90.2	64%	0.639	44%	0.442	S	S	*	.	H	α-helix	trans	-65.4	-39.6	177.6	-73.8	-157	0	0	0	111.1	M464 Q465 A471 L472	M464-H468 PolarHBondContact O-CD2 3.16Å; M464-H468 PolarHBondContact O-N 3.49Å; Q465-H468 PolarHBondContact O-N 3.4Å; H468-A471 PolarHBondContact O-N 3.29Å; H468-L472 WeakPolarHBondContact O-CB 3.31Å; H468-L472 PolarHBondContact O-N 3.33Å
469	I	83	Confident	82.4	Confident	69 Å²	69	92.3 Å²	92.3	35%	0.354	45%	0.451	S	S	.	.	H	α-helix	trans	-61	-48.9	172	-71.4	164.7	0	0	0	110	Q465 K467 A471 L472 E473	Q465-I469 WeakPolarHBondContact O-CB 3.47Å; Q465-I469 WeakPolarHBondContact O-CD1 3.27Å; Q465-I469 VanDerWaalsContact O-CG1 3.24Å; Q465-I469 WeakPolarHBondContact O-CG1 3.34Å; Q465-I469 PolarHBondContact O-N 3.04Å; K467-I469 VanDerWaalsContact C-N 3.34Å; I469-A471 PolarHBondContact O-N 2.83Å; I469-L472 PolarHBondContact O-N 3.09Å; I469-E473 HydrophobicContact CG2-CG 4.39Å; I469-E473 WeakPolarHBondContact CG2-OE1 3.32Å; I469-E473 WeakPolarHBondContact O-CB 3.19Å; I469-E473 VanDerWaalsContact O-CG 3.29Å; I469-E473 WeakPolarHBondContact O-CG 3.33Å; I469-E473 PolarHBondContact O-N 3.03Å
470	L	84.4	Confident	81.7	Confident	97 Å²	97	89.1 Å²	89.1	51%	0.508	46%	0.46	S	S	.	.	H	α-helix	trans	-62.6	-38.5	177.9	-75.5	168	0	0	0	113.6	D466 K467 E473 N474	D466-L470 WeakPolarHBondContact O-CB 3.47Å; D466-L470 VanDerWaalsContact O-CG 3.3Å; D466-L470 WeakPolarHBondContact O-CG 3.32Å; D466-L470 PolarHBondContact O-N 3.43Å; K467-L470 PolarHBondContact O-N 3.02Å; L470-E473 PolarHBondContact O-N 3.47Å; L470-N474 PolarHBondContact O-N 3.37Å
471	A	85.1	Confident	81.1	Confident	52 Å²	52	88.6 Å²	88.6	43%	0.43	46%	0.457	S	S	.	.	H	α-helix	trans	-64.7	-45.1	174.9	0	0	0	0	0	111.5	K467 H468 I469 N474 L475	K467-A471 WeakPolarHBondContact O-CB 3.32Å; K467-A471 PolarHBondContact O-N 2.9Å; H468-A471 PolarHBondContact O-N 3.29Å; I469-A471 PolarHBondContact O-N 2.83Å; A471-N474 PolarHBondContact O-N 2.84Å; A471-N474 VanDerWaalsContact O-N 3.15Å; A471-L475 WeakPolarHBondContact O-CG 3.36Å; A471-L475 PolarHBondContact O-N 3.15Å
472	L	83.1	Confident	80.5	Confident	105 Å²	105	89 Å²	89	55%	0.55	47%	0.466	S	S	.	.	H	α-helix	trans	-64	-39.6	175.1	-173.7	65.1	0	0	0	111.8	H468 I469 N474 L475 L476	H468-L472 WeakPolarHBondContact O-CB 3.31Å; H468-L472 PolarHBondContact O-N 3.33Å; I469-L472 PolarHBondContact O-N 3.09Å; L472-N474 VanDerWaalsContact C-N 3.25Å; L472-N474 PolarHBondContact O-N 3.02Å; L472-L475 PolarHBondContact O-N 2.79Å; L472-L476 HydrophobicContact CG-CD1 4.15Å; L472-L476 WeakPolarHBondContact O-CB 3.47Å; L472-L476 WeakPolarHBondContact O-CD1 3.49Å; L472-L476 WeakPolarHBondContact O-CG 3.41Å; L472-L476 PolarHBondContact O-N 2.86Å
473	E	80.7	Confident	79.8	Confident	26 Å²	26	87.4 Å²	87.4	12%	0.121	47%	0.469	C	S	.	.	H	α-helix	trans	-62.1	-30.9	173.2	-75.1	-175.7	-136.6	0	0	112.8	I469 L470 K477 I486 K490	I469-E473 HydrophobicContact CG2-CG 4.39Å; I469-E473 WeakPolarHBondContact CG2-OE1 3.32Å; I469-E473 WeakPolarHBondContact O-CB 3.19Å; I469-E473 VanDerWaalsContact O-CG 3.29Å; I469-E473 WeakPolarHBondContact O-CG 3.33Å; I469-E473 PolarHBondContact O-N 3.03Å; L470-E473 PolarHBondContact O-N 3.47Å; E473-K477 WeakPolarHBondContact O-CD 3.35Å; E473-K477 WeakPolarHBondContact O-CE 3.41Å; E473-K477 VanDerWaalsContact O-CG 3.23Å; E473-K477 WeakPolarHBondContact O-CG 3.48Å; E473-K477 PolarHBondContact O-N 2.99Å; E473-I486 HydrophobicContact CB-CG2 4.21Å; E473-I486 HydrophobicContact CG-CG2 3.66Å; E473-K490 VanDerWaalsContact CD-CE 3.48Å; E473-K490 WeakPolarHBondContact OE1-CE 3.44Å; E473-K490 IonicContact OE1-NZ 2.6Å; E473-K490 PolarHBondContact OE1-NZ 3.38Å; E473-K490 WeakPolarHBondContact OE2-CE 3.47Å; E473-K490 IonicContact OE2-NZ 2.7Å; E473-K490 PolarHBondContact OE2-NZ 2.99Å
474	N	82.8	Confident	78.9	Confident	76 Å²	76	88.7 Å²	88.7	41%	0.406	48%	0.478	S	S	.	.	H	α-helix	trans	-79.3	-45.5	176.8	-71.4	-10.1	0	0	0	111.8	L470 A471 L472 L476 K477 E478	L470-N474 PolarHBondContact O-N 3.37Å; A471-N474 PolarHBondContact O-N 2.84Å; A471-N474 VanDerWaalsContact O-N 3.15Å; L472-N474 VanDerWaalsContact C-N 3.25Å; L472-N474 PolarHBondContact O-N 3.02Å; N474-L476 PolarHBondContact O-N 2.85Å; N474-K477 WeakPolarHBondContact O-CB 3.46Å; N474-K477 PolarHBondContact O-N 3.36Å; N474-K477 PolarHBondContact OD1-NZ 3.44Å; N474-E478 WeakPolarHBondContact O-CG 3.31Å; N474-E478 PolarHBondContact O-N 3.14Å
475	L	82.2	Confident	78.2	Confident	96 Å²	96	86.2 Å²	86.2	50%	0.503	47%	0.47	S	S	.	.	H	α-helix	trans	-58	-36.5	173.4	-69.8	170.2	0	0	0	112.3	A471 L472 E478 M479	A471-L475 WeakPolarHBondContact O-CG 3.36Å; A471-L475 PolarHBondContact O-N 3.15Å; L472-L475 PolarHBondContact O-N 2.79Å; L475-E478 PolarHBondContact O-N 3.44Å; L475-M479 PolarHBondContact O-N 3.03Å
476	L	78.6	Confident	77.5	Confident	45 Å²	45	82.3 Å²	82.3	24%	0.236	45%	0.452	C	S	.	.	H	α-helix	trans	-66.2	-38	173.9	-73.5	167.7	0	0	0	112.4	L472 N474 G480 V481 I486	L472-L476 HydrophobicContact CG-CD1 4.15Å; L472-L476 WeakPolarHBondContact O-CB 3.47Å; L472-L476 WeakPolarHBondContact O-CD1 3.49Å; L472-L476 WeakPolarHBondContact O-CG 3.41Å; L472-L476 PolarHBondContact O-N 2.86Å; N474-L476 PolarHBondContact O-N 2.85Å; L476-G480 PolarHBondContact O-N 3.45Å; L476-V481 HydrophobicContact CB-CB 4.25Å; L476-V481 HydrophobicContact CD2-CB 4.41Å; L476-V481 HydrophobicContact CD2-CG2 3.99Å; L476-V481 WeakPolarHBondContact O-CB 3.31Å; L476-V481 WeakPolarHBondContact O-CG2 3.22Å; L476-V481 PolarHBondContact O-N 2.91Å; L476-I486 HydrophobicContact CB-CD1 3.69Å; L476-I486 HydrophobicContact CB-CG1 3.93Å; L476-I486 HydrophobicContact CD1-CG1 4.28Å
477	K	79.1	Confident	76.5	Confident	98 Å²	98	88.1 Å²	88.1	43%	0.426	47%	0.468	S	S	.	.	H	α-helix	trans	-67.1	-41.8	173.6	-66.4	159.6	-156.2	157.4	0	111.6	E473 N474 M479 G480 I486	E473-K477 WeakPolarHBondContact O-CD 3.35Å; E473-K477 WeakPolarHBondContact O-CE 3.41Å; E473-K477 VanDerWaalsContact O-CG 3.23Å; E473-K477 WeakPolarHBondContact O-CG 3.48Å; E473-K477 PolarHBondContact O-N 2.99Å; N474-K477 WeakPolarHBondContact O-CB 3.46Å; N474-K477 PolarHBondContact O-N 3.36Å; N474-K477 PolarHBondContact OD1-NZ 3.44Å; K477-M479 VanDerWaalsContact C-N 3.32Å; K477-M479 PolarHBondContact O-N 2.88Å; K477-G480 PolarHBondContact O-N 3.31Å; K477-I486 HydrophobicContact CG-CD1 3.79Å
478	E	80	Confident	75.6	Confident	151 Å²	151	89.8 Å²	89.8	71%	0.706	48%	0.476	S	S	*	.	H	α-helix	trans	-62.7	-38.3	178	-73	170.4	-171.3	0	0	111.7	N474 L475 G480	N474-E478 WeakPolarHBondContact O-CG 3.31Å; N474-E478 PolarHBondContact O-N 3.14Å; L475-E478 PolarHBondContact O-N 3.44Å; E478-G480 PolarHBondContact O-N 3.34Å
479	M	73.6	Confident	74.6	Confident	151 Å²	151	87.7 Å²	87.7	74%	0.744	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	20.1	170.6	-61.4	-155.5	-57.6	0	0	114.1	L475 K477 V481	L475-M479 PolarHBondContact O-N 3.03Å; K477-M479 VanDerWaalsContact C-N 3.32Å; K477-M479 PolarHBondContact O-N 2.88Å; M479-V481 VanDerWaalsContact C-N 3.3Å; M479-V481 PolarHBondContact O-N 2.9Å
480	G	68.9	Low	73.7	Confident	67 Å²	67	88.8 Å²	88.8	69%	0.691	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	72	12.3	170.9	0	0	0	0	0	116.1	L476 K477 E478 S482	L476-G480 PolarHBondContact O-N 3.45Å; K477-G480 PolarHBondContact O-N 3.31Å; E478-G480 PolarHBondContact O-N 3.34Å; G480-S482 PolarHBondContact O-N 2.81Å
481	V	69.1	Low	72.8	Confident	44 Å²	44	87.9 Å²	87.9	27%	0.267	48%	0.478	S	S	.	.			trans	-74.9	124.2	-179.4	-176.4	0	0	0	0	110	L476 M479 T485 I486	L476-V481 HydrophobicContact CB-CB 4.25Å; L476-V481 HydrophobicContact CD2-CB 4.41Å; L476-V481 HydrophobicContact CD2-CG2 3.99Å; L476-V481 WeakPolarHBondContact O-CB 3.31Å; L476-V481 WeakPolarHBondContact O-CG2 3.22Å; L476-V481 PolarHBondContact O-N 2.91Å; M479-V481 VanDerWaalsContact C-N 3.3Å; M479-V481 PolarHBondContact O-N 2.9Å; V481-T485 HydrophobicContact CG1-CG2 3.91Å; V481-I486 HydrophobicContact CG1-CG1 4.11Å
482	S	70.5	Confident	71.1	Confident	64 Å²	64	93.8 Å²	93.8	45%	0.448	50%	0.501	S	S	.	.			trans	-60.4	142	-177	69.1	0	0	0	0	113	G480 D484 T485 I486	G480-S482 PolarHBondContact O-N 2.81Å; S482-D484 PolarHBondContact O-N 3.37Å; S482-T485 WeakPolarHBondContact O-CA 3.34Å; S482-T485 WeakPolarHBondContact O-CB 3.23Å; S482-T485 PolarHBondContact O-N 2.91Å; S482-T485 PolarHBondContact OG-OG1 3.1Å; S482-I486 PolarHBondContact O-N 2.89Å; S482-I486 VanDerWaalsContact O-N 3.16Å
483	S	66.3	Low	69.7	Low	83 Å²	83	98 Å²	98	58%	0.58	51%	0.511	S	S	*	.	H	α-helix	trans	-52.8	-31.3	-179.7	-59.1	0	0	0	0	113.8	I486 R487	S483-I486 PolarHBondContact O-N 2.88Å; S483-R487 VanDerWaalsContact O-CB 3.29Å; S483-R487 WeakPolarHBondContact O-CB 3.47Å; S483-R487 PolarHBondContact O-N 3.26Å
484	D	65.4	Low	68.3	Low	100 Å²	100	105.9 Å²	105.9	54%	0.535	55%	0.545	S	S	.	.	H	α-helix	trans	-72.9	-28.7	177.2	-63.6	-61.3	0	0	0	113.5	S482 K488	S482-D484 PolarHBondContact O-N 3.37Å; D484-K488 WeakPolarHBondContact O-CD 3.34Å; D484-K488 VanDerWaalsContact O-CG 3.3Å; D484-K488 WeakPolarHBondContact O-CG 3.18Å; D484-K488 PolarHBondContact O-N 2.75Å
485	T	69.3	Low	66.9	Low	61 Å²	61	111.4 Å²	111.4	37%	0.374	57%	0.565	S	S	.	*	H	α-helix	trans	-71.7	-46.2	171	-50.8	0	0	0	0	109.6	V481 S482 R487 K488 C489	V481-T485 HydrophobicContact CG1-CG2 3.91Å; S482-T485 WeakPolarHBondContact O-CA 3.34Å; S482-T485 WeakPolarHBondContact O-CB 3.23Å; S482-T485 PolarHBondContact O-N 2.91Å; S482-T485 PolarHBondContact OG-OG1 3.1Å; T485-R487 VanDerWaalsContact C-N 3.26Å; T485-R487 PolarHBondContact O-N 3.49Å; T485-K488 WeakPolarHBondContact O-CB 3.49Å; T485-K488 PolarHBondContact O-N 3.44Å; T485-C489 PolarHBondContact O-N 3.03Å; T485-C489 PolarHBondContact O-SG 2.75Å
486	I	65.9	Low	65.5	Low	8 Å²	8	110.2 Å²	110.2	4%	0.041	56%	0.564	C	S	.	*	H	α-helix	trans	-57.9	-39.9	174.8	-59.1	176.8	0	0	0	111	E473 L476 K477 V481 S482 S483 K488 C489	E473-I486 HydrophobicContact CB-CG2 4.21Å; E473-I486 HydrophobicContact CG-CG2 3.66Å; L476-I486 HydrophobicContact CB-CD1 3.69Å; L476-I486 HydrophobicContact CB-CG1 3.93Å; L476-I486 HydrophobicContact CD1-CG1 4.28Å; K477-I486 HydrophobicContact CG-CD1 3.79Å; V481-I486 HydrophobicContact CG1-CG1 4.11Å; S482-I486 PolarHBondContact O-N 2.89Å; S482-I486 VanDerWaalsContact O-N 3.16Å; S483-I486 PolarHBondContact O-N 2.88Å; I486-K488 VanDerWaalsContact C-N 3.34Å; I486-K488 PolarHBondContact O-N 3.05Å; I486-C489 PolarHBondContact O-N 2.85Å
487	R	66.2	Low	64.6	Low	185 Å²	185	111.3 Å²	111.3	70%	0.698	57%	0.573	S	S	*	*	H	α-helix	trans	-64.7	-32.2	176.5	-173.4	176.3	179.9	178.8	0.5	113.5	S483 T485 C489	S483-R487 VanDerWaalsContact O-CB 3.29Å; S483-R487 WeakPolarHBondContact O-CB 3.47Å; S483-R487 PolarHBondContact O-N 3.26Å; T485-R487 VanDerWaalsContact C-N 3.26Å; T485-R487 PolarHBondContact O-N 3.49Å; R487-C489 VanDerWaalsContact C-N 3.34Å
488	K	67.2	Low	64	Low	170 Å²	170	115.2 Å²	115.2	74%	0.739	59%	0.59	S	S	*	*	H	α-helix	trans	-72.5	-26	174.4	-69.6	163.5	-171.9	173.6	0	112.6	D484 T485 I486 K490	D484-K488 WeakPolarHBondContact O-CD 3.34Å; D484-K488 VanDerWaalsContact O-CG 3.3Å; D484-K488 WeakPolarHBondContact O-CG 3.18Å; D484-K488 PolarHBondContact O-N 2.75Å; T485-K488 WeakPolarHBondContact O-CB 3.49Å; T485-K488 PolarHBondContact O-N 3.44Å; I486-K488 VanDerWaalsContact C-N 3.34Å; I486-K488 PolarHBondContact O-N 3.05Å; K488-K490 VanDerWaalsContact C-N 3.34Å
489	C	64.6	Low	63.5	Low	94 Å²	94	114.8 Å²	114.8	64%	0.635	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-11.5	177.4	-62.2	0	0	0	0	114.1	T485 I486 R487	T485-C489 PolarHBondContact O-N 3.03Å; T485-C489 PolarHBondContact O-SG 2.75Å; I486-C489 PolarHBondContact O-N 2.85Å; R487-C489 VanDerWaalsContact C-N 3.34Å
490	K	65.7	Low	63.3	Low	92 Å²	92	112.6 Å²	112.6	40%	0.4	58%	0.576	S	S	.	*	S	Bend	trans	-73.1	137.8	177.3	-56.7	-156.4	-172.2	-149.3	0	110.6	E473 K488 L492	E473-K490 VanDerWaalsContact CD-CE 3.48Å; E473-K490 WeakPolarHBondContact OE1-CE 3.44Å; E473-K490 IonicContact OE1-NZ 2.6Å; E473-K490 PolarHBondContact OE1-NZ 3.38Å; E473-K490 WeakPolarHBondContact OE2-CE 3.47Å; E473-K490 IonicContact OE2-NZ 2.7Å; E473-K490 PolarHBondContact OE2-NZ 2.99Å; K488-K490 VanDerWaalsContact C-N 3.34Å; K490-L492 PolarHBondContact O-N 3.43Å
491	P	63.8	Low	63.4	Low	78 Å²	78	112.1 Å²	112.1	51%	0.506	56%	0.559	S	S	.	*			trans	-58.6	126.1	178	23.1	-33.3	0	0	0	110.9	Y493	P491-Y493 HydrophobicContact CB-CE2 4.23Å; P491-Y493 HydrophobicContact CG-CD2 4.29Å; P491-Y493 HydrophobicContact CG-CE2 3.71Å; P491-Y493 WeakPolarHBondContact O-CD2 3.18Å; P491-Y493 PolarHBondContact O-N 2.94Å
492	L	50	Low	63.7	Low	175 Å²	175	114 Å²	114	92%	0.916	57%	0.568	S	S	*	*			trans	-73.7	75	-179.5	-80.2	167.9	0	0	0	111.3	K490 K494	K490-L492 PolarHBondContact O-N 3.43Å; L492-K494 PolarHBondContact O-N 2.8Å
493	Y	54.2	Low	63.9	Low	195 Å²	195	115.4 Å²	115.4	77%	0.765	57%	0.571	S	S	*	*			trans	-58.6	105.9	165.5	-69.5	-73.1	0	0	0	109.5	P491 K495	P491-Y493 HydrophobicContact CB-CE2 4.23Å; P491-Y493 HydrophobicContact CG-CD2 4.29Å; P491-Y493 HydrophobicContact CG-CE2 3.71Å; P491-Y493 WeakPolarHBondContact O-CD2 3.18Å; P491-Y493 PolarHBondContact O-N 2.94Å; Y493-K495 PolarHBondContact O-N 3.43Å
494	K	51.8	Low	64.3	Low	190 Å²	190	113.6 Å²	113.6	83%	0.826	56%	0.561	S	S	*	*			trans	-61.4	98.6	171.2	-174.7	174.8	-176.5	175.3	0	108.2	L492 C496	L492-K494 PolarHBondContact O-N 2.8Å; K494-C496 PolarHBondContact O-N 3.31Å
495	K	52.6	Low	64.7	Low	193 Å²	193	113.6 Å²	113.6	84%	0.839	56%	0.56	S	S	*	*			trans	-58.8	100.7	175.1	-74.2	-173.2	177.8	-177.9	0	108.7	Y493 T497	Y493-K495 PolarHBondContact O-N 3.43Å; K495-T497 PolarHBondContact O-N 2.99Å
496	C	53.6	Low	64.9	Low	70 Å²	70	117.5 Å²	117.5	47%	0.473	57%	0.572	S	S	.	*			trans	-54.7	122.4	166	-160.7	0	0	0	0	107	K494 Q500 T501	K494-C496 PolarHBondContact O-N 3.31Å; C496-Q500 WeakPolarHBondContact SG-CB 3.34Å; C496-T501 HydrophobicContact CB-CG2 3.89Å
497	T	59.8	Low	65.3	Low	69 Å²	69	120 Å²	120	42%	0.423	59%	0.591	S	S	.	*			trans	-65.1	153.7	-179	59.3	0	0	0	0	109.4	K495 E499 Q500 T501	K495-T497 PolarHBondContact O-N 2.99Å; T497-E499 PolarHBondContact O-N 2.87Å; T497-Q500 PolarHBondContact O-N 2.82Å; T497-Q500 WeakPolarHBondContact OG1-CG 3.41Å; T497-Q500 PolarHBondContact OG1-N 2.89Å; T497-T501 PolarHBondContact O-N 3.39Å; T497-T501 PolarHBondContact O-OG1 3.42Å
498	K	66.6	Low	65.4	Low	180 Å²	180	116.1 Å²	116.1	78%	0.783	58%	0.582	S	S	*	*	H	α-helix	trans	-52.8	-32.9	176.7	-70.1	-173.5	176.6	-175.7	0	111.6	T501 N502	K498-T501 WeakPolarHBondContact CA-OG1 3.43Å; K498-T501 PolarHBondContact O-OG1 3.46Å; K498-N502 WeakPolarHBondContact O-CB 3.26Å; K498-N502 PolarHBondContact O-N 3.3Å; K498-N502 PolarHBondContact O-ND2 3.49Å; K498-N502 PolarHBondContact O-OD1 3.33Å
499	E	68.8	Low	65.4	Low	142 Å²	142	110.5 Å²	110.5	66%	0.664	57%	0.568	S	S	*	*	H	α-helix	trans	-68.2	-44.9	174	-65.7	168	177.5	0	0	112.9	T497 N502 N503	T497-E499 PolarHBondContact O-N 2.87Å; E499-N502 PolarHBondContact O-N 3.38Å; E499-N503 VanDerWaalsContact O-CB 3.25Å; E499-N503 WeakPolarHBondContact O-CB 3.47Å; E499-N503 PolarHBondContact O-N 3.38Å; E499-N503 PolarHBondContact O-ND2 3.36Å
500	Q	69.3	Low	65.4	Low	104 Å²	104	108.9 Å²	108.9	49%	0.486	56%	0.561	S	S	.	*	H	α-helix	trans	-63.4	-41.4	175.1	-77	-178.1	-30.1	0	0	111.9	C496 T497 N503 A504	C496-Q500 WeakPolarHBondContact SG-CB 3.34Å; T497-Q500 PolarHBondContact O-N 2.82Å; T497-Q500 WeakPolarHBondContact OG1-CG 3.41Å; T497-Q500 PolarHBondContact OG1-N 2.89Å; Q500-N503 PolarHBondContact O-N 3.09Å; Q500-A504 WeakPolarHBondContact O-CB 3.32Å; Q500-A504 PolarHBondContact O-N 3.11Å
