A0A3Q0KL83_SCHMA Loading...

AAA domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KL83, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,765 aa.

						>A0A3Q0KL83_SCHMA|A0A3Q0KL83
MSGFVNVLVFCDHRDSFSVELDYLKKRFVDDSGSTKIIALCDYFSDHLISKHELLSDIFLTFLDLISAHNIIAFFVSQFTFEPCKCLPNKHPELDSFITKSSFEPDIPQHSHCTTESPFTCCTLMELLPFFDYERLLGTLRFKKMLYFFKKPSVNFKGSLSRQDILRSLLSGNGLDVYDYEDYKFTGFVLENELLKLKQTSHLRPLSCEGKENHGPKSEFILPRHIKKLEDILDRFCLSASKDENDSIPSVNNILDLYVLEDWSCKLKRSDQRLRNISTKFQHDSSRNRILLISGQPGVGKTRFLTSWLNKRKSDGFTFMNDHIKVKELTTITDADETTNNSLKTESDIIFIDEFIEPGKCNSDIWQLLDDLNRKARTARYKSSELNSSLATLLSSLTSGQEDFERARQLRQLGSRLFTSLSPTNSNDGRSDLPVIVIIDGLEYLEDPLAETAEAVKCIDWLFSCHAHTKETDMNEYGGINSGGLPIIPSRTRFILTCSSSHYINHQLTKCPLVNVIEYSSVLGLKENMLMKISPTSIGNLEETNEVLKENNPVTNQLYDLISLFFPLLNNDTLNHGKETEVNQEFNLHSLFKYRVQIVKDRLRNPIINKLHKYWCLKENALAQKIFIHELYITSFGFDANNNHKNIFNWDDYIERLLATQSIRQLLLCLLQQWAIEFEYNIITKEKELSLRNSMENSEGHSTLSTFNDDKQASDHKINFKALLQTSTTQLSKDWTVGLVGLVFHTLVAAFRFTWTNEKMYQEDENSGFKFQDVLHVLKNINLPKYYVIRSILPSTVMALHSPLLGYYCLRILHRAGAFSQTTEGGVLHQTNLDGYLKFNHEIIYSVVRQLLARDNGATGIHLPFITTALKWSTGGEQGNTLSNILSHRHLQTVSKASNQSLSNYSLSLIEKNLYKSKPKITFKKTGRIIQAALSLTQSGDTFSINNQFTNEKKSLNKINDNDTVVIPISIKRSSSLRASLQLVPDIYRIALKSNDLLDNNDVNYSTSQLSSDNCAYTRHILLLTEIMNYLVIKPNYPVTYGFLTRLVITQIEMICIVNNLNGVKIILNNLEFILLHPCFLLCLAFPTYATEVFTGSIQNSHLLVALWQTIQNSFMLIDKYHENDKNNDKTSLFENDVRSSIGKLNCSHENSFNIANASYNFSGDNTTMKRSITKLNELAQRVLDHVESKKYTKENCSDSPNICNSFSQLNDLSGENNLESLVWIIGELIYYLGDELVSVQILSKLAVCFINRETLCKSDILQLSHLGLNIMNKLRYLRNEVNESIDNQLMLYQSIVYETEMTITEWLKESFILTLCDTEENRLTERRIFTALAYIKMYRLESVIGLTESSNEQLNLFEYQICQTIQDIKQFNSQLIDRTLLAIGMYLLAKIRLLQMNTSEHEFLMFQAISECMADQGEYHPLIAEWLIILALSLQKPPNGDNNELDEVNFLRMKFGRTRAQECLRWSLDIMTYNQEILIRPVIPPPTSVLSNFNQHIYKKLHRSILLRLPRYLIIPQIQPSLLSPFLSESSRSTSYNLNSSTGRKVSNPSSNRTDITLNFNNQHLFSNPYVYQTLPAEICLQLVICLLKDKRQISLQEAITRAAFVLHERILFLGVDHPATIQISKILDHIEHYLIHGWTSNETRDKEVKLTKSKLLNDRKSGYLFSTNRPHDELFGRNQSTQHTRLSSRNSLFDEQMSKDHVSTRATSRAEQLPSKRLDRKQLKISNTFKISKYESNLKYLGKIHYFLSKKINQTSNTRKYTN
					

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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	24.6	Very low	27.6	Very low	236 Å²	236	121.8 Å²	121.8	100%	1.163	69%	0.694	S	S	*	*				0	123.9	0	-59.9	-179.1	179.2	0	0	106.8
2	S	22.5	Very low	27.6	Very low	108 Å²	108	120.8 Å²	120.8	76%	0.755	68%	0.684	S	S	*	*			cis	74.1	67.6	23.3	83	0	0	0	0	115.6
3	G	27.9	Very low	28.4	Very low	75 Å²	75	121.2 Å²	121.2	77%	0.773	68%	0.677	S	S	*	*			trans	-122.6	128.8	161.9	0	0	0	0	0	109.8
4	F	27.1	Very low	28.9	Very low	187 Å²	187	127.1 Å²	127.1	82%	0.82	68%	0.683	S	S	*	*			trans	-111.7	135.3	175.2	-58.5	-93.1	0	0	0	108
5	V	26.9	Very low	29.6	Very low	105 Å²	105	125.7 Å²	125.7	64%	0.636	68%	0.676	S	S	*	*			trans	-124.6	123.2	179.4	-178.2	0	0	0	0	109.2	I72	V5-I72 HydrophobicContact CG1-CD1 3.99Å; V5-I72 HydrophobicContact CG1-CG1 4.47Å
6	N	26.8	Very low	30.1	Very low	147 Å²	147	122.1 Å²	122.1	79%	0.786	66%	0.663	S	S	*	*			trans	-112.2	133.6	175.3	-68.3	-16.3	0	0	0	109
7	V	29.9	Very low	30.5	Very low	65 Å²	65	122.2 Å²	122.2	39%	0.394	66%	0.656	S	S	.	*			trans	-92.9	141.7	175.1	179.5	0	0	0	0	109.6	V9	V7-V9 HydrophobicContact CG1-CG2 4.16Å
8	L	29.9	Very low	31.1	Very low	108 Å²	108	118.6 Å²	118.6	57%	0.565	64%	0.642	S	S	*	*			trans	-135.5	124.2	-178.9	-166.8	82.4	0	0	0	108.9	F10	L8-F10 HydrophobicContact CD1-CE2 4.44Å; L8-F10 HydrophobicContact CD2-CD2 4.38Å; L8-F10 HydrophobicContact CD2-CE2 3.89Å; L8-F10 HydrophobicContact CG-CD2 4.38Å; L8-F10 HydrophobicContact CG-CE2 4Å
9	V	30.4	Very low	31.9	Very low	94 Å²	94	117.7 Å²	117.7	57%	0.57	64%	0.641	S	S	*	*			trans	-124	131.5	-175.4	-178.8	0	0	0	0	110.1	V7	V7-V9 HydrophobicContact CG1-CG2 4.16Å
10	F	27.3	Very low	32.3	Very low	120 Å²	120	117.3 Å²	117.3	53%	0.526	63%	0.634	S	S	.	*			trans	-134.5	127.6	169.7	-76.6	-81.8	0	0	0	109.7	L8	L8-F10 HydrophobicContact CD1-CE2 4.44Å; L8-F10 HydrophobicContact CD2-CD2 4.38Å; L8-F10 HydrophobicContact CD2-CE2 3.89Å; L8-F10 HydrophobicContact CG-CD2 4.38Å; L8-F10 HydrophobicContact CG-CE2 4Å
11	C	30.4	Very low	32.7	Very low	95 Å²	95	114.3 Å²	114.3	64%	0.642	62%	0.618	S	S	*	*			trans	-152.8	125.5	172.4	-170.1	0	0	0	0	110.7
12	D	27.2	Very low	33.8	Very low	109 Å²	109	107.6 Å²	107.6	58%	0.583	59%	0.587	S	S	*	*			trans	-142.1	82	172.9	-95.1	-31.9	0	0	0	108.4
13	H	38.2	Very low	34.9	Very low	126 Å²	126	109.1 Å²	109.1	58%	0.583	58%	0.577	S	S	*	*			trans	172.3	139.2	138.5	-99.6	-79	0	0	0	111.2
14	R	35.7	Very low	35.3	Very low	204 Å²	204	109.4 Å²	109.4	77%	0.77	56%	0.56	S	S	*	*	S	Bend	trans	-87.4	-27	-172.7	-165.7	178.6	-175.5	-154.8	-1.8	113.6
15	D	38.7	Very low	36	Very low	107 Å²	107	104.8 Å²	104.8	57%	0.572	54%	0.54	S	S	*	.	H	α-helix	trans	-87.5	-23	-165.6	-45	-57.5	0	0	0	113	S18 V19	D15-S18 PolarHBondContact O-OG 3.26Å; D15-V19 WeakPolarHBondContact O-CG2 3.36Å
16	S	38.6	Very low	37.1	Very low	67 Å²	67	108.3 Å²	108.3	47%	0.469	55%	0.546	S	S	.	.	H	α-helix	trans	-70.1	-38.1	172	39.5	0	0	0	0	112.3	V19 E20	S16-V19 PolarHBondContact O-N 3.32Å; S16-E20 PolarHBondContact O-N 2.92Å
17	F	36.4	Very low	37.8	Very low	124 Å²	124	109.6 Å²	109.6	54%	0.544	54%	0.54	S	S	.	.	H	α-helix	trans	-68.7	-36.6	-179	-169.7	-112.7	0	0	0	112.6	L21	F17-L21 HydrophobicContact CD1-CD1 3.77Å; F17-L21 HydrophobicContact CE1-CD1 3.42Å; F17-L21 VanDerWaalsContact CE1-CD1 3.42Å; F17-L21 HydrophobicContact CZ-CD1 3.91Å; F17-L21 WeakPolarHBondContact O-CB 3.41Å; F17-L21 PolarHBondContact O-N 3.37Å
18	S	41.8	Very low	38	Very low	58 Å²	58	112.6 Å²	112.6	41%	0.406	55%	0.548	S	S	.	.	H	α-helix	trans	-66	-35.2	174.6	41.4	0	0	0	0	113.1	D15 L21 D22	D15-S18 PolarHBondContact O-OG 3.26Å; S18-L21 PolarHBondContact O-N 3.08Å; S18-D22 PolarHBondContact O-N 2.72Å
19	V	46.5	Very low	38.3	Very low	102 Å²	102	112.7 Å²	112.7	62%	0.618	55%	0.553	S	S	*	*	H	α-helix	trans	-72.7	-37.8	179.5	175	0	0	0	0	111.5	D15 S16 Y23	D15-V19 WeakPolarHBondContact O-CG2 3.36Å; S16-V19 PolarHBondContact O-N 3.32Å; V19-Y23 VanDerWaalsContact O-CB 3.29Å; V19-Y23 WeakPolarHBondContact O-CB 3.41Å; V19-Y23 PolarHBondContact O-N 3.25Å
20	E	39.1	Very low	38.5	Very low	109 Å²	109	115.3 Å²	115.3	51%	0.509	56%	0.564	S	S	.	*	H	α-helix	trans	-65.5	-39.9	171.1	-75.7	-170.8	136.3	0	0	112.2	S16 Y23 L24	S16-E20 PolarHBondContact O-N 2.92Å; E20-Y23 PolarHBondContact O-N 3.34Å; E20-L24 WeakPolarHBondContact O-CB 3.27Å; E20-L24 WeakPolarHBondContact O-CG 3.5Å; E20-L24 PolarHBondContact O-N 3.4Å
21	L	40.2	Very low	38.9	Very low	55 Å²	55	117.2 Å²	117.2	29%	0.288	58%	0.58	S	S	.	*	H	α-helix	trans	-64	-44.6	176.2	-100.1	158.5	0	0	0	113	F17 S18 Y23 L24 K25	F17-L21 HydrophobicContact CD1-CD1 3.77Å; F17-L21 HydrophobicContact CE1-CD1 3.42Å; F17-L21 VanDerWaalsContact CE1-CD1 3.42Å; F17-L21 HydrophobicContact CZ-CD1 3.91Å; F17-L21 WeakPolarHBondContact O-CB 3.41Å; F17-L21 PolarHBondContact O-N 3.37Å; S18-L21 PolarHBondContact O-N 3.08Å; L21-Y23 VanDerWaalsContact C-N 3.31Å; L21-Y23 PolarHBondContact O-N 3.09Å; L21-L24 PolarHBondContact O-N 2.85Å; L21-K25 WeakPolarHBondContact O-CG 3.14Å; L21-K25 PolarHBondContact O-N 2.96Å
22	D	48.1	Very low	39.1	Very low	95 Å²	95	118.8 Å²	118.8	51%	0.508	59%	0.591	S	S	.	*	H	α-helix	trans	-70	-28.1	176.6	-81.2	-15.3	0	0	0	112.6	S18 K26	S18-D22 PolarHBondContact O-N 2.72Å; D22-K26 WeakPolarHBondContact O-CG 3.17Å; D22-K26 PolarHBondContact O-N 3.48Å
23	Y	45.5	Very low	39.5	Very low	139 Å²	139	117.6 Å²	117.6	55%	0.545	61%	0.605	S	S	.	*	H	α-helix	trans	-70.2	-41.8	171.7	-174.7	-98.8	0	0	0	111.8	V19 E20 L21 K26 R27	V19-Y23 VanDerWaalsContact O-CB 3.29Å; V19-Y23 WeakPolarHBondContact O-CB 3.41Å; V19-Y23 PolarHBondContact O-N 3.25Å; E20-Y23 PolarHBondContact O-N 3.34Å; L21-Y23 VanDerWaalsContact C-N 3.31Å; L21-Y23 PolarHBondContact O-N 3.09Å; Y23-K26 PolarHBondContact O-N 3.36Å; Y23-R27 PolarHBondContact O-N 2.81Å; Y23-R27 PolarHBondContact OH-NH1 2.98Å
24	L	37.2	Very low	39.2	Very low	81 Å²	81	115.3 Å²	115.3	42%	0.424	60%	0.603	S	S	.	*	H	α-helix	trans	-64.2	-43.4	173.7	-75.1	165.5	0	0	0	111.8	E20 L21 K26 R27 F28	E20-L24 WeakPolarHBondContact O-CB 3.27Å; E20-L24 WeakPolarHBondContact O-CG 3.5Å; E20-L24 PolarHBondContact O-N 3.4Å; L21-L24 PolarHBondContact O-N 2.85Å; L24-K26 PolarHBondContact O-N 3.47Å; L24-R27 PolarHBondContact O-N 3.24Å; L24-R27 VanDerWaalsContact O-N 3.08Å; L24-F28 HydrophobicContact CD2-CD2 4.46Å; L24-F28 HydrophobicContact CD2-CE2 4.05Å; L24-F28 PolarHBondContact O-N 3.35Å
25	K	41.8	Very low	39.1	Very low	90 Å²	90	111 Å²	111	39%	0.391	60%	0.6	S	S	.	*	H	α-helix	trans	-56.8	-34.9	174.4	-81	-177	173.5	-178.4	0	113.4	L21 S45	L21-K25 WeakPolarHBondContact O-CG 3.14Å; L21-K25 PolarHBondContact O-N 2.96Å; K25-S45 WeakPolarHBondContact CE-OG 3.21Å; K25-S45 PolarHBondContact NZ-OG 3.14Å
26	K	50.3	Low	38.9	Very low	179 Å²	179	114.3 Å²	114.3	78%	0.778	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-12.1	178.6	-76.1	177.3	178.9	176.2	0	114.8	D22 Y23 L24	D22-K26 WeakPolarHBondContact O-CG 3.17Å; D22-K26 PolarHBondContact O-N 3.48Å; Y23-K26 PolarHBondContact O-N 3.36Å; L24-K26 PolarHBondContact O-N 3.47Å
27	R	39.8	Very low	38.8	Very low	175 Å²	175	117.1 Å²	117.1	66%	0.66	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.3	-7.4	-172.1	-157.3	169.5	-179.7	176.4	-5.2	114.3	Y23 L24	Y23-R27 PolarHBondContact O-N 2.81Å; Y23-R27 PolarHBondContact OH-NH1 2.98Å; L24-R27 PolarHBondContact O-N 3.24Å; L24-R27 VanDerWaalsContact O-N 3.08Å
28	F	35.6	Very low	38.9	Very low	128 Å²	128	114.2 Å²	114.2	56%	0.561	61%	0.607	S	S	*	*	S	Bend	trans	-108.1	11.6	176.3	-83.2	-76.6	0	0	0	114.2	L24 M125	L24-F28 HydrophobicContact CD2-CD2 4.46Å; L24-F28 HydrophobicContact CD2-CE2 4.05Å; L24-F28 PolarHBondContact O-N 3.35Å; F28-M125 HydrophobicContact CZ-CE 4.05Å
29	V	35.7	Very low	38.7	Very low	110 Å²	110	114.3 Å²	114.3	67%	0.667	61%	0.611	S	S	*	*			trans	-98.3	93.4	165	-178.4	0	0	0	0	107.2
30	D	35.4	Very low	38.1	Very low	149 Å²	149	114.3 Å²	114.3	80%	0.797	61%	0.607	S	S	*	*	S	Bend	trans	179.2	105.3	147.9	-88.5	-16.6	0	0	0	110	S32	D30-S32 PolarHBondContact O-N 2.76Å
31	D	35.2	Very low	38	Very low	160 Å²	160	112.2 Å²	112.2	86%	0.856	60%	0.604	S	S	*	*	S	Bend	trans	30.3	74.1	153.9	-62.9	-11.3	0	0	0	121.1
32	S	33.5	Very low	38	Very low	127 Å²	127	113.4 Å²	113.4	89%	0.888	61%	0.611	S	S	*	*	S	Bend		167.4	129.9	115	48.1	0	0	0	0	113.7	D30	D30-S32 PolarHBondContact O-N 2.76Å
33	G	35.3	Very low	37.7	Very low	85 Å²	85	114.9 Å²	114.9	88%	0.876	61%	0.61	S	S	*	*			trans	111.3	3	166.6	0	0	0	0	0	117.6
34	S	33.3	Very low	37.2	Very low	77 Å²	77	112.3 Å²	112.3	54%	0.538	60%	0.602	S	S	.	*			trans	-79.4	129.7	177.7	55.4	0	0	0	0	114.1
35	T	32.7	Very low	37.3	Very low	114 Å²	114	109 Å²	109	70%	0.699	59%	0.585	S	S	*	*	S	Bend	trans	-152.3	-53.2	144.2	36.4	0	0	0	0	111.5	A39	T35-A39 WeakPolarHBondContact O-CB 3.31Å; T35-A39 PolarHBondContact O-N 3.11Å
36	K	35.8	Very low	37.1	Very low	176 Å²	176	110.2 Å²	110.2	77%	0.765	60%	0.596	S	S	*	*	H	α-helix	trans	-71.4	-37.6	-171.6	-71.5	-175.7	177.6	178.5	0	115.5	L40	K36-L40 PolarHBondContact O-N 3.03Å
37	I	35	Very low	36.6	Very low	126 Å²	126	106.3 Å²	106.3	65%	0.646	58%	0.58	S	S	*	*	H	α-helix	trans	-78.4	-38.9	-179.4	-62.3	176	0	0	0	110.7	L40 C41	I37-L40 WeakPolarHBondContact O-CB 3.34Å; I37-L40 PolarHBondContact O-N 3.19Å; I37-L40 VanDerWaalsContact O-N 3.15Å; I37-C41 PolarHBondContact O-N 2.93Å
38	I	38.4	Very low	36.4	Very low	64 Å²	64	103 Å²	103	33%	0.328	58%	0.576	S	S	.	*	H	α-helix	trans	-61.7	-43.6	172.3	-66.2	-163	0	0	0	110.5	L40 C41 D42	I38-L40 PolarHBondContact O-N 3.02Å; I38-C41 PolarHBondContact O-N 2.96Å; I38-C41 VanDerWaalsContact O-N 3.11Å; I38-D42 WeakPolarHBondContact CG2-OD2 3.47Å; I38-D42 VanDerWaalsContact O-CB 3.31Å; I38-D42 WeakPolarHBondContact O-CB 3.29Å; I38-D42 VanDerWaalsContact O-CG 3.3Å; I38-D42 PolarHBondContact O-N 3.21Å
39	A	37.5	Very low	36.2	Very low	60 Å²	60	103.4 Å²	103.4	50%	0.496	58%	0.582	S	S	.	*	H	α-helix	trans	-58.4	-32.1	174.3	0	0	0	0	0	114	T35 Y43	T35-A39 WeakPolarHBondContact O-CB 3.31Å; T35-A39 PolarHBondContact O-N 3.11Å; A39-Y43 WeakPolarHBondContact O-CB 3.46Å; A39-Y43 PolarHBondContact O-N 3.49Å
40	L	34.7	Very low	35.9	Very low	102 Å²	102	101.9 Å²	101.9	53%	0.534	58%	0.576	S	S	.	*	H	α-helix	trans	-73	-45.1	173.4	-101.9	157.3	0	0	0	111.9	K36 I37 I38 Y43 F44	K36-L40 PolarHBondContact O-N 3.03Å; I37-L40 WeakPolarHBondContact O-CB 3.34Å; I37-L40 PolarHBondContact O-N 3.19Å; I37-L40 VanDerWaalsContact O-N 3.15Å; I38-L40 PolarHBondContact O-N 3.02Å; L40-Y43 PolarHBondContact O-N 3.35Å; L40-F44 HydrophobicContact CD2-CD2 4.39Å; L40-F44 HydrophobicContact CD2-CE2 3.92Å; L40-F44 WeakPolarHBondContact O-CD2 3.44Å; L40-F44 PolarHBondContact O-N 3.06Å
41	C	37.4	Very low	35.8	Very low	65 Å²	65	104.6 Å²	104.6	44%	0.439	58%	0.581	S	S	.	*	H	α-helix	trans	-68.8	-31.1	177.7	-68.2	0	0	0	0	113.4	I37 I38 S45	I37-C41 PolarHBondContact O-N 2.93Å; I38-C41 PolarHBondContact O-N 2.96Å; I38-C41 VanDerWaalsContact O-N 3.11Å; C41-S45 VanDerWaalsContact O-CB 3.27Å; C41-S45 WeakPolarHBondContact O-CB 3.49Å; C41-S45 PolarHBondContact O-N 2.92Å; C41-S45 PolarHBondContact O-OG 2.92Å
42	D	40.3	Very low	35.6	Very low	79 Å²	79	105 Å²	105	42%	0.422	58%	0.577	S	S	.	*	H	α-helix	trans	-74.8	-43	173.6	-70.8	-13.1	0	0	0	110.5	I38 F44 S45 D46	I38-D42 WeakPolarHBondContact CG2-OD2 3.47Å; I38-D42 VanDerWaalsContact O-CB 3.31Å; I38-D42 WeakPolarHBondContact O-CB 3.29Å; I38-D42 VanDerWaalsContact O-CG 3.3Å; I38-D42 PolarHBondContact O-N 3.21Å; D42-F44 VanDerWaalsContact C-N 3.31Å; D42-F44 PolarHBondContact O-N 2.96Å; D42-S45 CarbonylContact O-C 3.59Å; D42-S45 WeakPolarHBondContact O-CA 3.37Å; D42-S45 PolarHBondContact O-N 3.35Å; D42-D46 PolarHBondContact O-N 2.98Å
43	Y	40.7	Very low	35.7	Very low	127 Å²	127	108 Å²	108	50%	0.498	58%	0.577	S	S	.	*	H	α-helix	trans	-56.4	-43.7	171.4	-177.8	-99.8	0	0	0	112.1	A39 L40 H47	A39-Y43 WeakPolarHBondContact O-CB 3.46Å; A39-Y43 PolarHBondContact O-N 3.49Å; L40-Y43 PolarHBondContact O-N 3.35Å; Y43-H47 AromaticContact CD2-CD2 3.78Å; Y43-H47 AromaticContact CE2-CD2 3.43Å; Y43-H47 VanDerWaalsContact CE2-CD2 3.43Å; Y43-H47 WeakPolarHBondContact CE2-CD2 3.33Å; Y43-H47 AromaticContact CE2-NE2 3.43Å; Y43-H47 WeakPolarHBondContact CE2-NE2 3.45Å; Y43-H47 AromaticContact CZ-CD2 3.62Å; Y43-H47 AromaticContact CZ-NE2 3.88Å; Y43-H47 WeakPolarHBondContact O-CB 3.19Å; Y43-H47 PolarHBondContact O-CD2 3.44Å; Y43-H47 PolarHBondContact O-N 3.47Å
44	F	36	Very low	35.7	Very low	84 Å²	84	109.4 Å²	109.4	37%	0.368	56%	0.564	S	S	.	*	H	α-helix	trans	-69	-31.8	172.6	-80.6	-64.6	0	0	0	113.1	L40 D42 L48 I58	L40-F44 HydrophobicContact CD2-CD2 4.39Å; L40-F44 HydrophobicContact CD2-CE2 3.92Å; L40-F44 WeakPolarHBondContact O-CD2 3.44Å; L40-F44 PolarHBondContact O-N 3.06Å; D42-F44 VanDerWaalsContact C-N 3.31Å; D42-F44 PolarHBondContact O-N 2.96Å; F44-L48 WeakPolarHBondContact O-CB 3.19Å; F44-L48 WeakPolarHBondContact O-CD1 3.43Å; F44-L48 WeakPolarHBondContact O-CG 3.46Å; F44-L48 PolarHBondContact O-N 3.44Å; F44-L48 VanDerWaalsContact O-N 3.14Å; F44-I58 HydrophobicContact CE1-CG2 4.18Å
45	S	39.5	Very low	35.6	Very low	12 Å²	12	111.7 Å²	111.7	8%	0.084	57%	0.57	C	S	.	*	H	α-helix	trans	-74.3	-46.8	179.7	-67.1	0	0	0	0	113.2	K25 C41 D42 H47 L48 I49	K25-S45 WeakPolarHBondContact CE-OG 3.21Å; K25-S45 PolarHBondContact NZ-OG 3.14Å; C41-S45 VanDerWaalsContact O-CB 3.27Å; C41-S45 WeakPolarHBondContact O-CB 3.49Å; C41-S45 PolarHBondContact O-N 2.92Å; C41-S45 PolarHBondContact O-OG 2.92Å; D42-S45 CarbonylContact O-C 3.59Å; D42-S45 WeakPolarHBondContact O-CA 3.37Å; D42-S45 PolarHBondContact O-N 3.35Å; S45-H47 VanDerWaalsContact C-N 3.33Å; S45-H47 PolarHBondContact O-N 2.96Å; S45-L48 PolarHBondContact O-N 3.35Å; S45-I49 WeakPolarHBondContact O-CB 3.43Å; S45-I49 WeakPolarHBondContact O-CG1 3.16Å; S45-I49 PolarHBondContact O-N 3.15Å; S45-I49 VanDerWaalsContact O-N 3.09Å
46	D	38.3	Very low	35.7	Very low	115 Å²	115	108.7 Å²	108.7	62%	0.615	55%	0.554	S	S	*	*	H	α-helix	trans	-68.5	-33.9	-177.6	-75.3	-16.1	0	0	0	111.8	D42 S50	D42-D46 PolarHBondContact O-N 2.98Å; D46-S50 PolarHBondContact O-N 3Å; D46-S50 PolarHBondContact O-OG 3.34Å
47	H	39.8	Very low	35.7	Very low	97 Å²	97	104.2 Å²	104.2	45%	0.449	54%	0.538	S	S	.	.	H	α-helix	trans	-82.7	-15.7	173.4	-74.9	-49.2	0	0	0	114.9	Y43 S45 I58	Y43-H47 AromaticContact CD2-CD2 3.78Å; Y43-H47 AromaticContact CE2-CD2 3.43Å; Y43-H47 VanDerWaalsContact CE2-CD2 3.43Å; Y43-H47 WeakPolarHBondContact CE2-CD2 3.33Å; Y43-H47 AromaticContact CE2-NE2 3.43Å; Y43-H47 WeakPolarHBondContact CE2-NE2 3.45Å; Y43-H47 AromaticContact CZ-CD2 3.62Å; Y43-H47 AromaticContact CZ-NE2 3.88Å; Y43-H47 WeakPolarHBondContact O-CB 3.19Å; Y43-H47 PolarHBondContact O-CD2 3.44Å; Y43-H47 PolarHBondContact O-N 3.47Å; S45-H47 VanDerWaalsContact C-N 3.33Å; S45-H47 PolarHBondContact O-N 2.96Å; H47-I58 HydrophobicContact CB-CD1 4.19Å
48	L	34.9	Very low	35.8	Very low	107 Å²	107	100.4 Å²	100.4	56%	0.56	52%	0.518	S	S	*	.	H	α-helix	trans	-90.1	-18.5	172	-80.3	168.7	0	0	0	113.9	F44 S45	F44-L48 WeakPolarHBondContact O-CB 3.19Å; F44-L48 WeakPolarHBondContact O-CD1 3.43Å; F44-L48 WeakPolarHBondContact O-CG 3.46Å; F44-L48 PolarHBondContact O-N 3.44Å; F44-L48 VanDerWaalsContact O-N 3.14Å; S45-L48 PolarHBondContact O-N 3.35Å
49	I	30.7	Very low	35.7	Very low	136 Å²	136	102.5 Å²	102.5	70%	0.697	53%	0.525	S	S	*	.	H	α-helix	trans	-104.4	-14.1	-173.5	-65.2	174	0	0	0	113	S45	S45-I49 WeakPolarHBondContact O-CB 3.43Å; S45-I49 WeakPolarHBondContact O-CG1 3.16Å; S45-I49 PolarHBondContact O-N 3.15Å; S45-I49 VanDerWaalsContact O-N 3.09Å
50	S	29	Very low	35.8	Very low	78 Å²	78	103.5 Å²	103.5	55%	0.545	52%	0.522	S	S	.	.	S	Bend	trans	-121.6	116.5	179	70.2	0	0	0	0	114.9	D46	D46-S50 PolarHBondContact O-N 3Å; D46-S50 PolarHBondContact O-OG 3.34Å
51	K	34.2	Very low	36	Very low	205 Å²	205	102 Å²	102	89%	0.891	52%	0.517	S	S	*	.			trans	67.8	124.8	172.9	-64	-178.3	178.2	177.1	0	117.7
52	H	31.2	Very low	36	Very low	168 Å²	168	103.9 Å²	103.9	78%	0.778	52%	0.518	S	S	*	.	S	Bend	trans	-58.2	158.2	167.5	-73.4	-87.9	0	0	0	112.4
53	E	35.4	Very low	36	Very low	191 Å²	191	102.6 Å²	102.6	89%	0.893	51%	0.511	S	S	*	.	S	Bend	trans	109.2	-16.5	160.1	-57.7	-176.5	154.1	0	0	119.3
54	L	34.6	Very low	36	Very low	114 Å²	114	101.2 Å²	101.2	60%	0.597	51%	0.512	S	S	*	.			trans	-111.2	31.4	-175.1	-86.1	158	0	0	0	116.6	S56 D57	L54-S56 PolarHBondContact O-N 3.41Å; L54-D57 HydrophobicContact CD2-CB 4.24Å; L54-D57 WeakPolarHBondContact CD2-OD2 3.37Å; L54-D57 PolarHBondContact O-N 3.3Å
55	L	32.1	Very low	36.1	Very low	125 Å²	125	102.3 Å²	102.3	65%	0.654	52%	0.521	S	S	*	.	H	α-helix	trans	-70.4	-16.1	179.2	-124	161	0	0	0	113.8
56	S	35.1	Very low	36	Very low	52 Å²	52	104 Å²	104	36%	0.364	53%	0.529	S	S	.	.	H	α-helix	trans	-68.2	-39.9	174.5	47.8	0	0	0	0	112.8	L54 F59 L60	L54-S56 PolarHBondContact O-N 3.41Å; S56-F59 PolarHBondContact O-N 3.25Å; S56-L60 PolarHBondContact O-N 3.21Å
57	D	36	Very low	35.9	Very low	82 Å²	82	102.5 Å²	102.5	44%	0.439	53%	0.527	S	S	.	.	H	α-helix	trans	-83.1	-28	-167.3	-66.5	19.8	0	0	0	110.9	L54 T61	L54-D57 HydrophobicContact CD2-CB 4.24Å; L54-D57 WeakPolarHBondContact CD2-OD2 3.37Å; L54-D57 PolarHBondContact O-N 3.3Å; D57-T61 WeakPolarHBondContact O-CB 3.48Å; D57-T61 PolarHBondContact O-N 3.14Å; D57-T61 PolarHBondContact O-OG1 3.45Å
58	I	35.8	Very low	35.8	Very low	45 Å²	45	101.1 Å²	101.1	23%	0.231	53%	0.533	C	S	.	.	H	α-helix	trans	-67.4	-37.8	167.7	-60.2	175.9	0	0	0	110.4	F44 H47 T61 F62	F44-I58 HydrophobicContact CE1-CG2 4.18Å; H47-I58 HydrophobicContact CB-CD1 4.19Å; I58-T61 WeakPolarHBondContact CA-OG1 3.29Å; I58-T61 PolarHBondContact O-OG1 3.27Å; I58-F62 WeakPolarHBondContact O-CB 3.39Å; I58-F62 PolarHBondContact O-N 2.73Å
59	F	37.1	Very low	35.8	Very low	109 Å²	109	100.9 Å²	100.9	48%	0.478	53%	0.529	S	S	.	.	H	α-helix	trans	-73	-34.6	176.1	-157.3	-98.2	0	0	0	112.3	S56 L63	S56-F59 PolarHBondContact O-N 3.25Å; F59-L63 HydrophobicContact CD1-CD1 3.67Å; F59-L63 HydrophobicContact CD1-CG 4.2Å; F59-L63 HydrophobicContact CE1-CD1 3.73Å; F59-L63 HydrophobicContact CE1-CG 4.17Å; F59-L63 WeakPolarHBondContact O-CB 3.31Å; F59-L63 VanDerWaalsContact O-CG 3.29Å; F59-L63 WeakPolarHBondContact O-CG 3.25Å; F59-L63 PolarHBondContact O-N 3.4Å
60	L	38.7	Very low	35.7	Very low	81 Å²	81	98.3 Å²	98.3	42%	0.424	52%	0.516	S	S	.	.	H	α-helix	trans	-66.5	-47.8	172.1	-81.2	161.4	0	0	0	112	S56 F62 L63 D64	S56-L60 PolarHBondContact O-N 3.21Å; L60-F62 VanDerWaalsContact C-N 3.32Å; L60-F62 PolarHBondContact O-N 3.42Å; L60-L63 CarbonylContact O-C 3.6Å; L60-L63 PolarHBondContact O-N 2.89Å; L60-D64 WeakPolarHBondContact O-CB 3.46Å; L60-D64 PolarHBondContact O-N 3.31Å
61	T	38.8	Very low	35.9	Very low	71 Å²	71	97.8 Å²	97.8	44%	0.436	51%	0.507	S	S	.	.	H	α-helix	trans	-65.6	-33.6	175.6	45.1	0	0	0	0	112.8	D57 I58 D64 L65	D57-T61 WeakPolarHBondContact O-CB 3.48Å; D57-T61 PolarHBondContact O-N 3.14Å; D57-T61 PolarHBondContact O-OG1 3.45Å; I58-T61 WeakPolarHBondContact CA-OG1 3.29Å; I58-T61 PolarHBondContact O-OG1 3.27Å; T61-D64 PolarHBondContact O-N 3.13Å; T61-L65 WeakPolarHBondContact O-CB 3.4Å; T61-L65 PolarHBondContact O-N 3.47Å
62	F	38.9	Very low	35.9	Very low	103 Å²	103	92.2 Å²	92.2	45%	0.452	49%	0.486	S	S	.	.	H	α-helix	trans	-66.6	-40.5	171.5	-170.6	-105.7	0	0	0	112.2	I58 L60 I66	I58-F62 WeakPolarHBondContact O-CB 3.39Å; I58-F62 PolarHBondContact O-N 2.73Å; L60-F62 VanDerWaalsContact C-N 3.32Å; L60-F62 PolarHBondContact O-N 3.42Å; F62-I66 HydrophobicContact CD1-CD1 3.66Å; F62-I66 HydrophobicContact CE1-CD1 3.46Å; F62-I66 VanDerWaalsContact CE1-CD1 3.46Å; F62-I66 HydrophobicContact CG-CD1 4.37Å; F62-I66 HydrophobicContact CZ-CD1 4.03Å; F62-I66 WeakPolarHBondContact O-CB 3.32Å; F62-I66 VanDerWaalsContact O-CG1 3.28Å; F62-I66 WeakPolarHBondContact O-CG1 3.44Å; F62-I66 PolarHBondContact O-N 2.88Å
63	L	39.4	Very low	35.8	Very low	52 Å²	52	86 Å²	86	27%	0.272	46%	0.464	S	S	.	.	H	α-helix	trans	-66.1	-39.6	172.2	-79.3	168.9	0	0	0	112.4	F59 L60 I66 S67 M145	F59-L63 HydrophobicContact CD1-CD1 3.67Å; F59-L63 HydrophobicContact CD1-CG 4.2Å; F59-L63 HydrophobicContact CE1-CD1 3.73Å; F59-L63 HydrophobicContact CE1-CG 4.17Å; F59-L63 WeakPolarHBondContact O-CB 3.31Å; F59-L63 VanDerWaalsContact O-CG 3.29Å; F59-L63 WeakPolarHBondContact O-CG 3.25Å; F59-L63 PolarHBondContact O-N 3.4Å; L60-L63 CarbonylContact O-C 3.6Å; L60-L63 PolarHBondContact O-N 2.89Å; L63-I66 PolarHBondContact O-N 3.09Å; L63-S67 WeakPolarHBondContact O-CB 3.36Å; L63-S67 PolarHBondContact O-N 3.25Å; L63-M145 HydrophobicContact CD2-CE 4.36Å
64	D	41.4	Very low	35.4	Very low	99 Å²	99	84.5 Å²	84.5	53%	0.529	45%	0.454	S	S	.	.	H	α-helix	trans	-65.8	-42.7	176.7	-75.1	-23.8	0	0	0	111	L60 T61 S67 A68	L60-D64 WeakPolarHBondContact O-CB 3.46Å; L60-D64 PolarHBondContact O-N 3.31Å; T61-D64 PolarHBondContact O-N 3.13Å; D64-S67 PolarHBondContact O-N 3.46Å; D64-S67 PolarHBondContact O-OG 3.26Å; D64-A68 WeakPolarHBondContact O-CB 3.14Å; D64-A68 PolarHBondContact O-N 3.09Å
65	L	38	Very low	35.1	Very low	107 Å²	107	84.2 Å²	84.2	56%	0.56	45%	0.449	S	S	*	.	H	α-helix	trans	-60.2	-43.6	171.8	-101.6	143.3	0	0	0	112.6	T61 S67 A68 H69	T61-L65 WeakPolarHBondContact O-CB 3.4Å; T61-L65 PolarHBondContact O-N 3.47Å; L65-S67 VanDerWaalsContact C-N 3.31Å; L65-S67 PolarHBondContact O-N 3.39Å; L65-A68 PolarHBondContact O-N 3.33Å; L65-H69 PolarHBondContact O-N 2.92Å
66	I	36.8	Very low	34.8	Very low	47 Å²	47	84.7 Å²	84.7	24%	0.241	46%	0.457	C	S	.	.	H	α-helix	trans	-64.7	-37.2	174.7	-72.4	167.5	0	0	0	111	F62 L63 A68 N70	F62-I66 HydrophobicContact CD1-CD1 3.66Å; F62-I66 HydrophobicContact CE1-CD1 3.46Å; F62-I66 VanDerWaalsContact CE1-CD1 3.46Å; F62-I66 HydrophobicContact CG-CD1 4.37Å; F62-I66 HydrophobicContact CZ-CD1 4.03Å; F62-I66 WeakPolarHBondContact O-CB 3.32Å; F62-I66 VanDerWaalsContact O-CG1 3.28Å; F62-I66 WeakPolarHBondContact O-CG1 3.44Å; F62-I66 PolarHBondContact O-N 2.88Å; L63-I66 PolarHBondContact O-N 3.09Å; I66-A68 VanDerWaalsContact C-N 3.33Å; I66-N70 PolarHBondContact O-N 3.27Å
67	S	36.2	Very low	34.4	Very low	83 Å²	83	85.9 Å²	85.9	58%	0.58	47%	0.465	S	S	*	.	H	α-helix	trans	-70.1	-28.6	176.8	86.1	0	0	0	0	113.3	L63 D64 L65	L63-S67 WeakPolarHBondContact O-CB 3.36Å; L63-S67 PolarHBondContact O-N 3.25Å; D64-S67 PolarHBondContact O-N 3.46Å; D64-S67 PolarHBondContact O-OG 3.26Å; L65-S67 VanDerWaalsContact C-N 3.31Å; L65-S67 PolarHBondContact O-N 3.39Å
68	A	37.4	Very low	34	Very low	69 Å²	69	88.1 Å²	88.1	57%	0.57	47%	0.473	S	S	*	.	H	α-helix	trans	-80.4	-24.1	178.5	0	0	0	0	0	113.5	D64 L65 I66	D64-A68 WeakPolarHBondContact O-CB 3.14Å; D64-A68 PolarHBondContact O-N 3.09Å; L65-A68 PolarHBondContact O-N 3.33Å; I66-A68 VanDerWaalsContact C-N 3.33Å
69	H	34.3	Very low	33.4	Very low	101 Å²	101	95.5 Å²	95.5	47%	0.468	50%	0.503	S	S	.	.	H	α-helix	trans	-126	13.8	-170	-68.6	-68.7	0	0	0	115.8	L65 I71	L65-H69 PolarHBondContact O-N 2.92Å; H69-I71 HydrophobicContact CB-CD1 4.1Å; H69-I71 HydrophobicContact CB-CG1 4.02Å; H69-I71 WeakPolarHBondContact O-CG1 3.41Å; H69-I71 PolarHBondContact O-N 2.88Å; H69-I71 VanDerWaalsContact O-N 3.09Å
70	N	30.2	Very low	32.9	Very low	83 Å²	83	96.2 Å²	96.2	44%	0.444	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	32.4	173.2	-76.4	-34.9	0	0	0	115.6	I66	I66-N70 PolarHBondContact O-N 3.27Å
71	I	33	Very low	32.2	Very low	66 Å²	66	101.3 Å²	101.3	34%	0.338	54%	0.536	S	S	.	.			trans	-80.7	130.6	-173.3	-58.7	-177.9	0	0	0	111.6	H69 F131	H69-I71 HydrophobicContact CB-CD1 4.1Å; H69-I71 HydrophobicContact CB-CG1 4.02Å; H69-I71 WeakPolarHBondContact O-CG1 3.41Å; H69-I71 PolarHBondContact O-N 2.88Å; H69-I71 VanDerWaalsContact O-N 3.09Å; I71-F131 HydrophobicContact CB-CE1 4.41Å; I71-F131 HydrophobicContact CG1-CE1 4.1Å; I71-F131 HydrophobicContact CG2-CE1 3.89Å; I71-F131 HydrophobicContact CG2-CZ 4.02Å
72	I	33.5	Very low	31.6	Very low	88 Å²	88	106.5 Å²	106.5	45%	0.451	56%	0.556	S	S	.	*			trans	-98.5	120	170.8	-56.7	173.1	0	0	0	108.7	V5 F74	V5-I72 HydrophobicContact CG1-CD1 3.99Å; V5-I72 HydrophobicContact CG1-CG1 4.47Å; I72-F74 HydrophobicContact CG2-CD2 4.16Å; I72-F74 HydrophobicContact CG2-CE2 3.62Å; I72-F74 HydrophobicContact CG2-CZ 4.17Å
73	A	29.1	Very low	31.1	Very low	39 Å²	39	107.2 Å²	107.2	32%	0.322	57%	0.57	S	S	.	*			trans	-114.4	135.1	176.4	0	0	0	0	0	111.8
74	F	27.6	Very low	30.3	Very low	158 Å²	158	110.1 Å²	110.1	69%	0.693	59%	0.594	S	S	*	*			trans	-119.6	132.9	173.7	-70.7	-84.8	0	0	0	109.9	I72	I72-F74 HydrophobicContact CG2-CD2 4.16Å; I72-F74 HydrophobicContact CG2-CE2 3.62Å; I72-F74 HydrophobicContact CG2-CZ 4.17Å
75	F	27.1	Very low	29.5	Very low	108 Å²	108	115.4 Å²	115.4	47%	0.474	61%	0.612	S	S	.	*			trans	-135.7	132.5	166.7	-72.7	-87.3	0	0	0	109.6	L124	F75-L124 HydrophobicContact CE1-CD1 3.87Å; F75-L124 HydrophobicContact CZ-CD1 3.78Å
76	V	26.6	Very low	28.8	Very low	136 Å²	136	116.3 Å²	116.3	82%	0.824	63%	0.626	S	S	*	*			trans	-141.1	118.9	175.8	178.4	0	0	0	0	108.4
77	S	25.9	Very low	28.1	Very low	77 Å²	77	121.7 Å²	121.7	54%	0.538	65%	0.654	S	S	.	*			trans	-140.9	115.2	163.6	64.9	0	0	0	0	111.3
78	Q	28.1	Very low	27.8	Very low	128 Å²	128	122.8 Å²	122.8	60%	0.598	66%	0.66	S	S	*	*				-174.2	113.8	122.5	-101.5	-175.3	11.8	0	0	109.7
79	F	23.3	Very low	27.3	Very low	200 Å²	200	126.9 Å²	126.9	88%	0.877	67%	0.672	S	S	*	*			trans	-70.9	125	147	-84.7	-104.8	0	0	0	107.2	F81	F79-F81 PolarHBondContact O-N 2.8Å
80	T	27.3	Very low	26.9	Very low	125 Å²	125	130.9 Å²	130.9	77%	0.767	69%	0.688	S	S	*	*			trans	-88.3	98.8	162.2	48.9	0	0	0	0	109.1
81	F	24.1	Very low	26.5	Very low	188 Å²	188	135 Å²	135	83%	0.825	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-59.6	128.4	156	-98.3	-104.7	0	0	0	108.8	F79	F79-F81 PolarHBondContact O-N 2.8Å
82	E	26.1	Very low	26.2	Very low	180 Å²	180	136.1 Å²	136.1	84%	0.841	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-78.4	134.5	154.2	-85.7	-168.1	142.5	0	0	108.9	C84	E82-C84 PolarHBondContact O-N 3.19Å
83	P	27.8	Very low	25.9	Very low	117 Å²	117	140.9 Å²	140.9	76%	0.76	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-80.8	118.6	-171.2	30.1	-34.1	0	0	0	112.3	K85	P83-K85 PolarHBondContact O-N 3.42Å
84	C	23	Very low	25.5	Very low	114 Å²	114	145.1 Å²	145.1	77%	0.77	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-57.2	120.6	172.3	-63.1	0	0	0	0	112.1	E82 C86	E82-C84 PolarHBondContact O-N 3.19Å; C84-C86 PolarHBondContact O-N 2.92Å
85	K	23.2	Very low	25.4	Very low	209 Å²	209	144.7 Å²	144.7	91%	0.909	76%	0.758	S	S	*	*	S	Bend	trans	-90.8	82.1	159.8	-78.6	-172.9	176.7	179.1	0	110.2	P83	P83-K85 PolarHBondContact O-N 3.42Å
86	C	23.6	Very low	25.2	Very low	126 Å²	126	144.2 Å²	144.2	85%	0.851	77%	0.768	S	S	*	*			trans	177.3	97.3	145	-96.6	0	0	0	0	110.6	C84	C84-C86 PolarHBondContact O-N 2.92Å
87	L	22.8	Very low	25.2	Very low	160 Å²	160	147 Å²	147	84%	0.838	77%	0.769	S	S	*	*			trans	-126.3	165.4	162.6	-86.5	159.9	0	0	0	106.1
88	P	30.1	Very low	24.9	Very low	107 Å²	107	150.8 Å²	150.8	70%	0.695	78%	0.781	S	S	*	*			cis	-132.9	170.4	-25.2	36.8	-21.6	0	0	0	112.6
89	N	25.8	Very low	24.7	Very low	155 Å²	155	150.3 Å²	150.3	83%	0.829	79%	0.788	S	S	*	*			trans	-154.1	117.4	150.2	-104.9	-30.4	0	0	0	111.7
90	K	26	Very low	24.7	Very low	185 Å²	185	151.1 Å²	151.1	80%	0.804	79%	0.791	S	S	*	*			trans	21.8	142.3	136.3	-72.8	-179	178.2	-177.2	0	119.7
91	H	21.9	Very low	24.5	Very low	170 Å²	170	150.2 Å²	150.2	79%	0.787	79%	0.789	S	S	*	*			cis	-165.6	-153.2	-9.9	-142.9	-30	0	0	0	108.2
92	P	27.4	Very low	24.5	Very low	88 Å²	88	146.4 Å²	146.4	57%	0.571	79%	0.786	S	S	*	*			trans	-115.8	163.7	-148.1	42.4	-24.1	0	0	0	116
93	E	26.9	Very low	24.3	Very low	188 Å²	188	146.7 Å²	146.7	88%	0.879	79%	0.785	S	S	*	*			trans	-157.3	110.7	146.2	-109.9	162.3	-156.2	0	0	105.9
94	L	22	Very low	24.1	Very low	129 Å²	129	149.9 Å²	149.9	68%	0.675	79%	0.79	S	S	*	*				75.6	121.3	74.7	-105.8	82.8	0	0	0	115.3
95	D	24.8	Very low	24.3	Very low	149 Å²	149	149 Å²	149	80%	0.797	78%	0.783	S	S	*	*				49.8	72.6	125.3	-57.2	-4.6	0	0	0	118.8
96	S	23	Very low	24.3	Very low	98 Å²	98	147.1 Å²	147.1	69%	0.685	78%	0.782	S	S	*	*			trans	-145.7	150.2	138.1	56.2	0	0	0	0	111.2
97	F	25.2	Very low	24.2	Very low	195 Å²	195	148 Å²	148	86%	0.855	78%	0.777	S	S	*	*			trans	75.1	36	179.9	-63.3	-83.4	0	0	0	118.5
98	I	20.9	Very low	24.3	Very low	155 Å²	155	145.8 Å²	145.8	80%	0.795	77%	0.772	S	S	*	*				-86.6	150.2	123.7	-62.9	178.1	0	0	0	107.2
99	T	22.9	Very low	24	Very low	119 Å²	119	149 Å²	149	73%	0.73	78%	0.778	S	S	*	*			trans	83.1	90.4	-178.8	74.3	0	0	0	0	117.9
100	K	24.5	Very low	23.9	Very low	216 Å²	216	150 Å²	150	94%	0.939	78%	0.777	S	S	*	*				-168	136.3	106.3	-103.3	174.6	-178.1	179.5	0	112.1
101	S	21.7	Very low	23.8	Very low	106 Å²	106	146.4 Å²	146.4	74%	0.741	78%	0.776	S	S	*	*			trans	-124	147.5	-167.8	51.6	0	0	0	0	112.2
102	S	24.9	Very low	23.8	Very low	108 Å²	108	146.7 Å²	146.7	76%	0.755	78%	0.777	S	S	*	*			trans	-179	112.3	144.9	48	0	0	0	0	108
103	F	22.2	Very low	23.5	Very low	187 Å²	187	148.6 Å²	148.6	82%	0.82	79%	0.791	S	S	*	*				57.6	130.3	77	-79.4	-83.8	0	0	0	112.1
104	E	24.3	Very low	23.3	Very low	184 Å²	184	145.5 Å²	145.5	86%	0.86	79%	0.785	S	S	*	*			cis	-142.3	168	28.2	-110.5	165.9	171.2	0	0	114.6
105	P	26.4	Very low	23.3	Very low	95 Å²	95	145.6 Å²	145.6	62%	0.617	79%	0.791	S	S	*	*			trans	-115	175.5	-176.1	42.4	-31.7	0	0	0	115
106	D	23.3	Very low	23.1	Very low	169 Å²	169	147 Å²	147	90%	0.904	79%	0.793	S	S	*	*			trans	-143.7	138.9	153.5	-109.8	-30.7	0	0	0	110.9
107	I	22.2	Very low	23	Very low	144 Å²	144	147.5 Å²	147.5	74%	0.738	80%	0.797	S	S	*	*			trans	-143.4	132.7	-170.6	-65.7	173.4	0	0	0	105.7
108	P	25	Very low	23.3	Very low	114 Å²	114	143.1 Å²	143.1	74%	0.74	79%	0.788	S	S	*	*				-141.5	168.8	61.5	25.1	1	0	0	0	114.7
109	Q	23.8	Very low	23.3	Very low	175 Å²	175	144.8 Å²	144.8	82%	0.818	79%	0.789	S	S	*	*	S	Bend	cis	-146.7	136.8	49.7	-70.8	175.1	-7.9	0	0	114.1
110	H	23.1	Very low	23.3	Very low	175 Å²	175	145.9 Å²	145.9	81%	0.81	80%	0.796	S	S	*	*	S	Bend	trans	58.8	74.3	162.7	-65.3	-64.4	0	0	0	120.5
111	S	23.5	Very low	23.3	Very low	110 Å²	110	141 Å²	141	77%	0.769	79%	0.788	S	S	*	*			trans	66.8	93.1	133.4	55.4	0	0	0	0	119.9
112	H	21	Very low	23.4	Very low	177 Å²	177	140.8 Å²	140.8	82%	0.819	79%	0.785	S	S	*	*			trans	-59.2	159.7	150.3	-65.2	-97.7	0	0	0	113.1
113	C	22.4	Very low	23.6	Very low	128 Å²	128	139.2 Å²	139.2	87%	0.865	77%	0.771	S	S	*	*				-169.6	115.3	107.2	-98.9	0	0	0	0	112.5
114	T	22	Very low	23.9	Very low	123 Å²	123	135.6 Å²	135.6	76%	0.755	76%	0.76	S	S	*	*			trans	-96	141.7	158.5	44.4	0	0	0	0	109.1
115	T	21.8	Very low	24.2	Very low	131 Å²	131	131.8 Å²	131.8	80%	0.804	74%	0.743	S	S	*	*			trans	-167	118.7	145.8	16.8	0	0	0	0	112.9
116	E	20.6	Very low	24.6	Very low	177 Å²	177	133.2 Å²	133.2	83%	0.827	74%	0.742	S	S	*	*			trans	20.2	115.5	133.9	-60.9	172.2	172.6	0	0	120.4
117	S	21.2	Very low	24.9	Very low	110 Å²	110	130.4 Å²	130.4	77%	0.769	73%	0.726	S	S	*	*			trans	13.6	164.7	144.8	70.5	0	0	0	0	123.5
118	P	31	Very low	25.2	Very low	102 Å²	102	128.4 Å²	128.4	66%	0.662	72%	0.717	S	S	*	*			cis	-134.7	177.3	-33.1	33.6	-14.3	0	0	0	113.8
119	F	20.8	Very low	25.3	Very low	190 Å²	190	127.9 Å²	127.9	83%	0.833	71%	0.713	S	S	*	*			trans	56.6	107.3	170.2	-72.1	-84.2	0	0	0	118.4
120	T	23.3	Very low	25.5	Very low	142 Å²	142	127.4 Å²	127.4	87%	0.871	71%	0.708	S	S	*	*				171	170.4	119	33.3	0	0	0	0	111.3
121	C	24.2	Very low	25.8	Very low	114 Å²	114	124.6 Å²	124.6	77%	0.77	69%	0.694	S	S	*	*			trans	-42.6	127.1	-172.6	-52.4	0	0	0	0	117.2	T123	C121-T123 PolarHBondContact O-N 2.93Å; C121-T123 VanDerWaalsContact O-N 3.14Å
122	C	25.3	Very low	25.9	Very low	101 Å²	101	126.5 Å²	126.5	68%	0.682	70%	0.696	S	S	*	*			trans	-66.2	106.7	158	-65.3	0	0	0	0	109.5	E126	C122-E126 VanDerWaalsContact CB-OE2 3.32Å; C122-E126 WeakPolarHBondContact CB-OE2 3.27Å; C122-E126 PolarHBondContact SG-OE2 3.44Å
123	T	28.7	Very low	26.1	Very low	75 Å²	75	129.2 Å²	129.2	46%	0.46	70%	0.701	S	S	.	*			trans	-80	164.2	173.2	44.8	0	0	0	0	111.1	C121 M125 E126	C121-T123 PolarHBondContact O-N 2.93Å; C121-T123 VanDerWaalsContact O-N 3.14Å; T123-M125 PolarHBondContact O-N 2.92Å; T123-E126 PolarHBondContact O-N 2.91Å
124	L	27.8	Very low	26.2	Very low	111 Å²	111	129.4 Å²	129.4	58%	0.581	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-51.3	-20.5	-177.3	-140.8	155	0	0	0	114.6	F75 E126 L127	F75-L124 HydrophobicContact CE1-CD1 3.87Å; F75-L124 HydrophobicContact CZ-CD1 3.78Å; L124-E126 VanDerWaalsContact C-N 3.28Å; L124-E126 PolarHBondContact O-N 3.46Å; L124-L127 PolarHBondContact O-N 2.95Å
125	M	30.9	Very low	26.4	Very low	104 Å²	104	135 Å²	135	51%	0.512	70%	0.696	S	S	.	*	G	3₁₀ helix	trans	-56.7	-30.3	177.9	-69.1	-69.2	-72.2	0	0	114.7	F28 T123 L127	F28-M125 HydrophobicContact CZ-CE 4.05Å; T123-M125 PolarHBondContact O-N 2.92Å; M125-L127 VanDerWaalsContact C-N 3.34Å; M125-L127 PolarHBondContact O-N 3.44Å
126	E	34.9	Very low	26.6	Very low	126 Å²	126	136.3 Å²	136.3	59%	0.589	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-79.6	-12.2	-175.2	-66.9	-176.9	162.9	0	0	114.3	C122 T123 L124	C122-E126 VanDerWaalsContact CB-OE2 3.32Å; C122-E126 WeakPolarHBondContact CB-OE2 3.27Å; C122-E126 PolarHBondContact SG-OE2 3.44Å; T123-E126 PolarHBondContact O-N 2.91Å; L124-E126 VanDerWaalsContact C-N 3.28Å; L124-E126 PolarHBondContact O-N 3.46Å
127	L	29.6	Very low	26.8	Very low	110 Å²	110	135.8 Å²	135.8	58%	0.576	70%	0.699	S	S	*	*	S	Bend	trans	-93.9	-17.1	-178.4	-77.7	167.1	0	0	0	114.2	L124 M125 P129 F130 F131	L124-L127 PolarHBondContact O-N 2.95Å; M125-L127 VanDerWaalsContact C-N 3.34Å; M125-L127 PolarHBondContact O-N 3.44Å; L127-P129 VanDerWaalsContact C-CD 3.45Å; L127-F130 PolarHBondContact O-N 2.9Å; L127-F131 WeakPolarHBondContact O-CD2 3.43Å; L127-F131 WeakPolarHBondContact O-CE2 3.49Å
128	L	28.1	Very low	27	Very low	102 Å²	102	133.5 Å²	133.5	53%	0.534	69%	0.693	S	S	.	*	G	3₁₀ helix	trans	-59.8	-36	179.9	-87.8	116.5	0	0	0	115.3	F130 F131	L128-F130 PolarHBondContact O-N 3.12Å; L128-F130 VanDerWaalsContact O-N 3.09Å; L128-F131 PolarHBondContact O-N 2.85Å
129	P	27.3	Very low	26.7	Very low	103 Å²	103	135.9 Å²	135.9	67%	0.669	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-66.1	-11	-178.9	-23.2	34.8	0	0	0	115.6	L127	L127-P129 VanDerWaalsContact C-CD 3.45Å
130	F	29.1	Very low	26.9	Very low	164 Å²	164	132.3 Å²	132.3	72%	0.719	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-85.3	-6.4	179.6	-93.4	-84.9	0	0	0	114.4	L127 L128	L127-F130 PolarHBondContact O-N 2.9Å; L128-F130 PolarHBondContact O-N 3.12Å; L128-F130 VanDerWaalsContact O-N 3.09Å
131	F	28.2	Very low	27	Very low	116 Å²	116	137.5 Å²	137.5	51%	0.509	70%	0.698	S	S	.	*	S	Bend	trans	-97.3	-0.1	-171	-74.3	-80.2	0	0	0	115.6	I71 L127 L128	I71-F131 HydrophobicContact CB-CE1 4.41Å; I71-F131 HydrophobicContact CG1-CE1 4.1Å; I71-F131 HydrophobicContact CG2-CE1 3.89Å; I71-F131 HydrophobicContact CG2-CZ 4.02Å; L127-F131 WeakPolarHBondContact O-CD2 3.43Å; L127-F131 WeakPolarHBondContact O-CE2 3.49Å; L128-F131 PolarHBondContact O-N 2.85Å
132	D	25.8	Very low	27.2	Very low	150 Å²	150	139 Å²	139	80%	0.802	69%	0.692	S	S	*	*	S	Bend	trans	-96	21.2	-171.5	-106.4	-20	0	0	0	115.5
133	Y	25.5	Very low	27.3	Very low	235 Å²	235	144.1 Å²	144.1	92%	0.922	70%	0.703	S	S	*	*			trans	-136.4	66.1	179	-103.2	-87.2	0	0	0	114.1
134	E	24.4	Very low	27.4	Very low	131 Å²	131	148.5 Å²	148.5	61%	0.612	72%	0.715	S	S	*	*			trans	-110.7	124.3	162.1	-91.7	-155.1	142.6	0	0	112
135	R	25.5	Very low	27.6	Very low	242 Å²	242	146.8 Å²	146.8	91%	0.913	71%	0.706	S	S	*	*			trans	172.1	103.1	140.6	-99	167.4	179.9	-167.8	0.5	112.7
136	L	26.8	Very low	27.6	Very low	157 Å²	157	146.1 Å²	146.1	82%	0.822	70%	0.703	S	S	*	*				172.9	112.6	115.8	-103.8	134.4	0	0	0	113.5
137	L	24.2	Very low	27.5	Very low	166 Å²	166	142.4 Å²	142.4	87%	0.869	69%	0.685	S	S	*	*			trans	19.2	136.3	155.1	-66.6	94.1	0	0	0	121.7
138	G	24.9	Very low	27.6	Very low	63 Å²	63	143.1 Å²	143.1	65%	0.649	68%	0.683	S	S	*	*			cis	169.1	-172	-1.5	0	0	0	0	0	117.8
139	T	26.5	Very low	27.9	Very low	151 Å²	151	141.5 Å²	141.5	93%	0.926	67%	0.672	S	S	*	*			trans	79.7	106.9	179.5	66.1	0	0	0	0	118.8
140	L	23.1	Very low	28.2	Very low	115 Å²	115	142.9 Å²	142.9	60%	0.602	67%	0.667	S	S	*	*			trans	-126.8	152.5	176	-80.7	155	0	0	0	110.5	F142	L140-F142 HydrophobicContact CB-CE2 3.83Å; L140-F142 HydrophobicContact CB-CZ 4.14Å; L140-F142 HydrophobicContact CD1-CE2 4.3Å; L140-F142 HydrophobicContact CD1-CZ 3.98Å; L140-F142 HydrophobicContact CD2-CE1 4.39Å; L140-F142 HydrophobicContact CD2-CE2 4.5Å; L140-F142 HydrophobicContact CD2-CZ 3.99Å; L140-F142 HydrophobicContact CG-CE2 4.44Å; L140-F142 HydrophobicContact CG-CZ 4.27Å
141	R	27.1	Very low	28.7	Very low	251 Å²	251	140.2 Å²	140.2	95%	0.947	66%	0.655	S	S	*	*			trans	-146.8	136.6	161.6	-76.7	-168.2	171.9	176.2	-1.9	110.5
142	F	26.9	Very low	29.1	Very low	147 Å²	147	139 Å²	139	65%	0.645	66%	0.659	S	S	*	*			trans	-123.1	160.5	-167.5	-59.3	-91.6	0	0	0	113.5	L140	L140-F142 HydrophobicContact CB-CE2 3.83Å; L140-F142 HydrophobicContact CB-CZ 4.14Å; L140-F142 HydrophobicContact CD1-CE2 4.3Å; L140-F142 HydrophobicContact CD1-CZ 3.98Å; L140-F142 HydrophobicContact CD2-CE1 4.39Å; L140-F142 HydrophobicContact CD2-CE2 4.5Å; L140-F142 HydrophobicContact CD2-CZ 3.99Å; L140-F142 HydrophobicContact CG-CE2 4.44Å; L140-F142 HydrophobicContact CG-CZ 4.27Å
143	K	29.2	Very low	29.3	Very low	207 Å²	207	137.8 Å²	137.8	90%	0.9	66%	0.662	S	S	*	*			trans	-174.1	143.8	144.7	-112	169.7	-176.8	-179.5	0	116.5
144	K	30.1	Very low	29.6	Very low	167 Å²	167	131.2 Å²	131.2	73%	0.726	65%	0.647	S	S	*	*			trans	96	127.7	167.6	-66.4	-160.7	164.8	-151	0	118.9	D176	K144-D176 IonicContact NZ-OD2 2.68Å; K144-D176 PolarHBondContact NZ-OD2 3.04Å
145	M	32.5	Very low	29.7	Very low	76 Å²	76	132.9 Å²	132.9	37%	0.374	66%	0.66	S	S	.	*			trans	-116.6	159	172.6	-103.1	178.5	171.1	0	0	109.4	L63 Y147 L175	L63-M145 HydrophobicContact CD2-CE 4.36Å; M145-Y147 HydrophobicContact CB-CE2 4.24Å; M145-Y147 HydrophobicContact SD-CE2 4.28Å; M145-L175 HydrophobicContact CB-CD2 4.28Å
146	L	30.3	Very low	29.8	Very low	89 Å²	89	128.9 Å²	128.9	47%	0.466	65%	0.649	S	S	.	*			trans	-133.7	141.3	176.7	-73	167	0	0	0	110.6
147	Y	33.3	Very low	29.9	Very low	49 Å²	49	131.9 Å²	131.9	19%	0.192	66%	0.656	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.1	142.2	-178.7	-69.8	-91.2	0	0	0	111.6	M145 L170 L175	M145-Y147 HydrophobicContact CB-CE2 4.24Å; M145-Y147 HydrophobicContact SD-CE2 4.28Å; Y147-L170 HydrophobicContact CE2-CD2 4.42Å; Y147-L175 HydrophobicContact CE2-CD1 4.25Å
148	F	31.7	Very low	30.4	Very low	125 Å²	125	127.3 Å²	127.3	55%	0.548	65%	0.648	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-128.6	136.8	178.1	-62.2	-79.8	0	0	0	110.6
149	F	33.1	Very low	30.9	Very low	68 Å²	68	127.6 Å²	127.6	30%	0.298	64%	0.64	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.9	143.2	175	-68.5	-77.6	0	0	0	111.7	V177	F149-V177 HydrophobicContact CD2-CG1 3.77Å; F149-V177 HydrophobicContact CE2-CG1 3.82Å
150	K	34.9	Very low	31.4	Very low	132 Å²	132	126.1 Å²	126.1	57%	0.574	63%	0.626	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97.1	126	171.6	-174.1	176.8	179.1	179.8	0	109.7
151	K	38.2	Very low	32.4	Very low	107 Å²	107	124.4 Å²	124.4	47%	0.465	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-71	127.8	166	-99.3	173.2	172.1	169.8	0	109.4	S153 E181	K151-S153 PolarHBondContact O-N 3.17Å; K151-E181 WeakPolarHBondContact CD-OE1 3.19Å; K151-E181 IonicContact NZ-OE1 3.63Å; K151-E181 PolarHBondContact NZ-OE1 3.05Å
152	P	37.5	Very low	33.1	Very low	90 Å²	90	121.2 Å²	121.2	58%	0.584	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-72.3	126	172.7	28.3	-32.5	0	0	0	110.5	V154	P152-V154 PolarHBondContact O-N 3.49Å
153	S	28.9	Very low	33.8	Very low	125 Å²	125	117.4 Å²	117.4	87%	0.874	60%	0.596	S	S	*	*	S	Bend	trans	-78.4	36.4	179.5	50.1	0	0	0	0	113.7	K151	K151-S153 PolarHBondContact O-N 3.17Å
154	V	32.2	Very low	34.6	Very low	97 Å²	97	111.2 Å²	111.2	59%	0.588	57%	0.573	S	S	*	*	S	Bend	trans	-138.2	128.6	178.9	-176.5	0	0	0	0	109.7	P152 F156	P152-V154 PolarHBondContact O-N 3.49Å; V154-F156 HydrophobicContact CG1-CD2 4.25Å; V154-F156 HydrophobicContact CG1-CE2 4.21Å; V154-F156 PolarHBondContact O-N 2.88Å
155	N	27.1	Very low	35.5	Very low	166 Å²	166	108 Å²	108	89%	0.888	56%	0.563	S	S	*	*			trans	-63.3	91.6	-177.7	-84.5	-40.6	0	0	0	113.3
156	F	27.4	Very low	35.9	Very low	159 Å²	159	108.6 Å²	108.6	70%	0.697	57%	0.567	S	S	*	*			trans	-108.3	103.9	163.1	-87	-83.9	0	0	0	110.7	V154 G158	V154-F156 HydrophobicContact CG1-CD2 4.25Å; V154-F156 HydrophobicContact CG1-CE2 4.21Å; V154-F156 PolarHBondContact O-N 2.88Å; F156-G158 PolarHBondContact O-N 3.48Å
157	K	29.2	Very low	36.5	Very low	220 Å²	220	107.5 Å²	107.5	96%	0.957	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	26.1	-177.5	-85.7	-174.1	170.4	-177.8	0	115.4
158	G	33.7	Very low	37.3	Very low	69 Å²	69	108.4 Å²	108.4	71%	0.711	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136	-6.4	-166.2	0	0	0	0	0	118.4	F156	F156-G158 PolarHBondContact O-N 3.48Å
159	S	35.3	Very low	37.8	Very low	69 Å²	69	106.8 Å²	106.8	48%	0.483	57%	0.566	S	S	.	*			trans	-120.9	2.5	-166.3	51.7	0	0	0	0	116.9	S161	S159-S161 VanDerWaalsContact C-N 3.32Å; S159-S161 PolarHBondContact O-N 3Å
160	L	37.7	Very low	38.2	Very low	121 Å²	121	104.7 Å²	104.7	63%	0.634	56%	0.558	S	S	*	*	H	α-helix	trans	-58.9	-38.7	-179.5	-93.7	80.4	0	0	0	113.5	R162 Q163 D164	L160-R162 VanDerWaalsContact C-N 3.28Å; L160-R162 PolarHBondContact O-N 2.85Å; L160-R162 VanDerWaalsContact O-N 3.13Å; L160-Q163 PolarHBondContact O-N 3.37Å; L160-D164 PolarHBondContact O-N 2.78Å
161	S	44.4	Very low	38.9	Very low	79 Å²	79	102 Å²	102	55%	0.552	56%	0.556	S	S	*	*	H	α-helix	trans	-63.1	-25.7	-168.5	56.5	0	0	0	0	115.1	S159 I165	S159-S161 VanDerWaalsContact C-N 3.32Å; S159-S161 PolarHBondContact O-N 3Å; S161-I165 VanDerWaalsContact O-CD1 3.31Å; S161-I165 WeakPolarHBondContact O-CD1 3.37Å; S161-I165 VanDerWaalsContact O-CG1 3.25Å; S161-I165 WeakPolarHBondContact O-CG1 3.49Å; S161-I165 PolarHBondContact O-N 3.07Å
162	R	41	Very low	39.1	Very low	184 Å²	184	100 Å²	100	69%	0.694	57%	0.565	S	S	*	*	H	α-helix	trans	-84.3	-31.5	180	-74.7	-174.8	176.7	165.3	1.6	113.8	L160 L166	L160-R162 VanDerWaalsContact C-N 3.28Å; L160-R162 PolarHBondContact O-N 2.85Å; L160-R162 VanDerWaalsContact O-N 3.13Å; R162-L166 PolarHBondContact O-N 2.99Å; R162-L166 VanDerWaalsContact O-N 3.09Å
163	Q	41.4	Very low	39.1	Very low	66 Å²	66	101.3 Å²	101.3	31%	0.308	57%	0.567	S	S	.	*	H	α-helix	trans	-69.4	-39	176.3	-77.3	-176.7	-28.1	0	0	111.2	L160 L166 R167	L160-Q163 PolarHBondContact O-N 3.37Å; Q163-L166 PolarHBondContact O-N 3.42Å; Q163-R167 WeakPolarHBondContact O-CG 3.28Å; Q163-R167 PolarHBondContact O-N 3.36Å
164	D	47.3	Very low	39.3	Very low	78 Å²	78	97.9 Å²	97.9	42%	0.417	55%	0.552	S	S	.	*	H	α-helix	trans	-71.3	-33.1	178.2	-66.3	-34.4	0	0	0	112.7	L160 R167 S168	L160-D164 PolarHBondContact O-N 2.78Å; D164-R167 PolarHBondContact O-N 3.3Å; D164-R167 IonicContact OD1-CZ 2.75Å; D164-R167 IonicContact OD1-NH1 2.64Å; D164-R167 PolarHBondContact OD1-NH1 3.14Å; D164-S168 WeakPolarHBondContact O-CB 3.48Å; D164-S168 PolarHBondContact O-N 2.83Å
165	I	47.5	Very low	39.5	Very low	99 Å²	99	95.5 Å²	95.5	51%	0.508	54%	0.536	S	S	.	.	H	α-helix	trans	-65.1	-45.9	170.9	-69	168.1	0	0	0	110.9	S161 R167 S168 L169	S161-I165 VanDerWaalsContact O-CD1 3.31Å; S161-I165 WeakPolarHBondContact O-CD1 3.37Å; S161-I165 VanDerWaalsContact O-CG1 3.25Å; S161-I165 WeakPolarHBondContact O-CG1 3.49Å; S161-I165 PolarHBondContact O-N 3.07Å; I165-R167 PolarHBondContact O-N 2.99Å; I165-S168 PolarHBondContact O-N 3.18Å; I165-S168 PolarHBondContact O-OG 3.3Å; I165-L169 HydrophobicContact CG2-CD1 4.14Å; I165-L169 PolarHBondContact O-N 3.38Å
166	L	41.4	Very low	40	Very low	88 Å²	88	91.1 Å²	91.1	46%	0.461	51%	0.512	S	S	.	.	H	α-helix	trans	-62.4	-40.5	176.1	-111.5	155.2	0	0	0	112.5	R162 Q163 L170	R162-L166 PolarHBondContact O-N 2.99Å; R162-L166 VanDerWaalsContact O-N 3.09Å; Q163-L166 PolarHBondContact O-N 3.42Å; L166-L170 HydrophobicContact CD2-CD1 4.04Å; L166-L170 HydrophobicContact CD2-CG 4.42Å; L166-L170 WeakPolarHBondContact O-CB 3.35Å; L166-L170 VanDerWaalsContact O-CG 3.27Å; L166-L170 WeakPolarHBondContact O-CG 3.38Å; L166-L170 PolarHBondContact O-N 3.4Å
167	R	43.2	Very low	40.5	Very low	67 Å²	67	85.3 Å²	85.3	25%	0.253	49%	0.49	S	S	.	.	H	α-helix	trans	-58.8	-48.1	170.2	-78.4	-178	-172.9	137.6	0.9	111.5	Q163 D164 I165 L169 L170 S171 V177 D179	Q163-R167 WeakPolarHBondContact O-CG 3.28Å; Q163-R167 PolarHBondContact O-N 3.36Å; D164-R167 PolarHBondContact O-N 3.3Å; D164-R167 IonicContact OD1-CZ 2.75Å; D164-R167 IonicContact OD1-NH1 2.64Å; D164-R167 PolarHBondContact OD1-NH1 3.14Å; I165-R167 PolarHBondContact O-N 2.99Å; R167-L169 VanDerWaalsContact C-N 3.34Å; R167-L169 PolarHBondContact O-N 2.75Å; R167-L170 PolarHBondContact O-N 3.2Å; R167-S171 WeakPolarHBondContact O-CB 3.5Å; R167-S171 PolarHBondContact O-N 2.7Å; R167-S171 PolarHBondContact O-OG 2.83Å; R167-V177 HydrophobicContact CG-CG1 4.31Å; R167-D179 IonicContact CZ-OD1 3.94Å; R167-D179 IonicContact CZ-OD2 3.78Å; R167-D179 IonicContact NE-OD1 3.97Å; R167-D179 IonicContact NH2-OD1 2.92Å; R167-D179 PolarHBondContact NH2-OD1 3.35Å; R167-D179 IonicContact NH2-OD2 2.75Å; R167-D179 PolarHBondContact NH2-OD2 3.35Å
168	S	50.4	Low	40.9	Very low	68 Å²	68	81.3 Å²	81.3	48%	0.476	47%	0.47	S	S	.	.	H	α-helix	trans	-61.4	-41.1	-178	75	0	0	0	0	112.4	D164 I165 S171 G172	D164-S168 WeakPolarHBondContact O-CB 3.48Å; D164-S168 PolarHBondContact O-N 2.83Å; I165-S168 PolarHBondContact O-N 3.18Å; I165-S168 PolarHBondContact O-OG 3.3Å; S168-S171 WeakPolarHBondContact CA-OG 3.41Å; S168-S171 PolarHBondContact O-OG 3.09Å; S168-S171 VanDerWaalsContact O-OG 3.07Å; S168-G172 PolarHBondContact O-N 2.9Å
169	L	42.6	Very low	41.1	Very low	90 Å²	90	81.3 Å²	81.3	47%	0.471	45%	0.453	S	S	.	.	H	α-helix	trans	-65.2	-46.2	174.3	-89.6	158.2	0	0	0	112.9	I165 R167 G172 N173	I165-L169 HydrophobicContact CG2-CD1 4.14Å; I165-L169 PolarHBondContact O-N 3.38Å; R167-L169 VanDerWaalsContact C-N 3.34Å; R167-L169 PolarHBondContact O-N 2.75Å; L169-G172 PolarHBondContact O-N 3.19Å; L169-N173 PolarHBondContact O-N 3.49Å; L169-N173 VanDerWaalsContact O-N 3.14Å
170	L	41.7	Very low	41.1	Very low	24 Å²	24	84.1 Å²	84.1	13%	0.126	45%	0.454	C	S	.	.	H	α-helix	trans	-67.5	-41.7	179.2	-69.7	168.8	0	0	0	111.8	Y147 L166 R167 N173 G174 L175 V177	Y147-L170 HydrophobicContact CE2-CD2 4.42Å; L166-L170 HydrophobicContact CD2-CD1 4.04Å; L166-L170 HydrophobicContact CD2-CG 4.42Å; L166-L170 WeakPolarHBondContact O-CB 3.35Å; L166-L170 VanDerWaalsContact O-CG 3.27Å; L166-L170 WeakPolarHBondContact O-CG 3.38Å; L166-L170 PolarHBondContact O-N 3.4Å; R167-L170 PolarHBondContact O-N 3.2Å; L170-N173 PolarHBondContact O-N 2.95Å; L170-G174 PolarHBondContact O-N 2.96Å; L170-L175 HydrophobicContact CD2-CD1 3.98Å; L170-L175 WeakPolarHBondContact O-CB 3.35Å; L170-L175 PolarHBondContact O-N 3.01Å; L170-V177 HydrophobicContact CB-CG2 3.95Å; L170-V177 HydrophobicContact CD1-CG2 4.14Å
171	S	48.8	Very low	40.7	Very low	77 Å²	77	84.5 Å²	84.5	54%	0.538	45%	0.453	S	S	.	.	H	α-helix	trans	-67.9	-35.7	174.4	65.4	0	0	0	0	112.5	R167 S168 N173 G174	R167-S171 WeakPolarHBondContact O-CB 3.5Å; R167-S171 PolarHBondContact O-N 2.7Å; R167-S171 PolarHBondContact O-OG 2.83Å; S168-S171 WeakPolarHBondContact CA-OG 3.41Å; S168-S171 PolarHBondContact O-OG 3.09Å; S168-S171 VanDerWaalsContact O-OG 3.07Å; S171-N173 PolarHBondContact O-N 2.68Å; S171-G174 PolarHBondContact O-N 2.97Å
172	G	43.2	Very low	40	Very low	63 Å²	63	87.4 Å²	87.4	65%	0.649	46%	0.462	S	S	*	.	H	α-helix	trans	-63.3	-31.2	175.8	0	0	0	0	0	112.8	S168 L169 G174	S168-G172 PolarHBondContact O-N 2.9Å; L169-G172 PolarHBondContact O-N 3.19Å; G172-G174 VanDerWaalsContact C-N 3.34Å
173	N	35.9	Very low	39.3	Very low	118 Å²	118	87.5 Å²	87.5	63%	0.631	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	6.6	174.5	-69.2	-15.7	0	0	0	113.8	L169 L170 S171	L169-N173 PolarHBondContact O-N 3.49Å; L169-N173 VanDerWaalsContact O-N 3.14Å; L170-N173 PolarHBondContact O-N 2.95Å; S171-N173 PolarHBondContact O-N 2.68Å
174	G	34	Very low	38.6	Very low	54 Å²	54	93.9 Å²	93.9	56%	0.557	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	29	174.1	0	0	0	0	0	115.4	L170 S171 G172	L170-G174 PolarHBondContact O-N 2.96Å; S171-G174 PolarHBondContact O-N 2.97Å; G172-G174 VanDerWaalsContact C-N 3.34Å
175	L	36.3	Very low	37.7	Very low	47 Å²	47	96.7 Å²	96.7	25%	0.246	50%	0.499	C	S	.	.			trans	-104.5	134.9	173.5	-65.2	166.3	0	0	0	111	M145 Y147 L170	M145-L175 HydrophobicContact CB-CD2 4.28Å; Y147-L175 HydrophobicContact CE2-CD1 4.25Å; L170-L175 HydrophobicContact CD2-CD1 3.98Å; L170-L175 WeakPolarHBondContact O-CB 3.35Å; L170-L175 PolarHBondContact O-N 3.01Å
176	D	37.9	Very low	36.8	Very low	73 Å²	73	96.1 Å²	96.1	39%	0.39	50%	0.5	S	S	.	.			trans	-83.8	132.6	-179.4	-54.9	-58.4	0	0	0	110.4	K144 Y178	K144-D176 IonicContact NZ-OD2 2.68Å; K144-D176 PolarHBondContact NZ-OD2 3.04Å; D176-Y178 HydrophobicContact CB-CE2 3.96Å
177	V	38.1	Very low	36.1	Very low	37 Å²	37	95 Å²	95	22%	0.224	51%	0.51	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	134.6	-176.1	-177.8	0	0	0	0	110.5	F149 R167 L170	F149-V177 HydrophobicContact CD2-CG1 3.77Å; F149-V177 HydrophobicContact CE2-CG1 3.82Å; R167-V177 HydrophobicContact CG-CG1 4.31Å; L170-V177 HydrophobicContact CB-CG2 3.95Å; L170-V177 HydrophobicContact CD1-CG2 4.14Å
178	Y	37.6	Very low	35.4	Very low	137 Å²	137	98.3 Å²	98.3	54%	0.537	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	143.8	-175.2	-62.3	-87.7	0	0	0	113.7	D176	D176-Y178 HydrophobicContact CB-CE2 3.96Å
179	D	36.6	Very low	34.5	Very low	68 Å²	68	98.9 Å²	98.9	36%	0.364	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	157.6	172.6	-79.7	13.7	0	0	0	110.9	R167	R167-D179 IonicContact CZ-OD1 3.94Å; R167-D179 IonicContact CZ-OD2 3.78Å; R167-D179 IonicContact NE-OD1 3.97Å; R167-D179 IonicContact NH2-OD1 2.92Å; R167-D179 PolarHBondContact NH2-OD1 3.35Å; R167-D179 IonicContact NH2-OD2 2.75Å; R167-D179 PolarHBondContact NH2-OD2 3.35Å