501	T	71.2	Confident	64.8	Low	57 Å²	57	110.5 Å²	110.5	35%	0.35	57%	0.573	S	S	.	*	H	α-helix	trans	-65	-42.3	173.8	53.1	0	0	0	0	111.7	C496 T497 K498 N503 A504 L505	C496-T501 HydrophobicContact CB-CG2 3.89Å; T497-T501 PolarHBondContact O-N 3.39Å; T497-T501 PolarHBondContact O-OG1 3.42Å; K498-T501 WeakPolarHBondContact CA-OG1 3.43Å; K498-T501 PolarHBondContact O-OG1 3.46Å; T501-N503 PolarHBondContact O-N 3.37Å; T501-A504 PolarHBondContact O-N 3Å; T501-L505 WeakPolarHBondContact O-CB 3.1Å; T501-L505 VanDerWaalsContact O-CG 3.3Å; T501-L505 WeakPolarHBondContact O-CG 3.2Å; T501-L505 PolarHBondContact O-N 3.08Å
502	N	74.6	Confident	64.5	Low	84 Å²	84	111.1 Å²	111.1	45%	0.449	58%	0.576	S	S	.	*	H	α-helix	trans	-68.3	-35.2	178.7	-70.9	-4.8	0	0	0	112.2	K498 E499 L505 K506	K498-N502 WeakPolarHBondContact O-CB 3.26Å; K498-N502 PolarHBondContact O-N 3.3Å; K498-N502 PolarHBondContact O-ND2 3.49Å; K498-N502 PolarHBondContact O-OD1 3.33Å; E499-N502 PolarHBondContact O-N 3.38Å; N502-L505 PolarHBondContact O-N 2.94Å; N502-K506 WeakPolarHBondContact O-CB 3.42Å; N502-K506 WeakPolarHBondContact O-CG 3.44Å; N502-K506 PolarHBondContact O-N 3.07Å
503	N	75.9	Confident	65	Low	94 Å²	94	107.2 Å²	107.2	50%	0.503	56%	0.559	S	S	.	*	H	α-helix	trans	-73.7	-34.7	176.8	-69.6	-16.3	0	0	0	111.8	E499 Q500 T501 K506 S507	E499-N503 VanDerWaalsContact O-CB 3.25Å; E499-N503 WeakPolarHBondContact O-CB 3.47Å; E499-N503 PolarHBondContact O-N 3.38Å; E499-N503 PolarHBondContact O-ND2 3.36Å; Q500-N503 PolarHBondContact O-N 3.09Å; T501-N503 PolarHBondContact O-N 3.37Å; N503-K506 PolarHBondContact O-N 3.31Å; N503-S507 PolarHBondContact O-N 2.92Å; N503-S507 PolarHBondContact O-OG 3.44Å
504	A	73.7	Confident	64.8	Low	45 Å²	45	101 Å²	101	37%	0.372	56%	0.555	S	S	.	*	H	α-helix	trans	-65.9	-42.5	169.4	0	0	0	0	0	112.1	Q500 T501 S507 I508	Q500-A504 WeakPolarHBondContact O-CB 3.32Å; Q500-A504 PolarHBondContact O-N 3.11Å; T501-A504 PolarHBondContact O-N 3Å; A504-S507 PolarHBondContact O-N 3.07Å; A504-S507 PolarHBondContact O-OG 3.15Å; A504-I508 WeakPolarHBondContact O-CB 3.45Å; A504-I508 WeakPolarHBondContact O-CD1 3.22Å; A504-I508 VanDerWaalsContact O-CG1 3.25Å; A504-I508 WeakPolarHBondContact O-CG1 3.34Å; A504-I508 PolarHBondContact O-N 2.91Å
505	L	73.9	Confident	64.5	Low	100 Å²	100	101 Å²	101	52%	0.524	56%	0.555	S	S	.	*	H	α-helix	trans	-64	-40.3	174.3	-73	168.8	0	0	0	111.8	T501 N502 I508 A509	T501-L505 WeakPolarHBondContact O-CB 3.1Å; T501-L505 VanDerWaalsContact O-CG 3.3Å; T501-L505 WeakPolarHBondContact O-CG 3.2Å; T501-L505 PolarHBondContact O-N 3.08Å; N502-L505 PolarHBondContact O-N 2.94Å; L505-I508 PolarHBondContact O-N 2.94Å; L505-A509 VanDerWaalsContact O-CB 3.29Å; L505-A509 WeakPolarHBondContact O-CB 3.5Å; L505-A509 PolarHBondContact O-N 3.18Å
506	K	73.8	Confident	64	Low	142 Å²	142	98.7 Å²	98.7	62%	0.617	55%	0.549	S	S	*	.	H	α-helix	trans	-62.1	-41.6	173.1	-77.2	170	-179.1	178.7	0	112.4	N502 N503 A509 A510	N502-K506 WeakPolarHBondContact O-CB 3.42Å; N502-K506 WeakPolarHBondContact O-CG 3.44Å; N502-K506 PolarHBondContact O-N 3.07Å; N503-K506 PolarHBondContact O-N 3.31Å; K506-A509 PolarHBondContact O-N 3.41Å; K506-A510 VanDerWaalsContact O-CB 3.28Å; K506-A510 WeakPolarHBondContact O-CB 3.41Å; K506-A510 PolarHBondContact O-N 2.94Å
507	S	73.2	Confident	63.5	Low	62 Å²	62	97.9 Å²	97.9	43%	0.434	55%	0.553	S	S	.	*	H	α-helix	trans	-71.5	-37.8	178.6	66.5	0	0	0	0	112.4	N503 A504 A510 L511	N503-S507 PolarHBondContact O-N 2.92Å; N503-S507 PolarHBondContact O-OG 3.44Å; A504-S507 PolarHBondContact O-N 3.07Å; A504-S507 PolarHBondContact O-OG 3.15Å; S507-A510 PolarHBondContact O-N 2.74Å; S507-L511 WeakPolarHBondContact O-CB 3.22Å; S507-L511 VanDerWaalsContact O-CG 3.3Å; S507-L511 WeakPolarHBondContact O-CG 3.46Å; S507-L511 PolarHBondContact O-N 3.19Å
508	I	69	Low	62.5	Low	102 Å²	102	97.7 Å²	97.7	52%	0.523	56%	0.564	S	S	.	*	H	α-helix	trans	-61.5	-44.9	171.4	-68.9	163.8	0	0	0	110.9	A504 L505 L511 T512	A504-I508 WeakPolarHBondContact O-CB 3.45Å; A504-I508 WeakPolarHBondContact O-CD1 3.22Å; A504-I508 VanDerWaalsContact O-CG1 3.25Å; A504-I508 WeakPolarHBondContact O-CG1 3.34Å; A504-I508 PolarHBondContact O-N 2.91Å; L505-I508 PolarHBondContact O-N 2.94Å; I508-L511 PolarHBondContact O-N 3.44Å; I508-T512 WeakPolarHBondContact O-CB 3.05Å; I508-T512 PolarHBondContact O-N 3.15Å; I508-T512 PolarHBondContact O-OG1 2.97Å
509	A	66.3	Low	61.4	Low	53 Å²	53	97.1 Å²	97.1	44%	0.438	57%	0.569	S	S	.	*	H	α-helix	trans	-62.3	-46.6	175.9	0	0	0	0	0	111.7	L505 K506 L511 T512 T513	L505-A509 VanDerWaalsContact O-CB 3.29Å; L505-A509 WeakPolarHBondContact O-CB 3.5Å; L505-A509 PolarHBondContact O-N 3.18Å; K506-A509 PolarHBondContact O-N 3.41Å; A509-L511 PolarHBondContact O-N 3.43Å; A509-T512 PolarHBondContact O-N 3.28Å; A509-T512 VanDerWaalsContact O-N 3.14Å; A509-T513 PolarHBondContact O-N 3.36Å; A509-T513 PolarHBondContact O-OG1 3.28Å; A509-T513 VanDerWaalsContact O-OG1 3.13Å
510	A	64.7	Low	60.4	Low	59 Å²	59	96.8 Å²	96.8	49%	0.488	58%	0.576	S	S	.	*	H	α-helix	trans	-64.1	-35.4	178.4	0	0	0	0	0	113.3	K506 S507 T513 G514	K506-A510 VanDerWaalsContact O-CB 3.28Å; K506-A510 WeakPolarHBondContact O-CB 3.41Å; K506-A510 PolarHBondContact O-N 2.94Å; S507-A510 PolarHBondContact O-N 2.74Å; A510-T513 PolarHBondContact O-OG1 2.96Å; A510-G514 PolarHBondContact O-N 3.42Å
511	L	53.6	Low	59.2	Low	127 Å²	127	95.4 Å²	95.4	67%	0.665	59%	0.59	S	S	*	*	H	α-helix	trans	-68.7	-38.5	172	-74.1	168.1	0	0	0	111.6	S507 I508 A509 F515	S507-L511 WeakPolarHBondContact O-CB 3.22Å; S507-L511 VanDerWaalsContact O-CG 3.3Å; S507-L511 WeakPolarHBondContact O-CG 3.46Å; S507-L511 PolarHBondContact O-N 3.19Å; I508-L511 PolarHBondContact O-N 3.44Å; A509-L511 PolarHBondContact O-N 3.43Å; L511-F515 VanDerWaalsContact O-CB 3.23Å; L511-F515 WeakPolarHBondContact O-CB 3.28Å; L511-F515 PolarHBondContact O-N 3.35Å; L511-F515 VanDerWaalsContact O-N 3.08Å
512	T	58.9	Low	57.8	Low	90 Å²	90	95.4 Å²	95.4	55%	0.552	60%	0.596	S	S	*	*	H	α-helix	trans	-71.4	-40	-179.8	-59.4	0	0	0	0	111.9	I508 A509	I508-T512 WeakPolarHBondContact O-CB 3.05Å; I508-T512 PolarHBondContact O-N 3.15Å; I508-T512 PolarHBondContact O-OG1 2.97Å; A509-T512 PolarHBondContact O-N 3.28Å; A509-T512 VanDerWaalsContact O-N 3.14Å
513	T	60.5	Low	56.5	Low	93 Å²	93	95.7 Å²	95.7	57%	0.571	60%	0.602	S	S	*	*	H	α-helix	trans	-71.3	-48.4	173.4	54.1	0	0	0	0	111.2	A509 A510 F515 M516 G517	A509-T513 PolarHBondContact O-N 3.36Å; A509-T513 PolarHBondContact O-OG1 3.28Å; A509-T513 VanDerWaalsContact O-OG1 3.13Å; A510-T513 PolarHBondContact O-OG1 2.96Å; T513-F515 PolarHBondContact O-N 3.36Å; T513-M516 PolarHBondContact O-N 2.88Å; T513-M516 VanDerWaalsContact O-N 3.14Å; T513-G517 PolarHBondContact O-N 2.83Å
514	G	49.3	Very low	55	Low	65 Å²	65	95.8 Å²	95.8	67%	0.67	61%	0.61	S	S	*	*	H	α-helix	trans	-62.1	-25.1	-178.6	0	0	0	0	0	114.9	A510	A510-G514 PolarHBondContact O-N 3.42Å
515	F	46.3	Very low	53.9	Low	191 Å²	191	100.7 Å²	100.7	84%	0.838	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	-9.6	178.5	-158.2	-99	0	0	0	114.3	L511 T513	L511-F515 VanDerWaalsContact O-CB 3.23Å; L511-F515 WeakPolarHBondContact O-CB 3.28Å; L511-F515 PolarHBondContact O-N 3.35Å; L511-F515 VanDerWaalsContact O-N 3.08Å; T513-F515 PolarHBondContact O-N 3.36Å
516	M	41.4	Very low	52.8	Low	144 Å²	144	98.8 Å²	98.8	71%	0.709	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.7	-12.6	-177.1	-71.2	-169.2	58.1	0	0	115.6	T513	T513-M516 PolarHBondContact O-N 2.88Å; T513-M516 VanDerWaalsContact O-N 3.14Å
517	G	42.8	Very low	51.6	Low	53 Å²	53	96.8 Å²	96.8	55%	0.546	61%	0.61	S	S	.	*	S	Bend	trans	-128.5	91.7	-175.3	0	0	0	0	0	113.8	T513	T513-G517 PolarHBondContact O-N 2.83Å
518	G	39.1	Very low	50.1	Low	65 Å²	65	99 Å²	99	67%	0.67	62%	0.618	S	S	*	*			trans	60.8	116	152	0	0	0	0	0	119	V520	G518-V520 PolarHBondContact O-N 3.29Å
519	L	43	Very low	49.2	Very low	168 Å²	168	98.3 Å²	98.3	88%	0.88	62%	0.618	S	S	*	*	S	Bend	trans	-71.5	27.2	162.6	-156.9	77.6	0	0	0	112.7
520	V	47	Very low	48.2	Very low	134 Å²	134	101.6 Å²	101.6	81%	0.812	63%	0.627	S	S	*	*	S	Bend	trans	-141.7	97.3	-164.9	-175.6	0	0	0	0	108.1	G518	G518-V520 PolarHBondContact O-N 3.29Å
521	G	44.6	Very low	47.2	Very low	76 Å²	76	100.9 Å²	100.9	78%	0.784	62%	0.618	S	S	*	*	S	Bend	trans	137.1	-12.5	176.9	0	0	0	0	0	116.3
522	A	42.3	Very low	46.6	Very low	56 Å²	56	103.2 Å²	103.2	46%	0.463	62%	0.623	S	S	.	*			trans	-71	130.9	173.1	0	0	0	0	0	110.8
523	P	46.6	Very low	45.9	Very low	90 Å²	90	109.1 Å²	109.1	58%	0.584	64%	0.637	S	S	*	*			trans	-65.9	144.3	178.6	26.2	-33.3	0	0	0	111.4	H525 V526	P523-H525 VanDerWaalsContact C-N 3.28Å; P523-H525 PolarHBondContact O-N 2.92Å; P523-H525 VanDerWaalsContact O-N 3.1Å; P523-V526 HydrophobicContact CG-CG2 4.18Å; P523-V526 PolarHBondContact O-N 2.79Å
524	S	46	Very low	44.8	Very low	97 Å²	97	107.5 Å²	107.5	68%	0.678	64%	0.638	S	S	*	*	H	α-helix	trans	-50.5	-40.2	-168.4	51.2	0	0	0	0	114.8	V526 Q527 D528	S524-V526 PolarHBondContact O-N 2.85Å; S524-V526 VanDerWaalsContact O-N 3.15Å; S524-Q527 PolarHBondContact O-N 3.27Å; S524-Q527 VanDerWaalsContact O-N 3.12Å; S524-D528 PolarHBondContact O-N 3.48Å
525	H	50	Low	44	Very low	147 Å²	147	113.1 Å²	113.1	68%	0.681	64%	0.644	S	S	*	*	H	α-helix	trans	-47.2	-40.7	172.6	158.2	-111.6	0	0	0	113.5	P523	P523-H525 VanDerWaalsContact C-N 3.28Å; P523-H525 PolarHBondContact O-N 2.92Å; P523-H525 VanDerWaalsContact O-N 3.1Å
526	V	51.1	Low	43.4	Very low	61 Å²	61	108.7 Å²	108.7	37%	0.37	64%	0.637	S	S	.	*	H	α-helix	trans	-83.8	-32.5	-177.2	-171.8	0	0	0	0	111.5	P523 S524 D528 V529 I530	P523-V526 HydrophobicContact CG-CG2 4.18Å; P523-V526 PolarHBondContact O-N 2.79Å; S524-V526 PolarHBondContact O-N 2.85Å; S524-V526 VanDerWaalsContact O-N 3.15Å; V526-D528 VanDerWaalsContact C-N 3.25Å; V526-D528 PolarHBondContact O-N 2.95Å; V526-V529 PolarHBondContact O-N 3.17Å; V526-I530 HydrophobicContact CG1-CD1 4.34Å; V526-I530 WeakPolarHBondContact O-CG1 3.41Å; V526-I530 PolarHBondContact O-N 3.46Å
527	Q	47.6	Very low	42.8	Very low	99 Å²	99	111.7 Å²	111.7	46%	0.463	65%	0.646	S	S	.	*	H	α-helix	trans	-58.8	-38.4	172.6	-84.5	-177.5	-29.1	0	0	111.6	S524 I530 S531	S524-Q527 PolarHBondContact O-N 3.27Å; S524-Q527 VanDerWaalsContact O-N 3.12Å; Q527-I530 PolarHBondContact O-N 3.41Å; Q527-S531 WeakPolarHBondContact O-CB 3.43Å; Q527-S531 PolarHBondContact O-N 2.98Å
528	D	42.9	Very low	42.1	Very low	110 Å²	110	118.2 Å²	118.2	59%	0.588	66%	0.66	S	S	*	*	H	α-helix	trans	-76.7	-26.9	-176.1	-113.9	-12	0	0	0	114.8	S524 V526 I530 S531 K532	S524-D528 PolarHBondContact O-N 3.48Å; V526-D528 VanDerWaalsContact C-N 3.25Å; V526-D528 PolarHBondContact O-N 2.95Å; D528-I530 VanDerWaalsContact C-N 3.3Å; D528-S531 PolarHBondContact O-N 2.94Å; D528-S531 PolarHBondContact O-OG 3.2Å; D528-S531 PolarHBondContact OD1-OG 3.33Å; D528-K532 WeakPolarHBondContact O-CB 3.37Å; D528-K532 PolarHBondContact O-N 3.2Å
529	V	50.2	Low	41.6	Very low	86 Å²	86	121.2 Å²	121.2	52%	0.521	67%	0.67	S	S	.	*	H	α-helix	trans	-67.3	-36.6	170.5	-174.1	0	0	0	0	110.4	V526	V526-V529 PolarHBondContact O-N 3.17Å
530	I	45.1	Very low	41	Very low	123 Å²	123	116.9 Å²	116.9	63%	0.631	65%	0.654	S	S	*	*	H	α-helix	trans	-72.9	-39.3	175.2	-61.5	169.2	0	0	0	110.5	V526 Q527 D528 K532 Y533 G534	V526-I530 HydrophobicContact CG1-CD1 4.34Å; V526-I530 WeakPolarHBondContact O-CG1 3.41Å; V526-I530 PolarHBondContact O-N 3.46Å; Q527-I530 PolarHBondContact O-N 3.41Å; D528-I530 VanDerWaalsContact C-N 3.3Å; I530-K532 VanDerWaalsContact C-N 3.31Å; I530-K532 PolarHBondContact O-N 2.74Å; I530-Y533 PolarHBondContact O-N 2.88Å; I530-G534 PolarHBondContact O-N 3.34Å
531	S	43.2	Very low	40.2	Very low	44 Å²	44	117.7 Å²	117.7	31%	0.308	66%	0.659	S	S	.	*	H	α-helix	trans	-62.1	-36.8	177.8	96.1	0	0	0	0	112.2	Q527 D528 Y533 G534	Q527-S531 WeakPolarHBondContact O-CB 3.43Å; Q527-S531 PolarHBondContact O-N 2.98Å; D528-S531 PolarHBondContact O-N 2.94Å; D528-S531 PolarHBondContact O-OG 3.2Å; D528-S531 PolarHBondContact OD1-OG 3.33Å; S531-Y533 PolarHBondContact O-N 3.48Å; S531-G534 PolarHBondContact O-N 3.3Å; S531-G534 VanDerWaalsContact O-N 3.15Å
532	K	42	Very low	39.8	Very low	175 Å²	175	122.5 Å²	122.5	76%	0.761	66%	0.662	S	S	*	*	H	α-helix	trans	-66.1	-32.1	-179	-123.1	170.2	-178.1	172.2	0	113.9	D528 I530	D528-K532 WeakPolarHBondContact O-CB 3.37Å; D528-K532 PolarHBondContact O-N 3.2Å; I530-K532 VanDerWaalsContact C-N 3.31Å; I530-K532 PolarHBondContact O-N 2.74Å
533	Y	43.1	Very low	39.2	Very low	215 Å²	215	125.1 Å²	125.1	84%	0.843	67%	0.668	S	S	*	*	H	α-helix	trans	-82.4	-12.7	174.5	-89.8	-86.4	0	0	0	113.7	I530 S531	I530-Y533 PolarHBondContact O-N 2.88Å; S531-Y533 PolarHBondContact O-N 3.48Å
534	G	38	Very low	38.3	Very low	58 Å²	58	129 Å²	129	60%	0.598	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-5	179.3	0	0	0	0	0	115.8	I530 S531 S536	I530-G534 PolarHBondContact O-N 3.34Å; S531-G534 PolarHBondContact O-N 3.3Å; S531-G534 VanDerWaalsContact O-N 3.15Å; G534-S536 PolarHBondContact O-N 3.43Å
535	K	32.1	Very low	37.7	Very low	183 Å²	183	128.4 Å²	128.4	80%	0.796	68%	0.677	S	S	*	*			trans	-94.3	57.9	-172.3	-72.9	-177.7	178	173.7	0	114
536	S	33.6	Very low	37	Very low	99 Å²	99	128 Å²	128	69%	0.692	68%	0.675	S	S	*	*	S	Bend	trans	-127.1	141	161.3	61.7	0	0	0	0	110.3	G534 F538	G534-S536 PolarHBondContact O-N 3.43Å; S536-F538 PolarHBondContact O-N 3.27Å
537	K	28.8	Very low	36	Very low	207 Å²	207	127.8 Å²	127.8	90%	0.9	68%	0.677	S	S	*	*			trans	-64.5	117.2	-167.4	-60.6	177.3	-178.5	178.4	0	111.7
538	F	28.8	Very low	35.4	Very low	189 Å²	189	126.8 Å²	126.8	83%	0.829	68%	0.677	S	S	*	*			trans	-146	83.1	164.6	-118	-78.7	0	0	0	113.1	S536 S540	S536-F538 PolarHBondContact O-N 3.27Å; F538-S540 PolarHBondContact O-N 2.93Å
539	S	28.4	Very low	34.9	Very low	128 Å²	128	126.7 Å²	126.7	90%	0.895	68%	0.676	S	S	*	*			trans	-94.2	82.2	176.1	-60	0	0	0	0	111.6
540	S	29.8	Very low	34.1	Very low	77 Å²	77	129.4 Å²	129.4	54%	0.538	68%	0.683	S	S	.	*			trans	-169.6	109.8	158.5	45.9	0	0	0	0	112.5	F538 Q542	F538-S540 PolarHBondContact O-N 2.93Å; S540-Q542 PolarHBondContact O-N 2.82Å
541	T	29.3	Very low	33.6	Very low	151 Å²	151	130.2 Å²	130.2	93%	0.926	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	71.2	-172.4	-46	0	0	0	0	112.6
542	Q	36.1	Very low	33.1	Very low	177 Å²	177	130.1 Å²	130.1	83%	0.827	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.7	-29.2	172.7	-113.7	163.9	20.5	0	0	117.1	S540	S540-Q542 PolarHBondContact O-N 2.82Å
543	N	31.2	Very low	32.6	Very low	112 Å²	112	127.6 Å²	127.6	60%	0.599	67%	0.674	S	S	*	*			trans	-97.3	-4.5	-162.7	-66.8	-11.4	0	0	0	117.1	A545 Q546	N543-A545 PolarHBondContact O-N 3.5Å; N543-Q546 PolarHBondContact O-N 2.89Å; N543-Q546 VanDerWaalsContact O-N 3.13Å
544	F	27.1	Very low	32.1	Very low	171 Å²	171	120.8 Å²	120.8	75%	0.75	66%	0.658	S	S	*	*	H	α-helix	trans	-66.9	-12.6	-172	-164.5	-105.3	0	0	0	115.1	Q546 S547 T548	F544-Q546 PolarHBondContact O-N 2.92Å; F544-S547 PolarHBondContact O-OG 3.05Å; F544-T548 PolarHBondContact O-OG1 3.47Å
545	A	34.2	Very low	31.9	Very low	84 Å²	84	123.5 Å²	123.5	69%	0.694	66%	0.658	S	S	*	*	H	α-helix	trans	-72.1	-15.5	174.4	0	0	0	0	0	113.7	N543	N543-A545 PolarHBondContact O-N 3.5Å
546	Q	33.7	Very low	31.9	Very low	139 Å²	139	119 Å²	119	65%	0.65	64%	0.643	S	S	*	*	H	α-helix	trans	-100.2	-29.1	-168.6	-158	161.8	-2.9	0	0	113.4	N543 F544 T548 L549	N543-Q546 PolarHBondContact O-N 2.89Å; N543-Q546 VanDerWaalsContact O-N 3.13Å; F544-Q546 PolarHBondContact O-N 2.92Å; Q546-T548 VanDerWaalsContact C-N 3.35Å; Q546-T548 PolarHBondContact O-N 2.81Å; Q546-L549 WeakPolarHBondContact O-CB 3.21Å; Q546-L549 PolarHBondContact O-N 3.27Å
547	S	31.8	Very low	31.9	Very low	57 Å²	57	117.9 Å²	117.9	40%	0.399	63%	0.632	S	S	.	*	H	α-helix	trans	-65.7	-34.7	173.2	40.6	0	0	0	0	112.9	F544 L549 Q550 Q551	F544-S547 PolarHBondContact O-OG 3.05Å; S547-L549 PolarHBondContact O-N 2.96Å; S547-Q550 PolarHBondContact O-N 3.39Å; S547-Q551 PolarHBondContact O-N 2.9Å
548	T	34.7	Very low	32	Very low	77 Å²	77	113.2 Å²	113.2	47%	0.472	62%	0.616	S	S	.	*	H	α-helix	trans	-68.1	-22	177.8	-38.3	0	0	0	0	112.4	F544 Q546 S552	F544-T548 PolarHBondContact O-OG1 3.47Å; Q546-T548 VanDerWaalsContact C-N 3.35Å; Q546-T548 PolarHBondContact O-N 2.81Å; T548-S552 PolarHBondContact O-N 3.38Å; T548-S552 VanDerWaalsContact O-N 3.11Å
549	L	32.6	Very low	32.3	Very low	109 Å²	109	106.1 Å²	106.1	57%	0.571	59%	0.59	S	S	*	*	H	α-helix	trans	-70.4	-38	173.5	-91.1	159.9	0	0	0	112.1	Q546 S547 Q551 S552 E553	Q546-L549 WeakPolarHBondContact O-CB 3.21Å; Q546-L549 PolarHBondContact O-N 3.27Å; S547-L549 PolarHBondContact O-N 2.96Å; L549-Q551 PolarHBondContact O-N 2.87Å; L549-S552 WeakPolarHBondContact O-CA 3.14Å; L549-S552 VanDerWaalsContact O-CB 3.29Å; L549-S552 WeakPolarHBondContact O-CB 3.49Å; L549-S552 PolarHBondContact O-N 3.42Å; L549-S552 PolarHBondContact O-OG 3.18Å; L549-E553 PolarHBondContact O-N 2.89Å
550	Q	32.1	Very low	32.4	Very low	143 Å²	143	106.4 Å²	106.4	67%	0.668	58%	0.575	S	S	*	*	H	α-helix	trans	-69.4	-31.7	175.7	-72.4	-176.9	-42.2	0	0	112.7	S547 S552 E553	S547-Q550 PolarHBondContact O-N 3.39Å; Q550-S552 VanDerWaalsContact C-N 3.28Å; Q550-S552 PolarHBondContact O-N 3.07Å; Q550-E553 WeakPolarHBondContact O-CB 3.5Å; Q550-E553 PolarHBondContact O-N 3.27Å
551	Q	34.5	Very low	32.5	Very low	140 Å²	140	111 Å²	111	65%	0.654	58%	0.582	S	S	*	*	H	α-helix	trans	-71.7	-21	167.5	-77	-172.9	-17.3	0	0	113.1	S547 L549 E553 S554 L555	S547-Q551 PolarHBondContact O-N 2.9Å; L549-Q551 PolarHBondContact O-N 2.87Å; Q551-E553 VanDerWaalsContact C-N 3.27Å; Q551-E553 PolarHBondContact O-N 2.61Å; Q551-S554 PolarHBondContact O-OG 3.03Å; Q551-L555 PolarHBondContact O-N 3.29Å
552	S	32.6	Very low	32.7	Very low	41 Å²	41	111.4 Å²	111.4	29%	0.287	57%	0.573	S	S	.	*	H	α-helix	trans	-71	-23.3	168.7	87.7	0	0	0	0	112.7	T548 L549 Q550 N556	T548-S552 PolarHBondContact O-N 3.38Å; T548-S552 VanDerWaalsContact O-N 3.11Å; L549-S552 WeakPolarHBondContact O-CA 3.14Å; L549-S552 VanDerWaalsContact O-CB 3.29Å; L549-S552 WeakPolarHBondContact O-CB 3.49Å; L549-S552 PolarHBondContact O-N 3.42Å; L549-S552 PolarHBondContact O-OG 3.18Å; Q550-S552 VanDerWaalsContact C-N 3.28Å; Q550-S552 PolarHBondContact O-N 3.07Å; S552-N556 WeakPolarHBondContact O-CB 3.33Å; S552-N556 PolarHBondContact O-N 3.01Å; S552-N556 PolarHBondContact O-ND2 3.01Å; S552-N556 VanDerWaalsContact O-ND2 3.15Å
553	E	31.7	Very low	32.5	Very low	122 Å²	122	112.6 Å²	112.6	57%	0.57	57%	0.57	S	S	*	*	H	α-helix	trans	-72.7	-38.4	175.2	-63	-174.8	122.5	0	0	112	L549 Q550 Q551 N556 V557	L549-E553 PolarHBondContact O-N 2.89Å; Q550-E553 WeakPolarHBondContact O-CB 3.5Å; Q550-E553 PolarHBondContact O-N 3.27Å; Q551-E553 VanDerWaalsContact C-N 3.27Å; Q551-E553 PolarHBondContact O-N 2.61Å; E553-N556 CarbonylContact O-C 3.51Å; E553-N556 WeakPolarHBondContact O-CA 3.48Å; E553-N556 WeakPolarHBondContact O-CB 3.43Å; E553-N556 PolarHBondContact O-N 3.09Å; E553-N556 VanDerWaalsContact O-N 3.1Å; E553-V557 PolarHBondContact O-N 3.04Å
554	S	33.4	Very low	32.4	Very low	73 Å²	73	113.5 Å²	113.5	51%	0.51	57%	0.571	S	S	.	*	H	α-helix	trans	-68.2	-34	172.7	65.4	0	0	0	0	112.5	Q551 N556 V557 L558	Q551-S554 PolarHBondContact O-OG 3.03Å; S554-N556 VanDerWaalsContact C-N 3.31Å; S554-V557 WeakPolarHBondContact O-CB 2.97Å; S554-V557 PolarHBondContact O-N 3.47Å; S554-L558 PolarHBondContact O-N 3.33Å; S554-L558 VanDerWaalsContact O-N 3.09Å
555	L	32.5	Very low	32.5	Very low	114 Å²	114	109.4 Å²	109.4	60%	0.597	56%	0.563	S	S	*	*	H	α-helix	trans	-69	-27.5	168.5	-68.5	176.1	0	0	0	112.8	Q551 L558 S559	Q551-L555 PolarHBondContact O-N 3.29Å; L555-L558 PolarHBondContact O-N 3.44Å; L555-S559 WeakPolarHBondContact O-CB 3.2Å; L555-S559 PolarHBondContact O-N 2.94Å
556	N	33.2	Very low	32.3	Very low	88 Å²	88	110.2 Å²	110.2	47%	0.471	56%	0.559	S	S	.	*	H	α-helix	trans	-76.5	-22.9	170.4	-84.4	-45.7	0	0	0	113.8	S552 E553 S554 S559 K560	S552-N556 WeakPolarHBondContact O-CB 3.33Å; S552-N556 PolarHBondContact O-N 3.01Å; S552-N556 PolarHBondContact O-ND2 3.01Å; S552-N556 VanDerWaalsContact O-ND2 3.15Å; E553-N556 CarbonylContact O-C 3.51Å; E553-N556 WeakPolarHBondContact O-CA 3.48Å; E553-N556 WeakPolarHBondContact O-CB 3.43Å; E553-N556 PolarHBondContact O-N 3.09Å; E553-N556 VanDerWaalsContact O-N 3.1Å; S554-N556 VanDerWaalsContact C-N 3.31Å; N556-S559 WeakPolarHBondContact CA-OG 3.47Å; N556-S559 PolarHBondContact O-OG 3.17Å; N556-S559 PolarHBondContact OD1-OG 2.9Å; N556-K560 WeakPolarHBondContact O-CB 3.41Å; N556-K560 VanDerWaalsContact O-CG 3.27Å; N556-K560 WeakPolarHBondContact O-CG 3.37Å; N556-K560 PolarHBondContact O-N 3.17Å
557	V	34.2	Very low	32.3	Very low	77 Å²	77	108.6 Å²	108.6	47%	0.467	56%	0.561	S	S	.	*	H	α-helix	trans	-67.9	-45.5	164.3	173.7	0	0	0	0	109.6	E553 S554 S559 K560 Y561	E553-V557 PolarHBondContact O-N 3.04Å; S554-V557 WeakPolarHBondContact O-CB 2.97Å; S554-V557 PolarHBondContact O-N 3.47Å; V557-S559 PolarHBondContact O-N 3.27Å; V557-K560 WeakPolarHBondContact O-CB 3.44Å; V557-K560 PolarHBondContact O-N 3.41Å; V557-Y561 HydrophobicContact CG1-CD2 3.94Å; V557-Y561 HydrophobicContact CG1-CE2 3.67Å; V557-Y561 VanDerWaalsContact O-CD2 3.26Å; V557-Y561 WeakPolarHBondContact O-CD2 3.38Å; V557-Y561 PolarHBondContact O-N 3.45Å
558	L	30.1	Very low	32	Very low	109 Å²	109	116.5 Å²	116.5	57%	0.571	58%	0.582	S	S	*	*	H	α-helix	trans	-62.7	-41	177	-147.5	74.2	0	0	0	112.2	S554 L555 Y561 Q562	S554-L558 PolarHBondContact O-N 3.33Å; S554-L558 VanDerWaalsContact O-N 3.09Å; L555-L558 PolarHBondContact O-N 3.44Å; L558-Y561 PolarHBondContact O-N 2.73Å; L558-Q562 PolarHBondContact O-N 2.91Å
559	S	34.6	Very low	31.6	Very low	39 Å²	39	120.5 Å²	120.5	27%	0.273	60%	0.6	S	S	.	*	H	α-helix	trans	-70.8	-27	176.5	83.8	0	0	0	0	113.4	L555 N556 V557 R563	L555-S559 WeakPolarHBondContact O-CB 3.2Å; L555-S559 PolarHBondContact O-N 2.94Å; N556-S559 WeakPolarHBondContact CA-OG 3.47Å; N556-S559 PolarHBondContact O-OG 3.17Å; N556-S559 PolarHBondContact OD1-OG 2.9Å; V557-S559 PolarHBondContact O-N 3.27Å; S559-R563 WeakPolarHBondContact O-CB 3.41Å; S559-R563 VanDerWaalsContact O-CG 3.32Å; S559-R563 WeakPolarHBondContact O-CG 3.26Å; S559-R563 PolarHBondContact O-N 3.4Å
560	K	31.6	Very low	31.4	Very low	135 Å²	135	120.7 Å²	120.7	59%	0.587	61%	0.605	S	S	*	*	H	α-helix	trans	-67	-46.4	168.5	-83	173.3	177.9	177.7	0	111.6	N556 V557 Q562 R563 Q564	N556-K560 WeakPolarHBondContact O-CB 3.41Å; N556-K560 VanDerWaalsContact O-CG 3.27Å; N556-K560 WeakPolarHBondContact O-CG 3.37Å; N556-K560 PolarHBondContact O-N 3.17Å; V557-K560 WeakPolarHBondContact O-CB 3.44Å; V557-K560 PolarHBondContact O-N 3.41Å; K560-Q562 VanDerWaalsContact C-N 3.29Å; K560-Q562 PolarHBondContact O-N 3.28Å; K560-R563 CarbonylContact O-C 3.56Å; K560-R563 PolarHBondContact O-N 3.03Å; K560-Q564 WeakPolarHBondContact O-CG 3.39Å; K560-Q564 PolarHBondContact O-N 3.33Å; K560-Q564 VanDerWaalsContact O-N 3.12Å
561	Y	32	Very low	31.1	Very low	172 Å²	172	121.5 Å²	121.5	68%	0.675	61%	0.609	S	S	*	*	H	α-helix	trans	-60.2	-39.2	174.8	-79.1	-68.5	0	0	0	112.1	V557 L558 R563 Q564	V557-Y561 HydrophobicContact CG1-CD2 3.94Å; V557-Y561 HydrophobicContact CG1-CE2 3.67Å; V557-Y561 VanDerWaalsContact O-CD2 3.26Å; V557-Y561 WeakPolarHBondContact O-CD2 3.38Å; V557-Y561 PolarHBondContact O-N 3.45Å; L558-Y561 PolarHBondContact O-N 2.73Å; Y561-R563 PolarHBondContact O-N 3.26Å; Y561-Q564 PolarHBondContact O-N 3.38Å
562	Q	32.4	Very low	30.9	Very low	160 Å²	160	121 Å²	121	75%	0.748	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	5.1	176	-156.2	171.7	-11	0	0	114.4	L558 K560	L558-Q562 PolarHBondContact O-N 2.91Å; K560-Q562 VanDerWaalsContact C-N 3.29Å; K560-Q562 PolarHBondContact O-N 3.28Å
563	R	31.4	Very low	30.7	Very low	202 Å²	202	127 Å²	127	76%	0.762	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.2	9	172.6	-70.8	-175.8	-176.5	-164	4.9	113.6	S559 K560 Y561	S559-R563 WeakPolarHBondContact O-CB 3.41Å; S559-R563 VanDerWaalsContact O-CG 3.32Å; S559-R563 WeakPolarHBondContact O-CG 3.26Å; S559-R563 PolarHBondContact O-N 3.4Å; K560-R563 CarbonylContact O-C 3.56Å; K560-R563 PolarHBondContact O-N 3.03Å; Y561-R563 PolarHBondContact O-N 3.26Å
564	Q	29.7	Very low	30.6	Very low	131 Å²	131	128.1 Å²	128.1	61%	0.612	64%	0.642	S	S	*	*			trans	-112.5	3.4	177	-75.7	-176.5	-17.2	0	0	113.7	K560 Y561 V566	K560-Q564 WeakPolarHBondContact O-CG 3.39Å; K560-Q564 PolarHBondContact O-N 3.33Å; K560-Q564 VanDerWaalsContact O-N 3.12Å; Y561-Q564 PolarHBondContact O-N 3.38Å; Q564-V566 PolarHBondContact O-N 3.33Å
565	S	30	Very low	30.5	Very low	85 Å²	85	130.5 Å²	130.5	59%	0.594	66%	0.655	S	S	*	*			trans	-78.7	63.3	166.9	61.2	0	0	0	0	111.3
566	V	29.8	Very low	30.2	Very low	101 Å²	101	128.7 Å²	128.7	61%	0.612	67%	0.665	S	S	*	*	S	Bend	trans	-128.9	129.8	161.1	178.3	0	0	0	0	104.6	Q564 R568	Q564-V566 PolarHBondContact O-N 3.33Å; V566-R568 PolarHBondContact O-N 3.34Å
567	P	32.5	Very low	30	Very low	105 Å²	105	132.3 Å²	132.3	68%	0.682	68%	0.684	S	S	*	*			trans	-62.1	110	-168.9	22.8	-33.5	0	0	0	111.4	L569	P567-L569 PolarHBondContact O-N 3.35Å
568	R	27	Very low	29.8	Very low	223 Å²	223	137 Å²	137	84%	0.842	70%	0.698	S	S	*	*			trans	-59.3	124.4	165.6	-84.5	-175.9	165.7	-175.3	-5.5	108	V566 V570	V566-R568 PolarHBondContact O-N 3.34Å; R568-V570 VanDerWaalsContact C-N 3.35Å; R568-V570 PolarHBondContact O-N 3.41Å
569	L	25.6	Very low	29.6	Very low	162 Å²	162	143 Å²	143	85%	0.848	71%	0.713	S	S	*	*			trans	-62	94.5	172.9	-172.7	72.7	0	0	0	109.1	P567 H571	P567-L569 PolarHBondContact O-N 3.35Å; L569-H571 PolarHBondContact O-N 3.46Å; L569-H571 VanDerWaalsContact O-N 3.12Å
570	V	29.4	Very low	29.3	Very low	113 Å²	113	148.1 Å²	148.1	69%	0.685	74%	0.737	S	S	*	*			trans	-71.5	107.2	174.2	177.8	0	0	0	0	107.2	R568 I572	R568-V570 VanDerWaalsContact C-N 3.35Å; R568-V570 PolarHBondContact O-N 3.41Å; V570-I572 VanDerWaalsContact C-N 3.32Å; V570-I572 HydrophobicContact CG1-CG1 4.15Å; V570-I572 PolarHBondContact O-N 2.88Å
571	H	25.7	Very low	29.2	Very low	159 Å²	159	149.5 Å²	149.5	74%	0.736	75%	0.745	S	S	*	*			trans	-69.9	90.9	174.3	-147.5	-88.3	0	0	0	108.3	L569 Q573	L569-H571 PolarHBondContact O-N 3.46Å; L569-H571 VanDerWaalsContact O-N 3.12Å; H571-Q573 PolarHBondContact O-N 2.9Å
572	I	30.6	Very low	29	Very low	129 Å²	129	146.8 Å²	146.8	66%	0.662	74%	0.742	S	S	*	*			trans	-69.2	106	178.9	-63.9	178	0	0	0	107.7	V570 L574	V570-I572 VanDerWaalsContact C-N 3.32Å; V570-I572 HydrophobicContact CG1-CG1 4.15Å; V570-I572 PolarHBondContact O-N 2.88Å; I572-L574 PolarHBondContact O-N 2.74Å
573	Q	27	Very low	28.8	Very low	167 Å²	167	146.2 Å²	146.2	78%	0.78	74%	0.74	S	S	*	*			trans	-68.1	92.4	173	-167.1	85.8	-19.6	0	0	108.8	H571	H571-Q573 PolarHBondContact O-N 2.9Å
574	L	30.9	Very low	28.7	Very low	146 Å²	146	144.6 Å²	144.6	76%	0.764	74%	0.741	S	S	*	*			trans	-62.5	136.1	175.3	-78.3	99.6	0	0	0	110.1	I572 G576	I572-L574 PolarHBondContact O-N 2.74Å; L574-G576 PolarHBondContact O-N 3.39Å
575	P	29.8	Very low	28.6	Very low	123 Å²	123	145.8 Å²	145.8	80%	0.799	75%	0.748	S	S	*	*			trans	-69	123.5	176.4	28.3	-33.4	0	0	0	110	N577	P575-N577 PolarHBondContact O-N 3.44Å
576	G	27.6	Very low	28.7	Very low	77 Å²	77	147 Å²	147	79%	0.794	76%	0.756	S	S	*	*			trans	-66.7	105.6	-177.3	0	0	0	0	0	112.6	L574	L574-G576 PolarHBondContact O-N 3.39Å
577	N	29	Very low	28.5	Very low	164 Å²	164	149.4 Å²	149.4	88%	0.877	77%	0.765	S	S	*	*			trans	-78.3	150.7	169	-159.2	3.5	0	0	0	110.5	P575	P575-N577 PolarHBondContact O-N 3.44Å
578	K	29.1	Very low	28.5	Very low	175 Å²	175	151 Å²	151	76%	0.761	77%	0.768	S	S	*	*			trans	-104.9	151.8	-171.8	-61.5	175.6	-179.2	176	0	111
579	R	27.2	Very low	28.6	Very low	234 Å²	234	149.1 Å²	149.1	88%	0.883	76%	0.762	S	S	*	*			trans	74.8	152.1	175.1	-52.5	171.5	176.4	168.1	-3.1	113.2
580	L	28	Very low	28.6	Very low	148 Å²	148	148.3 Å²	148.3	78%	0.775	75%	0.754	S	S	*	*			cis	-151.4	123.1	-6.5	-140.8	60.6	0	0	0	105.3
581	H	27.8	Very low	28.4	Very low	163 Å²	163	151 Å²	151	76%	0.755	76%	0.756	S	S	*	*				79.3	153.3	103	-162.1	68.4	0	0	0	115.7
582	N	28.9	Very low	28.4	Very low	116 Å²	116	148.8 Å²	148.8	62%	0.62	76%	0.759	S	S	*	*			trans	68.2	145.9	-174	-63.1	-14.4	0	0	0	116.7
583	Q	28.6	Very low	28.4	Very low	148 Å²	148	147.3 Å²	147.3	69%	0.692	76%	0.756	S	S	*	*			cis	-167.8	137.2	-26.1	-119.9	166.8	2.1	0	0	108
584	Q	28.7	Very low	28.3	Very low	167 Å²	167	146.8 Å²	146.8	78%	0.78	76%	0.758	S	S	*	*			trans	62.2	155.4	169	-75.3	154.7	-47.8	0	0	115.9
585	M	27.7	Very low	28.1	Very low	156 Å²	156	150 Å²	150	77%	0.768	76%	0.762	S	S	*	*			cis	-146	173.9	4.4	-121.9	-76.7	-177.4	0	0	109.8
586	C	32.1	Very low	27.9	Very low	112 Å²	112	149.9 Å²	149.9	76%	0.757	76%	0.759	S	S	*	*			trans	63.2	81.6	168.4	-60.4	0	0	0	0	118.6
587	N	25.5	Very low	27.8	Very low	151 Å²	151	155 Å²	155	81%	0.807	76%	0.76	S	S	*	*			trans	-58.2	152.2	133.9	-64	-35.1	0	0	0	109.4
588	N	31.8	Very low	27.7	Very low	138 Å²	138	152 Å²	152	74%	0.738	75%	0.747	S	S	*	*			trans	-177	131.1	135.5	-97.3	-9.8	0	0	0	113.1
589	Y	28.9	Very low	27.8	Very low	184 Å²	184	150.1 Å²	150.1	72%	0.722	75%	0.746	S	S	*	*			trans	43.8	109	155.8	-58.1	-72.2	0	0	0	119.4
590	E	27	Very low	27.8	Very low	144 Å²	144	148.5 Å²	148.5	67%	0.673	74%	0.74	S	S	*	*				77.8	132.3	76.7	-73.7	-152.9	120.2	0	0	113.1
591	K	24.9	Very low	27.9	Very low	170 Å²	170	146.4 Å²	146.4	74%	0.739	73%	0.73	S	S	*	*			cis	83.3	123.2	39.6	-165.7	-167.2	-173.7	-169.9	0	110.8
592	S	25.5	Very low	28	Very low	112 Å²	112	146.5 Å²	146.5	78%	0.783	73%	0.73	S	S	*	*			trans	66.2	157.5	-156.3	84.5	0	0	0	0	112.2
593	T	29.7	Very low	28.2	Very low	98 Å²	98	149.2 Å²	149.2	60%	0.601	74%	0.742	S	S	*	*			cis	-124.3	157.5	13.7	48.5	0	0	0	0	113.7	Y595	T593-Y595 HydrophobicContact CG2-CD2 4.46Å; T593-Y595 HydrophobicContact CG2-CE2 4.16Å
594	N	25	Very low	28.3	Very low	157 Å²	157	146.2 Å²	146.2	84%	0.84	74%	0.738	S	S	*	*			trans	-78.8	133.9	152	-60.5	-54.6	0	0	0	107.3
595	Y	27.5	Very low	28.4	Very low	212 Å²	212	145.9 Å²	145.9	83%	0.831	74%	0.742	S	S	*	*			trans	-142	146.7	154.3	-90.5	-68	0	0	0	112.2	T593	T593-Y595 HydrophobicContact CG2-CD2 4.46Å; T593-Y595 HydrophobicContact CG2-CE2 4.16Å
596	T	25.8	Very low	28.4	Very low	122 Å²	122	144.8 Å²	144.8	75%	0.748	74%	0.735	S	S	*	*			trans	-104.2	149.8	-169.7	45.2	0	0	0	0	112.2
597	F	24.8	Very low	28.6	Very low	183 Å²	183	147.7 Å²	147.7	80%	0.803	74%	0.741	S	S	*	*			trans	33.2	134	131.9	-163	-107.9	0	0	0	120.6
598	T	27.8	Very low	28.9	Very low	101 Å²	101	147.9 Å²	147.9	62%	0.62	74%	0.735	S	S	*	*			trans	62.7	137	174.7	39.8	0	0	0	0	115