180	Y	35.9	Very low	33.8	Very low	129 Å²	129	101.1 Å²	101.1	51%	0.506	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	143.8	172.7	-163.1	-107.4	0	0	0	113.9	D182	Y180-D182 VanDerWaalsContact CE1-O 3.25Å; Y180-D182 WeakPolarHBondContact CE1-O 3.24Å
181	E	30.1	Very low	33.2	Very low	128 Å²	128	107 Å²	107	60%	0.598	57%	0.566	S	S	*	*			trans	-125.5	142.3	172.4	-71.7	177.6	-174.7	0	0	109.6	K151	K151-E181 WeakPolarHBondContact CD-OE1 3.19Å; K151-E181 IonicContact NZ-OE1 3.63Å; K151-E181 PolarHBondContact NZ-OE1 3.05Å
182	D	28.2	Very low	32.3	Very low	141 Å²	141	107 Å²	107	75%	0.754	56%	0.56	S	S	*	*			trans	69.7	121.8	174.5	-74.3	-12.8	0	0	0	123.3	Y180 K184	Y180-D182 VanDerWaalsContact CE1-O 3.25Å; Y180-D182 WeakPolarHBondContact CE1-O 3.24Å; D182-K184 PolarHBondContact O-N 3.37Å
183	Y	26.4	Very low	31.6	Very low	185 Å²	185	108 Å²	108	73%	0.725	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	24.9	-160.8	-109.6	-99.3	0	0	0	117.4
184	K	28.5	Very low	31.2	Very low	201 Å²	201	108.3 Å²	108.3	87%	0.874	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.7	-2.2	-173.5	-82.6	-173.3	175.9	179.6	0	117.3	D182	D182-K184 PolarHBondContact O-N 3.37Å
185	F	28.1	Very low	31	Very low	137 Å²	137	112.5 Å²	112.5	60%	0.601	56%	0.557	S	S	*	*			trans	-121.5	7.5	-175.9	-102.6	-86.1	0	0	0	116.3	G187 F188	F185-G187 PolarHBondContact O-N 3.45Å; F185-F188 HydrophobicContact CD1-CB 4.31Å; F185-F188 PolarHBondContact O-N 3.1Å; F185-F188 VanDerWaalsContact O-N 3.16Å
186	T	27.6	Very low	30.7	Very low	86 Å²	86	116.8 Å²	116.8	53%	0.528	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.4	-12.3	-176.9	42.4	0	0	0	0	115.3
187	G	27.8	Very low	30.1	Very low	65 Å²	65	119.1 Å²	119.1	67%	0.67	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-25.8	173.3	0	0	0	0	0	115.1	F185	F185-G187 PolarHBondContact O-N 3.45Å
188	F	27.5	Very low	29.6	Very low	137 Å²	137	125.9 Å²	125.9	60%	0.601	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	-14.8	-167	-144.9	-98.9	0	0	0	114.6	F185 N192	F185-F188 HydrophobicContact CD1-CB 4.31Å; F185-F188 PolarHBondContact O-N 3.1Å; F185-F188 VanDerWaalsContact O-N 3.16Å; F188-N192 PolarHBondContact O-ND2 3.24Å
189	V	31.1	Very low	29	Very low	80 Å²	80	125 Å²	125	49%	0.485	61%	0.613	S	S	.	*	H	α-helix	trans	-83.1	-31	-177.4	-179.8	0	0	0	0	112	E191 E193	V189-E191 PolarHBondContact O-N 3.05Å; V189-E193 HydrophobicContact CG1-CG 4.37Å; V189-E193 PolarHBondContact O-N 2.78Å
190	L	28.7	Very low	28.5	Very low	137 Å²	137	128.5 Å²	128.5	72%	0.717	64%	0.637	S	S	*	*	H	α-helix	trans	-70	-27.6	-179.4	-86	162	0	0	0	114.1
191	E	28.6	Very low	27.9	Very low	147 Å²	147	127.5 Å²	127.5	69%	0.687	65%	0.649	S	S	*	*	H	α-helix	trans	-84.1	-26.6	177.5	-72.6	-169.8	135.1	0	0	113.5	V189	V189-E191 PolarHBondContact O-N 3.05Å
192	N	29.5	Very low	27.7	Very low	76 Å²	76	130.9 Å²	130.9	41%	0.406	66%	0.664	S	S	.	*	H	α-helix	trans	-93.4	-28.1	-173.6	-80.5	-63.2	0	0	0	115.1	F188	F188-N192 PolarHBondContact O-ND2 3.24Å
193	E	29.4	Very low	27.5	Very low	84 Å²	84	131.7 Å²	131.7	39%	0.393	67%	0.668	S	S	.	*	H	α-helix	trans	-78.6	-25.4	179.3	-75.2	-60.4	132.8	0	0	113.4	V189 L195 K196 L197	V189-E193 HydrophobicContact CG1-CG 4.37Å; V189-E193 PolarHBondContact O-N 2.78Å; E193-L195 PolarHBondContact O-N 3.42Å; E193-K196 PolarHBondContact O-N 3.49Å; E193-K196 VanDerWaalsContact O-N 3.17Å; E193-K196 WeakPolarHBondContact OE1-CD 3.5Å; E193-K196 WeakPolarHBondContact OE1-CE 3.47Å; E193-K196 IonicContact OE1-NZ 2.65Å; E193-K196 PolarHBondContact OE1-NZ 2.9Å; E193-L197 PolarHBondContact O-N 2.92Å
194	L	28.3	Very low	27.4	Very low	125 Å²	125	134.2 Å²	134.2	65%	0.654	68%	0.676	S	S	*	*	H	α-helix	trans	-63.5	-24.8	173.1	-96.2	164.3	0	0	0	113.4
195	L	29.1	Very low	27.2	Very low	142 Å²	142	129.8 Å²	129.8	74%	0.743	67%	0.668	S	S	*	*	H	α-helix	trans	-82.8	-26.6	175.3	-92.5	157.9	0	0	0	113.2	E193	E193-L195 PolarHBondContact O-N 3.42Å
196	K	29.1	Very low	26.9	Very low	137 Å²	137	131.7 Å²	131.7	60%	0.596	68%	0.684	S	S	*	*	H	α-helix	trans	-79.1	-28.7	176.8	-67.4	-176.5	-166.2	159.7	0	113.1	E193 K198	E193-K196 PolarHBondContact O-N 3.49Å; E193-K196 VanDerWaalsContact O-N 3.17Å; E193-K196 WeakPolarHBondContact OE1-CD 3.5Å; E193-K196 WeakPolarHBondContact OE1-CE 3.47Å; E193-K196 IonicContact OE1-NZ 2.65Å; E193-K196 PolarHBondContact OE1-NZ 2.9Å; K196-K198 PolarHBondContact O-N 3.45Å; K196-K198 VanDerWaalsContact O-N 3.15Å
197	L	26.9	Very low	26.6	Very low	122 Å²	122	132.2 Å²	132.2	64%	0.639	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-1.8	-176.9	-80	164.4	0	0	0	115.8	E193	E193-L197 PolarHBondContact O-N 2.92Å
198	K	26.6	Very low	26.4	Very low	180 Å²	180	134.7 Å²	134.7	78%	0.783	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	-2.3	-179.9	-105.2	-177.4	179.7	178.3	0	116.1	K196	K196-K198 PolarHBondContact O-N 3.45Å; K196-K198 VanDerWaalsContact O-N 3.15Å
199	Q	25.2	Very low	26.1	Very low	119 Å²	119	137.4 Å²	137.4	56%	0.556	71%	0.711	S	S	*	*	S	Bend	trans	-145.1	80.3	-177.8	-69.9	-175	-5.8	0	0	113.5
200	T	25.2	Very low	25.8	Very low	140 Å²	140	137.4 Å²	137.4	86%	0.859	73%	0.727	S	S	*	*			trans	-174.5	109	140	28.4	0	0	0	0	110.8
201	S	24	Very low	25.5	Very low	109 Å²	109	140.3 Å²	140.3	76%	0.762	73%	0.734	S	S	*	*			trans	-151.6	57.6	161.7	69.3	0	0	0	0	113.2
202	H	26.6	Very low	25.4	Very low	198 Å²	198	142 Å²	142	92%	0.917	74%	0.742	S	S	*	*			trans	-144.2	95.3	146.7	-86.2	-62	0	0	0	109.8
203	L	24.3	Very low	25	Very low	159 Å²	159	145.5 Å²	145.5	83%	0.832	76%	0.76	S	S	*	*			trans	-65.7	156.5	160.3	-69.4	152.6	0	0	0	108.3
204	R	23.3	Very low	24.9	Very low	237 Å²	237	150.6 Å²	150.6	89%	0.894	78%	0.784	S	S	*	*				-154.3	166.9	54	-102.2	-170.3	171.8	166	-2.8	114
205	P	23.7	Very low	24.7	Very low	109 Å²	109	147.8 Å²	147.8	71%	0.708	78%	0.784	S	S	*	*			trans	-98.3	177	-167.9	40.7	-37.5	0	0	0	114
206	L	22.3	Very low	24.5	Very low	177 Å²	177	147.7 Å²	147.7	93%	0.927	79%	0.792	S	S	*	*			trans	-121.6	131.5	155.4	-108.7	156.6	0	0	0	109.4
207	S	21.5	Very low	24.3	Very low	97 Å²	97	150.1 Å²	150.1	68%	0.678	80%	0.803	S	S	*	*			trans	-101.4	154	-173.5	48.4	0	0	0	0	112.6
208	C	23	Very low	24.3	Very low	116 Å²	116	148.1 Å²	148.1	78%	0.784	80%	0.799	S	S	*	*			trans	173.2	102.5	142.8	-88.3	0	0	0	0	106.5
209	E	22	Very low	24.3	Very low	195 Å²	195	149.2 Å²	149.2	91%	0.911	81%	0.807	S	S	*	*				73.1	121.3	83	-74	-160.4	155.4	0	0	114.8
210	G	24.9	Very low	24.4	Very low	79 Å²	79	151.8 Å²	151.8	81%	0.814	82%	0.817	S	S	*	*			trans	159.3	111.4	174.9	0	0	0	0	0	112.9
211	K	22.4	Very low	24.9	Very low	199 Å²	199	148.5 Å²	148.5	87%	0.865	79%	0.793	S	S	*	*			trans	-74.7	165	176.3	-56.3	165.4	-177.9	170	0	109
212	E	25.9	Very low	25.5	Very low	183 Å²	183	148.3 Å²	148.3	86%	0.855	78%	0.783	S	S	*	*			cis	-157.8	176.1	46.2	-70.9	-174.9	145.8	0	0	113.7
213	N	22.3	Very low	26.2	Very low	148 Å²	148	143.7 Å²	143.7	79%	0.791	77%	0.771	S	S	*	*			trans	-69.7	147.2	-174.9	-52.5	-64.1	0	0	0	114.4
214	H	25.6	Very low	27.1	Very low	192 Å²	192	146 Å²	146	89%	0.889	77%	0.768	S	S	*	*			trans	-178.9	104.1	135.4	-91.9	-52.1	0	0	0	113.9
215	G	24.4	Very low	28.2	Very low	65 Å²	65	139.6 Å²	139.6	67%	0.67	75%	0.748	S	S	*	*			trans	69.7	147.8	149.8	0	0	0	0	0	119.5	K217	G215-K217 PolarHBondContact O-N 2.88Å
216	P	24.6	Very low	29.5	Very low	140 Å²	140	136.8 Å²	136.8	91%	0.909	73%	0.727	S	S	*	*			trans	-77	88.7	178	32.4	-34	0	0	0	110.8
217	K	25.6	Very low	31	Very low	189 Å²	189	135.3 Å²	135.3	82%	0.822	71%	0.713	S	S	*	*			trans	-80.5	121.8	167.2	-80.2	-177.4	177.7	174.1	0	110.1	G215	G215-K217 PolarHBondContact O-N 2.88Å
218	S	26.8	Very low	32.6	Very low	80 Å²	80	135.2 Å²	135.2	56%	0.559	70%	0.7	S	S	*	*			trans	-41.2	138.5	162.7	50.9	0	0	0	0	112.5	F220	S218-F220 WeakPolarHBondContact O-CD2 3.45Å; S218-F220 PolarHBondContact O-N 2.87Å; S218-F220 VanDerWaalsContact OG-CE2 3.27Å; S218-F220 WeakPolarHBondContact OG-CE2 3.43Å
219	E	26.3	Very low	34.1	Very low	202 Å²	202	131 Å²	131	94%	0.944	67%	0.67	S	S	*	*			trans	-59.1	102.7	175.8	-65.4	177.2	143.7	0	0	110.9
220	F	27.2	Very low	36.1	Very low	174 Å²	174	122.5 Å²	122.5	76%	0.763	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-92.9	124	177.2	-93.5	-82.3	0	0	0	111	S218 L222	S218-F220 WeakPolarHBondContact O-CD2 3.45Å; S218-F220 PolarHBondContact O-N 2.87Å; S218-F220 VanDerWaalsContact OG-CE2 3.27Å; S218-F220 WeakPolarHBondContact OG-CE2 3.43Å; F220-L222 PolarHBondContact O-N 3.11Å
221	I	37.2	Very low	37.8	Very low	70 Å²	70	121.8 Å²	121.8	36%	0.359	61%	0.607	S	S	.	*	P	Polyproline II helix	trans	-61.5	131.1	162.6	-59.5	169.3	0	0	0	108.2	H225 I226 Y519	I221-H225 HydrophobicContact CG2-CB 4.49Å; I221-I226 HydrophobicContact CB-CD1 4.25Å; I221-I226 HydrophobicContact CB-CG1 4.42Å; I221-I226 HydrophobicContact CG2-CD1 4.22Å; I221-I226 HydrophobicContact CG2-CG1 3.85Å; I221-Y519 HydrophobicContact CD1-CE1 3.79Å; I221-Y519 VanDerWaalsContact CD1-OH 3.24Å; I221-Y519 WeakPolarHBondContact CD1-OH 3.43Å
222	L	36.5	Very low	39.7	Very low	106 Å²	106	116.4 Å²	116.4	56%	0.555	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-59	128.4	-178.6	-85.8	100.8	0	0	0	111.4	F220 R224 H225	F220-L222 PolarHBondContact O-N 3.11Å; L222-R224 PolarHBondContact O-N 3.29Å; L222-H225 PolarHBondContact O-N 2.95Å
223	P	40.3	Very low	41.5	Very low	100 Å²	100	107.7 Å²	107.7	65%	0.649	55%	0.546	S	S	*	.	H	α-helix	trans	-53.9	-28.5	-176.1	-30.5	35.3	0	0	0	115.6	H225 K227	P223-H225 VanDerWaalsContact C-N 3.27Å; P223-H225 PolarHBondContact O-N 3.16Å; P223-K227 PolarHBondContact O-N 3.29Å; P223-K227 VanDerWaalsContact O-N 3.14Å
224	R	44.4	Very low	43.5	Very low	208 Å²	208	101.4 Å²	101.4	79%	0.785	51%	0.513	S	S	*	.	H	α-helix	trans	-64	-26.9	175.9	-72.7	-175.6	175.6	-178.7	-1.8	113.9	L222 K228	L222-R224 PolarHBondContact O-N 3.29Å; R224-K228 WeakPolarHBondContact O-CG 3.49Å
225	H	45.1	Very low	45.2	Very low	103 Å²	103	97.5 Å²	97.5	48%	0.477	49%	0.49	S	S	.	.	H	α-helix	trans	-84.1	-41.4	-179	-65.9	72.3	0	0	0	110.8	I221 L222 P223 K227 K228 L229	I221-H225 HydrophobicContact CG2-CB 4.49Å; L222-H225 PolarHBondContact O-N 2.95Å; P223-H225 VanDerWaalsContact C-N 3.27Å; P223-H225 PolarHBondContact O-N 3.16Å; H225-K227 PolarHBondContact O-N 2.99Å; H225-K228 PolarHBondContact O-N 3.26Å; H225-L229 PolarHBondContact O-N 3.25Å; H225-L229 VanDerWaalsContact O-N 3.12Å
226	I	50.9	Low	47.1	Very low	49 Å²	49	95.3 Å²	95.3	25%	0.251	46%	0.462	S	S	.	.	H	α-helix	trans	-55.5	-51.6	172.1	-62	176.1	0	0	0	109.9	I221 K228 L229 E230 F304	I221-I226 HydrophobicContact CB-CD1 4.25Å; I221-I226 HydrophobicContact CB-CG1 4.42Å; I221-I226 HydrophobicContact CG2-CD1 4.22Å; I221-I226 HydrophobicContact CG2-CG1 3.85Å; I226-K228 VanDerWaalsContact C-N 3.27Å; I226-K228 PolarHBondContact O-N 3.31Å; I226-L229 PolarHBondContact O-N 3.46Å; I226-E230 HydrophobicContact CG2-CG 4.39Å; I226-E230 WeakPolarHBondContact O-CG 3.5Å; I226-E230 PolarHBondContact O-N 3.1Å; I226-F304 HydrophobicContact CG2-CD2 4.29Å; I226-F304 HydrophobicContact CG2-CE2 4.01Å
227	K	54.6	Low	48.9	Very low	146 Å²	146	89.1 Å²	89.1	64%	0.635	42%	0.422	S	S	*	.	H	α-helix	trans	-61.5	-32.2	-177.9	-156.5	174	-173.4	-179.8	0	113.5	P223 H225 D231	P223-K227 PolarHBondContact O-N 3.29Å; P223-K227 VanDerWaalsContact O-N 3.14Å; H225-K227 PolarHBondContact O-N 2.99Å; K227-D231 WeakPolarHBondContact O-CB 3.44Å; K227-D231 PolarHBondContact O-N 3Å; K227-D231 VanDerWaalsContact O-N 3.13Å
228	K	54	Low	50.7	Low	95 Å²	95	84.9 Å²	84.9	41%	0.413	41%	0.408	S	S	.	.	H	α-helix	trans	-71.4	-31.9	173.1	-79.4	-173.9	174.3	-169.4	0	113.2	R224 H225 I226 D231 I232	R224-K228 WeakPolarHBondContact O-CG 3.49Å; H225-K228 PolarHBondContact O-N 3.26Å; I226-K228 VanDerWaalsContact C-N 3.27Å; I226-K228 PolarHBondContact O-N 3.31Å; K228-D231 WeakPolarHBondContact O-CB 3.31Å; K228-I232 WeakPolarHBondContact O-CD1 3.24Å; K228-I232 VanDerWaalsContact O-CG1 3.3Å; K228-I232 WeakPolarHBondContact O-CG1 3.34Å; K228-I232 PolarHBondContact O-N 3.41Å
229	L	56.2	Low	52.4	Low	28 Å²	28	82.7 Å²	82.7	15%	0.147	39%	0.393	C	S	.	.	H	α-helix	trans	-77.1	-36.5	179.5	-136.4	157.1	0	0	0	110.9	H225 I226 I232 L233 F304 I517 Y519	H225-L229 PolarHBondContact O-N 3.25Å; H225-L229 VanDerWaalsContact O-N 3.12Å; I226-L229 PolarHBondContact O-N 3.46Å; L229-I232 PolarHBondContact O-N 3.4Å; L229-L233 PolarHBondContact O-N 2.78Å; L229-L233 VanDerWaalsContact O-N 3.17Å; L229-F304 HydrophobicContact CB-CE2 4.37Å; L229-F304 HydrophobicContact CB-CZ 3.89Å; L229-F304 HydrophobicContact CD2-CE1 3.66Å; L229-F304 HydrophobicContact CD2-CZ 3.68Å; L229-F304 HydrophobicContact CG-CZ 4.29Å; L229-I517 HydrophobicContact CD2-CG2 4.45Å; L229-Y519 HydrophobicContact CD1-CD2 3.98Å; L229-Y519 HydrophobicContact CD1-CE2 3.96Å
230	E	62	Low	53.9	Low	17 Å²	17	73.1 Å²	73.1	8%	0.079	35%	0.348	C	S	.	.	H	α-helix	trans	-57	-53.8	167	-64.2	175.8	161.2	0	0	110.3	I226 I232 L233 D234 F304 K311	I226-E230 HydrophobicContact CG2-CG 4.39Å; I226-E230 WeakPolarHBondContact O-CG 3.5Å; I226-E230 PolarHBondContact O-N 3.1Å; E230-I232 PolarHBondContact O-N 3.32Å; E230-L233 PolarHBondContact O-N 3.45Å; E230-D234 VanDerWaalsContact C-OD2 3.28Å; E230-D234 PolarHBondContact O-N 2.67Å; E230-F304 HydrophobicContact CG-CE2 4Å; E230-F304 HydrophobicContact CG-CZ 4.26Å; E230-K311 WeakPolarHBondContact OE1-CD 3.39Å; E230-K311 WeakPolarHBondContact OE1-CE 3.49Å; E230-K311 IonicContact OE1-NZ 2.74Å; E230-K311 PolarHBondContact OE1-NZ 3.05Å; E230-K311 IonicContact OE2-NZ 3.72Å; E230-K311 PolarHBondContact OE2-NZ 3.48Å
231	D	62.6	Low	55.1	Low	63 Å²	63	66.9 Å²	66.9	34%	0.337	33%	0.326	S	S	.	.	H	α-helix	trans	-51.9	-31.2	176	-106.1	41.2	0	0	0	115.1	K227 K228 R235	K227-D231 WeakPolarHBondContact O-CB 3.44Å; K227-D231 PolarHBondContact O-N 3Å; K227-D231 VanDerWaalsContact O-N 3.13Å; K228-D231 WeakPolarHBondContact O-CB 3.31Å; D231-R235 VanDerWaalsContact O-CG 3.24Å; D231-R235 WeakPolarHBondContact O-CG 3.38Å; D231-R235 PolarHBondContact O-N 2.97Å; D231-R235 PolarHBondContact O-NE 3.46Å; D231-R235 VanDerWaalsContact O-NE 3.08Å; D231-R235 IonicContact OD2-CZ 2.89Å; D231-R235 IonicContact OD2-NH2 2.61Å; D231-R235 PolarHBondContact OD2-NH2 3.44Å
232	I	61.7	Low	55.9	Low	86 Å²	86	69.1 Å²	69.1	44%	0.441	33%	0.333	S	S	.	.	H	α-helix	trans	-78.6	-44.6	178.1	-70.8	163.5	0	0	0	110.4	K228 L229 E230 R235 F236 I517	K228-I232 WeakPolarHBondContact O-CD1 3.24Å; K228-I232 VanDerWaalsContact O-CG1 3.3Å; K228-I232 WeakPolarHBondContact O-CG1 3.34Å; K228-I232 PolarHBondContact O-N 3.41Å; L229-I232 PolarHBondContact O-N 3.4Å; E230-I232 PolarHBondContact O-N 3.32Å; I232-R235 PolarHBondContact O-N 3.48Å; I232-F236 WeakPolarHBondContact O-CB 3.39Å; I232-F236 PolarHBondContact O-N 3.09Å; I232-I517 HydrophobicContact CG2-CD1 3.8Å
233	L	62.9	Low	56.7	Low	0 Å²	0	67 Å²	67	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-62.4	-44.2	176.3	-72.1	170.8	0	0	0	111.6	L229 E230 R235 F236 C237 L291 I293 F304 L305 W308 I495	L229-L233 PolarHBondContact O-N 2.78Å; L229-L233 VanDerWaalsContact O-N 3.17Å; E230-L233 PolarHBondContact O-N 3.45Å; L233-R235 PolarHBondContact O-N 2.77Å; L233-F236 PolarHBondContact O-N 2.83Å; L233-C237 PolarHBondContact O-N 2.99Å; L233-C237 PolarHBondContact O-SG 2.94Å; L233-L291 HydrophobicContact CD2-CD2 3.45Å; L233-L291 VanDerWaalsContact CD2-CD2 3.45Å; L233-I293 HydrophobicContact CD2-CD1 4.37Å; L233-F304 HydrophobicContact CD1-CE1 3.67Å; L233-F304 HydrophobicContact CD1-CZ 3.9Å; L233-L305 HydrophobicContact CD1-CD2 4.38Å; L233-W308 HydrophobicContact CB-CD2 4.19Å; L233-W308 HydrophobicContact CB-CH2 4.17Å; L233-W308 HydrophobicContact CB-CZ2 3.64Å; L233-W308 HydrophobicContact CD1-CD2 3.81Å; L233-W308 HydrophobicContact CD1-CE3 4.05Å; L233-W308 HydrophobicContact CD1-CG 4.09Å; L233-I495 HydrophobicContact CD2-CD1 4.19Å
234	D	64.1	Low	56.7	Low	16 Å²	16	67.7 Å²	67.7	9%	0.086	32%	0.317	C	S	.	.	H	α-helix	trans	-60.5	-45.1	178.4	-61.3	-47.3	0	0	0	111.2	E230 C237 L238 W308 R312	E230-D234 VanDerWaalsContact C-OD2 3.28Å; E230-D234 PolarHBondContact O-N 2.67Å; D234-C237 PolarHBondContact O-N 3.49Å; D234-L238 VanDerWaalsContact O-CB 3.28Å; D234-L238 WeakPolarHBondContact O-CB 3.47Å; D234-L238 WeakPolarHBondContact O-CD1 3.29Å; D234-L238 WeakPolarHBondContact O-CG 3.49Å; D234-L238 PolarHBondContact O-N 3.1Å; D234-W308 PolarHBondContact OD1-NE1 3.47Å; D234-R312 IonicContact OD1-CZ 2.92Å; D234-R312 IonicContact OD1-NE 2.75Å; D234-R312 PolarHBondContact OD1-NE 3.42Å; D234-R312 IonicContact OD1-NH2 3.21Å; D234-R312 PolarHBondContact OD1-NH2 3.2Å; D234-R312 IonicContact OD2-CZ 2.82Å; D234-R312 IonicContact OD2-NE 3.02Å; D234-R312 IonicContact OD2-NH2 3.96Å; D234-R312 PolarHBondContact OD2-NH2 3.05Å
235	R	62	Low	56.3	Low	110 Å²	110	64.1 Å²	64.1	42%	0.415	31%	0.313	S	S	.	.	H	α-helix	trans	-67.2	-35.2	176.8	-72.9	178.1	-128.6	-160.3	-2.9	113.1	D231 I232 L233 S239	D231-R235 VanDerWaalsContact O-CG 3.24Å; D231-R235 WeakPolarHBondContact O-CG 3.38Å; D231-R235 PolarHBondContact O-N 2.97Å; D231-R235 PolarHBondContact O-NE 3.46Å; D231-R235 VanDerWaalsContact O-NE 3.08Å; D231-R235 IonicContact OD2-CZ 2.89Å; D231-R235 IonicContact OD2-NH2 2.61Å; D231-R235 PolarHBondContact OD2-NH2 3.44Å; I232-R235 PolarHBondContact O-N 3.48Å; L233-R235 PolarHBondContact O-N 2.77Å; R235-S239 PolarHBondContact O-N 3.33Å
236	F	64.7	Low	55.8	Low	19 Å²	19	66.9 Å²	66.9	8%	0.083	33%	0.332	C	S	.	.	H	α-helix	trans	-64.5	-45.4	174.8	-178.7	-104.8	0	0	0	110.9	I232 L233 S239 N288 L291 R493 I495	I232-F236 WeakPolarHBondContact O-CB 3.39Å; I232-F236 PolarHBondContact O-N 3.09Å; L233-F236 PolarHBondContact O-N 2.83Å; F236-S239 WeakPolarHBondContact O-CB 3.49Å; F236-S239 PolarHBondContact O-N 3.2Å; F236-S239 PolarHBondContact O-OG 2.85Å; F236-N288 WeakPolarHBondContact CE2-O 3.49Å; F236-L291 HydrophobicContact CD1-CB 4.06Å; F236-L291 HydrophobicContact CD1-CD2 4.16Å; F236-L291 HydrophobicContact CD2-CB 4.47Å; F236-L291 HydrophobicContact CE1-CB 3.65Å; F236-L291 HydrophobicContact CE2-CB 4.11Å; F236-L291 HydrophobicContact CG-CB 4.45Å; F236-L291 HydrophobicContact CG-CD2 4.34Å; F236-L291 HydrophobicContact CZ-CB 3.68Å; F236-R493 HydrophobicContact CE1-CB 3.97Å; F236-R493 HydrophobicContact CE1-CG 4.37Å; F236-R493 HydrophobicContact CZ-CB 4.35Å; F236-I495 HydrophobicContact CD1-CG1 4.31Å; F236-I495 HydrophobicContact CE1-CG1 4.06Å
237	C	62.9	Low	55	Low	10 Å²	10	70.1 Å²	70.1	7%	0.068	36%	0.359	C	S	.	.	H	α-helix	trans	-67	-45.1	177.7	-62	0	0	0	0	112.1	L233 D234 S239 A240 I436	L233-C237 PolarHBondContact O-N 2.99Å; L233-C237 PolarHBondContact O-SG 2.94Å; D234-C237 PolarHBondContact O-N 3.49Å; C237-S239 PolarHBondContact O-N 3.31Å; C237-S239 VanDerWaalsContact O-N 3.08Å; C237-A240 VanDerWaalsContact O-CB 3.28Å; C237-A240 WeakPolarHBondContact O-CB 3.38Å; C237-A240 PolarHBondContact O-N 3.4Å; C237-I436 HydrophobicContact CB-CD1 3.72Å
238	L	62.1	Low	53.9	Low	101 Å²	101	68.2 Å²	68.2	53%	0.529	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-9.5	174.9	-71.9	168.6	0	0	0	114.3	D234 S241	D234-L238 VanDerWaalsContact O-CB 3.28Å; D234-L238 WeakPolarHBondContact O-CB 3.47Å; D234-L238 WeakPolarHBondContact O-CD1 3.29Å; D234-L238 WeakPolarHBondContact O-CG 3.49Å; D234-L238 PolarHBondContact O-N 3.1Å; L238-S241 PolarHBondContact O-OG 3.26Å
239	S	62.6	Low	52.8	Low	34 Å²	34	68.9 Å²	68.9	24%	0.238	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-26.2	170.4	78.4	0	0	0	0	112.5	R235 F236 C237 S241 K242 R493	R235-S239 PolarHBondContact O-N 3.33Å; F236-S239 WeakPolarHBondContact O-CB 3.49Å; F236-S239 PolarHBondContact O-N 3.2Å; F236-S239 PolarHBondContact O-OG 2.85Å; C237-S239 PolarHBondContact O-N 3.31Å; C237-S239 VanDerWaalsContact O-N 3.08Å; S239-S241 VanDerWaalsContact C-N 3.33Å; S239-S241 PolarHBondContact O-N 3.45Å; S239-K242 PolarHBondContact O-N 2.85Å; S239-K242 VanDerWaalsContact O-N 3.12Å; S239-R493 PolarHBondContact O-NH2 3.16Å; S239-R493 PolarHBondContact OG-NE 3.22Å; S239-R493 PolarHBondContact OG-NH2 2.8Å
240	A	57.7	Low	51.8	Low	0 Å²	0	70.7 Å²	70.7	0%	0	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-64.8	-34.6	-175.1	0	0	0	0	0	113.1	C237 K242 P434 R493	C237-A240 VanDerWaalsContact O-CB 3.28Å; C237-A240 WeakPolarHBondContact O-CB 3.38Å; C237-A240 PolarHBondContact O-N 3.4Å; A240-K242 VanDerWaalsContact C-N 3.3Å; A240-K242 PolarHBondContact O-N 3.27Å; A240-P434 HydrophobicContact CB-CB 3.61Å; A240-R493 HydrophobicContact CB-CG 3.75Å
241	S	53.3	Low	50.6	Low	43 Å²	43	75.1 Å²	75.1	30%	0.301	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-78.3	-11.2	176.9	54.2	0	0	0	0	114	L238 S239	L238-S241 PolarHBondContact O-OG 3.26Å; S239-S241 VanDerWaalsContact C-N 3.33Å; S239-S241 PolarHBondContact O-N 3.45Å
242	K	52.6	Low	49.2	Very low	118 Å²	118	77.2 Å²	77.2	51%	0.513	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-98.9	-4.2	-176.7	-68.6	178.1	174.5	-175.6	0	114.3	S239 A240 E244 I248	S239-K242 PolarHBondContact O-N 2.85Å; S239-K242 VanDerWaalsContact O-N 3.12Å; A240-K242 VanDerWaalsContact C-N 3.3Å; A240-K242 PolarHBondContact O-N 3.27Å; K242-E244 PolarHBondContact O-N 2.88Å; K242-E244 VanDerWaalsContact O-N 3.08Å; K242-I248 HydrophobicContact CB-CD1 4.3Å; K242-I248 HydrophobicContact CD-CD1 3.8Å; K242-I248 HydrophobicContact CG-CD1 4.12Å
243	D	53.3	Low	47.9	Very low	62 Å²	62	77.9 Å²	77.9	33%	0.332	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-8.5	-177.7	-81	-2.5	0	0	0	114.7	R493	D243-R493 VanDerWaalsContact CG-NH2 3.29Å; D243-R493 IonicContact OD1-CZ 3.06Å; D243-R493 IonicContact OD1-NH1 2.83Å; D243-R493 IonicContact OD1-NH2 2.78Å; D243-R493 PolarHBondContact OD1-NH2 3.49Å; D243-R493 IonicContact OD2-CZ 3.7Å; D243-R493 IonicContact OD2-NH1 3.76Å; D243-R493 PolarHBondContact OD2-NH1 3.08Å; D243-R493 IonicContact OD2-NH2 2.76Å; D243-R493 PolarHBondContact OD2-NH2 3.48Å; D243-R493 VanDerWaalsContact OD2-NH2 3.14Å
244	E	41	Very low	46.6	Very low	114 Å²	114	81.8 Å²	81.8	53%	0.533	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-10	-171.8	-118.5	174.8	-116.9	0	0	115.8	K242 R491	K242-E244 PolarHBondContact O-N 2.88Å; K242-E244 VanDerWaalsContact O-N 3.08Å; E244-R491 IonicContact OE1-CZ 3.41Å; E244-R491 IonicContact OE1-NE 3.91Å; E244-R491 IonicContact OE1-NH1 3.51Å; E244-R491 PolarHBondContact OE1-NH1 3.02Å; E244-R491 IonicContact OE1-NH2 2.66Å; E244-R491 PolarHBondContact OE1-NH2 3.14Å; E244-R491 IonicContact OE2-CZ 3.69Å; E244-R491 VanDerWaalsContact OE2-CZ 3.24Å; E244-R491 IonicContact OE2-NH1 3.97Å; E244-R491 PolarHBondContact OE2-NH1 2.9Å; E244-R491 IonicContact OE2-NH2 3.68Å; E244-R491 PolarHBondContact OE2-NH2 3.5Å
245	N	35.7	Very low	45.1	Very low	132 Å²	132	87 Å²	87	71%	0.706	47%	0.474	S	S	*	.	S	Bend	trans	-116.8	125	-177.3	-76.9	-22.7	0	0	0	112
246	D	35.2	Very low	43.7	Very low	161 Å²	161	86.8 Å²	86.8	86%	0.861	48%	0.482	S	S	*	.	S	Bend	trans	-54.2	143.9	179.7	-81.5	-53.1	0	0	0	114
247	S	32.7	Very low	42	Very low	117 Å²	117	93 Å²	93	82%	0.818	52%	0.515	S	S	*	.			trans	62	93	168.9	69	0	0	0	0	117.4
248	I	32.6	Very low	40.4	Very low	106 Å²	106	99.7 Å²	99.7	54%	0.544	54%	0.54	S	S	.	.			trans	-126.4	134.7	160.3	-65.4	-178.1	0	0	0	108.2	K242	K242-I248 HydrophobicContact CB-CD1 4.3Å; K242-I248 HydrophobicContact CD-CD1 3.8Å; K242-I248 HydrophobicContact CG-CD1 4.12Å
249	P	30.1	Very low	38.8	Very low	109 Å²	109	98.5 Å²	98.5	71%	0.708	54%	0.537	S	S	*	.			trans	-64.5	156.5	-168.7	24.2	-35.4	0	0	0	114.1	V251	P249-V251 PolarHBondContact O-N 3.11Å
250	S	35.1	Very low	37	Very low	67 Å²	67	104 Å²	104	47%	0.469	56%	0.562	S	S	.	*			trans	-54.4	129	-171	44	0	0	0	0	114.2	N252 N253	S250-N252 PolarHBondContact O-N 2.92Å; S250-N253 PolarHBondContact O-N 3.46Å
251	V	36.9	Very low	35.5	Very low	109 Å²	109	112.2 Å²	112.2	66%	0.661	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	-15	174.8	175.9	0	0	0	0	113	P249 N253 I254	P249-V251 PolarHBondContact O-N 3.11Å; V251-N253 PolarHBondContact O-N 2.9Å; V251-I254 PolarHBondContact O-N 2.87Å
252	N	33.8	Very low	34.3	Very low	107 Å²	107	117.8 Å²	117.8	57%	0.572	63%	0.627	S	S	*	*	H	α-helix	trans	-51.8	-37.9	173.1	-66	-3.9	0	0	0	112.9	S250 I254 L255 D256	S250-N252 PolarHBondContact O-N 2.92Å; N252-I254 PolarHBondContact O-N 3.05Å; N252-I254 VanDerWaalsContact O-N 3.11Å; N252-L255 PolarHBondContact O-N 3.3Å; N252-L255 VanDerWaalsContact O-N 3.08Å; N252-D256 PolarHBondContact O-N 3.02Å
253	N	34.3	Very low	33.1	Very low	101 Å²	101	121.1 Å²	121.1	54%	0.54	64%	0.637	S	S	.	*	H	α-helix	trans	-63.2	-20.8	-179.6	-76.6	4.5	0	0	0	114	S250 V251 L257	S250-N253 PolarHBondContact O-N 3.46Å; V251-N253 PolarHBondContact O-N 2.9Å; N253-L257 PolarHBondContact O-N 3.31Å
254	I	35.6	Very low	31.8	Very low	81 Å²	81	123 Å²	123	42%	0.415	66%	0.655	S	S	.	*	H	α-helix	trans	-80.6	-27.4	178.3	-66.6	175.6	0	0	0	111.5	V251 N252	V251-I254 PolarHBondContact O-N 2.87Å; N252-I254 PolarHBondContact O-N 3.05Å; N252-I254 VanDerWaalsContact O-N 3.11Å
255	L	32.3	Very low	31	Very low	125 Å²	125	123.4 Å²	123.4	65%	0.654	67%	0.669	S	S	*	*	H	α-helix	trans	-85.6	-37.1	174.4	-74.5	167.1	0	0	0	111.6	N252 L257 Y258 V259	N252-L255 PolarHBondContact O-N 3.3Å; N252-L255 VanDerWaalsContact O-N 3.08Å; L255-L257 VanDerWaalsContact C-N 3.28Å; L255-L257 PolarHBondContact O-N 2.92Å; L255-Y258 PolarHBondContact O-N 3.42Å; L255-V259 WeakPolarHBondContact O-CG2 3.47Å
256	D	32.9	Very low	30.5	Very low	107 Å²	107	126.9 Å²	126.9	57%	0.572	68%	0.678	S	S	*	*	H	α-helix	trans	-65.3	-29.2	179.1	-73	-37.8	0	0	0	113.1	N252 Y258	N252-D256 PolarHBondContact O-N 3.02Å; D256-Y258 VanDerWaalsContact C-N 3.26Å; D256-Y258 PolarHBondContact O-N 3.42Å
257	L	29.4	Very low	30.1	Very low	150 Å²	150	125.8 Å²	125.8	79%	0.785	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-9.3	172.6	-85	167.4	0	0	0	114.9	N253 L255	N253-L257 PolarHBondContact O-N 3.31Å; L255-L257 VanDerWaalsContact C-N 3.28Å; L255-L257 PolarHBondContact O-N 2.92Å
258	Y	29.9	Very low	29.8	Very low	149 Å²	149	130.3 Å²	130.3	58%	0.584	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	7.9	-179.6	-94.1	-75.4	0	0	0	114.1	L255 D256	L255-Y258 PolarHBondContact O-N 3.42Å; D256-Y258 VanDerWaalsContact C-N 3.26Å; D256-Y258 PolarHBondContact O-N 3.42Å
259	V	27.5	Very low	29.4	Very low	77 Å²	77	134.4 Å²	134.4	47%	0.467	69%	0.685	S	S	.	*	S	Bend	trans	-100.8	-2.4	-170.1	166.4	0	0	0	0	114.2	L255	L255-V259 WeakPolarHBondContact O-CG2 3.47Å
260	L	25.7	Very low	29.1	Very low	148 Å²	148	134.8 Å²	134.8	78%	0.775	69%	0.69	S	S	*	*	S	Bend	trans	-132.5	93.3	-177.6	-73.1	167.6	0	0	0	112
261	E	25.8	Very low	28.8	Very low	174 Å²	174	137.9 Å²	137.9	81%	0.813	70%	0.701	S	S	*	*	S	Bend		167.9	-30.9	107.1	-89.7	-177.8	159.9	0	0	112.9
262	D	27.1	Very low	28.3	Very low	160 Å²	160	139.4 Å²	139.4	86%	0.856	70%	0.701	S	S	*	*	S	Bend	trans	-102.5	6.4	-167.7	-113.6	-6.4	0	0	0	116.7
263	W	28.9	Very low	28	Very low	187 Å²	187	141.3 Å²	141.3	71%	0.708	70%	0.7	S	S	*	*	S	Bend	trans	-118.8	10.5	-174.4	-84.5	57.9	0	0	0	114.8	L267	W263-L267 HydrophobicContact CE3-CD1 4.12Å; W263-L267 HydrophobicContact CZ3-CD1 4.33Å
264	S	25	Very low	27.7	Very low	103 Å²	103	144.4 Å²	144.4	72%	0.72	72%	0.716	S	S	*	*	S	Bend	trans	-81.3	-13.7	-170.2	55.6	0	0	0	0	116.1
265	C	24.1	Very low	27.2	Very low	122 Å²	122	149.8 Å²	149.8	82%	0.824	73%	0.731	S	S	*	*	S	Bend	trans	-113.6	-0.6	-169.6	-67.3	0	0	0	0	117.3
266	K	26.2	Very low	26.9	Very low	205 Å²	205	151.4 Å²	151.4	89%	0.891	74%	0.741	S	S	*	*	S	Bend	trans	-124.3	3.7	-179.5	-79.7	-171.6	176.2	179.9	0	116.9
267	L	25.7	Very low	26.7	Very low	137 Å²	137	153.4 Å²	153.4	72%	0.717	75%	0.75	S	S	*	*			trans	-113.2	85.5	171.4	-83	163.6	0	0	0	111.3	W263 R269	W263-L267 HydrophobicContact CE3-CD1 4.12Å; W263-L267 HydrophobicContact CZ3-CD1 4.33Å; L267-R269 VanDerWaalsContact C-N 3.32Å; L267-R269 PolarHBondContact O-N 3.49Å
268	K	26.8	Very low	26.7	Very low	213 Å²	213	151 Å²	151	93%	0.926	75%	0.745	S	S	*	*			trans	-74.6	87.5	166.7	-99.1	-174.3	176.7	176.9	0	110.3
269	R	24.7	Very low	26.5	Very low	191 Å²	191	150 Å²	150	72%	0.721	76%	0.755	S	S	*	*			trans	35	113.6	146.5	-68.5	175.6	163.7	147.4	-4.5	118.5	L267 Q272	L267-R269 VanDerWaalsContact C-N 3.32Å; L267-R269 PolarHBondContact O-N 3.49Å; R269-Q272 VanDerWaalsContact CZ-OE1 3.28Å
270	S	24.5	Very low	26.5	Very low	118 Å²	118	155.6 Å²	155.6	83%	0.825	77%	0.773	S	S	*	*	S	Bend		-118	133.1	116.7	48	0	0	0	0	109.4
271	D	28.3	Very low	26.5	Very low	131 Å²	131	157.7 Å²	157.7	70%	0.701	78%	0.776	S	S	*	*			trans	45.9	90.2	173.8	-72.2	15.3	0	0	0	121.3	R273 K618	D271-R273 PolarHBondContact O-N 3.06Å; D271-K618 IonicContact OD2-NZ 2.65Å
272	Q	25.5	Very low	26.5	Very low	141 Å²	141	157 Å²	157	66%	0.659	77%	0.773	S	S	*	*			trans	-61.9	108.8	151.5	-63.6	172.1	-87.6	0	0	110.9	R269	R269-Q272 VanDerWaalsContact CZ-OE1 3.28Å
273	R	28.8	Very low	26.5	Very low	147 Å²	147	158.2 Å²	158.2	56%	0.555	77%	0.773	S	S	*	*			trans	-165	21.3	157	-111	158.3	-158.2	-153.8	11.8	117.7	D271 R275 K613	D271-R273 PolarHBondContact O-N 3.06Å; R273-R275 PolarHBondContact O-N 3.35Å; R273-K613 PolarHBondContact O-NZ 3.4Å
274	L	27.2	Very low	26.7	Very low	167 Å²	167	154.5 Å²	154.5	87%	0.874	77%	0.767	S	S	*	*			trans	-92.7	72.3	168.8	-78.2	171.4	0	0	0	112
275	R	24.8	Very low	27.1	Very low	193 Å²	193	155.5 Å²	155.5	73%	0.728	77%	0.774	S	S	*	*			trans	-144	147.7	157	-74.4	-162.3	177.6	-178.8	0.1	109.8	R273	R273-R275 PolarHBondContact O-N 3.35Å
276	N	25.8	Very low	27.8	Very low	160 Å²	160	152.2 Å²	152.2	86%	0.856	75%	0.753	S	S	*	*			trans	69.2	74.8	177.8	-57.3	4.1	0	0	0	116.1
277	I	29.9	Very low	28.8	Very low	149 Å²	149	149.2 Å²	149.2	76%	0.764	74%	0.736	S	S	*	*			trans	-79.6	121.5	147.8	-66.1	174.3	0	0	0	106.8
278	S	27.9	Very low	30.1	Very low	98 Å²	98	147 Å²	147	69%	0.685	73%	0.725	S	S	*	*			trans	-76.2	151	-178.8	47.8	0	0	0	0	112.8	K280	S278-K280 VanDerWaalsContact C-N 3.31Å; S278-K280 PolarHBondContact O-N 2.97Å
279	T	27.5	Very low	31.7	Very low	130 Å²	130	139.3 Å²	139.3	80%	0.798	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	54.2	-164.5	43	0	0	0	0	115
280	K	27.2	Very low	33.5	Very low	194 Å²	194	131 Å²	131	84%	0.843	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.1	7.3	178.7	-79	-163.9	173	-173.2	0	117.9	S278	S278-K280 VanDerWaalsContact C-N 3.31Å; S278-K280 PolarHBondContact O-N 2.97Å
281	F	25.8	Very low	35.4	Very low	191 Å²	191	125.6 Å²	125.6	84%	0.838	62%	0.621	S	S	*	*			trans	-109.8	72.1	171.9	-83.7	-82.4	0	0	0	111
282	Q	25.8	Very low	37.1	Very low	159 Å²	159	119.4 Å²	119.4	74%	0.743	59%	0.588	S	S	*	*			trans	-117.8	20	-168	-148.4	169.9	0.2	0	0	114.9
283	H	27.2	Very low	39.1	Very low	187 Å²	187	112.9 Å²	112.9	87%	0.866	56%	0.558	S	S	*	*	S	Bend	trans	-133.7	18.3	-173.9	-88.6	-61.2	0	0	0	116.9
284	D	32.9	Very low	40.6	Very low	108 Å²	108	105.9 Å²	105.9	58%	0.578	53%	0.531	S	S	*	.			trans	-142	57.8	179.5	-134.2	14.9	0	0	0	112.1	S286 R287	D284-S286 PolarHBondContact O-N 3.33Å; D284-S286 VanDerWaalsContact O-N 3.16Å; D284-R287 IonicContact OD2-CZ 3.53Å; D284-R287 IonicContact OD2-NE 3.45Å; D284-R287 IonicContact OD2-NH2 2.67Å; D284-R287 PolarHBondContact OD2-NH2 2.9Å
285	S	32.6	Very low	42.1	Very low	124 Å²	124	98.1 Å²	98.1	87%	0.867	49%	0.492	S	S	*	.			trans	-87.3	48.5	-166.1	52.7	0	0	0	0	115
286	S	39.8	Very low	43.4	Very low	53 Å²	53	96.1 Å²	96.1	37%	0.371	49%	0.491	S	S	.	.			trans	-123.3	3.3	-167.7	59.7	0	0	0	0	116.9	D284 R289	D284-S286 PolarHBondContact O-N 3.33Å; D284-S286 VanDerWaalsContact O-N 3.16Å; S286-R289 PolarHBondContact O-NE 3.03Å
287	R	46.5	Very low	44.2	Very low	143 Å²	143	92.1 Å²	92.1	54%	0.54	47%	0.474	S	S	.	.			trans	-100	4.6	-153.7	-59.5	-170.3	-175	-163.4	1.8	119	D284 L513	D284-R287 IonicContact OD2-CZ 3.53Å; D284-R287 IonicContact OD2-NE 3.45Å; D284-R287 IonicContact OD2-NH2 2.67Å; D284-R287 PolarHBondContact OD2-NH2 2.9Å; R287-L513 HydrophobicContact CB-CD2 4.25Å
288	N	53.2	Low	45	Very low	90 Å²	90	87.3 Å²	87.3	48%	0.481	46%	0.46	S	S	.	.			trans	-106	68.5	-179.5	-71.4	7.9	0	0	0	112.7	F236 N515	F236-N288 WeakPolarHBondContact CE2-O 3.49Å; N288-N515 PolarHBondContact ND2-ND2 3.4Å; N288-N515 VanDerWaalsContact ND2-ND2 3.19Å
289	R	60.6	Low	45.5	Very low	52 Å²	52	87 Å²	87	20%	0.196	45%	0.454	C	S	.	.			trans	-101.4	-13.8	-172.3	-65.8	-174.7	-179.5	170	1.6	115.7	S286 I488 F494	S286-R289 PolarHBondContact O-NE 3.03Å; R289-I488 HydrophobicContact CB-CB 4.48Å; R289-I488 HydrophobicContact CB-CD1 3.84Å; R289-I488 HydrophobicContact CB-CG2 4.27Å; R289-I488 PolarHBondContact NH1-O 2.9Å; R289-F494 PolarHBondContact O-N 3.33Å; R289-F494 VanDerWaalsContact O-N 3.08Å
290	I	62.2	Low	46.3	Very low	15 Å²	15	83 Å²	83	8%	0.077	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	137.7	177.9	-49	176.9	0	0	0	110.3	I488 F494 L496 L513 V514 N515	I290-I488 HydrophobicContact CD1-CD1 3.86Å; I290-I488 HydrophobicContact CG1-CD1 3.56Å; I290-F494 WeakPolarHBondContact CA-O 3.27Å; I290-F494 HydrophobicContact CB-CB 4.48Å; I290-F494 HydrophobicContact CG1-CB 4.3Å; I290-F494 HydrophobicContact CG2-CB 4.14Å; I290-L496 HydrophobicContact CG2-CD1 3.77Å; I290-L496 HydrophobicContact CG2-CG 4.11Å; I290-L513 PolarHBondContact N-O 3.15Å; I290-V514 HydrophobicContact CB-CG2 4.04Å; I290-V514 HydrophobicContact CD1-CG2 4.04Å; I290-V514 HydrophobicContact CG2-CG1 4.35Å; I290-V514 HydrophobicContact CG2-CG2 4.14Å; I290-N515 PolarHBondContact O-N 3.48Å
291	L	64	Low	47.8	Very low	6 Å²	6	74.5 Å²	74.5	3%	0.031	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	130.6	169.9	-171.3	73.2	0	0	0	110.2	L233 F236 F494 I495 L496 N515 I517	L233-L291 HydrophobicContact CD2-CD2 3.45Å; L233-L291 VanDerWaalsContact CD2-CD2 3.45Å; F236-L291 HydrophobicContact CD1-CB 4.06Å; F236-L291 HydrophobicContact CD1-CD2 4.16Å; F236-L291 HydrophobicContact CD2-CB 4.47Å; F236-L291 HydrophobicContact CE1-CB 3.65Å; F236-L291 HydrophobicContact CE2-CB 4.11Å; F236-L291 HydrophobicContact CG-CB 4.45Å; F236-L291 HydrophobicContact CG-CD2 4.34Å; F236-L291 HydrophobicContact CZ-CB 3.68Å; L291-F494 PolarHBondContact N-O 3.03Å; L291-I495 HydrophobicContact CB-CG1 4.49Å; L291-I495 CarbonylContact O-C 3.59Å; L291-I495 WeakPolarHBondContact O-CA 3.35Å; L291-L496 PolarHBondContact O-N 3.22Å; L291-N515 CarbonylContact C-O 3.6Å; L291-N515 WeakPolarHBondContact CA-O 3.4Å; L291-N515 HydrophobicContact CD1-CB 3.85Å; L291-I517 HydrophobicContact CD1-CD1 3.94Å; L291-I517 HydrophobicContact CD1-CG1 4.18Å; L291-I517 HydrophobicContact CD2-CD1 4.24Å; L291-I517 HydrophobicContact CG-CD1 4.42Å
292	L	64.6	Low	49.1	Very low	0 Å²	0	67.5 Å²	67.5	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	128.6	178.2	180	68.2	0	0	0	110.6	L496 C498 N505 L508 V514 N515 V516 I517	L292-L496 CarbonylContact C-O 3.14Å; L292-L496 WeakPolarHBondContact CA-O 3.49Å; L292-L496 HydrophobicContact CD1-CB 3.9Å; L292-C498 HydrophobicContact CD1-CB 4.18Å; L292-N505 WeakPolarHBondContact CD2-OD1 3.46Å; L292-L508 HydrophobicContact CD1-CD1 3.99Å; L292-L508 HydrophobicContact CD2-CB 3.76Å; L292-L508 HydrophobicContact CD2-CD1 4.29Å; L292-V514 HydrophobicContact CB-CG1 3.67Å; L292-V514 HydrophobicContact CD2-CG1 4.43Å; L292-N515 PolarHBondContact N-O 3.08Å; L292-V516 HydrophobicContact CB-CG2 4.32Å; L292-V516 HydrophobicContact CD2-CG1 4.33Å; L292-V516 HydrophobicContact CD2-CG2 4.16Å; L292-V516 WeakPolarHBondContact O-CA 3.38Å; L292-I517 PolarHBondContact O-N 2.92Å
293	I	66.3	Low	50.5	Low	4 Å²	4	68.3 Å²	68.3	2%	0.021	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	109.7	176.3	-53.6	176.4	0	0	0	109.1	L233 L305 I495 L496 T497 C498	L233-I293 HydrophobicContact CD2-CD1 4.37Å; I293-L305 HydrophobicContact CD1-CD2 4.12Å; I293-I495 HydrophobicContact CD1-CG2 4.11Å; I293-L496 PolarHBondContact N-O 3.04Å; I293-T497 HydrophobicContact CB-CG2 4.49Å; I293-T497 WeakPolarHBondContact O-CA 3.34Å; I293-C498 PolarHBondContact O-N 3.22Å
294	S	60	Low	52.1	Low	0 Å²	0	60 Å²	60	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	154.8	-176.5	63.5	0	0	0	0	112.3	C498 N505 I517 Y519	S294-C498 WeakPolarHBondContact CA-O 3.27Å; S294-N505 WeakPolarHBondContact CB-OD1 3.43Å; S294-I517 PolarHBondContact N-O 3.31Å; S294-I517 PolarHBondContact OG-O 2.99Å; S294-Y519 WeakPolarHBondContact O-CB 3.5Å; S294-Y519 PolarHBondContact O-N 3.31Å
295	G	58.9	Low	53.6	Low	5 Å²	5	55 Å²	55	5%	0.052	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.5	-175.1	-176.6	0	0	0	0	0	111.5	K301 S499 S500	G295-K301 VanDerWaalsContact C-NZ 3.34Å; G295-K301 PolarHBondContact O-NZ 2.87Å; G295-S499 CarbonylContact O-C 3.58Å; G295-S499 WeakPolarHBondContact O-CA 3.27Å; G295-S500 PolarHBondContact O-N 2.92Å
296	Q	52.3	Low	54.9	Low	151 Å²	151	51.2 Å²	51.2	71%	0.706	28%	0.277	S	S	*	.			trans	-63.7	149.3	177.3	-87.3	-176.2	-32.8	0	0	113.2	K301	Q296-K301 WeakPolarHBondContact O-CE 3.15Å; Q296-K301 PolarHBondContact O-NZ 2.94Å
297	P	44.2	Very low	55.9	Low	76 Å²	76	51.1 Å²	51.1	49%	0.494	28%	0.277	S	S	.	.	S	Bend	trans	-68.8	130.7	171.1	30	-33.1	0	0	0	109.5
298	G	45.9	Very low	56.9	Low	47 Å²	47	44.8 Å²	44.8	49%	0.485	25%	0.253	S	S	.	.	S	Bend	trans	162.2	157.7	-179	0	0	0	0	0	114.3	G300 K301	G298-G300 PolarHBondContact O-N 3.44Å; G298-K301 PolarHBondContact O-N 3.29Å
299	V	37.2	Very low	57.3	Low	92 Å²	92	40.9 Å²	40.9	56%	0.558	23%	0.232	S	C	*	.	H	α-helix	trans	-50.2	-20.9	-171.7	-174	0	0	0	0	114.4	R303	V299-R303 HydrophobicContact CG1-CG 3.88Å; V299-R303 WeakPolarHBondContact O-CB 3.42Å; V299-R303 VanDerWaalsContact O-CG 3.25Å; V299-R303 WeakPolarHBondContact O-CG 3.38Å; V299-R303 PolarHBondContact O-N 2.96Å
300	G	46.3	Very low	57.2	Low	45 Å²	45	42.2 Å²	42.2	46%	0.464	24%	0.243	S	C	.	.	H	α-helix	trans	-64.7	-38.7	178.6	0	0	0	0	0	115.3	G298 F304	G298-G300 PolarHBondContact O-N 3.44Å; G300-F304 VanDerWaalsContact O-CB 3.31Å; G300-F304 WeakPolarHBondContact O-CB 3.01Å; G300-F304 PolarHBondContact O-N 3.09Å
301	K	57.6	Low	57.2	Low	17 Å²	17	46.3 Å²	46.3	7%	0.074	26%	0.26	C	S	.	.	H	α-helix	trans	-70.6	-53	179.7	-69.2	-175.3	-166.5	159	0	111.3	G295 Q296 G298 R303 F304 L305 C498	G295-K301 VanDerWaalsContact C-NZ 3.34Å; G295-K301 PolarHBondContact O-NZ 2.87Å; Q296-K301 WeakPolarHBondContact O-CE 3.15Å; Q296-K301 PolarHBondContact O-NZ 2.94Å; G298-K301 PolarHBondContact O-N 3.29Å; K301-R303 PolarHBondContact O-N 3.35Å; K301-F304 WeakPolarHBondContact O-CB 3.48Å; K301-F304 PolarHBondContact O-N 3.41Å; K301-L305 PolarHBondContact O-N 3.41Å; K301-C498 PolarHBondContact NZ-O 2.93Å
302	T	54.2	Low	56.9	Low	43 Å²	43	49.8 Å²	49.8	26%	0.264	27%	0.273	S	S	.	.	H	α-helix	trans	-53.8	-53.2	175.2	-46.2	0	0	0	0	109.2	F304 L305 T306 D440	T302-F304 VanDerWaalsContact C-N 3.31Å; T302-F304 PolarHBondContact O-N 3.19Å; T302-L305 CarbonylContact O-C 3.59Å; T302-L305 PolarHBondContact O-N 2.88Å; T302-L305 VanDerWaalsContact O-N 3.09Å; T302-T306 PolarHBondContact O-N 3.5Å; T302-T306 PolarHBondContact O-OG1 3.32Å; T302-D440 WeakPolarHBondContact CA-OD2 3.45Å; T302-D440 VanDerWaalsContact CB-OD2 3.24Å; T302-D440 WeakPolarHBondContact CB-OD2 3.42Å; T302-D440 VanDerWaalsContact CG2-OD2 3.28Å; T302-D440 WeakPolarHBondContact CG2-OD2 3.25Å; T302-D440 PolarHBondContact OG1-OD2 3.43Å
303	R	53.5	Low	56.2	Low	177 Å²	177	54 Å²	54	67%	0.668	29%	0.291	S	S	*	.	H	α-helix	trans	-58.3	-35.2	175.9	-79.8	-176.7	-179.1	166.2	3.3	114.3	V299 K301 S307	V299-R303 HydrophobicContact CG1-CG 3.88Å; V299-R303 WeakPolarHBondContact O-CB 3.42Å; V299-R303 VanDerWaalsContact O-CG 3.25Å; V299-R303 WeakPolarHBondContact O-CG 3.38Å; V299-R303 PolarHBondContact O-N 2.96Å; K301-R303 PolarHBondContact O-N 3.35Å; R303-S307 WeakPolarHBondContact O-CA 3.26Å; R303-S307 WeakPolarHBondContact O-CB 3.37Å; R303-S307 PolarHBondContact O-N 3.31Å
304	F	62.5	Low	55.2	Low	13 Å²	13	58.6 Å²	58.6	6%	0.057	32%	0.323	C	S	.	.	H	α-helix	trans	-67.4	-45	175.1	167.9	-100.4	0	0	0	110.9	I226 L229 E230 L233 G300 K301 T302 S307 W308 Y519	I226-F304 HydrophobicContact CG2-CD2 4.29Å; I226-F304 HydrophobicContact CG2-CE2 4.01Å; L229-F304 HydrophobicContact CB-CE2 4.37Å; L229-F304 HydrophobicContact CB-CZ 3.89Å; L229-F304 HydrophobicContact CD2-CE1 3.66Å; L229-F304 HydrophobicContact CD2-CZ 3.68Å; L229-F304 HydrophobicContact CG-CZ 4.29Å; E230-F304 HydrophobicContact CG-CE2 4Å; E230-F304 HydrophobicContact CG-CZ 4.26Å; L233-F304 HydrophobicContact CD1-CE1 3.67Å; L233-F304 HydrophobicContact CD1-CZ 3.9Å; G300-F304 VanDerWaalsContact O-CB 3.31Å; G300-F304 WeakPolarHBondContact O-CB 3.01Å; G300-F304 PolarHBondContact O-N 3.09Å; K301-F304 WeakPolarHBondContact O-CB 3.48Å; K301-F304 PolarHBondContact O-N 3.41Å; T302-F304 VanDerWaalsContact C-N 3.31Å; T302-F304 PolarHBondContact O-N 3.19Å; F304-S307 PolarHBondContact O-N 2.93Å; F304-W308 WeakPolarHBondContact O-CB 3.11Å; F304-W308 PolarHBondContact O-N 2.87Å; F304-Y519 HydrophobicContact CD1-CE2 4.38Å; F304-Y519 HydrophobicContact CG-CE2 4.35Å
305	L	63	Low	54.5	Low	1 Å²	1	63 Å²	63	1%	0.005	35%	0.347	C	S	.	.	H	α-helix	trans	-63.8	-49	174.2	-73.8	172.2	0	0	0	111.6	L233 I293 K301 T302 S307 W308 L309 T497	L233-L305 HydrophobicContact CD1-CD2 4.38Å; I293-L305 HydrophobicContact CD1-CD2 4.12Å; K301-L305 PolarHBondContact O-N 3.41Å; T302-L305 CarbonylContact O-C 3.59Å; T302-L305 PolarHBondContact O-N 2.88Å; T302-L305 VanDerWaalsContact O-N 3.09Å; L305-S307 VanDerWaalsContact C-N 3.25Å; L305-S307 PolarHBondContact O-N 3.47Å; L305-W308 HydrophobicContact CD2-CE3 4.44Å; L305-W308 PolarHBondContact O-N 2.97Å; L305-L309 WeakPolarHBondContact O-CB 3.28Å; L305-L309 VanDerWaalsContact O-CG 3.25Å; L305-L309 WeakPolarHBondContact O-CG 3.41Å; L305-L309 PolarHBondContact O-N 3.04Å; L305-T497 HydrophobicContact CD1-CG2 3.56Å
306	T	59.8	Low	53.7	Low	46 Å²	46	64.6 Å²	64.6	28%	0.282	36%	0.363	S	S	.	.	H	α-helix	trans	-60.1	-35.9	174.4	1.6	0	0	0	0	111.6	T302 N310	T302-T306 PolarHBondContact O-N 3.5Å; T302-T306 PolarHBondContact O-OG1 3.32Å; T306-N310 WeakPolarHBondContact O-CB 3.39Å; T306-N310 PolarHBondContact O-N 2.82Å; T306-N310 PolarHBondContact O-ND2 2.9Å
307	S	61.2	Low	53.1	Low	51 Å²	51	59.8 Å²	59.8	36%	0.357	34%	0.34	S	S	.	.	H	α-helix	trans	-68.8	-40.6	175.7	176.6	0	0	0	0	112.6	R303 F304 L305 K311	R303-S307 WeakPolarHBondContact O-CA 3.26Å; R303-S307 WeakPolarHBondContact O-CB 3.37Å; R303-S307 PolarHBondContact O-N 3.31Å; F304-S307 PolarHBondContact O-N 2.93Å; L305-S307 VanDerWaalsContact C-N 3.25Å; L305-S307 PolarHBondContact O-N 3.47Å; S307-K311 WeakPolarHBondContact O-CB 3.47Å; S307-K311 WeakPolarHBondContact O-CG 3.45Å; S307-K311 PolarHBondContact O-N 3.41Å
308	W	68.3	Low	52.7	Low	9 Å²	9	61.1 Å²	61.1	3%	0.034	35%	0.347	C	S	.	.	H	α-helix	trans	-67.1	-46.6	176.7	171.8	68.2	0	0	0	110.6	L233 D234 F304 L305 N310 K311 R312 I438	L233-W308 HydrophobicContact CB-CD2 4.19Å; L233-W308 HydrophobicContact CB-CH2 4.17Å; L233-W308 HydrophobicContact CB-CZ2 3.64Å; L233-W308 HydrophobicContact CD1-CD2 3.81Å; L233-W308 HydrophobicContact CD1-CE3 4.05Å; L233-W308 HydrophobicContact CD1-CG 4.09Å; D234-W308 PolarHBondContact OD1-NE1 3.47Å; F304-W308 WeakPolarHBondContact O-CB 3.11Å; F304-W308 PolarHBondContact O-N 2.87Å; L305-W308 HydrophobicContact CD2-CE3 4.44Å; L305-W308 PolarHBondContact O-N 2.97Å; W308-N310 PolarHBondContact O-N 3.4Å; W308-K311 PolarHBondContact O-N 3.1Å; W308-R312 PolarHBondContact O-N 2.76Å; W308-I438 HydrophobicContact CZ3-CD1 4.42Å
309	L	61.1	Low	52.2	Low	8 Å²	8	61.5 Å²	61.5	4%	0.042	34%	0.336	C	S	.	.	H	α-helix	trans	-58.9	-46.9	172.6	-65.7	-178.1	0	0	0	111.6	L305 K311 R312 K313 F319 I349 F351 I438	L305-L309 WeakPolarHBondContact O-CB 3.28Å; L305-L309 VanDerWaalsContact O-CG 3.25Å; L305-L309 WeakPolarHBondContact O-CG 3.41Å; L305-L309 PolarHBondContact O-N 3.04Å; L309-K311 VanDerWaalsContact C-N 3.33Å; L309-K311 PolarHBondContact O-N 3.35Å; L309-R312 PolarHBondContact O-N 2.7Å; L309-R312 VanDerWaalsContact O-N 3.15Å; L309-K313 PolarHBondContact O-N 2.94Å; L309-F319 HydrophobicContact CB-CE2 4.19Å; L309-F319 HydrophobicContact CB-CZ 4.37Å; L309-F319 HydrophobicContact CD1-CE1 4.23Å; L309-F319 HydrophobicContact CD1-CE2 4.49Å; L309-F319 HydrophobicContact CD1-CZ 3.85Å; L309-F319 HydrophobicContact CD2-CE2 3.76Å; L309-F319 HydrophobicContact CD2-CZ 3.53Å; L309-F319 HydrophobicContact CG-CE2 4.35Å; L309-F319 HydrophobicContact CG-CZ 4.11Å; L309-I349 HydrophobicContact CD2-CD1 4.45Å; L309-F351 HydrophobicContact CD1-CD2 3.74Å; L309-F351 HydrophobicContact CD1-CE2 3.85Å; L309-F351 HydrophobicContact CD1-CG 4.28Å; L309-F351 HydrophobicContact CD1-CZ 4.39Å; L309-I438 HydrophobicContact CD1-CD1 4.33Å; L309-I438 HydrophobicContact CD2-CD1 4.14Å
310	N	58.5	Low	52.1	Low	81 Å²	81	64.2 Å²	64.2	43%	0.433	34%	0.344	S	S	.	.	H	α-helix	trans	-65.1	-32.1	178	-76.4	-31.4	0	0	0	113.2	T306 W308 K313	T306-N310 WeakPolarHBondContact O-CB 3.39Å; T306-N310 PolarHBondContact O-N 2.82Å; T306-N310 PolarHBondContact O-ND2 2.9Å; W308-N310 PolarHBondContact O-N 3.4Å; N310-K313 WeakPolarHBondContact O-CB 2.98Å; N310-K313 WeakPolarHBondContact OD1-CE 3.39Å; N310-K313 PolarHBondContact OD1-NZ 3.35Å
311	K	61.3	Low	51.4	Low	101 Å²	101	68.8 Å²	68.8	44%	0.439	36%	0.358	S	S	.	.	H	α-helix	trans	-67.8	-39.8	171.3	-82.3	173.9	172.5	177.4	0	111.9	E230 S307 W308 L309 K313 S314	E230-K311 WeakPolarHBondContact OE1-CD 3.39Å; E230-K311 WeakPolarHBondContact OE1-CE 3.49Å; E230-K311 IonicContact OE1-NZ 2.74Å; E230-K311 PolarHBondContact OE1-NZ 3.05Å; E230-K311 IonicContact OE2-NZ 3.72Å; E230-K311 PolarHBondContact OE2-NZ 3.48Å; S307-K311 WeakPolarHBondContact O-CB 3.47Å; S307-K311 WeakPolarHBondContact O-CG 3.45Å; S307-K311 PolarHBondContact O-N 3.41Å; W308-K311 PolarHBondContact O-N 3.1Å; L309-K311 VanDerWaalsContact C-N 3.33Å; L309-K311 PolarHBondContact O-N 3.35Å; K311-K313 VanDerWaalsContact C-N 3.31Å; K311-K313 PolarHBondContact O-N 3.49Å; K311-S314 PolarHBondContact O-OG 3.18Å
312	R	57.8	Low	49.9	Very low	79 Å²	79	74.8 Å²	74.8	30%	0.298	39%	0.391	S	S	.	.	H	α-helix	trans	-78.7	-10.4	-179.9	-67.8	-61.9	-174.8	-163.9	-2.7	113.9	D234 W308 L309 S314 D315 F317	D234-R312 IonicContact OD1-CZ 2.92Å; D234-R312 IonicContact OD1-NE 2.75Å; D234-R312 PolarHBondContact OD1-NE 3.42Å; D234-R312 IonicContact OD1-NH2 3.21Å; D234-R312 PolarHBondContact OD1-NH2 3.2Å; D234-R312 IonicContact OD2-CZ 2.82Å; D234-R312 IonicContact OD2-NE 3.02Å; D234-R312 IonicContact OD2-NH2 3.96Å; D234-R312 PolarHBondContact OD2-NH2 3.05Å; W308-R312 PolarHBondContact O-N 2.76Å; L309-R312 PolarHBondContact O-N 2.7Å; L309-R312 VanDerWaalsContact O-N 3.15Å; R312-S314 PolarHBondContact O-N 3.27Å; R312-D315 WeakPolarHBondContact CD-OD2 3.49Å; R312-D315 IonicContact CZ-OD2 3.24Å; R312-D315 IonicContact NE-OD2 3.03Å; R312-D315 IonicContact NH1-OD2 3.24Å; R312-D315 PolarHBondContact NH1-OD2 3.43Å; R312-D315 PolarHBondContact O-N 2.97Å; R312-F317 HydrophobicContact CB-CD2 3.76Å; R312-F317 HydrophobicContact CB-CE2 4.26Å; R312-F317 HydrophobicContact CB-CG 4.41Å; R312-F317 PolarHBondContact O-N 3.25Å
313	K	50.6	Low	48.8	Very low	89 Å²	89	81 Å²	81	39%	0.387	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-56.1	-30.2	166.6	-74.1	-179.9	176.8	173.1	0	113.4	L309 N310 K311 D315 F319	L309-K313 PolarHBondContact O-N 2.94Å; N310-K313 WeakPolarHBondContact O-CB 2.98Å; N310-K313 WeakPolarHBondContact OD1-CE 3.39Å; N310-K313 PolarHBondContact OD1-NZ 3.35Å; K311-K313 VanDerWaalsContact C-N 3.31Å; K311-K313 PolarHBondContact O-N 3.49Å; K313-D315 VanDerWaalsContact C-N 3.3Å; K313-F319 HydrophobicContact CG-CD2 4.48Å
314	S	46	Very low	47.5	Very low	99 Å²	99	79.7 Å²	79.7	69%	0.692	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-75.5	-17.9	176.7	59.6	0	0	0	0	114.1	K311 R312	K311-S314 PolarHBondContact O-OG 3.18Å; R312-S314 PolarHBondContact O-N 3.27Å
315	D	44.5	Very low	45.7	Very low	92 Å²	92	88 Å²	88	49%	0.492	46%	0.457	S	S	.	.	G	3₁₀ helix	trans	-103.8	8.6	-168.8	-59	-10.1	0	0	0	112.8	R312 K313	R312-D315 WeakPolarHBondContact CD-OD2 3.49Å; R312-D315 IonicContact CZ-OD2 3.24Å; R312-D315 IonicContact NE-OD2 3.03Å; R312-D315 IonicContact NH1-OD2 3.24Å; R312-D315 PolarHBondContact NH1-OD2 3.43Å; R312-D315 PolarHBondContact O-N 2.97Å; K313-D315 VanDerWaalsContact C-N 3.3Å
316	G	41.5	Very low	43.9	Very low	39 Å²	39	94.5 Å²	94.5	40%	0.402	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	106.8	8.7	175.9	0	0	0	0	0	116.3	T318	G316-T318 PolarHBondContact O-N 2.82Å
317	F	39.4	Very low	42.2	Very low	50 Å²	50	99.6 Å²	99.6	22%	0.219	52%	0.515	C	S	.	.			trans	-84.5	104.6	171.4	-71.2	-89.7	0	0	0	111.3	R312 F319 I349	R312-F317 HydrophobicContact CB-CD2 3.76Å; R312-F317 HydrophobicContact CB-CE2 4.26Å; R312-F317 HydrophobicContact CB-CG 4.41Å; R312-F317 PolarHBondContact O-N 3.25Å; F317-F319 PolarHBondContact O-N 3.09Å; F317-F319 VanDerWaalsContact O-N 3.16Å; F317-I349 HydrophobicContact CD1-CD1 3.49Å; F317-I349 VanDerWaalsContact CD1-CD1 3.49Å; F317-I349 HydrophobicContact CD1-CG1 4.34Å; F317-I349 HydrophobicContact CE1-CD1 3.97Å; F317-I349 HydrophobicContact CG-CD1 4.34Å
318	T	36.9	Very low	40.4	Very low	105 Å²	105	104.4 Å²	104.4	64%	0.644	53%	0.532	S	S	*	.			trans	-80.4	89.1	-178.1	41.8	0	0	0	0	112.8	G316 M320	G316-T318 PolarHBondContact O-N 2.82Å; T318-M320 PolarHBondContact O-N 3.03Å
319	F	35.3	Very low	38.2	Very low	54 Å²	54	111.6 Å²	111.6	24%	0.237	57%	0.57	C	S	.	*			trans	-81.6	107.9	166.3	-82.3	-85.5	0	0	0	111.9	L309 K313 F317 N321 I349 F351	L309-F319 HydrophobicContact CB-CE2 4.19Å; L309-F319 HydrophobicContact CB-CZ 4.37Å; L309-F319 HydrophobicContact CD1-CE1 4.23Å; L309-F319 HydrophobicContact CD1-CE2 4.49Å; L309-F319 HydrophobicContact CD1-CZ 3.85Å; L309-F319 HydrophobicContact CD2-CE2 3.76Å; L309-F319 HydrophobicContact CD2-CZ 3.53Å; L309-F319 HydrophobicContact CG-CE2 4.35Å; L309-F319 HydrophobicContact CG-CZ 4.11Å; K313-F319 HydrophobicContact CG-CD2 4.48Å; F317-F319 PolarHBondContact O-N 3.09Å; F317-F319 VanDerWaalsContact O-N 3.16Å; F319-N321 PolarHBondContact O-N 3.33Å; F319-N321 VanDerWaalsContact O-N 3.1Å; F319-I349 HydrophobicContact CE1-CB 3.91Å; F319-I349 HydrophobicContact CE1-CG2 3.86Å; F319-I349 HydrophobicContact CE2-CB 4.34Å; F319-I349 HydrophobicContact CE2-CD1 3.64Å; F319-I349 HydrophobicContact CZ-CB 3.55Å; F319-I349 HydrophobicContact CZ-CD1 3.57Å; F319-I349 HydrophobicContact CZ-CG1 4.13Å; F319-I349 HydrophobicContact CZ-CG2 3.53Å; F319-F351 HydrophobicContact CE1-CB 4.2Å
320	M	34	Very low	36.5	Very low	150 Å²	150	117.3 Å²	117.3	74%	0.739	61%	0.606	S	S	*	*			trans	-76.8	85.7	166.5	-83.3	-73.1	-158.1	0	0	110.8	T318	T318-M320 PolarHBondContact O-N 3.03Å
321	N	31.5	Very low	34.8	Very low	141 Å²	141	119.7 Å²	119.7	75%	0.754	62%	0.623	S	S	*	*			trans	-161.5	90.5	153.6	-108.2	-9.4	0	0	0	110.4	F319	F319-N321 PolarHBondContact O-N 3.33Å; F319-N321 VanDerWaalsContact O-N 3.1Å
322	D	27	Very low	33.1	Very low	142 Å²	142	122 Å²	122	76%	0.759	64%	0.639	S	S	*	*			trans	-136.1	140.7	157.9	-103.1	-45.2	0	0	0	108.5
323	H	30.8	Very low	31.8	Very low	174 Å²	174	124.6 Å²	124.6	81%	0.806	66%	0.663	S	S	*	*			trans	98.9	110.3	-166.2	-53.5	-11.6	0	0	0	112.1
324	I	26.9	Very low	30.6	Very low	150 Å²	150	127.2 Å²	127.2	77%	0.769	68%	0.682	S	S	*	*	S	Bend	cis	-125.5	116.5	48	-67.8	171.1	0	0	0	113.5
325	K	23.7	Very low	29.6	Very low	187 Å²	187	126.4 Å²	126.4	81%	0.813	68%	0.681	S	S	*	*	S	Bend	trans	70.2	124	166.4	-59.7	166.3	-175	173.5	0	114.9
326	V	25.9	Very low	28.8	Very low	137 Å²	137	130 Å²	130	83%	0.83	70%	0.701	S	S	*	*			cis	-160.8	142.3	38.9	170.3	0	0	0	0	108.1
327	K	23.6	Very low	28.1	Very low	153 Å²	153	136.7 Å²	136.7	67%	0.665	72%	0.721	S	S	*	*			cis	-163	169.4	-7.5	-138.1	-171.6	162.5	-147.3	0	109.8
328	E	24.3	Very low	27.5	Very low	152 Å²	152	140.7 Å²	140.7	71%	0.71	75%	0.75	S	S	*	*			trans	50.3	134.7	152	-82.6	164.3	179.4	0	0	122.7
329	L	22.3	Very low	27	Very low	161 Å²	161	141.2 Å²	141.2	84%	0.843	75%	0.753	S	S	*	*			trans	-89.5	148.2	175.4	-74.9	78.6	0	0	0	112.7
330	T	25.7	Very low	26.5	Very low	128 Å²	128	145.6 Å²	145.6	79%	0.785	78%	0.779	S	S	*	*			trans	-155.8	100.6	138.7	41.2	0	0	0	0	107.7
331	T	22.5	Very low	26.2	Very low	131 Å²	131	146.4 Å²	146.4	80%	0.804	79%	0.786	S	S	*	*				79.6	137	91.2	53	0	0	0	0	115.8
332	I	25.7	Very low	26.1	Very low	149 Å²	149	144.8 Å²	144.8	76%	0.764	79%	0.786	S	S	*	*			trans	-93.7	150.8	-165	-62.3	155.1	0	0	0	111.9