599	D	30.5	Very low	28.7	Very low	136 Å²	136	146.5 Å²	146.5	73%	0.727	73%	0.733	S	S	*	*			cis	-119.2	166.3	30	-99.9	-28.5	0	0	0	113.2
600	R	27.7	Very low	29.1	Very low	200 Å²	200	144.3 Å²	144.3	76%	0.755	74%	0.741	S	S	*	*				54.1	141.3	66.6	-59.1	-121.8	-141.8	170.8	5	114.2
601	D	29.1	Very low	29.2	Very low	105 Å²	105	142.7 Å²	142.7	56%	0.561	75%	0.746	S	S	*	*			cis	-150.2	161.3	-13.2	-102	-15.9	0	0	0	107.8
602	H	29.6	Very low	29.3	Very low	164 Å²	164	142.3 Å²	142.3	76%	0.759	75%	0.75	S	S	*	*			trans	38.5	121.5	162.2	-62.8	-63	0	0	0	122.1
603	I	34.6	Very low	29.6	Very low	173 Å²	173	143.4 Å²	143.4	89%	0.887	75%	0.752	S	S	*	*				-162.3	143.7	118.5	-96.9	150.2	0	0	0	108
604	S	29.8	Very low	29.4	Very low	86 Å²	86	147 Å²	147	60%	0.601	76%	0.762	S	S	*	*			trans	-124.1	169.5	-174.3	-61.1	0	0	0	0	112.1
605	D	30.5	Very low	29.7	Very low	159 Å²	159	143.7 Å²	143.7	85%	0.85	76%	0.757	S	S	*	*			trans	69.7	155.2	161.5	-45.5	-44.9	0	0	0	116
606	E	28.8	Very low	29.8	Very low	134 Å²	134	140.1 Å²	140.1	63%	0.626	76%	0.757	S	S	*	*			cis	-145.7	130.1	-2.1	-168.2	-161.3	156.5	0	0	109.8	K608	E606-K608 WeakPolarHBondContact OE1-CE 3.48Å; E606-K608 WeakPolarHBondContact OE1-CG 3.44Å; E606-K608 IonicContact OE1-NZ 2.74Å; E606-K608 PolarHBondContact OE1-NZ 2.98Å; E606-K608 IonicContact OE2-NZ 3.72Å
607	I	35.7	Very low	30	Very low	173 Å²	173	137.8 Å²	137.8	89%	0.887	76%	0.757	S	S	*	*			trans	-137.7	127	158.6	-61.4	-174.7	0	0	0	109.8
608	K	31.8	Very low	30.2	Very low	155 Å²	155	138 Å²	138	67%	0.674	76%	0.76	S	S	*	*			trans	-79.2	158.4	-169.9	-77.2	-178.4	168.1	74.9	0	115	E606	E606-K608 WeakPolarHBondContact OE1-CE 3.48Å; E606-K608 WeakPolarHBondContact OE1-CG 3.44Å; E606-K608 IonicContact OE1-NZ 2.74Å; E606-K608 PolarHBondContact OE1-NZ 2.98Å; E606-K608 IonicContact OE2-NZ 3.72Å
609	P	28	Very low	30.5	Very low	108 Å²	108	140.4 Å²	140.4	70%	0.701	77%	0.769	S	S	*	*			trans	-72.4	156.6	165	33.3	-36.3	0	0	0	111.9	S611	P609-S611 PolarHBondContact O-N 3.27Å
610	P	36.6	Very low	30.5	Very low	138 Å²	138	142 Å²	142	90%	0.896	78%	0.778	S	S	*	*			trans	-74.9	110.7	179.2	29.6	-33.8	0	0	0	112
611	S	30.1	Very low	30.6	Very low	110 Å²	110	137.7 Å²	137.7	77%	0.769	78%	0.779	S	S	*	*			trans	-90.9	149.5	170.1	55.7	0	0	0	0	112.3	P609	P609-S611 PolarHBondContact O-N 3.27Å
612	I	26.1	Very low	31	Very low	163 Å²	163	137.6 Å²	137.6	84%	0.836	78%	0.778	S	S	*	*			trans	-60.2	138.8	-177.6	-62.9	160	0	0	0	112.4
613	V	31.2	Very low	31.1	Very low	134 Å²	134	138.3 Å²	138.3	81%	0.812	78%	0.779	S	S	*	*			trans	-133.1	148.6	159.8	-179.9	0	0	0	0	108.4
614	Q	26.7	Very low	31.2	Very low	173 Å²	173	137.5 Å²	137.5	81%	0.808	78%	0.777	S	S	*	*			trans	-94.9	145	-164.2	-61.8	151.2	-82.6	0	0	114.3
615	A	31.9	Very low	31.4	Very low	89 Å²	89	140.7 Å²	140.7	74%	0.736	78%	0.78	S	S	*	*			trans	-144.6	108.7	146.3	0	0	0	0	0	106.1
616	T	28.8	Very low	31.4	Very low	137 Å²	137	139.2 Å²	139.2	84%	0.84	77%	0.771	S	S	*	*				59	105.1	73.2	68.5	0	0	0	0	113.2
617	G	29.3	Very low	31.6	Very low	72 Å²	72	142.6 Å²	142.6	74%	0.742	78%	0.784	S	S	*	*			trans	133.7	91	173.3	0	0	0	0	0	114.5
618	E	30.1	Very low	31.3	Very low	187 Å²	187	142.9 Å²	142.9	87%	0.874	78%	0.779	S	S	*	*			trans	15.9	101	137.2	-65.9	154.6	169.7	0	0	118.1
619	D	34.5	Very low	31	Very low	152 Å²	152	146.8 Å²	146.8	81%	0.813	79%	0.789	S	S	*	*				175.4	118	99.1	-96.8	-16.1	0	0	0	113.1
620	N	28.9	Very low	30.9	Very low	171 Å²	171	146.8 Å²	146.8	91%	0.914	79%	0.789	S	S	*	*			trans	-112	105.7	179.9	-86.4	-56.7	0	0	0	111.6
621	S	31.3	Very low	30.4	Very low	109 Å²	109	152.3 Å²	152.3	76%	0.762	79%	0.793	S	S	*	*			trans	-157.6	42.2	173.4	58.9	0	0	0	0	118.9
622	D	35.8	Very low	30.2	Very low	102 Å²	102	150.5 Å²	150.5	55%	0.545	78%	0.784	S	S	.	*	S	Bend	trans	-159	-15.1	154.4	-122.6	-3.5	0	0	0	119.8	D624 K625	D622-D624 VanDerWaalsContact C-N 3.26Å; D622-D624 PolarHBondContact O-N 3.47Å; D622-D624 VanDerWaalsContact O-N 3.08Å; D622-K625 PolarHBondContact O-N 3.26Å; D622-K625 VanDerWaalsContact O-N 3.16Å; D622-K625 WeakPolarHBondContact OD1-CD 3.5Å; D622-K625 WeakPolarHBondContact OD1-CE 3.35Å; D622-K625 IonicContact OD1-NZ 2.9Å; D622-K625 PolarHBondContact OD1-NZ 3.11Å
623	F	31.9	Very low	30.2	Very low	179 Å²	179	151.7 Å²	151.7	79%	0.785	78%	0.784	S	S	*	*	G	3₁₀ helix	trans	-62.7	-24	-168.6	-95.8	-86.2	0	0	0	116	K625 L626	F623-K625 PolarHBondContact O-N 3.07Å; F623-L626 HydrophobicContact CD1-CD1 4.13Å; F623-L626 HydrophobicContact CE1-CD1 4.15Å; F623-L626 PolarHBondContact O-N 3.44Å
624	D	36.4	Very low	30	Very low	157 Å²	157	151.3 Å²	151.3	84%	0.84	79%	0.787	S	S	*	*	G	3₁₀ helix	trans	-76.3	0.4	179.4	-117.3	-11.8	0	0	0	114.8	D622	D622-D624 VanDerWaalsContact C-N 3.26Å; D622-D624 PolarHBondContact O-N 3.47Å; D622-D624 VanDerWaalsContact O-N 3.08Å
625	K	35.3	Very low	30.2	Very low	152 Å²	152	149.8 Å²	149.8	66%	0.661	78%	0.783	S	S	*	*	G	3₁₀ helix	trans	-93.3	-14.2	172.4	-66	-178.3	-163.1	136.9	0	113.9	D622 F623	D622-K625 PolarHBondContact O-N 3.26Å; D622-K625 VanDerWaalsContact O-N 3.16Å; D622-K625 WeakPolarHBondContact OD1-CD 3.5Å; D622-K625 WeakPolarHBondContact OD1-CE 3.35Å; D622-K625 IonicContact OD1-NZ 2.9Å; D622-K625 PolarHBondContact OD1-NZ 3.11Å; F623-K625 PolarHBondContact O-N 3.07Å
626	L	30.7	Very low	30.1	Very low	128 Å²	128	149 Å²	149	67%	0.67	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-21.3	-172.5	-83	161.1	0	0	0	114.5	F623 K628	F623-L626 HydrophobicContact CD1-CD1 4.13Å; F623-L626 HydrophobicContact CE1-CD1 4.15Å; F623-L626 PolarHBondContact O-N 3.44Å; L626-K628 VanDerWaalsContact C-N 3.32Å; L626-K628 PolarHBondContact O-N 2.85Å
627	F	31.7	Very low	30.3	Very low	205 Å²	205	146.9 Å²	146.9	90%	0.899	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	22.9	177.6	-91.4	-80.8	0	0	0	115.2
628	K	30.2	Very low	30.4	Very low	179 Å²	179	150.7 Å²	150.7	78%	0.778	75%	0.754	S	S	*	*			trans	-119.7	78	174	-76.2	177.3	179.3	164.8	0	112.6	L626	L626-K628 VanDerWaalsContact C-N 3.32Å; L626-K628 PolarHBondContact O-N 2.85Å
629	R	26.1	Very low	30.8	Very low	237 Å²	237	147.4 Å²	147.4	89%	0.894	74%	0.738	S	S	*	*			trans	-126.7	154.3	163	-77.6	-165.4	178.4	-171.2	2.9	111.4
630	P	26.2	Very low	30.8	Very low	108 Å²	108	146.2 Å²	146.2	70%	0.701	73%	0.728	S	S	*	*				-93.9	149.2	-125.3	32	-37.2	0	0	0	116	A632	P630-A632 VanDerWaalsContact C-N 3.35Å; P630-A632 HydrophobicContact CB-CB 4.39Å; P630-A632 HydrophobicContact CG-CB 4.18Å; P630-A632 PolarHBondContact O-N 2.7Å
631	R	25.3	Very low	30.9	Very low	255 Å²	255	144.2 Å²	144.2	96%	0.962	71%	0.708	S	S	*	*			trans	-67.2	91.7	159.1	-74.2	-177.6	-78.2	-158.9	-4.3	109.1
632	A	25.1	Very low	31	Very low	72 Å²	72	141.7 Å²	141.7	60%	0.595	69%	0.69	S	S	*	*			trans	-122.9	48	-171.7	0	0	0	0	0	113.6	P630	P630-A632 VanDerWaalsContact C-N 3.35Å; P630-A632 HydrophobicContact CB-CB 4.39Å; P630-A632 HydrophobicContact CG-CB 4.18Å; P630-A632 PolarHBondContact O-N 2.7Å
633	F	27.2	Very low	31.3	Very low	188 Å²	188	139 Å²	139	83%	0.825	68%	0.679	S	S	*	*			trans	-136.4	69.1	157.7	-98.5	-73.1	0	0	0	110.1	L635	F633-L635 PolarHBondContact O-N 3.44Å; F633-L635 VanDerWaalsContact O-N 3.11Å
634	S	26.4	Very low	31.5	Very low	126 Å²	126	134.1 Å²	134.1	88%	0.881	66%	0.661	S	S	*	*			trans	-81.6	62	166.9	-178.7	0	0	0	0	110.2
635	L	31.5	Very low	31.7	Very low	140 Å²	140	132.8 Å²	132.8	73%	0.733	65%	0.649	S	S	*	*	S	Bend	trans	-118	134.7	162.2	-123.6	77.8	0	0	0	107.7	F633 P637	F633-L635 PolarHBondContact O-N 3.44Å; F633-L635 VanDerWaalsContact O-N 3.11Å; L635-P637 WeakPolarHBondContact O-CD 3.21Å
636	N	28.5	Very low	32.1	Very low	74 Å²	74	130.1 Å²	130.1	40%	0.396	64%	0.642	S	S	.	*			trans	-59.1	119	-171.9	-176.9	2.3	0	0	0	110.8	Q638 E639	N636-Q638 PolarHBondContact O-N 2.77Å; N636-Q638 VanDerWaalsContact O-N 3.1Å; N636-Q638 WeakPolarHBondContact OD1-CB 3.49Å; N636-Q638 PolarHBondContact OD1-N 3.21Å; N636-Q638 VanDerWaalsContact OD1-N 3.16Å; N636-E639 HydrophobicContact CB-CG 4.24Å; N636-E639 WeakPolarHBondContact CB-OE1 3.39Å; N636-E639 PolarHBondContact ND2-OE1 2.81Å; N636-E639 PolarHBondContact O-N 3.41Å
637	P	33.9	Very low	32.9	Very low	91 Å²	91	130.1 Å²	130.1	59%	0.591	64%	0.637	S	S	*	*	H	α-helix	trans	-55.1	-33.7	179.2	-26.4	35.1	0	0	0	112.5	L635 E639 H640 W641	L635-P637 WeakPolarHBondContact O-CD 3.21Å; P637-E639 PolarHBondContact O-N 2.73Å; P637-H640 PolarHBondContact O-N 3.12Å; P637-W641 PolarHBondContact O-N 3.22Å; P637-W641 VanDerWaalsContact O-N 3.11Å
638	Q	32.4	Very low	33.5	Very low	152 Å²	152	124.4 Å²	124.4	71%	0.71	61%	0.613	S	S	*	*	H	α-helix	trans	-68.2	-31.7	-172.2	-150.8	150.6	-24.7	0	0	113.2	N636 W641 S642	N636-Q638 PolarHBondContact O-N 2.77Å; N636-Q638 VanDerWaalsContact O-N 3.1Å; N636-Q638 WeakPolarHBondContact OD1-CB 3.49Å; N636-Q638 PolarHBondContact OD1-N 3.21Å; N636-Q638 VanDerWaalsContact OD1-N 3.16Å; Q638-W641 PolarHBondContact O-N 3.01Å; Q638-S642 PolarHBondContact O-N 3.05Å
639	E	37.2	Very low	34.1	Very low	118 Å²	118	122.2 Å²	122.2	55%	0.551	60%	0.604	S	S	*	*	H	α-helix	trans	-76.4	-30.3	176.8	-71.4	158.5	-136.1	0	0	112.6	N636 P637 S642 S643	N636-E639 HydrophobicContact CB-CG 4.24Å; N636-E639 WeakPolarHBondContact CB-OE1 3.39Å; N636-E639 PolarHBondContact ND2-OE1 2.81Å; N636-E639 PolarHBondContact O-N 3.41Å; P637-E639 PolarHBondContact O-N 2.73Å; E639-S642 PolarHBondContact O-OG 2.73Å; E639-S642 VanDerWaalsContact O-OG 3.13Å; E639-S643 PolarHBondContact O-N 3.2Å
640	H	34.5	Very low	35	Very low	128 Å²	128	116.9 Å²	116.9	59%	0.593	59%	0.589	S	S	*	*	H	α-helix	trans	-73.1	-33.7	171.6	-173.2	-109.4	0	0	0	111.4	P637 L644	P637-H640 PolarHBondContact O-N 3.12Å; H640-L644 WeakPolarHBondContact CE1-CD1 3.33Å; H640-L644 WeakPolarHBondContact O-CB 3.35Å; H640-L644 PolarHBondContact O-N 2.87Å
641	W	31.2	Very low	36	Very low	129 Å²	129	113.9 Å²	113.9	49%	0.489	57%	0.571	S	S	.	*	H	α-helix	trans	-64.5	-49.4	175.5	-76.8	117.8	0	0	0	112.8	P637 Q638 L644 Q645	P637-W641 PolarHBondContact O-N 3.22Å; P637-W641 VanDerWaalsContact O-N 3.11Å; Q638-W641 PolarHBondContact O-N 3.01Å; W641-L644 PolarHBondContact O-N 3.28Å; W641-Q645 WeakPolarHBondContact O-CG 3.23Å; W641-Q645 PolarHBondContact O-N 3.4Å
642	S	34.6	Very low	36.7	Very low	55 Å²	55	106.8 Å²	106.8	39%	0.385	55%	0.551	S	S	.	*	H	α-helix	trans	-59.4	-51.3	178.4	53.8	0	0	0	0	111.7	Q638 E639 L644 Q645 D646	Q638-S642 PolarHBondContact O-N 3.05Å; E639-S642 PolarHBondContact O-OG 2.73Å; E639-S642 VanDerWaalsContact O-OG 3.13Å; S642-L644 PolarHBondContact O-N 2.91Å; S642-L644 VanDerWaalsContact O-N 3.13Å; S642-Q645 WeakPolarHBondContact O-CB 3.36Å; S642-Q645 PolarHBondContact O-N 3.08Å; S642-D646 PolarHBondContact O-N 3.29Å
643	S	40.1	Very low	37.6	Very low	45 Å²	45	105.5 Å²	105.5	32%	0.315	53%	0.534	S	S	.	.	H	α-helix	trans	-61.1	-27.8	-179.4	-157.6	0	0	0	0	113.7	E639 K647	E639-S643 PolarHBondContact O-N 3.2Å; S643-K647 WeakPolarHBondContact O-CB 3.3Å; S643-K647 VanDerWaalsContact O-CD 3.24Å; S643-K647 WeakPolarHBondContact O-CD 3.42Å; S643-K647 VanDerWaalsContact O-CG 3.22Å; S643-K647 WeakPolarHBondContact O-CG 3.47Å; S643-K647 PolarHBondContact O-N 3.45Å; S643-K647 PolarHBondContact OG-NZ 3.2Å
644	L	37.6	Very low	38.4	Very low	77 Å²	77	102.1 Å²	102.1	40%	0.403	52%	0.524	S	S	.	.	H	α-helix	trans	-78.1	-39.5	172.3	-106.4	159.9	0	0	0	112.7	H640 W641 S642 Q648	H640-L644 WeakPolarHBondContact CE1-CD1 3.33Å; H640-L644 WeakPolarHBondContact O-CB 3.35Å; H640-L644 PolarHBondContact O-N 2.87Å; W641-L644 PolarHBondContact O-N 3.28Å; S642-L644 PolarHBondContact O-N 2.91Å; S642-L644 VanDerWaalsContact O-N 3.13Å; L644-Q648 WeakPolarHBondContact O-CB 3.48Å; L644-Q648 VanDerWaalsContact O-CG 3.31Å; L644-Q648 WeakPolarHBondContact O-CG 3.39Å; L644-Q648 PolarHBondContact O-N 3.43Å
645	Q	39.8	Very low	39.1	Very low	130 Å²	130	102.3 Å²	102.3	61%	0.607	51%	0.511	S	S	*	.	H	α-helix	trans	-60.3	-48	173.8	-75	-179.2	-104.3	0	0	110.9	W641 S642 K647 Q648 F649	W641-Q645 WeakPolarHBondContact O-CG 3.23Å; W641-Q645 PolarHBondContact O-N 3.4Å; S642-Q645 WeakPolarHBondContact O-CB 3.36Å; S642-Q645 PolarHBondContact O-N 3.08Å; Q645-K647 PolarHBondContact O-N 2.97Å; Q645-Q648 PolarHBondContact O-N 3.01Å; Q645-F649 WeakPolarHBondContact O-CB 3.25Å; Q645-F649 PolarHBondContact O-N 3.49Å
646	D	44.5	Very low	39.5	Very low	95 Å²	95	98.2 Å²	98.2	51%	0.508	49%	0.494	S	S	.	.	H	α-helix	trans	-60	-46.1	179.2	-65	-37.2	0	0	0	112.1	S642 Q648 F649 Q650	S642-D646 PolarHBondContact O-N 3.29Å; D646-Q648 VanDerWaalsContact C-N 3.35Å; D646-Q648 PolarHBondContact O-N 3.16Å; D646-F649 PolarHBondContact O-N 2.88Å; D646-Q650 WeakPolarHBondContact O-CB 3.49Å; D646-Q650 WeakPolarHBondContact O-CG 3.41Å; D646-Q650 PolarHBondContact O-N 3.14Å
647	K	46.8	Very low	40.2	Very low	129 Å²	129	99.9 Å²	99.9	56%	0.561	50%	0.499	S	S	*	.	H	α-helix	trans	-66.3	-34.6	178.7	-72.1	167.8	-173.8	142.8	0	112.4	S643 Q645 S651	S643-K647 WeakPolarHBondContact O-CB 3.3Å; S643-K647 VanDerWaalsContact O-CD 3.24Å; S643-K647 WeakPolarHBondContact O-CD 3.42Å; S643-K647 VanDerWaalsContact O-CG 3.22Å; S643-K647 WeakPolarHBondContact O-CG 3.47Å; S643-K647 PolarHBondContact O-N 3.45Å; S643-K647 PolarHBondContact OG-NZ 3.2Å; Q645-K647 PolarHBondContact O-N 2.97Å; K647-S651 WeakPolarHBondContact O-CB 3.47Å; K647-S651 PolarHBondContact O-N 3.34Å
648	Q	43.8	Very low	40.5	Very low	85 Å²	85	99.2 Å²	99.2	40%	0.397	50%	0.497	S	S	.	.	H	α-helix	trans	-70.9	-42.2	171.7	-70.7	-64	-87.9	0	0	111.7	L644 Q645 D646 S651 L652	L644-Q648 WeakPolarHBondContact O-CB 3.48Å; L644-Q648 VanDerWaalsContact O-CG 3.31Å; L644-Q648 WeakPolarHBondContact O-CG 3.39Å; L644-Q648 PolarHBondContact O-N 3.43Å; Q645-Q648 PolarHBondContact O-N 3.01Å; D646-Q648 VanDerWaalsContact C-N 3.35Å; D646-Q648 PolarHBondContact O-N 3.16Å; Q648-S651 PolarHBondContact O-N 2.92Å; Q648-S651 VanDerWaalsContact O-N 3.16Å; Q648-S651 PolarHBondContact O-OG 3.01Å; Q648-L652 PolarHBondContact O-N 2.75Å
649	F	42.4	Very low	40.9	Very low	132 Å²	132	96.2 Å²	96.2	58%	0.579	49%	0.489	S	S	*	.	H	α-helix	trans	-65.6	-44.2	-179.1	-161.8	-102.5	0	0	0	112	Q645 D646 S651 L652 L653	Q645-F649 WeakPolarHBondContact O-CB 3.25Å; Q645-F649 PolarHBondContact O-N 3.49Å; D646-F649 PolarHBondContact O-N 2.88Å; F649-S651 VanDerWaalsContact C-N 3.3Å; F649-S651 PolarHBondContact O-N 3.28Å; F649-L652 PolarHBondContact O-N 3.05Å; F649-L653 HydrophobicContact CD1-CD1 3.86Å; F649-L653 HydrophobicContact CD1-CG 4.42Å; F649-L653 HydrophobicContact CE1-CD1 3.77Å; F649-L653 HydrophobicContact CE1-CG 4.35Å; F649-L653 PolarHBondContact O-N 3.38Å
650	Q	47	Very low	41.1	Very low	126 Å²	126	95 Å²	95	59%	0.589	49%	0.49	S	S	*	.	H	α-helix	trans	-59.8	-38.6	170.9	-71.2	-175.5	13.6	0	0	112.3	D646 L652 L653 L654	D646-Q650 WeakPolarHBondContact O-CB 3.49Å; D646-Q650 WeakPolarHBondContact O-CG 3.41Å; D646-Q650 PolarHBondContact O-N 3.14Å; Q650-L652 VanDerWaalsContact C-N 3.35Å; Q650-L652 PolarHBondContact O-N 3.38Å; Q650-L653 PolarHBondContact O-N 3.49Å; Q650-L654 PolarHBondContact O-N 3.39Å
651	S	46.5	Very low	41.3	Very low	45 Å²	45	97.5 Å²	97.5	32%	0.315	50%	0.499	S	S	.	.	H	α-helix	trans	-66.9	-34.4	177	79.4	0	0	0	0	113.1	K647 Q648 F649 Q655	K647-S651 WeakPolarHBondContact O-CB 3.47Å; K647-S651 PolarHBondContact O-N 3.34Å; Q648-S651 PolarHBondContact O-N 2.92Å; Q648-S651 VanDerWaalsContact O-N 3.16Å; Q648-S651 PolarHBondContact O-OG 3.01Å; F649-S651 VanDerWaalsContact C-N 3.3Å; F649-S651 PolarHBondContact O-N 3.28Å; S651-Q655 WeakPolarHBondContact O-CG 3.36Å; S651-Q655 PolarHBondContact O-N 3.19Å; S651-Q655 VanDerWaalsContact O-N 3.15Å
652	L	40.6	Very low	41.5	Very low	106 Å²	106	98.2 Å²	98.2	56%	0.555	51%	0.511	S	S	*	.	H	α-helix	trans	-71.5	-39.6	174.5	-74	168.1	0	0	0	111.9	Q648 F649 Q650 Q655 S656	Q648-L652 PolarHBondContact O-N 2.75Å; F649-L652 PolarHBondContact O-N 3.05Å; Q650-L652 VanDerWaalsContact C-N 3.35Å; Q650-L652 PolarHBondContact O-N 3.38Å; L652-Q655 PolarHBondContact O-N 3.5Å; L652-S656 PolarHBondContact O-N 3.5Å
653	L	43.1	Very low	41.7	Very low	45 Å²	45	100.8 Å²	100.8	24%	0.236	53%	0.525	C	S	.	.	H	α-helix	trans	-63	-47.2	174.9	-74.6	174.2	0	0	0	111.7	F649 Q650 Q655 S656 E657 L691	F649-L653 HydrophobicContact CD1-CD1 3.86Å; F649-L653 HydrophobicContact CD1-CG 4.42Å; F649-L653 HydrophobicContact CE1-CD1 3.77Å; F649-L653 HydrophobicContact CE1-CG 4.35Å; F649-L653 PolarHBondContact O-N 3.38Å; Q650-L653 PolarHBondContact O-N 3.49Å; L653-Q655 PolarHBondContact O-N 2.76Å; L653-S656 PolarHBondContact O-N 3.32Å; L653-S656 PolarHBondContact O-OG 3.3Å; L653-E657 PolarHBondContact O-N 2.99Å; L653-L691 HydrophobicContact CD1-CD1 4.29Å; L653-L691 HydrophobicContact CD2-CD1 3.73Å
654	L	44.2	Very low	41.5	Very low	117 Å²	117	108.1 Å²	108.1	61%	0.613	55%	0.551	S	S	*	*	H	α-helix	trans	-60.8	-30.1	174.3	-76.8	166.1	0	0	0	113	Q650 S658	Q650-L654 PolarHBondContact O-N 3.39Å; L654-S658 PolarHBondContact O-N 3.45Å
655	Q	40.3	Very low	41.5	Very low	130 Å²	130	107.4 Å²	107.4	61%	0.607	56%	0.562	S	S	*	*	H	α-helix	trans	-71.2	-42.4	169.6	-73.7	-160.2	-89.8	0	0	112.3	S651 L652 L653 S658 T659	S651-Q655 WeakPolarHBondContact O-CG 3.36Å; S651-Q655 PolarHBondContact O-N 3.19Å; S651-Q655 VanDerWaalsContact O-N 3.15Å; L652-Q655 PolarHBondContact O-N 3.5Å; L653-Q655 PolarHBondContact O-N 2.76Å; Q655-S658 PolarHBondContact O-N 2.96Å; Q655-S658 PolarHBondContact O-OG 3.5Å; Q655-T659 PolarHBondContact O-N 3.31Å
656	S	40.4	Very low	41.2	Very low	53 Å²	53	109.1 Å²	109.1	37%	0.371	58%	0.575	S	S	.	*	H	α-helix	trans	-66	-42.9	179.1	68.5	0	0	0	0	113.1	L652 L653 S658 T659 T660	L652-S656 PolarHBondContact O-N 3.5Å; L653-S656 PolarHBondContact O-N 3.32Å; L653-S656 PolarHBondContact O-OG 3.3Å; S656-S658 PolarHBondContact O-N 2.97Å; S656-T659 PolarHBondContact O-N 3.28Å; S656-T659 PolarHBondContact O-OG1 3.33Å; S656-T660 PolarHBondContact O-N 2.97Å
657	E	42.3	Very low	40.7	Very low	109 Å²	109	113.2 Å²	113.2	51%	0.509	59%	0.591	S	S	.	*	H	α-helix	trans	-62.6	-25.6	174.8	-70.9	-177.4	176.7	0	0	113.1	L653 T659 T660	L653-E657 PolarHBondContact O-N 2.99Å; E657-T659 VanDerWaalsContact C-N 3.32Å; E657-T660 PolarHBondContact O-OG1 3.43Å
658	S	40.8	Very low	40	Very low	78 Å²	78	113.7 Å²	113.7	55%	0.545	61%	0.605	S	S	.	*	H	α-helix	trans	-71.9	-26.3	172.4	81.2	0	0	0	0	112.9	L654 Q655 S656	L654-S658 PolarHBondContact O-N 3.45Å; Q655-S658 PolarHBondContact O-N 2.96Å; Q655-S658 PolarHBondContact O-OG 3.5Å; S656-S658 PolarHBondContact O-N 2.97Å
659	T	40.9	Very low	39.4	Very low	89 Å²	89	119.1 Å²	119.1	55%	0.546	63%	0.633	S	S	.	*	H	α-helix	trans	-89.3	-25.8	-178	57.5	0	0	0	0	114.1	Q655 S656 E657 K661 L662	Q655-T659 PolarHBondContact O-N 3.31Å; S656-T659 PolarHBondContact O-N 3.28Å; S656-T659 PolarHBondContact O-OG1 3.33Å; E657-T659 VanDerWaalsContact C-N 3.32Å; T659-K661 PolarHBondContact O-N 2.84Å; T659-L662 PolarHBondContact O-N 3.2Å
660	T	42	Very low	38.9	Very low	91 Å²	91	121.5 Å²	121.5	56%	0.558	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-72.7	-11.5	178.9	53.6	0	0	0	0	114.1	S656 E657 L662 T663	S656-T660 PolarHBondContact O-N 2.97Å; E657-T660 PolarHBondContact O-OG1 3.43Å; T660-L662 VanDerWaalsContact C-N 3.32Å; T660-T663 PolarHBondContact O-OG1 3.33Å
661	K	38.3	Very low	38.2	Very low	182 Å²	182	125.3 Å²	125.3	79%	0.791	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-81.6	-6.8	174.3	-68.5	-178.5	-179.4	174.8	0	114.1	T659	T659-K661 PolarHBondContact O-N 2.84Å
662	L	35.3	Very low	37.5	Very low	143 Å²	143	131.2 Å²	131.2	75%	0.749	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-90.8	-11.5	-179.3	-106.9	160.3	0	0	0	114.5	T659 T660	T659-L662 PolarHBondContact O-N 3.2Å; T660-L662 VanDerWaalsContact C-N 3.32Å
663	T	38.5	Very low	37.2	Very low	109 Å²	109	132.8 Å²	132.8	67%	0.669	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-83.3	-11.9	-176.5	48.5	0	0	0	0	114.6	T660 G665	T660-T663 PolarHBondContact O-OG1 3.33Å; T663-G665 PolarHBondContact O-N 3.26Å
664	K	37	Very low	36.8	Very low	199 Å²	199	138.8 Å²	138.8	87%	0.865	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-82.1	12.6	177	-64.9	-165.2	175	-169.9	0	114.6
665	G	36.6	Very low	36.2	Very low	62 Å²	62	137.5 Å²	137.5	64%	0.639	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-107.3	-6.8	-179.5	0	0	0	0	0	115.9	T663	T663-G665 PolarHBondContact O-N 3.26Å
666	L	34	Very low	35.8	Very low	167 Å²	167	139.2 Å²	139.2	87%	0.874	74%	0.741	S	S	*	*			trans	-117.2	82.8	-175.8	-110.9	71.5	0	0	0	110.7
667	Q	34	Very low	35.4	Very low	180 Å²	180	144 Å²	144	84%	0.841	76%	0.761	S	S	*	*			trans	-146.2	51	-179.9	-158.7	171.4	5.1	0	0	113.1
668	T	31.9	Very low	34.7	Very low	140 Å²	140	146.9 Å²	146.9	86%	0.859	78%	0.779	S	S	*	*			trans	-153	77.5	173	25.3	0	0	0	0	112.4
669	M	30.9	Very low	34.2	Very low	198 Å²	198	148.9 Å²	148.9	98%	0.975	79%	0.792	S	S	*	*			trans	-160.5	132.6	142.5	-112.9	173	-176.5	0	0	109.9
670	K	31.8	Very low	33.7	Very low	183 Å²	183	154 Å²	154	80%	0.796	81%	0.809	S	S	*	*			trans	-118.6	179.2	176.9	-119.2	-172.4	179.6	-171.7	0	108.1
671	Y	32.4	Very low	32.9	Very low	206 Å²	206	159.6 Å²	159.6	81%	0.808	83%	0.826	S	S	*	*			trans	77.4	90.8	174.5	-52.8	-77.2	0	0	0	115.8
672	L	33.1	Very low	32.4	Very low	168 Å²	168	155.3 Å²	155.3	88%	0.88	82%	0.824	S	S	*	*				-148	130.7	102.2	-102	157.3	0	0	0	107.9
673	N	33	Very low	32.1	Very low	140 Å²	140	157.4 Å²	157.4	75%	0.749	83%	0.83	S	S	*	*			trans	-101.1	136	167.1	-71.1	3.6	0	0	0	106.6
674	D	34.6	Very low	31.5	Very low	171 Å²	171	162.6 Å²	162.6	91%	0.914	84%	0.843	S	S	*	*			trans	-137.1	145.9	133.7	-85.9	-49	0	0	0	106
675	A	31.9	Very low	31	Very low	89 Å²	89	158.3 Å²	158.3	74%	0.736	84%	0.839	S	S	*	*			trans	-134.9	120.7	-169.9	0	0	0	0	0	110.5
676	D	31.5	Very low	30.6	Very low	166 Å²	166	161.9 Å²	161.9	89%	0.888	85%	0.854	S	S	*	*			trans	-161.6	165.4	150.3	-109	-33.7	0	0	0	110.4
677	I	32.3	Very low	30.1	Very low	155 Å²	155	162.3 Å²	162.3	80%	0.795	85%	0.854	S	S	*	*			trans	67.2	90.2	179.7	-47.2	-178.4	0	0	0	114.6
678	L	27.6	Very low	29.7	Very low	168 Å²	168	159 Å²	159	88%	0.88	85%	0.85	S	S	*	*			trans	-81.8	168.3	154.4	-83.5	161.4	0	0	0	110.8
679	C	30.7	Very low	29.5	Very low	120 Å²	120	159.7 Å²	159.7	81%	0.811	85%	0.847	S	S	*	*			trans	70.1	138	-164.7	-59.6	0	0	0	0	113.3
680	E	29.8	Very low	29.3	Very low	197 Å²	197	160 Å²	160	92%	0.921	84%	0.843	S	S	*	*			cis	-129.6	158.3	6.2	-159.2	172.2	141.5	0	0	111
681	K	26.3	Very low	29.1	Very low	209 Å²	209	156.5 Å²	156.5	91%	0.909	83%	0.833	S	S	*	*			trans	-124.6	84.1	-152.5	-173.7	-170.8	174	-170.5	0	113.8
682	A	26.8	Very low	28.8	Very low	91 Å²	91	156.5 Å²	156.5	75%	0.752	83%	0.831	S	S	*	*			trans	-148.1	148	171.3	0	0	0	0	0	114.3
683	E	28.8	Very low	28.6	Very low	188 Å²	188	157.1 Å²	157.1	88%	0.879	83%	0.829	S	S	*	*			trans	47.4	70.5	154.1	-58.6	-165.3	154.8	0	0	120.7
684	K	27.1	Very low	28.6	Very low	217 Å²	217	156.3 Å²	156.3	94%	0.943	83%	0.83	S	S	*	*			trans	-133.1	59.2	150	-76.6	-171.1	178.5	170.5	0	112.9
685	S	26.7	Very low	28.4	Very low	110 Å²	110	153.2 Å²	153.2	77%	0.769	82%	0.821	S	S	*	*			trans	-158.3	71.9	171.9	-176.8	0	0	0	0	114.6
686	S	26.9	Very low	28.1	Very low	137 Å²	137	156.1 Å²	156.1	96%	0.958	83%	0.825	S	S	*	*			trans	-124.4	57.1	170	-65	0	0	0	0	111.9
687	M	24.3	Very low	28	Very low	176 Å²	176	155.5 Å²	155.5	87%	0.867	82%	0.821	S	S	*	*	S	Bend	trans	-130.1	128.9	168.7	-161.6	-177.9	-148.8	0	0	109.8
688	S	25.8	Very low	28	Very low	109 Å²	109	154.9 Å²	154.9	76%	0.762	83%	0.825	S	S	*	*	S	Bend	trans	77.7	163.1	-176.3	82.4	0	0	0	0	117.1
689	I	28.2	Very low	28.1	Very low	155 Å²	155	153.3 Å²	153.3	80%	0.795	82%	0.816	S	S	*	*			trans	70.7	88.4	177	-46.5	170.1	0	0	0	116
690	F	25.3	Very low	28	Very low	206 Å²	206	155.5 Å²	155.5	90%	0.904	82%	0.82	S	S	*	*			trans	-151.5	116.7	136.1	-114.1	-75.9	0	0	0	109
691	L	28.8	Very low	28.1	Very low	109 Å²	109	155 Å²	155	57%	0.571	82%	0.818	S	S	*	*			trans	-159.4	130	179.9	-134	177.2	0	0	0	111.2	L653	L653-L691 HydrophobicContact CD1-CD1 4.29Å; L653-L691 HydrophobicContact CD2-CD1 3.73Å
692	R	26.1	Very low	28.6	Very low	206 Å²	206	151 Å²	151	78%	0.777	81%	0.811	S	S	*	*			trans	73.3	157.6	170.5	-85.9	173.6	179.8	175.3	1.4	119
693	H	28.3	Very low	28.9	Very low	180 Å²	180	154.2 Å²	154.2	83%	0.833	81%	0.814	S	S	*	*			trans	67.1	129.2	-171	-52.1	-86.5	0	0	0	112.5
694	T	32	Very low	29	Very low	124 Å²	124	150.3 Å²	150.3	76%	0.761	81%	0.807	S	S	*	*			cis	-124.4	141.8	19.9	48.9	0	0	0	0	114.8
695	S	31.5	Very low	29.2	Very low	106 Å²	106	147.2 Å²	147.2	74%	0.741	80%	0.801	S	S	*	*			trans	15.9	136.1	149.5	55	0	0	0	0	121.9
696	D	25.6	Very low	29.4	Very low	150 Å²	150	151.7 Å²	151.7	80%	0.802	80%	0.803	S	S	*	*			trans	-61.3	-174.4	158	-56.5	-86.5	0	0	0	113.9
697	D	28.9	Very low	29.5	Very low	152 Å²	152	155 Å²	155	81%	0.813	80%	0.796	S	S	*	*			trans	85.8	141	-179.9	-60.2	-30.9	0	0	0	117.6
698	T	32.4	Very low	29.5	Very low	142 Å²	142	157.1 Å²	157.1	87%	0.871	80%	0.8	S	S	*	*	S	Bend	trans	74.5	47	171.6	68	0	0	0	0	120.4
699	L	31	Very low	29.7	Very low	135 Å²	135	155.6 Å²	155.6	71%	0.707	80%	0.795	S	S	*	*			trans	-146.7	27	158.6	-122.4	160.2	0	0	0	116.9
700	N	27.3	Very low	29.7	Very low	166 Å²	166	155.2 Å²	155.2	89%	0.888	79%	0.794	S	S	*	*			trans	-97.7	86	170.7	-81	-18.6	0	0	0	111.4
701	E	32.9	Very low	29.8	Very low	187 Å²	187	150.9 Å²	150.9	87%	0.874	79%	0.785	S	S	*	*	S	Bend	trans	-167.2	-28.9	152.9	-120.2	173.3	179.3	0	0	115.6
702	T	35.3	Very low	30	Very low	124 Å²	124	151.4 Å²	151.4	76%	0.761	80%	0.797	S	S	*	*	S	Bend	trans	-99.4	-0.8	-160.8	27.8	0	0	0	0	118.1
703	I	34	Very low	30.5	Very low	159 Å²	159	150.6 Å²	150.6	82%	0.815	80%	0.799	S	S	*	*	S	Bend	trans	-128.6	60.5	-173.8	-40.8	-178.6	0	0	0	112.3
704	S	30.4	Very low	30.7	Very low	106 Å²	106	144.7 Å²	144.7	74%	0.741	79%	0.788	S	S	*	*	S	Bend	trans	-135.4	-3.4	179.6	-168.4	0	0	0	0	116.5
705	N	32.4	Very low	31.1	Very low	153 Å²	153	146.3 Å²	146.3	82%	0.818	79%	0.786	S	S	*	*	S	Bend	trans	-130.9	13.1	-166.4	-89.3	-25	0	0	0	116.6
706	Y	29.3	Very low	31.4	Very low	203 Å²	203	149.2 Å²	149.2	80%	0.796	79%	0.788	S	S	*	*	S	Bend	trans	-133.6	148.4	178.9	-84.8	-86.9	0	0	0	113.8
707	Y	29.4	Very low	32.1	Very low	208 Å²	208	148.7 Å²	148.7	82%	0.816	78%	0.781	S	S	*	*			trans	71.9	50.6	174.1	-56.2	-68.8	0	0	0	118.5
708	F	25.8	Very low	32.4	Very low	219 Å²	219	148.4 Å²	148.4	96%	0.961	77%	0.772	S	S	*	*			trans	-109.7	54.5	150.9	-128.7	-74.4	0	0	0	111.4
709	A	29.4	Very low	32.9	Very low	78 Å²	78	146.1 Å²	146.1	65%	0.645	75%	0.754	S	S	*	*	S	Bend	trans	-156.4	130.2	173.7	0	0	0	0	0	113.2
710	N	27.5	Very low	33.5	Very low	147 Å²	147	148.9 Å²	148.9	79%	0.786	76%	0.755	S	S	*	*			trans	41	134.6	151.1	-64.7	-6.3	0	0	0	123
711	T	28.4	Very low	34.4	Very low	114 Å²	114	143.6 Å²	143.6	70%	0.699	73%	0.729	S	S	*	*	S	Bend	trans	64.5	101.6	144.3	51.6	0	0	0	0	120.1	K713	T711-K713 VanDerWaalsContact C-N 3.3Å; T711-K713 PolarHBondContact O-N 3.49Å
712	S	32.3	Very low	35	Very low	120 Å²	120	137.7 Å²	137.7	84%	0.839	70%	0.703	S	S	*	*	S	Bend	trans	55.2	-8	131.6	60.7	0	0	0	0	122.9
713	K	35.9	Very low	35.5	Very low	189 Å²	189	135.5 Å²	135.5	82%	0.822	69%	0.691	S	S	*	*			trans	-111	-6.7	-177.5	-69.1	-171.1	174.6	-175.3	0	116.3	T711	T711-K713 VanDerWaalsContact C-N 3.3Å; T711-K713 PolarHBondContact O-N 3.49Å
714	G	32.5	Very low	35.9	Very low	57 Å²	57	131.7 Å²	131.7	59%	0.588	67%	0.672	S	S	*	*	S	Bend	trans	-75.2	-26.6	-177.3	0	0	0	0	0	116.3	Q716 H717	G714-Q716 PolarHBondContact O-N 2.68Å; G714-H717 PolarHBondContact O-N 3.33Å
715	H	40.3	Very low	37	Very low	158 Å²	158	131.5 Å²	131.5	73%	0.731	66%	0.662	S	S	*	*	H	α-helix	trans	-67.8	-37.7	-168	-102.4	56.9	0	0	0	114.5	H717 F718 L719	H715-H717 VanDerWaalsContact C-N 3.27Å; H715-H717 PolarHBondContact O-N 2.92Å; H715-F718 PolarHBondContact O-N 3.08Å; H715-L719 PolarHBondContact O-N 3.22Å
716	Q	39.6	Very low	37.4	Very low	167 Å²	167	130.5 Å²	130.5	78%	0.78	65%	0.651	S	S	*	*	H	α-helix	trans	-64.7	-31.5	179.6	-74.7	-170.6	-16.2	0	0	112.4	G714 R720	G714-Q716 PolarHBondContact O-N 2.68Å; Q716-R720 WeakPolarHBondContact O-CB 3.37Å; Q716-R720 PolarHBondContact O-N 3.09Å
717	H	39.5	Very low	38.2	Very low	139 Å²	139	126.3 Å²	126.3	64%	0.644	64%	0.636	S	S	*	*	H	α-helix	trans	-71.5	-34.4	180	-147.3	-60.7	0	0	0	112.3	G714 H715 R720 T721	G714-H717 PolarHBondContact O-N 3.33Å; H715-H717 VanDerWaalsContact C-N 3.27Å; H715-H717 PolarHBondContact O-N 2.92Å; H717-R720 PolarHBondContact O-N 2.95Å; H717-T721 PolarHBondContact O-N 3.49Å; H717-T721 PolarHBondContact O-OG1 2.76Å
718	F	34.2	Very low	38.9	Very low	145 Å²	145	123.8 Å²	123.8	64%	0.636	63%	0.63	S	S	*	*	H	α-helix	trans	-66.9	-47	176.8	-168.6	-105	0	0	0	111.6	H715 R720 T721 L722	H715-F718 PolarHBondContact O-N 3.08Å; F718-R720 VanDerWaalsContact C-N 3.31Å; F718-R720 PolarHBondContact O-N 3.32Å; F718-T721 PolarHBondContact O-N 3.36Å; F718-T721 VanDerWaalsContact O-N 3.17Å; F718-L722 HydrophobicContact CD1-CD1 3.92Å; F718-L722 HydrophobicContact CE1-CD1 3.67Å; F718-L722 HydrophobicContact CE1-CG 4.37Å; F718-L722 HydrophobicContact CZ-CD1 4.41Å; F718-L722 PolarHBondContact O-N 2.74Å; F718-L722 VanDerWaalsContact O-N 3.09Å
719	L	43.5	Very low	39.7	Very low	94 Å²	94	115.7 Å²	115.7	49%	0.492	60%	0.604	S	S	.	*	H	α-helix	trans	-65.2	-31	176.2	-70.3	172.2	0	0	0	112.9	H715 T721 P723	H715-L719 PolarHBondContact O-N 3.22Å; L719-T721 VanDerWaalsContact C-N 3.33Å; L719-P723 WeakPolarHBondContact O-CD 3.39Å
720	R	44.1	Very low	40.4	Very low	194 Å²	194	117.3 Å²	117.3	73%	0.732	60%	0.601	S	S	*	*	H	α-helix	trans	-75.8	-19.4	175.1	-150.2	174.9	-161.9	-179.1	5.9	113.3	Q716 H717 F718 N724	Q716-R720 WeakPolarHBondContact O-CB 3.37Å; Q716-R720 PolarHBondContact O-N 3.09Å; H717-R720 PolarHBondContact O-N 2.95Å; F718-R720 VanDerWaalsContact C-N 3.31Å; F718-R720 PolarHBondContact O-N 3.32Å; R720-N724 PolarHBondContact O-ND2 3.34Å
721	T	46.6	Very low	41.3	Very low	55 Å²	55	114.4 Å²	114.4	34%	0.337	59%	0.585	S	S	.	*	H	α-helix	trans	-92.9	-33	178.9	-54.3	0	0	0	0	112.8	H717 F718 L719 N724 I725	H717-T721 PolarHBondContact O-N 3.49Å; H717-T721 PolarHBondContact O-OG1 2.76Å; F718-T721 PolarHBondContact O-N 3.36Å; F718-T721 VanDerWaalsContact O-N 3.17Å; L719-T721 VanDerWaalsContact C-N 3.33Å; T721-N724 WeakPolarHBondContact O-CA 3.25Å; T721-N724 WeakPolarHBondContact O-CB 3.47Å; T721-N724 PolarHBondContact O-N 3.26Å; T721-I725 HydrophobicContact CG2-CD1 3.84Å; T721-I725 HydrophobicContact CG2-CG1 4.09Å; T721-I725 PolarHBondContact O-N 3.19Å
722	L	45.2	Very low	42.1	Very low	63 Å²	63	114.2 Å²	114.2	33%	0.33	58%	0.579	S	S	.	*	H	α-helix	trans	-53.8	-49.3	179.4	-91.3	166.3	0	0	0	114.4	F718 N724 I725 F726	F718-L722 HydrophobicContact CD1-CD1 3.92Å; F718-L722 HydrophobicContact CE1-CD1 3.67Å; F718-L722 HydrophobicContact CE1-CG 4.37Å; F718-L722 HydrophobicContact CZ-CD1 4.41Å; F718-L722 PolarHBondContact O-N 2.74Å; F718-L722 VanDerWaalsContact O-N 3.09Å; L722-N724 PolarHBondContact O-N 3.38Å; L722-I725 PolarHBondContact O-N 2.9Å; L722-F726 PolarHBondContact O-N 2.91Å