333	T	29	Very low	26.1	Very low	133 Å²	133	145.5 Å²	145.5	82%	0.816	79%	0.789	S	S	*	*			trans	-142.6	114.1	141.4	50.8	0	0	0	0	110.9
334	D	26	Very low	26	Very low	144 Å²	144	146.2 Å²	146.2	77%	0.77	79%	0.79	S	S	*	*			trans	-5.1	157.7	140.2	-48.9	-28.6	0	0	0	118.3
335	A	24.6	Very low	26.6	Very low	82 Å²	82	142.2 Å²	142.2	68%	0.678	77%	0.773	S	S	*	*			cis	-172.7	159.4	-19.3	0	0	0	0	0	106.9
336	D	28.4	Very low	27.6	Very low	169 Å²	169	137.7 Å²	137.7	90%	0.904	75%	0.754	S	S	*	*			trans	-171.8	149.9	132.4	-101.6	-18.1	0	0	0	111.8
337	E	26.6	Very low	28.5	Very low	178 Å²	178	132.2 Å²	132.2	83%	0.832	72%	0.722	S	S	*	*			trans	-89.2	146	-167.8	-52.2	175.3	130.8	0	0	112.7
338	T	27.7	Very low	29.8	Very low	135 Å²	135	128 Å²	128	83%	0.828	71%	0.707	S	S	*	*				-158.9	99.9	126.2	46.3	0	0	0	0	111.1
339	T	26.2	Very low	31.1	Very low	115 Å²	115	121.9 Å²	121.9	71%	0.706	68%	0.679	S	S	*	*			trans	16.2	117.1	135.9	57.2	0	0	0	0	119.1
340	N	25.1	Very low	32.6	Very low	146 Å²	146	115.5 Å²	115.5	78%	0.781	65%	0.645	S	S	*	*				-174.4	116.3	115.4	-94.9	-31.1	0	0	0	113.3	S342	N340-S342 PolarHBondContact O-N 3.48Å
341	N	26.4	Very low	33.6	Very low	167 Å²	167	111.2 Å²	111.2	89%	0.893	62%	0.616	S	S	*	*			trans	7.1	96.5	157.1	-60.8	-16	0	0	0	118.3
342	S	29.4	Very low	35	Very low	107 Å²	107	105.7 Å²	105.7	75%	0.748	58%	0.581	S	S	*	*			trans	-131	138.8	150.7	63	0	0	0	0	109.3	N340 K344	N340-S342 PolarHBondContact O-N 3.48Å; S342-K344 PolarHBondContact O-N 3.01Å
343	L	27.3	Very low	35.8	Very low	158 Å²	158	102.3 Å²	102.3	83%	0.827	57%	0.565	S	S	*	*			trans	-67.1	118.9	-174	-76.6	82	0	0	0	110.5	T345	L343-T345 VanDerWaalsContact C-N 3.33Å; L343-T345 HydrophobicContact CB-CG2 4.34Å; L343-T345 HydrophobicContact CD2-CG2 4.45Å; L343-T345 PolarHBondContact O-N 2.87Å
344	K	29.5	Very low	36.5	Very low	189 Å²	189	103.4 Å²	103.4	82%	0.822	56%	0.56	S	S	*	*			trans	-73.5	87.3	159.9	-73.2	-171.6	174.5	-171	0	109.5	S342	S342-K344 PolarHBondContact O-N 3.01Å
345	T	38	Very low	37.1	Very low	66 Å²	66	98.8 Å²	98.8	41%	0.405	53%	0.533	S	S	.	.			trans	-101.3	87.8	162.5	53.9	0	0	0	0	108.3	L343	L343-T345 VanDerWaalsContact C-N 3.33Å; L343-T345 HydrophobicContact CB-CG2 4.34Å; L343-T345 HydrophobicContact CD2-CG2 4.45Å; L343-T345 PolarHBondContact O-N 2.87Å
346	E	44.7	Very low	37.5	Very low	92 Å²	92	98.4 Å²	98.4	43%	0.43	52%	0.519	S	S	.	.			trans	-62.1	137.3	178.8	-65.3	171.7	178	0	0	109.6	L433	E346-L433 WeakPolarHBondContact O-CD2 3.42Å
347	S	46.2	Very low	37.8	Very low	21 Å²	21	97.6 Å²	97.6	15%	0.147	51%	0.51	C	S	.	.			trans	-107.6	131.6	-178.7	-40.4	0	0	0	0	109.8	I349	S347-I349 PolarHBondContact O-N 3.09Å
348	D	50.5	Low	38.1	Very low	66 Å²	66	94 Å²	94	35%	0.353	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	118.4	173.1	-88.4	-38.1	0	0	0	109.6	P434 V435 I436	D348-P434 PolarHBondContact N-O 3.46Å; D348-V435 WeakPolarHBondContact O-CA 3.23Å; D348-I436 PolarHBondContact O-N 2.96Å
349	I	51.9	Low	38.5	Very low	23 Å²	23	90.5 Å²	90.5	12%	0.118	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	118.1	177.4	-53.7	171.3	0	0	0	110.2	L309 F317 F319 S347 I436 I438	L309-I349 HydrophobicContact CD2-CD1 4.45Å; F317-I349 HydrophobicContact CD1-CD1 3.49Å; F317-I349 VanDerWaalsContact CD1-CD1 3.49Å; F317-I349 HydrophobicContact CD1-CG1 4.34Å; F317-I349 HydrophobicContact CE1-CD1 3.97Å; F317-I349 HydrophobicContact CG-CD1 4.34Å; F319-I349 HydrophobicContact CE1-CB 3.91Å; F319-I349 HydrophobicContact CE1-CG2 3.86Å; F319-I349 HydrophobicContact CE2-CB 4.34Å; F319-I349 HydrophobicContact CE2-CD1 3.64Å; F319-I349 HydrophobicContact CZ-CB 3.55Å; F319-I349 HydrophobicContact CZ-CD1 3.57Å; F319-I349 HydrophobicContact CZ-CG1 4.13Å; F319-I349 HydrophobicContact CZ-CG2 3.53Å; S347-I349 PolarHBondContact O-N 3.09Å; I349-I436 WeakPolarHBondContact CA-O 3.38Å; I349-I436 HydrophobicContact CG1-CB 4.17Å; I349-I436 HydrophobicContact CG1-CD1 4.14Å; I349-I436 HydrophobicContact CG2-CB 4.38Å; I349-I436 HydrophobicContact CG2-CG2 4.37Å; I349-I438 HydrophobicContact CG2-CD1 3.81Å; I349-I438 HydrophobicContact CG2-CG1 4.15Å
350	I	53	Low	39	Very low	27 Å²	27	92.7 Å²	92.7	14%	0.138	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	118.2	171.5	-67.1	172.2	0	0	0	107.4	I352 L386 V435 I436 V437 I438	I350-I352 HydrophobicContact CG2-CG1 4.44Å; I350-L386 HydrophobicContact CD1-CD2 4.32Å; I350-V435 HydrophobicContact CD1-CG1 3.99Å; I350-I436 PolarHBondContact N-O 3.26Å; I350-V437 HydrophobicContact CB-CG2 4.35Å; I350-V437 HydrophobicContact CD1-CG2 4.38Å; I350-V437 HydrophobicContact CG2-CG1 4.26Å; I350-V437 WeakPolarHBondContact O-CA 3.44Å; I350-I438 PolarHBondContact O-N 3.36Å
351	F	47.7	Very low	39.6	Very low	38 Å²	38	88.9 Å²	88.9	17%	0.167	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	122.4	-177.7	-176.3	-106.2	0	0	0	109.8	L309 F319 D353 I438	L309-F351 HydrophobicContact CD1-CD2 3.74Å; L309-F351 HydrophobicContact CD1-CE2 3.85Å; L309-F351 HydrophobicContact CD1-CG 4.28Å; L309-F351 HydrophobicContact CD1-CZ 4.39Å; F319-F351 HydrophobicContact CE1-CB 4.2Å; F351-D353 HydrophobicContact CD1-CB 4.01Å; F351-D353 HydrophobicContact CE1-CB 3.51Å; F351-D353 WeakPolarHBondContact CE1-OD1 3.48Å; F351-D353 WeakPolarHBondContact CE1-OD2 3.2Å; F351-D353 HydrophobicContact CZ-CB 4.17Å; F351-D353 VanDerWaalsContact CZ-OD1 3.24Å; F351-D353 WeakPolarHBondContact CZ-OD1 3.48Å; F351-I438 HydrophobicContact CD2-CB 3.74Å; F351-I438 HydrophobicContact CD2-CD1 4.1Å; F351-I438 HydrophobicContact CD2-CG1 4.44Å; F351-I438 HydrophobicContact CD2-CG2 3.69Å; F351-I438 HydrophobicContact CE2-CB 4.4Å; F351-I438 HydrophobicContact CE2-CG2 3.82Å
352	I	50.8	Low	40.1	Very low	15 Å²	15	89.4 Å²	89.4	8%	0.077	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	110.5	-179.1	-54.8	178.5	0	0	0	107.9	I350 F355 I438 D440	I350-I352 HydrophobicContact CG2-CG1 4.44Å; I352-F355 HydrophobicContact CG2-CZ 4.44Å; I352-I438 PolarHBondContact N-O 3.45Å; I352-D440 PolarHBondContact O-N 3.36Å
353	D	42.8	Very low	40.6	Very low	78 Å²	78	87.4 Å²	87.4	42%	0.417	47%	0.466	S	S	.	.			trans	-115.5	-23.9	-167	-148.7	28.9	0	0	0	113.7	F351	F351-D353 HydrophobicContact CD1-CB 4.01Å; F351-D353 HydrophobicContact CE1-CB 3.51Å; F351-D353 WeakPolarHBondContact CE1-OD1 3.48Å; F351-D353 WeakPolarHBondContact CE1-OD2 3.2Å; F351-D353 HydrophobicContact CZ-CB 4.17Å; F351-D353 VanDerWaalsContact CZ-OD1 3.24Å; F351-D353 WeakPolarHBondContact CZ-OD1 3.48Å
354	E	43.4	Very low	41.5	Very low	156 Å²	156	85 Å²	85	73%	0.729	45%	0.453	S	S	*	.			trans	-136.4	121.4	-177.4	-70.2	-172.2	150.7	0	0	112.5
355	F	39.3	Very low	42	Very low	46 Å²	46	78 Å²	78	20%	0.202	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-92.4	122.1	159.4	-66.7	-84	0	0	0	108.6	I352 L394 I439 L445	I352-F355 HydrophobicContact CG2-CZ 4.44Å; F355-L394 HydrophobicContact CD1-CB 4.43Å; F355-L394 HydrophobicContact CE1-CB 4.05Å; F355-L394 HydrophobicContact CE1-CD1 4.29Å; F355-I439 HydrophobicContact CZ-CG2 4.48Å; F355-L445 HydrophobicContact CD1-CD2 4.12Å; F355-L445 HydrophobicContact CE1-CD1 4.21Å; F355-L445 HydrophobicContact CE1-CD2 3.65Å; F355-L445 HydrophobicContact CE1-CG 4Å; F355-L445 HydrophobicContact CE2-CG 4.4Å; F355-L445 HydrophobicContact CZ-CD1 3.83Å; F355-L445 HydrophobicContact CZ-CD2 4.07Å; F355-L445 HydrophobicContact CZ-CG 3.88Å
356	I	33.3	Very low	42.3	Very low	74 Å²	74	81.3 Å²	81.3	38%	0.379	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-70.7	140.3	-177.4	-53.8	175.9	0	0	0	110.5	T392	I356-T392 HydrophobicContact CD1-CG2 4.04Å
357	E	34.9	Very low	42.5	Very low	152 Å²	152	84.1 Å²	84.1	71%	0.71	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-48.8	138.7	172.8	-66.4	177.8	139.9	0	0	112.6	G359	E357-G359 PolarHBondContact O-N 2.94Å
358	P	31.7	Very low	42.5	Very low	103 Å²	103	86 Å²	86	67%	0.669	45%	0.451	S	S	*	.	S	Bend	trans	-63.3	134.4	-175.4	24.5	-33.9	0	0	0	112.9
359	G	35.9	Very low	42.1	Very low	61 Å²	61	83.4 Å²	83.4	63%	0.629	44%	0.437	S	S	*	.			trans	118.9	27.5	166	0	0	0	0	0	118.3	E357	E357-G359 PolarHBondContact O-N 2.94Å
360	K	37.8	Very low	42	Very low	161 Å²	161	87.2 Å²	87.2	70%	0.7	46%	0.458	S	S	*	.			trans	-117.7	-0.1	-177.8	-83.6	174.7	-177.6	152.7	0	117.9
361	C	38.1	Very low	41.8	Very low	67 Å²	67	88.7 Å²	88.7	45%	0.453	47%	0.466	S	S	.	.			trans	-121.8	129	-179.6	-79	0	0	0	0	113.2
362	N	36.9	Very low	41.5	Very low	178 Å²	178	88.1 Å²	88.1	95%	0.952	46%	0.464	S	S	*	.			trans	-120.1	28.2	177.9	-75.8	1.5	0	0	0	112.4
363	S	40.2	Very low	41.4	Very low	65 Å²	65	88.9 Å²	88.9	46%	0.455	47%	0.469	S	S	.	.	S	Bend	trans	-103.3	145.1	-174.6	44.9	0	0	0	0	112.5	I365 L368	S363-I365 PolarHBondContact O-N 2.89Å; S363-L368 VanDerWaalsContact OG-CD1 3.3Å; S363-L368 WeakPolarHBondContact OG-CD1 3.33Å
364	D	45.7	Very low	41.8	Very low	107 Å²	107	93.1 Å²	93.1	57%	0.572	48%	0.479	S	S	*	.			trans	-64.1	124.7	-176	-162.4	-13.1	0	0	0	112.2	W366 Q367 L368	D364-W366 VanDerWaalsContact C-N 3.32Å; D364-W366 PolarHBondContact O-N 3.38Å; D364-Q367 PolarHBondContact O-N 2.86Å; D364-L368 PolarHBondContact O-N 3.13Å
365	I	40	Very low	42	Very low	41 Å²	41	89.5 Å²	89.5	21%	0.21	46%	0.461	C	S	.	.	H	α-helix	trans	-67	-33.4	-165.4	-66.1	168.7	0	0	0	111.3	S363 L368 L369 L397 Q401	S363-I365 PolarHBondContact O-N 2.89Å; I365-L368 PolarHBondContact O-N 3.34Å; I365-L369 HydrophobicContact CG2-CD1 3.89Å; I365-L369 HydrophobicContact CG2-CG 4.38Å; I365-L369 WeakPolarHBondContact O-CB 3.47Å; I365-L369 WeakPolarHBondContact O-CG 3.38Å; I365-L369 PolarHBondContact O-N 3.2Å; I365-L397 HydrophobicContact CG2-CD2 4.18Å; I365-Q401 VanDerWaalsContact CD1-NE2 3.25Å
366	W	43.3	Very low	42.2	Very low	136 Å²	136	88 Å²	88	52%	0.515	46%	0.457	S	S	.	.	H	α-helix	trans	-71.5	-37.2	-178.3	-66.4	104.5	0	0	0	113.3	D364 L369 D370	D364-W366 VanDerWaalsContact C-N 3.32Å; D364-W366 PolarHBondContact O-N 3.38Å; W366-L369 HydrophobicContact CD2-CD1 4.41Å; W366-L369 HydrophobicContact CE3-CD1 3.83Å; W366-L369 HydrophobicContact CZ3-CD1 3.98Å; W366-L369 PolarHBondContact O-N 2.92Å; W366-D370 PolarHBondContact O-N 2.94Å
367	Q	49.3	Very low	42.8	Very low	151 Å²	151	93.7 Å²	93.7	71%	0.706	47%	0.473	S	S	*	.	H	α-helix	trans	-66	-40	173.2	-77.5	-170.3	-15.2	0	0	111.6	D364 D371	D364-Q367 PolarHBondContact O-N 2.86Å; Q367-D371 VanDerWaalsContact O-CB 3.29Å; Q367-D371 WeakPolarHBondContact O-CB 3.41Å; Q367-D371 PolarHBondContact O-N 2.84Å
368	L	46.5	Very low	43.3	Very low	60 Å²	60	90.5 Å²	90.5	31%	0.314	46%	0.464	S	S	.	.	H	α-helix	trans	-60.4	-44	173.2	-95	163.3	0	0	0	111.8	S363 D364 I365 L372 L393	S363-L368 VanDerWaalsContact OG-CD1 3.3Å; S363-L368 WeakPolarHBondContact OG-CD1 3.33Å; D364-L368 PolarHBondContact O-N 3.13Å; I365-L368 PolarHBondContact O-N 3.34Å; L368-L372 WeakPolarHBondContact O-CB 3.35Å; L368-L372 PolarHBondContact O-N 3.28Å; L368-L393 HydrophobicContact CB-CD1 3.91Å; L368-L393 HydrophobicContact CD2-CD1 4.35Å
369	L	41.7	Very low	43.8	Very low	13 Å²	13	85.9 Å²	85.9	7%	0.068	44%	0.435	C	S	.	.	H	α-helix	trans	-63.7	-44.1	178.3	-79.3	168	0	0	0	113.6	I365 W366 N373 L393 L413	I365-L369 HydrophobicContact CG2-CD1 3.89Å; I365-L369 HydrophobicContact CG2-CG 4.38Å; I365-L369 WeakPolarHBondContact O-CB 3.47Å; I365-L369 WeakPolarHBondContact O-CG 3.38Å; I365-L369 PolarHBondContact O-N 3.2Å; W366-L369 HydrophobicContact CD2-CD1 4.41Å; W366-L369 HydrophobicContact CE3-CD1 3.83Å; W366-L369 HydrophobicContact CZ3-CD1 3.98Å; W366-L369 PolarHBondContact O-N 2.92Å; L369-N373 WeakPolarHBondContact O-CB 3.44Å; L369-N373 PolarHBondContact O-N 3.06Å; L369-N373 PolarHBondContact O-ND2 3.25Å; L369-L393 HydrophobicContact CD2-CD2 4.4Å; L369-L413 HydrophobicContact CD2-CD1 3.98Å; L369-L413 HydrophobicContact CD2-CD2 3.52Å; L369-L413 HydrophobicContact CD2-CG 3.73Å
370	D	49.8	Very low	44.1	Very low	103 Å²	103	87.4 Å²	87.4	55%	0.551	42%	0.422	S	S	*	.	H	α-helix	trans	-72.2	-39.9	-179.8	-80.9	-16.1	0	0	0	111.7	W366 L372 N373 R374	W366-D370 PolarHBondContact O-N 2.94Å; D370-L372 VanDerWaalsContact C-N 3.32Å; D370-L372 PolarHBondContact O-N 3.16Å; D370-N373 PolarHBondContact O-N 2.99Å; D370-R374 WeakPolarHBondContact O-CB 3.44Å; D370-R374 PolarHBondContact O-N 3.29Å
371	D	48.9	Very low	44.4	Very low	58 Å²	58	89 Å²	89	31%	0.31	43%	0.425	S	S	.	.	H	α-helix	trans	-69.9	-30.2	177.5	-141.3	45	0	0	0	111.4	Q367 R374 K375	Q367-D371 VanDerWaalsContact O-CB 3.29Å; Q367-D371 WeakPolarHBondContact O-CB 3.41Å; Q367-D371 PolarHBondContact O-N 2.84Å; D371-R374 IonicContact OD1-CZ 3.27Å; D371-R374 IonicContact OD1-NH1 2.85Å; D371-R374 PolarHBondContact OD1-NH1 3.42Å; D371-K375 VanDerWaalsContact O-CB 3.23Å; D371-K375 WeakPolarHBondContact O-CB 3.43Å; D371-K375 WeakPolarHBondContact O-CD 3.49Å; D371-K375 WeakPolarHBondContact O-CG 3.48Å; D371-K375 PolarHBondContact O-N 2.84Å; D371-K375 IonicContact OD2-NZ 3.93Å; D371-K375 PolarHBondContact OD2-NZ 2.89Å
372	L	42.3	Very low	44.8	Very low	25 Å²	25	92.4 Å²	92.4	13%	0.131	43%	0.432	C	S	.	.	H	α-helix	trans	-77.7	-38.7	173.1	-148.8	166	0	0	0	112.3	L368 D370 R374 K375 A376 S389 L393	L368-L372 WeakPolarHBondContact O-CB 3.35Å; L368-L372 PolarHBondContact O-N 3.28Å; D370-L372 VanDerWaalsContact C-N 3.32Å; D370-L372 PolarHBondContact O-N 3.16Å; L372-R374 VanDerWaalsContact C-N 3.31Å; L372-R374 PolarHBondContact O-N 2.95Å; L372-K375 PolarHBondContact O-N 3.33Å; L372-A376 VanDerWaalsContact O-CB 3.27Å; L372-A376 WeakPolarHBondContact O-CB 3.45Å; L372-A376 PolarHBondContact O-N 3.28Å; L372-S389 WeakPolarHBondContact CD1-O 3.42Å; L372-L393 HydrophobicContact CD1-CB 3.74Å; L372-L393 HydrophobicContact CD1-CD1 3.79Å; L372-L393 HydrophobicContact CD1-CD2 4.19Å; L372-L393 HydrophobicContact CD1-CG 4.1Å
373	N	47.5	Very low	45.2	Very low	32 Å²	32	86.9 Å²	86.9	17%	0.171	41%	0.407	C	S	.	.	H	α-helix	trans	-61.6	-40.9	170.9	-84.3	-68.8	0	0	0	111.7	L369 D370 R377	L369-N373 WeakPolarHBondContact O-CB 3.44Å; L369-N373 PolarHBondContact O-N 3.06Å; L369-N373 PolarHBondContact O-ND2 3.25Å; D370-N373 PolarHBondContact O-N 2.99Å; N373-R377 WeakPolarHBondContact O-CB 3.38Å; N373-R377 VanDerWaalsContact O-CG 3.27Å; N373-R377 WeakPolarHBondContact O-CG 3.32Å; N373-R377 PolarHBondContact O-N 3.19Å; N373-R377 VanDerWaalsContact O-N 3.12Å
374	R	52	Low	45.4	Very low	167 Å²	167	87.1 Å²	87.1	63%	0.63	41%	0.409	S	S	*	.	H	α-helix	trans	-63.1	-48.3	172.9	178	179.3	166.4	-146.9	3.7	111.2	D370 D371 L372 R377 T378	D370-R374 WeakPolarHBondContact O-CB 3.44Å; D370-R374 PolarHBondContact O-N 3.29Å; D371-R374 IonicContact OD1-CZ 3.27Å; D371-R374 IonicContact OD1-NH1 2.85Å; D371-R374 PolarHBondContact OD1-NH1 3.42Å; L372-R374 VanDerWaalsContact C-N 3.31Å; L372-R374 PolarHBondContact O-N 2.95Å; R374-R377 PolarHBondContact O-N 3.35Å; R374-T378 PolarHBondContact O-N 2.86Å; R374-T378 PolarHBondContact O-OG1 2.94Å; R374-T378 VanDerWaalsContact O-OG1 3.13Å
375	K	46.5	Very low	45.6	Very low	80 Å²	80	86.5 Å²	86.5	35%	0.348	40%	0.402	S	S	.	.	H	α-helix	trans	-61.9	-46.6	177.1	-80.2	163.3	177.8	150	0	112.3	D371 L372 R377 T378 A379	D371-K375 VanDerWaalsContact O-CB 3.23Å; D371-K375 WeakPolarHBondContact O-CB 3.43Å; D371-K375 WeakPolarHBondContact O-CD 3.49Å; D371-K375 WeakPolarHBondContact O-CG 3.48Å; D371-K375 PolarHBondContact O-N 2.84Å; D371-K375 IonicContact OD2-NZ 3.93Å; D371-K375 PolarHBondContact OD2-NZ 2.89Å; L372-K375 PolarHBondContact O-N 3.33Å; K375-R377 VanDerWaalsContact C-N 3.34Å; K375-R377 PolarHBondContact O-N 3.2Å; K375-T378 WeakPolarHBondContact CA-OG1 3.5Å; K375-T378 CarbonylContact O-C 3.55Å; K375-T378 PolarHBondContact O-N 2.89Å; K375-T378 VanDerWaalsContact O-N 3.1Å; K375-T378 PolarHBondContact O-OG1 2.88Å; K375-A379 WeakPolarHBondContact O-CA 3.49Å; K375-A379 WeakPolarHBondContact O-CB 3.25Å; K375-A379 PolarHBondContact O-N 2.96Å
376	A	44.2	Very low	45.8	Very low	15 Å²	15	86.1 Å²	86.1	12%	0.124	40%	0.401	C	S	.	.	H	α-helix	trans	-59.5	-42.3	177.6	0	0	0	0	0	112.2	L372 T378 A379 R380 L386	L372-A376 VanDerWaalsContact O-CB 3.27Å; L372-A376 WeakPolarHBondContact O-CB 3.45Å; L372-A376 PolarHBondContact O-N 3.28Å; A376-T378 PolarHBondContact O-N 2.97Å; A376-A379 PolarHBondContact O-N 3.13Å; A376-R380 PolarHBondContact O-N 3.4Å; A376-L386 HydrophobicContact CB-CD1 4.45Å
377	R	46.2	Very low	45.9	Very low	192 Å²	192	82 Å²	82	73%	0.725	39%	0.389	S	S	*	.	H	α-helix	trans	-63.8	-36.5	173.8	-72.2	174	-174.9	-179.9	3	112.8	N373 R374 K375	N373-R377 WeakPolarHBondContact O-CB 3.38Å; N373-R377 VanDerWaalsContact O-CG 3.27Å; N373-R377 WeakPolarHBondContact O-CG 3.32Å; N373-R377 PolarHBondContact O-N 3.19Å; N373-R377 VanDerWaalsContact O-N 3.12Å; R374-R377 PolarHBondContact O-N 3.35Å; K375-R377 VanDerWaalsContact C-N 3.34Å; K375-R377 PolarHBondContact O-N 3.2Å
378	T	45.5	Very low	45.9	Very low	85 Å²	85	78.4 Å²	78.4	52%	0.521	38%	0.38	S	S	.	.	H	α-helix	trans	-80.5	-25.7	174	51.9	0	0	0	0	113.9	R374 K375 A376 Y381	R374-T378 PolarHBondContact O-N 2.86Å; R374-T378 PolarHBondContact O-OG1 2.94Å; R374-T378 VanDerWaalsContact O-OG1 3.13Å; K375-T378 WeakPolarHBondContact CA-OG1 3.5Å; K375-T378 CarbonylContact O-C 3.55Å; K375-T378 PolarHBondContact O-N 2.89Å; K375-T378 VanDerWaalsContact O-N 3.1Å; K375-T378 PolarHBondContact O-OG1 2.88Å; A376-T378 PolarHBondContact O-N 2.97Å; T378-Y381 PolarHBondContact O-N 3.21Å
379	A	41.5	Very low	45.9	Very low	6 Å²	6	76.6 Å²	76.6	5%	0.05	37%	0.373	C	S	.	.	H	α-helix	trans	-87.2	-3.2	-172.3	0	0	0	0	0	113.9	K375 A376 Y381 K382 L386	K375-A379 WeakPolarHBondContact O-CA 3.49Å; K375-A379 WeakPolarHBondContact O-CB 3.25Å; K375-A379 PolarHBondContact O-N 2.96Å; A376-A379 PolarHBondContact O-N 3.13Å; A379-Y381 PolarHBondContact O-N 2.9Å; A379-K382 CarbonylContact O-C 3.59Å; A379-K382 VanDerWaalsContact O-C 3.31Å; A379-K382 PolarHBondContact O-N 3.25Å; A379-L386 HydrophobicContact CB-CB 4.29Å; A379-L386 HydrophobicContact CB-CD1 4.15Å
380	R	42.4	Very low	46.3	Very low	94 Å²	94	77.3 Å²	77.3	36%	0.355	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	-18.2	156.6	-93.9	-167.2	178.7	-139	-8.3	113.4	A376 S420 S422	A376-R380 PolarHBondContact O-N 3.4Å; R380-S420 PolarHBondContact NH2-O 2.68Å; R380-S422 PolarHBondContact NH2-O 2.95Å
381	Y	44	Very low	46.2	Very low	194 Å²	194	73.6 Å²	73.6	76%	0.761	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.2	2.7	176.6	-60.2	-74.1	0	0	0	114.4	T378 A379	T378-Y381 PolarHBondContact O-N 3.21Å; A379-Y381 PolarHBondContact O-N 2.9Å
382	K	46.8	Very low	46.1	Very low	139 Å²	139	74 Å²	74	60%	0.604	37%	0.365	S	S	*	.			trans	-152.9	89.7	178	-69.7	-168.9	-179.7	178.1	0	111.6	A379 S384	A379-K382 CarbonylContact O-C 3.59Å; A379-K382 VanDerWaalsContact O-C 3.31Å; A379-K382 PolarHBondContact O-N 3.25Å; K382-S384 VanDerWaalsContact C-N 3.27Å; K382-S384 PolarHBondContact O-N 2.91Å
383	S	44.3	Very low	46.3	Very low	61 Å²	61	73.3 Å²	73.3	43%	0.427	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-20.9	-173.9	49.3	0	0	0	0	115.9	E385	S383-E385 PolarHBondContact O-N 2.89Å
384	S	46	Very low	46.3	Very low	71 Å²	71	73 Å²	73	50%	0.497	36%	0.359	S	S	.	.	H	α-helix	trans	-71.5	-28	-175.8	55.8	0	0	0	0	115.5	K382	K382-S384 VanDerWaalsContact C-N 3.27Å; K382-S384 PolarHBondContact O-N 2.91Å
385	E	48.4	Very low	46.1	Very low	93 Å²	93	65.6 Å²	65.6	44%	0.435	33%	0.333	S	S	.	.	H	α-helix	trans	-81.4	-23.6	-178.9	-69.5	-175.3	-178.7	0	0	112.8	S383 S388 S389	S383-E385 PolarHBondContact O-N 2.89Å; E385-S388 PolarHBondContact O-OG 3.01Å; E385-S389 PolarHBondContact O-N 3.43Å; E385-S389 PolarHBondContact O-OG 3.41Å
386	L	45.3	Very low	46	Very low	34 Å²	34	62.9 Å²	62.9	18%	0.178	32%	0.324	C	S	.	.	H	α-helix	trans	-74	-48.8	-171.2	-159.2	150.3	0	0	0	111.5	I350 A376 A379 S388 S389 L390	I350-L386 HydrophobicContact CD1-CD2 4.32Å; A376-L386 HydrophobicContact CB-CD1 4.45Å; A379-L386 HydrophobicContact CB-CB 4.29Å; A379-L386 HydrophobicContact CB-CD1 4.15Å; L386-S388 PolarHBondContact O-N 3.29Å; L386-S389 PolarHBondContact O-N 3.44Å; L386-S389 PolarHBondContact O-OG 3.07Å; L386-L390 HydrophobicContact CD2-CD1 3.67Å; L386-L390 WeakPolarHBondContact O-CB 3.39Å; L386-L390 PolarHBondContact O-N 2.71Å
387	N	44.5	Very low	46	Very low	49 Å²	49	62.6 Å²	62.6	26%	0.262	32%	0.321	S	S	.	.	H	α-helix	trans	-61.4	-42.6	-179.2	-68.1	-9.6	0	0	0	112.9	S389 A391	N387-S389 PolarHBondContact O-N 2.81Å; N387-A391 PolarHBondContact O-N 3.31Å
388	S	48.9	Very low	46	Very low	75 Å²	75	55.1 Å²	55.1	52%	0.524	30%	0.296	S	S	.	.	H	α-helix	trans	-67.2	-35.4	-177.4	62	0	0	0	0	113.4	E385 L386 T392	E385-S388 PolarHBondContact O-OG 3.01Å; L386-S388 PolarHBondContact O-N 3.29Å; S388-T392 PolarHBondContact O-OG1 3.03Å
389	S	48.2	Very low	45.8	Very low	23 Å²	23	52.5 Å²	52.5	16%	0.161	28%	0.282	C	S	.	.	H	α-helix	trans	-82.4	-33.1	-180	52	0	0	0	0	112.9	L372 E385 L386 N387 T392 L393	L372-S389 WeakPolarHBondContact CD1-O 3.42Å; E385-S389 PolarHBondContact O-N 3.43Å; E385-S389 PolarHBondContact O-OG 3.41Å; L386-S389 PolarHBondContact O-N 3.44Å; L386-S389 PolarHBondContact O-OG 3.07Å; N387-S389 PolarHBondContact O-N 2.81Å; S389-T392 PolarHBondContact O-OG1 3.39Å; S389-L393 WeakPolarHBondContact O-CB 3.42Å; S389-L393 PolarHBondContact O-N 3.18Å
390	L	49.5	Very low	46	Very low	27 Å²	27	56.1 Å²	56.1	14%	0.141	32%	0.32	C	S	.	.	H	α-helix	trans	-72.3	-40.5	179.1	-133.4	155.5	0	0	0	112.4	L386 L393 L394 L417	L386-L390 HydrophobicContact CD2-CD1 3.67Å; L386-L390 WeakPolarHBondContact O-CB 3.39Å; L386-L390 PolarHBondContact O-N 2.71Å; L390-L393 PolarHBondContact O-N 3.17Å; L390-L394 HydrophobicContact CD2-CD1 3.77Å; L390-L394 HydrophobicContact CD2-CG 4.18Å; L390-L394 PolarHBondContact O-N 3.25Å; L390-L417 HydrophobicContact CD1-CD1 3.9Å; L390-L417 HydrophobicContact CD2-CD1 3.79Å; L390-L417 HydrophobicContact CG-CD1 4.33Å
391	A	47	Very low	46.1	Very low	25 Å²	25	54.1 Å²	54.1	21%	0.207	31%	0.314	C	S	.	.	H	α-helix	trans	-64.9	-44.2	175.9	0	0	0	0	0	112.4	N387 S395	N387-A391 PolarHBondContact O-N 3.31Å; A391-S395 PolarHBondContact O-N 3.38Å; A391-S395 VanDerWaalsContact O-N 3.15Å; A391-S395 PolarHBondContact O-OG 2.86Å
392	T	47.5	Very low	46.3	Very low	68 Å²	68	52.7 Å²	52.7	42%	0.417	31%	0.314	S	S	.	.	H	α-helix	trans	-65.3	-39.6	175.7	38.4	0	0	0	0	112.2	I356 S388 S389 S395 S396	I356-T392 HydrophobicContact CD1-CG2 4.04Å; S388-T392 PolarHBondContact O-OG1 3.03Å; S389-T392 PolarHBondContact O-OG1 3.39Å; T392-S395 PolarHBondContact O-N 3.47Å; T392-S395 PolarHBondContact O-OG 3.21Å; T392-S396 WeakPolarHBondContact O-CB 3.38Å; T392-S396 PolarHBondContact O-N 3.35Å
393	L	45.9	Very low	46.2	Very low	10 Å²	10	48.7 Å²	48.7	5%	0.052	30%	0.3	C	S	.	.	H	α-helix	trans	-64.7	-47.7	177.8	-165.6	108.1	0	0	0	112.1	L368 L369 L372 S389 L390 S395 S396 L397 L413	L368-L393 HydrophobicContact CB-CD1 3.91Å; L368-L393 HydrophobicContact CD2-CD1 4.35Å; L369-L393 HydrophobicContact CD2-CD2 4.4Å; L372-L393 HydrophobicContact CD1-CB 3.74Å; L372-L393 HydrophobicContact CD1-CD1 3.79Å; L372-L393 HydrophobicContact CD1-CD2 4.19Å; L372-L393 HydrophobicContact CD1-CG 4.1Å; S389-L393 WeakPolarHBondContact O-CB 3.42Å; S389-L393 PolarHBondContact O-N 3.18Å; L390-L393 PolarHBondContact O-N 3.17Å; L393-S395 VanDerWaalsContact C-N 3.32Å; L393-S395 PolarHBondContact O-N 3.26Å; L393-S396 PolarHBondContact O-N 3.41Å; L393-S396 PolarHBondContact O-OG 2.92Å; L393-L397 HydrophobicContact CD2-CD1 3.79Å; L393-L397 HydrophobicContact CG-CD1 4.09Å; L393-L397 WeakPolarHBondContact O-CD1 3.46Å; L393-L397 WeakPolarHBondContact O-CG 3.31Å; L393-L397 PolarHBondContact O-N 3.34Å; L393-L413 HydrophobicContact CD2-CD1 3.92Å; L393-L413 HydrophobicContact CD2-CD2 3.77Å
394	L	47.9	Very low	46.1	Very low	25 Å²	25	52.6 Å²	52.6	13%	0.131	31%	0.309	C	S	.	.	H	α-helix	trans	-60.3	-39.5	178.1	-74.5	170.9	0	0	0	112.4	F355 L390 S396 L410	F355-L394 HydrophobicContact CD1-CB 4.43Å; F355-L394 HydrophobicContact CE1-CB 4.05Å; F355-L394 HydrophobicContact CE1-CD1 4.29Å; L390-L394 HydrophobicContact CD2-CD1 3.77Å; L390-L394 HydrophobicContact CD2-CG 4.18Å; L390-L394 PolarHBondContact O-N 3.25Å; L394-S396 VanDerWaalsContact C-N 3.34Å; L394-L410 HydrophobicContact CD2-CD2 4.48Å
395	S	47	Very low	46.2	Very low	11 Å²	11	53.7 Å²	53.7	8%	0.077	31%	0.307	C	S	.	.	H	α-helix	trans	-71.6	-24	174.3	71.3	0	0	0	0	114.4	A391 T392 L393 T398	A391-S395 PolarHBondContact O-N 3.38Å; A391-S395 VanDerWaalsContact O-N 3.15Å; A391-S395 PolarHBondContact O-OG 2.86Å; T392-S395 PolarHBondContact O-N 3.47Å; T392-S395 PolarHBondContact O-OG 3.21Å; L393-S395 VanDerWaalsContact C-N 3.32Å; L393-S395 PolarHBondContact O-N 3.26Å; S395-T398 PolarHBondContact O-OG1 2.95Å; S395-T398 VanDerWaalsContact O-OG1 3.1Å
396	S	45.1	Very low	46.3	Very low	23 Å²	23	50.9 Å²	50.9	16%	0.161	29%	0.292	C	S	.	.	H	α-helix	trans	-77.6	-27.6	177.5	72.1	0	0	0	0	113.1	T392 L393 L394 S399	T392-S396 WeakPolarHBondContact O-CB 3.38Å; T392-S396 PolarHBondContact O-N 3.35Å; L393-S396 PolarHBondContact O-N 3.41Å; L393-S396 PolarHBondContact O-OG 2.92Å; L394-S396 VanDerWaalsContact C-N 3.34Å; S396-S399 PolarHBondContact O-OG 3.45Å
397	L	44.3	Very low	46.4	Very low	9 Å²	9	49.8 Å²	49.8	5%	0.047	29%	0.288	C	S	.	.	H	α-helix	trans	-80.3	-17.5	-178.4	-69.6	157.9	0	0	0	113.4	I365 L393 L413	I365-L397 HydrophobicContact CG2-CD2 4.18Å; L393-L397 HydrophobicContact CD2-CD1 3.79Å; L393-L397 HydrophobicContact CG-CD1 4.09Å; L393-L397 WeakPolarHBondContact O-CD1 3.46Å; L393-L397 WeakPolarHBondContact O-CG 3.31Å; L393-L397 PolarHBondContact O-N 3.34Å; L397-L413 HydrophobicContact CD1-CD1 3.23Å; L397-L413 HydrophobicContact CD2-CD1 4.28Å; L397-L413 HydrophobicContact CG-CD1 4.39Å
398	T	46.6	Very low	46.7	Very low	35 Å²	35	54 Å²	54	22%	0.215	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-10.6	178.4	52.2	0	0	0	0	113.4	S395 L445	S395-T398 PolarHBondContact O-OG1 2.95Å; S395-T398 VanDerWaalsContact O-OG1 3.1Å; T398-L445 HydrophobicContact CG2-CD2 4.33Å
399	S	42	Very low	46.8	Very low	31 Å²	31	52 Å²	52	22%	0.217	28%	0.282	C	S	.	.	S	Bend	trans	-104.3	115.4	-178.6	65.9	0	0	0	0	114	S396	S396-S399 PolarHBondContact O-OG 3.45Å
400	G	45.1	Very low	47	Very low	82 Å²	82	51.5 Å²	51.5	85%	0.845	28%	0.278	S	S	*	.	S	Bend	trans	96.1	9.7	155	0	0	0	0	0	118.5
401	Q	44.6	Very low	47.1	Very low	52 Å²	52	54.5 Å²	54.5	24%	0.243	29%	0.288	C	S	.	.	S	Bend	trans	-113.1	150.9	173.3	-70.9	-173.3	-8	0	0	112.7	I365 R406	I365-Q401 VanDerWaalsContact CD1-NE2 3.25Å; Q401-R406 PolarHBondContact O-NH2 3.05Å
402	E	48.6	Very low	47.3	Very low	163 Å²	163	56.6 Å²	56.6	76%	0.762	29%	0.293	S	S	*	.			trans	-58.1	141.1	172.1	-63.9	-177.1	175.1	0	0	111.2	F404 E405 R406	E402-F404 PolarHBondContact O-N 3.12Å; E402-E405 PolarHBondContact O-N 3.21Å; E402-R406 PolarHBondContact O-N 3.18Å
403	D	44.1	Very low	47.5	Very low	55 Å²	55	54.9 Å²	54.9	29%	0.294	28%	0.281	S	S	.	.	H	α-helix	trans	-54.1	-34.5	-166.7	-61.2	-17.9	0	0	0	114.1	R406 A407	D403-R406 PolarHBondContact O-N 2.99Å; D403-R406 IonicContact OD1-NH2 3.73Å; D403-A407 PolarHBondContact O-N 3.27Å; D403-A407 VanDerWaalsContact O-N 3.11Å
404	F	41.7	Very low	47.8	Very low	144 Å²	144	54.5 Å²	54.5	63%	0.632	28%	0.279	S	S	*	.	H	α-helix	trans	-68.4	-40.9	-179.6	-176.7	-97	0	0	0	113.1	E402 R408	E402-F404 PolarHBondContact O-N 3.12Å; F404-R408 WeakPolarHBondContact O-CB 3.36Å; F404-R408 PolarHBondContact O-N 3.03Å
405	E	48.5	Very low	48	Very low	94 Å²	94	54 Å²	54	44%	0.439	28%	0.278	S	S	.	.	H	α-helix	trans	-70.2	-39.5	175.9	-70.2	-142.1	130.1	0	0	111.2	E402 A407 R408 Q409	E402-E405 PolarHBondContact O-N 3.21Å; E405-A407 PolarHBondContact O-N 3.43Å; E405-R408 PolarHBondContact O-N 3.1Å; E405-Q409 WeakPolarHBondContact O-CB 3.38Å; E405-Q409 WeakPolarHBondContact O-CG 3.23Å; E405-Q409 PolarHBondContact O-N 3.44Å
406	R	49.5	Very low	48	Very low	33 Å²	33	58.2 Å²	58.2	13%	0.125	29%	0.292	C	S	.	.	H	α-helix	trans	-55.5	-51.8	177.1	-159.2	-174.3	-57.1	177.1	9.6	111.3	Q401 E402 D403 R408 Q409 L410 D447	Q401-R406 PolarHBondContact O-NH2 3.05Å; E402-R406 PolarHBondContact O-N 3.18Å; D403-R406 PolarHBondContact O-N 2.99Å; D403-R406 IonicContact OD1-NH2 3.73Å; R406-R408 PolarHBondContact O-N 3.38Å; R406-Q409 PolarHBondContact O-N 2.88Å; R406-L410 HydrophobicContact CG-CD1 4.48Å; R406-L410 WeakPolarHBondContact O-CG 3.38Å; R406-L410 PolarHBondContact O-N 3.04Å; R406-L410 VanDerWaalsContact O-N 3.08Å; R406-D447 IonicContact NH1-OD2 2.7Å; R406-D447 PolarHBondContact NH1-OD2 3.38Å
407	A	48.8	Very low	48.5	Very low	11 Å²	11	59.2 Å²	59.2	9%	0.091	30%	0.296	C	S	.	.	H	α-helix	trans	-64.8	-37.7	178.4	0	0	0	0	0	113.1	D403 E405 R411	D403-A407 PolarHBondContact O-N 3.27Å; D403-A407 VanDerWaalsContact O-N 3.11Å; E405-A407 PolarHBondContact O-N 3.43Å; A407-R411 WeakPolarHBondContact O-CG 3.46Å; A407-R411 PolarHBondContact O-N 3.44Å
408	R	50.3	Low	48.9	Very low	137 Å²	137	60.2 Å²	60.2	52%	0.517	30%	0.3	S	S	.	.	H	α-helix	trans	-65.9	-45.3	177.6	-178.9	-178.6	175.3	-169.9	-0.2	112	F404 E405 R406 R411 Q412	F404-R408 WeakPolarHBondContact O-CB 3.36Å; F404-R408 PolarHBondContact O-N 3.03Å; E405-R408 PolarHBondContact O-N 3.1Å; R406-R408 PolarHBondContact O-N 3.38Å; R408-R411 PolarHBondContact O-N 2.92Å; R408-Q412 PolarHBondContact O-N 3.3Å
409	Q	50.3	Low	49.2	Very low	33 Å²	33	61 Å²	61	15%	0.154	30%	0.304	C	S	.	.	H	α-helix	trans	-67	-41.2	179.8	-70.3	173.8	34.4	0	0	111.4	E405 R406 R411 Q412 L413	E405-Q409 WeakPolarHBondContact O-CB 3.38Å; E405-Q409 WeakPolarHBondContact O-CG 3.23Å; E405-Q409 PolarHBondContact O-N 3.44Å; R406-Q409 PolarHBondContact O-N 2.88Å; Q409-R411 PolarHBondContact O-N 2.95Å; Q409-Q412 PolarHBondContact O-N 3.44Å; Q409-L413 WeakPolarHBondContact O-CB 3.24Å; Q409-L413 PolarHBondContact O-N 2.92Å
410	L	52.1	Low	49.7	Very low	14 Å²	14	61.4 Å²	61.4	7%	0.073	31%	0.308	C	S	.	.	H	α-helix	trans	-59.6	-41.2	175.7	-73.7	170.3	0	0	0	112.9	L394 R406 L413 G414 C458 W461	L394-L410 HydrophobicContact CD2-CD2 4.48Å; R406-L410 HydrophobicContact CG-CD1 4.48Å; R406-L410 WeakPolarHBondContact O-CG 3.38Å; R406-L410 PolarHBondContact O-N 3.04Å; R406-L410 VanDerWaalsContact O-N 3.08Å; L410-L413 PolarHBondContact O-N 3.3Å; L410-G414 PolarHBondContact O-N 3.43Å; L410-C458 HydrophobicContact CD1-CB 4.25Å; L410-W461 HydrophobicContact CB-CG 4.5Å; L410-W461 WeakPolarHBondContact O-CB 3.36Å
411	R	51.5	Low	50	Low	90 Å²	90	59.1 Å²	59.1	34%	0.34	28%	0.276	S	S	.	.	H	α-helix	trans	-64.1	-39.7	174.6	-70.8	175.5	-176.6	160.9	-1.6	113.3	A407 R408 Q409 L413 S415 D460 W461	A407-R411 WeakPolarHBondContact O-CG 3.46Å; A407-R411 PolarHBondContact O-N 3.44Å; R408-R411 PolarHBondContact O-N 2.92Å; Q409-R411 PolarHBondContact O-N 2.95Å; R411-L413 VanDerWaalsContact C-N 3.3Å; R411-L413 PolarHBondContact O-N 3.19Å; R411-S415 PolarHBondContact O-N 3.47Å; R411-S415 PolarHBondContact O-OG 3.21Å; R411-D460 IonicContact CZ-OD2 3.31Å; R411-D460 IonicContact NE-OD2 2.8Å; R411-D460 IonicContact NH2-OD2 2.96Å; R411-D460 PolarHBondContact NH2-OD2 3.45Å; R411-W461 HydrophobicContact CB-CB 4.44Å; R411-W461 HydrophobicContact CG-CB 4.16Å
412	Q	51.3	Low	50.2	Low	69 Å²	69	58 Å²	58	32%	0.322	27%	0.274	S	S	.	.	H	α-helix	trans	-68.7	-30.1	175.6	-69.7	-174.8	-15.5	0	0	112.4	R408 Q409 S415 R416	R408-Q412 PolarHBondContact O-N 3.3Å; Q409-Q412 PolarHBondContact O-N 3.44Å; Q412-S415 PolarHBondContact O-OG 3.34Å; Q412-R416 WeakPolarHBondContact O-CD 3.49Å; Q412-R416 VanDerWaalsContact O-CG 3.25Å; Q412-R416 WeakPolarHBondContact O-CG 3.49Å; Q412-R416 PolarHBondContact O-N 2.9Å
413	L	52.3	Low	50.2	Low	31 Å²	31	52.8 Å²	52.8	16%	0.162	25%	0.254	C	S	.	.	H	α-helix	trans	-74.6	-47	173.6	-102	159.9	0	0	0	113.2	L369 L393 L397 Q409 L410 R411 S415 R416 L417	L369-L413 HydrophobicContact CD2-CD1 3.98Å; L369-L413 HydrophobicContact CD2-CD2 3.52Å; L369-L413 HydrophobicContact CD2-CG 3.73Å; L393-L413 HydrophobicContact CD2-CD1 3.92Å; L393-L413 HydrophobicContact CD2-CD2 3.77Å; L397-L413 HydrophobicContact CD1-CD1 3.23Å; L397-L413 HydrophobicContact CD2-CD1 4.28Å; L397-L413 HydrophobicContact CG-CD1 4.39Å; Q409-L413 WeakPolarHBondContact O-CB 3.24Å; Q409-L413 PolarHBondContact O-N 2.92Å; L410-L413 PolarHBondContact O-N 3.3Å; R411-L413 VanDerWaalsContact C-N 3.3Å; R411-L413 PolarHBondContact O-N 3.19Å; L413-S415 PolarHBondContact O-N 2.87Å; L413-R416 CarbonylContact O-C 3.46Å; L413-R416 PolarHBondContact O-N 3.41Å; L413-R416 VanDerWaalsContact O-N 3.1Å; L413-L417 WeakPolarHBondContact O-CB 3.45Å; L413-L417 PolarHBondContact O-N 2.87Å
414	G	51.4	Low	50.2	Low	2 Å²	2	54.5 Å²	54.5	2%	0.021	27%	0.267	C	S	.	.	H	α-helix	trans	-55.8	-48.7	179.8	0	0	0	0	0	112.3	L410 R416 L417 F418	L410-G414 PolarHBondContact O-N 3.43Å; G414-R416 PolarHBondContact O-N 3.45Å; G414-L417 WeakPolarHBondContact O-CB 3.39Å; G414-L417 PolarHBondContact O-N 2.83Å; G414-F418 WeakPolarHBondContact O-CD2 3.15Å; G414-F418 PolarHBondContact O-N 3.15Å
415	S	52.7	Low	50	Low	15 Å²	15	55.5 Å²	55.5	11%	0.105	28%	0.279	C	S	.	.	H	α-helix	trans	-61.5	-39.5	175.2	51	0	0	0	0	113.2	R411 Q412 L413 T419	R411-S415 PolarHBondContact O-N 3.47Å; R411-S415 PolarHBondContact O-OG 3.21Å; Q412-S415 PolarHBondContact O-OG 3.34Å; L413-S415 PolarHBondContact O-N 2.87Å; S415-T419 WeakPolarHBondContact O-CB 3.29Å; S415-T419 VanDerWaalsContact O-CG2 3.31Å; S415-T419 WeakPolarHBondContact O-CG2 3.26Å; S415-T419 PolarHBondContact O-N 3.2Å; S415-T419 VanDerWaalsContact O-N 3.13Å; S415-T419 PolarHBondContact O-OG1 2.85Å
416	R	47.6	Very low	49.5	Very low	99 Å²	99	54.1 Å²	54.1	37%	0.374	28%	0.279	S	S	.	.	H	α-helix	trans	-67.5	-33.1	174.2	-73.6	176.1	-178.6	-162.1	0.1	113.1	Q412 L413 G414 T419 S420	Q412-R416 WeakPolarHBondContact O-CD 3.49Å; Q412-R416 VanDerWaalsContact O-CG 3.25Å; Q412-R416 WeakPolarHBondContact O-CG 3.49Å; Q412-R416 PolarHBondContact O-N 2.9Å; L413-R416 CarbonylContact O-C 3.46Å; L413-R416 PolarHBondContact O-N 3.41Å; L413-R416 VanDerWaalsContact O-N 3.1Å; G414-R416 PolarHBondContact O-N 3.45Å; R416-T419 VanDerWaalsContact CA-OG1 3.32Å; R416-T419 WeakPolarHBondContact CA-OG1 3.27Å; R416-T419 PolarHBondContact O-OG1 3.27Å; R416-T419 VanDerWaalsContact O-OG1 3.1Å; R416-S420 PolarHBondContact O-N 3.04Å
417	L	54.4	Low	49	Very low	44 Å²	44	60.5 Å²	60.5	23%	0.23	32%	0.316	C	S	.	.	H	α-helix	trans	-69.1	-50.5	176.6	-170.6	145	0	0	0	111.2	L390 L413 G414 T419 S420 L421	L390-L417 HydrophobicContact CD1-CD1 3.9Å; L390-L417 HydrophobicContact CD2-CD1 3.79Å; L390-L417 HydrophobicContact CG-CD1 4.33Å; L413-L417 WeakPolarHBondContact O-CB 3.45Å; L413-L417 PolarHBondContact O-N 2.87Å; G414-L417 WeakPolarHBondContact O-CB 3.39Å; G414-L417 PolarHBondContact O-N 2.83Å; L417-T419 VanDerWaalsContact C-N 3.29Å; L417-T419 PolarHBondContact O-N 2.86Å; L417-S420 PolarHBondContact O-N 3.13Å; L417-S420 PolarHBondContact O-OG 2.79Å; L417-L421 HydrophobicContact CD2-CD1 3.67Å; L417-L421 HydrophobicContact CD2-CG 4.47Å; L417-L421 PolarHBondContact O-N 3.02Å; L417-L421 VanDerWaalsContact O-N 3.15Å
418	F	53.6	Low	48.4	Very low	30 Å²	30	66.3 Å²	66.3	13%	0.132	35%	0.345	C	S	.	.	H	α-helix	trans	-59.7	-36.3	175.3	-71.1	-64.9	0	0	0	113.2	G414 S420 L421 S422 W461 L462 F494	G414-F418 WeakPolarHBondContact O-CD2 3.15Å; G414-F418 PolarHBondContact O-N 3.15Å; F418-S420 VanDerWaalsContact C-N 3.28Å; F418-S420 PolarHBondContact O-N 3.04Å; F418-L421 PolarHBondContact O-N 3.28Å; F418-S422 PolarHBondContact O-N 3.16Å; F418-S422 VanDerWaalsContact O-N 3.08Å; F418-W461 HydrophobicContact CE2-CE3 4.48Å; F418-W461 HydrophobicContact CE2-CZ3 4.48Å; F418-L462 HydrophobicContact CZ-CD2 4.09Å; F418-F494 HydrophobicContact CE1-CE2 4.03Å; F418-F494 AromaticContact CE1-CZ 3.71Å; F418-F494 HydrophobicContact CE1-CZ 3.71Å; F418-F494 HydrophobicContact CZ-CZ 4.38Å
419	T	53.8	Low	47.8	Very low	51 Å²	51	64.2 Å²	64.2	31%	0.313	37%	0.366	S	S	.	.	H	α-helix	trans	-77.3	-7.4	176.5	53.1	0	0	0	0	114.4	S415 R416 L417 S422 H468	S415-T419 WeakPolarHBondContact O-CB 3.29Å; S415-T419 VanDerWaalsContact O-CG2 3.31Å; S415-T419 WeakPolarHBondContact O-CG2 3.26Å; S415-T419 PolarHBondContact O-N 3.2Å; S415-T419 VanDerWaalsContact O-N 3.13Å; S415-T419 PolarHBondContact O-OG1 2.85Å; R416-T419 VanDerWaalsContact CA-OG1 3.32Å; R416-T419 WeakPolarHBondContact CA-OG1 3.27Å; R416-T419 PolarHBondContact O-OG1 3.27Å; R416-T419 VanDerWaalsContact O-OG1 3.1Å; L417-T419 VanDerWaalsContact C-N 3.29Å; L417-T419 PolarHBondContact O-N 2.86Å; T419-S422 PolarHBondContact O-OG 2.83Å; T419-H468 WeakPolarHBondContact CG2-NE2 3.46Å
420	S	52.3	Low	47.4	Very low	41 Å²	41	73 Å²	73	29%	0.287	40%	0.398	S	S	.	.	H	α-helix	trans	-92.3	-24.8	166.5	70.9	0	0	0	0	113.2	R380 R416 L417 F418	R380-S420 PolarHBondContact NH2-O 2.68Å; R416-S420 PolarHBondContact O-N 3.04Å; L417-S420 PolarHBondContact O-N 3.13Å; L417-S420 PolarHBondContact O-OG 2.79Å; F418-S420 VanDerWaalsContact C-N 3.28Å; F418-S420 PolarHBondContact O-N 3.04Å
421	L	51.5	Low	47.1	Very low	34 Å²	34	76.3 Å²	76.3	18%	0.178	42%	0.423	C	S	.	.	H	α-helix	trans	-83.4	-23.4	176.1	-67.9	174.2	0	0	0	112.8	L417 F418	L417-L421 HydrophobicContact CD2-CD1 3.67Å; L417-L421 HydrophobicContact CD2-CG 4.47Å; L417-L421 PolarHBondContact O-N 3.02Å; L417-L421 VanDerWaalsContact O-N 3.15Å; F418-L421 PolarHBondContact O-N 3.28Å
422	S	48.8	Very low	47.1	Very low	28 Å²	28	75.2 Å²	75.2	20%	0.196	42%	0.423	C	S	.	.	S	Bend	trans	-62.5	133.5	175.7	51.4	0	0	0	0	111.4	R380 F418 T419 T424	R380-S422 PolarHBondContact NH2-O 2.95Å; F418-S422 PolarHBondContact O-N 3.16Å; F418-S422 VanDerWaalsContact O-N 3.08Å; T419-S422 PolarHBondContact O-OG 2.83Å; S422-T424 PolarHBondContact O-N 3.07Å
423	P	48	Very low	47.2	Very low	54 Å²	54	75.6 Å²	75.6	35%	0.351	43%	0.427	S	S	.	.			trans	-61.5	112.3	177.6	24.7	-32.9	0	0	0	109.9	N425 D432	P423-N425 PolarHBondContact O-N 3.43Å; P423-D432 WeakPolarHBondContact CB-OD2 3.33Å
424	T	42.9	Very low	47.4	Very low	91 Å²	91	74.4 Å²	74.4	56%	0.558	42%	0.421	S	S	*	.			trans	-68.4	127	169.1	49.8	0	0	0	0	108.1	S422 S426	S422-T424 PolarHBondContact O-N 3.07Å; T424-S426 VanDerWaalsContact C-N 3.32Å; T424-S426 PolarHBondContact O-N 2.7Å
425	N	38.3	Very low	47.8	Very low	165 Å²	165	75.9 Å²	75.9	88%	0.882	43%	0.43	S	S	*	.			trans	-53.2	89.6	176.7	-68.7	-5.9	0	0	0	112	P423	P423-N425 PolarHBondContact O-N 3.43Å
426	S	37.9	Very low	48.2	Very low	64 Å²	64	75.2 Å²	75.2	45%	0.448	43%	0.425	S	S	.	.			trans	-100.5	116.7	168.9	48.6	0	0	0	0	108.2	T424 D428	T424-S426 VanDerWaalsContact C-N 3.32Å; T424-S426 PolarHBondContact O-N 2.7Å; S426-D428 PolarHBondContact O-N 3.17Å
427	N	38.3	Very low	48.9	Very low	168 Å²	168	71 Å²	71	90%	0.898	41%	0.41	S	S	*	.			trans	-70.6	15.8	-179.2	-69.6	-22.1	0	0	0	114.1
428	D	36.3	Very low	49.3	Very low	132 Å²	132	68.9 Å²	68.9	71%	0.706	40%	0.399	S	S	*	.	S	Bend	trans	-97	118.9	177.7	-72.9	-34.8	0	0	0	109.6	S426 R430	S426-D428 PolarHBondContact O-N 3.17Å; D428-R430 PolarHBondContact O-N 2.88Å
429	G	39.7	Very low	49.8	Very low	93 Å²	93	68.1 Å²	68.1	96%	0.959	40%	0.396	S	S	*	.			trans	-70.9	57.1	-171.3	0	0	0	0	0	116
430	R	41.2	Very low	50	Low	217 Å²	217	66.4 Å²	66.4	82%	0.819	39%	0.385	S	S	*	.			trans	-104.3	131.3	165.2	-72.8	-177.6	171.8	-177.7	-2.5	109	D428 D432	D428-R430 PolarHBondContact O-N 2.88Å; R430-D432 PolarHBondContact O-N 3.44Å; R430-D432 VanDerWaalsContact O-N 3.15Å
431	S	45.3	Very low	50.4	Low	85 Å²	85	64.8 Å²	64.8	59%	0.594	38%	0.375	S	S	*	.			trans	-67.9	109	175.8	53.6	0	0	0	0	110.2	L433	S431-L433 PolarHBondContact O-N 2.88Å
432	D	50.7	Low	51	Low	66 Å²	66	63.4 Å²	63.4	35%	0.353	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-53.2	124.3	174	-83.7	-21.2	0	0	0	110.6	P423 R430 R491	P423-D432 WeakPolarHBondContact CB-OD2 3.33Å; R430-D432 PolarHBondContact O-N 3.44Å; R430-D432 VanDerWaalsContact O-N 3.15Å; D432-R491 WeakPolarHBondContact O-CD 3.42Å; D432-R491 PolarHBondContact O-NE 3.32Å; D432-R491 PolarHBondContact O-NH1 2.94Å
433	L	55.1	Low	51.4	Low	78 Å²	78	63.4 Å²	63.4	41%	0.408	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-70.6	146.5	-176.2	-59.4	178.8	0	0	0	111.2	E346 S431	E346-L433 WeakPolarHBondContact O-CD2 3.42Å; S431-L433 PolarHBondContact O-N 2.88Å
434	P	55.7	Low	51.5	Low	6 Å²	6	68.9 Å²	68.9	4%	0.039	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-69.4	136.1	176.7	28.5	-33.2	0	0	0	111.8	A240 D348 R491	A240-P434 HydrophobicContact CB-CB 3.61Å; D348-P434 PolarHBondContact N-O 3.46Å; P434-R491 WeakPolarHBondContact CA-O 3.44Å; P434-R491 HydrophobicContact CB-CB 4.48Å
435	V	59	Low	51.8	Low	33 Å²	33	66.3 Å²	66.3	20%	0.2	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	124.7	-178.1	-178.7	0	0	0	0	109.9	D348 I350 V437 R491 T492 R493	D348-V435 WeakPolarHBondContact O-CA 3.23Å; I350-V435 HydrophobicContact CD1-CG1 3.99Å; V435-V437 HydrophobicContact CG1-CG2 4.26Å; V435-R491 PolarHBondContact N-O 3.39Å; V435-T492 WeakPolarHBondContact O-CA 3.39Å; V435-R493 PolarHBondContact O-N 3.15Å
436	I	62	Low	52.2	Low	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	120.1	177.4	-59.7	162.3	0	0	0	108.2	C237 D348 I349 I350 I438 I495	C237-I436 HydrophobicContact CB-CD1 3.72Å; D348-I436 PolarHBondContact O-N 2.96Å; I349-I436 WeakPolarHBondContact CA-O 3.38Å; I349-I436 HydrophobicContact CG1-CB 4.17Å; I349-I436 HydrophobicContact CG1-CD1 4.14Å; I349-I436 HydrophobicContact CG2-CB 4.38Å; I349-I436 HydrophobicContact CG2-CG2 4.37Å; I350-I436 PolarHBondContact N-O 3.26Å; I436-I438 HydrophobicContact CG2-CD1 4.49Å; I436-I438 HydrophobicContact CG2-CG1 4.1Å; I436-I495 HydrophobicContact CG2-CD1 4.22Å
437	V	61.9	Low	52.3	Low	11 Å²	11	60.7 Å²	60.7	7%	0.067	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	124.2	177.3	-175.8	0	0	0	0	109.4	I350 V435 I439 R493 F494 I495	I350-V437 HydrophobicContact CB-CG2 4.35Å; I350-V437 HydrophobicContact CD1-CG2 4.38Å; I350-V437 HydrophobicContact CG2-CG1 4.26Å; I350-V437 WeakPolarHBondContact O-CA 3.44Å; V435-V437 HydrophobicContact CG1-CG2 4.26Å; V437-I439 HydrophobicContact CG1-CG1 4.29Å; V437-R493 PolarHBondContact N-O 3.42Å; V437-F494 HydrophobicContact CB-CD1 3.77Å; V437-F494 HydrophobicContact CB-CE1 3.73Å; V437-F494 HydrophobicContact CB-CG 4.45Å; V437-F494 HydrophobicContact CB-CZ 4.38Å; V437-F494 HydrophobicContact CG1-CD1 3.97Å; V437-F494 HydrophobicContact CG1-CE1 3.77Å; V437-F494 HydrophobicContact CG2-CE1 4.07Å; V437-F494 HydrophobicContact CG2-CZ 4.28Å; V437-F494 CarbonylContact O-C 3.57Å; V437-F494 WeakPolarHBondContact O-CA 3.27Å; V437-I495 PolarHBondContact O-N 3.31Å
438	I	63.1	Low	52.3	Low	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	125.8	178.6	-50	-177.2	0	0	0	108.9	W308 L309 I349 I350 F351 I352 I436 I495	W308-I438 HydrophobicContact CZ3-CD1 4.42Å; L309-I438 HydrophobicContact CD1-CD1 4.33Å; L309-I438 HydrophobicContact CD2-CD1 4.14Å; I349-I438 HydrophobicContact CG2-CD1 3.81Å; I349-I438 HydrophobicContact CG2-CG1 4.15Å; I350-I438 PolarHBondContact O-N 3.36Å; F351-I438 HydrophobicContact CD2-CB 3.74Å; F351-I438 HydrophobicContact CD2-CD1 4.1Å; F351-I438 HydrophobicContact CD2-CG1 4.44Å; F351-I438 HydrophobicContact CD2-CG2 3.69Å; F351-I438 HydrophobicContact CE2-CB 4.4Å; F351-I438 HydrophobicContact CE2-CG2 3.82Å; I352-I438 PolarHBondContact N-O 3.45Å; I436-I438 HydrophobicContact CG2-CD1 4.49Å; I436-I438 HydrophobicContact CG2-CG1 4.1Å; I438-I495 WeakPolarHBondContact CA-O 3.48Å; I438-I495 HydrophobicContact CD1-CD1 4.32Å; I438-I495 HydrophobicContact CG1-CB 4.21Å; I438-I495 HydrophobicContact CG1-CD1 4.27Å; I438-I495 HydrophobicContact CG2-CB 4.35Å; I438-I495 HydrophobicContact CG2-CG2 4.45Å
439	I	63.4	Low	52.1	Low	13 Å²	13	59.7 Å²	59.7	7%	0.067	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	109.6	175.7	-49	-179.8	0	0	0	108.1	F355 V437 L442 I495 L496 T497	F355-I439 HydrophobicContact CZ-CG2 4.48Å; V437-I439 HydrophobicContact CG1-CG1 4.29Å; I439-L442 HydrophobicContact CB-CD1 4.23Å; I439-L442 HydrophobicContact CD1-CD1 4.35Å; I439-L442 HydrophobicContact CG2-CD1 3.96Å; I439-I495 PolarHBondContact N-O 3.33Å; I439-L496 HydrophobicContact CB-CD2 4.03Å; I439-L496 HydrophobicContact CD1-CD2 3.88Å; I439-L496 HydrophobicContact CG1-CD2 4.04Å; I439-T497 PolarHBondContact O-N 3.01Å; I439-T497 VanDerWaalsContact O-N 3.1Å
440	D	59.7	Low	52	Low	15 Å²	15	57.1 Å²	57.1	8%	0.08	30%	0.296	C	S	.	.	S	Bend	trans	-88.8	140.9	170.8	-155.8	12.9	0	0	0	109.9	T302 I352 T497	T302-D440 WeakPolarHBondContact CA-OD2 3.45Å; T302-D440 VanDerWaalsContact CB-OD2 3.24Å; T302-D440 WeakPolarHBondContact CB-OD2 3.42Å; T302-D440 VanDerWaalsContact CG2-OD2 3.28Å; T302-D440 WeakPolarHBondContact CG2-OD2 3.25Å; T302-D440 PolarHBondContact OG1-OD2 3.43Å; I352-D440 PolarHBondContact O-N 3.36Å; D440-T497 WeakPolarHBondContact CA-OG1 3.31Å; D440-T497 WeakPolarHBondContact OD1-CB 3.24Å; D440-T497 VanDerWaalsContact OD1-CG2 3.27Å; D440-T497 WeakPolarHBondContact OD1-CG2 3.29Å; D440-T497 PolarHBondContact OD1-OG1 3.18Å
441	G	59.7	Low	51.7	Low	7 Å²	7	56 Å²	56	7%	0.072	30%	0.301	C	S	.	.			trans	72.6	45.9	174.3	0	0	0	0	0	115.6	E443 Y444 T497	G441-E443 PolarHBondContact O-N 3.46Å; G441-Y444 VanDerWaalsContact O-CD2 3.27Å; G441-Y444 WeakPolarHBondContact O-CD2 3.15Å; G441-Y444 PolarHBondContact O-N 3.05Å; G441-T497 PolarHBondContact N-OG1 2.93Å
442	L	63.8	Low	51.4	Low	5 Å²	5	55.1 Å²	55.1	3%	0.026	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-61	-14.4	-178.9	-146.3	122.6	0	0	0	114.3	I439 L496 T497 I504	I439-L442 HydrophobicContact CB-CD1 4.23Å; I439-L442 HydrophobicContact CD1-CD1 4.35Å; I439-L442 HydrophobicContact CG2-CD1 3.96Å; L442-L496 HydrophobicContact CD1-CB 4.38Å; L442-L496 HydrophobicContact CD1-CD1 4.38Å; L442-L496 HydrophobicContact CD1-CD2 3.83Å; L442-L496 HydrophobicContact CD1-CG 4.41Å; L442-T497 WeakPolarHBondContact CB-O 3.34Å; L442-T497 PolarHBondContact N-O 3.48Å; L442-I504 HydrophobicContact CD2-CD1 4.15Å; L442-I504 HydrophobicContact CD2-CG2 3.69Å
443	E	57.2	Low	50.9	Low	28 Å²	28	56.1 Å²	56.1	13%	0.131	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-71.3	-21.7	174.5	59	-158.2	174.7	0	0	114.3	G441 L445 E446 S499 H502	G441-E443 PolarHBondContact O-N 3.46Å; E443-L445 PolarHBondContact O-N 2.88Å; E443-E446 PolarHBondContact O-N 2.95Å; E443-S499 WeakPolarHBondContact OE2-CB 3.47Å; E443-S499 PolarHBondContact OE2-N 3.31Å; E443-S499 PolarHBondContact OE2-OG 3.42Å; E443-H502 IonicContact OE2-CD2 2.73Å
444	Y	50.8	Low	49.9	Very low	170 Å²	170	57 Å²	57	67%	0.667	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-75.7	-2.6	176.5	-61.8	-66.7	0	0	0	114.3	G441	G441-Y444 VanDerWaalsContact O-CD2 3.27Å; G441-Y444 WeakPolarHBondContact O-CD2 3.15Å; G441-Y444 PolarHBondContact O-N 3.05Å
445	L	48.7	Very low	48.8	Very low	37 Å²	37	57.5 Å²	57.5	19%	0.194	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-92.2	-11.8	173.8	-74.1	170.6	0	0	0	113.5	F355 T398 E443	F355-L445 HydrophobicContact CD1-CD2 4.12Å; F355-L445 HydrophobicContact CE1-CD1 4.21Å; F355-L445 HydrophobicContact CE1-CD2 3.65Å; F355-L445 HydrophobicContact CE1-CG 4Å; F355-L445 HydrophobicContact CE2-CG 4.4Å; F355-L445 HydrophobicContact CZ-CD1 3.83Å; F355-L445 HydrophobicContact CZ-CD2 4.07Å; F355-L445 HydrophobicContact CZ-CG 3.88Å; T398-L445 HydrophobicContact CG2-CD2 4.33Å; E443-L445 PolarHBondContact O-N 2.88Å
446	E	46.6	Very low	47.8	Very low	38 Å²	38	58.7 Å²	58.7	18%	0.178	32%	0.323	C	S	.	.	S	Bend	trans	-90.3	124.4	167.6	-74.1	-177.1	137.8	0	0	108.9	E443 P448 I459 H502 I504	E443-E446 PolarHBondContact O-N 2.95Å; E446-P448 WeakPolarHBondContact O-CD 3.46Å; E446-I459 HydrophobicContact CG-CD1 4.37Å; E446-H502 IonicContact OE2-CE1 2.9Å; E446-H502 PolarHBondContact OE2-CE1 2.87Å; E446-H502 IonicContact OE2-ND1 3.67Å; E446-H502 PolarHBondContact OE2-ND1 2.92Å; E446-I504 HydrophobicContact CG-CD1 4.07Å; E446-I504 HydrophobicContact CG-CG1 4.5Å; E446-I504 WeakPolarHBondContact OE2-CD1 3.45Å; E446-I504 VanDerWaalsContact OE2-CG1 3.29Å; E446-I504 WeakPolarHBondContact OE2-CG1 3.45Å
447	D	40.4	Very low	46.7	Very low	73 Å²	73	62.5 Å²	62.5	39%	0.39	34%	0.339	S	S	.	.			trans	-74.6	116.1	174	-167.3	-29.6	0	0	0	108.9	R406 L449 A450	R406-D447 IonicContact NH1-OD2 2.7Å; R406-D447 PolarHBondContact NH1-OD2 3.38Å; D447-L449 PolarHBondContact O-N 3.44Å; D447-L449 PolarHBondContact OD1-N 3.31Å; D447-L449 VanDerWaalsContact OD1-N 3.1Å; D447-A450 HydrophobicContact CB-CB 4.43Å; D447-A450 VanDerWaalsContact O-CB 3.28Å; D447-A450 WeakPolarHBondContact O-CB 3.17Å; D447-A450 PolarHBondContact O-N 3.47Å
448	P	38	Very low	45.8	Very low	130 Å²	130	62.9 Å²	62.9	84%	0.844	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-4.6	-176.9	29.4	-35.9	0	0	0	113.6	E446	E446-P448 WeakPolarHBondContact O-CD 3.46Å
449	L	31.7	Very low	45.1	Very low	148 Å²	148	64.1 Å²	64.1	78%	0.775	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	7.8	173.6	-65.4	172.2	0	0	0	113.4	D447 E451	D447-L449 PolarHBondContact O-N 3.44Å; D447-L449 PolarHBondContact OD1-N 3.31Å; D447-L449 VanDerWaalsContact OD1-N 3.1Å; L449-E451 PolarHBondContact O-N 2.79Å
450	A	38.6	Very low	44.3	Very low	39 Å²	39	66.4 Å²	66.4	32%	0.322	36%	0.361	S	S	.	.			trans	-66.7	104.6	-179.7	0	0	0	0	0	113.2	D447 T452 A455	D447-A450 HydrophobicContact CB-CB 4.43Å; D447-A450 VanDerWaalsContact O-CB 3.28Å; D447-A450 WeakPolarHBondContact O-CB 3.17Å; D447-A450 PolarHBondContact O-N 3.47Å; A450-T452 VanDerWaalsContact C-N 3.28Å; A450-T452 PolarHBondContact O-N 2.91Å; A450-A455 HydrophobicContact CB-CB 3.42Å; A450-A455 VanDerWaalsContact CB-CB 3.42Å
451	E	35	Very low	43.7	Very low	194 Å²	194	67.3 Å²	67.3	91%	0.907	36%	0.363	S	S	*	.			trans	-77.6	-8.3	179.9	-60.9	-171.1	152.7	0	0	113.8	L449	L449-E451 PolarHBondContact O-N 2.79Å
452	T	37.7	Very low	43	Very low	67 Å²	67	67.9 Å²	67.9	41%	0.411	37%	0.365	S	S	.	.	S	Bend	trans	-116.4	141.6	-174.4	74.3	0	0	0	0	113.9	A450 E454 A455	A450-T452 VanDerWaalsContact C-N 3.28Å; A450-T452 PolarHBondContact O-N 2.91Å; T452-E454 PolarHBondContact O-N 3.5Å; T452-A455 PolarHBondContact O-N 3.31Å
453	A	41.1	Very low	41.9	Very low	86 Å²	86	70.2 Å²	70.2	71%	0.711	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-4	177	0	0	0	0	0	114.4
454	E	33.2	Very low	41.1	Very low	97 Å²	97	70.7 Å²	70.7	45%	0.453	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-24	175.4	-58.7	-139.5	111.6	0	0	112.8	T452 V456 K457	T452-E454 PolarHBondContact O-N 3.5Å; E454-V456 PolarHBondContact O-N 3.41Å; E454-K457 WeakPolarHBondContact O-CA 3.38Å; E454-K457 WeakPolarHBondContact O-CB 3.21Å; E454-K457 PolarHBondContact O-N 2.96Å; E454-K457 IonicContact OE1-NZ 2.8Å; E454-K457 PolarHBondContact OE1-NZ 2.9Å
455	A	33.2	Very low	40.2	Very low	16 Å²	16	65.8 Å²	65.8	13%	0.132	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-62.1	-33.8	172.2	0	0	0	0	0	112.2	A450 T452 K457 C458	A450-A455 HydrophobicContact CB-CB 3.42Å; A450-A455 VanDerWaalsContact CB-CB 3.42Å; T452-A455 PolarHBondContact O-N 3.31Å; A455-K457 PolarHBondContact O-N 2.98Å; A455-K457 VanDerWaalsContact O-N 3.16Å; A455-C458 VanDerWaalsContact O-CB 3.22Å; A455-C458 WeakPolarHBondContact O-CB 3.33Å; A455-C458 PolarHBondContact O-N 3.46Å; A455-C458 PolarHBondContact O-SG 3.16Å
456	V	37.2	Very low	39.6	Very low	59 Å²	59	70.9 Å²	70.9	36%	0.358	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-60.9	-22	172.9	-174	0	0	0	0	112.1	E454 C458 Y503	E454-V456 PolarHBondContact O-N 3.41Å; V456-C458 PolarHBondContact O-N 2.74Å; V456-Y503 HydrophobicContact CG1-CD1 3.87Å; V456-Y503 HydrophobicContact CG1-CE1 3.5Å
457	K	40.8	Very low	38.9	Very low	79 Å²	79	73.9 Å²	73.9	34%	0.343	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-77	-0.4	174.5	-57.2	178.5	-174.4	172.7	0	113.4	E454 A455 I459 D460	E454-K457 WeakPolarHBondContact O-CA 3.38Å; E454-K457 WeakPolarHBondContact O-CB 3.21Å; E454-K457 PolarHBondContact O-N 2.96Å; E454-K457 IonicContact OE1-NZ 2.8Å; E454-K457 PolarHBondContact OE1-NZ 2.9Å; A455-K457 PolarHBondContact O-N 2.98Å; A455-K457 VanDerWaalsContact O-N 3.16Å; K457-I459 PolarHBondContact O-N 3.25Å; K457-D460 WeakPolarHBondContact CB-OD2 3.34Å; K457-D460 VanDerWaalsContact O-CB 3.3Å; K457-D460 WeakPolarHBondContact O-CB 3.22Å; K457-D460 PolarHBondContact O-N 2.82Å