723	P	44.3	Very low	42.5	Very low	78 Å²	78	112.9 Å²	112.9	51%	0.506	56%	0.562	S	S	.	*	H	α-helix	trans	-60.9	-32.1	175.2	-25.1	34.7	0	0	0	113	L719 K727	L719-P723 WeakPolarHBondContact O-CD 3.39Å; P723-K727 WeakPolarHBondContact O-CB 3.28Å; P723-K727 PolarHBondContact O-N 2.97Å
724	N	42.6	Very low	42.8	Very low	79 Å²	79	110.4 Å²	110.4	42%	0.422	55%	0.551	S	S	.	*	H	α-helix	trans	-77.1	-30.6	178.5	-73.7	-53.4	0	0	0	112.6	R720 T721 L722 K728	R720-N724 PolarHBondContact O-ND2 3.34Å; T721-N724 WeakPolarHBondContact O-CA 3.25Å; T721-N724 WeakPolarHBondContact O-CB 3.47Å; T721-N724 PolarHBondContact O-N 3.26Å; L722-N724 PolarHBondContact O-N 3.38Å; N724-K728 WeakPolarHBondContact O-CB 3.45Å; N724-K728 PolarHBondContact O-N 2.86Å
725	I	53.9	Low	43.2	Very low	102 Å²	102	113.6 Å²	113.6	52%	0.523	55%	0.551	S	S	.	*	H	α-helix	trans	-69.1	-47.5	169.9	-66.6	168.1	0	0	0	110	T721 L722 K727 K728 A729	T721-I725 HydrophobicContact CG2-CD1 3.84Å; T721-I725 HydrophobicContact CG2-CG1 4.09Å; T721-I725 PolarHBondContact O-N 3.19Å; L722-I725 PolarHBondContact O-N 2.9Å; I725-K727 PolarHBondContact O-N 3.14Å; I725-K728 PolarHBondContact O-N 3.46Å; I725-A729 WeakPolarHBondContact O-CB 3.41Å; I725-A729 PolarHBondContact O-N 2.88Å
726	F	41.9	Very low	43.2	Very low	132 Å²	132	112.7 Å²	112.7	58%	0.579	55%	0.545	S	S	*	.	H	α-helix	trans	-61.9	-41.7	174.6	-95	-85	0	0	0	112.2	L722 A729 L730	L722-F726 PolarHBondContact O-N 2.91Å; F726-A729 PolarHBondContact O-N 3.34Å; F726-L730 VanDerWaalsContact O-CB 3.27Å; F726-L730 WeakPolarHBondContact O-CB 3.3Å; F726-L730 WeakPolarHBondContact O-CG 3.39Å; F726-L730 PolarHBondContact O-N 3.4Å
727	K	45.1	Very low	43.4	Very low	114 Å²	114	108 Å²	108	50%	0.496	53%	0.528	S	S	.	.	H	α-helix	trans	-67	-34.4	176.3	-168.4	170.7	-176.2	177	0	112.2	P723 I725 N731	P723-K727 WeakPolarHBondContact O-CB 3.28Å; P723-K727 PolarHBondContact O-N 2.97Å; I725-K727 PolarHBondContact O-N 3.14Å; K727-N731 WeakPolarHBondContact O-CB 3.33Å; K727-N731 PolarHBondContact O-N 3.37Å
728	K	44.9	Very low	43.5	Very low	155 Å²	155	104.9 Å²	104.9	67%	0.674	52%	0.516	S	S	*	.	H	α-helix	trans	-66.7	-47.3	168.7	-85.4	-168.3	176	-172.9	0	112.1	N724 I725 L730 N731 I732	N724-K728 WeakPolarHBondContact O-CB 3.45Å; N724-K728 PolarHBondContact O-N 2.86Å; I725-K728 PolarHBondContact O-N 3.46Å; K728-L730 VanDerWaalsContact C-N 3.32Å; K728-L730 PolarHBondContact O-N 3.01Å; K728-N731 PolarHBondContact O-N 3.17Å; K728-I732 VanDerWaalsContact O-CB 3.3Å; K728-I732 WeakPolarHBondContact O-CB 3.3Å; K728-I732 WeakPolarHBondContact O-CD1 3.32Å; K728-I732 WeakPolarHBondContact O-CG1 3.45Å; K728-I732 PolarHBondContact O-N 3.41Å
729	A	41.6	Very low	43.8	Very low	50 Å²	50	101.8 Å²	101.8	41%	0.413	51%	0.505	S	S	.	.	H	α-helix	trans	-61	-41.6	178	0	0	0	0	0	112	I725 F726 N733	I725-A729 WeakPolarHBondContact O-CB 3.41Å; I725-A729 PolarHBondContact O-N 2.88Å; F726-A729 PolarHBondContact O-N 3.34Å; A729-N733 PolarHBondContact O-N 3.17Å
730	L	44.4	Very low	43.6	Very low	111 Å²	111	103 Å²	103	58%	0.581	51%	0.511	S	S	*	.	H	α-helix	trans	-69.8	-42.2	175.9	-74.4	165.4	0	0	0	112.4	F726 K728 N733 K734	F726-L730 VanDerWaalsContact O-CB 3.27Å; F726-L730 WeakPolarHBondContact O-CB 3.3Å; F726-L730 WeakPolarHBondContact O-CG 3.39Å; F726-L730 PolarHBondContact O-N 3.4Å; K728-L730 VanDerWaalsContact C-N 3.32Å; K728-L730 PolarHBondContact O-N 3.01Å; L730-N733 PolarHBondContact O-N 2.83Å; L730-K734 VanDerWaalsContact O-CB 3.3Å; L730-K734 WeakPolarHBondContact O-CB 3.48Å; L730-K734 PolarHBondContact O-N 3.25Å
731	N	46	Very low	43.5	Very low	86 Å²	86	100 Å²	100	46%	0.46	51%	0.505	S	S	.	.	H	α-helix	trans	-69.6	-32.3	174.2	-97.4	29.1	0	0	0	113	K727 K728 K734 H735	K727-N731 WeakPolarHBondContact O-CB 3.33Å; K727-N731 PolarHBondContact O-N 3.37Å; K728-N731 PolarHBondContact O-N 3.17Å; N731-K734 PolarHBondContact O-N 3.11Å; N731-H735 WeakPolarHBondContact O-CB 3.39Å; N731-H735 PolarHBondContact O-CD2 3.11Å; N731-H735 PolarHBondContact O-N 2.94Å
732	I	46.5	Very low	43.1	Very low	110 Å²	110	103.1 Å²	103.1	56%	0.564	52%	0.516	S	S	*	.	H	α-helix	trans	-64.3	-45.4	173	-73.4	164.2	0	0	0	109.5	K728 K736	K728-I732 VanDerWaalsContact O-CB 3.3Å; K728-I732 WeakPolarHBondContact O-CB 3.3Å; K728-I732 WeakPolarHBondContact O-CD1 3.32Å; K728-I732 WeakPolarHBondContact O-CG1 3.45Å; K728-I732 PolarHBondContact O-N 3.41Å; I732-K736 VanDerWaalsContact O-CB 3.32Å; I732-K736 WeakPolarHBondContact O-CB 3.23Å; I732-K736 PolarHBondContact O-N 3.37Å
733	N	40.5	Very low	42.8	Very low	93 Å²	93	105.9 Å²	105.9	50%	0.497	53%	0.528	S	S	.	.	H	α-helix	trans	-66	-39.1	172.8	-81.1	-10.4	0	0	0	112.3	A729 L730 K736 T737	A729-N733 PolarHBondContact O-N 3.17Å; L730-N733 PolarHBondContact O-N 2.83Å; N733-K736 CarbonylContact O-C 3.45Å; N733-K736 WeakPolarHBondContact O-CA 3.26Å; N733-K736 PolarHBondContact O-N 3.46Å; N733-T737 WeakPolarHBondContact O-CG2 3.04Å; N733-T737 PolarHBondContact O-N 3.11Å; N733-T737 PolarHBondContact O-OG1 2.89Å
734	K	42.7	Very low	42.3	Very low	136 Å²	136	104 Å²	104	59%	0.591	52%	0.522	S	S	*	.	H	α-helix	trans	-68.7	-39.8	-179.3	-147.3	177	-170.5	-172.1	0	112.3	L730 N731 K736 T737 N738	L730-K734 VanDerWaalsContact O-CB 3.3Å; L730-K734 WeakPolarHBondContact O-CB 3.48Å; L730-K734 PolarHBondContact O-N 3.25Å; N731-K734 PolarHBondContact O-N 3.11Å; K734-K736 VanDerWaalsContact C-N 3.28Å; K734-K736 PolarHBondContact O-N 3.01Å; K734-T737 WeakPolarHBondContact CA-OG1 3.47Å; K734-T737 PolarHBondContact O-N 3.18Å; K734-T737 PolarHBondContact O-OG1 3.36Å; K734-T737 VanDerWaalsContact O-OG1 3.1Å; K734-N738 VanDerWaalsContact O-CB 3.25Å; K734-N738 WeakPolarHBondContact O-CB 3.28Å; K734-N738 PolarHBondContact O-N 3.12Å; K734-N738 PolarHBondContact O-OD1 2.82Å
735	H	40.3	Very low	42	Very low	125 Å²	125	107.7 Å²	107.7	58%	0.579	54%	0.537	S	S	*	.	H	α-helix	trans	-62.5	-36.6	167.2	-87.2	-73	0	0	0	111.8	N731 I739	N731-H735 WeakPolarHBondContact O-CB 3.39Å; N731-H735 PolarHBondContact O-CD2 3.11Å; N731-H735 PolarHBondContact O-N 2.94Å; H735-I739 VanDerWaalsContact O-CB 3.25Å; H735-I739 WeakPolarHBondContact O-CB 3.23Å; H735-I739 WeakPolarHBondContact O-CD1 3.48Å; H735-I739 WeakPolarHBondContact O-CG1 3.23Å; H735-I739 PolarHBondContact O-N 3.33Å
736	K	40.7	Very low	41.2	Very low	139 Å²	139	109 Å²	109	60%	0.604	54%	0.543	S	S	*	.	H	α-helix	trans	-77.8	-24.8	-179.2	-149.6	170.2	-169.3	177.6	0	114.1	I732 N733 K734 L740	I732-K736 VanDerWaalsContact O-CB 3.32Å; I732-K736 WeakPolarHBondContact O-CB 3.23Å; I732-K736 PolarHBondContact O-N 3.37Å; N733-K736 CarbonylContact O-C 3.45Å; N733-K736 WeakPolarHBondContact O-CA 3.26Å; N733-K736 PolarHBondContact O-N 3.46Å; K734-K736 VanDerWaalsContact C-N 3.28Å; K734-K736 PolarHBondContact O-N 3.01Å; K736-L740 WeakPolarHBondContact O-CB 3.37Å; K736-L740 WeakPolarHBondContact O-CD1 3.36Å; K736-L740 VanDerWaalsContact O-CG 3.22Å; K736-L740 WeakPolarHBondContact O-CG 3.34Å; K736-L740 PolarHBondContact O-N 2.91Å
737	T	44.1	Very low	40.7	Very low	68 Å²	68	108.2 Å²	108.2	42%	0.417	55%	0.545	S	S	.	.	H	α-helix	trans	-77.9	-46.7	168.6	53.3	0	0	0	0	110.4	N733 K734 I739 L740 E741	N733-T737 WeakPolarHBondContact O-CG2 3.04Å; N733-T737 PolarHBondContact O-N 3.11Å; N733-T737 PolarHBondContact O-OG1 2.89Å; K734-T737 WeakPolarHBondContact CA-OG1 3.47Å; K734-T737 PolarHBondContact O-N 3.18Å; K734-T737 PolarHBondContact O-OG1 3.36Å; K734-T737 VanDerWaalsContact O-OG1 3.1Å; T737-I739 VanDerWaalsContact C-N 3.33Å; T737-I739 PolarHBondContact O-N 2.97Å; T737-L740 CarbonylContact O-C 3.42Å; T737-L740 WeakPolarHBondContact O-CA 3.26Å; T737-L740 PolarHBondContact O-N 3.15Å; T737-E741 PolarHBondContact O-N 2.82Å
738	N	40.2	Very low	40.3	Very low	73 Å²	73	110.5 Å²	110.5	39%	0.39	56%	0.558	S	S	.	*	H	α-helix	trans	-61.4	-39.7	177.5	-76.6	62.1	0	0	0	112	K734 L740 E741 E742	K734-N738 VanDerWaalsContact O-CB 3.25Å; K734-N738 WeakPolarHBondContact O-CB 3.28Å; K734-N738 PolarHBondContact O-N 3.12Å; K734-N738 PolarHBondContact O-OD1 2.82Å; N738-L740 VanDerWaalsContact C-N 3.29Å; N738-L740 PolarHBondContact O-N 3.37Å; N738-E741 PolarHBondContact O-N 2.87Å; N738-E742 WeakPolarHBondContact O-CB 3.13Å; N738-E742 WeakPolarHBondContact O-CG 3.48Å; N738-E742 PolarHBondContact O-N 3.37Å
739	I	41.1	Very low	39.9	Very low	81 Å²	81	110.7 Å²	110.7	42%	0.415	56%	0.561	S	S	.	*	H	α-helix	trans	-65	-31.6	172.5	-70.8	165.3	0	0	0	111.7	H735 T737 E743	H735-I739 VanDerWaalsContact O-CB 3.25Å; H735-I739 WeakPolarHBondContact O-CB 3.23Å; H735-I739 WeakPolarHBondContact O-CD1 3.48Å; H735-I739 WeakPolarHBondContact O-CG1 3.23Å; H735-I739 PolarHBondContact O-N 3.33Å; T737-I739 VanDerWaalsContact C-N 3.33Å; T737-I739 PolarHBondContact O-N 2.97Å; I739-E743 HydrophobicContact CG2-CG 4.45Å; I739-E743 VanDerWaalsContact O-CB 3.22Å; I739-E743 WeakPolarHBondContact O-CB 3.47Å; I739-E743 VanDerWaalsContact O-CG 3.29Å; I739-E743 WeakPolarHBondContact O-CG 3.42Å; I739-E743 PolarHBondContact O-N 3.03Å
740	L	38.8	Very low	39.5	Very low	119 Å²	119	112.8 Å²	112.8	62%	0.623	57%	0.565	S	S	*	*	H	α-helix	trans	-82.4	-13.3	175.5	-73.9	172	0	0	0	114.1	K736 T737 N738	K736-L740 WeakPolarHBondContact O-CB 3.37Å; K736-L740 WeakPolarHBondContact O-CD1 3.36Å; K736-L740 VanDerWaalsContact O-CG 3.22Å; K736-L740 WeakPolarHBondContact O-CG 3.34Å; K736-L740 PolarHBondContact O-N 2.91Å; T737-L740 CarbonylContact O-C 3.42Å; T737-L740 WeakPolarHBondContact O-CA 3.26Å; T737-L740 PolarHBondContact O-N 3.15Å; N738-L740 VanDerWaalsContact C-N 3.29Å; N738-L740 PolarHBondContact O-N 3.37Å
741	E	41.5	Very low	39.1	Very low	130 Å²	130	115 Å²	115	61%	0.607	57%	0.572	S	S	*	*	H	α-helix	trans	-91.8	-39.1	170.9	-71.5	174.2	128.8	0	0	110.4	T737 N738 G744 E745	T737-E741 PolarHBondContact O-N 2.82Å; N738-E741 PolarHBondContact O-N 2.87Å; E741-G744 VanDerWaalsContact O-CA 3.32Å; E741-G744 WeakPolarHBondContact O-CA 3.46Å; E741-G744 PolarHBondContact O-N 3.28Å; E741-E745 PolarHBondContact O-N 2.8Å; E741-E745 VanDerWaalsContact O-N 3.09Å
742	E	40.1	Very low	38.6	Very low	121 Å²	121	118.2 Å²	118.2	57%	0.565	59%	0.585	S	S	*	*	H	α-helix	trans	-68.7	-37.7	171.6	-70.5	179.8	127.4	0	0	112.5	N738 G744 I746	N738-E742 WeakPolarHBondContact O-CB 3.13Å; N738-E742 WeakPolarHBondContact O-CG 3.48Å; N738-E742 PolarHBondContact O-N 3.37Å; E742-G744 PolarHBondContact O-N 3.27Å; E742-I746 WeakPolarHBondContact O-CD1 3.39Å; E742-I746 VanDerWaalsContact O-CG1 3.3Å; E742-I746 WeakPolarHBondContact O-CG1 3.43Å; E742-I746 PolarHBondContact O-N 2.96Å
743	E	37.1	Very low	38.1	Very low	122 Å²	122	119.3 Å²	119.3	57%	0.57	59%	0.592	S	S	*	*	H	α-helix	trans	-70.4	-12.2	167.8	-72.8	-175.8	171	0	0	112.8	I739 N747	I739-E743 HydrophobicContact CG2-CG 4.45Å; I739-E743 VanDerWaalsContact O-CB 3.22Å; I739-E743 WeakPolarHBondContact O-CB 3.47Å; I739-E743 VanDerWaalsContact O-CG 3.29Å; I739-E743 WeakPolarHBondContact O-CG 3.42Å; I739-E743 PolarHBondContact O-N 3.03Å; E743-N747 PolarHBondContact O-ND2 3.07Å
744	G	35.6	Very low	37.9	Very low	38 Å²	38	121 Å²	121	39%	0.392	60%	0.595	S	S	.	*	H	α-helix	trans	-75.7	-55.9	170.7	0	0	0	0	0	112.3	E741 E742 I746 N747	E741-G744 VanDerWaalsContact O-CA 3.32Å; E741-G744 WeakPolarHBondContact O-CA 3.46Å; E741-G744 PolarHBondContact O-N 3.28Å; E742-G744 PolarHBondContact O-N 3.27Å; G744-I746 VanDerWaalsContact C-N 3.3Å; G744-I746 PolarHBondContact O-N 2.89Å; G744-N747 PolarHBondContact O-N 2.69Å
745	E	35.9	Very low	37.6	Very low	157 Å²	157	121.3 Å²	121.3	73%	0.734	60%	0.602	S	S	*	*	H	α-helix	trans	-70.5	-21.5	-176	-65.5	-167.8	140	0	0	113.8	E741 N747	E741-E745 PolarHBondContact O-N 2.8Å; E741-E745 VanDerWaalsContact O-N 3.09Å; E745-N747 PolarHBondContact O-N 2.87Å
746	I	36.4	Very low	37.4	Very low	128 Å²	128	120.8 Å²	120.8	66%	0.656	61%	0.607	S	S	*	*	H	α-helix	trans	-79.1	-14.7	-179.5	-68.4	173.1	0	0	0	113.2	E742 G744	E742-I746 WeakPolarHBondContact O-CD1 3.39Å; E742-I746 VanDerWaalsContact O-CG1 3.3Å; E742-I746 WeakPolarHBondContact O-CG1 3.43Å; E742-I746 PolarHBondContact O-N 2.96Å; G744-I746 VanDerWaalsContact C-N 3.3Å; G744-I746 PolarHBondContact O-N 2.89Å
747	N	32	Very low	37.1	Very low	116 Å²	116	120.3 Å²	120.3	62%	0.62	61%	0.611	S	S	*	*	H	α-helix	trans	-95.4	-19.8	179.2	-79.2	-73.5	0	0	0	115.1	E743 G744 E745 Q749	E743-N747 PolarHBondContact O-ND2 3.07Å; G744-N747 PolarHBondContact O-N 2.69Å; E745-N747 PolarHBondContact O-N 2.87Å; N747-Q749 VanDerWaalsContact C-N 3.35Å
748	E	37	Very low	36.7	Very low	163 Å²	163	125.4 Å²	125.4	76%	0.762	63%	0.63	S	S	*	*	H	α-helix	trans	-76	-21.9	177.7	-71.2	-162.5	126.3	0	0	113.2	D750	E748-D750 VanDerWaalsContact C-N 3.32Å; E748-D750 PolarHBondContact O-N 3.35Å
749	Q	34.8	Very low	36.5	Very low	159 Å²	159	130.8 Å²	130.8	74%	0.743	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-20.2	-178.4	-146.5	70.8	-5	0	0	113.9	N747	N747-Q749 VanDerWaalsContact C-N 3.35Å
750	D	34.1	Very low	36.3	Very low	93 Å²	93	134 Å²	134	50%	0.497	66%	0.664	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.4	-11.2	-172.9	-153.6	52.4	0	0	0	114.2	E748 K754	E748-D750 VanDerWaalsContact C-N 3.32Å; E748-D750 PolarHBondContact O-N 3.35Å; D750-K754 IonicContact OD2-NZ 3.8Å; D750-K754 PolarHBondContact OD2-NZ 3.22Å
751	E	36.1	Very low	35.9	Very low	157 Å²	157	139.6 Å²	139.6	73%	0.734	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-31.1	168.9	-80	-134.4	116.7	0	0	112.1	N753 K754	E751-N753 PolarHBondContact O-N 3.41Å; E751-K754 PolarHBondContact O-N 2.9Å
752	H	35.6	Very low	35.5	Very low	155 Å²	155	142.6 Å²	142.6	72%	0.718	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-14.9	-174.2	-155	-63.5	0	0	0	113.9
753	N	35.4	Very low	35.1	Very low	132 Å²	132	143.7 Å²	143.7	71%	0.706	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	-5	173.6	-83.4	-40.4	0	0	0	114.9	E751	E751-N753 PolarHBondContact O-N 3.41Å
754	K	35.8	Very low	34.7	Very low	130 Å²	130	148.4 Å²	148.4	57%	0.565	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-8.6	174.9	-78.1	163.4	-175.3	141.3	0	113.8	D750 E751 V756	D750-K754 IonicContact OD2-NZ 3.8Å; D750-K754 PolarHBondContact OD2-NZ 3.22Å; E751-K754 PolarHBondContact O-N 2.9Å; K754-V756 PolarHBondContact O-N 3.38Å
755	L	36.2	Very low	34.5	Very low	141 Å²	141	154.4 Å²	154.4	74%	0.738	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-13.4	179.3	-153.9	71	0	0	0	114.5
756	V	36.5	Very low	34.3	Very low	114 Å²	114	154.7 Å²	154.7	69%	0.691	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-40.1	-178.7	179.6	0	0	0	0	112.5	K754	K754-V756 PolarHBondContact O-N 3.38Å
757	D	35.2	Very low	34	Very low	130 Å²	130	157.5 Å²	157.5	70%	0.695	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-87.1	-31.5	-165.3	-128.4	-16.8	0	0	0	114	K759 Q760	D757-K759 PolarHBondContact O-N 3.11Å; D757-K759 VanDerWaalsContact O-N 3.16Å; D757-Q760 PolarHBondContact O-N 3.39Å
758	Q	36.3	Very low	33.9	Very low	174 Å²	174	155.2 Å²	155.2	81%	0.813	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-68.7	-12.3	176.3	-73.8	-158.4	11.4	0	0	113.8
759	K	36.1	Very low	33.7	Very low	186 Å²	186	156.1 Å²	156.1	81%	0.809	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-82.8	-10.3	-178.4	-144.8	168.9	-173.6	173.7	0	114.2	D757	D757-K759 PolarHBondContact O-N 3.11Å; D757-K759 VanDerWaalsContact O-N 3.16Å