458	C	43.1	Very low	38.5	Very low	20 Å²	20	76.7 Å²	76.7	14%	0.135	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-64.9	-4.9	175.7	-69.9	0	0	0	0	114	L410 A455 V456 W461	L410-C458 HydrophobicContact CD1-CB 4.25Å; A455-C458 VanDerWaalsContact O-CB 3.22Å; A455-C458 WeakPolarHBondContact O-CB 3.33Å; A455-C458 PolarHBondContact O-N 3.46Å; A455-C458 PolarHBondContact O-SG 3.16Å; V456-C458 PolarHBondContact O-N 2.74Å; C458-W461 PolarHBondContact O-NE1 2.96Å
459	I	47.4	Very low	38.1	Very low	26 Å²	26	76.2 Å²	76.2	13%	0.133	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-97.5	-12.2	174	-63.7	171.6	0	0	0	112	E446 K457 W461 L462 F463 I504	E446-I459 HydrophobicContact CG-CD1 4.37Å; K457-I459 PolarHBondContact O-N 3.25Å; I459-W461 PolarHBondContact O-N 3.41Å; I459-L462 HydrophobicContact CG2-CD1 4.3Å; I459-L462 PolarHBondContact O-N 3.17Å; I459-F463 HydrophobicContact CG2-CE2 4.2Å; I459-I504 HydrophobicContact CD1-CB 4.39Å; I459-I504 HydrophobicContact CD1-CD1 3.59Å; I459-I504 HydrophobicContact CD1-CG1 3.57Å; I459-I504 HydrophobicContact CD1-CG2 4.06Å
460	D	45.6	Very low	37.9	Very low	61 Å²	61	78.7 Å²	78.7	33%	0.326	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-58.2	-17.9	180	-73.9	-10.9	0	0	0	113.6	R411 K457 L462 F463 S464	R411-D460 IonicContact CZ-OD2 3.31Å; R411-D460 IonicContact NE-OD2 2.8Å; R411-D460 IonicContact NH2-OD2 2.96Å; R411-D460 PolarHBondContact NH2-OD2 3.45Å; K457-D460 WeakPolarHBondContact CB-OD2 3.34Å; K457-D460 VanDerWaalsContact O-CB 3.3Å; K457-D460 WeakPolarHBondContact O-CB 3.22Å; K457-D460 PolarHBondContact O-N 2.82Å; D460-L462 PolarHBondContact O-N 3.4Å; D460-F463 CarbonylContact O-C 3.58Å; D460-F463 WeakPolarHBondContact O-CA 3.25Å; D460-F463 PolarHBondContact O-N 3.43Å; D460-S464 WeakPolarHBondContact O-CB 3.5Å; D460-S464 PolarHBondContact O-N 3.41Å
461	W	47.5	Very low	37.4	Very low	33 Å²	33	86 Å²	86	13%	0.125	46%	0.463	C	S	.	.	G	3₁₀ helix	trans	-66.1	-24.5	175.8	70.6	-99.2	0	0	0	113.4	L410 R411 F418 C458 I459 F463 S464	L410-W461 HydrophobicContact CB-CG 4.5Å; L410-W461 WeakPolarHBondContact O-CB 3.36Å; R411-W461 HydrophobicContact CB-CB 4.44Å; R411-W461 HydrophobicContact CG-CB 4.16Å; F418-W461 HydrophobicContact CE2-CE3 4.48Å; F418-W461 HydrophobicContact CE2-CZ3 4.48Å; C458-W461 PolarHBondContact O-NE1 2.96Å; I459-W461 PolarHBondContact O-N 3.41Å; W461-F463 PolarHBondContact O-N 3.2Å; W461-S464 WeakPolarHBondContact CA-OG 3.46Å
462	L	45.8	Very low	36.9	Very low	20 Å²	20	82.6 Å²	82.6	11%	0.105	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-71.5	-8.1	169	-78.1	173.3	0	0	0	112.6	F418 I459 D460 P486	F418-L462 HydrophobicContact CZ-CD2 4.09Å; I459-L462 HydrophobicContact CG2-CD1 4.3Å; I459-L462 PolarHBondContact O-N 3.17Å; D460-L462 PolarHBondContact O-N 3.4Å; L462-P486 WeakPolarHBondContact O-CB 3.46Å; L462-P486 VanDerWaalsContact O-CG 3.31Å; L462-P486 WeakPolarHBondContact O-CG 3.16Å
463	F	40.8	Very low	36.3	Very low	54 Å²	54	86.7 Å²	86.7	24%	0.237	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.4	-10.8	-174.5	-62.6	-83.2	0	0	0	113.3	I459 D460 W461 C465 P486 L508	I459-F463 HydrophobicContact CG2-CE2 4.2Å; D460-F463 CarbonylContact O-C 3.58Å; D460-F463 WeakPolarHBondContact O-CA 3.25Å; D460-F463 PolarHBondContact O-N 3.43Å; W461-F463 PolarHBondContact O-N 3.2Å; F463-C465 PolarHBondContact O-N 2.95Å; F463-P486 HydrophobicContact CD1-CG 4.39Å; F463-L508 HydrophobicContact CE2-CD2 4.5Å; F463-L508 HydrophobicContact CZ-CD2 3.93Å
464	S	39.3	Very low	35.5	Very low	38 Å²	38	90.2 Å²	90.2	27%	0.266	48%	0.478	S	S	.	.			trans	-89.6	97.5	-174.9	68.6	0	0	0	0	112.8	D460 W461	D460-S464 WeakPolarHBondContact O-CB 3.5Å; D460-S464 PolarHBondContact O-N 3.41Å; W461-S464 WeakPolarHBondContact CA-OG 3.46Å
465	C	33.5	Very low	35.1	Very low	67 Å²	67	93 Å²	93	45%	0.453	50%	0.496	S	S	.	.			trans	-73.3	123.9	170.2	-65.4	0	0	0	0	111.4	F463 L485	F463-C465 PolarHBondContact O-N 2.95Å; C465-L485 PolarHBondContact SG-O 2.8Å
466	H	34.8	Very low	34.7	Very low	144 Å²	144	101.2 Å²	101.2	67%	0.667	53%	0.532	S	S	*	.			trans	-107.8	128.6	156	-95.9	-15.7	0	0	0	108.4
467	A	31.6	Very low	34	Very low	100 Å²	100	109 Å²	109	83%	0.826	56%	0.556	S	S	*	*			trans	-64.3	145.3	-178.7	0	0	0	0	0	111.3	T469	A467-T469 PolarHBondContact O-N 3.29Å
468	H	32.5	Very low	33.1	Very low	132 Å²	132	108.6 Å²	108.6	61%	0.611	57%	0.574	S	S	*	*			trans	-65.1	128.7	176.5	-103.3	-67.7	0	0	0	110.9	T419	T419-H468 WeakPolarHBondContact CG2-NE2 3.46Å
469	T	29	Very low	32.3	Very low	121 Å²	121	110.4 Å²	110.4	74%	0.742	60%	0.596	S	S	*	*			trans	-44.4	139.2	176.6	50.8	0	0	0	0	116.1	A467	A467-T469 PolarHBondContact O-N 3.29Å
470	K	29.1	Very low	31.2	Very low	199 Å²	199	117.2 Å²	117.2	87%	0.865	63%	0.631	S	S	*	*				-160.8	152.2	125.5	-108	168	-173.8	-177.2	0	111.8	T472	K470-T472 PolarHBondContact O-N 3.33Å
471	E	26.6	Very low	30.3	Very low	194 Å²	194	121.8 Å²	121.8	91%	0.907	66%	0.656	S	S	*	*			trans	-82.4	93.1	-173.2	-60.9	160.3	127.3	0	0	111.7
472	T	25.1	Very low	29.3	Very low	122 Å²	122	123.8 Å²	123.8	75%	0.748	68%	0.675	S	S	*	*			trans	-155	130.9	162	40.2	0	0	0	0	111	K470	K470-T472 PolarHBondContact O-N 3.33Å
473	D	25.1	Very low	28.4	Very low	153 Å²	153	126.5 Å²	126.5	82%	0.818	71%	0.708	S	S	*	*			trans	57.5	114.1	164.3	-56.7	-26.8	0	0	0	120.5	N475	D473-N475 VanDerWaalsContact C-N 3.31Å; D473-N475 PolarHBondContact O-N 2.89Å
474	M	24.7	Very low	27.9	Very low	160 Å²	160	126 Å²	126	79%	0.788	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	11.6	-173.7	-75.9	-81.5	-77	0	0	115.6
475	N	24.6	Very low	27.6	Very low	155 Å²	155	128 Å²	128	83%	0.829	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	2.2	-165	-78.5	-3.8	0	0	0	116.5	D473	D473-N475 VanDerWaalsContact C-N 3.31Å; D473-N475 PolarHBondContact O-N 2.89Å
476	E	23.6	Very low	28	Very low	189 Å²	189	125.7 Å²	125.7	88%	0.883	71%	0.709	S	S	*	*			trans	-119.5	77.1	175.9	-69.8	-170.5	173.4	0	0	112.7	G478	E476-G478 PolarHBondContact O-N 3Å
477	Y	23.4	Very low	28.6	Very low	223 Å²	223	125.3 Å²	125.3	88%	0.875	71%	0.71	S	S	*	*			trans	-79.6	64.8	164.8	-90.9	-86.3	0	0	0	111
478	G	23	Very low	29.7	Very low	70 Å²	70	120.8 Å²	120.8	72%	0.722	67%	0.673	S	S	*	*			trans	-90.9	122.2	179.1	0	0	0	0	0	114.1	E476	E476-G478 PolarHBondContact O-N 3Å
479	G	24.8	Very low	30.8	Very low	58 Å²	58	115.2 Å²	115.2	60%	0.598	65%	0.648	S	S	*	*			trans	56.9	95.2	152	0	0	0	0	0	119.4	N481	G479-N481 PolarHBondContact O-N 3.42Å
480	I	24.6	Very low	31.9	Very low	168 Å²	168	112.1 Å²	112.1	86%	0.862	63%	0.631	S	S	*	*			trans	-77	69.8	160.3	-52.5	178	0	0	0	109.1	S482	I480-S482 VanDerWaalsContact C-N 3.33Å; I480-S482 PolarHBondContact O-N 3Å
481	N	25.9	Very low	33.4	Very low	158 Å²	158	104.5 Å²	104.5	85%	0.845	60%	0.597	S	S	*	*			trans	-94.5	45.9	-176.6	-73.8	9.8	0	0	0	112.9	G479	G479-N481 PolarHBondContact O-N 3.42Å
482	S	27.4	Very low	35	Very low	75 Å²	75	95.5 Å²	95.5	52%	0.524	56%	0.555	S	S	.	*	S	Bend	trans	-150.1	115.8	159	55.4	0	0	0	0	110.3	I480 G484	I480-S482 VanDerWaalsContact C-N 3.33Å; I480-S482 PolarHBondContact O-N 3Å; S482-G484 VanDerWaalsContact C-N 3.35Å; S482-G484 PolarHBondContact O-N 3.03Å
483	G	28	Very low	36.9	Very low	77 Å²	77	90 Å²	90	79%	0.794	52%	0.521	S	S	*	.			trans	-74.2	76.6	-173.1	0	0	0	0	0	113.9	L485	G483-L485 VanDerWaalsContact C-N 3.34Å; G483-L485 PolarHBondContact O-N 2.71Å
484	G	28.5	Very low	38.8	Very low	44 Å²	44	83.2 Å²	83.2	45%	0.454	48%	0.484	S	S	.	.	S	Bend	trans	61.2	30.7	163	0	0	0	0	0	116.2	S482	S482-G484 VanDerWaalsContact C-N 3.35Å; S482-G484 PolarHBondContact O-N 3.03Å
485	L	34.2	Very low	40.8	Very low	79 Å²	79	75.6 Å²	75.6	41%	0.414	45%	0.446	S	S	.	.			trans	-101.2	132.1	176.9	-71.9	169.8	0	0	0	110.9	C465 G483 I487 L513	C465-L485 PolarHBondContact SG-O 2.8Å; G483-L485 VanDerWaalsContact C-N 3.34Å; G483-L485 PolarHBondContact O-N 2.71Å; L485-I487 PolarHBondContact O-N 2.67Å; L485-L513 HydrophobicContact CD2-CD1 4.15Å
486	P	42	Very low	42.9	Very low	18 Å²	18	68.4 Å²	68.4	12%	0.117	41%	0.408	C	S	.	.			trans	-70.7	129.4	-179	25.4	-32.7	0	0	0	112.8	L462 F463 I488 L513	L462-P486 WeakPolarHBondContact O-CB 3.46Å; L462-P486 VanDerWaalsContact O-CG 3.31Å; L462-P486 WeakPolarHBondContact O-CG 3.16Å; F463-P486 HydrophobicContact CD1-CG 4.39Å; P486-I488 VanDerWaalsContact C-N 3.29Å; P486-I488 HydrophobicContact CB-CG1 4.43Å; P486-I488 PolarHBondContact O-N 2.73Å; P486-L513 HydrophobicContact CG-CD1 4.44Å
487	I	46.5	Very low	44.9	Very low	136 Å²	136	59.6 Å²	59.6	70%	0.697	37%	0.367	S	S	*	.			trans	-79.5	81.4	167	-53.4	175.7	0	0	0	108.2	L485	L485-I487 PolarHBondContact O-N 2.67Å
488	I	55.1	Low	47	Very low	6 Å²	6	49 Å²	49	3%	0.031	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-64.9	128.2	170.3	-63.5	168.9	0	0	0	108.2	R289 I290 P486 T492 F494	R289-I488 HydrophobicContact CB-CB 4.48Å; R289-I488 HydrophobicContact CB-CD1 3.84Å; R289-I488 HydrophobicContact CB-CG2 4.27Å; R289-I488 PolarHBondContact NH1-O 2.9Å; I290-I488 HydrophobicContact CD1-CD1 3.86Å; I290-I488 HydrophobicContact CG1-CD1 3.56Å; P486-I488 VanDerWaalsContact C-N 3.29Å; P486-I488 HydrophobicContact CB-CG1 4.43Å; P486-I488 PolarHBondContact O-N 2.73Å; I488-T492 HydrophobicContact CG2-CG2 4.18Å; I488-F494 HydrophobicContact CD1-CD2 4.19Å; I488-F494 HydrophobicContact CG1-CE2 4.38Å; I488-F494 HydrophobicContact CG2-CD2 4.32Å; I488-F494 HydrophobicContact CG2-CE2 4.1Å
489	P	54.9	Low	49	Very low	15 Å²	15	45.8 Å²	45.8	10%	0.097	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-57.4	157.1	178.2	-24.8	34	0	0	0	113.6	T492	P489-T492 PolarHBondContact O-N 3.26Å
490	S	53.9	Low	50.5	Low	55 Å²	55	45.4 Å²	45.4	39%	0.385	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	155.1	166.5	39.7	0	0	0	0	110.9	T492	S490-T492 PolarHBondContact O-N 3.49Å; S490-T492 PolarHBondContact O-OG1 3.09Å
491	R	58.9	Low	51.8	Low	40 Å²	40	41.9 Å²	41.9	15%	0.151	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.6	5.2	-176.6	-63.9	-170.1	160.4	133.5	8.7	116.5	E244 D432 P434 V435	E244-R491 IonicContact OE1-CZ 3.41Å; E244-R491 IonicContact OE1-NE 3.91Å; E244-R491 IonicContact OE1-NH1 3.51Å; E244-R491 PolarHBondContact OE1-NH1 3.02Å; E244-R491 IonicContact OE1-NH2 2.66Å; E244-R491 PolarHBondContact OE1-NH2 3.14Å; E244-R491 IonicContact OE2-CZ 3.69Å; E244-R491 VanDerWaalsContact OE2-CZ 3.24Å; E244-R491 IonicContact OE2-NH1 3.97Å; E244-R491 PolarHBondContact OE2-NH1 2.9Å; E244-R491 IonicContact OE2-NH2 3.68Å; E244-R491 PolarHBondContact OE2-NH2 3.5Å; D432-R491 WeakPolarHBondContact O-CD 3.42Å; D432-R491 PolarHBondContact O-NE 3.32Å; D432-R491 PolarHBondContact O-NH1 2.94Å; P434-R491 WeakPolarHBondContact CA-O 3.44Å; P434-R491 HydrophobicContact CB-CB 4.48Å; V435-R491 PolarHBondContact N-O 3.39Å
492	T	61.8	Low	53.3	Low	4 Å²	4	37.1 Å²	37.1	3%	0.025	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	142.6	175.6	-50.2	0	0	0	0	111.2	V435 I488 P489 S490 F494	V435-T492 WeakPolarHBondContact O-CA 3.39Å; I488-T492 HydrophobicContact CG2-CG2 4.18Å; P489-T492 PolarHBondContact O-N 3.26Å; S490-T492 PolarHBondContact O-N 3.49Å; S490-T492 PolarHBondContact O-OG1 3.09Å; T492-F494 HydrophobicContact CG2-CD2 4.35Å; T492-F494 HydrophobicContact CG2-CE2 3.79Å; T492-F494 HydrophobicContact CG2-CZ 4.46Å
493	R	63.1	Low	54.4	Low	7 Å²	7	39.4 Å²	39.4	3%	0.026	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	144.2	172	-65.9	-64	-176.4	-90.1	1.4	111.5	F236 S239 A240 D243 V435 V437	F236-R493 HydrophobicContact CE1-CB 3.97Å; F236-R493 HydrophobicContact CE1-CG 4.37Å; F236-R493 HydrophobicContact CZ-CB 4.35Å; S239-R493 PolarHBondContact O-NH2 3.16Å; S239-R493 PolarHBondContact OG-NE 3.22Å; S239-R493 PolarHBondContact OG-NH2 2.8Å; A240-R493 HydrophobicContact CB-CG 3.75Å; D243-R493 VanDerWaalsContact CG-NH2 3.29Å; D243-R493 IonicContact OD1-CZ 3.06Å; D243-R493 IonicContact OD1-NH1 2.83Å; D243-R493 IonicContact OD1-NH2 2.78Å; D243-R493 PolarHBondContact OD1-NH2 3.49Å; D243-R493 IonicContact OD2-CZ 3.7Å; D243-R493 IonicContact OD2-NH1 3.76Å; D243-R493 PolarHBondContact OD2-NH1 3.08Å; D243-R493 IonicContact OD2-NH2 2.76Å; D243-R493 PolarHBondContact OD2-NH2 3.48Å; D243-R493 VanDerWaalsContact OD2-NH2 3.14Å; V435-R493 PolarHBondContact O-N 3.15Å; V437-R493 PolarHBondContact N-O 3.42Å
494	F	65.7	Low	55.6	Low	11 Å²	11	35.9 Å²	35.9	5%	0.048	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	136.3	175.4	-74.9	-94.3	0	0	0	111.6	R289 I290 L291 F418 V437 I488 T492	R289-F494 PolarHBondContact O-N 3.33Å; R289-F494 VanDerWaalsContact O-N 3.08Å; I290-F494 WeakPolarHBondContact CA-O 3.27Å; I290-F494 HydrophobicContact CB-CB 4.48Å; I290-F494 HydrophobicContact CG1-CB 4.3Å; I290-F494 HydrophobicContact CG2-CB 4.14Å; L291-F494 PolarHBondContact N-O 3.03Å; F418-F494 HydrophobicContact CE1-CE2 4.03Å; F418-F494 AromaticContact CE1-CZ 3.71Å; F418-F494 HydrophobicContact CE1-CZ 3.71Å; F418-F494 HydrophobicContact CZ-CZ 4.38Å; V437-F494 HydrophobicContact CB-CD1 3.77Å; V437-F494 HydrophobicContact CB-CE1 3.73Å; V437-F494 HydrophobicContact CB-CG 4.45Å; V437-F494 HydrophobicContact CB-CZ 4.38Å; V437-F494 HydrophobicContact CG1-CD1 3.97Å; V437-F494 HydrophobicContact CG1-CE1 3.77Å; V437-F494 HydrophobicContact CG2-CE1 4.07Å; V437-F494 HydrophobicContact CG2-CZ 4.28Å; V437-F494 CarbonylContact O-C 3.57Å; V437-F494 WeakPolarHBondContact O-CA 3.27Å; I488-F494 HydrophobicContact CD1-CD2 4.19Å; I488-F494 HydrophobicContact CG1-CE2 4.38Å; I488-F494 HydrophobicContact CG2-CD2 4.32Å; I488-F494 HydrophobicContact CG2-CE2 4.1Å; T492-F494 HydrophobicContact CG2-CD2 4.35Å; T492-F494 HydrophobicContact CG2-CE2 3.79Å; T492-F494 HydrophobicContact CG2-CZ 4.46Å
495	I	67.5	Low	57	Low	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	121	168.5	-56.7	174.7	0	0	0	107.6	L233 F236 L291 I293 I436 V437 I438 I439	L233-I495 HydrophobicContact CD2-CD1 4.19Å; F236-I495 HydrophobicContact CD1-CG1 4.31Å; F236-I495 HydrophobicContact CE1-CG1 4.06Å; L291-I495 HydrophobicContact CB-CG1 4.49Å; L291-I495 CarbonylContact O-C 3.59Å; L291-I495 WeakPolarHBondContact O-CA 3.35Å; I293-I495 HydrophobicContact CD1-CG2 4.11Å; I436-I495 HydrophobicContact CG2-CD1 4.22Å; V437-I495 PolarHBondContact O-N 3.31Å; I438-I495 WeakPolarHBondContact CA-O 3.48Å; I438-I495 HydrophobicContact CD1-CD1 4.32Å; I438-I495 HydrophobicContact CG1-CB 4.21Å; I438-I495 HydrophobicContact CG1-CD1 4.27Å; I438-I495 HydrophobicContact CG2-CB 4.35Å; I438-I495 HydrophobicContact CG2-CG2 4.45Å; I439-I495 PolarHBondContact N-O 3.33Å
496	L	69.1	Low	58	Low	4 Å²	4	35.7 Å²	35.7	2%	0.021	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	142.1	-176.3	-52.7	179.4	0	0	0	109.8	I290 L291 L292 I293 I439 L442 L508	I290-L496 HydrophobicContact CG2-CD1 3.77Å; I290-L496 HydrophobicContact CG2-CG 4.11Å; L291-L496 PolarHBondContact O-N 3.22Å; L292-L496 CarbonylContact C-O 3.14Å; L292-L496 WeakPolarHBondContact CA-O 3.49Å; L292-L496 HydrophobicContact CD1-CB 3.9Å; I293-L496 PolarHBondContact N-O 3.04Å; I439-L496 HydrophobicContact CB-CD2 4.03Å; I439-L496 HydrophobicContact CD1-CD2 3.88Å; I439-L496 HydrophobicContact CG1-CD2 4.04Å; L442-L496 HydrophobicContact CD1-CB 4.38Å; L442-L496 HydrophobicContact CD1-CD1 4.38Å; L442-L496 HydrophobicContact CD1-CD2 3.83Å; L442-L496 HydrophobicContact CD1-CG 4.41Å; L496-L508 HydrophobicContact CD1-CD1 4.02Å
497	T	65.6	Low	58.4	Low	3 Å²	3	38.9 Å²	38.9	2%	0.018	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	145.6	168.2	83.6	0	0	0	0	111.4	I293 L305 I439 D440 G441 L442	I293-T497 HydrophobicContact CB-CG2 4.49Å; I293-T497 WeakPolarHBondContact O-CA 3.34Å; L305-T497 HydrophobicContact CD1-CG2 3.56Å; I439-T497 PolarHBondContact O-N 3.01Å; I439-T497 VanDerWaalsContact O-N 3.1Å; D440-T497 WeakPolarHBondContact CA-OG1 3.31Å; D440-T497 WeakPolarHBondContact OD1-CB 3.24Å; D440-T497 VanDerWaalsContact OD1-CG2 3.27Å; D440-T497 WeakPolarHBondContact OD1-CG2 3.29Å; D440-T497 PolarHBondContact OD1-OG1 3.18Å; G441-T497 PolarHBondContact N-OG1 2.93Å; L442-T497 WeakPolarHBondContact CB-O 3.34Å; L442-T497 PolarHBondContact N-O 3.48Å
498	C	67.2	Low	58.7	Low	1 Å²	1	32.7 Å²	32.7	1%	0.007	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	158.3	178.3	-171.3	0	0	0	0	110.1	L292 I293 S294 K301 H502	L292-C498 HydrophobicContact CD1-CB 4.18Å; I293-C498 PolarHBondContact O-N 3.22Å; S294-C498 WeakPolarHBondContact CA-O 3.27Å; K301-C498 PolarHBondContact NZ-O 2.93Å; C498-H502 VanDerWaalsContact SG-CB 3.53Å
499	S	64.4	Low	58.8	Low	3 Å²	3	35.4 Å²	35.4	2%	0.021	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	144.4	168.8	58.7	0	0	0	0	112.1	G295 E443 S501 H502 N505	G295-S499 CarbonylContact O-C 3.58Å; G295-S499 WeakPolarHBondContact O-CA 3.27Å; E443-S499 WeakPolarHBondContact OE2-CB 3.47Å; E443-S499 PolarHBondContact OE2-N 3.31Å; E443-S499 PolarHBondContact OE2-OG 3.42Å; S499-S501 PolarHBondContact O-N 3.24Å; S499-H502 PolarHBondContact O-N 3.13Å; S499-H502 VanDerWaalsContact O-N 3.15Å; S499-H502 WeakPolarHBondContact OG-CB 3.36Å; S499-H502 PolarHBondContact OG-CD2 2.89Å; S499-H502 VanDerWaalsContact OG-CD2 3.28Å; S499-N505 WeakPolarHBondContact O-CB 3.3Å
500	S	57.1	Low	58.4	Low	49 Å²	49	41.6 Å²	41.6	34%	0.343	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-24.9	178.9	45.9	0	0	0	0	112.7	G295 N505	G295-S500 PolarHBondContact O-N 2.92Å; S500-N505 PolarHBondContact O-ND2 3.37Å
501	S	51.5	Low	58.2	Low	94 Å²	94	39.8 Å²	39.8	66%	0.657	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-12.6	176.7	46.3	0	0	0	0	115.4	S499	S499-S501 PolarHBondContact O-N 3.24Å
502	H	57	Low	57.5	Low	58 Å²	58	42.7 Å²	42.7	27%	0.269	22%	0.224	S	C	.	.	S	Bend	trans	-74.2	146.9	-177.7	-118.6	-101.2	0	0	0	112.4	E443 E446 C498 S499 I504 N505 H506	E443-H502 IonicContact OE2-CD2 2.73Å; E446-H502 IonicContact OE2-CE1 2.9Å; E446-H502 PolarHBondContact OE2-CE1 2.87Å; E446-H502 IonicContact OE2-ND1 3.67Å; E446-H502 PolarHBondContact OE2-ND1 2.92Å; C498-H502 VanDerWaalsContact SG-CB 3.53Å; S499-H502 PolarHBondContact O-N 3.13Å; S499-H502 VanDerWaalsContact O-N 3.15Å; S499-H502 WeakPolarHBondContact OG-CB 3.36Å; S499-H502 PolarHBondContact OG-CD2 2.89Å; S499-H502 VanDerWaalsContact OG-CD2 3.28Å; H502-I504 PolarHBondContact O-N 3.26Å; H502-N505 WeakPolarHBondContact O-CB 3.37Å; H502-N505 PolarHBondContact O-N 2.7Å; H502-N505 VanDerWaalsContact O-N 3.1Å; H502-H506 PolarHBondContact O-N 2.82Å
503	Y	50.8	Low	56.9	Low	123 Å²	123	43.9 Å²	43.9	48%	0.482	23%	0.23	S	C	.	.	H	α-helix	trans	-56.2	-35.8	175.1	-179.3	-102.8	0	0	0	112.4	V456 N505 H506 Q507	V456-Y503 HydrophobicContact CG1-CD1 3.87Å; V456-Y503 HydrophobicContact CG1-CE1 3.5Å; Y503-N505 VanDerWaalsContact C-N 3.35Å; Y503-N505 PolarHBondContact O-N 2.85Å; Y503-H506 CarbonylContact O-C 3.58Å; Y503-H506 WeakPolarHBondContact O-CA 3.47Å; Y503-H506 WeakPolarHBondContact O-CB 3.46Å; Y503-H506 PolarHBondContact O-N 2.83Å; Y503-Q507 HydrophobicContact CD1-CG 4.02Å; Y503-Q507 HydrophobicContact CE1-CG 3.59Å; Y503-Q507 PolarHBondContact O-N 3.37Å; Y503-Q507 PolarHBondContact OH-NE2 3.26Å
504	I	53.1	Low	56.4	Low	3 Å²	3	44.3 Å²	44.3	2%	0.015	23%	0.234	C	C	.	.	H	α-helix	trans	-56.9	-44.3	176.6	-48.4	177.4	0	0	0	111.8	L442 E446 I459 H502 H506 Q507 L508	L442-I504 HydrophobicContact CD2-CD1 4.15Å; L442-I504 HydrophobicContact CD2-CG2 3.69Å; E446-I504 HydrophobicContact CG-CD1 4.07Å; E446-I504 HydrophobicContact CG-CG1 4.5Å; E446-I504 WeakPolarHBondContact OE2-CD1 3.45Å; E446-I504 VanDerWaalsContact OE2-CG1 3.29Å; E446-I504 WeakPolarHBondContact OE2-CG1 3.45Å; I459-I504 HydrophobicContact CD1-CB 4.39Å; I459-I504 HydrophobicContact CD1-CD1 3.59Å; I459-I504 HydrophobicContact CD1-CG1 3.57Å; I459-I504 HydrophobicContact CD1-CG2 4.06Å; H502-I504 PolarHBondContact O-N 3.26Å; I504-H506 VanDerWaalsContact C-N 3.31Å; I504-H506 PolarHBondContact O-N 3.23Å; I504-Q507 PolarHBondContact O-N 3.07Å; I504-Q507 VanDerWaalsContact O-N 3.14Å; I504-L508 HydrophobicContact CG2-CD1 3.81Å; I504-L508 HydrophobicContact CG2-CG 4.23Å; I504-L508 WeakPolarHBondContact O-CB 3.03Å; I504-L508 WeakPolarHBondContact O-CG 3.47Å; I504-L508 PolarHBondContact O-N 2.8Å
505	N	57.8	Low	56	Low	8 Å²	8	46.9 Å²	46.9	4%	0.043	25%	0.248	C	C	.	.	H	α-helix	trans	-60.9	-42.5	175.2	-178.5	48.2	0	0	0	110.6	L292 S294 S499 S500 H502 Y503 Q507 T509	L292-N505 WeakPolarHBondContact CD2-OD1 3.46Å; S294-N505 WeakPolarHBondContact CB-OD1 3.43Å; S499-N505 WeakPolarHBondContact O-CB 3.3Å; S500-N505 PolarHBondContact O-ND2 3.37Å; H502-N505 WeakPolarHBondContact O-CB 3.37Å; H502-N505 PolarHBondContact O-N 2.7Å; H502-N505 VanDerWaalsContact O-N 3.1Å; Y503-N505 VanDerWaalsContact C-N 3.35Å; Y503-N505 PolarHBondContact O-N 2.85Å; N505-Q507 VanDerWaalsContact C-N 3.28Å; N505-Q507 PolarHBondContact O-N 3.37Å; N505-T509 VanDerWaalsContact O-CB 3.26Å; N505-T509 WeakPolarHBondContact O-CB 3.41Å; N505-T509 WeakPolarHBondContact O-CG2 3.48Å; N505-T509 PolarHBondContact O-N 3.48Å; N505-T509 PolarHBondContact O-OG1 2.88Å
506	H	55.8	Low	55.4	Low	112 Å²	112	49.5 Å²	49.5	52%	0.519	26%	0.264	S	S	.	.	H	α-helix	trans	-69	-15.9	175.4	-91.9	-56.4	0	0	0	115.5	H502 Y503 I504 T509 K510	H502-H506 PolarHBondContact O-N 2.82Å; Y503-H506 CarbonylContact O-C 3.58Å; Y503-H506 WeakPolarHBondContact O-CA 3.47Å; Y503-H506 WeakPolarHBondContact O-CB 3.46Å; Y503-H506 PolarHBondContact O-N 2.83Å; I504-H506 VanDerWaalsContact C-N 3.31Å; I504-H506 PolarHBondContact O-N 3.23Å; H506-T509 WeakPolarHBondContact CA-OG1 3.35Å; H506-T509 PolarHBondContact O-OG1 2.98Å; H506-K510 VanDerWaalsContact O-CD 3.28Å; H506-K510 WeakPolarHBondContact O-CD 3.48Å; H506-K510 WeakPolarHBondContact O-CE 3.29Å; H506-K510 PolarHBondContact O-NZ 2.91Å
507	Q	50.3	Low	55	Low	85 Å²	85	50.8 Å²	50.8	40%	0.397	27%	0.27	S	S	.	.	H	α-helix	trans	-90.6	-49.7	171.6	-75.2	-72.6	18.9	0	0	111.1	Y503 I504 N505 T509 K510	Y503-Q507 HydrophobicContact CD1-CG 4.02Å; Y503-Q507 HydrophobicContact CE1-CG 3.59Å; Y503-Q507 PolarHBondContact O-N 3.37Å; Y503-Q507 PolarHBondContact OH-NE2 3.26Å; I504-Q507 PolarHBondContact O-N 3.07Å; I504-Q507 VanDerWaalsContact O-N 3.14Å; N505-Q507 VanDerWaalsContact C-N 3.28Å; N505-Q507 PolarHBondContact O-N 3.37Å; Q507-T509 PolarHBondContact O-N 3.22Å; Q507-K510 WeakPolarHBondContact O-CB 3.42Å; Q507-K510 PolarHBondContact O-N 3.48Å
508	L	52.4	Low	54.3	Low	6 Å²	6	57.8 Å²	57.8	3%	0.031	30%	0.303	C	S	.	.	H	α-helix	trans	-65.6	-34.8	-178.4	-68.4	176.6	0	0	0	112.8	L292 F463 L496 I504 K510 C511 V514	L292-L508 HydrophobicContact CD1-CD1 3.99Å; L292-L508 HydrophobicContact CD2-CB 3.76Å; L292-L508 HydrophobicContact CD2-CD1 4.29Å; F463-L508 HydrophobicContact CE2-CD2 4.5Å; F463-L508 HydrophobicContact CZ-CD2 3.93Å; L496-L508 HydrophobicContact CD1-CD1 4.02Å; I504-L508 HydrophobicContact CG2-CD1 3.81Å; I504-L508 HydrophobicContact CG2-CG 4.23Å; I504-L508 WeakPolarHBondContact O-CB 3.03Å; I504-L508 WeakPolarHBondContact O-CG 3.47Å; I504-L508 PolarHBondContact O-N 2.8Å; L508-K510 PolarHBondContact O-N 3.43Å; L508-K510 VanDerWaalsContact O-N 3.15Å; L508-C511 WeakPolarHBondContact O-CB 3.48Å; L508-C511 PolarHBondContact O-N 2.92Å; L508-V514 HydrophobicContact CD2-CG2 4.49Å
509	T	57.7	Low	53.4	Low	62 Å²	62	60.1 Å²	60.1	38%	0.38	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-18.9	172.1	47	0	0	0	0	114.4	N505 H506 Q507 V516	N505-T509 VanDerWaalsContact O-CB 3.26Å; N505-T509 WeakPolarHBondContact O-CB 3.41Å; N505-T509 WeakPolarHBondContact O-CG2 3.48Å; N505-T509 PolarHBondContact O-N 3.48Å; N505-T509 PolarHBondContact O-OG1 2.88Å; H506-T509 WeakPolarHBondContact CA-OG1 3.35Å; H506-T509 PolarHBondContact O-OG1 2.98Å; Q507-T509 PolarHBondContact O-N 3.22Å; T509-V516 HydrophobicContact CG2-CB 4.46Å; T509-V516 HydrophobicContact CG2-CG1 4.06Å; T509-V516 HydrophobicContact CG2-CG2 3.82Å
510	K	46.6	Very low	52.4	Low	145 Å²	145	64.4 Å²	64.4	63%	0.63	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-10.2	176.8	-62.4	169.5	-176.8	154.9	0	113.1	H506 Q507 L508	H506-K510 VanDerWaalsContact O-CD 3.28Å; H506-K510 WeakPolarHBondContact O-CD 3.48Å; H506-K510 WeakPolarHBondContact O-CE 3.29Å; H506-K510 PolarHBondContact O-NZ 2.91Å; Q507-K510 WeakPolarHBondContact O-CB 3.42Å; Q507-K510 PolarHBondContact O-N 3.48Å; L508-K510 PolarHBondContact O-N 3.43Å; L508-K510 VanDerWaalsContact O-N 3.15Å
511	C	48.5	Very low	51.4	Low	17 Å²	17	67 Å²	67	12%	0.115	36%	0.36	C	S	.	.			trans	-86.3	125.6	-175.7	-174.8	0	0	0	0	111.2	L508 L513 V514	L508-C511 WeakPolarHBondContact O-CB 3.48Å; L508-C511 PolarHBondContact O-N 2.92Å; C511-L513 PolarHBondContact O-N 2.95Å; C511-V514 HydrophobicContact CB-CB 4.49Å; C511-V514 HydrophobicContact CB-CG2 3.84Å; C511-V514 PolarHBondContact O-N 3.44Å
512	P	45.2	Very low	50.4	Low	102 Å²	102	67.4 Å²	67.4	66%	0.662	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-1.4	-177.2	29.7	-36.7	0	0	0	114.8
513	L	49.5	Very low	48.9	Very low	29 Å²	29	72.7 Å²	72.7	15%	0.152	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-5.3	176.7	-63.5	171.5	0	0	0	113.5	R287 I290 L485 P486 C511	R287-L513 HydrophobicContact CB-CD2 4.25Å; I290-L513 PolarHBondContact N-O 3.15Å; L485-L513 HydrophobicContact CD2-CD1 4.15Å; P486-L513 HydrophobicContact CG-CD1 4.44Å; C511-L513 PolarHBondContact O-N 2.95Å
514	V	52	Low	47.7	Very low	16 Å²	16	70.6 Å²	70.6	10%	0.097	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	119.5	-171.5	-176.7	0	0	0	0	110.5	I290 L292 L508 C511 V516	I290-V514 HydrophobicContact CB-CG2 4.04Å; I290-V514 HydrophobicContact CD1-CG2 4.04Å; I290-V514 HydrophobicContact CG2-CG1 4.35Å; I290-V514 HydrophobicContact CG2-CG2 4.14Å; L292-V514 HydrophobicContact CB-CG1 3.67Å; L292-V514 HydrophobicContact CD2-CG1 4.43Å; L508-V514 HydrophobicContact CD2-CG2 4.49Å; C511-V514 HydrophobicContact CB-CB 4.49Å; C511-V514 HydrophobicContact CB-CG2 3.84Å; C511-V514 PolarHBondContact O-N 3.44Å; V514-V516 HydrophobicContact CG1-CG2 4.08Å
515	N	56.6	Low	46.4	Very low	64 Å²	64	78.2 Å²	78.2	34%	0.342	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	135.3	165.2	-79	-40.2	0	0	0	109.8	N288 I290 L291 L292	N288-N515 PolarHBondContact ND2-ND2 3.4Å; N288-N515 VanDerWaalsContact ND2-ND2 3.19Å; I290-N515 PolarHBondContact O-N 3.48Å; L291-N515 CarbonylContact C-O 3.6Å; L291-N515 WeakPolarHBondContact CA-O 3.4Å; L291-N515 HydrophobicContact CD1-CB 3.85Å; L292-N515 PolarHBondContact N-O 3.08Å
516	V	55.8	Low	45	Very low	56 Å²	56	86.4 Å²	86.4	34%	0.339	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	133.8	-174.6	-173.3	0	0	0	0	110.9	L292 T509 V514	L292-V516 HydrophobicContact CB-CG2 4.32Å; L292-V516 HydrophobicContact CD2-CG1 4.33Å; L292-V516 HydrophobicContact CD2-CG2 4.16Å; L292-V516 WeakPolarHBondContact O-CA 3.38Å; T509-V516 HydrophobicContact CG2-CB 4.46Å; T509-V516 HydrophobicContact CG2-CG1 4.06Å; T509-V516 HydrophobicContact CG2-CG2 3.82Å; V514-V516 HydrophobicContact CG1-CG2 4.08Å
517	I	59.3	Low	43.5	Very low	31 Å²	31	88.5 Å²	88.5	16%	0.159	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	116.1	173.4	-57.9	178.1	0	0	0	108.6	L229 I232 L291 L292 S294	L229-I517 HydrophobicContact CD2-CG2 4.45Å; I232-I517 HydrophobicContact CG2-CD1 3.8Å; L291-I517 HydrophobicContact CD1-CD1 3.94Å; L291-I517 HydrophobicContact CD1-CG1 4.18Å; L291-I517 HydrophobicContact CD2-CD1 4.24Å; L291-I517 HydrophobicContact CG-CD1 4.42Å; L292-I517 PolarHBondContact O-N 2.92Å; S294-I517 PolarHBondContact N-O 3.31Å; S294-I517 PolarHBondContact OG-O 2.99Å
518	E	51.8	Low	42.2	Very low	149 Å²	149	90.9 Å²	90.9	70%	0.696	50%	0.504	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85	122.4	172.5	-71.1	-171.4	158.9	0	0	111.3	S520	E518-S520 PolarHBondContact O-N 2.71Å
519	Y	48.4	Very low	40.9	Very low	50 Å²	50	96.8 Å²	96.8	20%	0.196	53%	0.533	C	S	.	.			trans	-91	92.4	176.1	-154.8	-83.4	0	0	0	109.7	I221 L229 S294 F304	I221-Y519 HydrophobicContact CD1-CE1 3.79Å; I221-Y519 VanDerWaalsContact CD1-OH 3.24Å; I221-Y519 WeakPolarHBondContact CD1-OH 3.43Å; L229-Y519 HydrophobicContact CD1-CD2 3.98Å; L229-Y519 HydrophobicContact CD1-CE2 3.96Å; S294-Y519 WeakPolarHBondContact O-CB 3.5Å; S294-Y519 PolarHBondContact O-N 3.31Å; F304-Y519 HydrophobicContact CD1-CE2 4.38Å; F304-Y519 HydrophobicContact CG-CE2 4.35Å
520	S	44.3	Very low	39.3	Very low	93 Å²	93	100.5 Å²	100.5	65%	0.65	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-80.6	130.8	-177.9	54.3	0	0	0	0	112.9	E518	E518-S520 PolarHBondContact O-N 2.71Å
521	S	34.9	Very low	38.1	Very low	105 Å²	105	100.7 Å²	100.7	73%	0.734	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-74.4	133.7	161.3	45.2	0	0	0	0	109.3
522	V	30.8	Very low	36.9	Very low	102 Å²	102	107.8 Å²	107.8	62%	0.618	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-88.9	121.4	-161.1	172.4	0	0	0	0	112.3
523	L	26.6	Very low	35.8	Very low	169 Å²	169	110.7 Å²	110.7	89%	0.885	59%	0.592	S	S	*	*			trans	54.4	96.4	152.9	-63.8	166.7	0	0	0	119.2
524	G	25.3	Very low	34.5	Very low	79 Å²	79	112.2 Å²	112.2	81%	0.814	61%	0.605	S	S	*	*			trans	-138.4	123	154.6	0	0	0	0	0	110.7	K526	G524-K526 PolarHBondContact O-N 3.45Å
525	L	24.8	Very low	33.2	Very low	162 Å²	162	117.2 Å²	117.2	85%	0.848	64%	0.638	S	S	*	*			trans	-56	128.4	-170.3	-82.9	149.3	0	0	0	115.5
526	K	29.5	Very low	31.4	Very low	180 Å²	180	120 Å²	120	78%	0.783	66%	0.657	S	S	*	*				-150.9	117.6	124.9	-111.2	-174.2	-177.6	-171.8	0	111.4	G524	G524-K526 PolarHBondContact O-N 3.45Å
527	E	24.2	Very low	29.9	Very low	157 Å²	157	122.7 Å²	122.7	73%	0.734	68%	0.679	S	S	*	*			trans	-73.2	156.8	165.9	-62.6	175.7	122.8	0	0	110.7
528	N	23.1	Very low	28.2	Very low	135 Å²	135	129.9 Å²	129.9	72%	0.722	72%	0.715	S	S	*	*			trans	62	94.3	159.7	-60.3	-35.6	0	0	0	119.1
529	M	24.8	Very low	26.8	Very low	129 Å²	129	125.5 Å²	125.5	64%	0.635	71%	0.711	S	S	*	*			trans	-169.2	103.3	131.1	-93.2	-75.3	-156.5	0	0	105.5	M531	M529-M531 HydrophobicContact SD-CG 4.01Å
530	L	22.7	Very low	25.5	Very low	141 Å²	141	130.7 Å²	130.7	74%	0.738	74%	0.742	S	S	*	*			cis	42.4	55.1	13.1	-80.3	176.7	0	0	0	114.8
531	M	23	Very low	24.6	Very low	149 Å²	149	134 Å²	134	73%	0.734	75%	0.751	S	S	*	*				-59.8	118.5	120	-66.3	-156.5	-160.8	0	0	105.7	M529 I533	M529-M531 HydrophobicContact SD-CG 4.01Å; M531-I533 VanDerWaalsContact C-N 3.34Å
532	K	21.7	Very low	24	Very low	166 Å²	166	137 Å²	137	72%	0.722	75%	0.754	S	S	*	*			cis	42	62.4	35	-94.1	-167.9	176.4	-174.9	0	110.4	S534	K532-S534 PolarHBondContact O-N 3.03Å; K532-S534 VanDerWaalsContact O-N 3.1Å
533	I	23.6	Very low	23.6	Very low	163 Å²	163	140 Å²	140	84%	0.836	76%	0.761	S	S	*	*				-59.8	92.9	119.3	-60.5	176.3	0	0	0	104.3	M531 P535	M531-I533 VanDerWaalsContact C-N 3.34Å; I533-P535 WeakPolarHBondContact O-CD 3.36Å
534	S	21	Very low	23.4	Very low	61 Å²	61	137.1 Å²	137.1	43%	0.427	75%	0.751	S	S	.	*			trans	-67.4	120.1	173.5	43.5	0	0	0	0	107.4	K532 T536	K532-S534 PolarHBondContact O-N 3.03Å; K532-S534 VanDerWaalsContact O-N 3.1Å; S534-T536 PolarHBondContact O-N 3.18Å; S534-T536 VanDerWaalsContact O-N 3.16Å
535	P	24.2	Very low	23.3	Very low	121 Å²	121	139.7 Å²	139.7	79%	0.786	75%	0.746	S	S	*	*			trans	-67.7	115.1	168.5	28.9	-31.9	0	0	0	108	I533	I533-P535 WeakPolarHBondContact O-CD 3.36Å
536	T	20.7	Very low	23.2	Very low	122 Å²	122	139.8 Å²	139.8	75%	0.748	74%	0.742	S	S	*	*			trans	-134.3	110	170.4	52.1	0	0	0	0	106.5	S534	S534-T536 PolarHBondContact O-N 3.18Å; S534-T536 VanDerWaalsContact O-N 3.16Å
537	S	23.4	Very low	22.9	Very low	113 Å²	113	137 Å²	137	79%	0.79	74%	0.739	S	S	*	*			cis	-150.2	128.7	5.7	47	0	0	0	0	110.5
538	I	23.6	Very low	22.9	Very low	181 Å²	181	136.2 Å²	136.2	93%	0.928	74%	0.74	S	S	*	*			trans	-94	112.2	158.5	-67.5	172.9	0	0	0	106.8
539	G	21.4	Very low	23.1	Very low	58 Å²	58	138.2 Å²	138.2	60%	0.598	74%	0.742	S	S	*	*			trans	-158.3	134.5	164.6	0	0	0	0	0	106.3
540	N	22.5	Very low	23.1	Very low	159 Å²	159	140.4 Å²	140.4	85%	0.85	75%	0.751	S	S	*	*			cis	-119.9	159.2	16.7	-72.1	-20.3	0	0	0	114.6
541	L	24.8	Very low	23.3	Very low	162 Å²	162	140.7 Å²	140.7	85%	0.848	75%	0.753	S	S	*	*			trans	-69.8	141.9	155.9	-137.5	80.4	0	0	0	109
542	E	22.3	Very low	23.5	Very low	167 Å²	167	139.3 Å²	139.3	78%	0.78	75%	0.749	S	S	*	*			trans	-163.5	103.3	143.7	-107.9	158.3	-142.7	0	0	105.8
543	E	21.9	Very low	24.1	Very low	166 Å²	166	136.5 Å²	136.5	78%	0.776	75%	0.747	S	S	*	*				84.6	122.6	102.2	-78.6	-170.7	-176.8	0	0	111.5
544	T	24	Very low	24.7	Very low	109 Å²	109	134.4 Å²	134.4	67%	0.669	74%	0.742	S	S	*	*			cis	-157.2	154.5	40	40.1	0	0	0	0	112.7
545	N	22.2	Very low	25.5	Very low	132 Å²	132	134.8 Å²	134.8	71%	0.706	74%	0.742	S	S	*	*			trans	44.1	146	132	-53.8	-5.4	0	0	0	121
546	E	23.2	Very low	26.3	Very low	164 Å²	164	133.9 Å²	133.9	77%	0.766	73%	0.73	S	S	*	*			cis	-162.5	146.5	1.9	-119.4	168.8	-175.5	0	0	110.5
547	V	23	Very low	27.3	Very low	121 Å²	121	132.4 Å²	132.4	73%	0.733	72%	0.715	S	S	*	*			trans	29	122.2	140.9	-173.8	0	0	0	0	120.3
548	L	24.4	Very low	27.9	Very low	142 Å²	142	129.5 Å²	129.5	74%	0.743	69%	0.69	S	S	*	*				-177.5	113.7	116.4	-95.3	176.7	0	0	0	115.1
549	K	26.1	Very low	28.9	Very low	177 Å²	177	127.9 Å²	127.9	77%	0.77	67%	0.673	S	S	*	*			trans	57.8	110.4	143.7	-66.8	179.9	-175.6	179.4	0	122.9
550	E	26.6	Very low	30.1	Very low	174 Å²	174	130 Å²	130	81%	0.813	67%	0.671	S	S	*	*				20.3	114.3	126	-60.6	176.4	134.8	0	0	119.3
551	N	25.4	Very low	31.1	Very low	148 Å²	148	122.7 Å²	122.7	79%	0.791	63%	0.632	S	S	*	*				-175.2	136.8	120.1	-93.8	-47.9	0	0	0	112.2
552	N	27.3	Very low	32.1	Very low	120 Å²	120	116.8 Å²	116.8	64%	0.642	60%	0.601	S	S	*	*			trans	63.3	111.5	174.2	-67.5	-34	0	0	0	119	V554 T555	N552-V554 PolarHBondContact O-N 2.74Å; N552-V554 VanDerWaalsContact O-N 3.11Å; N552-T555 PolarHBondContact O-OG1 3.5Å
553	P	34.1	Very low	33.4	Very low	106 Å²	106	111.4 Å²	111.4	69%	0.688	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	7.2	-179.9	33.1	-37	0	0	0	115.4
554	V	37.1	Very low	34.4	Very low	120 Å²	120	106.3 Å²	106.3	73%	0.727	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-22.9	179.7	-179.2	0	0	0	0	111.9	N552	N552-V554 PolarHBondContact O-N 2.74Å; N552-V554 VanDerWaalsContact O-N 3.11Å
555	T	37.9	Very low	35.3	Very low	69 Å²	69	101.7 Å²	101.7	42%	0.423	53%	0.53	S	S	.	.	S	Bend	trans	-77.8	-28.8	177.8	38.1	0	0	0	0	113.2	N552 Q557 L558 Y559	N552-T555 PolarHBondContact O-OG1 3.5Å; T555-Q557 PolarHBondContact O-N 3.26Å; T555-L558 PolarHBondContact O-N 2.94Å; T555-Y559 PolarHBondContact O-N 3.49Å
556	N	40	Very low	36.3	Very low	101 Å²	101	100.3 Å²	100.3	54%	0.54	52%	0.518	S	S	.	.	H	α-helix	trans	-64.4	-36.9	-172.3	-71.3	7.6	0	0	0	114.2	L558 Y559 D560	N556-L558 VanDerWaalsContact C-N 3.35Å; N556-L558 PolarHBondContact O-N 3.29Å; N556-Y559 CarbonylContact O-C 3.59Å; N556-Y559 WeakPolarHBondContact O-CA 3.46Å; N556-Y559 WeakPolarHBondContact O-CB 3.23Å; N556-Y559 PolarHBondContact O-N 3.41Å; N556-Y559 VanDerWaalsContact O-N 3.12Å; N556-D560 PolarHBondContact O-N 3.29Å
557	Q	41.2	Very low	37.3	Very low	91 Å²	91	97.4 Å²	97.4	43%	0.425	51%	0.513	S	S	.	.	H	α-helix	trans	-72.4	-27.6	177.6	-73.5	172.4	46.3	0	0	113.2	T555	T555-Q557 PolarHBondContact O-N 3.26Å
558	L	37.7	Very low	38	Very low	52 Å²	52	95.1 Å²	95.1	27%	0.272	50%	0.496	S	S	.	.	H	α-helix	trans	-73.1	-35.9	167.7	-94.9	157.6	0	0	0	110.6	T555 N556 L561 I562	T555-L558 PolarHBondContact O-N 2.94Å; N556-L558 VanDerWaalsContact C-N 3.35Å; N556-L558 PolarHBondContact O-N 3.29Å; L558-L561 PolarHBondContact O-N 2.88Å; L558-I562 HydrophobicContact CB-CD1 4.31Å; L558-I562 HydrophobicContact CD2-CD1 4.17Å; L558-I562 VanDerWaalsContact O-CB 3.24Å; L558-I562 WeakPolarHBondContact O-CB 3.49Å; L558-I562 WeakPolarHBondContact O-CD1 3.17Å; L558-I562 WeakPolarHBondContact O-CG1 3.49Å; L558-I562 PolarHBondContact O-N 3.19Å
559	Y	42.9	Very low	38.6	Very low	147 Å²	147	91.1 Å²	91.1	58%	0.576	48%	0.476	S	S	*	.	H	α-helix	trans	-66.5	-32.3	175.2	-106.8	-91.6	0	0	0	113.6	T555 N556 I562 S563	T555-Y559 PolarHBondContact O-N 3.49Å; N556-Y559 CarbonylContact O-C 3.59Å; N556-Y559 WeakPolarHBondContact O-CA 3.46Å; N556-Y559 WeakPolarHBondContact O-CB 3.23Å; N556-Y559 PolarHBondContact O-N 3.41Å; N556-Y559 VanDerWaalsContact O-N 3.12Å; Y559-I562 PolarHBondContact O-N 2.87Å; Y559-S563 WeakPolarHBondContact O-CA 3.38Å; Y559-S563 WeakPolarHBondContact O-CB 3.35Å; Y559-S563 PolarHBondContact O-N 3.46Å; Y559-S563 PolarHBondContact O-OG 2.97Å
560	D	47.5	Very low	39	Very low	103 Å²	103	87.1 Å²	87.1	55%	0.551	46%	0.463	S	S	*	.	H	α-helix	trans	-63.3	-46.7	173.8	-68.1	-29.2	0	0	0	111.4	N556 S563 L564	N556-D560 PolarHBondContact O-N 3.29Å; D560-S563 PolarHBondContact O-OG 3.4Å; D560-S563 VanDerWaalsContact O-OG 3.05Å; D560-L564 WeakPolarHBondContact O-CG 3.48Å; D560-L564 PolarHBondContact O-N 2.75Å
561	L	43.9	Very low	39.2	Very low	5 Å²	5	84.2 Å²	84.2	3%	0.026	45%	0.453	C	S	.	.	H	α-helix	trans	-69.8	-38.5	176.3	-102.1	161	0	0	0	112.7	L558 F565	L558-L561 PolarHBondContact O-N 2.88Å; L561-F565 WeakPolarHBondContact O-CD2 3.49Å
562	I	45.8	Very low	39.6	Very low	39 Å²	39	83.1 Å²	83.1	20%	0.2	45%	0.447	C	S	.	.	H	α-helix	trans	-73.4	-35.7	179.1	-69.4	167.1	0	0	0	111.5	L558 Y559 L564 F565 F566	L558-I562 HydrophobicContact CB-CD1 4.31Å; L558-I562 HydrophobicContact CD2-CD1 4.17Å; L558-I562 VanDerWaalsContact O-CB 3.24Å; L558-I562 WeakPolarHBondContact O-CB 3.49Å; L558-I562 WeakPolarHBondContact O-CD1 3.17Å; L558-I562 WeakPolarHBondContact O-CG1 3.49Å; L558-I562 PolarHBondContact O-N 3.19Å; Y559-I562 PolarHBondContact O-N 2.87Å; I562-L564 VanDerWaalsContact C-N 3.34Å; I562-F565 WeakPolarHBondContact O-CA 3.45Å; I562-F565 WeakPolarHBondContact O-CB 3.26Å; I562-F565 PolarHBondContact O-N 3.36Å; I562-F565 VanDerWaalsContact O-N 3.07Å; I562-F566 HydrophobicContact CG2-CD2 4.15Å; I562-F566 HydrophobicContact CG2-CE2 3.95Å; I562-F566 WeakPolarHBondContact O-CD2 3.23Å; I562-F566 PolarHBondContact O-N 3.43Å
563	S	48.4	Very low	40	Very low	54 Å²	54	84 Å²	84	38%	0.378	46%	0.457	S	S	.	.	H	α-helix	trans	-68.9	-31	176.6	62.5	0	0	0	0	112.4	Y559 D560 F565 F566 P567	Y559-S563 WeakPolarHBondContact O-CA 3.38Å; Y559-S563 WeakPolarHBondContact O-CB 3.35Å; Y559-S563 PolarHBondContact O-N 3.46Å; Y559-S563 PolarHBondContact O-OG 2.97Å; D560-S563 PolarHBondContact O-OG 3.4Å; D560-S563 VanDerWaalsContact O-OG 3.05Å; S563-F565 PolarHBondContact O-N 3.31Å; S563-F566 PolarHBondContact O-N 3.02Å; S563-P567 WeakPolarHBondContact O-CD 3.34Å
564	L	43.2	Very low	39.9	Very low	59 Å²	59	85.5 Å²	85.5	31%	0.309	46%	0.458	S	S	.	.	H	α-helix	trans	-67.7	-21.1	169.2	-71.1	164.6	0	0	0	113.4	D560 I562 I628	D560-L564 WeakPolarHBondContact O-CG 3.48Å; D560-L564 PolarHBondContact O-N 2.75Å; I562-L564 VanDerWaalsContact C-N 3.34Å; L564-I628 HydrophobicContact CB-CD1 3.34Å; L564-I628 HydrophobicContact CD1-CD1 4.01Å; L564-I628 HydrophobicContact CG-CD1 4.23Å
565	F	42.7	Very low	39.5	Very low	11 Å²	11	85.9 Å²	85.9	5%	0.048	46%	0.456	C	S	.	.	H	α-helix	trans	-82.8	-22.3	169.9	-92.1	-84.4	0	0	0	113.4	L561 I562 S563 L568 L569 V599 L603 I628 L631 Y632	L561-F565 WeakPolarHBondContact O-CD2 3.49Å; I562-F565 WeakPolarHBondContact O-CA 3.45Å; I562-F565 WeakPolarHBondContact O-CB 3.26Å; I562-F565 PolarHBondContact O-N 3.36Å; I562-F565 VanDerWaalsContact O-N 3.07Å; S563-F565 PolarHBondContact O-N 3.31Å; F565-L568 WeakPolarHBondContact O-CB 3.5Å; F565-L568 PolarHBondContact O-N 3.47Å; F565-L569 HydrophobicContact CB-CD1 4.38Å; F565-L569 PolarHBondContact O-N 2.97Å; F565-V599 HydrophobicContact CZ-CG1 4.49Å; F565-L603 HydrophobicContact CD2-CD1 4.25Å; F565-L603 HydrophobicContact CE2-CD1 4.05Å; F565-I628 HydrophobicContact CD1-CG2 4.08Å; F565-I628 HydrophobicContact CD2-CG1 4.45Å; F565-I628 HydrophobicContact CD2-CG2 4.12Å; F565-I628 HydrophobicContact CE1-CG2 3.84Å; F565-I628 HydrophobicContact CE2-CB 4.37Å; F565-I628 HydrophobicContact CE2-CG1 4.05Å; F565-I628 HydrophobicContact CE2-CG2 3.89Å; F565-I628 HydrophobicContact CG-CG2 4.22Å; F565-I628 HydrophobicContact CZ-CB 4.4Å; F565-I628 HydrophobicContact CZ-CG2 3.74Å; F565-L631 HydrophobicContact CZ-CB 4.29Å; F565-Y632 HydrophobicContact CE1-CD2 4.11Å
566	F	44.7	Very low	39	Very low	104 Å²	104	91.7 Å²	91.7	46%	0.456	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-60.9	-38.9	-177.7	-100.6	-84.7	0	0	0	114.5	I562 S563 L568 L569 N570	I562-F566 HydrophobicContact CG2-CD2 4.15Å; I562-F566 HydrophobicContact CG2-CE2 3.95Å; I562-F566 WeakPolarHBondContact O-CD2 3.23Å; I562-F566 PolarHBondContact O-N 3.43Å; S563-F566 PolarHBondContact O-N 3.02Å; F566-L568 PolarHBondContact O-N 3.03Å; F566-L568 VanDerWaalsContact O-N 3.13Å; F566-L569 CarbonylContact O-C 3.6Å; F566-L569 WeakPolarHBondContact O-CA 3.33Å; F566-L569 PolarHBondContact O-N 2.88Å; F566-N570 PolarHBondContact O-N 2.91Å; F566-N570 PolarHBondContact O-OD1 3.14Å
567	P	42.9	Very low	38.5	Very low	103 Å²	103	90.2 Å²	90.2	67%	0.669	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-60.8	-18.8	172.5	-26.8	34.8	0	0	0	115.2	S563	S563-P567 WeakPolarHBondContact O-CD 3.34Å
568	L	38.8	Very low	37.9	Very low	72 Å²	72	94.9 Å²	94.9	38%	0.377	51%	0.505	S	S	.	.	G	3₁₀ helix	trans	-93.2	-8.3	173.1	-76.1	160.6	0	0	0	112.8	F565 F566 I628	F565-L568 WeakPolarHBondContact O-CB 3.5Å; F565-L568 PolarHBondContact O-N 3.47Å; F566-L568 PolarHBondContact O-N 3.03Å; F566-L568 VanDerWaalsContact O-N 3.13Å; L568-I628 HydrophobicContact CD1-CG2 3.91Å
569	L	36.2	Very low	37.3	Very low	58 Å²	58	101.6 Å²	101.6	30%	0.304	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117	-5.3	-178.6	-73.1	165.4	0	0	0	113.4	F565 F566 N571 F592 V596	F565-L569 HydrophobicContact CB-CD1 4.38Å; F565-L569 PolarHBondContact O-N 2.97Å; F566-L569 CarbonylContact O-C 3.6Å; F566-L569 WeakPolarHBondContact O-CA 3.33Å; F566-L569 PolarHBondContact O-N 2.88Å; L569-N571 PolarHBondContact O-N 2.82Å; L569-F592 HydrophobicContact CD2-CE1 4.44Å; L569-V596 HydrophobicContact CD2-CG2 4.24Å
570	N	35.5	Very low	36.6	Very low	93 Å²	93	100.9 Å²	100.9	50%	0.497	55%	0.547	S	S	.	.			trans	-70.7	115.5	175	-88.8	15.6	0	0	0	110.2	F566 D572	F566-N570 PolarHBondContact O-N 2.91Å; F566-N570 PolarHBondContact O-OD1 3.14Å; N570-D572 PolarHBondContact O-N 3.2Å; N570-D572 VanDerWaalsContact O-N 3.08Å
571	N	30.9	Very low	35.7	Very low	113 Å²	113	104.3 Å²	104.3	60%	0.604	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-74	6.6	-170.4	-68.7	-41.3	0	0	0	115.3	L569 T573 L574	L569-N571 PolarHBondContact O-N 2.82Å; N571-T573 VanDerWaalsContact C-N 3.26Å; N571-T573 PolarHBondContact O-N 3.29Å; N571-L574 PolarHBondContact O-N 3.49Å
572	D	33	Very low	35	Very low	125 Å²	125	109.8 Å²	109.8	67%	0.668	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-73.8	-11.6	-166.2	-59.3	-38.9	0	0	0	114.4	N570	N570-D572 PolarHBondContact O-N 3.2Å; N570-D572 VanDerWaalsContact O-N 3.08Å
573	T	35.3	Very low	34.4	Very low	138 Å²	138	115.8 Å²	115.8	85%	0.847	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-91.3	2.3	173.9	55.9	0	0	0	0	114.6	N571	N571-T573 VanDerWaalsContact C-N 3.26Å; N571-T573 PolarHBondContact O-N 3.29Å
574	L	32.6	Very low	33.9	Very low	138 Å²	138	120.9 Å²	120.9	72%	0.723	64%	0.643	S	S	*	*	S	Bend	trans	-97	-17	177.1	-82	161.4	0	0	0	114	N571 H576	N571-L574 PolarHBondContact O-N 3.49Å; L574-H576 VanDerWaalsContact C-N 3.34Å; L574-H576 PolarHBondContact O-N 3.13Å
575	N	27.9	Very low	33.4	Very low	129 Å²	129	124.5 Å²	124.5	69%	0.69	66%	0.658	S	S	*	*	S	Bend	trans	-85.1	9.4	-171.9	-75.4	-22	0	0	0	115.8
576	H	27.8	Very low	32.9	Very low	191 Å²	191	132.9 Å²	132.9	88%	0.884	70%	0.695	S	S	*	*	S	Bend	trans	-126.8	67.1	178.8	-75.1	-19.6	0	0	0	112.1	L574	L574-H576 VanDerWaalsContact C-N 3.34Å; L574-H576 PolarHBondContact O-N 3.13Å
577	G	28.7	Very low	32.7	Very low	69 Å²	69	134.3 Å²	134.3	71%	0.711	71%	0.707	S	S	*	*	S	Bend	trans	-160.9	29.6	-174.4	0	0	0	0	0	117.5
578	K	28.8	Very low	32.5	Very low	189 Å²	189	134.3 Å²	134.3	82%	0.822	70%	0.701	S	S	*	*			trans	40.5	102.5	166.4	-69.2	-173.1	175.1	-174.9	0	118.9	T580	K578-T580 PolarHBondContact O-N 3.11Å
579	E	26.1	Very low	32.5	Very low	194 Å²	194	137.7 Å²	137.7	91%	0.907	72%	0.715	S	S	*	*			trans	20.8	84.5	133.6	-59.8	177.8	142.8	0	0	118.8
580	T	27.7	Very low	32.9	Very low	132 Å²	132	138.1 Å²	138.1	81%	0.81	72%	0.723	S	S	*	*			trans	-157.7	136.9	146.5	35.5	0	0	0	0	110.4	K578	K578-T580 PolarHBondContact O-N 3.11Å
581	E	28.6	Very low	33.2	Very low	174 Å²	174	137.5 Å²	137.5	81%	0.813	72%	0.719	S	S	*	*			trans	73.8	83.1	173.2	-56	-165.6	171.8	0	0	119.2	N583	E581-N583 PolarHBondContact O-N 3.21Å
582	V	28.4	Very low	33.7	Very low	121 Å²	121	136.2 Å²	136.2	73%	0.733	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	0.3	-172.1	175	0	0	0	0	115.6
583	N	33.6	Very low	34.3	Very low	165 Å²	165	138.2 Å²	138.2	88%	0.882	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	5.7	-167.1	-79.4	-14.5	0	0	0	117.2	E581	E581-N583 PolarHBondContact O-N 3.21Å
584	Q	38.2	Very low	34.9	Very low	160 Å²	160	139 Å²	139	75%	0.748	70%	0.699	S	S	*	*	S	Bend	trans	-111.1	-14.6	176.5	-67.2	-170.5	2.9	0	0	114.9	F586	Q584-F586 PolarHBondContact O-N 3.1Å
585	E	32.7	Very low	35.3	Very low	135 Å²	135	136.7 Å²	136.7	63%	0.631	68%	0.681	S	S	*	*	H	α-helix	trans	-75.9	-24.1	-169.8	-63	-168.3	127.5	0	0	114.8	N587 L588 H589	E585-N587 VanDerWaalsContact C-N 3.28Å; E585-N587 PolarHBondContact O-N 3.47Å; E585-L588 PolarHBondContact O-N 2.99Å; E585-L588 VanDerWaalsContact O-N 3.12Å; E585-H589 PolarHBondContact O-N 2.69Å
586	F	32.4	Very low	36.3	Very low	188 Å²	188	132.4 Å²	132.4	83%	0.825	66%	0.66	S	S	*	*	H	α-helix	trans	-63.9	-29.4	-179.5	-104	-85.9	0	0	0	113.8	Q584	Q584-F586 PolarHBondContact O-N 3.1Å
587	N	41.3	Very low	37.5	Very low	133 Å²	133	127.4 Å²	127.4	71%	0.711	64%	0.637	S	S	*	*	H	α-helix	trans	-78.4	-31.1	174.1	-86.8	-19.3	0	0	0	112.7	E585 S590 L591	E585-N587 VanDerWaalsContact C-N 3.28Å; E585-N587 PolarHBondContact O-N 3.47Å; N587-S590 PolarHBondContact O-OG 2.97Å; N587-S590 VanDerWaalsContact O-OG 3.07Å; N587-L591 WeakPolarHBondContact O-CB 3.25Å; N587-L591 PolarHBondContact O-N 3.24Å
588	L	37.6	Very low	38.5	Very low	104 Å²	104	126.5 Å²	126.5	55%	0.545	62%	0.615	S	S	.	*	H	α-helix	trans	-69.1	-38	174.8	-78.5	166.3	0	0	0	111.3	E585 S590 L591 F592	E585-L588 PolarHBondContact O-N 2.99Å; E585-L588 VanDerWaalsContact O-N 3.12Å; L588-S590 PolarHBondContact O-N 3.33Å; L588-L591 PolarHBondContact O-N 3.2Å; L588-F592 WeakPolarHBondContact O-CB 3.35Å; L588-F592 PolarHBondContact O-N 2.93Å
589	H	39.8	Very low	39.4	Very low	143 Å²	143	118.6 Å²	118.6	66%	0.662	58%	0.583	S	S	*	*	H	α-helix	trans	-68.8	-36	-176.8	-154	-13.5	0	0	0	113.1	E585 K593	E585-H589 PolarHBondContact O-N 2.69Å; H589-K593 WeakPolarHBondContact O-CB 3.29Å; H589-K593 PolarHBondContact O-N 2.94Å
590	S	44.8	Very low	40.5	Very low	67 Å²	67	113.9 Å²	113.9	47%	0.469	56%	0.559	S	S	.	*	H	α-helix	trans	-70.7	-41.3	173.1	62.1	0	0	0	0	111.9	N587 L588 F592 K593 Y594	N587-S590 PolarHBondContact O-OG 2.97Å; N587-S590 VanDerWaalsContact O-OG 3.07Å; L588-S590 PolarHBondContact O-N 3.33Å; S590-F592 VanDerWaalsContact C-N 3.34Å; S590-F592 PolarHBondContact O-N 3.42Å; S590-K593 PolarHBondContact O-N 3.27Å; S590-Y594 PolarHBondContact O-N 3.48Å
591	L	41.4	Very low	41.8	Very low	79 Å²	79	111.1 Å²	111.1	41%	0.414	54%	0.539	S	S	.	.	H	α-helix	trans	-60.8	-42.1	174.1	-142.8	82.7	0	0	0	111.7	N587 L588 Y594 R595	N587-L591 WeakPolarHBondContact O-CB 3.25Å; N587-L591 PolarHBondContact O-N 3.24Å; L588-L591 PolarHBondContact O-N 3.2Å; L591-Y594 PolarHBondContact O-N 3.13Å; L591-R595 WeakPolarHBondContact O-CB 3.47Å; L591-R595 VanDerWaalsContact O-CG 3.25Å; L591-R595 WeakPolarHBondContact O-CG 3.47Å; L591-R595 PolarHBondContact O-N 3.01Å
592	F	40.3	Very low	42.6	Very low	86 Å²	86	106.4 Å²	106.4	38%	0.377	51%	0.514	S	S	.	.	H	α-helix	trans	-63.3	-43.6	174.4	-114.8	-87.5	0	0	0	111.7	L569 L588 S590 Y594 R595 V596	L569-F592 HydrophobicContact CD2-CE1 4.44Å; L588-F592 WeakPolarHBondContact O-CB 3.35Å; L588-F592 PolarHBondContact O-N 2.93Å; S590-F592 VanDerWaalsContact C-N 3.34Å; S590-F592 PolarHBondContact O-N 3.42Å; F592-Y594 VanDerWaalsContact C-N 3.33Å; F592-Y594 PolarHBondContact O-N 2.84Å; F592-R595 PolarHBondContact O-N 3.03Å; F592-V596 HydrophobicContact CD1-CG2 4.32Å; F592-V596 WeakPolarHBondContact O-CB 3.13Å; F592-V596 VanDerWaalsContact O-CG2 3.28Å; F592-V596 WeakPolarHBondContact O-CG2 3.13Å; F592-V596 PolarHBondContact O-N 2.78Å
593	K	46.8	Very low	43.5	Very low	167 Å²	167	101.2 Å²	101.2	73%	0.726	48%	0.482	S	S	*	.	H	α-helix	trans	-62.7	-40.3	178.7	-155.6	171.9	-173.7	176.7	0	111.5	H589 S590 Q597	H589-K593 WeakPolarHBondContact O-CB 3.29Å; H589-K593 PolarHBondContact O-N 2.94Å; S590-K593 PolarHBondContact O-N 3.27Å; K593-Q597 WeakPolarHBondContact O-CB 3.38Å; K593-Q597 PolarHBondContact O-N 3.25Å; K593-Q597 VanDerWaalsContact O-N 3.09Å
594	Y	46.9	Very low	44.2	Very low	154 Å²	154	100.8 Å²	100.8	60%	0.604	47%	0.468	S	S	*	.	H	α-helix	trans	-68.9	-42.7	174.8	-167.1	-107.6	0	0	0	112.5	S590 L591 F592 Q597 I598	S590-Y594 PolarHBondContact O-N 3.48Å; L591-Y594 PolarHBondContact O-N 3.13Å; F592-Y594 VanDerWaalsContact C-N 3.33Å; F592-Y594 PolarHBondContact O-N 2.84Å; Y594-Q597 WeakPolarHBondContact O-CB 3.32Å; Y594-Q597 PolarHBondContact O-N 3.06Å; Y594-I598 HydrophobicContact CD1-CD1 3.75Å; Y594-I598 HydrophobicContact CE1-CD1 3.62Å; Y594-I598 HydrophobicContact CE1-CG1 4.46Å; Y594-I598 WeakPolarHBondContact O-CG1 3.44Å; Y594-I598 PolarHBondContact O-N 3.43Å
595	R	42.3	Very low	44.9	Very low	90 Å²	90	95.5 Å²	95.5	34%	0.34	45%	0.445	S	S	.	.	H	α-helix	trans	-66.8	-40.8	177.1	-73.7	173.5	177.3	-163.2	-3.8	112.7	L591 F592 Q597 I598 V599	L591-R595 WeakPolarHBondContact O-CB 3.47Å; L591-R595 VanDerWaalsContact O-CG 3.25Å; L591-R595 WeakPolarHBondContact O-CG 3.47Å; L591-R595 PolarHBondContact O-N 3.01Å; F592-R595 PolarHBondContact O-N 3.03Å; R595-Q597 VanDerWaalsContact C-N 3.28Å; R595-Q597 PolarHBondContact O-N 3.48Å; R595-I598 PolarHBondContact O-N 3.17Å; R595-V599 WeakPolarHBondContact O-CG2 3.3Å; R595-V599 PolarHBondContact O-N 3.2Å
596	V	49.2	Very low	45.6	Very low	40 Å²	40	93.1 Å²	93.1	24%	0.242	44%	0.441	C	S	.	.	H	α-helix	trans	-63.5	-35	172.2	169.8	0	0	0	0	111.1	L569 F592 V599 K600	L569-V596 HydrophobicContact CD2-CG2 4.24Å; F592-V596 HydrophobicContact CD1-CG2 4.32Å; F592-V596 WeakPolarHBondContact O-CB 3.13Å; F592-V596 VanDerWaalsContact O-CG2 3.28Å; F592-V596 WeakPolarHBondContact O-CG2 3.13Å; F592-V596 PolarHBondContact O-N 2.78Å; V596-V599 PolarHBondContact O-N 2.78Å; V596-K600 HydrophobicContact CG1-CD 4.28Å; V596-K600 WeakPolarHBondContact O-CB 3.19Å; V596-K600 WeakPolarHBondContact O-CG 3.4Å; V596-K600 PolarHBondContact O-N 2.99Å
597	Q	51.6	Low	46.2	Very low	85 Å²	85	87.7 Å²	87.7	40%	0.397	42%	0.42	S	S	.	.	H	α-helix	trans	-66.2	-45.2	173.5	-168.1	59.9	35.1	0	0	111.5	K593 Y594 R595 V599 K600 D601	K593-Q597 WeakPolarHBondContact O-CB 3.38Å; K593-Q597 PolarHBondContact O-N 3.25Å; K593-Q597 VanDerWaalsContact O-N 3.09Å; Y594-Q597 WeakPolarHBondContact O-CB 3.32Å; Y594-Q597 PolarHBondContact O-N 3.06Å; R595-Q597 VanDerWaalsContact C-N 3.28Å; R595-Q597 PolarHBondContact O-N 3.48Å; Q597-V599 VanDerWaalsContact C-N 3.33Å; Q597-V599 PolarHBondContact O-N 2.9Å; Q597-K600 PolarHBondContact O-N 3.49Å; Q597-K600 VanDerWaalsContact O-N 3.16Å; Q597-D601 PolarHBondContact NE2-OD2 2.98Å; Q597-D601 PolarHBondContact O-N 3.08Å
598	I	51.2	Low	46.5	Very low	51 Å²	51	82 Å²	82	26%	0.262	39%	0.389	S	S	.	.	H	α-helix	trans	-58	-43	173.3	-69.3	166.5	0	0	0	111.6	Y594 R595 D601 R602	Y594-I598 HydrophobicContact CD1-CD1 3.75Å; Y594-I598 HydrophobicContact CE1-CD1 3.62Å; Y594-I598 HydrophobicContact CE1-CG1 4.46Å; Y594-I598 WeakPolarHBondContact O-CG1 3.44Å; Y594-I598 PolarHBondContact O-N 3.43Å; R595-I598 PolarHBondContact O-N 3.17Å; I598-D601 PolarHBondContact O-N 3.08Å; I598-R602 HydrophobicContact CG2-CG 4.36Å; I598-R602 WeakPolarHBondContact O-CB 3.49Å; I598-R602 VanDerWaalsContact O-CG 3.29Å; I598-R602 WeakPolarHBondContact O-CG 3.45Å; I598-R602 PolarHBondContact O-N 3.48Å
599	V	46.2	Very low	47.1	Very low	23 Å²	23	79.3 Å²	79.3	14%	0.139	38%	0.375	C	S	.	.	H	α-helix	trans	-64.6	-42.3	176.2	172	0	0	0	0	111.1	F565 R595 V596 Q597 R602 L603	F565-V599 HydrophobicContact CZ-CG1 4.49Å; R595-V599 WeakPolarHBondContact O-CG2 3.3Å; R595-V599 PolarHBondContact O-N 3.2Å; V596-V599 PolarHBondContact O-N 2.78Å; Q597-V599 VanDerWaalsContact C-N 3.33Å; Q597-V599 PolarHBondContact O-N 2.9Å; V599-R602 PolarHBondContact O-N 3.45Å; V599-L603 HydrophobicContact CG1-CD1 3.86Å; V599-L603 HydrophobicContact CG1-CG 4.37Å; V599-L603 WeakPolarHBondContact O-CB 3.29Å; V599-L603 VanDerWaalsContact O-CG 3.31Å; V599-L603 WeakPolarHBondContact O-CG 3.47Å; V599-L603 PolarHBondContact O-N 3.39Å
600	K	50.3	Low	47.3	Very low	95 Å²	95	78 Å²	78	41%	0.413	37%	0.368	S	S	.	.	H	α-helix	trans	-62.7	-41.3	175.2	-77	175.3	178.8	179.8	0	112.7	V596 Q597 R604	V596-K600 HydrophobicContact CG1-CD 4.28Å; V596-K600 WeakPolarHBondContact O-CB 3.19Å; V596-K600 WeakPolarHBondContact O-CG 3.4Å; V596-K600 PolarHBondContact O-N 2.99Å; Q597-K600 PolarHBondContact O-N 3.49Å; Q597-K600 VanDerWaalsContact O-N 3.16Å; K600-R604 VanDerWaalsContact O-CG 3.31Å; K600-R604 WeakPolarHBondContact O-CG 3.45Å; K600-R604 PolarHBondContact O-N 2.89Å; K600-R604 VanDerWaalsContact O-N 3.14Å
601	D	54.2	Low	47.1	Very low	74 Å²	74	78 Å²	78	40%	0.396	36%	0.362	S	S	.	.	H	α-helix	trans	-77.1	-28.5	-179.6	-67	-36.4	0	0	0	112.2	Q597 I598 R604	Q597-D601 PolarHBondContact NE2-OD2 2.98Å; Q597-D601 PolarHBondContact O-N 3.08Å; I598-D601 PolarHBondContact O-N 3.08Å; D601-R604 PolarHBondContact O-N 3.5Å; D601-R604 IonicContact OD1-CZ 3.91Å; D601-R604 IonicContact OD1-NH1 2.95Å; D601-R604 PolarHBondContact OD1-NH1 3.34Å
602	R	46.3	Very low	47.2	Very low	75 Å²	75	76.2 Å²	76.2	28%	0.283	35%	0.352	S	S	.	.	H	α-helix	trans	-71.8	-40.1	168.3	-72.4	178.5	-176.9	-179.7	3.9	112.8	I598 V599 R604 N605	I598-R602 HydrophobicContact CG2-CG 4.36Å; I598-R602 WeakPolarHBondContact O-CB 3.49Å; I598-R602 VanDerWaalsContact O-CG 3.29Å; I598-R602 WeakPolarHBondContact O-CG 3.45Å; I598-R602 PolarHBondContact O-N 3.48Å; V599-R602 PolarHBondContact O-N 3.45Å; R602-R604 PolarHBondContact O-N 2.95Å; R602-N605 WeakPolarHBondContact O-CB 3.26Å; R602-N605 PolarHBondContact O-N 3.35Å
603	L	47.4	Very low	47.4	Very low	11 Å²	11	76.1 Å²	76.1	6%	0.058	35%	0.351	C	S	.	.	H	α-helix	trans	-67.3	-17.9	173.6	-74.4	171.3	0	0	0	113.2	F565 V599 N605 N609 L631	F565-L603 HydrophobicContact CD2-CD1 4.25Å; F565-L603 HydrophobicContact CE2-CD1 4.05Å; V599-L603 HydrophobicContact CG1-CD1 3.86Å; V599-L603 HydrophobicContact CG1-CG 4.37Å; V599-L603 WeakPolarHBondContact O-CB 3.29Å; V599-L603 VanDerWaalsContact O-CG 3.31Å; V599-L603 WeakPolarHBondContact O-CG 3.47Å; V599-L603 PolarHBondContact O-N 3.39Å; L603-N605 VanDerWaalsContact C-N 3.26Å; L603-N609 PolarHBondContact O-ND2 2.93Å; L603-L631 HydrophobicContact CD2-CD1 4.43Å
604	R	48.4	Very low	46.9	Very low	157 Å²	157	76 Å²	76	59%	0.592	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-6.9	168.7	-77.1	165.3	165.6	-178.2	-9	113.7	K600 D601 R602 P606	K600-R604 VanDerWaalsContact O-CG 3.31Å; K600-R604 WeakPolarHBondContact O-CG 3.45Å; K600-R604 PolarHBondContact O-N 2.89Å; K600-R604 VanDerWaalsContact O-N 3.14Å; D601-R604 PolarHBondContact O-N 3.5Å; D601-R604 IonicContact OD1-CZ 3.91Å; D601-R604 IonicContact OD1-NH1 2.95Å; D601-R604 PolarHBondContact OD1-NH1 3.34Å; R602-R604 PolarHBondContact O-N 2.95Å; R604-P606 WeakPolarHBondContact O-CD 3.44Å
605	N	52.2	Low	46.6	Very low	49 Å²	49	69.9 Å²	69.9	26%	0.262	32%	0.323	S	S	.	.			trans	-63.5	122.2	177.3	-173.9	-26.8	0	0	0	110.5	R602 L603 I607 I608 N609	R602-N605 WeakPolarHBondContact O-CB 3.26Å; R602-N605 PolarHBondContact O-N 3.35Å; L603-N605 VanDerWaalsContact C-N 3.26Å; N605-I607 PolarHBondContact O-N 2.93Å; N605-I607 WeakPolarHBondContact OD1-CB 3.41Å; N605-I607 PolarHBondContact OD1-N 3.14Å; N605-I608 HydrophobicContact CB-CD1 4.28Å; N605-I608 HydrophobicContact CB-CG1 4.32Å; N605-I608 PolarHBondContact O-N 3.01Å; N605-N609 PolarHBondContact O-N 2.97Å; N605-N609 PolarHBondContact O-ND2 3.41Å
606	P	47.2	Very low	46.3	Very low	85 Å²	85	71.7 Å²	71.7	55%	0.552	35%	0.348	S	S	*	.	H	α-helix	trans	-67.3	-19.7	-178.4	27.6	-35.6	0	0	0	113.7	R604 K610	R604-P606 WeakPolarHBondContact O-CD 3.44Å; P606-K610 WeakPolarHBondContact O-CB 3.26Å; P606-K610 WeakPolarHBondContact O-CG 3.46Å; P606-K610 PolarHBondContact O-N 2.91Å
607	I	45	Very low	45.8	Very low	74 Å²	74	71.8 Å²	71.8	38%	0.379	35%	0.347	S	S	.	.	H	α-helix	trans	-70.4	-49.3	175.8	-58.8	174.7	0	0	0	109.7	N605 N609 K610 L611	N605-I607 PolarHBondContact O-N 2.93Å; N605-I607 WeakPolarHBondContact OD1-CB 3.41Å; N605-I607 PolarHBondContact OD1-N 3.14Å; I607-N609 VanDerWaalsContact C-N 3.3Å; I607-N609 PolarHBondContact O-N 3.05Å; I607-K610 PolarHBondContact O-N 3.44Å; I607-K610 VanDerWaalsContact O-N 3.13Å; I607-L611 HydrophobicContact CG2-CD1 4.1Å; I607-L611 HydrophobicContact CG2-CG 4.48Å; I607-L611 WeakPolarHBondContact O-CG 3.49Å; I607-L611 PolarHBondContact O-N 3.4Å
608	I	47.6	Very low	45.4	Very low	12 Å²	12	71.3 Å²	71.3	6%	0.062	34%	0.344	C	S	.	.	H	α-helix	trans	-61.1	-40.5	176.5	-61.9	178.4	0	0	0	110.6	N605 L611 H612 F627	N605-I608 HydrophobicContact CB-CD1 4.28Å; N605-I608 HydrophobicContact CB-CG1 4.32Å; N605-I608 PolarHBondContact O-N 3.01Å; I608-L611 PolarHBondContact O-N 2.89Å; I608-H612 WeakPolarHBondContact O-CB 3.24Å; I608-H612 PolarHBondContact O-N 2.81Å; I608-F627 HydrophobicContact CG2-CZ 4.26Å
609	N	49.6	Very low	45	Very low	48 Å²	48	76.6 Å²	76.6	26%	0.257	37%	0.368	S	S	.	.	H	α-helix	trans	-67.6	-35.8	175.1	-75.2	-64.8	0	0	0	113.3	L603 N605 I607 K613	L603-N609 PolarHBondContact O-ND2 2.93Å; N605-N609 PolarHBondContact O-N 2.97Å; N605-N609 PolarHBondContact O-ND2 3.41Å; I607-N609 VanDerWaalsContact C-N 3.3Å; I607-N609 PolarHBondContact O-N 3.05Å; N609-K613 WeakPolarHBondContact O-CB 3.28Å; N609-K613 PolarHBondContact O-N 3.01Å
610	K	45.5	Very low	44.9	Very low	116 Å²	116	77.3 Å²	77.3	50%	0.504	37%	0.371	S	S	.	.	H	α-helix	trans	-64.5	-45.8	170.1	-84.9	-178.8	176.1	-179.4	0	111.3	P606 I607 K613 Y614	P606-K610 WeakPolarHBondContact O-CB 3.26Å; P606-K610 WeakPolarHBondContact O-CG 3.46Å; P606-K610 PolarHBondContact O-N 2.91Å; I607-K610 PolarHBondContact O-N 3.44Å; I607-K610 VanDerWaalsContact O-N 3.13Å; K610-K613 WeakPolarHBondContact O-CB 3.14Å; K610-K613 PolarHBondContact O-N 3.41Å; K610-K613 VanDerWaalsContact O-N 3.15Å; K610-Y614 HydrophobicContact CB-CD2 4.43Å; K610-Y614 HydrophobicContact CB-CE2 4.43Å; K610-Y614 WeakPolarHBondContact O-CD2 3.42Å; K610-Y614 PolarHBondContact O-N 3.25Å
611	L	40.1	Very low	44.4	Very low	66 Å²	66	75.5 Å²	75.5	35%	0.346	37%	0.373	S	S	.	.	H	α-helix	trans	-61	-47.3	179.3	-71.9	173.4	0	0	0	111.6	I607 I608 K613 Y614 W615 I654 L658	I607-L611 HydrophobicContact CG2-CD1 4.1Å; I607-L611 HydrophobicContact CG2-CG 4.48Å; I607-L611 WeakPolarHBondContact O-CG 3.49Å; I607-L611 PolarHBondContact O-N 3.4Å; I608-L611 PolarHBondContact O-N 2.89Å; L611-K613 VanDerWaalsContact C-N 3.29Å; L611-K613 PolarHBondContact O-N 3Å; L611-Y614 CarbonylContact O-C 3.59Å; L611-Y614 PolarHBondContact O-N 3.36Å; L611-W615 WeakPolarHBondContact O-CB 3.46Å; L611-W615 PolarHBondContact O-N 3.33Å; L611-I654 HydrophobicContact CD1-CG2 4.42Å; L611-L658 HydrophobicContact CD1-CD1 4.48Å; L611-L658 HydrophobicContact CD1-CD2 4.22Å; L611-L658 HydrophobicContact CD2-CD1 4.48Å; L611-L658 HydrophobicContact CD2-CD2 3.84Å
612	H	43.9	Very low	43.7	Very low	42 Å²	42	76.4 Å²	76.4	19%	0.194	38%	0.377	C	S	.	.	H	α-helix	trans	-61.4	-36	173.8	-172.9	-101.6	0	0	0	112.5	I608 W615 F627	I608-H612 WeakPolarHBondContact O-CB 3.24Å; I608-H612 PolarHBondContact O-N 2.81Å; H612-W615 AromaticContact CD2-CE3 3.71Å; H612-W615 AromaticContact CD2-CZ3 3.86Å; H612-W615 WeakPolarHBondContact O-CB 3.19Å; H612-W615 PolarHBondContact O-N 2.71Å; H612-F627 AromaticContact CD2-CE1 3.92Å
613	K	42.8	Very low	43.5	Very low	84 Å²	84	73.5 Å²	73.5	37%	0.365	37%	0.369	S	S	.	.	H	α-helix	trans	-71.6	-27.3	178.3	-168.7	-179.4	-179.1	-168.7	0	113.5	R273 N609 K610 L611	R273-K613 PolarHBondContact O-NZ 3.4Å; N609-K613 WeakPolarHBondContact O-CB 3.28Å; N609-K613 PolarHBondContact O-N 3.01Å; K610-K613 WeakPolarHBondContact O-CB 3.14Å; K610-K613 PolarHBondContact O-N 3.41Å; K610-K613 VanDerWaalsContact O-N 3.15Å; L611-K613 VanDerWaalsContact C-N 3.29Å; L611-K613 PolarHBondContact O-N 3Å
614	Y	38.2	Very low	43.4	Very low	164 Å²	164	74.9 Å²	74.9	64%	0.643	38%	0.376	S	S	*	.	H	α-helix	trans	-99.7	3.5	175.7	-66.9	-59.4	0	0	0	113.9	K610 L611 C616	K610-Y614 HydrophobicContact CB-CD2 4.43Å; K610-Y614 HydrophobicContact CB-CE2 4.43Å; K610-Y614 WeakPolarHBondContact O-CD2 3.42Å; K610-Y614 PolarHBondContact O-N 3.25Å; L611-Y614 CarbonylContact O-C 3.59Å; L611-Y614 PolarHBondContact O-N 3.36Å; Y614-C616 PolarHBondContact O-N 3.42Å
615	W	39.8	Very low	43.2	Very low	26 Å²	26	73.9 Å²	73.9	10%	0.098	38%	0.376	C	S	.	.			trans	-71	119.2	-177.7	-173.4	29.7	0	0	0	111.6	L611 H612 L617 K618 A623 Q624 F627 Q665	L611-W615 WeakPolarHBondContact O-CB 3.46Å; L611-W615 PolarHBondContact O-N 3.33Å; H612-W615 AromaticContact CD2-CE3 3.71Å; H612-W615 AromaticContact CD2-CZ3 3.86Å; H612-W615 WeakPolarHBondContact O-CB 3.19Å; H612-W615 PolarHBondContact O-N 2.71Å; W615-L617 PolarHBondContact O-N 3.27Å; W615-L617 VanDerWaalsContact O-N 3.1Å; W615-K618 HydrophobicContact CB-CB 4.43Å; W615-K618 HydrophobicContact CE3-CB 4.39Å; W615-K618 WeakPolarHBondContact O-CB 3.32Å; W615-K618 PolarHBondContact O-N 3.45Å; W615-K618 VanDerWaalsContact O-N 3.11Å; W615-A623 HydrophobicContact CH2-CB 4.01Å; W615-A623 WeakPolarHBondContact CH2-O 3.46Å; W615-A623 HydrophobicContact CZ2-CB 3.68Å; W615-Q624 HydrophobicContact CZ3-CG 4.13Å; W615-F627 HydrophobicContact CH2-CB 3.57Å; W615-F627 HydrophobicContact CH2-CD1 4.19Å; W615-F627 HydrophobicContact CH2-CG 4.02Å; W615-F627 HydrophobicContact CZ2-CB 4.23Å; W615-F627 HydrophobicContact CZ3-CB 4.28Å; W615-F627 HydrophobicContact CZ3-CD1 4.07Å; W615-F627 HydrophobicContact CZ3-CG 4.36Å; W615-Q665 VanDerWaalsContact NE1-NE2 3.12Å
616	C	36.6	Very low	42.8	Very low	128 Å²	128	75 Å²	75	87%	0.865	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-17.9	-178.7	-65	0	0	0	0	113.7	Y614	Y614-C616 PolarHBondContact O-N 3.42Å
617	L	38.7	Very low	42.8	Very low	43 Å²	43	71.9 Å²	71.9	23%	0.225	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	22.3	178.4	-65.1	175.7	0	0	0	113	W615 E619 N620 A623	W615-L617 PolarHBondContact O-N 3.27Å; W615-L617 VanDerWaalsContact O-N 3.1Å; L617-E619 PolarHBondContact O-N 3.02Å; L617-N620 HydrophobicContact CB-CB 4.24Å; L617-N620 HydrophobicContact CD2-CB 4.41Å; L617-N620 PolarHBondContact O-N 3.18Å; L617-A623 HydrophobicContact CB-CB 4.07Å; L617-A623 HydrophobicContact CD1-CB 4.48Å
618	K	42.2	Very low	42.9	Very low	74 Å²	74	68.6 Å²	68.6	32%	0.322	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-18.3	177.5	75.8	-172.4	-178.3	-174.9	0	114.5	D271 W615 Q624	D271-K618 IonicContact OD2-NZ 2.65Å; W615-K618 HydrophobicContact CB-CB 4.43Å; W615-K618 HydrophobicContact CE3-CB 4.39Å; W615-K618 WeakPolarHBondContact O-CB 3.32Å; W615-K618 PolarHBondContact O-N 3.45Å; W615-K618 VanDerWaalsContact O-N 3.11Å; K618-Q624 PolarHBondContact O-NE2 3.34Å
619	E	43.1	Very low	42.8	Very low	163 Å²	163	72.4 Å²	72.4	76%	0.762	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	-6.6	-178.6	-54.7	-176.5	-177	0	0	112.8	L617 A621	L617-E619 PolarHBondContact O-N 3.02Å; E619-A621 PolarHBondContact O-N 3.05Å
620	N	42.9	Very low	42.5	Very low	38 Å²	38	72 Å²	72	20%	0.203	36%	0.356	C	S	.	.			trans	-87.7	105.1	177.7	-176.6	-28.6	0	0	0	110.1	L617 L622 A623 Q624 Q672	L617-N620 HydrophobicContact CB-CB 4.24Å; L617-N620 HydrophobicContact CD2-CB 4.41Å; L617-N620 PolarHBondContact O-N 3.18Å; N620-L622 PolarHBondContact O-N 3.01Å; N620-L622 VanDerWaalsContact O-N 3.1Å; N620-L622 PolarHBondContact OD1-N 2.71Å; N620-A623 HydrophobicContact CB-CB 3.98Å; N620-A623 WeakPolarHBondContact O-CB 3.45Å; N620-A623 PolarHBondContact O-N 3.09Å; N620-A623 PolarHBondContact OD1-N 2.93Å; N620-Q624 PolarHBondContact O-N 3.09Å; N620-Q672 PolarHBondContact ND2-OE1 3.24Å
621	A	41.1	Very low	42.5	Very low	57 Å²	57	68 Å²	68	47%	0.471	34%	0.339	S	S	.	.	H	α-helix	trans	-57.8	-25.6	-176.9	0	0	0	0	0	114.6	E619 K625	E619-A621 PolarHBondContact O-N 3.05Å; A621-K625 WeakPolarHBondContact O-CB 3.35Å; A621-K625 WeakPolarHBondContact O-CG 3.33Å; A621-K625 PolarHBondContact O-N 2.78Å; A621-K625 VanDerWaalsContact O-N 3.13Å
622	L	39.6	Very low	42.7	Very low	92 Å²	92	67.9 Å²	67.9	48%	0.482	34%	0.335	S	S	.	.	H	α-helix	trans	-80	-39.3	178.2	-156.1	152.8	0	0	0	110.6	N620 K625 I626	N620-L622 PolarHBondContact O-N 3.01Å; N620-L622 VanDerWaalsContact O-N 3.1Å; N620-L622 PolarHBondContact OD1-N 2.71Å; L622-K625 PolarHBondContact O-N 3.35Å; L622-I626 HydrophobicContact CD2-CD1 3.6Å; L622-I626 HydrophobicContact CD2-CG1 4.29Å; L622-I626 WeakPolarHBondContact O-CG1 3.39Å; L622-I626 PolarHBondContact O-N 3.03Å
623	A	42.1	Very low	42.6	Very low	14 Å²	14	70.4 Å²	70.4	12%	0.116	35%	0.349	C	S	.	.	H	α-helix	trans	-61.5	-47.7	170.7	0	0	0	0	0	111.1	W615 L617 N620 K625 I626 F627	W615-A623 HydrophobicContact CH2-CB 4.01Å; W615-A623 WeakPolarHBondContact CH2-O 3.46Å; W615-A623 HydrophobicContact CZ2-CB 3.68Å; L617-A623 HydrophobicContact CB-CB 4.07Å; L617-A623 HydrophobicContact CD1-CB 4.48Å; N620-A623 HydrophobicContact CB-CB 3.98Å; N620-A623 WeakPolarHBondContact O-CB 3.45Å; N620-A623 PolarHBondContact O-N 3.09Å; N620-A623 PolarHBondContact OD1-N 2.93Å; A623-K625 PolarHBondContact O-N 2.75Å; A623-I626 PolarHBondContact O-N 2.84Å; A623-F627 WeakPolarHBondContact O-CB 3.49Å; A623-F627 PolarHBondContact O-N 3.35Å
624	Q	44.4	Very low	42.6	Very low	40 Å²	40	67.3 Å²	67.3	19%	0.187	34%	0.337	C	S	.	.	H	α-helix	trans	-53.1	-49.5	174.2	-71.9	-179.5	-11	0	0	112.2	W615 K618 N620 I626 F627 I628	W615-Q624 HydrophobicContact CZ3-CG 4.13Å; K618-Q624 PolarHBondContact O-NE2 3.34Å; N620-Q624 PolarHBondContact O-N 3.09Å; Q624-I626 PolarHBondContact O-N 3.25Å; Q624-F627 PolarHBondContact O-N 2.78Å; Q624-I628 WeakPolarHBondContact O-CB 3.43Å; Q624-I628 WeakPolarHBondContact O-CG1 3.48Å; Q624-I628 PolarHBondContact O-N 2.81Å
625	K	44.8	Very low	42.8	Very low	136 Å²	136	60.4 Å²	60.4	59%	0.591	31%	0.313	S	S	*	.	H	α-helix	trans	-63.2	-39.9	179.3	-78.9	176.5	178.6	177.9	0	113	A621 L622 A623 I628 H629	A621-K625 WeakPolarHBondContact O-CB 3.35Å; A621-K625 WeakPolarHBondContact O-CG 3.33Å; A621-K625 PolarHBondContact O-N 2.78Å; A621-K625 VanDerWaalsContact O-N 3.13Å; L622-K625 PolarHBondContact O-N 3.35Å; A623-K625 PolarHBondContact O-N 2.75Å; K625-I628 PolarHBondContact O-N 3.38Å; K625-H629 VanDerWaalsContact O-CB 3.32Å; K625-H629 WeakPolarHBondContact O-CB 3.48Å; K625-H629 PolarHBondContact O-N 2.85Å
626	I	43.7	Very low	42.5	Very low	72 Å²	72	61.9 Å²	61.9	37%	0.369	32%	0.32	S	S	.	.	H	α-helix	trans	-66.8	-43.2	176.2	-69.4	174.7	0	0	0	110.9	L622 A623 Q624 I628 H629 E630 L668	L622-I626 HydrophobicContact CD2-CD1 3.6Å; L622-I626 HydrophobicContact CD2-CG1 4.29Å; L622-I626 WeakPolarHBondContact O-CG1 3.39Å; L622-I626 PolarHBondContact O-N 3.03Å; A623-I626 PolarHBondContact O-N 2.84Å; Q624-I626 PolarHBondContact O-N 3.25Å; I626-I628 VanDerWaalsContact C-N 3.32Å; I626-I628 PolarHBondContact O-N 3.35Å; I626-H629 PolarHBondContact O-N 3.42Å; I626-H629 VanDerWaalsContact O-N 3.14Å; I626-E630 PolarHBondContact O-N 2.92Å; I626-L668 HydrophobicContact CD1-CD1 4.19Å
627	F	46.5	Very low	42.7	Very low	20 Å²	20	59 Å²	59	9%	0.088	31%	0.312	C	S	.	.	H	α-helix	trans	-59	-42.8	176.3	179.8	-124.5	0	0	0	112.2	I608 H612 W615 A623 Q624 E630 L631	I608-F627 HydrophobicContact CG2-CZ 4.26Å; H612-F627 AromaticContact CD2-CE1 3.92Å; W615-F627 HydrophobicContact CH2-CB 3.57Å; W615-F627 HydrophobicContact CH2-CD1 4.19Å; W615-F627 HydrophobicContact CH2-CG 4.02Å; W615-F627 HydrophobicContact CZ2-CB 4.23Å; W615-F627 HydrophobicContact CZ3-CB 4.28Å; W615-F627 HydrophobicContact CZ3-CD1 4.07Å; W615-F627 HydrophobicContact CZ3-CG 4.36Å; A623-F627 WeakPolarHBondContact O-CB 3.49Å; A623-F627 PolarHBondContact O-N 3.35Å; Q624-F627 PolarHBondContact O-N 2.78Å; F627-E630 PolarHBondContact O-N 2.95Å; F627-L631 HydrophobicContact CD1-CD1 4.05Å; F627-L631 HydrophobicContact CD2-CD1 4.3Å; F627-L631 HydrophobicContact CE1-CD1 3.75Å; F627-L631 HydrophobicContact CE2-CD1 4.04Å; F627-L631 HydrophobicContact CE2-CG 4.41Å; F627-L631 HydrophobicContact CG-CD1 4.34Å; F627-L631 HydrophobicContact CZ-CD1 3.77Å; F627-L631 WeakPolarHBondContact O-CB 3.32Å; F627-L631 WeakPolarHBondContact O-CG 3.14Å; F627-L631 PolarHBondContact O-N 3.48Å
628	I	48	Very low	42.6	Very low	5 Å²	5	61.1 Å²	61.1	3%	0.026	32%	0.319	C	S	.	.	H	α-helix	trans	-64.8	-42	174.2	-73.3	171	0	0	0	111.4	L564 F565 L568 Q624 K625 I626 E630 L631 Y632	L564-I628 HydrophobicContact CB-CD1 3.34Å; L564-I628 HydrophobicContact CD1-CD1 4.01Å; L564-I628 HydrophobicContact CG-CD1 4.23Å; F565-I628 HydrophobicContact CD1-CG2 4.08Å; F565-I628 HydrophobicContact CD2-CG1 4.45Å; F565-I628 HydrophobicContact CD2-CG2 4.12Å; F565-I628 HydrophobicContact CE1-CG2 3.84Å; F565-I628 HydrophobicContact CE2-CB 4.37Å; F565-I628 HydrophobicContact CE2-CG1 4.05Å; F565-I628 HydrophobicContact CE2-CG2 3.89Å; F565-I628 HydrophobicContact CG-CG2 4.22Å; F565-I628 HydrophobicContact CZ-CB 4.4Å; F565-I628 HydrophobicContact CZ-CG2 3.74Å; L568-I628 HydrophobicContact CD1-CG2 3.91Å; Q624-I628 WeakPolarHBondContact O-CB 3.43Å; Q624-I628 WeakPolarHBondContact O-CG1 3.48Å; Q624-I628 PolarHBondContact O-N 2.81Å; K625-I628 PolarHBondContact O-N 3.38Å; I626-I628 VanDerWaalsContact C-N 3.32Å; I626-I628 PolarHBondContact O-N 3.35Å; I628-E630 PolarHBondContact O-N 2.89Å; I628-L631 PolarHBondContact O-N 2.76Å; I628-Y632 VanDerWaalsContact O-CB 3.3Å; I628-Y632 WeakPolarHBondContact O-CB 3.28Å; I628-Y632 PolarHBondContact O-N 2.94Å
629	H	45	Very low	42.3	Very low	93 Å²	93	64.9 Å²	64.9	43%	0.431	34%	0.343	S	S	.	.	H	α-helix	trans	-69.3	-31.4	179.9	-157.9	-50.2	0	0	0	112.8	K625 I626 I633	K625-H629 VanDerWaalsContact O-CB 3.32Å; K625-H629 WeakPolarHBondContact O-CB 3.48Å; K625-H629 PolarHBondContact O-N 2.85Å; I626-H629 PolarHBondContact O-N 3.42Å; I626-H629 VanDerWaalsContact O-N 3.14Å; H629-I633 VanDerWaalsContact ND1-CD1 3.34Å; H629-I633 WeakPolarHBondContact ND1-CD1 3.38Å; H629-I633 VanDerWaalsContact O-CG1 3.31Å; H629-I633 WeakPolarHBondContact O-CG1 3.45Å; H629-I633 PolarHBondContact O-N 3.14Å
630	E	43.2	Very low	41.9	Very low	39 Å²	39	61.4 Å²	61.4	18%	0.182	34%	0.342	C	S	.	.	H	α-helix	trans	-72.5	-46.2	170.2	-70.2	-143.2	93.3	0	0	111.9	I626 F627 I628 Y632 I633 T634 R664	I626-E630 PolarHBondContact O-N 2.92Å; F627-E630 PolarHBondContact O-N 2.95Å; I628-E630 PolarHBondContact O-N 2.89Å; E630-Y632 PolarHBondContact O-N 3.41Å; E630-I633 PolarHBondContact O-N 2.87Å; E630-T634 WeakPolarHBondContact O-CB 3.12Å; E630-T634 WeakPolarHBondContact O-CG2 3.22Å; E630-T634 PolarHBondContact O-N 3.16Å; E630-T634 PolarHBondContact O-OG1 3Å; E630-R664 IonicContact OE1-CZ 3.54Å; E630-R664 IonicContact OE1-NH1 3.85Å; E630-R664 PolarHBondContact OE1-NH1 2.86Å; E630-R664 IonicContact OE2-NH1 2.86Å; E630-R664 PolarHBondContact OE2-NH1 2.89Å
631	L	46.3	Very low	41.6	Very low	31 Å²	31	66.3 Å²	66.3	16%	0.162	37%	0.368	C	S	.	.	H	α-helix	trans	-56.8	-34.9	172.6	-76.5	168.3	0	0	0	111.9	F565 L603 F627 I628 T634 S635	F565-L631 HydrophobicContact CZ-CB 4.29Å; L603-L631 HydrophobicContact CD2-CD1 4.43Å; F627-L631 HydrophobicContact CD1-CD1 4.05Å; F627-L631 HydrophobicContact CD2-CD1 4.3Å; F627-L631 HydrophobicContact CE1-CD1 3.75Å; F627-L631 HydrophobicContact CE2-CD1 4.04Å; F627-L631 HydrophobicContact CE2-CG 4.41Å; F627-L631 HydrophobicContact CG-CD1 4.34Å; F627-L631 HydrophobicContact CZ-CD1 3.77Å; F627-L631 WeakPolarHBondContact O-CB 3.32Å; F627-L631 WeakPolarHBondContact O-CG 3.14Å; F627-L631 PolarHBondContact O-N 3.48Å; I628-L631 PolarHBondContact O-N 2.76Å; L631-T634 PolarHBondContact O-OG1 3.41Å; L631-S635 VanDerWaalsContact O-CB 3.26Å; L631-S635 WeakPolarHBondContact O-CB 3.49Å; L631-S635 PolarHBondContact O-N 2.87Å; L631-S635 PolarHBondContact O-OG 3.28Å
632	Y	44.2	Very low	41.2	Very low	65 Å²	65	69.5 Å²	69.5	26%	0.255	38%	0.378	S	S	.	.	H	α-helix	trans	-68.9	-52.6	173.5	-170.3	-99.3	0	0	0	112.7	F565 I628 E630 T634 S635 F636	F565-Y632 HydrophobicContact CE1-CD2 4.11Å; I628-Y632 VanDerWaalsContact O-CB 3.3Å; I628-Y632 WeakPolarHBondContact O-CB 3.28Å; I628-Y632 PolarHBondContact O-N 2.94Å; E630-Y632 PolarHBondContact O-N 3.41Å; Y632-T634 PolarHBondContact O-N 2.99Å; Y632-S635 PolarHBondContact O-N 2.91Å; Y632-S635 PolarHBondContact O-OG 3.07Å; Y632-S635 VanDerWaalsContact O-OG 3.07Å; Y632-F636 AromaticContact CD2-CE2 3.97Å; Y632-F636 HydrophobicContact CD2-CE2 3.97Å; Y632-F636 HydrophobicContact CE2-CD2 4.45Å; Y632-F636 AromaticContact CE2-CE2 3.62Å; Y632-F636 HydrophobicContact CE2-CE2 3.62Å; Y632-F636 AromaticContact CE2-CZ 3.93Å; Y632-F636 HydrophobicContact CE2-CZ 3.93Å; Y632-F636 AromaticContact CZ-CE2 3.93Å; Y632-F636 AromaticContact CZ-CZ 3.96Å; Y632-F636 VanDerWaalsContact O-CD2 3.23Å; Y632-F636 WeakPolarHBondContact O-CD2 2.92Å; Y632-F636 PolarHBondContact O-N 2.74Å
633	I	41.6	Very low	40.8	Very low	95 Å²	95	71.5 Å²	71.5	49%	0.487	39%	0.389	S	S	.	.	H	α-helix	trans	-59.6	-46.6	179.9	-71.4	166.9	0	0	0	111.4	H629 E630 S635 F636 G637	H629-I633 VanDerWaalsContact ND1-CD1 3.34Å; H629-I633 WeakPolarHBondContact ND1-CD1 3.38Å; H629-I633 VanDerWaalsContact O-CG1 3.31Å; H629-I633 WeakPolarHBondContact O-CG1 3.45Å; H629-I633 PolarHBondContact O-N 3.14Å; E630-I633 PolarHBondContact O-N 2.87Å; I633-S635 VanDerWaalsContact C-N 3.34Å; I633-S635 PolarHBondContact O-N 3.17Å; I633-F636 PolarHBondContact O-N 3.13Å; I633-G637 PolarHBondContact O-N 3.39Å
634	T	42	Very low	40.6	Very low	19 Å²	19	78.3 Å²	78.3	12%	0.117	42%	0.418	C	S	.	.	H	α-helix	trans	-72.9	-23.1	-174.4	57.9	0	0	0	0	113.5	E630 L631 Y632 F636 F638 Y653	E630-T634 WeakPolarHBondContact O-CB 3.12Å; E630-T634 WeakPolarHBondContact O-CG2 3.22Å; E630-T634 PolarHBondContact O-N 3.16Å; E630-T634 PolarHBondContact O-OG1 3Å; L631-T634 PolarHBondContact O-OG1 3.41Å; Y632-T634 PolarHBondContact O-N 2.99Å; T634-F636 VanDerWaalsContact C-N 3.35Å; T634-F638 WeakPolarHBondContact O-CD2 3.23Å; T634-F638 WeakPolarHBondContact O-CE2 3.06Å; T634-Y653 HydrophobicContact CG2-CE1 4.39Å; T634-Y653 WeakPolarHBondContact CG2-OH 3.28Å
635	S	42.2	Very low	40.2	Very low	18 Å²	18	85.1 Å²	85.1	13%	0.126	45%	0.447	C	S	.	.	H	α-helix	trans	-80.2	-15.4	173.3	52.7	0	0	0	0	113.9	L631 Y632 I633	L631-S635 VanDerWaalsContact O-CB 3.26Å; L631-S635 WeakPolarHBondContact O-CB 3.49Å; L631-S635 PolarHBondContact O-N 2.87Å; L631-S635 PolarHBondContact O-OG 3.28Å; Y632-S635 PolarHBondContact O-N 2.91Å; Y632-S635 PolarHBondContact O-OG 3.07Å; Y632-S635 VanDerWaalsContact O-OG 3.07Å; I633-S635 VanDerWaalsContact C-N 3.34Å; I633-S635 PolarHBondContact O-N 3.17Å
636	F	34.9	Very low	39.9	Very low	58 Å²	58	81.2 Å²	81.2	25%	0.254	43%	0.432	S	S	.	.	H	α-helix	trans	-99	-10.3	177.8	-81.8	-112.3	0	0	0	114.3	Y632 I633 T634	Y632-F636 AromaticContact CD2-CE2 3.97Å; Y632-F636 HydrophobicContact CD2-CE2 3.97Å; Y632-F636 HydrophobicContact CE2-CD2 4.45Å; Y632-F636 AromaticContact CE2-CE2 3.62Å; Y632-F636 HydrophobicContact CE2-CE2 3.62Å; Y632-F636 AromaticContact CE2-CZ 3.93Å; Y632-F636 HydrophobicContact CE2-CZ 3.93Å; Y632-F636 AromaticContact CZ-CE2 3.93Å; Y632-F636 AromaticContact CZ-CZ 3.96Å; Y632-F636 VanDerWaalsContact O-CD2 3.23Å; Y632-F636 WeakPolarHBondContact O-CD2 2.92Å; Y632-F636 PolarHBondContact O-N 2.74Å; I633-F636 PolarHBondContact O-N 3.13Å; T634-F636 VanDerWaalsContact C-N 3.35Å
637	G	39.3	Very low	39.6	Very low	67 Å²	67	82.9 Å²	82.9	69%	0.691	44%	0.441	S	S	*	.	S	Bend	trans	-91.8	4.3	-173.9	0	0	0	0	0	117.5	I633	I633-G637 PolarHBondContact O-N 3.39Å
638	F	37.6	Very low	39	Very low	88 Å²	88	90 Å²	90	39%	0.386	47%	0.472	S	S	.	.	S	Bend	trans	-108	123.9	178.9	-71.3	-87.2	0	0	0	111.2	T634	T634-F638 WeakPolarHBondContact O-CD2 3.23Å; T634-F638 WeakPolarHBondContact O-CE2 3.06Å
639	D	35.7	Very low	38.7	Very low	153 Å²	153	94 Å²	94	82%	0.818	49%	0.493	S	S	*	.			trans	-64.9	136.5	173.1	-85.1	-37.2	0	0	0	111.7	N641	D639-N641 PolarHBondContact O-N 2.96Å; D639-N641 VanDerWaalsContact O-N 3.11Å
640	A	35.8	Very low	38.5	Very low	90 Å²	90	91.6 Å²	91.6	74%	0.744	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-2.8	-165.2	0	0	0	0	0	115.6
641	N	36	Very low	38.3	Very low	140 Å²	140	94.1 Å²	94.1	75%	0.749	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-6.4	-164.3	-74	-0.8	0	0	0	116	D639	D639-N641 PolarHBondContact O-N 2.96Å; D639-N641 VanDerWaalsContact O-N 3.11Å
642	N	31.7	Very low	38.1	Very low	125 Å²	125	96.1 Å²	96.1	67%	0.668	51%	0.506	S	S	*	.			trans	-102.5	102.1	-174.6	-75.9	-4.8	0	0	0	113.3	N646	N642-N646 PolarHBondContact O-ND2 3.2Å
643	N	32.1	Very low	38	Very low	134 Å²	134	96.6 Å²	96.6	72%	0.717	51%	0.508	S	S	*	.			trans	-61.5	140.7	-176.9	-73	-35.7	0	0	0	114.8	K645	N643-K645 VanDerWaalsContact C-N 3.27Å; N643-K645 PolarHBondContact O-N 3.39Å
644	H	37.3	Very low	37.9	Very low	156 Å²	156	93.1 Å²	93.1	72%	0.722	49%	0.49	S	S	*	.	S	Bend	trans	51.6	-33.4	158.3	-65.6	-64.7	0	0	0	121.5	N646	H644-N646 VanDerWaalsContact C-N 3.27Å; H644-N646 PolarHBondContact O-N 2.9Å
645	K	36.5	Very low	37.8	Very low	183 Å²	183	99.1 Å²	99.1	80%	0.796	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-67.4	-26.1	176.3	-75.3	-171	171.6	-171.2	0	113.2	N643 I647 F648	N643-K645 VanDerWaalsContact C-N 3.27Å; N643-K645 PolarHBondContact O-N 3.39Å; K645-I647 PolarHBondContact O-N 3.41Å; K645-I647 VanDerWaalsContact O-N 3.11Å; K645-F648 PolarHBondContact O-N 2.77Å
646	N	38.2	Very low	37.7	Very low	55 Å²	55	103.3 Å²	103.3	29%	0.294	53%	0.53	S	S	.	.	G	3₁₀ helix	trans	-70.5	-1	-179.9	-75	-36.9	0	0	0	115.3	N642 H644	N642-N646 PolarHBondContact O-ND2 3.2Å; H644-N646 VanDerWaalsContact C-N 3.27Å; H644-N646 PolarHBondContact O-N 2.9Å
647	I	38.3	Very low	37.9	Very low	106 Å²	106	102.1 Å²	102.1	54%	0.544	53%	0.526	S	S	.	.	G	3₁₀ helix	trans	-80	-39.3	176.6	-61.8	175.3	0	0	0	111	K645 W650	K645-I647 PolarHBondContact O-N 3.41Å; K645-I647 VanDerWaalsContact O-N 3.11Å; I647-W650 WeakPolarHBondContact O-CB 3.49Å; I647-W650 PolarHBondContact O-N 2.9Å
648	F	33.6	Very low	37.8	Very low	171 Å²	171	102.3 Å²	102.3	75%	0.75	51%	0.511	S	S	*	.	H	α-helix	trans	-67.4	-36	175.4	-82	-82.4	0	0	0	112.4	K645 W650 D651 D652	K645-F648 PolarHBondContact O-N 2.77Å; F648-W650 PolarHBondContact O-N 3.15Å; F648-W650 VanDerWaalsContact O-N 3.13Å; F648-D651 PolarHBondContact O-N 3.32Å; F648-D652 PolarHBondContact O-N 3.38Å
649	N	42.3	Very low	37.9	Very low	88 Å²	88	99.3 Å²	99.3	47%	0.471	50%	0.503	S	S	.	.	H	α-helix	trans	-62.9	-14.3	170.7	-78	-17.1	0	0	0	113.4	Y653	N649-Y653 WeakPolarHBondContact O-CB 3.4Å; N649-Y653 PolarHBondContact O-N 3.08Å; N649-Y653 VanDerWaalsContact O-N 3.13Å
650	W	39.7	Very low	38.1	Very low	43 Å²	43	93.2 Å²	93.2	16%	0.163	47%	0.471	C	S	.	.	H	α-helix	trans	-83.9	-35	179.1	-110.7	86.7	0	0	0	113.7	I647 F648 I654	I647-W650 WeakPolarHBondContact O-CB 3.49Å; I647-W650 PolarHBondContact O-N 2.9Å; F648-W650 PolarHBondContact O-N 3.15Å; F648-W650 VanDerWaalsContact O-N 3.13Å; W650-I654 HydrophobicContact CE3-CD1 3.92Å; W650-I654 HydrophobicContact CE3-CG1 4.06Å; W650-I654 HydrophobicContact CZ3-CD1 4.33Å; W650-I654 HydrophobicContact CZ3-CG1 4.3Å; W650-I654 WeakPolarHBondContact O-CB 3.46Å; W650-I654 VanDerWaalsContact O-CG1 3.26Å; W650-I654 WeakPolarHBondContact O-CG1 3.3Å; W650-I654 PolarHBondContact O-N 3.09Å
651	D	40	Very low	38.1	Very low	91 Å²	91	90 Å²	90	49%	0.487	44%	0.441	S	S	.	.	H	α-helix	trans	-73.2	-43	175.5	-71.2	-34.6	0	0	0	110.6	F648 Y653 I654 E655	F648-D651 PolarHBondContact O-N 3.32Å; D651-Y653 VanDerWaalsContact C-N 3.26Å; D651-Y653 PolarHBondContact O-N 2.96Å; D651-I654 PolarHBondContact O-N 2.83Å; D651-E655 PolarHBondContact O-N 3.27Å
652	D	41.1	Very low	38.3	Very low	73 Å²	73	86.6 Å²	86.6	39%	0.39	43%	0.428	S	S	.	.	H	α-helix	trans	-62.1	-35.6	173.4	-149.3	73.7	0	0	0	111.5	F648 R656	F648-D652 PolarHBondContact O-N 3.38Å; D652-R656 WeakPolarHBondContact O-CB 3.46Å; D652-R656 WeakPolarHBondContact O-CD 3.41Å; D652-R656 WeakPolarHBondContact O-CG 3.28Å; D652-R656 PolarHBondContact O-N 2.85Å; D652-R656 IonicContact OD2-CZ 3.14Å; D652-R656 IonicContact OD2-NE 2.82Å; D652-R656 PolarHBondContact OD2-NE 2.99Å; D652-R656 IonicContact OD2-NH2 2.68Å; D652-R656 PolarHBondContact OD2-NH2 3.28Å
653	Y	41.3	Very low	38.7	Very low	76 Å²	76	82.4 Å²	82.4	30%	0.298	41%	0.405	S	S	.	.	H	α-helix	trans	-70.5	-35.5	171.1	-175	-103.9	0	0	0	113	T634 N649 D651 R656 L657	T634-Y653 HydrophobicContact CG2-CE1 4.39Å; T634-Y653 WeakPolarHBondContact CG2-OH 3.28Å; N649-Y653 WeakPolarHBondContact O-CB 3.4Å; N649-Y653 PolarHBondContact O-N 3.08Å; N649-Y653 VanDerWaalsContact O-N 3.13Å; D651-Y653 VanDerWaalsContact C-N 3.26Å; D651-Y653 PolarHBondContact O-N 2.96Å; Y653-R656 PolarHBondContact O-N 3.4Å; Y653-L657 HydrophobicContact CD1-CD1 4.37Å; Y653-L657 HydrophobicContact CE1-CD1 3.57Å; Y653-L657 WeakPolarHBondContact O-CB 3.45Å; Y653-L657 PolarHBondContact O-N 3.4Å
654	I	40.4	Very low	39.2	Very low	22 Å²	22	79.2 Å²	79.2	11%	0.113	38%	0.383	C	S	.	.	H	α-helix	trans	-65.4	-41.8	174	-76.7	165.5	0	0	0	110.6	L611 W650 D651 L657 L658	L611-I654 HydrophobicContact CD1-CG2 4.42Å; W650-I654 HydrophobicContact CE3-CD1 3.92Å; W650-I654 HydrophobicContact CE3-CG1 4.06Å; W650-I654 HydrophobicContact CZ3-CD1 4.33Å; W650-I654 HydrophobicContact CZ3-CG1 4.3Å; W650-I654 WeakPolarHBondContact O-CB 3.46Å; W650-I654 VanDerWaalsContact O-CG1 3.26Å; W650-I654 WeakPolarHBondContact O-CG1 3.3Å; W650-I654 PolarHBondContact O-N 3.09Å; D651-I654 PolarHBondContact O-N 2.83Å; I654-L657 CarbonylContact O-C 3.58Å; I654-L657 PolarHBondContact O-N 3.2Å; I654-L658 HydrophobicContact CG2-CD1 3.97Å; I654-L658 HydrophobicContact CG2-CG 4.49Å; I654-L658 WeakPolarHBondContact O-CB 3.41Å; I654-L658 VanDerWaalsContact O-CG 3.29Å; I654-L658 WeakPolarHBondContact O-CG 3.29Å; I654-L658 PolarHBondContact O-N 3.01Å
655	E	40.7	Very low	39.3	Very low	144 Å²	144	74 Å²	74	67%	0.673	36%	0.358	S	S	*	.	H	α-helix	trans	-65.3	-42.8	174.9	-68.6	-159.5	160.2	0	0	112	D651 L657 L658 A659	D651-E655 PolarHBondContact O-N 3.27Å; E655-L657 VanDerWaalsContact C-N 3.31Å; E655-L657 PolarHBondContact O-N 3.22Å; E655-L658 PolarHBondContact O-N 3.42Å; E655-A659 WeakPolarHBondContact O-CB 3.31Å; E655-A659 PolarHBondContact O-N 2.92Å
656	R	39	Very low	39.6	Very low	106 Å²	106	69.1 Å²	69.1	40%	0.4	34%	0.341	S	S	.	.	H	α-helix	trans	-63.8	-34	172.4	-67.9	166.5	-165.4	-134.3	11.5	112.6	D652 Y653 T660 S767	D652-R656 WeakPolarHBondContact O-CB 3.46Å; D652-R656 WeakPolarHBondContact O-CD 3.41Å; D652-R656 WeakPolarHBondContact O-CG 3.28Å; D652-R656 PolarHBondContact O-N 2.85Å; D652-R656 IonicContact OD2-CZ 3.14Å; D652-R656 IonicContact OD2-NE 2.82Å; D652-R656 PolarHBondContact OD2-NE 2.99Å; D652-R656 IonicContact OD2-NH2 2.68Å; D652-R656 PolarHBondContact OD2-NH2 3.28Å; Y653-R656 PolarHBondContact O-N 3.4Å; R656-T660 WeakPolarHBondContact O-CB 3.31Å; R656-T660 VanDerWaalsContact O-CG2 3.28Å; R656-T660 WeakPolarHBondContact O-CG2 3.47Å; R656-T660 PolarHBondContact O-N 2.98Å; R656-T660 PolarHBondContact O-OG1 3.46Å; R656-S767 PolarHBondContact NH1-O 3.06Å; R656-S767 PolarHBondContact NH1-OG 3.17Å; R656-S767 PolarHBondContact NH2-OG 2.9Å
657	L	40.4	Very low	39.9	Very low	33 Å²	33	68.8 Å²	68.8	17%	0.173	34%	0.338	C	S	.	.	H	α-helix	trans	-75	-32.2	176.8	-162.7	143.9	0	0	0	111.2	Y653 I654 E655 T660 Q661	Y653-L657 HydrophobicContact CD1-CD1 4.37Å; Y653-L657 HydrophobicContact CE1-CD1 3.57Å; Y653-L657 WeakPolarHBondContact O-CB 3.45Å; Y653-L657 PolarHBondContact O-N 3.4Å; I654-L657 CarbonylContact O-C 3.58Å; I654-L657 PolarHBondContact O-N 3.2Å; E655-L657 VanDerWaalsContact C-N 3.31Å; E655-L657 PolarHBondContact O-N 3.22Å; L657-T660 WeakPolarHBondContact CA-OG1 3.25Å; L657-T660 PolarHBondContact O-OG1 3.35Å; L657-Q661 HydrophobicContact CD2-CG 3.79Å; L657-Q661 HydrophobicContact CG-CG 4.45Å; L657-Q661 WeakPolarHBondContact O-CA 3.39Å; L657-Q661 WeakPolarHBondContact O-CB 3.47Å; L657-Q661 VanDerWaalsContact O-CG 3.25Å; L657-Q661 WeakPolarHBondContact O-CG 3.38Å; L657-Q661 PolarHBondContact O-N 3Å
658	L	37.1	Very low	40.2	Very low	71 Å²	71	67 Å²	67	37%	0.372	33%	0.33	S	S	.	.	H	α-helix	trans	-68.8	-43.4	169.9	-74.9	165.5	0	0	0	112.1	L611 I654 E655 S662	L611-L658 HydrophobicContact CD1-CD1 4.48Å; L611-L658 HydrophobicContact CD1-CD2 4.22Å; L611-L658 HydrophobicContact CD2-CD1 4.48Å; L611-L658 HydrophobicContact CD2-CD2 3.84Å; I654-L658 HydrophobicContact CG2-CD1 3.97Å; I654-L658 HydrophobicContact CG2-CG 4.49Å; I654-L658 WeakPolarHBondContact O-CB 3.41Å; I654-L658 VanDerWaalsContact O-CG 3.29Å; I654-L658 WeakPolarHBondContact O-CG 3.29Å; I654-L658 PolarHBondContact O-N 3.01Å; E655-L658 PolarHBondContact O-N 3.42Å; L658-S662 WeakPolarHBondContact O-CB 3.17Å; L658-S662 PolarHBondContact O-N 2.93Å; L658-S662 PolarHBondContact O-OG 3.12Å
659	A	38.1	Very low	40.6	Very low	26 Å²	26	61.3 Å²	61.3	22%	0.215	31%	0.31	C	S	.	.	H	α-helix	trans	-60.3	-47.6	173.2	0	0	0	0	0	111.3	E655 S662 I663 F751	E655-A659 WeakPolarHBondContact O-CB 3.31Å; E655-A659 PolarHBondContact O-N 2.92Å; A659-S662 PolarHBondContact O-OG 3.5Å; A659-I663 VanDerWaalsContact O-CD1 3.29Å; A659-I663 WeakPolarHBondContact O-CD1 3.37Å; A659-I663 WeakPolarHBondContact O-CG1 3.28Å; A659-I663 PolarHBondContact O-N 3.5Å; A659-F751 HydrophobicContact CB-CE1 4.31Å; A659-F751 HydrophobicContact CB-CZ 3.85Å
660	T	40.8	Very low	40.6	Very low	24 Å²	24	59.5 Å²	59.5	15%	0.147	30%	0.3	C	S	.	.	H	α-helix	trans	-77.2	-29.2	-179.9	54.5	0	0	0	0	113.7	R656 L657 R664 F769	R656-T660 WeakPolarHBondContact O-CB 3.31Å; R656-T660 VanDerWaalsContact O-CG2 3.28Å; R656-T660 WeakPolarHBondContact O-CG2 3.47Å; R656-T660 PolarHBondContact O-N 2.98Å; R656-T660 PolarHBondContact O-OG1 3.46Å; L657-T660 WeakPolarHBondContact CA-OG1 3.25Å; L657-T660 PolarHBondContact O-OG1 3.35Å; T660-R664 VanDerWaalsContact O-CB 3.31Å; T660-R664 WeakPolarHBondContact O-CB 3.49Å; T660-R664 WeakPolarHBondContact O-CG 3.47Å; T660-R664 PolarHBondContact O-N 3.45Å; T660-F769 HydrophobicContact CG2-CE2 3.43Å; T660-F769 VanDerWaalsContact CG2-CE2 3.43Å; T660-F769 HydrophobicContact CG2-CZ 3.52Å
661	Q	36.6	Very low	40.9	Very low	24 Å²	24	59.4 Å²	59.4	11%	0.112	30%	0.303	C	S	.	.	H	α-helix	trans	-70.8	-43.1	172.6	-85.2	-158.7	-27.4	0	0	112.2	L657 I663 R664 Q665	L657-Q661 HydrophobicContact CD2-CG 3.79Å; L657-Q661 HydrophobicContact CG-CG 4.45Å; L657-Q661 WeakPolarHBondContact O-CA 3.39Å; L657-Q661 WeakPolarHBondContact O-CB 3.47Å; L657-Q661 VanDerWaalsContact O-CG 3.25Å; L657-Q661 WeakPolarHBondContact O-CG 3.38Å; L657-Q661 PolarHBondContact O-N 3Å; Q661-I663 VanDerWaalsContact C-N 3.26Å; Q661-I663 PolarHBondContact O-N 3.06Å; Q661-R664 PolarHBondContact O-N 3.45Å; Q661-Q665 WeakPolarHBondContact O-CB 3.4Å; Q661-Q665 WeakPolarHBondContact O-CG 3.03Å; Q661-Q665 PolarHBondContact O-N 2.97Å
662	S	39.7	Very low	41	Very low	68 Å²	68	59.2 Å²	59.2	48%	0.476	30%	0.299	S	S	.	.	H	α-helix	trans	-60.7	-39.8	175.3	53.3	0	0	0	0	111.1	L658 A659 L666	L658-S662 WeakPolarHBondContact O-CB 3.17Å; L658-S662 PolarHBondContact O-N 2.93Å; L658-S662 PolarHBondContact O-OG 3.12Å; A659-S662 PolarHBondContact O-OG 3.5Å; S662-L666 VanDerWaalsContact O-CB 3.27Å; S662-L666 WeakPolarHBondContact O-CB 3.4Å; S662-L666 PolarHBondContact O-N 3.17Å
663	I	39.6	Very low	41.2	Very low	36 Å²	36	61.2 Å²	61.2	19%	0.185	31%	0.306	C	S	.	.	H	α-helix	trans	-61	-51.1	171.1	-68.5	168	0	0	0	112.2	A659 Q661 Q665 L666 L667 L747 F751	A659-I663 VanDerWaalsContact O-CD1 3.29Å; A659-I663 WeakPolarHBondContact O-CD1 3.37Å; A659-I663 WeakPolarHBondContact O-CG1 3.28Å; A659-I663 PolarHBondContact O-N 3.5Å; Q661-I663 VanDerWaalsContact C-N 3.26Å; Q661-I663 PolarHBondContact O-N 3.06Å; I663-Q665 PolarHBondContact O-N 3.12Å; I663-L666 PolarHBondContact O-N 3.32Å; I663-L667 HydrophobicContact CG2-CD1 4.34Å; I663-L667 WeakPolarHBondContact O-CB 3.3Å; I663-L667 PolarHBondContact O-N 3.33Å; I663-L747 HydrophobicContact CB-CD1 4.26Å; I663-L747 HydrophobicContact CD1-CD1 4.2Å; I663-L747 HydrophobicContact CD1-CD2 3.72Å; I663-L747 HydrophobicContact CD1-CG 4.42Å; I663-L747 HydrophobicContact CG1-CD1 3.76Å; I663-L747 HydrophobicContact CG1-CD2 3.56Å; I663-L747 HydrophobicContact CG1-CG 4.26Å; I663-L747 HydrophobicContact CG2-CD1 3.7Å; I663-F751 HydrophobicContact CD1-CD2 4.45Å; I663-F751 HydrophobicContact CD1-CE2 3.93Å
664	R	42	Very low	41.3	Very low	68 Å²	68	60.7 Å²	60.7	26%	0.257	30%	0.304	S	S	.	.	H	α-helix	trans	-67.5	-33.8	-179.3	-74.9	171.8	-178.6	-179.3	2.6	112.7	E630 T660 Q661 L667 L668	E630-R664 IonicContact OE1-CZ 3.54Å; E630-R664 IonicContact OE1-NH1 3.85Å; E630-R664 PolarHBondContact OE1-NH1 2.86Å; E630-R664 IonicContact OE2-NH1 2.86Å; E630-R664 PolarHBondContact OE2-NH1 2.89Å; T660-R664 VanDerWaalsContact O-CB 3.31Å; T660-R664 WeakPolarHBondContact O-CB 3.49Å; T660-R664 WeakPolarHBondContact O-CG 3.47Å; T660-R664 PolarHBondContact O-N 3.45Å; Q661-R664 PolarHBondContact O-N 3.45Å; R664-L667 WeakPolarHBondContact O-CB 3.25Å; R664-L667 PolarHBondContact O-N 2.94Å; R664-L668 VanDerWaalsContact O-CB 3.29Å; R664-L668 WeakPolarHBondContact O-CB 3.1Å; R664-L668 WeakPolarHBondContact O-CG 3.11Å; R664-L668 PolarHBondContact O-N 3.22Å
665	Q	40.1	Very low	41.4	Very low	46 Å²	46	60 Å²	60	22%	0.215	30%	0.302	C	S	.	.	H	α-helix	trans	-72.3	-39.7	175.6	-72.2	169.4	17.8	0	0	110.7	W615 Q661 I663 L668 C669	W615-Q665 VanDerWaalsContact NE1-NE2 3.12Å; Q661-Q665 WeakPolarHBondContact O-CB 3.4Å; Q661-Q665 WeakPolarHBondContact O-CG 3.03Å; Q661-Q665 PolarHBondContact O-N 2.97Å; I663-Q665 PolarHBondContact O-N 3.12Å; Q665-L668 PolarHBondContact O-N 3.38Å; Q665-C669 VanDerWaalsContact O-CB 3.26Å; Q665-C669 WeakPolarHBondContact O-CB 3.24Å; Q665-C669 PolarHBondContact O-N 3.32Å; Q665-C669 PolarHBondContact O-SG 3.39Å; Q665-C669 VanDerWaalsContact O-SG 3.33Å
666	L	43.5	Very low	41.6	Very low	81 Å²	81	57.8 Å²	57.8	42%	0.424	29%	0.293	S	S	.	.	H	α-helix	trans	-62.1	-44	170.7	-167.8	83.5	0	0	0	110.9	S662 I663 C669 L670 V743	S662-L666 VanDerWaalsContact O-CB 3.27Å; S662-L666 WeakPolarHBondContact O-CB 3.4Å; S662-L666 PolarHBondContact O-N 3.17Å; I663-L666 PolarHBondContact O-N 3.32Å; L666-C669 PolarHBondContact O-N 3.11Å; L666-L670 HydrophobicContact CD2-CD1 4.44Å; L666-L670 HydrophobicContact CG-CD1 4.07Å; L666-L670 VanDerWaalsContact O-CB 3.31Å; L666-L670 WeakPolarHBondContact O-CB 3.42Å; L666-L670 WeakPolarHBondContact O-CG 3.46Å; L666-L670 PolarHBondContact O-N 3.4Å; L666-V743 HydrophobicContact CD2-CG1 3.48Å; L666-V743 VanDerWaalsContact CD2-CG1 3.48Å; L666-V743 HydrophobicContact CD2-CG2 4.21Å
667	L	44.3	Very low	41.7	Very low	47 Å²	47	56.7 Å²	56.7	25%	0.246	29%	0.293	C	S	.	.	H	α-helix	trans	-59.7	-46.7	173.4	-110.9	152.2	0	0	0	112.6	I663 R664 L670 L671 F744	I663-L667 HydrophobicContact CG2-CD1 4.34Å; I663-L667 WeakPolarHBondContact O-CB 3.3Å; I663-L667 PolarHBondContact O-N 3.33Å; R664-L667 WeakPolarHBondContact O-CB 3.25Å; R664-L667 PolarHBondContact O-N 2.94Å; L667-L670 PolarHBondContact O-N 2.94Å; L667-L671 HydrophobicContact CD2-CD1 4.11Å; L667-L671 VanDerWaalsContact O-CB 3.3Å; L667-L671 WeakPolarHBondContact O-CB 3.2Å; L667-L671 WeakPolarHBondContact O-CD1 3.49Å; L667-L671 WeakPolarHBondContact O-CG 3.35Å; L667-L671 PolarHBondContact O-N 3.16Å; L667-F744 HydrophobicContact CD1-CE2 3.78Å; L667-F744 HydrophobicContact CD1-CZ 3.92Å; L667-F744 HydrophobicContact CD2-CE2 4.13Å; L667-F744 HydrophobicContact CG-CE2 4.27Å
668	L	43.8	Very low	41.8	Very low	70 Å²	70	56.4 Å²	56.4	37%	0.366	29%	0.29	S	S	.	.	H	α-helix	trans	-68.1	-40.3	178.3	-85.5	159.6	0	0	0	112	I626 R664 Q665 L671 Q672	I626-L668 HydrophobicContact CD1-CD1 4.19Å; R664-L668 VanDerWaalsContact O-CB 3.29Å; R664-L668 WeakPolarHBondContact O-CB 3.1Å; R664-L668 WeakPolarHBondContact O-CG 3.11Å; R664-L668 PolarHBondContact O-N 3.22Å; Q665-L668 PolarHBondContact O-N 3.38Å; L668-L671 PolarHBondContact O-N 3.01Å; L668-Q672 WeakPolarHBondContact O-CB 3.37Å; L668-Q672 PolarHBondContact O-N 3.25Å
669	C	42.6	Very low	42.1	Very low	50 Å²	50	55.7 Å²	55.7	34%	0.338	29%	0.285	S	S	.	.	H	α-helix	trans	-64.3	-42.8	173.4	-75.5	0	0	0	0	111.3	Q665 L666 Q672 Q673	Q665-C669 VanDerWaalsContact O-CB 3.26Å; Q665-C669 WeakPolarHBondContact O-CB 3.24Å; Q665-C669 PolarHBondContact O-N 3.32Å; Q665-C669 PolarHBondContact O-SG 3.39Å; Q665-C669 VanDerWaalsContact O-SG 3.33Å; L666-C669 PolarHBondContact O-N 3.11Å; C669-Q672 PolarHBondContact O-N 2.78Å; C669-Q673 WeakPolarHBondContact O-CB 3.42Å; C669-Q673 PolarHBondContact O-N 3.46Å
670	L	43.1	Very low	42.5	Very low	50 Å²	50	61.9 Å²	61.9	26%	0.262	30%	0.304	S	S	.	.	H	α-helix	trans	-65.7	-39.3	175.4	-72.4	167.2	0	0	0	112	L666 L667 W674 V740	L666-L670 HydrophobicContact CD2-CD1 4.44Å; L666-L670 HydrophobicContact CG-CD1 4.07Å; L666-L670 VanDerWaalsContact O-CB 3.31Å; L666-L670 WeakPolarHBondContact O-CB 3.42Å; L666-L670 WeakPolarHBondContact O-CG 3.46Å; L666-L670 PolarHBondContact O-N 3.4Å; L667-L670 PolarHBondContact O-N 2.94Å; L670-W674 WeakPolarHBondContact O-CB 3.42Å; L670-W674 PolarHBondContact O-N 3.32Å; L670-V740 HydrophobicContact CB-CG2 4.31Å; L670-V740 HydrophobicContact CD1-CG2 4.12Å
671	L	44.5	Very low	42.6	Very low	41 Å²	41	65 Å²	65	22%	0.215	32%	0.319	C	S	.	.	H	α-helix	trans	-69	-35.2	174.3	-75.2	165.1	0	0	0	112.6	L667 L668 W674 A675 L800	L667-L671 HydrophobicContact CD2-CD1 4.11Å; L667-L671 VanDerWaalsContact O-CB 3.3Å; L667-L671 WeakPolarHBondContact O-CB 3.2Å; L667-L671 WeakPolarHBondContact O-CD1 3.49Å; L667-L671 WeakPolarHBondContact O-CG 3.35Å; L667-L671 PolarHBondContact O-N 3.16Å; L668-L671 PolarHBondContact O-N 3.01Å; L671-W674 HydrophobicContact CD2-CE3 4.09Å; L671-W674 HydrophobicContact CD2-CZ3 4.46Å; L671-A675 WeakPolarHBondContact O-CB 3.41Å; L671-A675 PolarHBondContact O-N 3.17Å; L671-L800 HydrophobicContact CD1-CD2 4.08Å
672	Q	43.4	Very low	42.9	Very low	88 Å²	88	65.8 Å²	65.8	41%	0.411	32%	0.324	S	S	.	.	H	α-helix	trans	-74.8	-40.6	177.7	-171	172.7	4.2	0	0	111.1	N620 L668 C669 A675 I676	N620-Q672 PolarHBondContact ND2-OE1 3.24Å; L668-Q672 WeakPolarHBondContact O-CB 3.37Å; L668-Q672 PolarHBondContact O-N 3.25Å; C669-Q672 PolarHBondContact O-N 2.78Å; Q672-A675 PolarHBondContact O-N 3.48Å; Q672-I676 HydrophobicContact CG-CD1 4.2Å; Q672-I676 WeakPolarHBondContact O-CD1 3.45Å; Q672-I676 VanDerWaalsContact O-CG1 3.24Å; Q672-I676 WeakPolarHBondContact O-CG1 2.76Å; Q672-I676 PolarHBondContact O-N 2.92Å
673	Q	44.4	Very low	43.3	Very low	115 Å²	115	65.9 Å²	65.9	54%	0.537	32%	0.318	S	S	.	.	H	α-helix	trans	-59.5	-47.5	170.1	-166.1	91	12.4	0	0	110.3	C669 A675 I676 E677	C669-Q673 WeakPolarHBondContact O-CB 3.42Å; C669-Q673 PolarHBondContact O-N 3.46Å; Q673-A675 VanDerWaalsContact C-N 3.35Å; Q673-A675 PolarHBondContact O-N 3.12Å; Q673-I676 PolarHBondContact O-N 3.42Å; Q673-E677 WeakPolarHBondContact O-CG 3.44Å; Q673-E677 PolarHBondContact O-N 3.08Å
674	W	43.2	Very low	43.7	Very low	65 Å²	65	66.4 Å²	66.4	25%	0.246	32%	0.323	C	S	.	.	H	α-helix	trans	-60.7	-40.5	175.4	-179.1	55.5	0	0	0	112.5	L670 L671 F678 A799	L670-W674 WeakPolarHBondContact O-CB 3.42Å; L670-W674 PolarHBondContact O-N 3.32Å; L671-W674 HydrophobicContact CD2-CE3 4.09Å; L671-W674 HydrophobicContact CD2-CZ3 4.46Å; W674-F678 WeakPolarHBondContact O-CB 3.34Å; W674-F678 PolarHBondContact O-N 3Å; W674-A799 HydrophobicContact CE3-CB 3.84Å; W674-A799 HydrophobicContact CH2-CB 3.99Å; W674-A799 HydrophobicContact CZ3-CB 3.27Å
675	A	43.5	Very low	43.9	Very low	8 Å²	8	65.7 Å²	65.7	7%	0.066	32%	0.322	C	S	.	.	H	α-helix	trans	-65.1	-40.6	175.6	0	0	0	0	0	112.5	L671 Q672 Q673 F678 E679 T796	L671-A675 WeakPolarHBondContact O-CB 3.41Å; L671-A675 PolarHBondContact O-N 3.17Å; Q672-A675 PolarHBondContact O-N 3.48Å; Q673-A675 VanDerWaalsContact C-N 3.35Å; Q673-A675 PolarHBondContact O-N 3.12Å; A675-F678 PolarHBondContact O-N 3.42Å; A675-E679 VanDerWaalsContact O-CB 3.27Å; A675-E679 WeakPolarHBondContact O-CB 3.24Å; A675-E679 PolarHBondContact O-N 3.18Å; A675-T796 HydrophobicContact CB-CG2 4.29Å
676	I	43.3	Very low	44	Very low	97 Å²	97	67.3 Å²	67.3	50%	0.497	33%	0.33	S	S	.	.	H	α-helix	trans	-67.3	-42.6	177	-68.9	162.8	0	0	0	111.2	Q672 Q673 E679 Y680	Q672-I676 HydrophobicContact CG-CD1 4.2Å; Q672-I676 WeakPolarHBondContact O-CD1 3.45Å; Q672-I676 VanDerWaalsContact O-CG1 3.24Å; Q672-I676 WeakPolarHBondContact O-CG1 2.76Å; Q672-I676 PolarHBondContact O-N 2.92Å; Q673-I676 PolarHBondContact O-N 3.42Å; I676-E679 PolarHBondContact O-N 2.81Å; I676-Y680 WeakPolarHBondContact O-CB 3.49Å; I676-Y680 PolarHBondContact O-N 2.92Å
677	E	42.3	Very low	44.1	Very low	82 Å²	82	69.6 Å²	69.6	38%	0.383	34%	0.336	S	S	.	.	H	α-helix	trans	-69.6	-35.6	176.8	-72.1	172.9	-171.3	0	0	112	Q673 N681	Q673-E677 WeakPolarHBondContact O-CG 3.44Å; Q673-E677 PolarHBondContact O-N 3.08Å; E677-N681 WeakPolarHBondContact O-CB 3.44Å; E677-N681 PolarHBondContact O-N 3.31Å; E677-N681 VanDerWaalsContact O-N 3.1Å; E677-N681 PolarHBondContact O-ND2 3.01Å
678	F	42.5	Very low	44.3	Very low	27 Å²	27	73.6 Å²	73.6	12%	0.118	35%	0.354	C	S	.	.	H	α-helix	trans	-64.9	-43.9	171.9	-179.1	-102.4	0	0	0	111.7	W674 A675 N681 I682 L731	W674-F678 WeakPolarHBondContact O-CB 3.34Å; W674-F678 PolarHBondContact O-N 3Å; A675-F678 PolarHBondContact O-N 3.42Å; F678-N681 PolarHBondContact O-N 3.49Å; F678-I682 HydrophobicContact CD1-CD1 3.81Å; F678-I682 HydrophobicContact CE1-CD1 3.33Å; F678-I682 HydrophobicContact CE2-CD1 4.19Å; F678-I682 HydrophobicContact CG-CD1 4.42Å; F678-I682 HydrophobicContact CZ-CD1 3.56Å; F678-I682 WeakPolarHBondContact O-CG1 3.5Å; F678-I682 PolarHBondContact O-N 2.88Å; F678-L731 HydrophobicContact CD2-CD1 3.6Å; F678-L731 HydrophobicContact CD2-CD2 3.83Å; F678-L731 HydrophobicContact CD2-CG 4.38Å; F678-L731 HydrophobicContact CE2-CD1 3.7Å
679	E	42.9	Very low	44.2	Very low	56 Å²	56	74.6 Å²	74.6	26%	0.262	36%	0.359	S	S	.	.	H	α-helix	trans	-64.6	-45.6	176.3	-178.1	173.8	-172.4	0	0	112	A675 I676 N681 I682 I683 L793	A675-E679 VanDerWaalsContact O-CB 3.27Å; A675-E679 WeakPolarHBondContact O-CB 3.24Å; A675-E679 PolarHBondContact O-N 3.18Å; I676-E679 PolarHBondContact O-N 2.81Å; E679-N681 VanDerWaalsContact C-N 3.31Å; E679-N681 PolarHBondContact O-N 3.32Å; E679-I682 PolarHBondContact O-N 3.49Å; E679-I683 HydrophobicContact CG-CD1 3.74Å; E679-I683 HydrophobicContact CG-CG1 4.44Å; E679-I683 WeakPolarHBondContact O-CB 3.48Å; E679-I683 VanDerWaalsContact O-CG1 3.31Å; E679-I683 WeakPolarHBondContact O-CG1 3.32Å; E679-I683 PolarHBondContact O-N 3.36Å; E679-L793 WeakPolarHBondContact OE1-CD1 3.37Å; E679-L793 WeakPolarHBondContact OE1-CD2 3.41Å; E679-L793 WeakPolarHBondContact OE2-CD1 3.45Å
680	Y	45.7	Very low	44.4	Very low	157 Å²	157	75.6 Å²	75.6	62%	0.616	37%	0.366	S	S	*	.	H	α-helix	trans	-56.3	-45.9	174.6	-176.6	-95.2	0	0	0	111.7	I676 I683 T684	I676-Y680 WeakPolarHBondContact O-CB 3.49Å; I676-Y680 PolarHBondContact O-N 2.92Å; Y680-I683 PolarHBondContact O-N 3.28Å; Y680-T684 HydrophobicContact CD1-CG2 4.25Å; Y680-T684 HydrophobicContact CE1-CG2 3.87Å; Y680-T684 WeakPolarHBondContact O-CG2 3.5Å; Y680-T684 PolarHBondContact O-N 2.82Å; Y680-T684 PolarHBondContact O-OG1 2.87Å; Y680-T684 VanDerWaalsContact O-OG1 3.09Å
681	N	44.5	Very low	44.5	Very low	88 Å²	88	78.6 Å²	78.6	47%	0.471	38%	0.382	S	S	.	.	H	α-helix	trans	-69.8	-29.6	179.7	-77.3	-50.5	0	0	0	113.9	E677 F678 E679 T684 K685	E677-N681 WeakPolarHBondContact O-CB 3.44Å; E677-N681 PolarHBondContact O-N 3.31Å; E677-N681 VanDerWaalsContact O-N 3.1Å; E677-N681 PolarHBondContact O-ND2 3.01Å; F678-N681 PolarHBondContact O-N 3.49Å; E679-N681 VanDerWaalsContact C-N 3.31Å; E679-N681 PolarHBondContact O-N 3.32Å; N681-T684 WeakPolarHBondContact CA-OG1 3.39Å; N681-T684 PolarHBondContact O-OG1 3.41Å; N681-T684 VanDerWaalsContact O-OG1 3.13Å; N681-K685 PolarHBondContact O-N 3.46Å
682	I	42.9	Very low	44.4	Very low	42 Å²	42	86.1 Å²	86.1	22%	0.215	41%	0.407	C	S	.	.	H	α-helix	trans	-71.1	-47.8	170.7	-72.7	176.6	0	0	0	110	F678 E679 T684 K685 E686 L723	F678-I682 HydrophobicContact CD1-CD1 3.81Å; F678-I682 HydrophobicContact CE1-CD1 3.33Å; F678-I682 HydrophobicContact CE2-CD1 4.19Å; F678-I682 HydrophobicContact CG-CD1 4.42Å; F678-I682 HydrophobicContact CZ-CD1 3.56Å; F678-I682 WeakPolarHBondContact O-CG1 3.5Å; F678-I682 PolarHBondContact O-N 2.88Å; E679-I682 PolarHBondContact O-N 3.49Å; I682-T684 VanDerWaalsContact C-N 3.31Å; I682-T684 PolarHBondContact O-N 2.94Å; I682-K685 PolarHBondContact O-N 2.85Å; I682-E686 VanDerWaalsContact O-CB 3.3Å; I682-E686 WeakPolarHBondContact O-CB 3.42Å; I682-E686 PolarHBondContact O-N 3.38Å; I682-L723 HydrophobicContact CD1-CD2 4.44Å; I682-L723 HydrophobicContact CG1-CD2 4.02Å; I682-L723 HydrophobicContact CG2-CD2 4.4Å
683	I	47.7	Very low	44.2	Very low	69 Å²	69	87 Å²	87	35%	0.354	42%	0.415	S	S	.	.	H	α-helix	trans	-62.6	-36.2	-179.3	-68.3	169.5	0	0	0	111.6	E679 Y680 K687	E679-I683 HydrophobicContact CG-CD1 3.74Å; E679-I683 HydrophobicContact CG-CG1 4.44Å; E679-I683 WeakPolarHBondContact O-CB 3.48Å; E679-I683 VanDerWaalsContact O-CG1 3.31Å; E679-I683 WeakPolarHBondContact O-CG1 3.32Å; E679-I683 PolarHBondContact O-N 3.36Å; Y680-I683 PolarHBondContact O-N 3.28Å; I683-K687 HydrophobicContact CG2-CD 4.37Å; I683-K687 WeakPolarHBondContact O-CB 3.45Å; I683-K687 WeakPolarHBondContact O-CG 3.22Å; I683-K687 PolarHBondContact O-N 3.05Å
684	T	47.7	Very low	43.9	Very low	47 Å²	47	85.2 Å²	85.2	29%	0.288	42%	0.415	S	S	.	.	H	α-helix	trans	-68.6	-43.9	174.1	49.8	0	0	0	0	112.2	Y680 N681 I682 K687 E688	Y680-T684 HydrophobicContact CD1-CG2 4.25Å; Y680-T684 HydrophobicContact CE1-CG2 3.87Å; Y680-T684 WeakPolarHBondContact O-CG2 3.5Å; Y680-T684 PolarHBondContact O-N 2.82Å; Y680-T684 PolarHBondContact O-OG1 2.87Å; Y680-T684 VanDerWaalsContact O-OG1 3.09Å; N681-T684 WeakPolarHBondContact CA-OG1 3.39Å; N681-T684 PolarHBondContact O-OG1 3.41Å; N681-T684 VanDerWaalsContact O-OG1 3.13Å; I682-T684 VanDerWaalsContact C-N 3.31Å; I682-T684 PolarHBondContact O-N 2.94Å; T684-K687 WeakPolarHBondContact O-CB 3.31Å; T684-K687 PolarHBondContact O-N 2.94Å; T684-E688 WeakPolarHBondContact O-CG 3.38Å; T684-E688 PolarHBondContact O-N 3.1Å
685	K	45.6	Very low	43.5	Very low	53 Å²	53	90 Å²	90	23%	0.23	44%	0.443	C	S	.	.	H	α-helix	trans	-64.5	-38.7	174.3	-96.1	-171.4	170.7	-177.3	0	113.4	N681 I682 K687 E688 L689	N681-K685 PolarHBondContact O-N 3.46Å; I682-K685 PolarHBondContact O-N 2.85Å; K685-K687 VanDerWaalsContact C-N 3.32Å; K685-E688 PolarHBondContact O-N 3.48Å; K685-L689 WeakPolarHBondContact O-CB 3.45Å; K685-L689 WeakPolarHBondContact O-CG 3.46Å; K685-L689 PolarHBondContact O-N 3.01Å
686	E	42.5	Very low	43.3	Very low	81 Å²	81	97.4 Å²	97.4	38%	0.379	48%	0.476	S	S	.	.	H	α-helix	trans	-67	-36.9	177.4	-167.9	166.3	-138.7	0	0	110.5	I682 L689 S690 I718	I682-E686 VanDerWaalsContact O-CB 3.3Å; I682-E686 WeakPolarHBondContact O-CB 3.42Å; I682-E686 PolarHBondContact O-N 3.38Å; E686-L689 PolarHBondContact O-N 3.38Å; E686-S690 WeakPolarHBondContact O-CB 3.28Å; E686-S690 PolarHBondContact O-N 3.47Å; E686-S690 PolarHBondContact O-OG 3.28Å; E686-I718 WeakPolarHBondContact OE1-CD1 3.4Å
687	K	46.7	Very low	42.7	Very low	129 Å²	129	99.3 Å²	99.3	56%	0.561	49%	0.487	S	S	*	.	H	α-helix	trans	-64	-44.3	168.5	-78.7	175.5	177.7	175.9	0	113	I683 T684 K685 L689 S690 L691	I683-K687 HydrophobicContact CG2-CD 4.37Å; I683-K687 WeakPolarHBondContact O-CB 3.45Å; I683-K687 WeakPolarHBondContact O-CG 3.22Å; I683-K687 PolarHBondContact O-N 3.05Å; T684-K687 WeakPolarHBondContact O-CB 3.31Å; T684-K687 PolarHBondContact O-N 2.94Å; K685-K687 VanDerWaalsContact C-N 3.32Å; K687-L689 PolarHBondContact O-N 2.84Å; K687-S690 WeakPolarHBondContact CA-OG 3.21Å; K687-S690 PolarHBondContact O-N 3.1Å; K687-S690 PolarHBondContact O-OG 3.38Å; K687-L691 WeakPolarHBondContact O-CB 3.28Å; K687-L691 WeakPolarHBondContact O-CD1 3.38Å; K687-L691 PolarHBondContact O-N 3Å