760	Q	35.6	Very low	33.5	Very low	149 Å²	149	155.7 Å²	155.7	70%	0.696	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	-22.8	176.6	-66.3	-165.8	-1.7	0	0	114.4	D757 K762	D757-Q760 PolarHBondContact O-N 3.39Å; Q760-K762 VanDerWaalsContact C-N 3.3Å; Q760-K762 PolarHBondContact O-N 3.45Å; Q760-K762 VanDerWaalsContact O-N 3.17Å
761	R	31.4	Very low	33.3	Very low	237 Å²	237	158.1 Å²	158.1	89%	0.894	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	14.6	-171	-113.2	-177	-171.7	-152	2.6	117.1
762	K	32.6	Very low	33	Very low	193 Å²	193	158.4 Å²	158.4	84%	0.839	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.3	-0.8	176.4	-82.8	-179.5	175.6	172	0	115.8	Q760	Q760-K762 VanDerWaalsContact C-N 3.3Å; Q760-K762 PolarHBondContact O-N 3.45Å; Q760-K762 VanDerWaalsContact O-N 3.17Å
763	N	31.2	Very low	32.8	Very low	144 Å²	144	157.2 Å²	157.2	77%	0.77	76%	0.759	S	S	*	*	S	Bend	trans	-114.8	26.9	-178.1	-83.6	-0.6	0	0	0	114.7
764	Y	28.9	Very low	32.3	Very low	220 Å²	220	161.1 Å²	161.1	86%	0.863	76%	0.763	S	S	*	*			trans	-141.8	72.7	175.2	-79	-71.4	0	0	0	113.8
765	L	32	Very low	32.1	Very low	165 Å²	165	161.1 Å²	161.1	86%	0.864	78%	0.775	S	S	*	*			trans	-163.3	51.6	141.3	-151.8	66.7	0	0	0	113.6
766	I	30.5	Very low	31.6	Very low	162 Å²	162	161.1 Å²	161.1	83%	0.831	78%	0.775	S	S	*	*			trans	-95.9	85.3	168	-56.8	176.2	0	0	0	108.7
767	H	30.1	Very low	31.1	Very low	187 Å²	187	163 Å²	163	87%	0.866	78%	0.781	S	S	*	*			trans	170.6	136.1	149.9	-111.8	-96.2	0	0	0	109.5
768	G	31	Very low	30.8	Very low	69 Å²	69	162.4 Å²	162.4	71%	0.711	79%	0.788	S	S	*	*			trans	144.5	72.9	166.2	0	0	0	0	0	117.7
769	K	32.4	Very low	30.2	Very low	181 Å²	181	164.3 Å²	164.3	79%	0.787	79%	0.789	S	S	*	*			trans	50.6	111.5	148.4	-63.4	-172.7	172	178.6	0	118.8
770	E	30.1	Very low	30.1	Very low	151 Å²	151	161 Å²	161	71%	0.706	79%	0.787	S	S	*	*				70.5	123.5	72.6	-69.2	172.7	161.8	0	0	114.5
771	N	30.7	Very low	29.6	Very low	143 Å²	143	162.9 Å²	162.9	77%	0.765	80%	0.795	S	S	*	*			trans	69.9	155	158.3	-52.9	-34.4	0	0	0	116
772	F	29.4	Very low	29.6	Very low	164 Å²	164	156 Å²	156	72%	0.719	78%	0.783	S	S	*	*			cis	-151.7	133.8	2.3	-155.7	-121.1	0	0	0	112.6
773	Q	31.7	Very low	29.4	Very low	129 Å²	129	155.2 Å²	155.2	60%	0.603	78%	0.783	S	S	*	*			trans	33.7	116.4	137.1	-123.1	142.7	-64.9	0	0	123.7
774	R	24.8	Very low	29.2	Very low	214 Å²	214	154.1 Å²	154.1	81%	0.808	78%	0.781	S	S	*	*				47.3	102.3	123.3	-173.2	-155.7	-73.6	177.6	-4.7	120.8
775	T	31.1	Very low	29.5	Very low	130 Å²	130	150.3 Å²	150.3	80%	0.798	78%	0.781	S	S	*	*			trans	-164.1	126.6	132.3	34.6	0	0	0	0	108.4
776	N	25.1	Very low	29.4	Very low	141 Å²	141	147.4 Å²	147.4	75%	0.754	77%	0.774	S	S	*	*				62.8	127.6	76.9	-88	13.9	0	0	0	116.6
777	N	26.5	Very low	29.6	Very low	153 Å²	153	145.5 Å²	145.5	82%	0.818	77%	0.771	S	S	*	*			trans	65.1	108.5	161.1	-55.5	-7.5	0	0	0	119.4
778	S	30	Very low	29.6	Very low	119 Å²	119	141.9 Å²	141.9	83%	0.832	76%	0.762	S	S	*	*				172	165.5	100.2	-160.5	0	0	0	0	112.5
779	Y	24	Very low	29.7	Very low	213 Å²	213	146.7 Å²	146.7	84%	0.835	77%	0.765	S	S	*	*			trans	-79.4	153.8	170.6	-84.7	-103.9	0	0	0	112.2
780	P	32.9	Very low	29.4	Very low	118 Å²	118	145.8 Å²	145.8	77%	0.766	76%	0.764	S	S	*	*			trans	-111.2	141.5	141.4	34.4	-27.7	0	0	0	111.5
781	H	26.1	Very low	29.4	Very low	187 Å²	187	145.6 Å²	145.6	87%	0.866	77%	0.766	S	S	*	*			trans	-141.9	98.8	-179.2	-166.3	22.8	0	0	0	110.1
782	S	30.3	Very low	29.3	Very low	92 Å²	92	144 Å²	144	64%	0.643	76%	0.757	S	S	*	*			trans	-161.4	124.6	-177	48.7	0	0	0	0	108.3
783	Q	29.3	Very low	29.2	Very low	178 Å²	178	144.1 Å²	144.1	83%	0.832	76%	0.76	S	S	*	*				67.9	135.7	75.6	-70.4	-178.9	2.4	0	0	113.9
784	T	27.3	Very low	29.1	Very low	121 Å²	121	143.5 Å²	143.5	74%	0.742	77%	0.765	S	S	*	*			cis	-174.3	140.3	-17.5	18.2	0	0	0	0	110.2
785	T	33.2	Very low	29.2	Very low	139 Å²	139	139.8 Å²	139.8	85%	0.853	76%	0.761	S	S	*	*			trans	-165.7	124.7	159.8	25.7	0	0	0	0	106.9
786	S	31.4	Very low	29.2	Very low	104 Å²	104	142.9 Å²	142.9	73%	0.727	77%	0.766	S	S	*	*			cis	68.5	127.8	25	-150.9	0	0	0	0	113.1
787	T	33	Very low	29.3	Very low	123 Å²	123	144.7 Å²	144.7	76%	0.755	77%	0.772	S	S	*	*			cis	-121.2	175.5	12.7	47.8	0	0	0	0	111.6
788	V	31.2	Very low	29.2	Very low	111 Å²	111	142.5 Å²	142.5	67%	0.673	77%	0.769	S	S	*	*				-160.4	137.1	54.6	165.9	0	0	0	0	111.9
789	Q	32.3	Very low	29.2	Very low	169 Å²	169	142.3 Å²	142.3	79%	0.79	77%	0.765	S	S	*	*			trans	24.4	123.6	156.9	-62.1	166.8	-82.2	0	0	119.5
790	E	26.6	Very low	29.2	Very low	162 Å²	162	138.9 Å²	138.9	76%	0.757	76%	0.759	S	S	*	*			cis	72.6	114.7	23	-162.2	176.4	-132.2	0	0	117.5	L792	E790-L792 HydrophobicContact CG-CD1 4.32Å
791	I	30.6	Very low	28.9	Very low	147 Å²	147	139.1 Å²	139.1	75%	0.754	76%	0.763	S	S	*	*			trans	170.3	101.9	144.3	-86.3	153.2	0	0	0	104.6
792	L	29	Very low	28.8	Very low	109 Å²	109	136.8 Å²	136.8	57%	0.571	76%	0.757	S	S	*	*				64.9	107.1	77.8	-70.3	162.3	0	0	0	112.5	E790	E790-L792 HydrophobicContact CG-CD1 4.32Å
793	E	26.8	Very low	28.8	Very low	168 Å²	168	140.6 Å²	140.6	79%	0.785	77%	0.769	S	S	*	*				86	150.6	96.4	-121.3	171.3	-134.3	0	0	110.8
794	V	30.3	Very low	28.5	Very low	116 Å²	116	140 Å²	140	70%	0.703	77%	0.771	S	S	*	*			cis	-143.5	176.2	21.8	-177.6	0	0	0	0	109.8
795	D	26	Very low	28.5	Very low	136 Å²	136	137.2 Å²	137.2	73%	0.727	77%	0.766	S	S	*	*			trans	-49.5	162.6	170.4	-54.2	-90.1	0	0	0	116.6
796	E	30.9	Very low	28.1	Very low	194 Å²	194	135.4 Å²	135.4	91%	0.907	76%	0.76	S	S	*	*				-170	156.9	106.6	-106	-172.4	169.7	0	0	116.4
797	M	26.6	Very low	28	Very low	180 Å²	180	136.9 Å²	136.9	89%	0.887	76%	0.76	S	S	*	*			trans	-77	164.2	-166.7	-57.4	178.7	-179.3	0	0	115.9
798	S	25.6	Very low	27.7	Very low	106 Å²	106	138 Å²	138	74%	0.741	76%	0.756	S	S	*	*			trans	-97.4	143.9	173.7	59.4	0	0	0	0	114.6
799	P	30	Very low	27.4	Very low	115 Å²	115	140.7 Å²	140.7	75%	0.747	76%	0.759	S	S	*	*			trans	-126.1	137.8	136.8	34.7	-24.5	0	0	0	110.5
800	I	23.3	Very low	27.3	Very low	141 Å²	141	138.5 Å²	138.5	72%	0.723	75%	0.75	S	S	*	*				63.7	95.8	61.7	-55.6	178.4	0	0	0	113.8
801	C	27.5	Very low	27.2	Very low	123 Å²	123	137.2 Å²	137.2	83%	0.831	75%	0.749	S	S	*	*			trans	-157.7	119.7	144.5	-91.9	0	0	0	0	105.4
802	N	24.2	Very low	27	Very low	139 Å²	139	135.4 Å²	135.4	74%	0.743	75%	0.749	S	S	*	*				71.1	146.8	58.5	-76.2	-4.3	0	0	0	114.9
803	L	28.6	Very low	27	Very low	172 Å²	172	138.2 Å²	138.2	90%	0.901	76%	0.759	S	S	*	*			trans	83.3	98.1	-162.9	-56.8	163.1	0	0	0	112.5
804	N	23.6	Very low	27.2	Very low	165 Å²	165	136.9 Å²	136.9	88%	0.882	76%	0.763	S	S	*	*			cis	82.8	125.9	17.4	-155.4	51.8	0	0	0	116.3
805	G	27.2	Very low	27	Very low	62 Å²	62	137.7 Å²	137.7	64%	0.639	76%	0.763	S	S	*	*			trans	82.8	154.5	-176.3	0	0	0	0	0	114.6
806	S	26.1	Very low	27.2	Very low	102 Å²	102	139 Å²	139	71%	0.713	77%	0.768	S	S	*	*			cis	-176.5	145.7	-14.4	44	0	0	0	0	109.9
807	N	28.6	Very low	27.1	Very low	135 Å²	135	138 Å²	138	72%	0.722	77%	0.766	S	S	*	*			trans	67.1	164.1	159	-58.1	18.7	0	0	0	117.3
808	E	27.1	Very low	27	Very low	147 Å²	147	139 Å²	139	69%	0.687	77%	0.766	S	S	*	*			cis	-163.5	163.8	-37.7	-108.8	169.7	141.3	0	0	109.2
809	F	25.4	Very low	27.4	Very low	167 Å²	167	141.6 Å²	141.6	73%	0.732	77%	0.768	S	S	*	*			trans	69.5	137.3	146.4	-94.7	-128	0	0	0	124
810	M	29.2	Very low	27.3	Very low	123 Å²	123	143.9 Å²	143.9	61%	0.606	77%	0.766	S	S	*	*			trans	76.2	103.4	145.7	-59.4	-70.4	92.3	0	0	123.1
811	D	25.3	Very low	27.9	Very low	135 Å²	135	144.8 Å²	144.8	72%	0.722	77%	0.772	S	S	*	*				59.8	158.1	103.9	-66.6	19.3	0	0	0	124.5
812	S	26.4	Very low	27.9	Very low	109 Å²	109	145 Å²	145	76%	0.762	77%	0.765	S	S	*	*			trans	84.2	89.1	164.7	69.9	0	0	0	0	120.5
813	Q	27.5	Very low	28.4	Very low	167 Å²	167	147.7 Å²	147.7	78%	0.78	77%	0.77	S	S	*	*				44.8	122.7	111.1	-171.5	177.1	30	0	0	120.5
814	T	31.3	Very low	28.3	Very low	140 Å²	140	146.3 Å²	146.3	86%	0.859	76%	0.763	S	S	*	*			trans	-161.9	131.1	137.2	-2.8	0	0	0	0	111.9
815	D	26.2	Very low	28.6	Very low	133 Å²	133	144 Å²	144	71%	0.711	76%	0.758	S	S	*	*			trans	-79.4	168.4	168.4	-61.7	-82.2	0	0	0	111.7
816	I	30.8	Very low	28.6	Very low	164 Å²	164	145.3 Å²	145.3	84%	0.841	76%	0.757	S	S	*	*			trans	-168.9	114.9	138.1	-103.3	154.2	0	0	0	114.1
817	M	28.4	Very low	28.8	Very low	174 Å²	174	147.5 Å²	147.5	86%	0.857	76%	0.761	S	S	*	*			trans	80.2	130.8	135.7	-157.6	159.6	176.7	0	0	123.4
818	F	25.4	Very low	28.9	Very low	200 Å²	200	148.7 Å²	148.7	88%	0.877	77%	0.766	S	S	*	*			trans	-102.8	160.1	169.6	-90.7	-105.1	0	0	0	111.9
819	M	33.1	Very low	28.9	Very low	160 Å²	160	148 Å²	148	79%	0.788	77%	0.767	S	S	*	*			trans	177.9	130.3	138.7	-86.2	-86.1	178.2	0	0	105.9
820	K	27.9	Very low	29.2	Very low	163 Å²	163	148.3 Å²	148.3	71%	0.709	77%	0.768	S	S	*	*			cis	91.4	120.1	39.3	-177.4	-177	178.3	-179.5	0	112.9
821	D	36.4	Very low	29.1	Very low	160 Å²	160	147.9 Å²	147.9	86%	0.856	77%	0.768	S	S	*	*			trans	-161.1	157.5	149.4	-121.6	-27	0	0	0	113.3
822	N	28.1	Very low	29.3	Very low	127 Å²	127	151 Å²	151	68%	0.679	77%	0.771	S	S	*	*			trans	-134.7	146.6	-168.9	-81.2	-7.7	0	0	0	114.1
823	K	34	Very low	29.4	Very low	196 Å²	196	153.2 Å²	153.2	85%	0.852	77%	0.771	S	S	*	*			trans	-173.6	132	145.6	-103.4	158.9	178.4	-179.4	0	108.9
824	I	26.8	Very low	29.7	Very low	144 Å²	144	150.9 Å²	150.9	74%	0.738	77%	0.768	S	S	*	*			cis	98.7	142.3	36.2	-70.3	166.7	0	0	0	112.5
825	C	29.1	Very low	29.6	Very low	116 Å²	116	149.2 Å²	149.2	78%	0.784	76%	0.76	S	S	*	*			trans	76.9	146.3	179.6	-77.1	0	0	0	0	117.7
826	S	28.2	Very low	29.5	Very low	90 Å²	90	147.1 Å²	147.1	63%	0.629	76%	0.755	S	S	*	*			cis	177.2	140.2	-37.9	41.5	0	0	0	0	108.6
827	D	29.4	Very low	29.3	Very low	147 Å²	147	146.5 Å²	146.5	79%	0.786	75%	0.754	S	S	*	*			trans	31.2	132.4	153.1	-47.5	-40.2	0	0	0	121.6
828	I	31.7	Very low	29.2	Very low	161 Å²	161	144.3 Å²	144.3	83%	0.826	75%	0.75	S	S	*	*				178.5	98.2	109.6	-86.2	153.5	0	0	0	110
829	N	26.8	Very low	29.2	Very low	132 Å²	132	139.9 Å²	139.9	71%	0.706	74%	0.739	S	S	*	*				53.7	153.2	118.4	-144.8	1.1	0	0	0	122.5
830	K	31.5	Very low	28.9	Very low	173 Å²	173	140 Å²	140	75%	0.752	74%	0.738	S	S	*	*			trans	77.4	146.5	168.5	-56.7	-179.3	179.8	179.2	0	117.8
831	D	26.9	Very low	28.8	Very low	115 Å²	115	138.1 Å²	138.1	62%	0.615	74%	0.735	S	S	*	*			cis	-175.6	176.8	-32.2	-110.5	-47.1	0	0	0	107.7
832	Y	28.9	Very low	28.4	Very low	201 Å²	201	138.1 Å²	138.1	79%	0.788	73%	0.728	S	S	*	*			trans	72.2	134.8	168.1	-47.9	-76.8	0	0	0	117.1
833	M	29.5	Very low	28.5	Very low	154 Å²	154	138.1 Å²	138.1	76%	0.759	73%	0.728	S	S	*	*			cis	-157.8	153.3	-16.1	-130.8	174.4	87.3	0	0	110.5
834	V	32.6	Very low	28.5	Very low	118 Å²	118	137 Å²	137	72%	0.715	72%	0.723	S	S	*	*			trans	-124.2	136.6	172.4	-176.1	0	0	0	0	109
835	P	29.9	Very low	28.8	Very low	106 Å²	106	137.5 Å²	137.5	69%	0.688	72%	0.722	S	S	*	*				-138.8	133	125.4	29	-12.8	0	0	0	110.6
836	S	25.2	Very low	28.8	Very low	88 Å²	88	137.7 Å²	137.7	62%	0.615	71%	0.714	S	S	*	*			cis	49.6	108	41.8	-66.9	0	0	0	0	114.2
837	N	25.8	Very low	28.9	Very low	151 Å²	151	138.4 Å²	138.4	81%	0.807	72%	0.718	S	S	*	*			trans	165	149.6	131.1	-87.3	-21.3	0	0	0	114.8
838	V	25.4	Very low	29	Very low	128 Å²	128	138.1 Å²	138.1	78%	0.776	71%	0.712	S	S	*	*			trans	69.1	138.9	136.3	159.6	0	0	0	0	120
839	V	25.7	Very low	28.9	Very low	108 Å²	108	136.8 Å²	136.8	66%	0.655	71%	0.706	S	S	*	*			cis	-170.3	167.3	-18.8	78.3	0	0	0	0	111.5
840	Q	27	Very low	29.1	Very low	161 Å²	161	135.2 Å²	135.2	75%	0.752	70%	0.701	S	S	*	*			trans	67.9	110.8	153.5	-76.1	177.9	13.1	0	0	123.6
841	N	25.1	Very low	29.1	Very low	124 Å²	124	133.4 Å²	133.4	66%	0.663	70%	0.7	S	S	*	*				90.2	150.7	99.6	-153.7	12.4	0	0	0	121.7
842	K	29.8	Very low	29.4	Very low	160 Å²	160	133 Å²	133	70%	0.696	70%	0.702	S	S	*	*			trans	85.4	95.8	162.9	-56.3	-164.5	175.2	175.4	0	121.3
843	D	29.2	Very low	29.5	Very low	127 Å²	127	129.4 Å²	129.4	68%	0.679	70%	0.696	S	S	*	*				50.8	127.5	118.1	-37.1	-35.3	0	0	0	121.2
844	K	33	Very low	29.7	Very low	174 Å²	174	127.6 Å²	127.6	76%	0.757	69%	0.689	S	S	*	*				178	135.3	94.6	-100.1	177.8	175.9	-177.5	0	116.2
845	H	35.1	Very low	29.7	Very low	153 Å²	153	129.2 Å²	129.2	71%	0.708	69%	0.689	S	S	*	*			trans	59.5	148.2	151.9	-59.8	-54.2	0	0	0	119.1
846	L	28	Very low	29.8	Very low	120 Å²	120	129.9 Å²	129.9	63%	0.628	69%	0.686	S	S	*	*			cis	-167.8	158.5	-21.7	-158.5	56	0	0	0	104.4	Q848	L846-Q848 HydrophobicContact CD1-CG 4.01Å
847	C	30.8	Very low	30.1	Very low	105 Å²	105	131.8 Å²	131.8	71%	0.709	69%	0.689	S	S	*	*			cis	-122.8	178.4	19.5	-61.7	0	0	0	0	110.6
848	Q	31.8	Very low	30.4	Very low	141 Å²	141	130.6 Å²	130.6	66%	0.659	68%	0.683	S	S	*	*			cis	78.1	136.9	20.9	-56	-166.2	-19.6	0	0	114.9	L846	L846-Q848 HydrophobicContact CD1-CG 4.01Å
849	L	29.6	Very low	30.6	Very low	134 Å²	134	129.5 Å²	129.5	70%	0.702	68%	0.676	S	S	*	*			cis	-164.3	152.4	2	-133	53.3	0	0	0	105.8
850	T	29.9	Very low	30.7	Very low	98 Å²	98	130.4 Å²	130.4	60%	0.601	68%	0.677	S	S	*	*			cis	179.6	166.7	-11.3	27.1	0	0	0	0	110.7
851	N	32.2	Very low	30.7	Very low	136 Å²	136	129.4 Å²	129.4	73%	0.727	68%	0.676	S	S	*	*			trans	75.2	150.2	143.7	-71.1	4.1	0	0	0	120.9
852	T	33.6	Very low	31	Very low	107 Å²	107	133.4 Å²	133.4	66%	0.656	69%	0.687	S	S	*	*			cis	-165.7	151	-8.2	24.4	0	0	0	0	113.3
853	N	30.7	Very low	30.9	Very low	124 Å²	124	134.2 Å²	134.2	66%	0.663	69%	0.694	S	S	*	*			trans	82.7	138.1	137.1	-82.9	39.8	0	0	0	125.7
854	D	33.6	Very low	30.9	Very low	116 Å²	116	133.6 Å²	133.6	62%	0.62	70%	0.699	S	S	*	*			trans	69.1	139.4	137.7	-57.1	-11.6	0	0	0	120.9
855	H	32.6	Very low	30.9	Very low	152 Å²	152	132.8 Å²	132.8	70%	0.704	70%	0.701	S	S	*	*			cis	-168.5	160.2	-13.1	-124.2	-32.1	0	0	0	111.6
856	I	32	Very low	30.5	Very low	121 Å²	121	135.1 Å²	135.1	62%	0.621	71%	0.71	S	S	*	*			trans	70.1	115.4	140.5	-74.7	164.6	0	0	0	121.7
857	N	31.7	Very low	30.4	Very low	128 Å²	128	134.4 Å²	134.4	68%	0.684	72%	0.715	S	S	*	*			trans	58.8	160.7	130.1	-57.9	39.2	0	0	0	121.2
858	D	32.3	Very low	30.3	Very low	126 Å²	126	135.3 Å²	135.3	67%	0.674	72%	0.716	S	S	*	*			cis	-151.4	173	-13.1	-125.6	-41.2	0	0	0	114.6
859	T	29.3	Very low	30.3	Very low	104 Å²	104	136 Å²	136	64%	0.638	72%	0.719	S	S	*	*			trans	-51.7	167.6	177.7	60.1	0	0	0	0	120.6
860	N	26.8	Very low	30.2	Very low	128 Å²	128	135.8 Å²	135.8	68%	0.684	72%	0.719	S	S	*	*			trans	102.1	120.6	132.4	-81.9	-33.8	0	0	0	124.1
861	I	27.1	Very low	30.4	Very low	139 Å²	139	138 Å²	138	71%	0.713	73%	0.725	S	S	*	*			trans	68.4	114.7	133.5	-58.6	163.6	0	0	0	120
862	K	32.2	Very low	30.1	Very low	208 Å²	208	137.1 Å²	137.1	90%	0.904	72%	0.721	S	S	*	*				-154.9	138.3	124.5	-113.6	163.2	-174.1	170.8	0	112.5
863	Q	28	Very low	29.8	Very low	178 Å²	178	138.7 Å²	138.7	83%	0.832	73%	0.725	S	S	*	*			trans	-107.9	-179.1	178.6	-72.4	-178.1	-27.2	0	0	111.4
864	S	28	Very low	29.8	Very low	114 Å²	114	140.2 Å²	140.2	80%	0.797	73%	0.734	S	S	*	*			trans	76.2	149.6	176.5	81.7	0	0	0	0	114.7
865	I	33	Very low	29.6	Very low	157 Å²	157	141.6 Å²	141.6	81%	0.805	75%	0.746	S	S	*	*			cis	-131.2	150.4	14.9	-63.6	169.7	0	0	0	111.2
866	K	26.5	Very low	29.4	Very low	202 Å²	202	143 Å²	143	88%	0.878	75%	0.752	S	S	*	*			trans	-105.7	148.7	165.8	-85.6	-175.7	174.6	178.8	0	110.7