688	E	47	Very low	41.9	Very low	131 Å²	131	100.7 Å²	100.7	61%	0.612	51%	0.505	S	S	*	.	H	α-helix	trans	-61	-42.3	175.6	-75	-176.6	147.4	0	0	112.2	T684 K685 L691 R692	T684-E688 WeakPolarHBondContact O-CG 3.38Å; T684-E688 PolarHBondContact O-N 3.1Å; K685-E688 PolarHBondContact O-N 3.48Å; E688-L691 PolarHBondContact O-N 3.26Å; E688-R692 PolarHBondContact O-N 2.83Å
689	L	42.8	Very low	41.3	Very low	91 Å²	91	108.6 Å²	108.6	48%	0.476	54%	0.543	S	S	.	.	H	α-helix	trans	-67.3	-40.4	175.4	-73.2	166.1	0	0	0	111.9	K685 E686 K687 L691 R692 N693	K685-L689 WeakPolarHBondContact O-CB 3.45Å; K685-L689 WeakPolarHBondContact O-CG 3.46Å; K685-L689 PolarHBondContact O-N 3.01Å; E686-L689 PolarHBondContact O-N 3.38Å; K687-L689 PolarHBondContact O-N 2.84Å; L689-L691 VanDerWaalsContact C-N 3.31Å; L689-L691 PolarHBondContact O-N 3.23Å; L689-R692 PolarHBondContact O-N 3.3Å; L689-N693 PolarHBondContact O-N 2.95Å; L689-N693 PolarHBondContact O-OD1 2.71Å
690	S	45.1	Very low	40.4	Very low	70 Å²	70	109 Å²	109	49%	0.49	56%	0.562	S	S	.	*	H	α-helix	trans	-65	-35.3	173.9	73.2	0	0	0	0	112.4	E686 K687 S694	E686-S690 WeakPolarHBondContact O-CB 3.28Å; E686-S690 PolarHBondContact O-N 3.47Å; E686-S690 PolarHBondContact O-OG 3.28Å; K687-S690 WeakPolarHBondContact CA-OG 3.21Å; K687-S690 PolarHBondContact O-N 3.1Å; K687-S690 PolarHBondContact O-OG 3.38Å; S690-S694 WeakPolarHBondContact O-CB 3.29Å; S690-S694 PolarHBondContact O-N 3.41Å; S690-S694 PolarHBondContact O-OG 3.45Å
691	L	45.9	Very low	39.5	Very low	114 Å²	114	110.9 Å²	110.9	60%	0.597	58%	0.576	S	S	*	*	H	α-helix	trans	-68.2	-43.5	176.2	-105.2	112.2	0	0	0	111.4	K687 E688 L689 S694 M695	K687-L691 WeakPolarHBondContact O-CB 3.28Å; K687-L691 WeakPolarHBondContact O-CD1 3.38Å; K687-L691 PolarHBondContact O-N 3Å; E688-L691 PolarHBondContact O-N 3.26Å; L689-L691 VanDerWaalsContact C-N 3.31Å; L689-L691 PolarHBondContact O-N 3.23Å; L691-S694 WeakPolarHBondContact CA-OG 3.41Å; L691-S694 PolarHBondContact O-N 2.89Å; L691-S694 PolarHBondContact O-OG 2.94Å; L691-M695 PolarHBondContact O-N 3.46Å
692	R	41.7	Very low	38.6	Very low	198 Å²	198	111.3 Å²	111.3	75%	0.747	59%	0.586	S	S	*	*	H	α-helix	trans	-60.8	-50	175.1	-79.1	-171.1	173.1	-152.4	-2.3	111.6	E688 L689 S694 M695	E688-R692 PolarHBondContact O-N 2.83Å; L689-R692 PolarHBondContact O-N 3.3Å; R692-S694 PolarHBondContact O-N 3.27Å; R692-M695 PolarHBondContact O-N 2.97Å
693	N	39.3	Very low	37.7	Very low	106 Å²	106	115.5 Å²	115.5	57%	0.567	61%	0.614	S	S	*	*	H	α-helix	trans	-65.5	-21.1	179.6	-65.4	7.5	0	0	0	113	L689	L689-N693 PolarHBondContact O-N 2.95Å; L689-N693 PolarHBondContact O-OD1 2.71Å
694	S	38.3	Very low	36.7	Very low	78 Å²	78	120.6 Å²	120.6	55%	0.545	64%	0.641	S	S	.	*	H	α-helix	trans	-79	-13.1	174.3	74.4	0	0	0	0	114.8	S690 L691 R692	S690-S694 WeakPolarHBondContact O-CB 3.29Å; S690-S694 PolarHBondContact O-N 3.41Å; S690-S694 PolarHBondContact O-OG 3.45Å; L691-S694 WeakPolarHBondContact CA-OG 3.41Å; L691-S694 PolarHBondContact O-N 2.89Å; L691-S694 PolarHBondContact O-OG 2.94Å; R692-S694 PolarHBondContact O-N 3.27Å
695	M	36.1	Very low	35.5	Very low	166 Å²	166	123.9 Å²	123.9	82%	0.818	67%	0.665	S	S	*	*	H	α-helix	trans	-88.7	-16.4	176.4	-73.2	-166.8	73.2	0	0	113.9	L691 R692	L691-M695 PolarHBondContact O-N 3.46Å; R692-M695 PolarHBondContact O-N 2.97Å
696	E	37.8	Very low	34.4	Very low	164 Å²	164	127.7 Å²	127.7	77%	0.766	69%	0.693	S	S	*	*	H	α-helix	trans	-99.9	-13.7	-177.2	-70.4	178.7	167.1	0	0	114.1
697	N	30.6	Very low	33.5	Very low	137 Å²	137	133.2 Å²	133.2	73%	0.733	72%	0.717	S	S	*	*			trans	-117.6	75.3	174.4	-77.4	-41.4	0	0	0	111.4	E699	N697-E699 VanDerWaalsContact C-N 3.33Å; N697-E699 PolarHBondContact O-N 3.19Å; N697-E699 VanDerWaalsContact O-N 3.09Å
698	S	26.8	Very low	32.4	Very low	110 Å²	110	134.4 Å²	134.4	77%	0.769	73%	0.729	S	S	*	*			trans	-77.9	79.6	166.8	59.3	0	0	0	0	111
699	E	28.6	Very low	31.6	Very low	194 Å²	194	135 Å²	135	91%	0.907	74%	0.736	S	S	*	*	S	Bend	trans	170.1	134.1	149.3	-98.3	169.7	-156.4	0	0	110.3	N697	N697-E699 VanDerWaalsContact C-N 3.33Å; N697-E699 PolarHBondContact O-N 3.19Å; N697-E699 VanDerWaalsContact O-N 3.09Å
700	G	25.8	Very low	30.9	Very low	64 Å²	64	137.6 Å²	137.6	66%	0.66	75%	0.751	S	S	*	*	S	Bend	trans	106.5	82.4	164.3	0	0	0	0	0	118.4
701	H	26.4	Very low	30	Very low	197 Å²	197	143.7 Å²	143.7	91%	0.912	77%	0.768	S	S	*	*			trans	79.5	156.5	148.6	-59.8	-68.3	0	0	0	121.6
702	S	24.4	Very low	29.2	Very low	97 Å²	97	147.6 Å²	147.6	68%	0.678	78%	0.784	S	S	*	*			trans	-135.4	179.8	-156.2	54.5	0	0	0	0	111.6
703	T	24.2	Very low	28.6	Very low	130 Å²	130	143 Å²	143	80%	0.798	79%	0.787	S	S	*	*			trans	88.7	131.7	166.1	68.6	0	0	0	0	118.9
704	L	26.3	Very low	28	Very low	176 Å²	176	142.5 Å²	142.5	92%	0.921	79%	0.793	S	S	*	*			trans	-60.9	140.9	157.9	-82.4	69.1	0	0	0	109.3
705	S	23.3	Very low	27.5	Very low	115 Å²	115	144.7 Å²	144.7	80%	0.804	80%	0.798	S	S	*	*			trans	-139.4	141.7	153.2	60.2	0	0	0	0	111.5
706	T	23.4	Very low	27.1	Very low	134 Å²	134	145 Å²	145	82%	0.822	80%	0.798	S	S	*	*			trans	-69.6	159.3	176.3	42.1	0	0	0	0	111.9	N708	T706-N708 PolarHBondContact O-N 2.88Å
707	F	23.9	Very low	26.8	Very low	197 Å²	197	144.5 Å²	144.5	86%	0.864	79%	0.793	S	S	*	*			trans	-48	136.4	168.1	-97.4	-100.1	0	0	0	112.1
708	N	23.8	Very low	27	Very low	154 Å²	154	142.2 Å²	142.2	82%	0.824	78%	0.779	S	S	*	*			trans	-147.1	150.8	148.7	-101.2	-15.9	0	0	0	107.5	T706	T706-N708 PolarHBondContact O-N 2.88Å
709	D	29.2	Very low	27.5	Very low	143 Å²	143	142.6 Å²	142.6	77%	0.765	77%	0.773	S	S	*	*	S	Bend	trans	-69.4	164.2	-169.7	-64.8	-61.6	0	0	0	114.4
710	D	27.5	Very low	27.7	Very low	146 Å²	146	139.1 Å²	139.1	78%	0.781	76%	0.755	S	S	*	*			trans	61.9	78	168.6	-66.2	-23	0	0	0	118.9
711	K	27.8	Very low	28.2	Very low	198 Å²	198	143 Å²	143	86%	0.861	75%	0.754	S	S	*	*	S	Bend		174.9	139.3	113.3	-90.9	149.5	-167.9	166.9	0	113.8
712	Q	28	Very low	28.9	Very low	196 Å²	196	135.9 Å²	135.9	92%	0.916	73%	0.729	S	S	*	*			trans	32.4	84.5	160.5	-68.7	-176.8	-14.4	0	0	117	S714	Q712-S714 PolarHBondContact O-N 3.4Å
713	A	28.4	Very low	29.5	Very low	100 Å²	100	132.4 Å²	132.4	83%	0.826	70%	0.703	S	S	*	*			trans	-63.3	117.5	166.2	0	0	0	0	0	110.9
714	S	27.9	Very low	30	Very low	97 Å²	97	129.6 Å²	129.6	68%	0.678	68%	0.682	S	S	*	*			trans	-69	127.6	161.7	42.6	0	0	0	0	109.2	Q712 H716	Q712-S714 PolarHBondContact O-N 3.4Å; S714-H716 VanDerWaalsContact C-N 3.32Å; S714-H716 PolarHBondContact O-N 2.89Å
715	D	27.4	Very low	30.7	Very low	124 Å²	124	127 Å²	127	66%	0.663	67%	0.666	S	S	*	*			trans	-68.5	81.9	-176.4	-117	7.4	0	0	0	110.9	K717	D715-K717 HydrophobicContact CB-CG 4.43Å; D715-K717 PolarHBondContact O-N 2.81Å; D715-K717 IonicContact OD2-NZ 2.83Å; D715-K717 PolarHBondContact OD2-NZ 3.02Å
716	H	28.4	Very low	31.5	Very low	173 Å²	173	124.6 Å²	124.6	80%	0.801	65%	0.646	S	S	*	*			trans	-67.9	77	159.3	-82.4	-42.2	0	0	0	109	S714 I718	S714-H716 VanDerWaalsContact C-N 3.32Å; S714-H716 PolarHBondContact O-N 2.89Å; H716-I718 PolarHBondContact O-N 2.88Å
717	K	30.7	Very low	32.1	Very low	152 Å²	152	118.9 Å²	118.9	66%	0.661	61%	0.612	S	S	*	*			trans	-66.3	81.8	172.1	-83.6	-172	172.9	79.8	0	110	D715 N719	D715-K717 HydrophobicContact CB-CG 4.43Å; D715-K717 PolarHBondContact O-N 2.81Å; D715-K717 IonicContact OD2-NZ 2.83Å; D715-K717 PolarHBondContact OD2-NZ 3.02Å; K717-N719 PolarHBondContact O-N 2.97Å
718	I	34.8	Very low	32.6	Very low	89 Å²	89	113.6 Å²	113.6	46%	0.456	60%	0.595	S	S	.	*			trans	-52.8	114.6	155	-64.5	162.1	0	0	0	105.9	E686 H716 F720 L723	E686-I718 WeakPolarHBondContact OE1-CD1 3.4Å; H716-I718 PolarHBondContact O-N 2.88Å; I718-F720 HydrophobicContact CG2-CD2 4.21Å; I718-F720 PolarHBondContact O-N 3.49Å; I718-L723 HydrophobicContact CG2-CD1 4.15Å
719	N	36.6	Very low	33.3	Very low	118 Å²	118	109.6 Å²	109.6	63%	0.631	58%	0.577	S	S	*	*			trans	-78.9	71.7	-170	-157.9	-4.8	0	0	0	109.6	K717 K721 A722 L723	K717-N719 PolarHBondContact O-N 2.97Å; N719-K721 PolarHBondContact O-N 3.22Å; N719-A722 PolarHBondContact O-N 3.05Å; N719-L723 PolarHBondContact O-N 2.91Å
720	F	32.8	Very low	33.6	Very low	121 Å²	121	105.7 Å²	105.7	53%	0.531	55%	0.554	S	S	.	*	H	α-helix	trans	-47.9	-27.5	-173.4	-116.3	-91	0	0	0	113.5	I718 L724 M798	I718-F720 HydrophobicContact CG2-CD2 4.21Å; I718-F720 PolarHBondContact O-N 3.49Å; F720-L724 VanDerWaalsContact O-CB 3.32Å; F720-L724 WeakPolarHBondContact O-CB 3.46Å; F720-L724 PolarHBondContact O-N 3.29Å; F720-M798 HydrophobicContact CE1-SD 3.99Å
721	K	36.8	Very low	33.9	Very low	146 Å²	146	101.3 Å²	101.3	64%	0.635	53%	0.53	S	S	*	.	H	α-helix	trans	-66.6	-42.2	176.6	-164.3	177.4	-179.5	-174.8	0	112.9	N719 L724 Q725	N719-K721 PolarHBondContact O-N 3.22Å; K721-L724 WeakPolarHBondContact O-CB 3.13Å; K721-L724 PolarHBondContact O-N 2.8Å; K721-Q725 WeakPolarHBondContact O-CG 3.22Å; K721-Q725 PolarHBondContact O-N 2.76Å; K721-Q725 PolarHBondContact O-OE1 3.02Å
722	A	41.9	Very low	34.4	Very low	47 Å²	47	95.3 Å²	95.3	39%	0.388	51%	0.513	S	S	.	.	H	α-helix	trans	-71.2	-36.3	175.4	0	0	0	0	0	111.7	N719 Q725 T726	N719-A722 PolarHBondContact O-N 3.05Å; A722-Q725 PolarHBondContact O-N 3.31Å; A722-T726 WeakPolarHBondContact O-CG2 3.21Å; A722-T726 PolarHBondContact O-N 3.09Å; A722-T726 PolarHBondContact O-OG1 3.26Å
723	L	36.7	Very low	34.6	Very low	25 Å²	25	88.4 Å²	88.4	13%	0.131	48%	0.48	C	S	.	.	H	α-helix	trans	-66.2	-37.8	174.1	-129.2	159.3	0	0	0	111.3	I682 I718 N719 T726 S727	I682-L723 HydrophobicContact CD1-CD2 4.44Å; I682-L723 HydrophobicContact CG1-CD2 4.02Å; I682-L723 HydrophobicContact CG2-CD2 4.4Å; I718-L723 HydrophobicContact CG2-CD1 4.15Å; N719-L723 PolarHBondContact O-N 2.91Å; L723-T726 PolarHBondContact O-OG1 2.82Å; L723-S727 VanDerWaalsContact O-CB 3.23Å; L723-S727 WeakPolarHBondContact O-CB 3.07Å; L723-S727 PolarHBondContact O-N 2.64Å; L723-S727 PolarHBondContact O-OG 3.29Å
724	L	35.4	Very low	34.8	Very low	70 Å²	70	87.9 Å²	87.9	37%	0.366	46%	0.463	S	S	.	.	H	α-helix	trans	-63.6	-49.5	169.9	-97.1	159.6	0	0	0	112.8	F720 K721 T726 S727 T728 M798	F720-L724 VanDerWaalsContact O-CB 3.32Å; F720-L724 WeakPolarHBondContact O-CB 3.46Å; F720-L724 PolarHBondContact O-N 3.29Å; K721-L724 WeakPolarHBondContact O-CB 3.13Å; K721-L724 PolarHBondContact O-N 2.8Å; L724-T726 VanDerWaalsContact C-N 3.33Å; L724-T726 PolarHBondContact O-N 2.92Å; L724-S727 WeakPolarHBondContact CA-OG 3.46Å; L724-S727 PolarHBondContact O-N 2.84Å; L724-S727 PolarHBondContact O-OG 3.13Å; L724-T728 WeakPolarHBondContact O-CG2 3.29Å; L724-T728 PolarHBondContact O-N 3.34Å; L724-T728 PolarHBondContact O-OG1 3.4Å; L724-T728 VanDerWaalsContact O-OG1 3.1Å; L724-M798 HydrophobicContact CD1-CE 3.81Å; L724-M798 HydrophobicContact CD2-CE 3.66Å; L724-M798 HydrophobicContact CG-CE 3.85Å
725	Q	40.1	Very low	35.2	Very low	123 Å²	123	94 Å²	94	58%	0.575	47%	0.472	S	S	*	.	H	α-helix	trans	-67.3	-31.7	-177.9	-72.8	175.7	-78.2	0	0	113.2	K721 A722 T728 T729	K721-Q725 WeakPolarHBondContact O-CG 3.22Å; K721-Q725 PolarHBondContact O-N 2.76Å; K721-Q725 PolarHBondContact O-OE1 3.02Å; A722-Q725 PolarHBondContact O-N 3.31Å; Q725-T728 PolarHBondContact O-OG1 2.74Å; Q725-T729 WeakPolarHBondContact O-CG2 3.49Å; Q725-T729 PolarHBondContact O-OG1 2.61Å
726	T	39.4	Very low	35.8	Very low	64 Å²	64	90.3 Å²	90.3	39%	0.393	45%	0.454	S	S	.	.	H	α-helix	trans	-85.8	-14.1	175.4	58.8	0	0	0	0	114	A722 L723 L724 T729 Q730	A722-T726 WeakPolarHBondContact O-CG2 3.21Å; A722-T726 PolarHBondContact O-N 3.09Å; A722-T726 PolarHBondContact O-OG1 3.26Å; L723-T726 PolarHBondContact O-OG1 2.82Å; L724-T726 VanDerWaalsContact C-N 3.33Å; L724-T726 PolarHBondContact O-N 2.92Å; T726-T729 WeakPolarHBondContact CA-OG1 3.44Å; T726-T729 PolarHBondContact O-OG1 3.45Å; T726-Q730 PolarHBondContact O-OE1 3.07Å
727	S	36.2	Very low	36.2	Very low	14 Å²	14	84.6 Å²	84.6	10%	0.098	43%	0.431	C	S	.	.	H	α-helix	trans	-90.5	-40.5	172.6	53.8	0	0	0	0	112	L723 L724 T729 Q730 L731	L723-S727 VanDerWaalsContact O-CB 3.23Å; L723-S727 WeakPolarHBondContact O-CB 3.07Å; L723-S727 PolarHBondContact O-N 2.64Å; L723-S727 PolarHBondContact O-OG 3.29Å; L724-S727 WeakPolarHBondContact CA-OG 3.46Å; L724-S727 PolarHBondContact O-N 2.84Å; L724-S727 PolarHBondContact O-OG 3.13Å; S727-T729 PolarHBondContact O-N 3.42Å; S727-Q730 PolarHBondContact O-N 2.83Å; S727-L731 WeakPolarHBondContact O-CB 3.47Å; S727-L731 WeakPolarHBondContact O-CD1 3.36Å; S727-L731 PolarHBondContact O-N 2.93Å
728	T	35.3	Very low	36.5	Very low	85 Å²	85	79.9 Å²	79.9	52%	0.521	43%	0.426	S	S	.	.	H	α-helix	trans	-61.4	-27.3	175.6	53.1	0	0	0	0	113.4	L724 Q725	L724-T728 WeakPolarHBondContact O-CG2 3.29Å; L724-T728 PolarHBondContact O-N 3.34Å; L724-T728 PolarHBondContact O-OG1 3.4Å; L724-T728 VanDerWaalsContact O-OG1 3.1Å; Q725-T728 PolarHBondContact O-OG1 2.74Å
729	T	38	Very low	36.9	Very low	70 Å²	70	79.7 Å²	79.7	43%	0.429	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-12.5	175.3	46.2	0	0	0	0	114	Q725 T726 S727 K733	Q725-T729 WeakPolarHBondContact O-CG2 3.49Å; Q725-T729 PolarHBondContact O-OG1 2.61Å; T726-T729 WeakPolarHBondContact CA-OG1 3.44Å; T726-T729 PolarHBondContact O-OG1 3.45Å; S727-T729 PolarHBondContact O-N 3.42Å; T729-K733 WeakPolarHBondContact O-CE 3.49Å
730	Q	36.5	Very low	37.2	Very low	62 Å²	62	76.2 Å²	76.2	29%	0.29	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110	-30.7	177.2	-70.5	-171.9	-94.8	0	0	114	T726 S727 K733 R1481	T726-Q730 PolarHBondContact O-OE1 3.07Å; S727-Q730 PolarHBondContact O-N 2.83Å; Q730-K733 VanDerWaalsContact O-CB 3.25Å; Q730-K733 WeakPolarHBondContact O-CB 3.43Å; Q730-K733 VanDerWaalsContact O-CG 3.22Å; Q730-K733 WeakPolarHBondContact O-CG 3.03Å; Q730-R1481 VanDerWaalsContact NE2-NH1 3.13Å
731	L	33.5	Very low	37.6	Very low	54 Å²	54	71.4 Å²	71.4	28%	0.283	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-7.9	-175.7	-89	122.7	0	0	0	115.5	F678 S727 K733	F678-L731 HydrophobicContact CD2-CD1 3.6Å; F678-L731 HydrophobicContact CD2-CD2 3.83Å; F678-L731 HydrophobicContact CD2-CG 4.38Å; F678-L731 HydrophobicContact CE2-CD1 3.7Å; S727-L731 WeakPolarHBondContact O-CB 3.47Å; S727-L731 WeakPolarHBondContact O-CD1 3.36Å; S727-L731 PolarHBondContact O-N 2.93Å; L731-K733 PolarHBondContact O-N 3.25Å
732	S	37.7	Very low	37.9	Very low	72 Å²	72	69.8 Å²	69.8	50%	0.503	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	3.2	170.9	54.3	0	0	0	0	113.6
733	K	33.2	Very low	37.9	Very low	51 Å²	51	68.9 Å²	68.9	22%	0.222	38%	0.38	C	S	.	.	S	Bend	trans	-104.4	-29	-160.2	-59.1	-163.7	166.6	-119.5	0	115.2	T729 Q730 L731 I1516	T729-K733 WeakPolarHBondContact O-CE 3.49Å; Q730-K733 VanDerWaalsContact O-CB 3.25Å; Q730-K733 WeakPolarHBondContact O-CB 3.43Å; Q730-K733 VanDerWaalsContact O-CG 3.22Å; Q730-K733 WeakPolarHBondContact O-CG 3.03Å; L731-K733 PolarHBondContact O-N 3.25Å; K733-I1516 HydrophobicContact CB-CG1 3.88Å; K733-I1516 HydrophobicContact CB-CG2 4.39Å; K733-I1516 HydrophobicContact CD-CB 4.13Å; K733-I1516 HydrophobicContact CD-CD1 3.75Å; K733-I1516 HydrophobicContact CD-CG1 3.66Å; K733-I1516 HydrophobicContact CD-CG2 3.87Å; K733-I1516 HydrophobicContact CG-CB 4.3Å; K733-I1516 HydrophobicContact CG-CD1 4.43Å; K733-I1516 HydrophobicContact CG-CG1 3.83Å; K733-I1516 HydrophobicContact CG-CG2 3.65Å
734	D	32.2	Very low	38.2	Very low	89 Å²	89	70 Å²	70	48%	0.476	38%	0.383	S	S	.	.	S	Bend	trans	-117.7	111.5	-165.2	-61.5	-43.6	0	0	0	113.5	T736 L1514	D734-T736 PolarHBondContact O-N 3.28Å; D734-T736 PolarHBondContact O-OG1 2.58Å; D734-T736 VanDerWaalsContact O-OG1 3.04Å; D734-L1514 VanDerWaalsContact OD1-CD1 3.28Å; D734-L1514 WeakPolarHBondContact OD1-CD1 3.17Å
735	W	35.7	Very low	38.5	Very low	224 Å²	224	70.4 Å²	70.4	85%	0.848	38%	0.383	S	S	*	.	S	Bend	trans	41.5	-42.4	156.3	-82.5	48.1	0	0	0	121.1	G738 L739	W735-G738 PolarHBondContact O-N 2.75Å; W735-L739 WeakPolarHBondContact O-CB 3.28Å; W735-L739 PolarHBondContact O-N 2.82Å
736	T	39.3	Very low	38.4	Very low	48 Å²	48	68.1 Å²	68.1	29%	0.294	38%	0.378	S	S	.	.	H	α-helix	trans	-63.2	-41.9	-174.1	54.6	0	0	0	0	114.1	D734 L739 V740	D734-T736 PolarHBondContact O-N 3.28Å; D734-T736 PolarHBondContact O-OG1 2.58Å; D734-T736 VanDerWaalsContact O-OG1 3.04Å; T736-L739 PolarHBondContact O-N 3.08Å; T736-V740 WeakPolarHBondContact O-CB 3.46Å; T736-V740 WeakPolarHBondContact O-CG2 3.23Å; T736-V740 PolarHBondContact O-N 3.15Å
737	V	38.1	Very low	38.4	Very low	53 Å²	53	66.9 Å²	66.9	32%	0.321	37%	0.369	S	S	.	.	H	α-helix	trans	-65.9	-42.1	178.3	173.6	0	0	0	0	111.6	L739 G741 Y808	V737-L739 VanDerWaalsContact C-N 3.33Å; V737-G741 PolarHBondContact O-N 3.04Å; V737-Y808 HydrophobicContact CG1-CD1 3.87Å; V737-Y808 HydrophobicContact CG1-CD2 4.41Å; V737-Y808 HydrophobicContact CG1-CE1 3.31Å; V737-Y808 HydrophobicContact CG1-CE2 3.91Å; V737-Y808 HydrophobicContact CG1-CG 4.4Å
738	G	37.4	Very low	38.7	Very low	53 Å²	53	67.3 Å²	67.3	55%	0.546	37%	0.37	S	S	.	.	H	α-helix	trans	-62	-42.5	174.7	0	0	0	0	0	111.2	W735 G741 L742	W735-G738 PolarHBondContact O-N 2.75Å; G738-G741 PolarHBondContact O-N 2.82Å; G738-L742 VanDerWaalsContact O-CB 3.26Å; G738-L742 WeakPolarHBondContact O-CB 3.43Å; G738-L742 PolarHBondContact O-N 3.41Å
739	L	41.2	Very low	38.8	Very low	84 Å²	84	66.5 Å²	66.5	44%	0.44	37%	0.373	S	S	.	.	H	α-helix	trans	-74.5	-39.1	-178.3	-155.6	146.9	0	0	0	112.8	W735 T736 V737 G741 L742 V743	W735-L739 WeakPolarHBondContact O-CB 3.28Å; W735-L739 PolarHBondContact O-N 2.82Å; T736-L739 PolarHBondContact O-N 3.08Å; V737-L739 VanDerWaalsContact C-N 3.33Å; L739-G741 VanDerWaalsContact C-N 3.32Å; L739-G741 PolarHBondContact O-N 3.43Å; L739-L742 PolarHBondContact O-N 3.45Å; L739-V743 HydrophobicContact CD2-CG2 3.95Å; L739-V743 VanDerWaalsContact O-CB 3.26Å; L739-V743 WeakPolarHBondContact O-CB 3.24Å; L739-V743 WeakPolarHBondContact O-CG2 3.43Å; L739-V743 PolarHBondContact O-N 3.14Å
740	V	43.8	Very low	38.7	Very low	46 Å²	46	66.9 Å²	66.9	28%	0.279	38%	0.383	S	S	.	.	H	α-helix	trans	-61.4	-41.9	169.6	169.9	0	0	0	0	110.6	L670 T736 F744	L670-V740 HydrophobicContact CB-CG2 4.31Å; L670-V740 HydrophobicContact CD1-CG2 4.12Å; T736-V740 WeakPolarHBondContact O-CB 3.46Å; T736-V740 WeakPolarHBondContact O-CG2 3.23Å; T736-V740 PolarHBondContact O-N 3.15Å; V740-F744 HydrophobicContact CG1-CD2 4.27Å; V740-F744 WeakPolarHBondContact O-CB 3.04Å; V740-F744 PolarHBondContact O-N 3.47Å
741	G	42.2	Very low	38.5	Very low	19 Å²	19	69.2 Å²	69.2	20%	0.196	39%	0.392	C	S	.	.	H	α-helix	trans	-67.3	-38.2	175.7	0	0	0	0	0	113.7	V737 G738 L739 H745	V737-G741 PolarHBondContact O-N 3.04Å; G738-G741 PolarHBondContact O-N 2.82Å; L739-G741 VanDerWaalsContact C-N 3.32Å; L739-G741 PolarHBondContact O-N 3.43Å; G741-H745 VanDerWaalsContact O-CB 3.27Å; G741-H745 WeakPolarHBondContact O-CB 3.34Å; G741-H745 PolarHBondContact O-N 2.9Å
742	L	41.5	Very low	38.5	Very low	113 Å²	113	77.3 Å²	77.3	59%	0.592	42%	0.419	S	S	*	.	H	α-helix	trans	-68.7	-44.4	175.8	-165.7	92.4	0	0	0	110.9	G738 L739 H745 T746	G738-L742 VanDerWaalsContact O-CB 3.26Å; G738-L742 WeakPolarHBondContact O-CB 3.43Å; G738-L742 PolarHBondContact O-N 3.41Å; L739-L742 PolarHBondContact O-N 3.45Å; L742-H745 CarbonylContact O-C 3.6Å; L742-H745 WeakPolarHBondContact O-CB 3.18Å; L742-H745 PolarHBondContact O-N 3.14Å; L742-H745 VanDerWaalsContact O-N 3.17Å; L742-T746 WeakPolarHBondContact O-CG2 3.49Å; L742-T746 PolarHBondContact O-N 3.27Å; L742-T746 PolarHBondContact O-OG1 3.05Å
743	V	42.7	Very low	38.4	Very low	28 Å²	28	77 Å²	77	17%	0.17	41%	0.408	C	S	.	.	H	α-helix	trans	-57.9	-50	173.2	160.9	0	0	0	0	110.3	L666 L739 H745 T746 L747	L666-V743 HydrophobicContact CD2-CG1 3.48Å; L666-V743 VanDerWaalsContact CD2-CG1 3.48Å; L666-V743 HydrophobicContact CD2-CG2 4.21Å; L739-V743 HydrophobicContact CD2-CG2 3.95Å; L739-V743 VanDerWaalsContact O-CB 3.26Å; L739-V743 WeakPolarHBondContact O-CB 3.24Å; L739-V743 WeakPolarHBondContact O-CG2 3.43Å; L739-V743 PolarHBondContact O-N 3.14Å; V743-H745 VanDerWaalsContact C-N 3.29Å; V743-H745 PolarHBondContact O-N 3.04Å; V743-T746 WeakPolarHBondContact CA-OG1 3.49Å; V743-T746 PolarHBondContact O-N 2.69Å; V743-T746 PolarHBondContact O-OG1 2.85Å; V743-L747 HydrophobicContact CG1-CD1 3.85Å; V743-L747 HydrophobicContact CG1-CG 4.45Å; V743-L747 WeakPolarHBondContact O-CB 3.17Å; V743-L747 WeakPolarHBondContact O-CG 3.49Å; V743-L747 PolarHBondContact O-N 3.24Å
744	F	43.5	Very low	38.4	Very low	48 Å²	48	79 Å²	79	21%	0.211	43%	0.426	C	S	.	.	H	α-helix	trans	-60.8	-39	175.3	-110.2	-76.8	0	0	0	112.4	L667 V740 L747 V748 I812	L667-F744 HydrophobicContact CD1-CE2 3.78Å; L667-F744 HydrophobicContact CD1-CZ 3.92Å; L667-F744 HydrophobicContact CD2-CE2 4.13Å; L667-F744 HydrophobicContact CG-CE2 4.27Å; V740-F744 HydrophobicContact CG1-CD2 4.27Å; V740-F744 WeakPolarHBondContact O-CB 3.04Å; V740-F744 PolarHBondContact O-N 3.47Å; F744-L747 PolarHBondContact O-N 3.01Å; F744-V748 VanDerWaalsContact O-CG2 3.28Å; F744-V748 WeakPolarHBondContact O-CG2 3.31Å; F744-V748 PolarHBondContact O-N 3.32Å; F744-I812 HydrophobicContact CB-CD1 3.72Å; F744-I812 HydrophobicContact CB-CG1 4.35Å; F744-I812 HydrophobicContact CB-CG2 3.76Å; F744-I812 HydrophobicContact CD1-CG2 4.19Å; F744-I812 HydrophobicContact CD2-CD1 4.39Å; F744-I812 HydrophobicContact CG-CD1 4.09Å; F744-I812 HydrophobicContact CG-CG2 4.3Å
745	H	40.4	Very low	38.6	Very low	79 Å²	79	78.1 Å²	78.1	37%	0.366	42%	0.415	S	S	.	.	H	α-helix	trans	-66	-43.7	176.8	-174.4	-81.3	0	0	0	112.1	G741 L742 V743 L747 V748 A749	G741-H745 VanDerWaalsContact O-CB 3.27Å; G741-H745 WeakPolarHBondContact O-CB 3.34Å; G741-H745 PolarHBondContact O-N 2.9Å; L742-H745 CarbonylContact O-C 3.6Å; L742-H745 WeakPolarHBondContact O-CB 3.18Å; L742-H745 PolarHBondContact O-N 3.14Å; L742-H745 VanDerWaalsContact O-N 3.17Å; V743-H745 VanDerWaalsContact C-N 3.29Å; V743-H745 PolarHBondContact O-N 3.04Å; H745-L747 VanDerWaalsContact C-N 3.34Å; H745-V748 PolarHBondContact O-N 2.96Å; H745-A749 WeakPolarHBondContact O-CB 3.15Å; H745-A749 PolarHBondContact O-N 3.44Å
746	T	38.9	Very low	38.5	Very low	75 Å²	75	70.3 Å²	70.3	46%	0.46	39%	0.393	S	S	.	.	H	α-helix	trans	-67.1	-35.8	176	53.9	0	0	0	0	111.6	L742 V743 A750	L742-T746 WeakPolarHBondContact O-CG2 3.49Å; L742-T746 PolarHBondContact O-N 3.27Å; L742-T746 PolarHBondContact O-OG1 3.05Å; V743-T746 WeakPolarHBondContact CA-OG1 3.49Å; V743-T746 PolarHBondContact O-N 2.69Å; V743-T746 PolarHBondContact O-OG1 2.85Å; T746-A750 WeakPolarHBondContact O-CB 3.49Å; T746-A750 PolarHBondContact O-N 3.24Å
747	L	39.9	Very low	38.1	Very low	38 Å²	38	72.1 Å²	72.1	20%	0.199	40%	0.401	C	S	.	.	H	α-helix	trans	-65.9	-47.7	173.8	-69.8	172.8	0	0	0	112.2	I663 V743 F744 H745 A749 A750 F751	I663-L747 HydrophobicContact CB-CD1 4.26Å; I663-L747 HydrophobicContact CD1-CD1 4.2Å; I663-L747 HydrophobicContact CD1-CD2 3.72Å; I663-L747 HydrophobicContact CD1-CG 4.42Å; I663-L747 HydrophobicContact CG1-CD1 3.76Å; I663-L747 HydrophobicContact CG1-CD2 3.56Å; I663-L747 HydrophobicContact CG1-CG 4.26Å; I663-L747 HydrophobicContact CG2-CD1 3.7Å; V743-L747 HydrophobicContact CG1-CD1 3.85Å; V743-L747 HydrophobicContact CG1-CG 4.45Å; V743-L747 WeakPolarHBondContact O-CB 3.17Å; V743-L747 WeakPolarHBondContact O-CG 3.49Å; V743-L747 PolarHBondContact O-N 3.24Å; F744-L747 PolarHBondContact O-N 3.01Å; H745-L747 VanDerWaalsContact C-N 3.34Å; L747-A749 VanDerWaalsContact C-N 3.34Å; L747-A749 PolarHBondContact O-N 3.37Å; L747-A750 PolarHBondContact O-N 3.21Å; L747-F751 WeakPolarHBondContact O-CB 3.38Å; L747-F751 WeakPolarHBondContact O-CD2 3.42Å; L747-F751 PolarHBondContact O-N 3.08Å; L747-F751 VanDerWaalsContact O-N 3.09Å
748	V	42.3	Very low	38	Very low	22 Å²	22	77.4 Å²	77.4	13%	0.133	42%	0.422	C	S	.	.	H	α-helix	trans	-70.2	-32.5	179.7	-178.3	0	0	0	0	111.8	F744 H745 F753 A816	F744-V748 VanDerWaalsContact O-CG2 3.28Å; F744-V748 WeakPolarHBondContact O-CG2 3.31Å; F744-V748 PolarHBondContact O-N 3.32Å; H745-V748 PolarHBondContact O-N 2.96Å; V748-F753 HydrophobicContact CB-CE2 4.34Å; V748-F753 HydrophobicContact CG1-CD2 3.85Å; V748-F753 HydrophobicContact CG1-CE2 4.09Å; V748-F753 HydrophobicContact CG2-CE2 4.11Å; V748-A816 HydrophobicContact CB-CB 4.23Å; V748-A816 HydrophobicContact CG1-CB 3.3Å
749	A	36.6	Very low	37.8	Very low	69 Å²	69	84.1 Å²	84.1	57%	0.57	44%	0.436	S	S	*	.	H	α-helix	trans	-70.4	-38.3	172.4	0	0	0	0	0	113.1	H745 L747	H745-A749 WeakPolarHBondContact O-CB 3.15Å; H745-A749 PolarHBondContact O-N 3.44Å; L747-A749 VanDerWaalsContact C-N 3.34Å; L747-A749 PolarHBondContact O-N 3.37Å
750	A	35.2	Very low	37.2	Very low	77 Å²	77	88.1 Å²	88.1	64%	0.636	45%	0.454	S	S	*	.	H	α-helix	trans	-69.9	-34.7	179.3	0	0	0	0	0	112.9	T746 L747	T746-A750 WeakPolarHBondContact O-CB 3.49Å; T746-A750 PolarHBondContact O-N 3.24Å; L747-A750 PolarHBondContact O-N 3.21Å
751	F	33.1	Very low	36.6	Very low	112 Å²	112	91 Å²	91	49%	0.491	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	3.1	-171.7	-87.2	-74.7	0	0	0	116.3	A659 I663 L747 F753	A659-F751 HydrophobicContact CB-CE1 4.31Å; A659-F751 HydrophobicContact CB-CZ 3.85Å; I663-F751 HydrophobicContact CD1-CD2 4.45Å; I663-F751 HydrophobicContact CD1-CE2 3.93Å; L747-F751 WeakPolarHBondContact O-CB 3.38Å; L747-F751 WeakPolarHBondContact O-CD2 3.42Å; L747-F751 PolarHBondContact O-N 3.08Å; L747-F751 VanDerWaalsContact O-N 3.09Å; F751-F753 VanDerWaalsContact C-N 3.31Å; F751-F753 HydrophobicContact CB-CD2 4.2Å; F751-F753 HydrophobicContact CB-CE2 4.07Å; F751-F753 PolarHBondContact O-N 3.49Å; F751-F753 VanDerWaalsContact O-N 3.12Å
752	R	33.9	Very low	36.1	Very low	223 Å²	223	99.4 Å²	99.4	84%	0.842	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	34.5	60.8	179.5	-99.2	-164.3	174.8	-167.9	-0.1	112.1	T754	R752-T754 PolarHBondContact O-N 3.24Å
753	F	35.3	Very low	35.4	Very low	65 Å²	65	102.9 Å²	102.9	29%	0.285	51%	0.508	S	S	.	.			trans	-49.3	107.2	-177.2	-87.6	-105.3	0	0	0	110.6	V748 F751 W755 F769	V748-F753 HydrophobicContact CB-CE2 4.34Å; V748-F753 HydrophobicContact CG1-CD2 3.85Å; V748-F753 HydrophobicContact CG1-CE2 4.09Å; V748-F753 HydrophobicContact CG2-CE2 4.11Å; F751-F753 VanDerWaalsContact C-N 3.31Å; F751-F753 HydrophobicContact CB-CD2 4.2Å; F751-F753 HydrophobicContact CB-CE2 4.07Å; F751-F753 PolarHBondContact O-N 3.49Å; F751-F753 VanDerWaalsContact O-N 3.12Å; F753-W755 HydrophobicContact CB-CZ2 4.28Å; F753-W755 PolarHBondContact O-N 3.37Å; F753-W755 VanDerWaalsContact O-N 3.09Å; F753-W755 PolarHBondContact O-NE1 3.41Å; F753-F769 HydrophobicContact CD1-CB 4.19Å; F753-F769 HydrophobicContact CE1-CB 3.62Å; F753-F769 HydrophobicContact CE1-CG 4.36Å; F753-F769 HydrophobicContact CZ-CB 4.45Å
754	T	34	Very low	34.7	Very low	95 Å²	95	107.5 Å²	107.5	58%	0.583	53%	0.532	S	S	*	.			trans	-79.3	92.7	179	41.5	0	0	0	0	108.6	R752 T756	R752-T754 PolarHBondContact O-N 3.24Å; T754-T756 PolarHBondContact O-N 3.42Å
755	W	36	Very low	34.2	Very low	69 Å²	69	113.9 Å²	113.9	26%	0.261	56%	0.563	S	S	.	*			trans	-67.8	100.1	172.3	-54.6	93.3	0	0	0	108.5	F753 N757 A818 T823 V827	F753-W755 HydrophobicContact CB-CZ2 4.28Å; F753-W755 PolarHBondContact O-N 3.37Å; F753-W755 VanDerWaalsContact O-N 3.09Å; F753-W755 PolarHBondContact O-NE1 3.41Å; W755-N757 PolarHBondContact O-N 3.27Å; W755-A818 HydrophobicContact CH2-CB 3.75Å; W755-A818 HydrophobicContact CZ2-CB 3.56Å; W755-T823 HydrophobicContact CB-CG2 4.31Å; W755-T823 HydrophobicContact CD2-CG2 4.46Å; W755-T823 HydrophobicContact CG-CG2 3.8Å; W755-V827 HydrophobicContact CH2-CG2 3.73Å; W755-V827 HydrophobicContact CZ3-CG2 3.73Å
756	T	32.6	Very low	33.8	Very low	61 Å²	61	115.7 Å²	115.7	37%	0.374	58%	0.575	S	S	.	*			trans	-71.4	117.2	-174.8	54	0	0	0	0	111.2	T754 E758 Y761	T754-T756 PolarHBondContact O-N 3.42Å; T756-E758 PolarHBondContact O-N 3.25Å; T756-Y761 HydrophobicContact CG2-CE2 4.07Å; T756-Y761 VanDerWaalsContact CG2-OH 3.32Å; T756-Y761 WeakPolarHBondContact CG2-OH 2.97Å
757	N	32.3	Very low	33.5	Very low	86 Å²	86	115.5 Å²	115.5	46%	0.46	58%	0.577	S	S	.	*			trans	-61.7	118.1	167.2	-106.9	-1.9	0	0	0	109.8	W755 K759 M760	W755-N757 PolarHBondContact O-N 3.27Å; N757-K759 PolarHBondContact O-N 2.83Å; N757-M760 PolarHBondContact O-N 2.94Å
758	E	35.2	Very low	33.1	Very low	163 Å²	163	115.3 Å²	115.3	76%	0.762	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-8.7	-178.9	-71.4	-173.5	153.6	0	0	113.7	T756	T756-E758 PolarHBondContact O-N 3.25Å
759	K	34.3	Very low	32.8	Very low	194 Å²	194	118.6 Å²	118.6	84%	0.843	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-4.4	-179.6	-71	-176	179	171.5	0	115.9	N757	N757-K759 PolarHBondContact O-N 2.83Å
760	M	28.7	Very low	33.1	Very low	168 Å²	168	121.1 Å²	121.1	83%	0.828	60%	0.595	S	S	*	*	S	Bend	trans	-121.6	27	-172.8	-141.9	172.2	-170	0	0	114.8	N757	N757-M760 PolarHBondContact O-N 2.94Å
761	Y	30.9	Very low	33.3	Very low	106 Å²	106	118.4 Å²	118.4	42%	0.416	57%	0.569	S	S	.	*			trans	-119.6	93.7	177	-76.6	-99.8	0	0	0	111.1	T756 D764 N766	T756-Y761 HydrophobicContact CG2-CE2 4.07Å; T756-Y761 VanDerWaalsContact CG2-OH 3.32Å; T756-Y761 WeakPolarHBondContact CG2-OH 2.97Å; Y761-D764 VanDerWaalsContact CD1-O 3.29Å; Y761-D764 WeakPolarHBondContact CD1-O 3.27Å; Y761-D764 WeakPolarHBondContact CE1-O 3.35Å; Y761-N766 WeakPolarHBondContact OH-CB 3.24Å; Y761-N766 PolarHBondContact OH-O 3.21Å
762	Q	30.4	Very low	33.7	Very low	197 Å²	197	118 Å²	118	92%	0.921	57%	0.568	S	S	*	*	S	Bend	trans	-114.9	-23.4	150.2	-95.1	-172.5	-26.3	0	0	113.4
763	E	27.9	Very low	34.3	Very low	185 Å²	185	110.9 Å²	110.9	86%	0.864	55%	0.547	S	S	*	.	S	Bend	trans	-133.6	-23	-174.1	-64.1	-167	142.6	0	0	118.6
764	D	28.4	Very low	34.6	Very low	126 Å²	126	109.8 Å²	109.8	67%	0.674	55%	0.545	S	S	*	.			trans	-106.3	119.8	-173.9	-78	-46.3	0	0	0	116.2	Y761 N766	Y761-D764 VanDerWaalsContact CD1-O 3.29Å; Y761-D764 WeakPolarHBondContact CD1-O 3.27Å; Y761-D764 WeakPolarHBondContact CE1-O 3.35Å; D764-N766 PolarHBondContact O-N 3.36Å; D764-N766 VanDerWaalsContact O-N 3.07Å
765	E	32.2	Very low	34.9	Very low	181 Å²	181	108.4 Å²	108.4	85%	0.846	53%	0.534	S	S	*	.			trans	-76.1	82.1	-179.8	-64.2	-175.6	146.3	0	0	113.8
766	N	30.9	Very low	35.3	Very low	117 Å²	117	110.1 Å²	110.1	63%	0.626	55%	0.545	S	S	*	.			trans	-106.4	117	168.5	-87.9	-53.6	0	0	0	112.7	Y761 D764	Y761-N766 WeakPolarHBondContact OH-CB 3.24Å; Y761-N766 PolarHBondContact OH-O 3.21Å; D764-N766 PolarHBondContact O-N 3.36Å; D764-N766 VanDerWaalsContact O-N 3.07Å
767	S	33.6	Very low	35.6	Very low	72 Å²	72	109.5 Å²	109.5	50%	0.503	54%	0.541	S	S	.	.			trans	-109.9	93.2	-164.1	45.3	0	0	0	0	113.7	R656	R656-S767 PolarHBondContact NH1-O 3.06Å; R656-S767 PolarHBondContact NH1-OG 3.17Å; R656-S767 PolarHBondContact NH2-OG 2.9Å
768	G	32.1	Very low	36	Very low	33 Å²	33	107.9 Å²	107.9	34%	0.34	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-94.1	161.9	173.2	0	0	0	0	0	114.6
769	F	36.3	Very low	36.1	Very low	92 Å²	92	107.4 Å²	107.4	40%	0.404	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-64.6	130.4	173.9	-118.7	-93.3	0	0	0	111.3	T660 F753 D773 V774	T660-F769 HydrophobicContact CG2-CE2 3.43Å; T660-F769 VanDerWaalsContact CG2-CE2 3.43Å; T660-F769 HydrophobicContact CG2-CZ 3.52Å; F753-F769 HydrophobicContact CD1-CB 4.19Å; F753-F769 HydrophobicContact CE1-CB 3.62Å; F753-F769 HydrophobicContact CE1-CG 4.36Å; F753-F769 HydrophobicContact CZ-CB 4.45Å; F769-D773 HydrophobicContact CD1-CB 4.1Å; F769-D773 HydrophobicContact CE1-CB 4.07Å; F769-V774 HydrophobicContact CD1-CG2 4.25Å
770	K	41.2	Very low	36.2	Very low	122 Å²	122	102.2 Å²	102.2	53%	0.53	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-85.5	146.3	173.1	-62.7	-177.8	179.5	-179.3	0	110.2	Q772 D773	K770-Q772 PolarHBondContact O-N 3.47Å; K770-D773 WeakPolarHBondContact CB-OD2 3.35Å; K770-D773 PolarHBondContact N-OD2 2.77Å; K770-D773 VanDerWaalsContact N-OD2 3.14Å; K770-D773 WeakPolarHBondContact O-CB 3.24Å; K770-D773 PolarHBondContact O-N 3.02Å
771	F	40	Very low	36.7	Very low	20 Å²	20	97 Å²	97	9%	0.088	48%	0.483	C	S	.	.	H	α-helix	trans	-65.2	-26	177	-173.8	-118.4	0	0	0	112	D773 V774 L775 L813 V827 T831	F771-D773 PolarHBondContact O-N 3.24Å; F771-V774 HydrophobicContact CD2-CB 4.38Å; F771-V774 PolarHBondContact O-N 2.85Å; F771-L775 HydrophobicContact CD1-CD1 3.82Å; F771-L775 HydrophobicContact CD1-CG 4.16Å; F771-L775 HydrophobicContact CE1-CD1 3.48Å; F771-L775 VanDerWaalsContact CE1-CD1 3.48Å; F771-L775 HydrophobicContact CE1-CD2 4.26Å; F771-L775 HydrophobicContact CE1-CG 3.71Å; F771-L775 HydrophobicContact CZ-CD1 4.18Å; F771-L775 HydrophobicContact CZ-CD2 4.17Å; F771-L775 HydrophobicContact CZ-CG 3.91Å; F771-L775 PolarHBondContact O-N 2.8Å; F771-L813 HydrophobicContact CD2-CD1 4.46Å; F771-L813 HydrophobicContact CE2-CD1 3.46Å; F771-L813 VanDerWaalsContact CE2-CD1 3.46Å; F771-L813 HydrophobicContact CE2-CD2 4.27Å; F771-L813 HydrophobicContact CZ-CD1 3.89Å; F771-V827 HydrophobicContact CD1-CG1 3.78Å; F771-V827 HydrophobicContact CE1-CG1 3.64Å; F771-V827 HydrophobicContact CG-CG1 4.33Å; F771-V827 HydrophobicContact CG-CG2 4.46Å; F771-V827 HydrophobicContact CZ-CG1 4.12Å; F771-T831 HydrophobicContact CD1-CG2 3.66Å; F771-T831 HydrophobicContact CE1-CG2 3.47Å; F771-T831 VanDerWaalsContact CE1-CG2 3.47Å
772	Q	42.4	Very low	36.9	Very low	102 Å²	102	95.9 Å²	95.9	48%	0.477	49%	0.485	S	S	.	.	H	α-helix	trans	-58.4	-32.3	169.6	-76.8	178.6	-5.3	0	0	113	K770 L775 H776 Q830	K770-Q772 PolarHBondContact O-N 3.47Å; Q772-L775 CarbonylContact O-C 3.52Å; Q772-L775 PolarHBondContact O-N 3.39Å; Q772-H776 WeakPolarHBondContact O-CB 3.45Å; Q772-H776 PolarHBondContact O-N 3.28Å; Q772-Q830 HydrophobicContact CG-CB 4.3Å; Q772-Q830 WeakPolarHBondContact CG-O 3.38Å; Q772-Q830 PolarHBondContact NE2-O 2.8Å
773	D	44.9	Very low	37.1	Very low	74 Å²	74	91 Å²	91	40%	0.396	46%	0.464	S	S	.	.	H	α-helix	trans	-72.5	-41.2	179.7	-55.7	-43.5	0	0	0	111.1	F769 K770 F771 H776 V777	F769-D773 HydrophobicContact CD1-CB 4.1Å; F769-D773 HydrophobicContact CE1-CB 4.07Å; K770-D773 WeakPolarHBondContact CB-OD2 3.35Å; K770-D773 PolarHBondContact N-OD2 2.77Å; K770-D773 VanDerWaalsContact N-OD2 3.14Å; K770-D773 WeakPolarHBondContact O-CB 3.24Å; K770-D773 PolarHBondContact O-N 3.02Å; F771-D773 PolarHBondContact O-N 3.24Å; D773-H776 PolarHBondContact O-N 2.73Å; D773-V777 VanDerWaalsContact O-CG2 3.31Å; D773-V777 WeakPolarHBondContact O-CG2 3.39Å; D773-V777 PolarHBondContact O-N 2.93Å
774	V	42.9	Very low	37.5	Very low	43 Å²	43	86.3 Å²	86.3	26%	0.261	45%	0.45	S	S	.	.	H	α-helix	trans	-63.2	-43.8	173.5	-178.9	0	0	0	0	110.5	F769 F771 L778	F769-V774 HydrophobicContact CD1-CG2 4.25Å; F771-V774 HydrophobicContact CD2-CB 4.38Å; F771-V774 PolarHBondContact O-N 2.85Å; V774-L778 HydrophobicContact CG1-CD1 4.18Å; V774-L778 WeakPolarHBondContact O-CB 3.39Å; V774-L778 WeakPolarHBondContact O-CG 3.49Å; V774-L778 PolarHBondContact O-N 3.36Å
775	L	40.3	Very low	37.7	Very low	65 Å²	65	89.4 Å²	89.4	34%	0.34	46%	0.458	S	S	.	.	H	α-helix	trans	-67.3	-33.2	173.5	-78.4	179.8	0	0	0	113.1	F771 Q772 L778 K779 T831	F771-L775 HydrophobicContact CD1-CD1 3.82Å; F771-L775 HydrophobicContact CD1-CG 4.16Å; F771-L775 HydrophobicContact CE1-CD1 3.48Å; F771-L775 VanDerWaalsContact CE1-CD1 3.48Å; F771-L775 HydrophobicContact CE1-CD2 4.26Å; F771-L775 HydrophobicContact CE1-CG 3.71Å; F771-L775 HydrophobicContact CZ-CD1 4.18Å; F771-L775 HydrophobicContact CZ-CD2 4.17Å; F771-L775 HydrophobicContact CZ-CG 3.91Å; F771-L775 PolarHBondContact O-N 2.8Å; Q772-L775 CarbonylContact O-C 3.52Å; Q772-L775 PolarHBondContact O-N 3.39Å; L775-L778 PolarHBondContact O-N 3.09Å; L775-K779 WeakPolarHBondContact O-CB 3.44Å; L775-K779 PolarHBondContact O-N 3.26Å; L775-T831 HydrophobicContact CD1-CG2 3.56Å
776	H	43.1	Very low	37.7	Very low	105 Å²	105	90.6 Å²	90.6	49%	0.486	46%	0.456	S	S	.	.	H	α-helix	trans	-71.5	-39.4	178.1	-166.4	35.7	0	0	0	110.6	Q772 D773 K779 N780	Q772-H776 WeakPolarHBondContact O-CB 3.45Å; Q772-H776 PolarHBondContact O-N 3.28Å; D773-H776 PolarHBondContact O-N 2.73Å; H776-K779 PolarHBondContact O-N 3.2Å; H776-N780 PolarHBondContact CE1-ND2 2.89Å; H776-N780 PolarHBondContact CE1-OD1 3.43Å; H776-N780 PolarHBondContact ND1-ND2 3.35Å; H776-N780 PolarHBondContact ND1-OD1 3.38Å; H776-N780 VanDerWaalsContact ND1-OD1 3.17Å; H776-N780 PolarHBondContact NE2-ND2 3.16Å; H776-N780 VanDerWaalsContact O-CB 3.23Å; H776-N780 WeakPolarHBondContact O-CB 3.14Å; H776-N780 PolarHBondContact O-N 3.1Å; H776-N780 PolarHBondContact O-ND2 3.35Å; H776-N780 PolarHBondContact O-OD1 3.24Å
777	V	40.6	Very low	37.7	Very low	49 Å²	49	91 Å²	91	30%	0.297	45%	0.45	S	S	.	.	H	α-helix	trans	-58.2	-52.1	168.5	171.3	0	0	0	0	110.7	D773 K779 N780 I781	D773-V777 VanDerWaalsContact O-CG2 3.31Å; D773-V777 WeakPolarHBondContact O-CG2 3.39Å; D773-V777 PolarHBondContact O-N 2.93Å; V777-K779 VanDerWaalsContact C-N 3.26Å; V777-K779 PolarHBondContact O-N 3.13Å; V777-N780 PolarHBondContact O-N 2.79Å; V777-I781 HydrophobicContact CG1-CD1 4.17Å; V777-I781 VanDerWaalsContact O-CG1 3.31Å; V777-I781 WeakPolarHBondContact O-CG1 3.19Å; V777-I781 PolarHBondContact O-N 2.9Å
778	L	38.9	Very low	37.5	Very low	52 Å²	52	90.9 Å²	90.9	27%	0.272	45%	0.446	S	S	.	.	H	α-helix	trans	-63.1	-29.9	177.9	-70.7	169	0	0	0	113.3	V774 L775 L805	V774-L778 HydrophobicContact CG1-CD1 4.18Å; V774-L778 WeakPolarHBondContact O-CB 3.39Å; V774-L778 WeakPolarHBondContact O-CG 3.49Å; V774-L778 PolarHBondContact O-N 3.36Å; L775-L778 PolarHBondContact O-N 3.09Å; L778-L805 HydrophobicContact CD2-CD2 4.21Å
779	K	37.2	Very low	37.5	Very low	152 Å²	152	96 Å²	96	66%	0.661	46%	0.464	S	S	*	.	H	α-helix	trans	-78.8	-38	177.2	-169.2	178.2	-178.2	-172.3	0	111.8	L775 H776 V777 I781 N782	L775-K779 WeakPolarHBondContact O-CB 3.44Å; L775-K779 PolarHBondContact O-N 3.26Å; H776-K779 PolarHBondContact O-N 3.2Å; V777-K779 VanDerWaalsContact C-N 3.26Å; V777-K779 PolarHBondContact O-N 3.13Å; K779-I781 VanDerWaalsContact C-N 3.32Å; K779-N782 WeakPolarHBondContact O-CB 3.28Å; K779-N782 PolarHBondContact O-N 3.34Å
780	N	37.2	Very low	37.2	Very low	86 Å²	86	102.6 Å²	102.6	46%	0.46	49%	0.486	S	S	.	.	H	α-helix	trans	-77	-18.3	178.6	-65	-7.5	0	0	0	112.7	H776 V777 N782	H776-N780 PolarHBondContact CE1-ND2 2.89Å; H776-N780 PolarHBondContact CE1-OD1 3.43Å; H776-N780 PolarHBondContact ND1-ND2 3.35Å; H776-N780 PolarHBondContact ND1-OD1 3.38Å; H776-N780 VanDerWaalsContact ND1-OD1 3.17Å; H776-N780 PolarHBondContact NE2-ND2 3.16Å; H776-N780 VanDerWaalsContact O-CB 3.23Å; H776-N780 WeakPolarHBondContact O-CB 3.14Å; H776-N780 PolarHBondContact O-N 3.1Å; H776-N780 PolarHBondContact O-ND2 3.35Å; H776-N780 PolarHBondContact O-OD1 3.24Å; V777-N780 PolarHBondContact O-N 2.79Å; N780-N782 PolarHBondContact O-N 3.1Å
781	I	38.4	Very low	36.6	Very low	57 Å²	57	99.2 Å²	99.2	29%	0.292	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-23.5	165.7	-78.2	167.3	0	0	0	111.9	V777 K779 L783 L800	V777-I781 HydrophobicContact CG1-CD1 4.17Å; V777-I781 VanDerWaalsContact O-CG1 3.31Å; V777-I781 WeakPolarHBondContact O-CG1 3.19Å; V777-I781 PolarHBondContact O-N 2.9Å; K779-I781 VanDerWaalsContact C-N 3.32Å; I781-L783 VanDerWaalsContact C-N 3.25Å; I781-L783 PolarHBondContact O-N 2.94Å; I781-L800 HydrophobicContact CG2-CB 3.94Å; I781-L800 HydrophobicContact CG2-CD1 4.21Å; I781-L800 HydrophobicContact CG2-CD2 3.8Å; I781-L800 HydrophobicContact CG2-CG 4.19Å
782	N	35.4	Very low	36.6	Very low	84 Å²	84	105.7 Å²	105.7	45%	0.449	51%	0.512	S	S	.	.	S	Bend	trans	-76.6	79.2	166.2	-64.9	-72.9	0	0	0	110.1	K779 N780 H801	K779-N782 WeakPolarHBondContact O-CB 3.28Å; K779-N782 PolarHBondContact O-N 3.34Å; N780-N782 PolarHBondContact O-N 3.1Å; N782-H801 PolarHBondContact OD1-CE1 3.4Å; N782-H801 PolarHBondContact OD1-ND1 3.1Å
783	L	36.3	Very low	36.3	Very low	93 Å²	93	104.5 Å²	104.5	49%	0.487	51%	0.508	S	S	.	.			trans	-52.2	136.1	174.7	-77	162.8	0	0	0	111.1	I781 Y787	I781-L783 VanDerWaalsContact C-N 3.25Å; I781-L783 PolarHBondContact O-N 2.94Å; L783-Y787 HydrophobicContact CD2-CG 4.34Å
784	P	34.6	Very low	36.1	Very low	88 Å²	88	105.7 Å²	105.7	57%	0.571	52%	0.52	S	S	*	.			trans	-61.8	143.2	172.9	26.3	-33.1	0	0	0	110	Y786 Y787	P784-Y786 PolarHBondContact O-N 2.82Å; P784-Y787 HydrophobicContact CG-CD2 4.42Å; P784-Y787 PolarHBondContact O-N 3.13Å
785	K	33.9	Very low	35.7	Very low	190 Å²	190	104.4 Å²	104.4	83%	0.826	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.6	-26.2	-170.9	-74.1	-174.3	173.3	-174	0	115.8	Y787 V788	K785-Y787 VanDerWaalsContact C-N 3.34Å; K785-Y787 PolarHBondContact O-N 3.36Å; K785-V788 WeakPolarHBondContact O-CB 3.32Å; K785-V788 PolarHBondContact O-N 3.02Å
786	Y	32.2	Very low	35.6	Very low	206 Å²	206	103.9 Å²	103.9	81%	0.808	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-28.9	179.1	-122.1	-90.1	0	0	0	114.3	P784	P784-Y786 PolarHBondContact O-N 2.82Å
787	Y	30	Very low	35.4	Very low	126 Å²	126	101 Å²	101	49%	0.494	50%	0.502	S	S	.	.	G	3₁₀ helix	trans	-78.6	-20.7	178	-94.7	-86	0	0	0	113.6	L783 P784 K785 I789 R790	L783-Y787 HydrophobicContact CD2-CG 4.34Å; P784-Y787 HydrophobicContact CG-CD2 4.42Å; P784-Y787 PolarHBondContact O-N 3.13Å; K785-Y787 VanDerWaalsContact C-N 3.34Å; K785-Y787 PolarHBondContact O-N 3.36Å; Y787-I789 PolarHBondContact O-N 2.94Å; Y787-R790 PolarHBondContact O-N 3.33Å
788	V	30.1	Very low	35.3	Very low	70 Å²	70	101.9 Å²	101.9	42%	0.424	50%	0.504	S	S	.	.	G	3₁₀ helix	trans	-64.2	-22.8	-177.9	-178.3	0	0	0	0	112.4	K785 V797	K785-V788 WeakPolarHBondContact O-CB 3.32Å; K785-V788 PolarHBondContact O-N 3.02Å; V788-V797 HydrophobicContact CG1-CG2 4.49Å
789	I	32.3	Very low	35.3	Very low	141 Å²	141	100 Å²	100	72%	0.723	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-80.7	-13.7	-175.4	-58.9	173.6	0	0	0	112.4	Y787	Y787-I789 PolarHBondContact O-N 2.94Å
790	R	28.8	Very low	35.4	Very low	230 Å²	230	95.2 Å²	95.2	87%	0.868	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-125.4	19.6	-172.2	-76.6	-173.6	170.4	-179	-3.3	115.7	Y787	Y787-R790 PolarHBondContact O-N 3.33Å
791	S	28.7	Very low	35.5	Very low	51 Å²	51	96 Å²	96	36%	0.357	48%	0.478	S	S	.	.	S	Bend	trans	-141.1	94.8	172.2	60	0	0	0	0	113
792	I	41.7	Very low	35.7	Very low	155 Å²	155	94.8 Å²	94.8	80%	0.795	48%	0.475	S	S	*	.	S	Bend	trans	21.4	105.6	145.6	-40	177.7	0	0	0	116
793	L	34.5	Very low	36	Very low	78 Å²	78	95.6 Å²	95.6	41%	0.408	48%	0.484	S	S	.	.			trans	77.8	116.6	166	-67.2	155.6	0	0	0	119.1	E679 S795 T796	E679-L793 WeakPolarHBondContact OE1-CD1 3.37Å; E679-L793 WeakPolarHBondContact OE1-CD2 3.41Å; E679-L793 WeakPolarHBondContact OE2-CD1 3.45Å; L793-S795 VanDerWaalsContact C-N 3.28Å; L793-S795 PolarHBondContact O-N 2.81Å; L793-T796 PolarHBondContact O-OG1 3.04Å; L793-T796 VanDerWaalsContact O-OG1 3.12Å
794	P	40.3	Very low	36.2	Very low	98 Å²	98	95.2 Å²	95.2	64%	0.636	48%	0.482	S	S	*	.	H	α-helix	trans	-62.4	-21.1	176.8	-25.4	35	0	0	0	116.6	T796 V797 M798	P794-T796 VanDerWaalsContact C-N 3.34Å; P794-T796 PolarHBondContact O-N 3.1Å; P794-V797 WeakPolarHBondContact O-CB 3.45Å; P794-V797 PolarHBondContact O-N 3.39Å; P794-V797 VanDerWaalsContact O-N 3.16Å; P794-M798 PolarHBondContact O-N 3.25Å; P794-M798 VanDerWaalsContact O-N 3.16Å
795	S	36.1	Very low	36.6	Very low	17 Å²	17	93.5 Å²	93.5	12%	0.119	47%	0.468	C	S	.	.	H	α-helix	trans	-58.7	-44	179.2	44.2	0	0	0	0	112	L793 V797 M798 A799	L793-S795 VanDerWaalsContact C-N 3.28Å; L793-S795 PolarHBondContact O-N 2.81Å; S795-V797 PolarHBondContact O-N 2.89Å; S795-M798 PolarHBondContact O-N 3.15Å; S795-M798 VanDerWaalsContact O-N 3.15Å; S795-A799 WeakPolarHBondContact O-CB 3.38Å; S795-A799 PolarHBondContact O-N 3.03Å
796	T	37.9	Very low	37	Very low	54 Å²	54	85.2 Å²	85.2	33%	0.331	44%	0.436	S	S	.	.	H	α-helix	trans	-61	-30.4	176.8	-16.4	0	0	0	0	112.9	A675 L793 P794 L800	A675-T796 HydrophobicContact CB-CG2 4.29Å; L793-T796 PolarHBondContact O-OG1 3.04Å; L793-T796 VanDerWaalsContact O-OG1 3.12Å; P794-T796 VanDerWaalsContact C-N 3.34Å; P794-T796 PolarHBondContact O-N 3.1Å; T796-L800 WeakPolarHBondContact O-CG 3.35Å; T796-L800 PolarHBondContact O-N 2.98Å
797	V	39	Very low	37.4	Very low	45 Å²	45	77.9 Å²	77.9	27%	0.273	41%	0.408	S	S	.	.	H	α-helix	trans	-76.9	-38	177.1	178.1	0	0	0	0	111	V788 P794 S795 H801	V788-V797 HydrophobicContact CG1-CG2 4.49Å; P794-V797 WeakPolarHBondContact O-CB 3.45Å; P794-V797 PolarHBondContact O-N 3.39Å; P794-V797 VanDerWaalsContact O-N 3.16Å; S795-V797 PolarHBondContact O-N 2.89Å; V797-H801 WeakPolarHBondContact O-CB 3.47Å; V797-H801 PolarHBondContact O-CD2 3.26Å; V797-H801 VanDerWaalsContact O-CD2 3.26Å; V797-H801 PolarHBondContact O-N 3.47Å; V797-H801 VanDerWaalsContact O-N 3.14Å
798	M	37.2	Very low	38.1	Very low	67 Å²	67	75.6 Å²	75.6	33%	0.33	40%	0.399	S	S	.	.	H	α-helix	trans	-66	-39.4	172.9	-68.8	-174.7	68.8	0	0	112.4	F720 L724 P794 S795 H801 S802	F720-M798 HydrophobicContact CE1-SD 3.99Å; L724-M798 HydrophobicContact CD1-CE 3.81Å; L724-M798 HydrophobicContact CD2-CE 3.66Å; L724-M798 HydrophobicContact CG-CE 3.85Å; P794-M798 PolarHBondContact O-N 3.25Å; P794-M798 VanDerWaalsContact O-N 3.16Å; S795-M798 PolarHBondContact O-N 3.15Å; S795-M798 VanDerWaalsContact O-N 3.15Å; M798-H801 PolarHBondContact O-N 3.39Å; M798-S802 PolarHBondContact O-N 3.27Å
799	A	40.4	Very low	38.8	Very low	12 Å²	12	73.1 Å²	73.1	10%	0.099	38%	0.384	C	S	.	.	H	α-helix	trans	-54.8	-52.5	175.2	0	0	0	0	0	112.2	W674 S795 H801 S802	W674-A799 HydrophobicContact CE3-CB 3.84Å; W674-A799 HydrophobicContact CH2-CB 3.99Å; W674-A799 HydrophobicContact CZ3-CB 3.27Å; S795-A799 WeakPolarHBondContact O-CB 3.38Å; S795-A799 PolarHBondContact O-N 3.03Å; A799-H801 VanDerWaalsContact C-N 3.35Å; A799-H801 PolarHBondContact O-N 3.18Å; A799-S802 VanDerWaalsContact O-CB 3.28Å; A799-S802 WeakPolarHBondContact O-CB 3.45Å; A799-S802 PolarHBondContact O-N 3.06Å
800	L	37.6	Very low	39.4	Very low	52 Å²	52	67.6 Å²	67.6	27%	0.272	36%	0.356	S	S	.	.	H	α-helix	trans	-75.3	-20.9	-177.7	-64.6	170.1	0	0	0	113.6	L671 I781 T796	L671-L800 HydrophobicContact CD1-CD2 4.08Å; I781-L800 HydrophobicContact CG2-CB 3.94Å; I781-L800 HydrophobicContact CG2-CD1 4.21Å; I781-L800 HydrophobicContact CG2-CD2 3.8Å; I781-L800 HydrophobicContact CG2-CG 4.19Å; T796-L800 WeakPolarHBondContact O-CG 3.35Å; T796-L800 PolarHBondContact O-N 2.98Å
801	H	40.1	Very low	40.1	Very low	102 Å²	102	60.9 Å²	60.9	47%	0.472	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	8.1	172.2	-68.3	-36.6	0	0	0	114.1	N782 V797 M798 A799	N782-H801 PolarHBondContact OD1-CE1 3.4Å; N782-H801 PolarHBondContact OD1-ND1 3.1Å; V797-H801 WeakPolarHBondContact O-CB 3.47Å; V797-H801 PolarHBondContact O-CD2 3.26Å; V797-H801 VanDerWaalsContact O-CD2 3.26Å; V797-H801 PolarHBondContact O-N 3.47Å; V797-H801 VanDerWaalsContact O-N 3.14Å; M798-H801 PolarHBondContact O-N 3.39Å; A799-H801 VanDerWaalsContact C-N 3.35Å; A799-H801 PolarHBondContact O-N 3.18Å
802	S	42.7	Very low	40.8	Very low	32 Å²	32	59.3 Å²	59.3	22%	0.224	32%	0.318	C	S	.	.			trans	-63.8	124.1	178.7	179.8	0	0	0	0	112.1	M798 A799 L804 L805	M798-S802 PolarHBondContact O-N 3.27Å; A799-S802 VanDerWaalsContact O-CB 3.28Å; A799-S802 WeakPolarHBondContact O-CB 3.45Å; A799-S802 PolarHBondContact O-N 3.06Å; S802-L804 PolarHBondContact O-N 3.05Å; S802-L804 VanDerWaalsContact O-N 3.15Å; S802-L804 PolarHBondContact OG-N 3.47Å; S802-L805 PolarHBondContact O-N 2.88Å
803	P	41.8	Very low	40.9	Very low	101 Å²	101	53.1 Å²	53.1	66%	0.656	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-18.1	178.4	27.2	-34.5	0	0	0	113.1	L805	P803-L805 VanDerWaalsContact C-N 3.34Å; P803-L805 PolarHBondContact O-N 3.11Å
804	L	39.6	Very low	41.4	Very low	84 Å²	84	51.3 Å²	51.3	44%	0.44	28%	0.276	S	S	.	.	H	α-helix	trans	-73.7	-21.3	180	-63.8	171	0	0	0	113.2	S802 G806 Y807 Y808	S802-L804 PolarHBondContact O-N 3.05Å; S802-L804 VanDerWaalsContact O-N 3.15Å; S802-L804 PolarHBondContact OG-N 3.47Å; L804-G806 VanDerWaalsContact C-N 3.29Å; L804-G806 PolarHBondContact O-N 2.84Å; L804-Y807 WeakPolarHBondContact O-CB 3.41Å; L804-Y807 PolarHBondContact O-N 3.41Å; L804-Y807 VanDerWaalsContact O-N 3.11Å; L804-Y808 HydrophobicContact CB-CD2 4.46Å; L804-Y808 HydrophobicContact CB-CE2 4.06Å; L804-Y808 WeakPolarHBondContact O-CD2 3.45Å; L804-Y808 PolarHBondContact O-N 2.98Å
805	L	44.4	Very low	41.4	Very low	53 Å²	53	54.6 Å²	54.6	28%	0.277	28%	0.276	S	S	.	.	H	α-helix	trans	-60.8	-40	-179	-172	66	0	0	0	111.5	L778 S802 P803 Y807 Y808 C809	L778-L805 HydrophobicContact CD2-CD2 4.21Å; S802-L805 PolarHBondContact O-N 2.88Å; P803-L805 VanDerWaalsContact C-N 3.34Å; P803-L805 PolarHBondContact O-N 3.11Å; L805-Y807 PolarHBondContact O-N 2.95Å; L805-Y808 PolarHBondContact O-N 3.26Å; L805-C809 PolarHBondContact O-N 3.15Å; L805-C809 VanDerWaalsContact O-N 3.1Å; L805-C809 PolarHBondContact O-SG 3.14Å; L805-C809 VanDerWaalsContact O-SG 3.34Å
806	G	41.8	Very low	41.7	Very low	15 Å²	15	55.6 Å²	55.6	16%	0.155	29%	0.285	C	S	.	.	H	α-helix	trans	-66.6	-33.3	175.8	0	0	0	0	0	113.8	L804 L810	L804-G806 VanDerWaalsContact C-N 3.29Å; L804-G806 PolarHBondContact O-N 2.84Å; G806-L810 WeakPolarHBondContact O-CB 3.3Å; G806-L810 PolarHBondContact O-N 3.03Å
807	Y	40.9	Very low	41.6	Very low	53 Å²	53	54 Å²	54	21%	0.208	28%	0.28	C	S	.	.	H	α-helix	trans	-63	-47.4	174.7	171.5	-95.7	0	0	0	111.3	L804 L805 L810 R811 I843	L804-Y807 WeakPolarHBondContact O-CB 3.41Å; L804-Y807 PolarHBondContact O-N 3.41Å; L804-Y807 VanDerWaalsContact O-N 3.11Å; L805-Y807 PolarHBondContact O-N 2.95Å; Y807-L810 PolarHBondContact O-N 2.89Å; Y807-R811 WeakPolarHBondContact O-CB 3.36Å; Y807-R811 PolarHBondContact O-N 3.22Å; Y807-R811 PolarHBondContact OH-NH1 3.25Å; Y807-I843 HydrophobicContact CD2-CG1 4.27Å
808	Y	44.5	Very low	41.8	Very low	78 Å²	78	51.9 Å²	51.9	31%	0.306	27%	0.267	S	S	.	.	H	α-helix	trans	-65.1	-47.1	178.6	-67.4	-62.3	0	0	0	111.9	V737 L804 L805 L810 R811 I812	V737-Y808 HydrophobicContact CG1-CD1 3.87Å; V737-Y808 HydrophobicContact CG1-CD2 4.41Å; V737-Y808 HydrophobicContact CG1-CE1 3.31Å; V737-Y808 HydrophobicContact CG1-CE2 3.91Å; V737-Y808 HydrophobicContact CG1-CG 4.4Å; L804-Y808 HydrophobicContact CB-CD2 4.46Å; L804-Y808 HydrophobicContact CB-CE2 4.06Å; L804-Y808 WeakPolarHBondContact O-CD2 3.45Å; L804-Y808 PolarHBondContact O-N 2.98Å; L805-Y808 PolarHBondContact O-N 3.26Å; Y808-L810 VanDerWaalsContact C-N 3.34Å; Y808-L810 PolarHBondContact O-N 3.11Å; Y808-R811 PolarHBondContact O-N 2.95Å; Y808-I812 WeakPolarHBondContact O-CB 3.47Å; Y808-I812 VanDerWaalsContact O-CD1 3.22Å; Y808-I812 WeakPolarHBondContact O-CD1 3.35Å; Y808-I812 WeakPolarHBondContact O-CG1 3.44Å; Y808-I812 PolarHBondContact O-N 3.48Å
809	C	45.1	Very low	42	Very low	18 Å²	18	49.9 Å²	49.9	12%	0.122	26%	0.256	C	S	.	.	H	α-helix	trans	-55.4	-46.2	176	-69.2	0	0	0	0	112.4	L805 R811 I812 L813	L805-C809 PolarHBondContact O-N 3.15Å; L805-C809 VanDerWaalsContact O-N 3.1Å; L805-C809 PolarHBondContact O-SG 3.14Å; L805-C809 VanDerWaalsContact O-SG 3.34Å; C809-R811 PolarHBondContact O-N 3.4Å; C809-I812 PolarHBondContact O-N 2.86Å; C809-L813 WeakPolarHBondContact O-CB 3.43Å; C809-L813 VanDerWaalsContact O-CD1 3.32Å; C809-L813 WeakPolarHBondContact O-CD1 3.48Å; C809-L813 WeakPolarHBondContact O-CG 3.38Å; C809-L813 PolarHBondContact O-N 2.95Å
810	L	45.1	Very low	42	Very low	25 Å²	25	51.2 Å²	51.2	13%	0.131	26%	0.264	C	S	.	.	H	α-helix	trans	-63.3	-41	177.5	-90.8	159.7	0	0	0	112.9	G806 Y807 Y808 I812 L813 H814 F819 Y836 I843	G806-L810 WeakPolarHBondContact O-CB 3.3Å; G806-L810 PolarHBondContact O-N 3.03Å; Y807-L810 PolarHBondContact O-N 2.89Å; Y808-L810 VanDerWaalsContact C-N 3.34Å; Y808-L810 PolarHBondContact O-N 3.11Å; L810-I812 VanDerWaalsContact C-N 3.32Å; L810-I812 PolarHBondContact O-N 3.18Å; L810-L813 PolarHBondContact O-N 3.22Å; L810-H814 WeakPolarHBondContact O-CB 3.21Å; L810-H814 PolarHBondContact O-N 3.04Å; L810-F819 HydrophobicContact CD2-CZ 3.97Å; L810-Y836 HydrophobicContact CD1-CE2 4.39Å; L810-Y836 HydrophobicContact CD2-CE2 4.39Å; L810-I843 HydrophobicContact CD1-CD1 3.83Å; L810-I843 HydrophobicContact CD1-CG2 4.35Å
811	R	42.5	Very low	42	Very low	88 Å²	88	55 Å²	55	33%	0.332	28%	0.281	S	S	.	.	H	α-helix	trans	-69	-32.1	-179.4	-150.7	174.5	-168.5	-164.3	2	112.5	Y807 Y808 C809 R815	Y807-R811 WeakPolarHBondContact O-CB 3.36Å; Y807-R811 PolarHBondContact O-N 3.22Å; Y807-R811 PolarHBondContact OH-NH1 3.25Å; Y808-R811 PolarHBondContact O-N 2.95Å; C809-R811 PolarHBondContact O-N 3.4Å; R811-R815 PolarHBondContact O-N 3.05Å; R811-R815 VanDerWaalsContact O-N 3.15Å
812	I	43.6	Very low	42	Very low	18 Å²	18	56.5 Å²	56.5	9%	0.092	30%	0.297	C	S	.	.	H	α-helix	trans	-70.6	-49.3	173.3	-69	157.6	0	0	0	110.5	F744 Y808 C809 L810 H814 R815 A816	F744-I812 HydrophobicContact CB-CD1 3.72Å; F744-I812 HydrophobicContact CB-CG1 4.35Å; F744-I812 HydrophobicContact CB-CG2 3.76Å; F744-I812 HydrophobicContact CD1-CG2 4.19Å; F744-I812 HydrophobicContact CD2-CD1 4.39Å; F744-I812 HydrophobicContact CG-CD1 4.09Å; F744-I812 HydrophobicContact CG-CG2 4.3Å; Y808-I812 WeakPolarHBondContact O-CB 3.47Å; Y808-I812 VanDerWaalsContact O-CD1 3.22Å; Y808-I812 WeakPolarHBondContact O-CD1 3.35Å; Y808-I812 WeakPolarHBondContact O-CG1 3.44Å; Y808-I812 PolarHBondContact O-N 3.48Å; C809-I812 PolarHBondContact O-N 2.86Å; L810-I812 VanDerWaalsContact C-N 3.32Å; L810-I812 PolarHBondContact O-N 3.18Å; I812-H814 PolarHBondContact O-N 2.83Å; I812-R815 PolarHBondContact O-N 2.49Å; I812-R815 VanDerWaalsContact O-N 3.09Å; I812-A816 WeakPolarHBondContact O-CB 3.41Å; I812-A816 PolarHBondContact O-N 2.95Å
813	L	44.2	Very low	41.8	Very low	26 Å²	26	55.7 Å²	55.7	14%	0.136	29%	0.291	C	S	.	.	H	α-helix	trans	-59.7	-34.9	176.5	-69.9	160.2	0	0	0	111.9	F771 C809 L810 A816 A818	F771-L813 HydrophobicContact CD2-CD1 4.46Å; F771-L813 HydrophobicContact CE2-CD1 3.46Å; F771-L813 VanDerWaalsContact CE2-CD1 3.46Å; F771-L813 HydrophobicContact CE2-CD2 4.27Å; F771-L813 HydrophobicContact CZ-CD1 3.89Å; C809-L813 WeakPolarHBondContact O-CB 3.43Å; C809-L813 VanDerWaalsContact O-CD1 3.32Å; C809-L813 WeakPolarHBondContact O-CD1 3.48Å; C809-L813 WeakPolarHBondContact O-CG 3.38Å; C809-L813 PolarHBondContact O-N 2.95Å; L810-L813 PolarHBondContact O-N 3.22Å; L813-A816 PolarHBondContact O-N 3.06Å; L813-A818 HydrophobicContact CB-CB 4.31Å; L813-A818 WeakPolarHBondContact O-CB 3.44Å; L813-A818 PolarHBondContact O-N 3.44Å; L813-A818 VanDerWaalsContact O-N 3.09Å
814	H	45.4	Very low	41.5	Very low	39 Å²	39	57.2 Å²	57.2	18%	0.181	29%	0.289	C	S	.	.	H	α-helix	trans	-64.5	-46.6	172.2	-179.3	-92.2	0	0	0	112.7	L810 I812 A816 G817 F819 L851	L810-H814 WeakPolarHBondContact O-CB 3.21Å; L810-H814 PolarHBondContact O-N 3.04Å; I812-H814 PolarHBondContact O-N 2.83Å; H814-A816 VanDerWaalsContact C-N 3.26Å; H814-A816 PolarHBondContact O-N 2.97Å; H814-G817 PolarHBondContact O-N 3.36Å; H814-G817 VanDerWaalsContact O-N 3.15Å; H814-F819 HydrophobicContact CB-CD2 3.98Å; H814-F819 HydrophobicContact CB-CE2 4.01Å; H814-F819 AromaticContact CD2-CD2 3.89Å; H814-L851 VanDerWaalsContact NE2-CD2 3.26Å; H814-L851 WeakPolarHBondContact NE2-CD2 3.46Å
815	R	40.2	Very low	41.4	Very low	168 Å²	168	53.4 Å²	53.4	63%	0.634	27%	0.271	S	S	*	.	H	α-helix	trans	-63.8	-30.3	174.4	-77.6	-174.3	169.6	-168.2	-5.2	113.1	R811 I812 G817	R811-R815 PolarHBondContact O-N 3.05Å; R811-R815 VanDerWaalsContact O-N 3.15Å; I812-R815 PolarHBondContact O-N 2.49Å; I812-R815 VanDerWaalsContact O-N 3.09Å; R815-G817 PolarHBondContact O-N 3.39Å
816	A	41.7	Very low	41	Very low	37 Å²	37	51.8 Å²	51.8	31%	0.306	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	0.4	174.5	0	0	0	0	0	115.1	V748 I812 L813 H814 A818	V748-A816 HydrophobicContact CB-CB 4.23Å; V748-A816 HydrophobicContact CG1-CB 3.3Å; I812-A816 WeakPolarHBondContact O-CB 3.41Å; I812-A816 PolarHBondContact O-N 2.95Å; L813-A816 PolarHBondContact O-N 3.06Å; H814-A816 VanDerWaalsContact C-N 3.26Å; H814-A816 PolarHBondContact O-N 2.97Å; A816-A818 VanDerWaalsContact C-N 3.32Å; A816-A818 PolarHBondContact O-N 2.78Å
817	G	36.5	Very low	40.8	Very low	22 Å²	22	51.3 Å²	51.3	23%	0.227	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	14.1	-178.6	0	0	0	0	0	114.3	H814 R815 F819 S820 T823	H814-G817 PolarHBondContact O-N 3.36Å; H814-G817 VanDerWaalsContact O-N 3.15Å; R815-G817 PolarHBondContact O-N 3.39Å; G817-F819 PolarHBondContact O-N 2.77Å; G817-S820 PolarHBondContact O-N 2.95Å; G817-S820 PolarHBondContact O-OG 3.27Å; G817-T823 WeakPolarHBondContact O-CG2 3.38Å; G817-T823 PolarHBondContact O-OG1 3.47Å
818	A	43.4	Very low	40.5	Very low	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-9	-178	0	0	0	0	0	114.4	W755 L813 A816 T823 V827	W755-A818 HydrophobicContact CH2-CB 3.75Å; W755-A818 HydrophobicContact CZ2-CB 3.56Å; L813-A818 HydrophobicContact CB-CB 4.31Å; L813-A818 WeakPolarHBondContact O-CB 3.44Å; L813-A818 PolarHBondContact O-N 3.44Å; L813-A818 VanDerWaalsContact O-N 3.09Å; A816-A818 VanDerWaalsContact C-N 3.32Å; A816-A818 PolarHBondContact O-N 2.78Å; A818-T823 PolarHBondContact O-OG1 3.37Å; A818-V827 HydrophobicContact CB-CG2 3.68Å
819	F	41.2	Very low	40.2	Very low	25 Å²	25	51.6 Å²	51.6	11%	0.11	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.9	13.8	174.6	-50.9	-71.1	0	0	0	113.5	L810 H814 G817 V827 L828 I861	L810-F819 HydrophobicContact CD2-CZ 3.97Å; H814-F819 HydrophobicContact CB-CD2 3.98Å; H814-F819 HydrophobicContact CB-CE2 4.01Å; H814-F819 AromaticContact CD2-CD2 3.89Å; G817-F819 PolarHBondContact O-N 2.77Å; F819-V827 HydrophobicContact CD1-CB 4.49Å; F819-V827 HydrophobicContact CE1-CB 3.87Å; F819-V827 HydrophobicContact CE1-CG1 3.77Å; F819-V827 HydrophobicContact CE1-CG2 4.46Å; F819-V827 HydrophobicContact CZ-CB 4.48Å; F819-V827 HydrophobicContact CZ-CG1 4.08Å; F819-L828 HydrophobicContact CD1-CD1 4.43Å; F819-L828 HydrophobicContact CE1-CG 4.46Å; F819-I861 HydrophobicContact CB-CD1 3.9Å
820	S	40.4	Very low	39.8	Very low	39 Å²	39	53 Å²	53	27%	0.273	27%	0.272	S	S	.	.	S	Bend	trans	-77.8	161	177.3	63.1	0	0	0	0	112.1	G817 T822 T823	G817-S820 PolarHBondContact O-N 2.95Å; G817-S820 PolarHBondContact O-OG 3.27Å; S820-T822 PolarHBondContact O-N 3.47Å; S820-T822 PolarHBondContact OG-OG1 3.35Å; S820-T823 PolarHBondContact O-N 2.96Å; S820-T823 PolarHBondContact O-OG1 3.01Å; S820-T823 VanDerWaalsContact O-OG1 3.08Å
821	Q	37	Very low	39.3	Very low	132 Å²	132	53.1 Å²	53.1	62%	0.617	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-59.6	-30.3	176.5	-149.9	174.5	19.4	0	0	112	T823 E824 G857	Q821-T823 PolarHBondContact O-N 3.15Å; Q821-E824 PolarHBondContact O-N 3.05Å; Q821-G857 PolarHBondContact OE1-O 3.25Å
822	T	39.3	Very low	39.2	Very low	133 Å²	133	56 Å²	56	82%	0.816	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-70.2	-6.4	174.5	46.8	0	0	0	0	115.4	S820	S820-T822 PolarHBondContact O-N 3.47Å; S820-T822 PolarHBondContact OG-OG1 3.35Å
823	T	38.6	Very low	38.7	Very low	16 Å²	16	57.9 Å²	57.9	10%	0.098	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-120.5	10.1	176.7	65.9	0	0	0	0	113.3	W755 G817 A818 S820 Q821 G825 G826	W755-T823 HydrophobicContact CB-CG2 4.31Å; W755-T823 HydrophobicContact CD2-CG2 4.46Å; W755-T823 HydrophobicContact CG-CG2 3.8Å; G817-T823 WeakPolarHBondContact O-CG2 3.38Å; G817-T823 PolarHBondContact O-OG1 3.47Å; A818-T823 PolarHBondContact O-OG1 3.37Å; S820-T823 PolarHBondContact O-N 2.96Å; S820-T823 PolarHBondContact O-OG1 3.01Å; S820-T823 VanDerWaalsContact O-OG1 3.08Å; Q821-T823 PolarHBondContact O-N 3.15Å; T823-G825 PolarHBondContact O-N 3.21Å; T823-G826 PolarHBondContact O-N 3.06Å
824	E	36.9	Very low	38.2	Very low	132 Å²	132	62.7 Å²	62.7	62%	0.617	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	15.8	-171.9	-64	-162.9	161.7	0	0	114.9	Q821 G826	Q821-E824 PolarHBondContact O-N 3.05Å; E824-G826 VanDerWaalsContact C-N 3.31Å
825	G	35.7	Very low	37.7	Very low	5 Å²	5	63.1 Å²	63.1	5%	0.052	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.1	30.9	-170.8	0	0	0	0	0	114	T823 V827 L828	T823-G825 PolarHBondContact O-N 3.21Å; G825-V827 PolarHBondContact O-N 3Å; G825-L828 PolarHBondContact O-N 2.8Å
826	G	36.4	Very low	37.5	Very low	18 Å²	18	58.6 Å²	58.6	19%	0.186	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-22.7	-170.6	0	0	0	0	0	116.6	T823 E824 L828 H829 Q830	T823-G826 PolarHBondContact O-N 3.06Å; E824-G826 VanDerWaalsContact C-N 3.31Å; G826-L828 VanDerWaalsContact C-N 3.26Å; G826-L828 PolarHBondContact O-N 2.78Å; G826-H829 PolarHBondContact O-N 3.17Å; G826-Q830 PolarHBondContact O-N 2.61Å
827	V	37.5	Very low	37.1	Very low	5 Å²	5	60.5 Å²	60.5	3%	0.03	33%	0.334	C	S	.	.	H	α-helix	trans	-53.8	-42.3	168.7	172.2	0	0	0	0	111.9	W755 F771 A818 F819 G825 H829 Q830 T831	W755-V827 HydrophobicContact CH2-CG2 3.73Å; W755-V827 HydrophobicContact CZ3-CG2 3.73Å; F771-V827 HydrophobicContact CD1-CG1 3.78Å; F771-V827 HydrophobicContact CE1-CG1 3.64Å; F771-V827 HydrophobicContact CG-CG1 4.33Å; F771-V827 HydrophobicContact CG-CG2 4.46Å; F771-V827 HydrophobicContact CZ-CG1 4.12Å; A818-V827 HydrophobicContact CB-CG2 3.68Å; F819-V827 HydrophobicContact CD1-CB 4.49Å; F819-V827 HydrophobicContact CE1-CB 3.87Å; F819-V827 HydrophobicContact CE1-CG1 3.77Å; F819-V827 HydrophobicContact CE1-CG2 4.46Å; F819-V827 HydrophobicContact CZ-CB 4.48Å; F819-V827 HydrophobicContact CZ-CG1 4.08Å; G825-V827 PolarHBondContact O-N 3Å; V827-H829 PolarHBondContact O-N 3.22Å; V827-Q830 PolarHBondContact O-N 2.76Å; V827-T831 WeakPolarHBondContact O-CG2 3.48Å
828	L	35.9	Very low	37.1	Very low	28 Å²	28	68.7 Å²	68.7	15%	0.147	36%	0.364	C	S	.	.	H	α-helix	trans	-76	-20.3	-176.3	-71.3	162.3	0	0	0	113.6	F819 G825 G826 I861 P864	F819-L828 HydrophobicContact CD1-CD1 4.43Å; F819-L828 HydrophobicContact CE1-CG 4.46Å; G825-L828 PolarHBondContact O-N 2.8Å; G826-L828 VanDerWaalsContact C-N 3.26Å; G826-L828 PolarHBondContact O-N 2.78Å; L828-I861 HydrophobicContact CD1-CG2 4.27Å; L828-P864 HydrophobicContact CB-CB 3.91Å; L828-P864 HydrophobicContact CB-CG 4.11Å; L828-P864 HydrophobicContact CD1-CB 3.73Å; L828-P864 HydrophobicContact CD1-CG 3.75Å; L828-P864 HydrophobicContact CG-CB 4.32Å
829	H	36.8	Very low	36.5	Very low	110 Å²	110	73.2 Å²	73.2	51%	0.509	38%	0.383	S	S	.	.	H	α-helix	trans	-80	-27.4	173.3	-97.1	46.3	0	0	0	112.8	G826 V827	G826-H829 PolarHBondContact O-N 3.17Å; V827-H829 PolarHBondContact O-N 3.22Å
830	Q	37	Very low	36.4	Very low	46 Å²	46	72.7 Å²	72.7	22%	0.215	38%	0.382	C	S	.	.	H	α-helix	trans	-91.1	-14.4	-174.7	-67.2	-173.3	1.8	0	0	114.8	Q772 G826 V827	Q772-Q830 HydrophobicContact CG-CB 4.3Å; Q772-Q830 WeakPolarHBondContact CG-O 3.38Å; Q772-Q830 PolarHBondContact NE2-O 2.8Å; G826-Q830 PolarHBondContact O-N 2.61Å; V827-Q830 PolarHBondContact O-N 2.76Å
831	T	36	Very low	36.1	Very low	29 Å²	29	77.3 Å²	77.3	18%	0.178	40%	0.399	C	S	.	.	S	Bend	trans	-89.4	127.1	-178.6	59	0	0	0	0	114.8	F771 L775 V827 L833	F771-T831 HydrophobicContact CD1-CG2 3.66Å; F771-T831 HydrophobicContact CE1-CG2 3.47Å; F771-T831 VanDerWaalsContact CE1-CG2 3.47Å; L775-T831 HydrophobicContact CD1-CG2 3.56Å; V827-T831 WeakPolarHBondContact O-CG2 3.48Å; T831-L833 PolarHBondContact O-N 2.99Å
832	N	39.3	Very low	35.8	Very low	147 Å²	147	78.1 Å²	78.1	79%	0.786	40%	0.403	S	S	*	.			trans	-66.7	123.7	162.2	-87.4	-29.5	0	0	0	110.9	D834 G835	N832-D834 VanDerWaalsContact C-N 3.28Å; N832-D834 PolarHBondContact O-N 3.24Å; N832-G835 PolarHBondContact O-N 3.13Å
833	L	33	Very low	35.6	Very low	59 Å²	59	72.2 Å²	72.2	31%	0.309	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-31.8	-165.4	-90	99	0	0	0	116.7	T831 G835 Y836 L837 T868	T831-L833 PolarHBondContact O-N 2.99Å; L833-G835 PolarHBondContact O-N 2.97Å; L833-Y836 PolarHBondContact O-N 3.33Å; L833-Y836 VanDerWaalsContact O-N 3.13Å; L833-L837 PolarHBondContact O-N 3.24Å; L833-T868 HydrophobicContact CD1-CG2 3.96Å
834	D	35	Very low	35.5	Very low	127 Å²	127	75 Å²	75	68%	0.679	38%	0.38	S	S	*	.	H	α-helix	trans	-64.9	-22.8	-174.2	-85.9	-21.6	0	0	0	113.9	N832	N832-D834 VanDerWaalsContact C-N 3.28Å; N832-D834 PolarHBondContact O-N 3.24Å
835	G	34	Very low	35.4	Very low	47 Å²	47	74.3 Å²	74.3	49%	0.485	37%	0.372	S	S	.	.	H	α-helix	trans	-69.4	-44.5	172.7	0	0	0	0	0	112.2	N832 L833 K838	N832-G835 PolarHBondContact O-N 3.13Å; L833-G835 PolarHBondContact O-N 2.97Å; G835-K838 PolarHBondContact O-N 3.17Å
836	Y	35.8	Very low	35.3	Very low	74 Å²	74	75.5 Å²	75.5	29%	0.29	38%	0.38	S	S	.	.	H	α-helix	trans	-68.9	-44.7	-175.1	-158.4	-126.3	0	0	0	111.4	L810 L833 K838 F839 N840	L810-Y836 HydrophobicContact CD1-CE2 4.39Å; L810-Y836 HydrophobicContact CD2-CE2 4.39Å; L833-Y836 PolarHBondContact O-N 3.33Å; L833-Y836 VanDerWaalsContact O-N 3.13Å; Y836-K838 VanDerWaalsContact C-N 3.26Å; Y836-K838 PolarHBondContact O-N 2.97Å; Y836-F839 PolarHBondContact O-N 3.12Å; Y836-F839 VanDerWaalsContact O-N 3.1Å; Y836-N840 WeakPolarHBondContact CD1-ND2 3.48Å; Y836-N840 WeakPolarHBondContact CE1-ND2 3.26Å; Y836-N840 WeakPolarHBondContact O-CB 3.32Å; Y836-N840 PolarHBondContact O-N 2.96Å; Y836-N840 PolarHBondContact O-ND2 2.81Å; Y836-N840 PolarHBondContact O-OD1 3.05Å
837	L	33.2	Very low	35.2	Very low	76 Å²	76	75.6 Å²	75.6	40%	0.398	38%	0.377	S	S	.	.	H	α-helix	trans	-64.3	-23.1	-179.7	-82.1	165.5	0	0	0	114.7	L833 F923	L833-L837 PolarHBondContact O-N 3.24Å; L837-F923 HydrophobicContact CD2-CD2 4.26Å
838	K	37.5	Very low	35.2	Very low	194 Å²	194	78.4 Å²	78.4	84%	0.843	39%	0.393	S	S	*	.	H	α-helix	trans	-77.9	-25	174.1	-93.8	-179.3	174.8	176.8	0	113.8	G835 Y836	G835-K838 PolarHBondContact O-N 3.17Å; Y836-K838 VanDerWaalsContact C-N 3.26Å; Y836-K838 PolarHBondContact O-N 2.97Å
839	F	30.8	Very low	35.1	Very low	95 Å²	95	84 Å²	84	42%	0.417	41%	0.413	S	S	.	.	H	α-helix	trans	-94	-17	-177.3	-90.8	-84.8	0	0	0	114.2	Y836 H841 I843	Y836-F839 PolarHBondContact O-N 3.12Å; Y836-F839 VanDerWaalsContact O-N 3.1Å; F839-H841 PolarHBondContact O-N 3.15Å; F839-I843 HydrophobicContact CB-CD1 4.27Å; F839-I843 WeakPolarHBondContact O-CD1 3.24Å
840	N	37.5	Very low	35	Very low	14 Å²	14	82.1 Å²	82.1	8%	0.075	40%	0.404	C	S	.	.	H	α-helix	trans	-84.8	0.3	-158.1	-85	-9.9	0	0	0	118.7	Y836 E842 I844	Y836-N840 WeakPolarHBondContact CD1-ND2 3.48Å; Y836-N840 WeakPolarHBondContact CE1-ND2 3.26Å; Y836-N840 WeakPolarHBondContact O-CB 3.32Å; Y836-N840 PolarHBondContact O-N 2.96Å; Y836-N840 PolarHBondContact O-ND2 2.81Å; Y836-N840 PolarHBondContact O-OD1 3.05Å; N840-E842 VanDerWaalsContact C-N 3.27Å; N840-E842 PolarHBondContact O-N 3.49Å; N840-I844 HydrophobicContact CB-CD1 4.15Å; N840-I844 HydrophobicContact CB-CG1 4.29Å; N840-I844 WeakPolarHBondContact O-CD1 3.34Å; N840-I844 WeakPolarHBondContact O-CG1 3.35Å
841	H	34.2	Very low	34.8	Very low	136 Å²	136	81.6 Å²	81.6	63%	0.63	40%	0.402	S	S	*	.	H	α-helix	trans	-68.2	-20.7	-171.1	-107.1	-63.4	0	0	0	115.3	F839	F839-H841 PolarHBondContact O-N 3.15Å
842	E	32	Very low	34.8	Very low	149 Å²	149	84 Å²	84	70%	0.696	41%	0.414	S	S	*	.	H	α-helix	trans	-118.3	-28.6	177.8	-67.1	176.3	158.3	0	0	113.1	N840 I844	N840-E842 VanDerWaalsContact C-N 3.27Å; N840-E842 PolarHBondContact O-N 3.49Å; E842-I844 VanDerWaalsContact C-N 3.35Å; E842-I844 PolarHBondContact O-N 3.45Å
843	I	34.9	Very low	34.7	Very low	10 Å²	10	80.3 Å²	80.3	5%	0.051	40%	0.404	C	S	.	.	H	α-helix	trans	-66.4	-34.6	-171.9	-55.4	-173.3	0	0	0	112.6	Y807 L810 F839 Y845 S846 V847	Y807-I843 HydrophobicContact CD2-CG1 4.27Å; L810-I843 HydrophobicContact CD1-CD1 3.83Å; L810-I843 HydrophobicContact CD1-CG2 4.35Å; F839-I843 HydrophobicContact CB-CD1 4.27Å; F839-I843 WeakPolarHBondContact O-CD1 3.24Å; I843-Y845 VanDerWaalsContact C-N 3.27Å; I843-Y845 PolarHBondContact O-N 3.19Å; I843-S846 PolarHBondContact O-N 3.1Å; I843-S846 PolarHBondContact O-OG 3.05Å; I843-V847 HydrophobicContact CG2-CB 4.38Å; I843-V847 HydrophobicContact CG2-CG2 3.54Å; I843-V847 PolarHBondContact O-N 3.45Å
844	I	36.7	Very low	34.6	Very low	75 Å²	75	87.6 Å²	87.6	39%	0.385	43%	0.427	S	S	.	.	H	α-helix	trans	-53.6	-43.9	-175.6	-68	171.2	0	0	0	111.1	N840 E842 S846 V848	N840-I844 HydrophobicContact CB-CD1 4.15Å; N840-I844 HydrophobicContact CB-CG1 4.29Å; N840-I844 WeakPolarHBondContact O-CD1 3.34Å; N840-I844 WeakPolarHBondContact O-CG1 3.35Å; E842-I844 VanDerWaalsContact C-N 3.35Å; E842-I844 PolarHBondContact O-N 3.45Å; I844-S846 PolarHBondContact O-N 3.49Å; I844-V848 HydrophobicContact CG2-CG2 3.92Å; I844-V848 WeakPolarHBondContact O-CB 3.35Å; I844-V848 WeakPolarHBondContact O-CG2 3.27Å; I844-V848 PolarHBondContact O-N 2.89Å
845	Y	34	Very low	34.1	Very low	117 Å²	117	88.3 Å²	88.3	46%	0.459	43%	0.431	S	S	.	.	H	α-helix	trans	-64.9	-44.6	-175.7	-170.5	-104.3	0	0	0	112.7	I843 R849 T1050	I843-Y845 VanDerWaalsContact C-N 3.27Å; I843-Y845 PolarHBondContact O-N 3.19Å; Y845-R849 PolarHBondContact O-N 3.02Å; Y845-T1050 HydrophobicContact CE2-CG2 4.36Å
846	S	34.7	Very low	33.9	Very low	29 Å²	29	94.2 Å²	94.2	20%	0.203	45%	0.451	C	S	.	.	H	α-helix	trans	-76.4	-35.2	-178.8	62.6	0	0	0	0	113.6	I843 I844 Q850	I843-S846 PolarHBondContact O-N 3.1Å; I843-S846 PolarHBondContact O-OG 3.05Å; I844-S846 PolarHBondContact O-N 3.49Å; S846-Q850 WeakPolarHBondContact O-CB 3.42Å; S846-Q850 WeakPolarHBondContact O-CG 3.42Å; S846-Q850 PolarHBondContact O-N 3.21Å
847	V	33.7	Very low	33.5	Very low	21 Å²	21	91.9 Å²	91.9	13%	0.127	45%	0.45	C	S	.	.	H	α-helix	trans	-78.5	-38.9	-177.9	174.7	0	0	0	0	111	I843 Q850 L851	I843-V847 HydrophobicContact CG2-CB 4.38Å; I843-V847 HydrophobicContact CG2-CG2 3.54Å; I843-V847 PolarHBondContact O-N 3.45Å; V847-Q850 PolarHBondContact O-N 3.05Å; V847-L851 HydrophobicContact CG1-CD1 3.77Å; V847-L851 HydrophobicContact CG1-CG 4.3Å; V847-L851 WeakPolarHBondContact O-CB 3.23Å; V847-L851 WeakPolarHBondContact O-CG 3.39Å; V847-L851 PolarHBondContact O-N 3.37Å
848	V	37.3	Very low	33.3	Very low	63 Å²	63	90.5 Å²	90.5	38%	0.382	45%	0.449	S	S	.	.	H	α-helix	trans	-62	-47.5	173.5	171.4	0	0	0	0	110.3	I844 Q850 L851 L852	I844-V848 HydrophobicContact CG2-CG2 3.92Å; I844-V848 WeakPolarHBondContact O-CB 3.35Å; I844-V848 WeakPolarHBondContact O-CG2 3.27Å; I844-V848 PolarHBondContact O-N 2.89Å; V848-Q850 VanDerWaalsContact C-N 3.3Å; V848-Q850 PolarHBondContact O-N 3.49Å; V848-L851 PolarHBondContact O-N 3.41Å; V848-L852 HydrophobicContact CG1-CD1 3.48Å; V848-L852 VanDerWaalsContact CG1-CD1 3.48Å; V848-L852 HydrophobicContact CG1-CG 4.09Å; V848-L852 WeakPolarHBondContact O-CB 3.43Å; V848-L852 WeakPolarHBondContact O-CG 3.5Å; V848-L852 PolarHBondContact O-N 3.3Å
849	R	33.9	Very low	33	Very low	147 Å²	147	85.4 Å²	85.4	56%	0.555	44%	0.435	S	S	*	.	H	α-helix	trans	-62.4	-33.4	178.3	-130.2	-179.6	-168.3	-165.1	3.5	113.7	Y845 A853	Y845-R849 PolarHBondContact O-N 3.02Å; R849-A853 WeakPolarHBondContact O-CB 3.3Å; R849-A853 PolarHBondContact O-N 3.49Å
850	Q	34	Very low	32.9	Very low	70 Å²	70	82.7 Å²	82.7	33%	0.327	43%	0.433	S	S	.	.	H	α-helix	trans	-80.4	-24.3	177	-72.1	-169.4	-27.1	0	0	113.9	S846 V847 V848	S846-Q850 WeakPolarHBondContact O-CB 3.42Å; S846-Q850 WeakPolarHBondContact O-CG 3.42Å; S846-Q850 PolarHBondContact O-N 3.21Å; V847-Q850 PolarHBondContact O-N 3.05Å; V848-Q850 VanDerWaalsContact C-N 3.3Å; V848-Q850 PolarHBondContact O-N 3.49Å
851	L	33.6	Very low	32.7	Very low	34 Å²	34	83.9 Å²	83.9	18%	0.178	44%	0.439	C	S	.	.	H	α-helix	trans	-79.2	-32	171.9	-78.2	170.5	0	0	0	112.8	H814 V847 V848 I861	H814-L851 VanDerWaalsContact NE2-CD2 3.26Å; H814-L851 WeakPolarHBondContact NE2-CD2 3.46Å; V847-L851 HydrophobicContact CG1-CD1 3.77Å; V847-L851 HydrophobicContact CG1-CG 4.3Å; V847-L851 WeakPolarHBondContact O-CB 3.23Å; V847-L851 WeakPolarHBondContact O-CG 3.39Å; V847-L851 PolarHBondContact O-N 3.37Å; V848-L851 PolarHBondContact O-N 3.41Å; L851-I861 HydrophobicContact CD1-CD1 3.68Å; L851-I861 HydrophobicContact CD2-CD1 3.44Å; L851-I861 VanDerWaalsContact CD2-CD1 3.44Å; L851-I861 HydrophobicContact CG-CD1 4.17Å
852	L	35.9	Very low	32.7	Very low	81 Å²	81	81.1 Å²	81.1	42%	0.424	43%	0.427	S	S	.	.	H	α-helix	trans	-79.9	-20.6	-179.9	-67.7	175	0	0	0	113.8	V848 R854 M1054	V848-L852 HydrophobicContact CG1-CD1 3.48Å; V848-L852 VanDerWaalsContact CG1-CD1 3.48Å; V848-L852 HydrophobicContact CG1-CG 4.09Å; V848-L852 WeakPolarHBondContact O-CB 3.43Å; V848-L852 WeakPolarHBondContact O-CG 3.5Å; V848-L852 PolarHBondContact O-N 3.3Å; L852-R854 PolarHBondContact O-N 3.12Å; L852-M1054 HydrophobicContact CD1-CG 4.34Å; L852-M1054 HydrophobicContact CD1-SD 3.46Å; L852-M1054 WeakPolarHBondContact CD1-SD 3.1Å; L852-M1054 HydrophobicContact CD2-CE 3.67Å; L852-M1054 HydrophobicContact CD2-SD 3.4Å; L852-M1054 WeakPolarHBondContact CD2-SD 3.26Å; L852-M1054 HydrophobicContact CG-SD 4.03Å
853	A	37	Very low	32.7	Very low	69 Å²	69	79.4 Å²	79.4	57%	0.57	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	17.7	179.7	0	0	0	0	0	114.2	R849	R849-A853 WeakPolarHBondContact O-CB 3.3Å; R849-A853 PolarHBondContact O-N 3.49Å
854	R	30.6	Very low	32.5	Very low	211 Å²	211	79.6 Å²	79.6	80%	0.796	42%	0.423	S	S	*	.	S	Bend	trans	-127.1	105.8	172	-88.4	-171.7	165	-174	-5.5	109.9	L852	L852-R854 PolarHBondContact O-N 3.12Å
855	D	26.2	Very low	32.4	Very low	142 Å²	142	81.8 Å²	81.8	76%	0.759	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	146.6	-175.1	-67.7	-43.9	0	0	0	114.3	G857	D855-G857 VanDerWaalsContact C-N 3.31Å; D855-G857 PolarHBondContact O-N 2.98Å
856	N	29.4	Very low	32.3	Very low	171 Å²	171	78.2 Å²	78.2	91%	0.914	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	2	153.5	-56.3	-18	0	0	0	119.8
857	G	25.9	Very low	32.1	Very low	25 Å²	25	78.9 Å²	78.9	26%	0.258	42%	0.422	S	S	.	.			trans	-123.3	-11.4	-179.8	0	0	0	0	0	117.8	Q821 D855 T859	Q821-G857 PolarHBondContact OE1-O 3.25Å; D855-G857 VanDerWaalsContact C-N 3.31Å; D855-G857 PolarHBondContact O-N 2.98Å; G857-T859 PolarHBondContact O-N 3.12Å
858	A	29.7	Very low	32.1	Very low	47 Å²	47	79.5 Å²	79.5	39%	0.388	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-91.7	19.6	-162.8	0	0	0	0	0	116.4	G860	A858-G860 PolarHBondContact O-N 2.82Å; A858-G860 VanDerWaalsContact O-N 3.16Å
859	T	31	Very low	31.8	Very low	88 Å²	88	77.8 Å²	77.8	54%	0.54	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-64.3	-20.5	-178.2	52.4	0	0	0	0	114.1	G857 I861	G857-T859 PolarHBondContact O-N 3.12Å; T859-I861 VanDerWaalsContact C-N 3.3Å; T859-I861 PolarHBondContact O-N 2.99Å
860	G	29.7	Very low	31.6	Very low	37 Å²	37	74.3 Å²	74.3	38%	0.381	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-64.4	-19.9	-177.1	0	0	0	0	0	116.3	A858 P864	A858-G860 PolarHBondContact O-N 2.82Å; A858-G860 VanDerWaalsContact O-N 3.16Å; G860-P864 WeakPolarHBondContact O-CD 3.25Å
861	I	32.7	Very low	31.6	Very low	39 Å²	39	77.2 Å²	77.2	20%	0.2	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-88.5	-18.4	-174.2	-57.6	172.5	0	0	0	112.7	F819 L828 L851 T859 L863 P864	F819-I861 HydrophobicContact CB-CD1 3.9Å; L828-I861 HydrophobicContact CD1-CG2 4.27Å; L851-I861 HydrophobicContact CD1-CD1 3.68Å; L851-I861 HydrophobicContact CD2-CD1 3.44Å; L851-I861 VanDerWaalsContact CD2-CD1 3.44Å; L851-I861 HydrophobicContact CG-CD1 4.17Å; T859-I861 VanDerWaalsContact C-N 3.3Å; T859-I861 PolarHBondContact O-N 2.99Å; I861-L863 VanDerWaalsContact C-N 3.32Å; I861-P864 WeakPolarHBondContact O-CD 3.39Å
862	H	33.5	Very low	31.5	Very low	79 Å²	79	81.1 Å²	81.1	37%	0.366	43%	0.434	S	S	.	.	H	α-helix	trans	-72.6	-25.3	171.7	-80.9	-97.3	0	0	0	112.7	I866 H1020	H862-I866 PolarHBondContact O-N 3.39Å; H862-H1020 AromaticContact CE1-CE1 3.87Å; H862-H1020 AromaticContact CE1-NE2 3.62Å
863	L	32.1	Very low	31.4	Very low	113 Å²	113	79.9 Å²	79.9	59%	0.592	43%	0.432	S	S	*	.	H	α-helix	trans	-66.8	-46	177.2	-127.9	77.2	0	0	0	112.7	I861 F865 I866 T867	I861-L863 VanDerWaalsContact C-N 3.32Å; L863-F865 PolarHBondContact O-N 2.83Å; L863-I866 PolarHBondContact O-N 2.88Å; L863-T867 HydrophobicContact CG-CG2 4.48Å; L863-T867 WeakPolarHBondContact O-CB 3.43Å; L863-T867 WeakPolarHBondContact O-CG2 3.27Å; L863-T867 PolarHBondContact O-N 2.77Å; L863-T867 PolarHBondContact O-OG1 3.26Å
864	P	32	Very low	31.1	Very low	13 Å²	13	81.4 Å²	81.4	8%	0.084	44%	0.435	C	S	.	.	H	α-helix	trans	-52.4	-41.2	172.9	-34.5	37.2	0	0	0	115.9	L828 G860 I861 I866 T867 T868	L828-P864 HydrophobicContact CB-CB 3.91Å; L828-P864 HydrophobicContact CB-CG 4.11Å; L828-P864 HydrophobicContact CD1-CB 3.73Å; L828-P864 HydrophobicContact CD1-CG 3.75Å; L828-P864 HydrophobicContact CG-CB 4.32Å; G860-P864 WeakPolarHBondContact O-CD 3.25Å; I861-P864 WeakPolarHBondContact O-CD 3.39Å; P864-I866 VanDerWaalsContact C-N 3.33Å; P864-I866 PolarHBondContact O-N 3.35Å; P864-T867 VanDerWaalsContact CA-OG1 3.26Å; P864-T867 WeakPolarHBondContact CA-OG1 3.34Å; P864-T867 PolarHBondContact O-OG1 3.1Å; P864-T868 VanDerWaalsContact O-CB 3.3Å; P864-T868 WeakPolarHBondContact O-CB 3.36Å; P864-T868 VanDerWaalsContact O-CG2 3.27Å; P864-T868 WeakPolarHBondContact O-CG2 3.47Å; P864-T868 PolarHBondContact O-N 2.83Å; P864-T868 PolarHBondContact O-OG1 3.37Å
865	F	33	Very low	31	Very low	121 Å²	121	74.9 Å²	74.9	53%	0.531	43%	0.433	S	S	.	.	H	α-helix	trans	-69.3	-33.5	179.9	-124.1	-81.8	0	0	0	112.2	L863 T868 A869 F923	L863-F865 PolarHBondContact O-N 2.83Å; F865-T868 PolarHBondContact O-OG1 3.41Å; F865-A869 WeakPolarHBondContact O-CB 3.28Å; F865-A869 PolarHBondContact O-N 2.99Å; F865-F923 HydrophobicContact CE1-CD1 4.43Å
866	I	32.2	Very low	31.1	Very low	42 Å²	42	71 Å²	71	22%	0.215	43%	0.426	C	S	.	.	H	α-helix	trans	-82.5	-38.3	178.2	-65	170.9	0	0	0	111.2	H862 L863 P864 A869 L870 L934	H862-I866 PolarHBondContact O-N 3.39Å; L863-I866 PolarHBondContact O-N 2.88Å; P864-I866 VanDerWaalsContact C-N 3.33Å; P864-I866 PolarHBondContact O-N 3.35Å; I866-A869 PolarHBondContact O-N 2.89Å; I866-L870 HydrophobicContact CG2-CD1 3.95Å; I866-L870 WeakPolarHBondContact O-CB 3.35Å; I866-L870 WeakPolarHBondContact O-CG 3.37Å; I866-L870 PolarHBondContact O-N 2.99Å; I866-L934 HydrophobicContact CD1-CD1 4.06Å; I866-L934 HydrophobicContact CG1-CD1 4.49Å; I866-L934 HydrophobicContact CG2-CD1 4.39Å
867	T	31.4	Very low	31.1	Very low	43 Å²	43	71.7 Å²	71.7	26%	0.264	42%	0.424	S	S	.	.	H	α-helix	trans	-72.1	-28.9	175.7	51.5	0	0	0	0	112.8	L863 P864 K871	L863-T867 HydrophobicContact CG-CG2 4.48Å; L863-T867 WeakPolarHBondContact O-CB 3.43Å; L863-T867 WeakPolarHBondContact O-CG2 3.27Å; L863-T867 PolarHBondContact O-N 2.77Å; L863-T867 PolarHBondContact O-OG1 3.26Å; P864-T867 VanDerWaalsContact CA-OG1 3.26Å; P864-T867 WeakPolarHBondContact CA-OG1 3.34Å; P864-T867 PolarHBondContact O-OG1 3.1Å; T867-K871 WeakPolarHBondContact O-CB 3.34Å; T867-K871 WeakPolarHBondContact O-CG 3.46Å; T867-K871 PolarHBondContact O-N 3.48Å
868	T	33.1	Very low	31.3	Very low	35 Å²	35	79.9 Å²	79.9	22%	0.215	46%	0.456	C	S	.	.	H	α-helix	trans	-74.3	-34.8	169	51.8	0	0	0	0	112.3	L833 P864 F865 W872	L833-T868 HydrophobicContact CD1-CG2 3.96Å; P864-T868 VanDerWaalsContact O-CB 3.3Å; P864-T868 WeakPolarHBondContact O-CB 3.36Å; P864-T868 VanDerWaalsContact O-CG2 3.27Å; P864-T868 WeakPolarHBondContact O-CG2 3.47Å; P864-T868 PolarHBondContact O-N 2.83Å; P864-T868 PolarHBondContact O-OG1 3.37Å; F865-T868 PolarHBondContact O-OG1 3.41Å; T868-W872 WeakPolarHBondContact O-CB 3.44Å; T868-W872 PolarHBondContact O-N 2.98Å
869	A	31.6	Very low	31.3	Very low	27 Å²	27	81.3 Å²	81.3	22%	0.223	48%	0.475	C	S	.	.	H	α-helix	trans	-63.7	-43.6	168.1	0	0	0	0	0	112	F865 I866 W872 S873	F865-A869 WeakPolarHBondContact O-CB 3.28Å; F865-A869 PolarHBondContact O-N 2.99Å; I866-A869 PolarHBondContact O-N 2.89Å; A869-W872 CarbonylContact O-C 3.57Å; A869-W872 WeakPolarHBondContact O-CA 3.14Å; A869-W872 WeakPolarHBondContact O-CB 3.47Å; A869-W872 PolarHBondContact O-N 3.22Å; A869-S873 PolarHBondContact O-N 3.42Å; A869-S873 VanDerWaalsContact O-N 3.11Å
870	L	29.9	Very low	31.1	Very low	73 Å²	73	84.5 Å²	84.5	38%	0.382	49%	0.489	S	S	.	.	H	α-helix	trans	-62.4	-48.7	174.6	-79.7	160.2	0	0	0	111.9	I866 W872 S873 T874	I866-L870 HydrophobicContact CG2-CD1 3.95Å; I866-L870 WeakPolarHBondContact O-CB 3.35Å; I866-L870 WeakPolarHBondContact O-CG 3.37Å; I866-L870 PolarHBondContact O-N 2.99Å; L870-W872 PolarHBondContact O-N 3.05Å; L870-S873 CarbonylContact O-C 3.59Å; L870-S873 WeakPolarHBondContact O-CA 3.43Å; L870-S873 WeakPolarHBondContact O-CB 3.39Å; L870-S873 PolarHBondContact O-N 2.89Å; L870-S873 PolarHBondContact O-OG 3.26Å; L870-T874 PolarHBondContact O-N 2.66Å; L870-T874 PolarHBondContact O-OG1 2.87Å
871	K	32.4	Very low	31	Very low	131 Å²	131	86 Å²	86	57%	0.57	49%	0.491	S	S	*	.	H	α-helix	trans	-59.3	-30.6	173.3	-82	-177.5	174.7	174.9	0	112.3	T867 S873 G875	T867-K871 WeakPolarHBondContact O-CB 3.34Å; T867-K871 WeakPolarHBondContact O-CG 3.46Å; T867-K871 PolarHBondContact O-N 3.48Å; K871-S873 VanDerWaalsContact C-N 3.29Å; K871-G875 PolarHBondContact O-N 2.99Å
872	W	33.2	Very low	30.8	Very low	116 Å²	116	89.2 Å²	89.2	44%	0.439	51%	0.508	S	S	.	.	H	α-helix	trans	-75.8	-10.8	171	-98.8	28.7	0	0	0	115.1	T868 A869 L870 K924	T868-W872 WeakPolarHBondContact O-CB 3.44Å; T868-W872 PolarHBondContact O-N 2.98Å; A869-W872 CarbonylContact O-C 3.57Å; A869-W872 WeakPolarHBondContact O-CA 3.14Å; A869-W872 WeakPolarHBondContact O-CB 3.47Å; A869-W872 PolarHBondContact O-N 3.22Å; L870-W872 PolarHBondContact O-N 3.05Å; W872-K924 HydrophobicContact CE3-CB 4.29Å; W872-K924 HydrophobicContact CE3-CD 3.88Å; W872-K924 HydrophobicContact CE3-CG 3.81Å; W872-K924 HydrophobicContact CH2-CD 4.4Å; W872-K924 HydrophobicContact CZ3-CB 3.79Å; W872-K924 HydrophobicContact CZ3-CD 3.58Å; W872-K924 HydrophobicContact CZ3-CG 3.69Å
873	S	32.2	Very low	30.6	Very low	56 Å²	56	89 Å²	89	39%	0.392	52%	0.515	S	S	.	.	H	α-helix	trans	-99.1	-31.9	172.8	75.1	0	0	0	0	113	A869 L870 K871 Q931	A869-S873 PolarHBondContact O-N 3.42Å; A869-S873 VanDerWaalsContact O-N 3.11Å; L870-S873 CarbonylContact O-C 3.59Å; L870-S873 WeakPolarHBondContact O-CA 3.43Å; L870-S873 WeakPolarHBondContact O-CB 3.39Å; L870-S873 PolarHBondContact O-N 2.89Å; L870-S873 PolarHBondContact O-OG 3.26Å; K871-S873 VanDerWaalsContact C-N 3.29Å; S873-Q931 PolarHBondContact OG-NE2 2.93Å
874	T	31.7	Very low	30.4	Very low	101 Å²	101	88.5 Å²	88.5	62%	0.62	51%	0.513	S	S	*	.	H	α-helix	trans	-94.5	-21.1	-178.7	56.1	0	0	0	0	113.7	L870 G876	L870-T874 PolarHBondContact O-N 2.66Å; L870-T874 PolarHBondContact O-OG1 2.87Å; T874-G876 PolarHBondContact O-N 3.47Å
875	G	28	Very low	30.4	Very low	74 Å²	74	94.6 Å²	94.6	76%	0.763	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	48.2	175	0	0	0	0	0	114	K871	K871-G875 PolarHBondContact O-N 2.99Å
876	G	28.7	Very low	30.2	Very low	60 Å²	60	95.8 Å²	95.8	62%	0.619	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-149.3	9.2	-168.3	0	0	0	0	0	116.7	T874 Q878	T874-G876 PolarHBondContact O-N 3.47Å; G876-Q878 VanDerWaalsContact C-N 3.34Å; G876-Q878 PolarHBondContact O-N 3.42Å
877	E	29.2	Very low	29.9	Very low	186 Å²	186	97.1 Å²	97.1	87%	0.869	57%	0.568	S	S	*	*	S	Bend	trans	-93	58.9	172.5	-69	-166.1	165.9	0	0	112.4
878	Q	30.3	Very low	29.6	Very low	196 Å²	196	102.7 Å²	102.7	92%	0.916	59%	0.59	S	S	*	*	S	Bend	trans	175.6	113.6	153.4	-100.7	163	50.3	0	0	109	G876	G876-Q878 VanDerWaalsContact C-N 3.34Å; G876-Q878 PolarHBondContact O-N 3.42Å
879	G	29.3	Very low	29.1	Very low	78 Å²	78	112.2 Å²	112.2	80%	0.804	62%	0.623	S	S	*	*			trans	118.1	89	174.8	0	0	0	0	0	114.2
880	N	26.1	Very low	28.9	Very low	155 Å²	155	118.7 Å²	118.7	83%	0.829	65%	0.648	S	S	*	*			trans	-62.5	157.3	178.1	-74.7	-43.8	0	0	0	113.9
881	T	29.2	Very low	28.6	Very low	68 Å²	68	123 Å²	123	42%	0.417	67%	0.671	S	S	.	*			trans	111.3	53.2	156	73	0	0	0	0	119.7	S883 N884	T881-S883 PolarHBondContact O-N 3.38Å; T881-N884 VanDerWaalsContact CB-ND2 3.29Å; T881-N884 WeakPolarHBondContact CB-ND2 3.37Å; T881-N884 PolarHBondContact O-N 2.88Å; T881-N884 VanDerWaalsContact O-N 3.09Å; T881-N884 PolarHBondContact OG1-ND2 3.41Å
882	L	26.7	Very low	28.2	Very low	106 Å²	106	125.3 Å²	125.3	56%	0.555	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-17.6	152.7	-151.3	85.7	0	0	0	112.5	N884	L882-N884 VanDerWaalsContact C-N 3.35Å
883	S	30.2	Very low	27.9	Very low	75 Å²	75	126.6 Å²	126.6	52%	0.524	70%	0.704	S	S	.	*	H	α-helix	trans	-63.6	-31.7	170	46.8	0	0	0	0	113.8	T881 I885 L886 S887	T881-S883 PolarHBondContact O-N 3.38Å; S883-I885 VanDerWaalsContact C-N 3.33Å; S883-I885 PolarHBondContact O-N 2.76Å; S883-L886 PolarHBondContact O-N 2.81Å; S883-S887 PolarHBondContact O-OG 2.86Å
884	N	28.2	Very low	27.4	Very low	103 Å²	103	130 Å²	130	55%	0.551	72%	0.722	S	S	*	*	H	α-helix	trans	-78.3	-15	-177.4	-76.6	-13.2	0	0	0	113.7	T881 L882 S887	T881-N884 VanDerWaalsContact CB-ND2 3.29Å; T881-N884 WeakPolarHBondContact CB-ND2 3.37Å; T881-N884 PolarHBondContact O-N 2.88Å; T881-N884 VanDerWaalsContact O-N 3.09Å; T881-N884 PolarHBondContact OG1-ND2 3.41Å; L882-N884 VanDerWaalsContact C-N 3.35Å; N884-S887 PolarHBondContact O-OG 3.03Å
885	I	32.6	Very low	27	Very low	141 Å²	141	129.8 Å²	129.8	72%	0.723	73%	0.725	S	S	*	*	H	α-helix	trans	-91.8	-17.9	177.7	-61.6	176.2	0	0	0	111.4	S883	S883-I885 VanDerWaalsContact C-N 3.33Å; S883-I885 PolarHBondContact O-N 2.76Å
886	L	27.1	Very low	26.9	Very low	146 Å²	146	136 Å²	136	76%	0.764	73%	0.731	S	S	*	*	H	α-helix	trans	-101.6	-5.3	-177.9	-69.3	170.5	0	0	0	113.9	S883	S883-L886 PolarHBondContact O-N 2.81Å
887	S	26.3	Very low	26.7	Very low	70 Å²	70	137.8 Å²	137.8	49%	0.49	74%	0.74	S	S	.	*	S	Bend	trans	-91.3	-14.1	-175.9	51.1	0	0	0	0	115.4	S883 N884 R889	S883-S887 PolarHBondContact O-OG 2.86Å; N884-S887 PolarHBondContact O-OG 3.03Å; S887-R889 PolarHBondContact O-N 2.78Å
888	H	25.9	Very low	26.5	Very low	159 Å²	159	134.2 Å²	134.2	74%	0.736	74%	0.736	S	S	*	*			trans	-101.6	72.2	177.7	-83	-62.2	0	0	0	114.1
889	R	23	Very low	26.2	Very low	236 Å²	236	132.6 Å²	132.6	89%	0.891	73%	0.733	S	S	*	*				-76.5	121.1	128.5	-86.5	-174.8	172.8	-171.5	-2.4	106.7	S887	S887-R889 PolarHBondContact O-N 2.78Å
890	H	26.3	Very low	26.1	Very low	162 Å²	162	138.5 Å²	138.5	75%	0.75	74%	0.74	S	S	*	*			trans	-143.4	115.2	150	-108.8	-72.2	0	0	0	110.3
891	L	23.2	Very low	26	Very low	165 Å²	165	136.2 Å²	136.2	86%	0.864	74%	0.736	S	S	*	*			trans	-63.4	151.3	155.5	-121.6	79.6	0	0	0	108.2
892	Q	24.3	Very low	25.9	Very low	178 Å²	178	140.9 Å²	140.9	83%	0.832	76%	0.757	S	S	*	*			trans	-62.8	141.4	-179.1	-64.3	162.9	-43	0	0	112.5
893	T	27.8	Very low	25.7	Very low	144 Å²	144	140.1 Å²	140.1	88%	0.883	76%	0.761	S	S	*	*			trans	-132	141.1	142.7	43.1	0	0	0	0	108.9
894	V	22.3	Very low	25.3	Very low	126 Å²	126	143.6 Å²	143.6	76%	0.764	77%	0.774	S	S	*	*			trans	-101.2	166.1	-164.7	169.1	0	0	0	0	111.6
895	S	23.2	Very low	25.1	Very low	98 Å²	98	149.5 Å²	149.5	69%	0.685	79%	0.79	S	S	*	*			trans	95.8	137.6	161.7	88.8	0	0	0	0	115
896	K	25	Very low	24.7	Very low	204 Å²	204	145.7 Å²	145.7	89%	0.887	78%	0.776	S	S	*	*			cis	-139.5	157.3	2.1	-58.1	168.5	-175.6	171.7	0	107.2
897	A	24.4	Very low	24.6	Very low	98 Å²	98	145.6 Å²	145.6	81%	0.81	78%	0.775	S	S	*	*			cis	-144.1	-166.3	1.6	0	0	0	0	0	107.8
898	S	26.1	Very low	24.7	Very low	111 Å²	111	146.8 Å²	146.8	78%	0.776	78%	0.783	S	S	*	*			cis	-141.8	152.8	-0.2	50	0	0	0	0	111.8
899	N	23.1	Very low	24.8	Very low	161 Å²	161	144 Å²	144	86%	0.861	77%	0.774	S	S	*	*			trans	-39.8	128.8	-176.8	-49	-23.3	0	0	0	117.4
900	Q	27.9	Very low	25	Very low	202 Å²	202	137.3 Å²	137.3	94%	0.944	75%	0.754	S	S	*	*				-157.3	141.5	123.9	-110.9	173.5	9.3	0	0	110.6
901	S	22.8	Very low	25	Very low	107 Å²	107	137 Å²	137	75%	0.748	75%	0.753	S	S	*	*			trans	-112.2	128.2	-168.2	53	0	0	0	0	112.4
902	L	27	Very low	25.2	Very low	166 Å²	166	138.1 Å²	138.1	87%	0.869	75%	0.751	S	S	*	*			trans	-155.1	90.6	160.4	-94.5	138.1	0	0	0	105.9
903	S	22.5	Very low	25.2	Very low	90 Å²	90	134.9 Å²	134.9	63%	0.629	74%	0.74	S	S	*	*				47.7	122.5	77.7	76.1	0	0	0	0	114.2
904	N	23.4	Very low	25	Very low	148 Å²	148	131.7 Å²	131.7	79%	0.791	72%	0.717	S	S	*	*			trans	53.2	87.3	162.9	-56.1	-12.5	0	0	0	117.7
905	Y	22.4	Very low	25.1	Very low	228 Å²	228	136.5 Å²	136.5	89%	0.894	72%	0.723	S	S	*	*	S	Bend		-166.3	126.2	128.6	-99.6	-66.9	0	0	0	112.4
906	S	25.4	Very low	25.3	Very low	60 Å²	60	139.5 Å²	139.5	42%	0.42	72%	0.723	S	S	.	*			trans	76.2	31	152.8	76.9	0	0	0	0	122.7	S908 L909	S906-S908 PolarHBondContact O-N 2.82Å; S906-L909 PolarHBondContact O-N 3.47Å
907	L	25.3	Very low	25.4	Very low	144 Å²	144	134.9 Å²	134.9	75%	0.754	72%	0.717	S	S	*	*	H	α-helix	trans	-62.1	-32.7	164.4	-131.1	94.5	0	0	0	112.4	L909 I910	L907-L909 PolarHBondContact O-N 3.22Å; L907-I910 PolarHBondContact O-N 3.2Å
908	S	26.9	Very low	25.5	Very low	95 Å²	95	137 Å²	137	66%	0.664	71%	0.708	S	S	*	*	H	α-helix	trans	-72.3	-6.6	177.3	54.6	0	0	0	0	115.3	S906	S906-S908 PolarHBondContact O-N 2.82Å
909	L	27.7	Very low	25.5	Very low	102 Å²	102	137 Å²	137	53%	0.534	71%	0.705	S	S	.	*	H	α-helix	trans	-103.1	-10	-178.8	-129.8	147.8	0	0	0	112.3	S906 L907 N913	S906-L909 PolarHBondContact O-N 3.47Å; L907-L909 PolarHBondContact O-N 3.22Å; L909-N913 PolarHBondContact O-ND2 3.41Å
910	I	27.3	Very low	25.8	Very low	94 Å²	94	138.1 Å²	138.1	48%	0.482	70%	0.702	S	S	.	*	H	α-helix	trans	-92.2	-44.7	175.9	-69.2	178.9	0	0	0	109.6	L907 K912 N913 L914	L907-I910 PolarHBondContact O-N 3.2Å; I910-K912 VanDerWaalsContact C-N 3.25Å; I910-K912 PolarHBondContact O-N 3.4Å; I910-N913 PolarHBondContact O-N 3.47Å; I910-L914 HydrophobicContact CB-CD1 4.4Å; I910-L914 HydrophobicContact CG2-CD1 3.64Å; I910-L914 HydrophobicContact CG2-CD2 4.13Å; I910-L914 HydrophobicContact CG2-CG 4.44Å; I910-L914 WeakPolarHBondContact O-CD1 3.48Å; I910-L914 PolarHBondContact O-N 3.46Å
911	E	28	Very low	26.1	Very low	155 Å²	155	132.9 Å²	132.9	72%	0.724	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	-28.2	179.4	-67.9	-174.8	141.8	0	0	114.1
912	K	27.4	Very low	26.6	Very low	189 Å²	189	131.1 Å²	131.1	82%	0.822	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-4.7	174.5	-76.7	-176.4	175.2	177.8	0	115.2	I910	I910-K912 VanDerWaalsContact C-N 3.25Å; I910-K912 PolarHBondContact O-N 3.4Å
913	N	24	Very low	26.9	Very low	111 Å²	111	128.4 Å²	128.4	59%	0.594	65%	0.646	S	S	*	*	S	Bend	trans	-120.3	10.4	-178.8	-73.4	-53.1	0	0	0	113.6	L909 I910	L909-N913 PolarHBondContact O-ND2 3.41Å; I910-N913 PolarHBondContact O-N 3.47Å
914	L	23.6	Very low	27.5	Very low	77 Å²	77	127.9 Å²	127.9	40%	0.403	63%	0.632	S	S	.	*			trans	-130.2	81.8	-177.6	-85.6	81	0	0	0	113.2	I910 K916	I910-L914 HydrophobicContact CB-CD1 4.4Å; I910-L914 HydrophobicContact CG2-CD1 3.64Å; I910-L914 HydrophobicContact CG2-CD2 4.13Å; I910-L914 HydrophobicContact CG2-CG 4.44Å; I910-L914 WeakPolarHBondContact O-CD1 3.48Å; I910-L914 PolarHBondContact O-N 3.46Å; L914-K916 HydrophobicContact CB-CB 4.09Å; L914-K916 HydrophobicContact CB-CG 4.24Å; L914-K916 HydrophobicContact CD1-CD 4.29Å; L914-K916 HydrophobicContact CD2-CB 3.94Å; L914-K916 HydrophobicContact CD2-CD 3.91Å; L914-K916 HydrophobicContact CD2-CG 4.26Å; L914-K916 HydrophobicContact CG-CB 3.82Å; L914-K916 HydrophobicContact CG-CD 3.6Å; L914-K916 HydrophobicContact CG-CG 3.73Å; L914-K916 PolarHBondContact O-N 2.78Å; L914-K916 VanDerWaalsContact O-N 3.14Å
915	Y	24.4	Very low	28.2	Very low	226 Å²	226	127.1 Å²	127.1	89%	0.886	62%	0.622	S	S	*	*			trans	-76.8	38.2	140.3	-76.3	-68.9	0	0	0	110.4	S917	Y915-S917 PolarHBondContact O-N 3.22Å
916	K	26.5	Very low	28.9	Very low	161 Å²	161	118.1 Å²	118.1	70%	0.7	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	43.2	-175.6	-73.4	-171.6	-151.8	158.2	0	112.8	L914	L914-K916 HydrophobicContact CB-CB 4.09Å; L914-K916 HydrophobicContact CB-CG 4.24Å; L914-K916 HydrophobicContact CD1-CD 4.29Å; L914-K916 HydrophobicContact CD2-CB 3.94Å; L914-K916 HydrophobicContact CD2-CD 3.91Å; L914-K916 HydrophobicContact CD2-CG 4.26Å; L914-K916 HydrophobicContact CG-CB 3.82Å; L914-K916 HydrophobicContact CG-CD 3.6Å; L914-K916 HydrophobicContact CG-CG 3.73Å; L914-K916 PolarHBondContact O-N 2.78Å; L914-K916 VanDerWaalsContact O-N 3.14Å
917	S	27	Very low	29.4	Very low	107 Å²	107	116.1 Å²	116.1	75%	0.748	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-158.4	46.4	162.4	53.1	0	0	0	0	111.8	Y915 P919	Y915-S917 PolarHBondContact O-N 3.22Å; S917-P919 WeakPolarHBondContact O-CD 3.35Å; S917-P919 VanDerWaalsContact O-N 3.09Å
918	K	26.3	Very low	30.1	Very low	144 Å²	144	116 Å²	116	63%	0.626	57%	0.569	S	S	*	*			trans	-46.6	122.3	152.6	-78.2	-170.3	175	-173.7	0	107.2	K920	K918-K920 PolarHBondContact O-N 3.43Å
919	P	27	Very low	30.7	Very low	110 Å²	110	113.3 Å²	113.3	71%	0.714	55%	0.547	S	S	*	.			trans	-62.9	113.1	173.5	25.6	-31.6	0	0	0	106.5	S917 I921	S917-P919 WeakPolarHBondContact O-CD 3.35Å; S917-P919 VanDerWaalsContact O-N 3.09Å; P919-I921 VanDerWaalsContact C-N 3.29Å; P919-I921 PolarHBondContact O-N 3.04Å
920	K	29.9	Very low	31.1	Very low	185 Å²	185	110.5 Å²	110.5	80%	0.804	53%	0.532	S	S	*	.			trans	-61.9	97.1	173.4	-70.1	-178.6	177.4	179.1	0	107.4	K918 T922	K918-K920 PolarHBondContact O-N 3.43Å; K920-T922 HydrophobicContact CB-CG2 3.91Å; K920-T922 PolarHBondContact O-N 3.2Å
921	I	33.9	Very low	31.7	Very low	91 Å²	91	108.4 Å²	108.4	47%	0.467	52%	0.52	S	S	.	.			trans	-62.2	86.9	152.1	-59.9	177.2	0	0	0	104.3	P919 F923	P919-I921 VanDerWaalsContact C-N 3.29Å; P919-I921 PolarHBondContact O-N 3.04Å; I921-F923 PolarHBondContact O-N 3.46Å; I921-F923 VanDerWaalsContact O-N 3.15Å
922	T	32.1	Very low	32.2	Very low	71 Å²	71	103 Å²	103	44%	0.436	50%	0.503	S	S	.	.			trans	-70.4	113.4	174.1	44.8	0	0	0	0	105.9	K920 K924 K925	K920-T922 HydrophobicContact CB-CG2 3.91Å; K920-T922 PolarHBondContact O-N 3.2Å; T922-K924 PolarHBondContact O-N 2.99Å; T922-K925 PolarHBondContact O-N 3.19Å
923	F	33.7	Very low	32.5	Very low	109 Å²	109	95 Å²	95	48%	0.478	47%	0.472	S	S	.	.	H	α-helix	trans	-50.3	-16.9	168.3	-77.8	-93.5	0	0	0	112	L837 F865 I921 K925 G927	L837-F923 HydrophobicContact CD2-CD2 4.26Å; F865-F923 HydrophobicContact CE1-CD1 4.43Å; I921-F923 PolarHBondContact O-N 3.46Å; I921-F923 VanDerWaalsContact O-N 3.15Å; F923-K925 PolarHBondContact O-N 2.72Å; F923-G927 WeakPolarHBondContact O-CA 3.45Å; F923-G927 PolarHBondContact O-N 3.16Å
924	K	35.1	Very low	33	Very low	78 Å²	78	90.9 Å²	90.9	34%	0.339	45%	0.449	S	S	.	.	H	α-helix	trans	-48.2	-35.8	163.6	-152.4	161.7	-167.6	160.6	0	115	W872 T922 R928	W872-K924 HydrophobicContact CE3-CB 4.29Å; W872-K924 HydrophobicContact CE3-CD 3.88Å; W872-K924 HydrophobicContact CE3-CG 3.81Å; W872-K924 HydrophobicContact CH2-CD 4.4Å; W872-K924 HydrophobicContact CZ3-CB 3.79Å; W872-K924 HydrophobicContact CZ3-CD 3.58Å; W872-K924 HydrophobicContact CZ3-CG 3.69Å; T922-K924 PolarHBondContact O-N 2.99Å; K924-R928 WeakPolarHBondContact O-CB 3.32Å; K924-R928 WeakPolarHBondContact O-CD 3.41Å; K924-R928 WeakPolarHBondContact O-CG 3.46Å; K924-R928 PolarHBondContact O-N 3.15Å
925	K	37.7	Very low	33.7	Very low	133 Å²	133	90.4 Å²	90.4	58%	0.578	45%	0.452	S	S	*	.	H	α-helix	trans	-84.4	-46.4	-177.1	-150.2	-178.8	-175.3	-169.7	0	111.4	T922 F923 R928 I929	T922-K925 PolarHBondContact O-N 3.19Å; F923-K925 PolarHBondContact O-N 2.72Å; K925-R928 PolarHBondContact O-N 3.06Å; K925-I929 WeakPolarHBondContact O-CG1 3.37Å; K925-I929 PolarHBondContact O-N 3.04Å
926	T	37.2	Very low	34.3	Very low	39 Å²	39	84.9 Å²	84.9	24%	0.239	44%	0.437	C	S	.	.	H	α-helix	trans	-63	-45.7	173.7	-12.7	0	0	0	0	111.2	R928 I929 I930 L1023	T926-R928 VanDerWaalsContact C-N 3.32Å; T926-R928 PolarHBondContact O-N 3.37Å; T926-I929 PolarHBondContact O-N 3.34Å; T926-I929 VanDerWaalsContact O-N 3.11Å; T926-I930 WeakPolarHBondContact O-CG1 3.43Å; T926-I930 PolarHBondContact O-N 3.4Å; T926-L1023 HydrophobicContact CG2-CD1 4.33Å
927	G	37.5	Very low	34.7	Very low	18 Å²	18	79.9 Å²	79.9	19%	0.186	42%	0.421	C	S	.	.	H	α-helix	trans	-61.2	-35.1	176.3	0	0	0	0	0	113.4	F923 Q931	F923-G927 WeakPolarHBondContact O-CA 3.45Å; F923-G927 PolarHBondContact O-N 3.16Å; G927-Q931 WeakPolarHBondContact O-CB 3.41Å; G927-Q931 PolarHBondContact O-N 3.41Å
928	R	39.1	Very low	35	Very low	141 Å²	141	82.4 Å²	82.4	53%	0.532	42%	0.42	S	S	.	.	H	α-helix	trans	-67.7	-36.3	172.2	-84.4	176.1	174.4	-169.1	-4.3	113.3	K924 K925 T926 A932	K924-R928 WeakPolarHBondContact O-CB 3.32Å; K924-R928 WeakPolarHBondContact O-CD 3.41Å; K924-R928 WeakPolarHBondContact O-CG 3.46Å; K924-R928 PolarHBondContact O-N 3.15Å; K925-R928 PolarHBondContact O-N 3.06Å; T926-R928 VanDerWaalsContact C-N 3.32Å; T926-R928 PolarHBondContact O-N 3.37Å; R928-A932 WeakPolarHBondContact O-CB 3.46Å; R928-A932 PolarHBondContact O-N 2.91Å
929	I	38.5	Very low	35.3	Very low	38 Å²	38	78.5 Å²	78.5	20%	0.195	41%	0.412	C	S	.	.	H	α-helix	trans	-69.7	-45.1	176.6	-66.6	165.7	0	0	0	110	K925 T926 Q931 A932 A933 I967	K925-I929 WeakPolarHBondContact O-CG1 3.37Å; K925-I929 PolarHBondContact O-N 3.04Å; T926-I929 PolarHBondContact O-N 3.34Å; T926-I929 VanDerWaalsContact O-N 3.11Å; I929-Q931 PolarHBondContact O-N 2.97Å; I929-A932 PolarHBondContact O-N 3.49Å; I929-A933 PolarHBondContact O-N 3.41Å; I929-I967 HydrophobicContact CG2-CD1 4.06Å
930	I	37.7	Very low	35.4	Very low	43 Å²	43	76.6 Å²	76.6	22%	0.221	41%	0.411	C	S	.	.	H	α-helix	trans	-62.4	-42.7	175	-63.4	162.2	0	0	0	110.7	T926 A933 L934 R1019 L1023	T926-I930 WeakPolarHBondContact O-CG1 3.43Å; T926-I930 PolarHBondContact O-N 3.4Å; I930-A933 PolarHBondContact O-N 2.86Å; I930-L934 HydrophobicContact CG2-CD1 3.73Å; I930-L934 HydrophobicContact CG2-CG 4.31Å; I930-L934 WeakPolarHBondContact O-CB 3.44Å; I930-L934 VanDerWaalsContact O-CG 3.27Å; I930-L934 WeakPolarHBondContact O-CG 3.3Å; I930-L934 PolarHBondContact O-N 2.82Å; I930-R1019 HydrophobicContact CG2-CG 4.42Å; I930-L1023 HydrophobicContact CD1-CD1 3.7Å
931	Q	38.7	Very low	35.2	Very low	51 Å²	51	73.8 Å²	73.8	24%	0.238	41%	0.406	C	S	.	.	H	α-helix	trans	-64	-43.3	176.6	-176	178	3.8	0	0	111.7	S873 G927 I929 L934 S935	S873-Q931 PolarHBondContact OG-NE2 2.93Å; G927-Q931 WeakPolarHBondContact O-CB 3.41Å; G927-Q931 PolarHBondContact O-N 3.41Å; I929-Q931 PolarHBondContact O-N 2.97Å; Q931-L934 PolarHBondContact O-N 2.99Å; Q931-S935 WeakPolarHBondContact O-CB 3.14Å; Q931-S935 PolarHBondContact O-N 3.15Å; Q931-S935 PolarHBondContact O-OG 3.31Å
932	A	38.3	Very low	35	Very low	42 Å²	42	74.9 Å²	74.9	35%	0.347	42%	0.417	S	S	.	.	H	α-helix	trans	-61.8	-43	176.8	0	0	0	0	0	111.9	R928 I929 S935 L936	R928-A932 WeakPolarHBondContact O-CB 3.46Å; R928-A932 PolarHBondContact O-N 2.91Å; I929-A932 PolarHBondContact O-N 3.49Å; A932-S935 WeakPolarHBondContact CA-OG 3.39Å; A932-S935 PolarHBondContact O-OG 3.05Å; A932-L936 WeakPolarHBondContact O-CD1 3.22Å; A932-L936 WeakPolarHBondContact O-CG 2.91Å; A932-L936 PolarHBondContact O-N 3.36Å
933	A	34.8	Very low	34.7	Very low	21 Å²	21	81.1 Å²	81.1	17%	0.174	44%	0.438	C	S	.	.	H	α-helix	trans	-63.8	-44.8	174.3	0	0	0	0	0	112.1	I929 I930 L936 T937 L1022	I929-A933 PolarHBondContact O-N 3.41Å; I930-A933 PolarHBondContact O-N 2.86Å; A933-L936 PolarHBondContact O-N 2.96Å; A933-T937 PolarHBondContact O-N 3.39Å; A933-T937 VanDerWaalsContact O-N 3.16Å; A933-T937 PolarHBondContact O-OG1 2.83Å; A933-L1022 HydrophobicContact CB-CD1 3.7Å
934	L	33.4	Very low	34.3	Very low	24 Å²	24	80 Å²	80	13%	0.126	44%	0.444	C	S	.	.	H	α-helix	trans	-66.3	-37.9	178.5	-74.5	170.4	0	0	0	112.9	I866 I930 Q931 L936 T937 Q938 R1019	I866-L934 HydrophobicContact CD1-CD1 4.06Å; I866-L934 HydrophobicContact CG1-CD1 4.49Å; I866-L934 HydrophobicContact CG2-CD1 4.39Å; I930-L934 HydrophobicContact CG2-CD1 3.73Å; I930-L934 HydrophobicContact CG2-CG 4.31Å; I930-L934 WeakPolarHBondContact O-CB 3.44Å; I930-L934 VanDerWaalsContact O-CG 3.27Å; I930-L934 WeakPolarHBondContact O-CG 3.3Å; I930-L934 PolarHBondContact O-N 2.82Å; Q931-L934 PolarHBondContact O-N 2.99Å; L934-L936 VanDerWaalsContact C-N 3.27Å; L934-L936 PolarHBondContact O-N 3.21Å; L934-T937 WeakPolarHBondContact CA-OG1 3.25Å; L934-T937 PolarHBondContact O-N 2.81Å; L934-T937 PolarHBondContact O-OG1 3.4Å; L934-Q938 PolarHBondContact O-N 3.39Å; L934-R1019 HydrophobicContact CD1-CG 4.27Å; L934-R1019 HydrophobicContact CD2-CG 3.93Å; L934-R1019 HydrophobicContact CG-CG 4.37Å
935	S	39.9	Very low	33.9	Very low	66 Å²	66	83.3 Å²	83.3	46%	0.462	46%	0.463	S	S	.	.	H	α-helix	trans	-65.4	-30.6	175.6	53.3	0	0	0	0	112.7	Q931 A932 S939	Q931-S935 WeakPolarHBondContact O-CB 3.14Å; Q931-S935 PolarHBondContact O-N 3.15Å; Q931-S935 PolarHBondContact O-OG 3.31Å; A932-S935 WeakPolarHBondContact CA-OG 3.39Å; A932-S935 PolarHBondContact O-OG 3.05Å; S935-S939 PolarHBondContact O-N 2.66Å; S935-S939 PolarHBondContact O-OG 3.07Å
936	L	36	Very low	33.3	Very low	110 Å²	110	83.1 Å²	83.1	58%	0.576	47%	0.469	S	S	*	.	H	α-helix	trans	-72.4	-33.2	173.1	-71.4	164.2	0	0	0	112	A932 A933 L934 S939 V965	A932-L936 WeakPolarHBondContact O-CD1 3.22Å; A932-L936 WeakPolarHBondContact O-CG 2.91Å; A932-L936 PolarHBondContact O-N 3.36Å; A933-L936 PolarHBondContact O-N 2.96Å; L934-L936 VanDerWaalsContact C-N 3.27Å; L934-L936 PolarHBondContact O-N 3.21Å; L936-S939 PolarHBondContact O-OG 3.07Å; L936-V965 HydrophobicContact CD1-CG1 4.34Å
937	T	34.7	Very low	32.7	Very low	57 Å²	57	87.9 Å²	87.9	35%	0.35	49%	0.493	S	S	.	.	H	α-helix	trans	-80.3	-21.4	176	54.2	0	0	0	0	114.4	A933 L934	A933-T937 PolarHBondContact O-N 3.39Å; A933-T937 VanDerWaalsContact O-N 3.16Å; A933-T937 PolarHBondContact O-OG1 2.83Å; L934-T937 WeakPolarHBondContact CA-OG1 3.25Å; L934-T937 PolarHBondContact O-N 2.81Å; L934-T937 PolarHBondContact O-OG1 3.4Å
938	Q	33	Very low	32.1	Very low	159 Å²	159	95.8 Å²	95.8	74%	0.743	53%	0.525	S	S	*	.	H	α-helix	trans	-88.8	-17.3	178.1	-75.9	-172.4	-39.1	0	0	113.6	L934 G940	L934-Q938 PolarHBondContact O-N 3.39Å; Q938-G940 PolarHBondContact O-N 2.96Å
939	S	32.5	Very low	31.4	Very low	63 Å²	63	99.4 Å²	99.4	44%	0.441	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	51.7	172.2	59.4	0	0	0	0	112.3	S935 L936	S935-S939 PolarHBondContact O-N 2.66Å; S935-S939 PolarHBondContact O-OG 3.07Å; L936-S939 PolarHBondContact O-OG 3.07Å
940	G	29.1	Very low	30.8	Very low	69 Å²	69	103.5 Å²	103.5	71%	0.711	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-28.5	169.8	0	0	0	0	0	112.7	Q938	Q938-G940 PolarHBondContact O-N 2.96Å
941	D	27.1	Very low	30.2	Very low	127 Å²	127	108.7 Å²	108.7	68%	0.679	60%	0.6	S	S	*	*	S	Bend	trans	-110.3	126.9	-179.8	-73	-50.2	0	0	0	112.2
942	T	29.4	Very low	29.6	Very low	114 Å²	114	115.9 Å²	115.9	70%	0.699	63%	0.634	S	S	*	*			trans	66.7	72.5	161.4	62.2	0	0	0	0	118.8	S944	T942-S944 PolarHBondContact O-N 3.35Å
943	F	25.5	Very low	28.9	Very low	201 Å²	201	123.9 Å²	123.9	88%	0.882	66%	0.661	S	S	*	*			trans	-70.8	48.2	143.6	-109.8	-80.2	0	0	0	111.3	I945	F943-I945 PolarHBondContact O-N 3.1Å
944	S	25.3	Very low	28.6	Very low	86 Å²	86	132.8 Å²	132.8	60%	0.601	70%	0.696	S	S	*	*			trans	-90.7	93.1	179.5	62.2	0	0	0	0	111.2	T942 N946	T942-S944 PolarHBondContact O-N 3.35Å; S944-N946 PolarHBondContact O-N 3.16Å
945	I	25.8	Very low	28.2	Very low	147 Å²	147	137.2 Å²	137.2	75%	0.754	73%	0.729	S	S	*	*			trans	-5.1	109.6	152.7	-55.7	161.9	0	0	0	114.6	F943	F943-I945 PolarHBondContact O-N 3.1Å
946	N	25.2	Very low	27.6	Very low	130 Å²	130	141.8 Å²	141.8	70%	0.695	75%	0.747	S	S	*	*				-175.4	122.3	120.8	-97.8	-43.1	0	0	0	114.7	S944	S944-N946 PolarHBondContact O-N 3.16Å
947	N	24.9	Very low	27	Very low	138 Å²	138	144.4 Å²	144.4	74%	0.738	76%	0.762	S	S	*	*			trans	46.2	92.1	141.4	-55.5	-23.6	0	0	0	120.5
948	Q	24.4	Very low	26.7	Very low	185 Å²	185	151.4 Å²	151.4	86%	0.864	79%	0.787	S	S	*	*				-177.4	71.5	112.8	-97.8	178.6	14.4	0	0	112.6
949	F	24.8	Very low	26.6	Very low	217 Å²	217	151.7 Å²	151.7	95%	0.952	79%	0.792	S	S	*	*			trans	-143.5	77.4	157.5	-95.4	-75.6	0	0	0	109.5
950	T	25.3	Very low	26.4	Very low	124 Å²	124	154.9 Å²	154.9	76%	0.761	80%	0.804	S	S	*	*			trans	-81.9	138.9	169.9	44.8	0	0	0	0	110.3
951	N	25.7	Very low	26.3	Very low	151 Å²	151	157.9 Å²	157.9	81%	0.807	80%	0.804	S	S	*	*	S	Bend	trans	85.2	59.5	170.4	-52.6	-19	0	0	0	118.4
952	E	26.6	Very low	26.3	Very low	202 Å²	202	158.9 Å²	158.9	94%	0.944	81%	0.809	S	S	*	*			trans	-156.8	52.4	133	-118.3	176	-152.3	0	0	113.8
953	K	24.3	Very low	26.2	Very low	211 Å²	211	160.8 Å²	160.8	92%	0.917	82%	0.815	S	S	*	*			trans	-97.4	97.2	168.7	-88.1	-171.7	174.8	-179.5	0	111.1
954	K	27.2	Very low	26.4	Very low	208 Å²	208	156 Å²	156	90%	0.904	80%	0.802	S	S	*	*	S	Bend	trans	-160.5	28.5	163	-120	168.7	-170.5	179.2	0	118.3
955	S	26.6	Very low	26.6	Very low	117 Å²	117	157 Å²	157	82%	0.818	81%	0.805	S	S	*	*	S	Bend	trans	-160.5	37.1	175.3	54.6	0	0	0	0	117.2
956	L	26.2	Very low	26.7	Very low	162 Å²	162	153.9 Å²	153.9	85%	0.848	79%	0.792	S	S	*	*			trans	-146	45.9	176.4	-133.8	118	0	0	0	116.7
957	N	24.2	Very low	26.7	Very low	165 Å²	165	150.6 Å²	150.6	88%	0.882	77%	0.774	S	S	*	*			trans	-115.3	87.2	166.2	-78.6	12.5	0	0	0	110.1