867	S	27.9	Very low	29.2	Very low	105 Å²	105	143.5 Å²	143.5	73%	0.734	76%	0.756	S	S	*	*				-175.4	159.1	127.7	76.4	0	0	0	0	113
868	V	28.6	Very low	29.2	Very low	123 Å²	123	143.7 Å²	143.7	75%	0.745	76%	0.762	S	S	*	*			trans	61	135	153.3	170.7	0	0	0	0	118.2
869	H	31.8	Very low	29	Very low	155 Å²	155	148.8 Å²	148.8	72%	0.718	77%	0.773	S	S	*	*			cis	-139.7	137.2	-11.5	-108.5	-3.1	0	0	0	105
870	N	26.6	Very low	28.9	Very low	130 Å²	130	150.1 Å²	150.1	70%	0.695	78%	0.776	S	S	*	*				67.3	145.6	65.5	-157	21	0	0	0	115.5
871	I	33	Very low	29.1	Very low	144 Å²	144	151.8 Å²	151.8	74%	0.738	78%	0.78	S	S	*	*			trans	76.4	130	179.7	-48.9	172.1	0	0	0	115
872	N	27.4	Very low	29.1	Very low	118 Å²	118	153.6 Å²	153.6	63%	0.631	79%	0.79	S	S	*	*			cis	-160.6	160.1	-39.3	-134.1	0.4	0	0	0	110.1
873	N	27.6	Very low	29	Very low	140 Å²	140	147.9 Å²	147.9	75%	0.749	78%	0.782	S	S	*	*			trans	40	103.2	153.1	-55.5	-16.3	0	0	0	119.8
874	N	29.3	Very low	29	Very low	157 Å²	157	144.9 Å²	144.9	84%	0.84	78%	0.775	S	S	*	*				-178	34	112.2	-152.3	1.4	0	0	0	114.6
875	V	30.3	Very low	29	Very low	144 Å²	144	146.6 Å²	146.6	87%	0.873	78%	0.776	S	S	*	*			trans	-105.8	60.6	-175	-167.1	0	0	0	0	111.5
876	H	28.1	Very low	28.7	Very low	182 Å²	182	151.1 Å²	151.1	84%	0.843	78%	0.782	S	S	*	*	S	Bend	trans	-152.5	69.4	176.5	-116.9	-80.3	0	0	0	112.8
877	N	28.6	Very low	28.7	Very low	131 Å²	131	149.5 Å²	149.5	70%	0.701	78%	0.776	S	S	*	*	S	Bend	trans	-161	-25.1	162.6	-121.3	-11.7	0	0	0	115.9	Y879 N880	N877-Y879 PolarHBondContact O-N 3.46Å; N877-Y879 VanDerWaalsContact O-N 3.07Å; N877-N880 PolarHBondContact O-N 3.4Å
878	V	31.5	Very low	28.7	Very low	133 Å²	133	153.2 Å²	153.2	81%	0.806	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-15.9	-166.5	-176.7	0	0	0	0	114.9
879	Y	27	Very low	28.7	Very low	233 Å²	233	151.3 Å²	151.3	91%	0.914	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-0.7	-178.1	-93.5	-82.7	0	0	0	116.3	N877	N877-Y879 PolarHBondContact O-N 3.46Å; N877-Y879 VanDerWaalsContact O-N 3.07Å
880	N	28.4	Very low	28.4	Very low	132 Å²	132	151.1 Å²	151.1	71%	0.706	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.5	-8.4	178.1	-88.1	-28.1	0	0	0	115.4	N877	N877-N880 PolarHBondContact O-N 3.4Å
881	E	29.5	Very low	28.5	Very low	163 Å²	163	152.2 Å²	152.2	76%	0.762	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	1.3	-168.7	-137.9	-172.4	159.5	0	0	116.2
882	L	28.5	Very low	28.2	Very low	177 Å²	177	152.1 Å²	152.1	93%	0.927	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	-4.5	172.1	-83.5	165.5	0	0	0	114.2
883	A	28.7	Very low	28.2	Very low	88 Å²	88	152.8 Å²	152.8	73%	0.727	78%	0.777	S	S	*	*	S	Bend	trans	-81	-13.5	178.5	0	0	0	0	0	114.1
884	V	28.7	Very low	28.3	Very low	115 Å²	115	155.6 Å²	155.6	70%	0.697	78%	0.778	S	S	*	*	S	Bend	trans	-130.2	62.1	-167.4	-164.8	0	0	0	0	112.6
885	N	27.5	Very low	28.3	Very low	150 Å²	150	155.8 Å²	155.8	80%	0.802	78%	0.777	S	S	*	*			trans	-156.4	3.8	158.6	-106.6	-46	0	0	0	117.1	K887	N885-K887 PolarHBondContact O-N 2.95Å
886	R	26.9	Very low	28.3	Very low	251 Å²	251	155.4 Å²	155.4	95%	0.947	77%	0.769	S	S	*	*			trans	-69.6	89.1	158	-87.4	-169.2	178.3	174.3	3	108.9	E888	R886-E888 VanDerWaalsContact C-N 3.27Å; R886-E888 PolarHBondContact O-N 2.96Å
887	K	27.4	Very low	28.3	Very low	169 Å²	169	155.2 Å²	155.2	74%	0.735	77%	0.769	S	S	*	*			trans	-65.9	97.8	154	-81.6	-175.1	177.4	177	0	107.2	N885 S889	N885-K887 PolarHBondContact O-N 2.95Å; K887-S889 PolarHBondContact O-N 3.46Å
888	E	28.2	Very low	28.4	Very low	182 Å²	182	155.8 Å²	155.8	85%	0.85	78%	0.78	S	S	*	*			trans	-66.5	85.9	166	-163.9	155.3	-126.4	0	0	107.3	R886	R886-E888 VanDerWaalsContact C-N 3.27Å; R886-E888 PolarHBondContact O-N 2.96Å
889	S	27.6	Very low	28.3	Very low	84 Å²	84	152.1 Å²	152.1	59%	0.587	77%	0.769	S	S	*	*			trans	-81.7	120.7	174.5	49.6	0	0	0	0	108.7	K887 E891	K887-S889 PolarHBondContact O-N 3.46Å; S889-E891 PolarHBondContact O-N 3.02Å
890	D	25.4	Very low	28.4	Very low	151 Å²	151	151.4 Å²	151.4	81%	0.807	77%	0.766	S	S	*	*			trans	-65.9	68.9	-178.6	-63.6	-69.9	0	0	0	113.3	Q892	D890-Q892 PolarHBondContact O-N 3.24Å
891	E	28.7	Very low	28.6	Very low	153 Å²	153	153.1 Å²	153.1	72%	0.715	77%	0.773	S	S	*	*			trans	-72.4	83.9	167	-72.6	-166.2	-175.3	0	0	109.6	S889 I893	S889-E891 PolarHBondContact O-N 3.02Å; E891-I893 HydrophobicContact CB-CG1 4.2Å; E891-I893 PolarHBondContact O-N 3.4Å
892	Q	26.7	Very low	28.4	Very low	141 Å²	141	156.1 Å²	156.1	66%	0.659	78%	0.778	S	S	*	*			trans	-63.3	85	158.7	-66.7	-173.5	5.6	0	0	108.4	D890 W894	D890-Q892 PolarHBondContact O-N 3.24Å; Q892-W894 VanDerWaalsContact C-N 3.27Å; Q892-W894 PolarHBondContact O-N 3.04Å
893	I	28.8	Very low	28.5	Very low	132 Å²	132	152.9 Å²	152.9	68%	0.677	77%	0.769	S	S	*	*			trans	-68.6	89.2	176.7	-59.1	177.7	0	0	0	108.4	E891 I895	E891-I893 HydrophobicContact CB-CG1 4.2Å; E891-I893 PolarHBondContact O-N 3.4Å; I893-I895 PolarHBondContact O-N 3.16Å; I893-I895 VanDerWaalsContact O-N 3.15Å
894	W	27.9	Very low	28.5	Very low	200 Å²	200	155 Å²	155	76%	0.758	76%	0.764	S	S	*	*			trans	-56.5	115.2	164.7	-72.3	88.8	0	0	0	108.7	Q892 L896	Q892-W894 VanDerWaalsContact C-N 3.27Å; Q892-W894 PolarHBondContact O-N 3.04Å; W894-L896 HydrophobicContact CB-CD1 3.94Å; W894-L896 PolarHBondContact O-N 3.27Å
895	I	30.4	Very low	28.4	Very low	161 Å²	161	154.8 Å²	154.8	83%	0.826	77%	0.767	S	S	*	*			trans	-76.3	72.5	171.5	-53.4	179	0	0	0	107.7	I893	I893-I895 PolarHBondContact O-N 3.16Å; I893-I895 VanDerWaalsContact O-N 3.15Å
896	L	29.5	Very low	28.6	Very low	135 Å²	135	154.9 Å²	154.9	71%	0.707	76%	0.763	S	S	*	*			trans	-63.1	154.8	165.4	-108.5	72.5	0	0	0	109.8	W894	W894-L896 HydrophobicContact CB-CD1 3.94Å; W894-L896 PolarHBondContact O-N 3.27Å
897	Q	28.1	Very low	28.7	Very low	179 Å²	179	150.4 Å²	150.4	84%	0.836	76%	0.758	S	S	*	*			trans	-61.8	150.2	179.4	-64.5	176.1	-72.1	0	0	111.2	G899	Q897-G899 PolarHBondContact O-N 3.11Å
898	P	30.8	Very low	28.7	Very low	143 Å²	143	152.1 Å²	152.1	93%	0.929	77%	0.768	S	S	*	*	S	Bend	trans	-67.1	94.5	176.7	28.5	-34.7	0	0	0	110.2
899	G	29.4	Very low	28.9	Very low	56 Å²	56	148.1 Å²	148.1	58%	0.577	77%	0.766	S	S	*	*			trans	-153.3	-18.9	-172.8	0	0	0	0	0	117	Q897	Q897-G899 PolarHBondContact O-N 3.11Å
900	Y	30.2	Very low	28.9	Very low	218 Å²	218	154.1 Å²	154.1	86%	0.855	78%	0.782	S	S	*	*			trans	-138.7	134.8	179	-66.9	-79.3	0	0	0	111.9
901	I	31.2	Very low	29.1	Very low	168 Å²	168	155.3 Å²	155.3	86%	0.862	79%	0.787	S	S	*	*			trans	-118.9	109.8	170.4	-61.3	174.3	0	0	0	107.3
902	W	26.5	Very low	29.3	Very low	226 Å²	226	153.3 Å²	153.3	86%	0.856	79%	0.79	S	S	*	*			trans	-90.8	138.3	162.6	-97.1	63.7	0	0	0	109.4
903	C	30.8	Very low	29.5	Very low	109 Å²	109	152 Å²	152	74%	0.736	79%	0.792	S	S	*	*			trans	-123	79.7	179.3	-171.1	0	0	0	0	109.2	S905	C903-S905 PolarHBondContact O-N 3.37Å
904	Q	28.9	Very low	29.7	Very low	132 Å²	132	155.6 Å²	155.6	62%	0.617	80%	0.803	S	S	*	*			trans	-82.7	111.1	-179.7	-170.7	163.8	-3.6	0	0	109.8	E906	Q904-E906 HydrophobicContact CG-CG 4.33Å; Q904-E906 PolarHBondContact NE2-OE1 3.46Å; Q904-E906 PolarHBondContact O-N 3.4Å
905	S	26.5	Very low	29.9	Very low	110 Å²	110	154.8 Å²	154.8	77%	0.769	81%	0.805	S	S	*	*			trans	-96.2	85.9	178.1	63.9	0	0	0	0	110.8	C903	C903-S905 PolarHBondContact O-N 3.37Å
906	E	30.3	Very low	29.8	Very low	153 Å²	153	158.5 Å²	158.5	72%	0.715	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-100.6	120.5	175.6	-89	172.2	-158.8	0	0	112.5	Q904	Q904-E906 HydrophobicContact CG-CG 4.33Å; Q904-E906 PolarHBondContact NE2-OE1 3.46Å; Q904-E906 PolarHBondContact O-N 3.4Å
907	N	30.1	Very low	30	Very low	157 Å²	157	161 Å²	161	84%	0.84	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-79.9	158.3	167.9	-69.5	-60.8	0	0	0	109.9	A909	N907-A909 PolarHBondContact O-N 3.02Å
908	Q	26.9	Very low	30	Very low	205 Å²	205	163.7 Å²	163.7	96%	0.958	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-52.7	123.2	-175.2	-56.8	168.5	15.5	0	0	113.5
909	A	32.1	Very low	30	Very low	98 Å²	98	162 Å²	162	81%	0.81	81%	0.809	S	S	*	*			trans	-138.9	112.9	159.1	0	0	0	0	0	109.5	N907	N907-A909 PolarHBondContact O-N 3.02Å
910	K	28.4	Very low	30	Very low	209 Å²	209	163.9 Å²	163.9	91%	0.909	82%	0.82	S	S	*	*			trans	-78.4	124.3	171.5	-67	175.6	-179.5	175.1	0	108.6
911	L	29.9	Very low	30	Very low	176 Å²	176	159.3 Å²	159.3	92%	0.921	81%	0.814	S	S	*	*			trans	-134	143.8	157.4	-145.7	72.8	0	0	0	111
912	S	32.5	Very low	30.1	Very low	112 Å²	112	160.3 Å²	160.3	78%	0.783	81%	0.813	S	S	*	*			trans	-86.3	149.1	-164.7	50.1	0	0	0	0	113.4	K914	S912-K914 PolarHBondContact O-N 2.91Å
913	T	30.3	Very low	30.2	Very low	114 Å²	114	154.8 Å²	154.8	70%	0.699	81%	0.808	S	S	*	*			trans	-67.9	123.9	-180	52.1	0	0	0	0	111.9
914	K	32.6	Very low	30.5	Very low	206 Å²	206	155.3 Å²	155.3	90%	0.896	81%	0.81	S	S	*	*			trans	-109.8	89.8	164.9	-144.6	166.9	-168.8	172	0	110.3	S912 R916	S912-K914 PolarHBondContact O-N 2.91Å; K914-R916 PolarHBondContact O-N 2.62Å
915	K	32	Very low	30.9	Very low	183 Å²	183	154 Å²	154	80%	0.796	81%	0.814	S	S	*	*			trans	-57.7	132.8	176.2	-68.5	173.4	178.2	170.9	0	110.1
916	R	29.6	Very low	31	Very low	240 Å²	240	159.8 Å²	159.8	91%	0.906	82%	0.818	S	S	*	*			trans	-117.6	105.9	152.1	-88.8	-173.1	166.2	173.3	-3.5	108.9	K914	K914-R916 PolarHBondContact O-N 2.62Å
917	K	33.8	Very low	31	Very low	186 Å²	186	158.3 Å²	158.3	81%	0.809	81%	0.812	S	S	*	*			trans	-69.6	140.4	164.1	-68.4	179.5	174.1	-177.5	0	108
918	Y	26.8	Very low	31.1	Very low	236 Å²	236	158.6 Å²	158.6	93%	0.925	81%	0.805	S	S	*	*			trans	-92.1	124.4	157.7	-85.5	-96.9	0	0	0	108.9
919	S	31.6	Very low	31.2	Very low	108 Å²	108	153.7 Å²	153.7	76%	0.755	79%	0.793	S	S	*	*			trans	-151.2	130	164.3	52.7	0	0	0	0	107.3
920	A	28.8	Very low	31.2	Very low	96 Å²	96	160 Å²	160	79%	0.793	80%	0.796	S	S	*	*			trans	-79.2	157.4	-167.8	0	0	0	0	0	113.7
921	T	30.8	Very low	31.3	Very low	122 Å²	122	156 Å²	156	75%	0.748	79%	0.789	S	S	*	*				173.2	142.3	123.5	-74.1	0	0	0	0	111.2
922	K	32.4	Very low	31.4	Very low	189 Å²	189	156.5 Å²	156.5	82%	0.822	78%	0.784	S	S	*	*			trans	2.7	144.5	159.1	-48.5	163.5	-176.2	175.7	0	118
923	S	30	Very low	31.3	Very low	110 Å²	110	160 Å²	160	77%	0.769	79%	0.785	S	S	*	*			cis	-158.7	171	33.4	-45.1	0	0	0	0	112.6
924	P	37.2	Very low	31.4	Very low	119 Å²	119	160.2 Å²	160.2	77%	0.773	78%	0.781	S	S	*	*			trans	-91.6	-168.2	-177.8	42.5	-37.7	0	0	0	111.9
925	P	36.8	Very low	31.3	Very low	106 Å²	106	158.3 Å²	158.3	69%	0.688	77%	0.773	S	S	*	*			cis	-148.9	172.5	18.2	45.5	-25.4	0	0	0	120.9
926	R	28.1	Very low	31.3	Very low	231 Å²	231	157 Å²	157	87%	0.872	77%	0.769	S	S	*	*			trans	58.3	152.8	147.5	-79.1	-179.3	178.7	177.2	0	118.2
927	E	29.5	Very low	31.4	Very low	122 Å²	122	150.6 Å²	150.6	57%	0.57	76%	0.757	S	S	*	*			cis	-160.9	159.5	13.9	-137.3	-173.4	170.8	0	0	112.4
928	K	32.4	Very low	31.2	Very low	162 Å²	162	151 Å²	151	70%	0.704	76%	0.759	S	S	*	*			trans	61.1	164.9	155	-72.2	155	-176.8	154.5	0	118.8
929	S	29.8	Very low	31.6	Very low	102 Å²	102	144.3 Å²	144.3	71%	0.713	75%	0.747	S	S	*	*			cis	-169	147.7	-44.8	-102.6	0	0	0	0	111.3
930	R	32.6	Very low	31.6	Very low	230 Å²	230	150 Å²	150	87%	0.868	75%	0.752	S	S	*	*			trans	51	96.7	154.6	-70.2	-178.7	170.1	168.9	-3.3	120.5
931	T	30.1	Very low	31.7	Very low	125 Å²	125	152.2 Å²	152.2	77%	0.767	75%	0.75	S	S	*	*				14.6	123	119.8	55.3	0	0	0	0	120.5
932	K	31	Very low	31.8	Very low	188 Å²	188	156.2 Å²	156.2	82%	0.817	76%	0.757	S	S	*	*				150.5	151.7	118.9	-89.9	177.5	175.1	173.1	0	113.3
933	K	30.9	Very low	31.8	Very low	184 Å²	184	153.8 Å²	153.8	80%	0.8	76%	0.759	S	S	*	*			trans	70.8	151.7	152.6	-81	-176.8	174.5	-173.4	0	116.3
934	I	32.3	Very low	32	Very low	119 Å²	119	153.7 Å²	153.7	61%	0.61	76%	0.758	S	S	*	*			cis	-165.8	144.5	-18.4	-131.7	176.5	0	0	0	110
935	K	30	Very low	31.9	Very low	167 Å²	167	153.9 Å²	153.9	73%	0.726	75%	0.752	S	S	*	*			trans	62.2	169.7	155.3	-68.8	-176.6	178	-166.7	0	117.3
936	Q	32	Very low	31.8	Very low	154 Å²	154	156.7 Å²	156.7	72%	0.72	75%	0.754	S	S	*	*			cis	-162.2	166.8	-7.9	-124.3	177.5	-56.2	0	0	112.7
937	V	32.3	Very low	32.1	Very low	106 Å²	106	152.4 Å²	152.4	64%	0.642	75%	0.746	S	S	*	*			trans	78.3	98.1	139.4	166	0	0	0	0	121.5
938	F	29.5	Very low	32.3	Very low	194 Å²	194	151 Å²	151	85%	0.851	75%	0.75	S	S	*	*				61.4	151.3	117.5	-86.9	-86.6	0	0	0	125.1
939	S	34.7	Very low	32.4	Very low	96 Å²	96	152.4 Å²	152.4	67%	0.671	76%	0.756	S	S	*	*			trans	96.7	137.4	161.5	-51.7	0	0	0	0	115.7
940	R	32.1	Very low	32.6	Very low	229 Å²	229	151.7 Å²	151.7	86%	0.864	76%	0.756	S	S	*	*			cis	-156.1	162.5	1.4	-128.9	169.2	-175.1	148.2	-0.4	112.2
941	D	31.1	Very low	32.5	Very low	141 Å²	141	148.9 Å²	148.9	75%	0.754	76%	0.758	S	S	*	*			trans	-69.4	155.8	-176.8	-39.8	-101.1	0	0	0	114.8
942	K	33.7	Very low	32.6	Very low	206 Å²	206	148.7 Å²	148.7	90%	0.896	76%	0.762	S	S	*	*				-178.3	129.9	113.8	-98.5	161.8	-175.2	179.4	0	113.7
943	T	31.2	Very low	32.8	Very low	139 Å²	139	147.9 Å²	147.9	85%	0.853	76%	0.763	S	S	*	*			trans	-125.7	132.1	159.2	49.6	0	0	0	0	109.6
944	S	34.6	Very low	33	Very low	107 Å²	107	148.6 Å²	148.6	75%	0.748	77%	0.766	S	S	*	*			trans	-169	125.1	165.9	-110	0	0	0	0	115.5
945	N	35	Very low	33.2	Very low	123 Å²	123	148.5 Å²	148.5	66%	0.658	77%	0.773	S	S	*	*				63.2	122.3	127	-79.1	-63.8	0	0	0	122
946	K	35.7	Very low	33.6	Very low	166 Å²	166	149.6 Å²	149.6	72%	0.722	78%	0.781	S	S	*	*				92.3	116.8	120.3	-76.5	175.6	177.4	-179.1	0	121.8
947	I	33.3	Very low	33.8	Very low	140 Å²	140	147.1 Å²	147.1	72%	0.718	78%	0.78	S	S	*	*				92.3	121.4	117	-72.8	173.7	0	0	0	120.9
948	S	33.4	Very low	34	Very low	94 Å²	94	148 Å²	148	66%	0.657	79%	0.786	S	S	*	*			trans	85.3	128	143.3	-81.9	0	0	0	0	123.9
949	K	34.6	Very low	34.3	Very low	191 Å²	191	144.2 Å²	144.2	83%	0.83	78%	0.784	S	S	*	*				67.8	100	129.5	-68.4	178.6	175.2	-178.3	0	121
950	A	34	Very low	34.5	Very low	86 Å²	86	148.8 Å²	148.8	71%	0.711	82%	0.816	S	S	*	*				76.5	144.7	108	0	0	0	0	0	121.3
951	L	30.5	Very low	34.6	Very low	171 Å²	171	144.8 Å²	144.8	90%	0.895	81%	0.814	S	S	*	*			trans	54.7	107.8	154.8	-66.5	162.9	0	0	0	118
952	S	33.4	Very low	34.8	Very low	122 Å²	122	145 Å²	145	85%	0.853	82%	0.817	S	S	*	*				-172.3	175.6	95.1	-159.6	0	0	0	0	112.2
953	M	33.7	Very low	34.8	Very low	170 Å²	170	141.6 Å²	141.6	84%	0.837	81%	0.812	S	S	*	*			trans	-92.2	138.3	-177.7	-55.9	162.1	66.9	0	0	112.1
954	K	36	Very low	35	Very low	199 Å²	199	141.8 Å²	141.8	87%	0.865	81%	0.81	S	S	*	*				176.1	145.4	112.2	-97.9	174.9	178.2	-178.9	0	112.1
955	P	37.3	Very low	35.1	Very low	117 Å²	117	143.9 Å²	143.9	76%	0.76	81%	0.814	S	S	*	*			trans	-99.9	151	169.9	37.2	-31.4	0	0	0	112.4
956	Q	38.2	Very low	35.1	Very low	190 Å²	190	145.3 Å²	145.3	89%	0.888	82%	0.824	S	S	*	*			trans	179.5	-177.9	137.7	-105	173.4	-0.1	0	0	112.9
957	S	36.5	Very low	35	Very low	102 Å²	102	143.9 Å²	143.9	71%	0.713	83%	0.832	S	S	*	*			trans	67.2	93.4	166.5	64.2	0	0	0	0	119.9
958	T	36	Very low	35.2	Very low	125 Å²	125	144.2 Å²	144.2	77%	0.767	84%	0.84	S	S	*	*				55.9	109.2	121.5	56.3	0	0	0	0	121.3
959	S	36.1	Very low	35.3	Very low	115 Å²	115	148.3 Å²	148.3	80%	0.804	86%	0.856	S	S	*	*				36.3	119.9	127	62.2	0	0	0	0	120.5
960	S	37.3	Very low	35.4	Very low	192 Å²	192	144.5 Å²	144.5	100%	1.343	86%	0.858	S	S	*	*				-141.3	0	97.7	-173	0	0	0	0	110.4

Retrieved 960 of 960 residues in 413.7 ms (Link to these results)

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