958	K	28.2	Very low	26.7	Very low	204 Å²	204	149.4 Å²	149.4	89%	0.887	77%	0.774	S	S	*	*			trans	173.8	72.2	157.9	-103.4	178.8	-179	-174.4	0	111.6
959	I	30.8	Very low	26.7	Very low	164 Å²	164	144.4 Å²	144.4	84%	0.841	75%	0.752	S	S	*	*			trans	-139	116.9	151.1	-58.3	-176.8	0	0	0	105.9
960	N	27.3	Very low	26.7	Very low	130 Å²	130	139.8 Å²	139.8	70%	0.695	75%	0.747	S	S	*	*			trans	-102.4	143.7	171.7	-95	55.5	0	0	0	108.5
961	D	28.1	Very low	26.7	Very low	132 Å²	132	140.5 Å²	140.5	71%	0.706	74%	0.744	S	S	*	*	S	Bend	trans	48.9	72.6	142.4	-43.2	-34.5	0	0	0	117.2
962	N	27.1	Very low	26.7	Very low	148 Å²	148	142.7 Å²	142.7	79%	0.791	75%	0.747	S	S	*	*			trans	175.5	105.1	135.4	-91.7	-41.5	0	0	0	109.6	T964	N962-T964 PolarHBondContact O-N 2.99Å
963	D	27.4	Very low	26.5	Very low	154 Å²	154	145 Å²	145	82%	0.824	75%	0.747	S	S	*	*			trans	-65.7	100.1	-175.9	-74.7	-53.2	0	0	0	112.5
964	T	28.7	Very low	26.5	Very low	101 Å²	101	139.2 Å²	139.2	62%	0.62	73%	0.733	S	S	*	*			trans	-120.8	114.3	160.4	48.2	0	0	0	0	107.4	N962 V966	N962-T964 PolarHBondContact O-N 2.99Å; T964-V966 PolarHBondContact O-N 3.19Å
965	V	29	Very low	26.4	Very low	107 Å²	107	135.2 Å²	135.2	65%	0.648	73%	0.731	S	S	*	*			trans	-74.9	64.7	173.2	-172.9	0	0	0	0	109.1	L936 I967	L936-V965 HydrophobicContact CD1-CG1 4.34Å; V965-I967 VanDerWaalsContact C-N 3.32Å; V965-I967 HydrophobicContact CG1-CG1 4.28Å; V965-I967 PolarHBondContact O-N 3.03Å
966	V	28.3	Very low	26.4	Very low	81 Å²	81	134.7 Å²	134.7	49%	0.491	73%	0.727	S	S	.	*			trans	-73.2	90.4	168.5	-176.6	0	0	0	0	106.9	T964 P968	T964-V966 PolarHBondContact O-N 3.19Å; V966-P968 WeakPolarHBondContact O-CD 3.24Å
967	I	25.4	Very low	26.4	Very low	62 Å²	62	133.1 Å²	133.1	32%	0.318	72%	0.719	S	S	.	*			trans	-55.4	112.2	170.2	-60.7	177.9	0	0	0	107.3	I929 V965 I969 R989	I929-I967 HydrophobicContact CG2-CD1 4.06Å; V965-I967 VanDerWaalsContact C-N 3.32Å; V965-I967 HydrophobicContact CG1-CG1 4.28Å; V965-I967 PolarHBondContact O-N 3.03Å; I967-I969 PolarHBondContact O-N 3.18Å; I967-R989 PolarHBondContact O-NH2 3.26Å
968	P	24.3	Very low	26.5	Very low	113 Å²	113	136.1 Å²	136.1	73%	0.734	72%	0.718	S	S	*	*			trans	-88.2	85.7	-168.8	33.3	-30.2	0	0	0	108.6	V966 S970	V966-P968 WeakPolarHBondContact O-CD 3.24Å; P968-S970 PolarHBondContact O-N 2.89Å
969	I	26	Very low	26.4	Very low	80 Å²	80	130.2 Å²	130.2	41%	0.41	71%	0.708	S	S	.	*			trans	-68.5	107	165.3	-54.5	-178.7	0	0	0	106.9	I967 I971	I967-I969 PolarHBondContact O-N 3.18Å; I969-I971 HydrophobicContact CG2-CD1 4.45Å; I969-I971 HydrophobicContact CG2-CG1 3.88Å; I969-I971 PolarHBondContact O-N 3.05Å
970	S	23.3	Very low	26.2	Very low	119 Å²	119	125.2 Å²	125.2	83%	0.832	69%	0.687	S	S	*	*			trans	-68.4	71.7	177	46	0	0	0	0	111.9	P968 K972	P968-S970 PolarHBondContact O-N 2.89Å; S970-K972 PolarHBondContact O-N 3.41Å
971	I	27	Very low	26	Very low	139 Å²	139	123.2 Å²	123.2	71%	0.713	68%	0.676	S	S	*	*			trans	-75	112.4	168.1	-57.4	-177.8	0	0	0	107.5	I969 R973	I969-I971 HydrophobicContact CG2-CD1 4.45Å; I969-I971 HydrophobicContact CG2-CG1 3.88Å; I969-I971 PolarHBondContact O-N 3.05Å; I971-R973 PolarHBondContact O-N 3.45Å
972	K	24.3	Very low	25.9	Very low	197 Å²	197	124 Å²	124	86%	0.857	68%	0.675	S	S	*	*			trans	-51.3	127.3	169.8	-91.3	-176.2	172	-179.4	0	109.2	S970 S974	S970-K972 PolarHBondContact O-N 3.41Å; K972-S974 PolarHBondContact O-N 3.49Å
973	R	23	Very low	26	Very low	252 Å²	252	120.8 Å²	120.8	95%	0.951	66%	0.658	S	S	*	*			trans	-50.3	109.3	174.8	-67.5	175.1	175.8	170.7	-3	110.3	I971	I971-R973 PolarHBondContact O-N 3.45Å
974	S	23.9	Very low	26.2	Very low	88 Å²	88	117.1 Å²	117.1	62%	0.615	64%	0.641	S	S	*	*			trans	-105.2	113	159.6	52.5	0	0	0	0	107.8	K972 S976	K972-S974 PolarHBondContact O-N 3.49Å; S974-S976 VanDerWaalsContact C-N 3.29Å; S974-S976 PolarHBondContact O-N 2.82Å
975	S	25	Very low	26.2	Very low	124 Å²	124	117.2 Å²	117.2	87%	0.867	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	10.8	-164.4	37.5	0	0	0	0	115.6
976	S	26.1	Very low	26.6	Very low	106 Å²	106	118.8 Å²	118.8	74%	0.741	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.6	11.2	-168.6	63.7	0	0	0	0	116	S974	S974-S976 VanDerWaalsContact C-N 3.29Å; S974-S976 PolarHBondContact O-N 2.82Å
977	L	27.1	Very low	27	Very low	130 Å²	130	117.1 Å²	117.1	68%	0.681	64%	0.636	S	S	*	*	S	Bend	trans	-128.4	12.5	-176.1	-99	159.6	0	0	0	113.8
978	R	25.8	Very low	27.5	Very low	227 Å²	227	119.6 Å²	119.6	86%	0.857	64%	0.642	S	S	*	*	S	Bend	trans	-90.7	-3.4	-169.8	-143.2	178.5	-167.2	-175.8	0.6	115.2
979	A	25.8	Very low	28.3	Very low	81 Å²	81	119.6 Å²	119.6	67%	0.669	63%	0.627	S	S	*	*	S	Bend	trans	-104.6	-16	-172.6	0	0	0	0	0	114.6
980	S	26.5	Very low	29.1	Very low	59 Å²	59	116.3 Å²	116.3	41%	0.413	61%	0.611	S	S	.	*	S	Bend	trans	-100.4	13.8	-163.3	58.6	0	0	0	0	115.8	Q1209	S980-Q1209 PolarHBondContact O-OE1 2.72Å
981	L	25	Very low	30	Very low	87 Å²	87	114.5 Å²	114.5	46%	0.455	60%	0.603	S	S	.	*			trans	-147.2	25.9	-175.9	-76.5	176.2	0	0	0	114.1	L983 Y988	L981-L983 PolarHBondContact O-N 3.41Å; L981-L983 VanDerWaalsContact O-N 3.14Å; L981-Y988 VanDerWaalsContact C-OH 3.31Å; L981-Y988 HydrophobicContact CB-CE1 4.32Å; L981-Y988 PolarHBondContact O-OH 3.47Å
982	Q	25.1	Very low	30.7	Very low	149 Å²	149	109.4 Å²	109.4	70%	0.696	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	54	-175	-69.1	-168.2	-59	0	0	114.7	Y988	Q982-Y988 WeakPolarHBondContact CA-OH 3.44Å
983	L	29.4	Very low	31.6	Very low	80 Å²	80	106.5 Å²	106.5	42%	0.419	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-111.2	-13.2	-179	-85.2	161.2	0	0	0	116.9	L981	L981-L983 PolarHBondContact O-N 3.41Å; L981-L983 VanDerWaalsContact O-N 3.14Å
984	V	30.6	Very low	32.3	Very low	77 Å²	77	96.8 Å²	96.8	47%	0.467	54%	0.535	S	S	.	.			trans	-146.7	123.1	156.4	-174.6	0	0	0	0	108.7	D986 I987	V984-D986 VanDerWaalsContact C-N 3.25Å; V984-D986 PolarHBondContact O-N 3.09Å; V984-I987 HydrophobicContact CB-CD1 4.09Å; V984-I987 HydrophobicContact CB-CG1 4.3Å; V984-I987 HydrophobicContact CG1-CD1 4.16Å; V984-I987 HydrophobicContact CG1-CG1 4.14Å; V984-I987 HydrophobicContact CG2-CD1 4.28Å
985	P	29.9	Very low	33.1	Very low	103 Å²	103	96.9 Å²	96.9	67%	0.669	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-20.7	-176	-26.3	36.3	0	0	0	116.3	Y988	P985-Y988 VanDerWaalsContact O-CD2 3.24Å; P985-Y988 WeakPolarHBondContact O-CD2 3.49Å
986	D	36.6	Very low	33.9	Very low	141 Å²	141	93.6 Å²	93.6	75%	0.754	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	-3.7	-164.7	-60.4	-40.2	0	0	0	115.4	V984	V984-D986 VanDerWaalsContact C-N 3.25Å; V984-D986 PolarHBondContact O-N 3.09Å
987	I	37.5	Very low	34.7	Very low	46 Å²	46	90.1 Å²	90.1	24%	0.236	47%	0.474	C	S	.	.			trans	-94.5	-2.2	-175.8	-53.7	178.2	0	0	0	112.7	V984 R989 F1073 I1074	V984-I987 HydrophobicContact CB-CD1 4.09Å; V984-I987 HydrophobicContact CB-CG1 4.3Å; V984-I987 HydrophobicContact CG1-CD1 4.16Å; V984-I987 HydrophobicContact CG1-CG1 4.14Å; V984-I987 HydrophobicContact CG2-CD1 4.28Å; I987-R989 PolarHBondContact O-N 3.18Å; I987-F1073 HydrophobicContact CD1-CB 4.45Å; I987-I1074 HydrophobicContact CG2-CD1 4.25Å; I987-I1074 HydrophobicContact CG2-CG1 4.31Å
988	Y	34.8	Very low	35.4	Very low	113 Å²	113	87.9 Å²	87.9	44%	0.443	46%	0.462	S	S	.	.	S	Bend	trans	-62.6	-13.1	-177.2	-68.9	-62.6	0	0	0	115.6	L981 Q982 P985	L981-Y988 VanDerWaalsContact C-OH 3.31Å; L981-Y988 HydrophobicContact CB-CE1 4.32Å; L981-Y988 PolarHBondContact O-OH 3.47Å; Q982-Y988 WeakPolarHBondContact CA-OH 3.44Å; P985-Y988 VanDerWaalsContact O-CD2 3.24Å; P985-Y988 WeakPolarHBondContact O-CD2 3.49Å
989	R	41.3	Very low	35.9	Very low	113 Å²	113	82.5 Å²	82.5	43%	0.426	45%	0.45	S	S	.	.			trans	-158.1	120.5	168.2	-123.6	171.8	169.1	-179.5	-9.4	107.8	I967 I987 A991 N1029	I967-R989 PolarHBondContact O-NH2 3.26Å; I987-R989 PolarHBondContact O-N 3.18Å; R989-A991 VanDerWaalsContact C-N 3.34Å; R989-A991 PolarHBondContact O-N 3.27Å; R989-N1029 WeakPolarHBondContact CA-OD1 3.3Å
990	I	43.7	Very low	36.3	Very low	12 Å²	12	81.9 Å²	81.9	6%	0.062	44%	0.436	C	S	.	.			trans	-65.6	104.5	158.2	-57.1	-178.4	0	0	0	105.5	T1025 M1028 N1029 N1070 I1074	I990-T1025 HydrophobicContact CB-CG2 3.98Å; I990-T1025 HydrophobicContact CG2-CG2 3.86Å; I990-T1025 WeakPolarHBondContact O-CG2 3.38Å; I990-M1028 HydrophobicContact CD1-CB 3.6Å; I990-M1028 HydrophobicContact CD1-CG 4.2Å; I990-N1029 PolarHBondContact N-OD1 2.92Å; I990-N1029 PolarHBondContact O-ND2 2.67Å; I990-N1070 HydrophobicContact CD1-CB 3.9Å; I990-N1070 HydrophobicContact CG1-CB 4.36Å; I990-I1074 HydrophobicContact CD1-CD1 4.47Å
991	A	42.1	Very low	36.7	Very low	81 Å²	81	84.5 Å²	84.5	67%	0.669	45%	0.445	S	S	*	.			trans	-113.7	108.5	177.5	0	0	0	0	0	107.9	R989	R989-A991 VanDerWaalsContact C-N 3.34Å; R989-A991 PolarHBondContact O-N 3.27Å
992	L	40.3	Very low	37.1	Very low	31 Å²	31	89 Å²	89	16%	0.162	47%	0.47	C	S	.	.			trans	-81.1	133.8	171.6	-65.6	159.9	0	0	0	108.3	L997 I1021 T1025 I1067	L992-L997 HydrophobicContact CB-CD1 4.23Å; L992-L997 HydrophobicContact CD1-CD2 4.47Å; L992-I1021 HydrophobicContact CD1-CG2 3.19Å; L992-T1025 HydrophobicContact CD1-CG2 4.41Å; L992-T1025 VanDerWaalsContact CD1-OG1 3.3Å; L992-T1025 WeakPolarHBondContact CD1-OG1 3.49Å; L992-I1067 HydrophobicContact CD1-CD1 4.15Å; L992-I1067 HydrophobicContact CD2-CD1 4.27Å; L992-I1067 HydrophobicContact CD2-CG1 4.1Å
993	K	44.2	Very low	37.5	Very low	137 Å²	137	86.2 Å²	86.2	60%	0.596	46%	0.463	S	S	*	.			trans	-74.6	152.3	167.7	-59.1	174.1	179.4	174.1	0	108.5	N995 D996	K993-N995 PolarHBondContact O-N 3.45Å; K993-D996 WeakPolarHBondContact CB-OD2 3.39Å; K993-D996 PolarHBondContact N-OD2 2.86Å; K993-D996 VanDerWaalsContact N-OD2 3.16Å; K993-D996 PolarHBondContact O-N 2.86Å
994	S	38.5	Very low	37.5	Very low	48 Å²	48	89 Å²	89	34%	0.336	48%	0.478	S	S	.	.	S	Bend	trans	-56.7	-36.6	174.5	39.1	0	0	0	0	112.4	L997 L998	S994-L997 WeakPolarHBondContact O-CB 3.42Å; S994-L997 PolarHBondContact O-N 2.91Å; S994-L998 PolarHBondContact O-N 2.84Å
995	N	38.9	Very low	37.4	Very low	89 Å²	89	94.5 Å²	94.5	48%	0.476	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-68.3	-43.9	-177.9	-58.7	37.2	0	0	0	110.8	K993 L997 L998 D999	K993-N995 PolarHBondContact O-N 3.45Å; N995-L997 PolarHBondContact O-N 2.85Å; N995-L998 PolarHBondContact O-N 3.23Å; N995-D999 WeakPolarHBondContact CA-OD1 3.44Å; N995-D999 WeakPolarHBondContact CB-OD2 3.33Å; N995-D999 WeakPolarHBondContact O-CB 3.23Å; N995-D999 PolarHBondContact O-N 3.33Å
996	D	42.7	Very low	37.3	Very low	56 Å²	56	93.3 Å²	93.3	30%	0.299	49%	0.486	S	S	.	.	G	3₁₀ helix	trans	-58.6	-14.6	174.9	-49.9	-28.9	0	0	0	113.7	K993 I1066	K993-D996 WeakPolarHBondContact CB-OD2 3.39Å; K993-D996 PolarHBondContact N-OD2 2.86Å; K993-D996 VanDerWaalsContact N-OD2 3.16Å; K993-D996 PolarHBondContact O-N 2.86Å; D996-I1066 HydrophobicContact CB-CD1 4.28Å
997	L	42.8	Very low	37.1	Very low	33 Å²	33	93.1 Å²	93.1	17%	0.173	49%	0.49	C	S	.	.	G	3₁₀ helix	trans	-100.8	-15	177.8	-74.6	165.9	0	0	0	114.4	L992 S994 N995 T1018 I1021	L992-L997 HydrophobicContact CB-CD1 4.23Å; L992-L997 HydrophobicContact CD1-CD2 4.47Å; S994-L997 WeakPolarHBondContact O-CB 3.42Å; S994-L997 PolarHBondContact O-N 2.91Å; N995-L997 PolarHBondContact O-N 2.85Å; L997-T1018 HydrophobicContact CB-CG2 4.28Å; L997-T1018 HydrophobicContact CD1-CG2 4.45Å; L997-T1018 HydrophobicContact CD2-CG2 4.09Å; L997-I1021 HydrophobicContact CD2-CB 4.37Å; L997-I1021 HydrophobicContact CD2-CD1 4.25Å; L997-I1021 HydrophobicContact CD2-CG2 3.69Å
998	L	41.6	Very low	36.7	Very low	82 Å²	82	95 Å²	95	43%	0.429	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.3	-16.4	-167.4	-72.6	170.8	0	0	0	115	S994 N995 N1000	S994-L998 PolarHBondContact O-N 2.84Å; N995-L998 PolarHBondContact O-N 3.23Å; L998-N1000 PolarHBondContact O-N 2.95Å
999	D	37.6	Very low	36.7	Very low	114 Å²	114	98.6 Å²	98.6	61%	0.61	53%	0.528	S	S	*	.			trans	-69.7	7.1	-169.9	-71.7	-0.9	0	0	0	115.7	N995	N995-D999 WeakPolarHBondContact CA-OD1 3.44Å; N995-D999 WeakPolarHBondContact CB-OD2 3.33Å; N995-D999 WeakPolarHBondContact O-CB 3.23Å; N995-D999 PolarHBondContact O-N 3.33Å
1000	N	33.4	Very low	36.5	Very low	68 Å²	68	97.1 Å²	97.1	36%	0.364	53%	0.529	S	S	.	.	S	Bend	trans	-100.3	68.7	168	-77.8	10.7	0	0	0	110.3	L998 N1060	L998-N1000 PolarHBondContact O-N 2.95Å; N1000-N1060 VanDerWaalsContact CB-OD1 3.3Å; N1000-N1060 WeakPolarHBondContact CB-OD1 3.31Å; N1000-N1060 PolarHBondContact ND2-OD1 3.17Å
1001	N	35.1	Very low	36.4	Very low	114 Å²	114	99.2 Å²	99.2	61%	0.61	54%	0.544	S	S	*	.			trans	171.1	109.1	139.5	-87.4	-15.6	0	0	0	111.5	V1003	N1001-V1003 HydrophobicContact CB-CB 4.44Å; N1001-V1003 HydrophobicContact CB-CG2 4.15Å; N1001-V1003 PolarHBondContact O-N 3.41Å
1002	D	32.9	Very low	36.3	Very low	182 Å²	182	98.9 Å²	98.9	97%	0.973	54%	0.537	S	S	*	.			trans	-72.2	57.5	160	-84.2	-41.4	0	0	0	110.8
1003	V	33.3	Very low	36.2	Very low	90 Å²	90	101.3 Å²	101.3	55%	0.545	55%	0.55	S	S	.	*			trans	-109.5	111.3	169.8	-179.3	0	0	0	0	107.1	N1001 Y1005	N1001-V1003 HydrophobicContact CB-CB 4.44Å; N1001-V1003 HydrophobicContact CB-CG2 4.15Å; N1001-V1003 PolarHBondContact O-N 3.41Å; V1003-Y1005 PolarHBondContact O-N 2.9Å
1004	N	29.1	Very low	36.2	Very low	138 Å²	138	97.4 Å²	97.4	74%	0.738	54%	0.535	S	S	*	.			trans	-36	125.1	-175.8	-74.5	-56.4	0	0	0	113.4	S1006	N1004-S1006 PolarHBondContact O-N 2.98Å
1005	Y	28.8	Very low	36.4	Very low	194 Å²	194	96.4 Å²	96.4	76%	0.761	53%	0.528	S	S	*	.	S	Bend	trans	-68	68.7	174.7	-87.9	-96.2	0	0	0	111.8	V1003	V1003-Y1005 PolarHBondContact O-N 2.9Å
1006	S	29	Very low	36.8	Very low	78 Å²	78	93.2 Å²	93.2	55%	0.545	51%	0.514	S	S	.	.	S	Bend	trans	-137.2	108.6	167.1	56.8	0	0	0	0	109.1	N1004 S1008	N1004-S1006 PolarHBondContact O-N 2.98Å; S1006-S1008 VanDerWaalsContact C-N 3.32Å; S1006-S1008 PolarHBondContact O-N 3.17Å
1007	T	31.9	Very low	37	Very low	136 Å²	136	90.9 Å²	90.9	83%	0.834	50%	0.501	S	S	*	.	S	Bend	trans	62.4	1	160.3	61.2	0	0	0	0	120.5
1008	S	29.5	Very low	37.4	Very low	87 Å²	87	90.3 Å²	90.3	61%	0.608	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-80	119.7	165.5	60.7	0	0	0	0	111.1	S1006 L1010	S1006-S1008 VanDerWaalsContact C-N 3.32Å; S1006-S1008 PolarHBondContact O-N 3.17Å; S1008-L1010 PolarHBondContact O-N 3.41Å
1009	Q	34.5	Very low	37.8	Very low	187 Å²	187	88.7 Å²	88.7	87%	0.874	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-53	129.6	175.6	-67.7	171.3	-27	0	0	110.6	S1011	Q1009-S1011 PolarHBondContact O-N 2.92Å; Q1009-S1011 VanDerWaalsContact O-N 3.07Å
1010	L	36.3	Very low	38.6	Very low	83 Å²	83	84.3 Å²	84.3	44%	0.435	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-51.8	121.2	165.6	-88.3	103.6	0	0	0	108	S1008 S1012	S1008-L1010 PolarHBondContact O-N 3.41Å; L1010-S1012 PolarHBondContact O-N 3.3Å
1011	S	42	Very low	39.7	Very low	55 Å²	55	81 Å²	81	39%	0.385	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-53.5	142.6	175.9	62.1	0	0	0	0	109.6	Q1009 D1013 N1014 C1015	Q1009-S1011 PolarHBondContact O-N 2.92Å; Q1009-S1011 VanDerWaalsContact O-N 3.07Å; S1011-D1013 PolarHBondContact O-N 3.39Å; S1011-N1014 PolarHBondContact O-N 3.03Å; S1011-C1015 PolarHBondContact O-N 3.12Å
1012	S	40.1	Very low	40.6	Very low	74 Å²	74	78.5 Å²	78.5	52%	0.517	43%	0.432	S	S	.	.	H	α-helix	trans	-50.3	-30.3	180	42.6	0	0	0	0	112.6	L1010 A1016	L1010-S1012 PolarHBondContact O-N 3.3Å; S1012-A1016 PolarHBondContact O-N 2.84Å
1013	D	38.4	Very low	41.6	Very low	83 Å²	83	72 Å²	72	44%	0.444	40%	0.397	S	S	.	.	H	α-helix	trans	-83.5	-39.4	-167.9	-47.2	-19.4	0	0	0	110.6	S1011 C1015 A1016 Y1017 V1058	S1011-D1013 PolarHBondContact O-N 3.39Å; D1013-C1015 VanDerWaalsContact C-N 3.3Å; D1013-C1015 PolarHBondContact O-N 3.08Å; D1013-A1016 WeakPolarHBondContact O-CB 3.41Å; D1013-A1016 PolarHBondContact O-N 3.27Å; D1013-Y1017 WeakPolarHBondContact O-CB 3.43Å; D1013-Y1017 PolarHBondContact O-N 2.81Å; D1013-V1058 HydrophobicContact CB-CG1 4.45Å
1014	N	43.9	Very low	42.8	Very low	54 Å²	54	67.9 Å²	67.9	29%	0.289	37%	0.371	S	S	.	.	H	α-helix	trans	-61.5	-39.5	170.2	-84.5	-9.9	0	0	0	111.6	S1011 A1016 T1018 N1060	S1011-N1014 PolarHBondContact O-N 3.03Å; N1014-A1016 VanDerWaalsContact C-N 3.32Å; N1014-A1016 PolarHBondContact O-N 2.86Å; N1014-T1018 PolarHBondContact O-N 3.44Å; N1014-T1018 PolarHBondContact O-OG1 3.07Å; N1014-N1060 PolarHBondContact OD1-ND2 2.97Å
1015	C	43.4	Very low	44.1	Very low	27 Å²	27	61.8 Å²	61.8	18%	0.182	34%	0.339	C	S	.	.	H	α-helix	trans	-67.6	-31.1	173.1	-70.6	0	0	0	0	112.4	S1011 D1013 T1018 R1019	S1011-C1015 PolarHBondContact O-N 3.12Å; D1013-C1015 VanDerWaalsContact C-N 3.3Å; D1013-C1015 PolarHBondContact O-N 3.08Å; C1015-T1018 PolarHBondContact O-OG1 3.42Å; C1015-R1019 VanDerWaalsContact C-NH2 3.35Å; C1015-R1019 WeakPolarHBondContact O-CG 3.39Å; C1015-R1019 PolarHBondContact O-N 3.05Å; C1015-R1019 PolarHBondContact O-NE 2.98Å; C1015-R1019 PolarHBondContact O-NH2 3.41Å
1016	A	45.7	Very low	45.3	Very low	22 Å²	22	55.9 Å²	55.9	18%	0.182	32%	0.319	C	S	.	.	H	α-helix	trans	-73.6	-42.2	176.9	0	0	0	0	0	111.1	S1012 D1013 N1014 R1019 H1020	S1012-A1016 PolarHBondContact O-N 2.84Å; D1013-A1016 WeakPolarHBondContact O-CB 3.41Å; D1013-A1016 PolarHBondContact O-N 3.27Å; N1014-A1016 VanDerWaalsContact C-N 3.32Å; N1014-A1016 PolarHBondContact O-N 2.86Å; A1016-R1019 WeakPolarHBondContact O-CB 3.43Å; A1016-R1019 PolarHBondContact O-N 3.33Å; A1016-H1020 PolarHBondContact O-CD2 3.4Å; A1016-H1020 PolarHBondContact O-N 2.88Å
1017	Y	48.5	Very low	46.5	Very low	8 Å²	8	53 Å²	53	3%	0.031	30%	0.297	C	S	.	.	H	α-helix	trans	-56.3	-51.6	175.2	173.5	-103	0	0	0	112.6	D1013 R1019 H1020 I1021 I1055 V1058 N1060 V1064	D1013-Y1017 WeakPolarHBondContact O-CB 3.43Å; D1013-Y1017 PolarHBondContact O-N 2.81Å; Y1017-R1019 VanDerWaalsContact C-N 3.29Å; Y1017-R1019 PolarHBondContact O-N 2.66Å; Y1017-H1020 PolarHBondContact O-N 3.14Å; Y1017-I1021 HydrophobicContact CD1-CD1 4.21Å; Y1017-I1021 HydrophobicContact CD2-CD1 4.09Å; Y1017-I1021 HydrophobicContact CE1-CD1 3.61Å; Y1017-I1021 HydrophobicContact CE2-CD1 3.46Å; Y1017-I1021 VanDerWaalsContact CE2-CD1 3.46Å; Y1017-I1021 HydrophobicContact CE2-CG1 4.4Å; Y1017-I1021 HydrophobicContact CG-CD1 4.42Å; Y1017-I1021 PolarHBondContact O-N 2.92Å; Y1017-I1021 VanDerWaalsContact OH-CD1 3.31Å; Y1017-I1021 WeakPolarHBondContact OH-CD1 3.47Å; Y1017-I1055 HydrophobicContact CD2-CG2 4.23Å; Y1017-I1055 HydrophobicContact CE2-CG2 3.89Å; Y1017-V1058 HydrophobicContact CD2-CB 4.19Å; Y1017-V1058 HydrophobicContact CD2-CG1 4.38Å; Y1017-V1058 HydrophobicContact CG-CG1 4.5Å; Y1017-N1060 HydrophobicContact CD1-CB 4.48Å; Y1017-N1060 HydrophobicContact CE1-CB 4.08Å; Y1017-N1060 HydrophobicContact CE2-CB 4.27Å; Y1017-N1060 WeakPolarHBondContact CE2-O 3.27Å; Y1017-N1060 PolarHBondContact OH-O 3.46Å; Y1017-V1064 HydrophobicContact CE2-CG2 3.73Å
1018	T	50.7	Low	47.5	Very low	20 Å²	20	46.7 Å²	46.7	12%	0.123	26%	0.258	C	S	.	.	H	α-helix	trans	-58	-39.7	174.8	24.7	0	0	0	0	112.3	L997 N1014 C1015 L1022	L997-T1018 HydrophobicContact CB-CG2 4.28Å; L997-T1018 HydrophobicContact CD1-CG2 4.45Å; L997-T1018 HydrophobicContact CD2-CG2 4.09Å; N1014-T1018 PolarHBondContact O-N 3.44Å; N1014-T1018 PolarHBondContact O-OG1 3.07Å; C1015-T1018 PolarHBondContact O-OG1 3.42Å; T1018-L1022 WeakPolarHBondContact O-CB 3.37Å; T1018-L1022 VanDerWaalsContact O-CG 3.28Å; T1018-L1022 WeakPolarHBondContact O-CG 3.3Å; T1018-L1022 PolarHBondContact O-N 3.48Å
1019	R	50.1	Low	48.7	Very low	49 Å²	49	43 Å²	43	19%	0.185	23%	0.232	C	C	.	.	H	α-helix	trans	-61.7	-47.8	175.9	-81	174.2	-92.6	167.6	-1.8	112.4	I930 L934 C1015 A1016 Y1017 L1023	I930-R1019 HydrophobicContact CG2-CG 4.42Å; L934-R1019 HydrophobicContact CD1-CG 4.27Å; L934-R1019 HydrophobicContact CD2-CG 3.93Å; L934-R1019 HydrophobicContact CG-CG 4.37Å; C1015-R1019 VanDerWaalsContact C-NH2 3.35Å; C1015-R1019 WeakPolarHBondContact O-CG 3.39Å; C1015-R1019 PolarHBondContact O-N 3.05Å; C1015-R1019 PolarHBondContact O-NE 2.98Å; C1015-R1019 PolarHBondContact O-NH2 3.41Å; A1016-R1019 WeakPolarHBondContact O-CB 3.43Å; A1016-R1019 PolarHBondContact O-N 3.33Å; Y1017-R1019 VanDerWaalsContact C-N 3.29Å; Y1017-R1019 PolarHBondContact O-N 2.66Å; R1019-L1023 WeakPolarHBondContact O-CB 3.49Å; R1019-L1023 PolarHBondContact O-N 3.04Å
1020	H	53.6	Low	49.6	Very low	21 Å²	21	38 Å²	38	10%	0.097	21%	0.205	C	C	.	.	H	α-helix	trans	-67.3	-40.3	-179.4	-76	-68.8	0	0	0	112.2	H862 A1016 Y1017 L1023 L1024 Q1051 I1055	H862-H1020 AromaticContact CE1-CE1 3.87Å; H862-H1020 AromaticContact CE1-NE2 3.62Å; A1016-H1020 PolarHBondContact O-CD2 3.4Å; A1016-H1020 PolarHBondContact O-N 2.88Å; Y1017-H1020 PolarHBondContact O-N 3.14Å; H1020-L1023 PolarHBondContact O-N 2.98Å; H1020-L1024 WeakPolarHBondContact O-CB 3.49Å; H1020-L1024 PolarHBondContact O-N 3.26Å; H1020-Q1051 PolarHBondContact ND1-OE1 3.33Å; H1020-I1055 HydrophobicContact CB-CD1 4.2Å; H1020-I1055 HydrophobicContact CB-CG1 3.64Å
1021	I	56.6	Low	50.4	Low	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63.9	-45.8	176	-81.7	-179.8	0	0	0	112.3	L992 L997 Y1017 L1023 L1024 T1025 I1055 I1067	L992-I1021 HydrophobicContact CD1-CG2 3.19Å; L997-I1021 HydrophobicContact CD2-CB 4.37Å; L997-I1021 HydrophobicContact CD2-CD1 4.25Å; L997-I1021 HydrophobicContact CD2-CG2 3.69Å; Y1017-I1021 HydrophobicContact CD1-CD1 4.21Å; Y1017-I1021 HydrophobicContact CD2-CD1 4.09Å; Y1017-I1021 HydrophobicContact CE1-CD1 3.61Å; Y1017-I1021 HydrophobicContact CE2-CD1 3.46Å; Y1017-I1021 VanDerWaalsContact CE2-CD1 3.46Å; Y1017-I1021 HydrophobicContact CE2-CG1 4.4Å; Y1017-I1021 HydrophobicContact CG-CD1 4.42Å; Y1017-I1021 PolarHBondContact O-N 2.92Å; Y1017-I1021 VanDerWaalsContact OH-CD1 3.31Å; Y1017-I1021 WeakPolarHBondContact OH-CD1 3.47Å; I1021-L1023 VanDerWaalsContact C-N 3.3Å; I1021-L1023 PolarHBondContact O-N 3.32Å; I1021-L1024 PolarHBondContact O-N 2.97Å; I1021-T1025 VanDerWaalsContact O-CB 3.32Å; I1021-T1025 WeakPolarHBondContact O-CB 3.41Å; I1021-T1025 PolarHBondContact O-N 3.26Å; I1021-T1025 PolarHBondContact O-OG1 2.91Å; I1021-I1055 HydrophobicContact CD1-CG2 4.3Å; I1021-I1055 HydrophobicContact CG1-CD1 3.7Å; I1021-I1055 HydrophobicContact CG1-CG1 4.06Å; I1021-I1055 HydrophobicContact CG1-CG2 4.13Å; I1021-I1067 HydrophobicContact CB-CD1 4.17Å; I1021-I1067 HydrophobicContact CD1-CD1 4.2Å; I1021-I1067 HydrophobicContact CG1-CD1 3.86Å; I1021-I1067 HydrophobicContact CG2-CD1 3.54Å
1022	L	54.6	Low	50.9	Low	61 Å²	61	33.7 Å²	33.7	32%	0.319	18%	0.18	S	C	.	.	H	α-helix	trans	-63.5	-37.4	176.7	-72.6	169.6	0	0	0	111.6	A933 T1018 T1025 E1026	A933-L1022 HydrophobicContact CB-CD1 3.7Å; T1018-L1022 WeakPolarHBondContact O-CB 3.37Å; T1018-L1022 VanDerWaalsContact O-CG 3.28Å; T1018-L1022 WeakPolarHBondContact O-CG 3.3Å; T1018-L1022 PolarHBondContact O-N 3.48Å; L1022-T1025 PolarHBondContact O-N 3.48Å; L1022-E1026 PolarHBondContact O-N 2.92Å
1023	L	54.3	Low	51.5	Low	45 Å²	45	35.7 Å²	35.7	24%	0.236	18%	0.183	C	C	.	.	H	α-helix	trans	-64.5	-48.3	175.3	-159.5	88.6	0	0	0	111.7	T926 I930 R1019 H1020 I1021 T1025 E1026 I1027 Q1051	T926-L1023 HydrophobicContact CG2-CD1 4.33Å; I930-L1023 HydrophobicContact CD1-CD1 3.7Å; R1019-L1023 WeakPolarHBondContact O-CB 3.49Å; R1019-L1023 PolarHBondContact O-N 3.04Å; H1020-L1023 PolarHBondContact O-N 2.98Å; I1021-L1023 VanDerWaalsContact C-N 3.3Å; I1021-L1023 PolarHBondContact O-N 3.32Å; L1023-T1025 VanDerWaalsContact C-N 3.3Å; L1023-T1025 PolarHBondContact O-N 2.94Å; L1023-E1026 PolarHBondContact O-N 3.17Å; L1023-I1027 HydrophobicContact CD2-CD1 3.98Å; L1023-I1027 HydrophobicContact CG-CD1 3.98Å; L1023-I1027 WeakPolarHBondContact O-CD1 3.41Å; L1023-I1027 VanDerWaalsContact O-CG1 3.23Å; L1023-I1027 WeakPolarHBondContact O-CG1 3.33Å; L1023-I1027 PolarHBondContact O-N 2.81Å; L1023-Q1051 HydrophobicContact CD2-CG 4.02Å
1024	L	58.6	Low	52.1	Low	3 Å²	3	37 Å²	37	2%	0.016	19%	0.185	C	C	.	.	H	α-helix	trans	-58.1	-44.9	176.7	177.3	54.9	0	0	0	110.8	H1020 I1021 E1026 I1027 M1028 V1048 Q1051 I1052 I1055 I1067	H1020-L1024 WeakPolarHBondContact O-CB 3.49Å; H1020-L1024 PolarHBondContact O-N 3.26Å; I1021-L1024 PolarHBondContact O-N 2.97Å; L1024-E1026 PolarHBondContact O-N 3.28Å; L1024-I1027 PolarHBondContact O-N 3.22Å; L1024-M1028 HydrophobicContact CD1-CG 4.01Å; L1024-M1028 HydrophobicContact CG-CG 4.47Å; L1024-M1028 WeakPolarHBondContact O-CB 3.35Å; L1024-M1028 VanDerWaalsContact O-CG 3.28Å; L1024-M1028 WeakPolarHBondContact O-CG 3.43Å; L1024-M1028 PolarHBondContact O-N 2.7Å; L1024-V1048 HydrophobicContact CD1-CB 4.23Å; L1024-V1048 HydrophobicContact CD1-CG1 4.08Å; L1024-V1048 HydrophobicContact CD1-CG2 4.05Å; L1024-Q1051 HydrophobicContact CB-CB 3.92Å; L1024-Q1051 HydrophobicContact CB-CG 4.42Å; L1024-Q1051 HydrophobicContact CD1-CB 4.17Å; L1024-Q1051 HydrophobicContact CD2-CB 4.46Å; L1024-Q1051 HydrophobicContact CG-CB 4.4Å; L1024-I1052 HydrophobicContact CD1-CG1 4.46Å; L1024-I1052 HydrophobicContact CD2-CG1 3.94Å; L1024-I1055 HydrophobicContact CB-CD1 4.16Å; L1024-I1055 HydrophobicContact CD2-CD1 3.55Å; L1024-I1067 HydrophobicContact CD2-CG2 3.54Å; L1024-I1067 HydrophobicContact CG-CG2 3.85Å
1025	T	55.7	Low	52.3	Low	10 Å²	10	37 Å²	37	6%	0.061	19%	0.188	C	C	.	.	H	α-helix	trans	-59.6	-45	178.5	-59.9	0	0	0	0	112.4	I990 L992 I1021 L1022 L1023 M1028 N1029	I990-T1025 HydrophobicContact CB-CG2 3.98Å; I990-T1025 HydrophobicContact CG2-CG2 3.86Å; I990-T1025 WeakPolarHBondContact O-CG2 3.38Å; L992-T1025 HydrophobicContact CD1-CG2 4.41Å; L992-T1025 VanDerWaalsContact CD1-OG1 3.3Å; L992-T1025 WeakPolarHBondContact CD1-OG1 3.49Å; I1021-T1025 VanDerWaalsContact O-CB 3.32Å; I1021-T1025 WeakPolarHBondContact O-CB 3.41Å; I1021-T1025 PolarHBondContact O-N 3.26Å; I1021-T1025 PolarHBondContact O-OG1 2.91Å; L1022-T1025 PolarHBondContact O-N 3.48Å; L1023-T1025 VanDerWaalsContact C-N 3.3Å; L1023-T1025 PolarHBondContact O-N 2.94Å; T1025-M1028 PolarHBondContact O-N 2.95Å; T1025-N1029 WeakPolarHBondContact O-CB 3.35Å; T1025-N1029 VanDerWaalsContact O-CG 3.25Å; T1025-N1029 PolarHBondContact O-N 3.27Å; T1025-N1029 PolarHBondContact O-ND2 3.19Å
1026	E	54.4	Low	52.4	Low	70 Å²	70	42 Å²	42	33%	0.327	21%	0.213	S	C	.	.	H	α-helix	trans	-68.1	-37.8	175.3	-81.4	-71.1	142.4	0	0	113	L1022 L1023 L1024 N1029 Y1030	L1022-E1026 PolarHBondContact O-N 2.92Å; L1023-E1026 PolarHBondContact O-N 3.17Å; L1024-E1026 PolarHBondContact O-N 3.28Å; E1026-N1029 PolarHBondContact O-N 2.87Å; E1026-Y1030 WeakPolarHBondContact O-CB 3.3Å; E1026-Y1030 PolarHBondContact O-N 3.05Å
1027	I	53	Low	52.4	Low	19 Å²	19	48.5 Å²	48.5	10%	0.097	23%	0.234	C	C	.	.	H	α-helix	trans	-62.8	-43.8	174.7	-66.9	158.9	0	0	0	110.4	L1023 L1024 Y1030 L1031 L1044 L1047 V1048 Q1051	L1023-I1027 HydrophobicContact CD2-CD1 3.98Å; L1023-I1027 HydrophobicContact CG-CD1 3.98Å; L1023-I1027 WeakPolarHBondContact O-CD1 3.41Å; L1023-I1027 VanDerWaalsContact O-CG1 3.23Å; L1023-I1027 WeakPolarHBondContact O-CG1 3.33Å; L1023-I1027 PolarHBondContact O-N 2.81Å; L1024-I1027 PolarHBondContact O-N 3.22Å; I1027-Y1030 WeakPolarHBondContact O-CB 3.42Å; I1027-Y1030 PolarHBondContact O-N 3.42Å; I1027-L1031 HydrophobicContact CG2-CD1 4.49Å; I1027-L1031 PolarHBondContact O-N 3.43Å; I1027-L1044 HydrophobicContact CG2-CB 4.38Å; I1027-L1044 HydrophobicContact CG2-CD2 4.04Å; I1027-L1047 HydrophobicContact CD1-CB 4.03Å; I1027-L1047 HydrophobicContact CG2-CB 4.47Å; I1027-V1048 HydrophobicContact CG2-CG2 3.62Å; I1027-Q1051 HydrophobicContact CD1-CG 4.09Å
1028	M	54.6	Low	52.1	Low	2 Å²	2	50.4 Å²	50.4	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-65.4	-44.4	176.9	-71.3	-54.7	-63.7	0	0	112.4	I990 L1024 T1025 Y1030 L1031 V1032 V1048 L1071 I1074	I990-M1028 HydrophobicContact CD1-CB 3.6Å; I990-M1028 HydrophobicContact CD1-CG 4.2Å; L1024-M1028 HydrophobicContact CD1-CG 4.01Å; L1024-M1028 HydrophobicContact CG-CG 4.47Å; L1024-M1028 WeakPolarHBondContact O-CB 3.35Å; L1024-M1028 VanDerWaalsContact O-CG 3.28Å; L1024-M1028 WeakPolarHBondContact O-CG 3.43Å; L1024-M1028 PolarHBondContact O-N 2.7Å; T1025-M1028 PolarHBondContact O-N 2.95Å; M1028-Y1030 PolarHBondContact O-N 3.31Å; M1028-L1031 WeakPolarHBondContact O-CB 3.47Å; M1028-L1031 PolarHBondContact O-N 3.04Å; M1028-L1031 VanDerWaalsContact O-N 3.14Å; M1028-L1031 HydrophobicContact SD-CD1 3.79Å; M1028-V1032 PolarHBondContact O-N 3.01Å; M1028-V1048 HydrophobicContact CG-CG2 4.41Å; M1028-V1048 HydrophobicContact SD-CG1 4.17Å; M1028-V1048 HydrophobicContact SD-CG2 3.48Å; M1028-V1048 WeakPolarHBondContact SD-CG2 3.5Å; M1028-L1071 HydrophobicContact CE-CD2 3.46Å; M1028-L1071 VanDerWaalsContact CE-CD2 3.46Å; M1028-L1071 HydrophobicContact CE-CG 3.86Å; M1028-L1071 HydrophobicContact CG-CD2 4.5Å; M1028-L1071 HydrophobicContact SD-CD2 3.42Å; M1028-L1071 WeakPolarHBondContact SD-CD2 3.19Å; M1028-L1071 HydrophobicContact SD-CG 4.07Å; M1028-I1074 HydrophobicContact CE-CB 4.09Å; M1028-I1074 HydrophobicContact CE-CD1 3.4Å; M1028-I1074 HydrophobicContact CE-CG1 4.32Å; M1028-I1074 HydrophobicContact CE-CG2 4Å
1029	N	54.1	Low	51.5	Low	10 Å²	10	55 Å²	55	5%	0.053	28%	0.275	C	S	.	.	H	α-helix	trans	-59.4	-36.3	173.3	-74	-31.7	0	0	0	111.4	R989 I990 T1025 E1026 V1032 I1033	R989-N1029 WeakPolarHBondContact CA-OD1 3.3Å; I990-N1029 PolarHBondContact N-OD1 2.92Å; I990-N1029 PolarHBondContact O-ND2 2.67Å; T1025-N1029 WeakPolarHBondContact O-CB 3.35Å; T1025-N1029 VanDerWaalsContact O-CG 3.25Å; T1025-N1029 PolarHBondContact O-N 3.27Å; T1025-N1029 PolarHBondContact O-ND2 3.19Å; E1026-N1029 PolarHBondContact O-N 2.87Å; N1029-V1032 PolarHBondContact O-N 3.03Å; N1029-I1033 VanDerWaalsContact O-CD1 3.27Å; N1029-I1033 WeakPolarHBondContact O-CD1 3.35Å; N1029-I1033 WeakPolarHBondContact O-CG1 3.33Å; N1029-I1033 PolarHBondContact O-N 2.75Å
1030	Y	53.7	Low	51.4	Low	81 Å²	81	54.9 Å²	54.9	32%	0.318	28%	0.28	S	S	.	.	H	α-helix	trans	-68	-37.9	175.3	-161.8	-82.9	0	0	0	113.1	E1026 I1027 M1028 V1032 I1033 L1044	E1026-Y1030 WeakPolarHBondContact O-CB 3.3Å; E1026-Y1030 PolarHBondContact O-N 3.05Å; I1027-Y1030 WeakPolarHBondContact O-CB 3.42Å; I1027-Y1030 PolarHBondContact O-N 3.42Å; M1028-Y1030 PolarHBondContact O-N 3.31Å; Y1030-V1032 VanDerWaalsContact C-N 3.27Å; Y1030-V1032 PolarHBondContact O-N 2.9Å; Y1030-I1033 PolarHBondContact O-N 3.11Å; Y1030-L1044 HydrophobicContact CD1-CD1 3.61Å; Y1030-L1044 HydrophobicContact CD1-CD2 4.25Å; Y1030-L1044 HydrophobicContact CE1-CD1 4.06Å
1031	L	52.8	Low	51.2	Low	7 Å²	7	54.5 Å²	54.5	4%	0.037	28%	0.278	C	S	.	.	H	α-helix	trans	-61.9	-31.7	174.7	-77.4	167.3	0	0	0	112.7	I1027 M1028 Y1041 L1044 V1048 F1080	I1027-L1031 HydrophobicContact CG2-CD1 4.49Å; I1027-L1031 PolarHBondContact O-N 3.43Å; M1028-L1031 WeakPolarHBondContact O-CB 3.47Å; M1028-L1031 PolarHBondContact O-N 3.04Å; M1028-L1031 VanDerWaalsContact O-N 3.14Å; M1028-L1031 HydrophobicContact SD-CD1 3.79Å; L1031-Y1041 HydrophobicContact CB-CE1 4.39Å; L1031-Y1041 HydrophobicContact CD2-CD1 3.39Å; L1031-Y1041 HydrophobicContact CD2-CE1 3.43Å; L1031-Y1041 VanDerWaalsContact CD2-CE1 3.43Å; L1031-Y1041 HydrophobicContact CD2-CG 4.36Å; L1031-Y1041 PolarHBondContact O-OH 3.24Å; L1031-L1044 HydrophobicContact CD1-CB 4.34Å; L1031-L1044 HydrophobicContact CD2-CB 3.55Å; L1031-L1044 HydrophobicContact CD2-CD1 3.82Å; L1031-L1044 HydrophobicContact CD2-CG 4.33Å; L1031-L1044 HydrophobicContact CG-CB 3.94Å; L1031-L1044 HydrophobicContact CG-CD1 4.24Å; L1031-V1048 HydrophobicContact CD1-CG2 3.75Å; L1031-F1080 HydrophobicContact CD2-CE2 4.31Å
1032	V	52.6	Low	50.7	Low	41 Å²	41	55.4 Å²	55.4	25%	0.248	29%	0.287	C	S	.	.	H	α-helix	trans	-77.7	-32.9	176.1	176.8	0	0	0	0	112.1	M1028 N1029 Y1030 I1074	M1028-V1032 PolarHBondContact O-N 3.01Å; N1029-V1032 PolarHBondContact O-N 3.03Å; Y1030-V1032 VanDerWaalsContact C-N 3.27Å; Y1030-V1032 PolarHBondContact O-N 2.9Å; V1032-I1074 HydrophobicContact CG2-CD1 3.8Å; V1032-I1074 HydrophobicContact CG2-CG1 4.42Å
1033	I	52.4	Low	50.3	Low	116 Å²	116	57 Å²	57	60%	0.595	29%	0.292	S	S	*	.	H	α-helix	trans	-84	-16.2	-169.3	-68.1	166	0	0	0	114.1	N1029 Y1030	N1029-I1033 VanDerWaalsContact O-CD1 3.27Å; N1029-I1033 WeakPolarHBondContact O-CD1 3.35Å; N1029-I1033 WeakPolarHBondContact O-CG1 3.33Å; N1029-I1033 PolarHBondContact O-N 2.75Å; Y1030-I1033 PolarHBondContact O-N 3.11Å
1034	K	50.9	Low	50.1	Low	110 Å²	110	55.5 Å²	55.5	48%	0.478	28%	0.284	S	S	.	.			trans	-140.2	76.2	-174.8	-73.4	-159.9	170.3	-163.9	0	116.4	N1036 Y1041	K1034-N1036 VanDerWaalsContact C-N 3.3Å; K1034-N1036 PolarHBondContact O-N 3.48Å; K1034-N1036 VanDerWaalsContact O-N 3.16Å; K1034-Y1041 VanDerWaalsContact C-OH 3.28Å; K1034-Y1041 WeakPolarHBondContact O-CE2 3.32Å; K1034-Y1041 PolarHBondContact O-OH 3.2Å; K1034-Y1041 VanDerWaalsContact O-OH 3.12Å
1035	P	48.1	Very low	49.8	Very low	54 Å²	54	55.5 Å²	55.5	35%	0.351	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-23.8	179.1	16.1	-27.3	0	0	0	117.4	Y1037 Y1041	P1035-Y1037 PolarHBondContact O-N 2.93Å; P1035-Y1041 VanDerWaalsContact CA-OH 3.23Å; P1035-Y1041 WeakPolarHBondContact CA-OH 3.09Å; P1035-Y1041 WeakPolarHBondContact O-CE2 3.46Å
1036	N	45.6	Very low	49.5	Very low	133 Å²	133	60.4 Å²	60.4	71%	0.711	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	14.7	-159.3	-58.8	22.1	0	0	0	116.2	K1034	K1034-N1036 VanDerWaalsContact C-N 3.3Å; K1034-N1036 PolarHBondContact O-N 3.48Å; K1034-N1036 VanDerWaalsContact O-N 3.16Å
1037	Y	45.5	Very low	49.4	Very low	159 Å²	159	59.3 Å²	59.3	62%	0.624	30%	0.297	S	S	*	.			trans	-129.6	97.1	-178.9	-79.4	-89.5	0	0	0	112.9	P1035 V1039 T1040 Y1041	P1035-Y1037 PolarHBondContact O-N 2.93Å; Y1037-V1039 PolarHBondContact O-N 3.04Å; Y1037-T1040 WeakPolarHBondContact CB-OG1 3.32Å; Y1037-T1040 PolarHBondContact O-N 2.65Å; Y1037-T1040 PolarHBondContact O-OG1 3.36Å; Y1037-Y1041 WeakPolarHBondContact O-CD2 3.5Å; Y1037-Y1041 PolarHBondContact O-N 3.28Å
1038	P	43.1	Very low	49.7	Very low	48 Å²	48	58.5 Å²	58.5	31%	0.312	29%	0.293	S	S	.	.	H	α-helix	trans	-66.5	-38	-169.3	22.8	-33.2	0	0	0	114	T1040 Y1041 G1042 P1087	P1038-T1040 PolarHBondContact O-N 3.31Å; P1038-Y1041 PolarHBondContact O-N 3.25Å; P1038-Y1041 VanDerWaalsContact O-N 3.09Å; P1038-G1042 PolarHBondContact O-N 2.73Å; P1038-P1087 HydrophobicContact CB-CB 3.55Å; P1038-P1087 VanDerWaalsContact CB-O 3.24Å; P1038-P1087 WeakPolarHBondContact CB-O 3.4Å; P1038-P1087 HydrophobicContact CG-CB 4.45Å; P1038-P1087 WeakPolarHBondContact CG-O 3.36Å
1039	V	38.4	Very low	49.7	Very low	117 Å²	117	59.2 Å²	59.2	71%	0.709	30%	0.297	S	S	*	.	H	α-helix	trans	-63.3	-29.8	178.1	-177.5	0	0	0	0	111.9	Y1037	Y1037-V1039 PolarHBondContact O-N 3.04Å
1040	T	47.6	Very low	49.7	Very low	45 Å²	45	60 Å²	60	28%	0.276	30%	0.302	S	S	.	.	H	α-helix	trans	-74.8	-32.6	173.9	23.9	0	0	0	0	113	Y1037 P1038 F1043 L1044	Y1037-T1040 WeakPolarHBondContact CB-OG1 3.32Å; Y1037-T1040 PolarHBondContact O-N 2.65Å; Y1037-T1040 PolarHBondContact O-OG1 3.36Å; P1038-T1040 PolarHBondContact O-N 3.31Å; T1040-F1043 PolarHBondContact O-N 3.35Å; T1040-L1044 VanDerWaalsContact O-CB 3.31Å; T1040-L1044 WeakPolarHBondContact O-CB 3.38Å; T1040-L1044 WeakPolarHBondContact O-CD1 3.42Å; T1040-L1044 WeakPolarHBondContact O-CG 3.41Å; T1040-L1044 PolarHBondContact O-N 2.91Å
1041	Y	49.8	Very low	49.8	Very low	13 Å²	13	57.1 Å²	57.1	5%	0.051	29%	0.291	C	S	.	.	H	α-helix	trans	-60.8	-53.2	178.1	-86.9	-79.7	0	0	0	111.6	L1031 K1034 P1035 Y1037 P1038 F1043 L1044 T1045 F1080 L1084	L1031-Y1041 HydrophobicContact CB-CE1 4.39Å; L1031-Y1041 HydrophobicContact CD2-CD1 3.39Å; L1031-Y1041 HydrophobicContact CD2-CE1 3.43Å; L1031-Y1041 VanDerWaalsContact CD2-CE1 3.43Å; L1031-Y1041 HydrophobicContact CD2-CG 4.36Å; L1031-Y1041 PolarHBondContact O-OH 3.24Å; K1034-Y1041 VanDerWaalsContact C-OH 3.28Å; K1034-Y1041 WeakPolarHBondContact O-CE2 3.32Å; K1034-Y1041 PolarHBondContact O-OH 3.2Å; K1034-Y1041 VanDerWaalsContact O-OH 3.12Å; P1035-Y1041 VanDerWaalsContact CA-OH 3.23Å; P1035-Y1041 WeakPolarHBondContact CA-OH 3.09Å; P1035-Y1041 WeakPolarHBondContact O-CE2 3.46Å; Y1037-Y1041 WeakPolarHBondContact O-CD2 3.5Å; Y1037-Y1041 PolarHBondContact O-N 3.28Å; P1038-Y1041 PolarHBondContact O-N 3.25Å; P1038-Y1041 VanDerWaalsContact O-N 3.09Å; Y1041-F1043 PolarHBondContact O-N 3.06Å; Y1041-L1044 PolarHBondContact O-N 2.75Å; Y1041-T1045 VanDerWaalsContact O-CB 3.22Å; Y1041-T1045 WeakPolarHBondContact O-CB 3.36Å; Y1041-T1045 PolarHBondContact O-N 3.39Å; Y1041-T1045 PolarHBondContact O-OG1 3.33Å; Y1041-F1080 HydrophobicContact CD1-CD2 4.18Å; Y1041-F1080 AromaticContact CD1-CE2 3.71Å; Y1041-F1080 HydrophobicContact CD1-CE2 3.71Å; Y1041-F1080 AromaticContact CE1-CD2 3.87Å; Y1041-F1080 HydrophobicContact CE1-CD2 3.87Å; Y1041-F1080 AromaticContact CE1-CE2 3.71Å; Y1041-F1080 HydrophobicContact CE1-CE2 3.71Å; Y1041-L1084 HydrophobicContact CD1-CD1 4.48Å
1042	G	45.3	Very low	50.1	Low	19 Å²	19	56.8 Å²	56.8	20%	0.196	29%	0.29	C	S	.	.	H	α-helix	trans	-57.6	-33.9	178.6	0	0	0	0	0	114.2	P1038 R1046	P1038-G1042 PolarHBondContact O-N 2.73Å; G1042-R1046 WeakPolarHBondContact O-CD 3.01Å; G1042-R1046 VanDerWaalsContact O-CG 3.26Å; G1042-R1046 WeakPolarHBondContact O-CG 3.29Å; G1042-R1046 PolarHBondContact O-N 3.43Å
1043	F	45.2	Very low	50.2	Low	95 Å²	95	58.5 Å²	58.5	42%	0.417	30%	0.295	S	S	.	.	H	α-helix	trans	-75	-47.6	176.3	177	-104.7	0	0	0	113	T1040 Y1041 T1045 R1046 L1047	T1040-F1043 PolarHBondContact O-N 3.35Å; Y1041-F1043 PolarHBondContact O-N 3.06Å; F1043-T1045 VanDerWaalsContact C-N 3.33Å; F1043-T1045 PolarHBondContact O-N 3.24Å; F1043-R1046 PolarHBondContact O-N 2.9Å; F1043-L1047 HydrophobicContact CD1-CD1 4.02Å; F1043-L1047 HydrophobicContact CE1-CD1 3.45Å; F1043-L1047 VanDerWaalsContact CE1-CD1 3.45Å; F1043-L1047 HydrophobicContact CE1-CG 4.27Å; F1043-L1047 HydrophobicContact CZ-CD1 3.77Å; F1043-L1047 HydrophobicContact CZ-CG 4.24Å; F1043-L1047 PolarHBondContact O-N 2.93Å
1044	L	50.3	Low	50.1	Low	14 Å²	14	54.4 Å²	54.4	7%	0.073	27%	0.274	C	S	.	.	H	α-helix	trans	-63.2	-40.8	178.4	-71.4	164.1	0	0	0	111.2	I1027 Y1030 L1031 T1040 Y1041 R1046 L1047 V1048	I1027-L1044 HydrophobicContact CG2-CB 4.38Å; I1027-L1044 HydrophobicContact CG2-CD2 4.04Å; Y1030-L1044 HydrophobicContact CD1-CD1 3.61Å; Y1030-L1044 HydrophobicContact CD1-CD2 4.25Å; Y1030-L1044 HydrophobicContact CE1-CD1 4.06Å; L1031-L1044 HydrophobicContact CD1-CB 4.34Å; L1031-L1044 HydrophobicContact CD2-CB 3.55Å; L1031-L1044 HydrophobicContact CD2-CD1 3.82Å; L1031-L1044 HydrophobicContact CD2-CG 4.33Å; L1031-L1044 HydrophobicContact CG-CB 3.94Å; L1031-L1044 HydrophobicContact CG-CD1 4.24Å; T1040-L1044 VanDerWaalsContact O-CB 3.31Å; T1040-L1044 WeakPolarHBondContact O-CB 3.38Å; T1040-L1044 WeakPolarHBondContact O-CD1 3.42Å; T1040-L1044 WeakPolarHBondContact O-CG 3.41Å; T1040-L1044 PolarHBondContact O-N 2.91Å; Y1041-L1044 PolarHBondContact O-N 2.75Å; L1044-R1046 PolarHBondContact O-N 2.79Å; L1044-L1047 CarbonylContact O-C 3.46Å; L1044-L1047 WeakPolarHBondContact O-CA 3.28Å; L1044-L1047 WeakPolarHBondContact O-CB 3.42Å; L1044-L1047 PolarHBondContact O-N 3.2Å; L1044-L1047 VanDerWaalsContact O-N 3.14Å; L1044-V1048 WeakPolarHBondContact O-CG2 3.48Å; L1044-V1048 PolarHBondContact O-N 3.1Å
1045	T	52.6	Low	50.4	Low	2 Å²	2	49.2 Å²	49.2	1%	0.012	25%	0.251	C	S	.	.	H	α-helix	trans	-64.2	-37.4	176.2	-64.4	0	0	0	0	112.5	Y1041 F1043 V1048 I1049 L1084 L1107	Y1041-T1045 VanDerWaalsContact O-CB 3.22Å; Y1041-T1045 WeakPolarHBondContact O-CB 3.36Å; Y1041-T1045 PolarHBondContact O-N 3.39Å; Y1041-T1045 PolarHBondContact O-OG1 3.33Å; F1043-T1045 VanDerWaalsContact C-N 3.33Å; F1043-T1045 PolarHBondContact O-N 3.24Å; T1045-V1048 WeakPolarHBondContact O-CB 3.34Å; T1045-V1048 PolarHBondContact O-N 3.34Å; T1045-I1049 WeakPolarHBondContact O-CG1 3.38Å; T1045-I1049 PolarHBondContact O-N 3.26Å; T1045-I1049 VanDerWaalsContact O-N 3.07Å; T1045-L1084 HydrophobicContact CG2-CD1 4.19Å; T1045-L1084 VanDerWaalsContact OG1-CD1 3.27Å; T1045-L1084 WeakPolarHBondContact OG1-CD1 3.45Å; T1045-L1107 HydrophobicContact CG2-CD1 3.22Å; T1045-L1107 HydrophobicContact CG2-CD2 4.02Å; T1045-L1107 HydrophobicContact CG2-CG 3.85Å
1046	R	49.8	Very low	50.4	Low	114 Å²	114	47.9 Å²	47.9	43%	0.43	24%	0.243	S	C	.	.	H	α-helix	trans	-66.9	-37.8	171.1	-73.6	171.7	-177	-166.2	-0.2	112.2	G1042 F1043 L1044 I1049 T1050 L1103	G1042-R1046 WeakPolarHBondContact O-CD 3.01Å; G1042-R1046 VanDerWaalsContact O-CG 3.26Å; G1042-R1046 WeakPolarHBondContact O-CG 3.29Å; G1042-R1046 PolarHBondContact O-N 3.43Å; F1043-R1046 PolarHBondContact O-N 2.9Å; L1044-R1046 PolarHBondContact O-N 2.79Å; R1046-I1049 PolarHBondContact O-N 2.87Å; R1046-T1050 PolarHBondContact O-N 3.31Å; R1046-T1050 VanDerWaalsContact O-N 3.09Å; R1046-T1050 PolarHBondContact O-OG1 2.98Å; R1046-L1103 HydrophobicContact CG-CD2 4.12Å
1047	L	51.6	Low	50.5	Low	47 Å²	47	47.5 Å²	47.5	25%	0.246	24%	0.24	C	C	.	.	H	α-helix	trans	-62.5	-43.4	172.4	-72.5	174.8	0	0	0	111.6	I1027 F1043 L1044 T1050 Q1051	I1027-L1047 HydrophobicContact CD1-CB 4.03Å; I1027-L1047 HydrophobicContact CG2-CB 4.47Å; F1043-L1047 HydrophobicContact CD1-CD1 4.02Å; F1043-L1047 HydrophobicContact CE1-CD1 3.45Å; F1043-L1047 VanDerWaalsContact CE1-CD1 3.45Å; F1043-L1047 HydrophobicContact CE1-CG 4.27Å; F1043-L1047 HydrophobicContact CZ-CD1 3.77Å; F1043-L1047 HydrophobicContact CZ-CG 4.24Å; F1043-L1047 PolarHBondContact O-N 2.93Å; L1044-L1047 CarbonylContact O-C 3.46Å; L1044-L1047 WeakPolarHBondContact O-CA 3.28Å; L1044-L1047 WeakPolarHBondContact O-CB 3.42Å; L1044-L1047 PolarHBondContact O-N 3.2Å; L1044-L1047 VanDerWaalsContact O-N 3.14Å; L1047-T1050 WeakPolarHBondContact CA-OG1 3.24Å; L1047-T1050 PolarHBondContact O-N 2.9Å; L1047-T1050 PolarHBondContact O-OG1 3.45Å; L1047-Q1051 WeakPolarHBondContact O-CG 3.44Å; L1047-Q1051 PolarHBondContact O-N 2.86Å
1048	V	59.5	Low	50.5	Low	1 Å²	1	41.4 Å²	41.4	1%	0.006	22%	0.219	C	C	.	.	H	α-helix	trans	-53	-54.5	173.2	163.7	0	0	0	0	111.3	L1024 I1027 M1028 L1031 L1044 T1045 T1050 Q1051 I1052 L1071 L1107	L1024-V1048 HydrophobicContact CD1-CB 4.23Å; L1024-V1048 HydrophobicContact CD1-CG1 4.08Å; L1024-V1048 HydrophobicContact CD1-CG2 4.05Å; I1027-V1048 HydrophobicContact CG2-CG2 3.62Å; M1028-V1048 HydrophobicContact CG-CG2 4.41Å; M1028-V1048 HydrophobicContact SD-CG1 4.17Å; M1028-V1048 HydrophobicContact SD-CG2 3.48Å; M1028-V1048 WeakPolarHBondContact SD-CG2 3.5Å; L1031-V1048 HydrophobicContact CD1-CG2 3.75Å; L1044-V1048 WeakPolarHBondContact O-CG2 3.48Å; L1044-V1048 PolarHBondContact O-N 3.1Å; T1045-V1048 WeakPolarHBondContact O-CB 3.34Å; T1045-V1048 PolarHBondContact O-N 3.34Å; V1048-T1050 PolarHBondContact O-N 3.02Å; V1048-Q1051 PolarHBondContact O-N 2.89Å; V1048-Q1051 VanDerWaalsContact O-N 3.12Å; V1048-I1052 HydrophobicContact CG1-CD1 3.61Å; V1048-I1052 HydrophobicContact CG1-CG1 4.4Å; V1048-I1052 VanDerWaalsContact O-CG1 3.32Å; V1048-I1052 WeakPolarHBondContact O-CG1 3.41Å; V1048-I1052 PolarHBondContact O-N 2.96Å; V1048-L1071 HydrophobicContact CG1-CD1 4.49Å; V1048-L1071 HydrophobicContact CG1-CD2 3.45Å; V1048-L1071 VanDerWaalsContact CG1-CD2 3.45Å; V1048-L1107 HydrophobicContact CG1-CD2 4Å
1049	I	54.3	Low	50.5	Low	18 Å²	18	44 Å²	44	9%	0.092	23%	0.23	C	C	.	.	H	α-helix	trans	-52.8	-53.6	177.5	-64.9	165	0	0	0	110.2	T1045 R1046 Q1051 I1052 E1053 L1107 T1110	T1045-I1049 WeakPolarHBondContact O-CG1 3.38Å; T1045-I1049 PolarHBondContact O-N 3.26Å; T1045-I1049 VanDerWaalsContact O-N 3.07Å; R1046-I1049 PolarHBondContact O-N 2.87Å; I1049-Q1051 VanDerWaalsContact C-N 3.29Å; I1049-Q1051 PolarHBondContact O-N 3.24Å; I1049-I1052 PolarHBondContact O-N 2.95Å; I1049-I1052 VanDerWaalsContact O-N 3.11Å; I1049-E1053 HydrophobicContact CG2-CG 4.32Å; I1049-E1053 WeakPolarHBondContact O-CG 3.39Å; I1049-E1053 PolarHBondContact O-N 3.47Å; I1049-L1107 HydrophobicContact CD1-CD2 4.28Å; I1049-L1107 HydrophobicContact CD1-CG 4.11Å; I1049-L1107 HydrophobicContact CG1-CD2 3.65Å; I1049-L1107 HydrophobicContact CG1-CG 4Å; I1049-T1110 HydrophobicContact CG2-CG2 4.38Å
1050	T	54	Low	51	Low	27 Å²	27	39.9 Å²	39.9	17%	0.166	20%	0.204	C	C	.	.	H	α-helix	trans	-63.4	-29.3	-178.9	57.8	0	0	0	0	114.2	Y845 R1046 L1047 V1048 M1054	Y845-T1050 HydrophobicContact CE2-CG2 4.36Å; R1046-T1050 PolarHBondContact O-N 3.31Å; R1046-T1050 VanDerWaalsContact O-N 3.09Å; R1046-T1050 PolarHBondContact O-OG1 2.98Å; L1047-T1050 WeakPolarHBondContact CA-OG1 3.24Å; L1047-T1050 PolarHBondContact O-N 2.9Å; L1047-T1050 PolarHBondContact O-OG1 3.45Å; V1048-T1050 PolarHBondContact O-N 3.02Å; T1050-M1054 WeakPolarHBondContact O-CB 3.41Å; T1050-M1054 WeakPolarHBondContact O-CG 3.43Å; T1050-M1054 PolarHBondContact O-N 2.64Å
1051	Q	57.1	Low	51.1	Low	19 Å²	19	38.6 Å²	38.6	9%	0.089	20%	0.195	C	C	.	.	H	α-helix	trans	-75.9	-37.9	173.6	-64.1	-42.4	-80.6	0	0	111.7	H1020 L1023 L1024 I1027 L1047 V1048 I1049 M1054 I1055	H1020-Q1051 PolarHBondContact ND1-OE1 3.33Å; L1023-Q1051 HydrophobicContact CD2-CG 4.02Å; L1024-Q1051 HydrophobicContact CB-CB 3.92Å; L1024-Q1051 HydrophobicContact CB-CG 4.42Å; L1024-Q1051 HydrophobicContact CD1-CB 4.17Å; L1024-Q1051 HydrophobicContact CD2-CB 4.46Å; L1024-Q1051 HydrophobicContact CG-CB 4.4Å; I1027-Q1051 HydrophobicContact CD1-CG 4.09Å; L1047-Q1051 WeakPolarHBondContact O-CG 3.44Å; L1047-Q1051 PolarHBondContact O-N 2.86Å; V1048-Q1051 PolarHBondContact O-N 2.89Å; V1048-Q1051 VanDerWaalsContact O-N 3.12Å; I1049-Q1051 VanDerWaalsContact C-N 3.29Å; I1049-Q1051 PolarHBondContact O-N 3.24Å; Q1051-M1054 PolarHBondContact O-N 2.75Å; Q1051-I1055 WeakPolarHBondContact O-CB 3.5Å; Q1051-I1055 VanDerWaalsContact O-CD1 3.28Å; Q1051-I1055 WeakPolarHBondContact O-CD1 3.45Å; Q1051-I1055 WeakPolarHBondContact O-CG1 3.44Å; Q1051-I1055 PolarHBondContact O-N 3.34Å
1052	I	58.1	Low	51.2	Low	1 Å²	1	41.6 Å²	41.6	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-61	-49.3	174.4	-64.1	161.7	0	0	0	110.1	L1024 V1048 I1049 M1054 I1055 C1056 L1068 L1071 T1110 I1111 S1114	L1024-I1052 HydrophobicContact CD1-CG1 4.46Å; L1024-I1052 HydrophobicContact CD2-CG1 3.94Å; V1048-I1052 HydrophobicContact CG1-CD1 3.61Å; V1048-I1052 HydrophobicContact CG1-CG1 4.4Å; V1048-I1052 VanDerWaalsContact O-CG1 3.32Å; V1048-I1052 WeakPolarHBondContact O-CG1 3.41Å; V1048-I1052 PolarHBondContact O-N 2.96Å; I1049-I1052 PolarHBondContact O-N 2.95Å; I1049-I1052 VanDerWaalsContact O-N 3.11Å; I1052-M1054 VanDerWaalsContact C-N 3.31Å; I1052-M1054 PolarHBondContact O-N 3.38Å; I1052-I1055 PolarHBondContact O-N 3.39Å; I1052-C1056 PolarHBondContact O-N 3.17Å; I1052-C1056 PolarHBondContact O-SG 2.77Å; I1052-L1068 HydrophobicContact CG1-CD2 4.46Å; I1052-L1068 HydrophobicContact CG2-CD2 3.87Å; I1052-L1071 HydrophobicContact CD1-CD1 3.52Å; I1052-L1071 HydrophobicContact CD1-CD2 4.35Å; I1052-L1071 HydrophobicContact CG1-CD1 3.93Å; I1052-T1110 HydrophobicContact CB-CG2 4.31Å; I1052-T1110 HydrophobicContact CG2-CG2 3.85Å; I1052-I1111 HydrophobicContact CD1-CG1 4.43Å; I1052-S1114 WeakPolarHBondContact CG2-OG 3.31Å
1053	E	54.1	Low	51.4	Low	76 Å²	76	40.8 Å²	40.8	36%	0.355	20%	0.204	S	C	.	.	H	α-helix	trans	-53.2	-47.7	175.9	-72.4	176.4	153.1	0	0	111.1	I1049 C1056 T1110	I1049-E1053 HydrophobicContact CG2-CG 4.32Å; I1049-E1053 WeakPolarHBondContact O-CG 3.39Å; I1049-E1053 PolarHBondContact O-N 3.47Å; E1053-C1056 PolarHBondContact O-N 3.5Å; E1053-T1110 HydrophobicContact CG-CG2 4.07Å
1054	M	51.6	Low	52	Low	31 Å²	31	36.5 Å²	36.5	15%	0.153	19%	0.185	C	C	.	.	H	α-helix	trans	-64.9	-38.5	178.3	-74.7	-64.4	-67.2	0	0	114	L852 T1050 Q1051 I1052 C1056 I1057	L852-M1054 HydrophobicContact CD1-CG 4.34Å; L852-M1054 HydrophobicContact CD1-SD 3.46Å; L852-M1054 WeakPolarHBondContact CD1-SD 3.1Å; L852-M1054 HydrophobicContact CD2-CE 3.67Å; L852-M1054 HydrophobicContact CD2-SD 3.4Å; L852-M1054 WeakPolarHBondContact CD2-SD 3.26Å; L852-M1054 HydrophobicContact CG-SD 4.03Å; T1050-M1054 WeakPolarHBondContact O-CB 3.41Å; T1050-M1054 WeakPolarHBondContact O-CG 3.43Å; T1050-M1054 PolarHBondContact O-N 2.64Å; Q1051-M1054 PolarHBondContact O-N 2.75Å; I1052-M1054 VanDerWaalsContact C-N 3.31Å; I1052-M1054 PolarHBondContact O-N 3.38Å; M1054-C1056 VanDerWaalsContact C-N 3.34Å; M1054-I1057 PolarHBondContact O-N 3.05Å
1055	I	57.3	Low	52.3	Low	1 Å²	1	38.9 Å²	38.9	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-70	-34.4	-179.9	-69	160.8	0	0	0	110.6	Y1017 H1020 I1021 L1024 Q1051 I1052 I1057 V1058 V1064	Y1017-I1055 HydrophobicContact CD2-CG2 4.23Å; Y1017-I1055 HydrophobicContact CE2-CG2 3.89Å; H1020-I1055 HydrophobicContact CB-CD1 4.2Å; H1020-I1055 HydrophobicContact CB-CG1 3.64Å; I1021-I1055 HydrophobicContact CD1-CG2 4.3Å; I1021-I1055 HydrophobicContact CG1-CD1 3.7Å; I1021-I1055 HydrophobicContact CG1-CG1 4.06Å; I1021-I1055 HydrophobicContact CG1-CG2 4.13Å; L1024-I1055 HydrophobicContact CB-CD1 4.16Å; L1024-I1055 HydrophobicContact CD2-CD1 3.55Å; Q1051-I1055 WeakPolarHBondContact O-CB 3.5Å; Q1051-I1055 VanDerWaalsContact O-CD1 3.28Å; Q1051-I1055 WeakPolarHBondContact O-CD1 3.45Å; Q1051-I1055 WeakPolarHBondContact O-CG1 3.44Å; Q1051-I1055 PolarHBondContact O-N 3.34Å; I1052-I1055 PolarHBondContact O-N 3.39Å; I1055-I1057 PolarHBondContact O-N 3.21Å; I1055-V1058 PolarHBondContact O-N 3.08Å; I1055-V1064 HydrophobicContact CG2-CB 4.03Å; I1055-V1064 HydrophobicContact CG2-CG1 3.61Å; I1055-V1064 HydrophobicContact CG2-CG2 3.34Å
1056	C	48.5	Very low	52.6	Low	25 Å²	25	42 Å²	42	17%	0.169	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-11.8	179.3	-63	0	0	0	0	114.5	I1052 E1053 M1054 S1114 L1117	I1052-C1056 PolarHBondContact O-N 3.17Å; I1052-C1056 PolarHBondContact O-SG 2.77Å; E1053-C1056 PolarHBondContact O-N 3.5Å; M1054-C1056 VanDerWaalsContact C-N 3.34Å; C1056-S1114 WeakPolarHBondContact SG-CB 3.4Å; C1056-S1114 PolarHBondContact SG-OG 3.04Å; C1056-L1117 HydrophobicContact CB-CD1 4.41Å
1057	I	47.8	Very low	53.1	Low	126 Å²	126	36.7 Å²	36.7	65%	0.646	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-18.6	175.7	-65.5	167	0	0	0	111.2	M1054 I1055	M1054-I1057 PolarHBondContact O-N 3.05Å; I1055-I1057 PolarHBondContact O-N 3.21Å
1058	V	45.5	Very low	53.5	Low	30 Å²	30	34.5 Å²	34.5	18%	0.182	18%	0.18	C	C	.	.	S	Bend	trans	-104.3	123.9	-177.1	-168.5	0	0	0	0	110.4	D1013 Y1017 I1055 N1060	D1013-V1058 HydrophobicContact CB-CG1 4.45Å; Y1017-V1058 HydrophobicContact CD2-CB 4.19Å; Y1017-V1058 HydrophobicContact CD2-CG1 4.38Å; Y1017-V1058 HydrophobicContact CG-CG1 4.5Å; I1055-V1058 PolarHBondContact O-N 3.08Å; V1058-N1060 PolarHBondContact O-N 3.46Å
1059	N	42.5	Very low	53.6	Low	102 Å²	102	36.7 Å²	36.7	55%	0.545	19%	0.191	S	C	.	.	S	Bend	trans	-71.7	39.2	-165.8	-71.2	-12.4	0	0	0	116.4	Y1121	N1059-Y1121 PolarHBondContact OD1-OH 3.48Å
1060	N	48.6	Very low	53.9	Low	31 Å²	31	38.1 Å²	38.1	17%	0.166	20%	0.199	C	C	.	.			trans	-125.6	121.5	170.2	-109.7	-34	0	0	0	109.7	N1000 N1014 Y1017 V1058 V1064	N1000-N1060 VanDerWaalsContact CB-OD1 3.3Å; N1000-N1060 WeakPolarHBondContact CB-OD1 3.31Å; N1000-N1060 PolarHBondContact ND2-OD1 3.17Å; N1014-N1060 PolarHBondContact OD1-ND2 2.97Å; Y1017-N1060 HydrophobicContact CD1-CB 4.48Å; Y1017-N1060 HydrophobicContact CE1-CB 4.08Å; Y1017-N1060 HydrophobicContact CE2-CB 4.27Å; Y1017-N1060 WeakPolarHBondContact CE2-O 3.27Å; Y1017-N1060 PolarHBondContact OH-O 3.46Å; V1058-N1060 PolarHBondContact O-N 3.46Å; N1060-V1064 WeakPolarHBondContact O-CG2 3.43Å
1061	L	48.7	Very low	54.3	Low	18 Å²	18	37 Å²	37	9%	0.094	19%	0.192	C	C	.	.			trans	-111.9	-23	-152.2	-56.4	170.6	0	0	0	114.7	V1064 K1065 I1118 Y1121	L1061-V1064 WeakPolarHBondContact O-CB 3.27Å; L1061-V1064 PolarHBondContact O-N 3.25Å; L1061-K1065 PolarHBondContact O-N 3.49Å; L1061-I1118 HydrophobicContact CB-CG1 4.24Å; L1061-I1118 HydrophobicContact CB-CG2 4.14Å; L1061-I1118 HydrophobicContact CD2-CG1 3.9Å; L1061-Y1121 HydrophobicContact CD1-CD2 4.42Å; L1061-Y1121 HydrophobicContact CD1-CG 4.25Å; L1061-Y1121 HydrophobicContact CD2-CD2 4.47Å
1062	N	51.8	Low	54.6	Low	77 Å²	77	36.3 Å²	36.3	41%	0.412	19%	0.189	S	C	.	.	H	α-helix	trans	-67.8	-49.7	-171.6	-76.6	-26.2	0	0	0	113.4	V1064 K1065 I1066	N1062-V1064 VanDerWaalsContact C-N 3.25Å; N1062-V1064 PolarHBondContact O-N 3.24Å; N1062-K1065 WeakPolarHBondContact O-CB 3.29Å; N1062-K1065 PolarHBondContact O-N 2.83Å; N1062-K1065 VanDerWaalsContact O-N 3.15Å; N1062-I1066 PolarHBondContact O-N 3.05Å
1063	G	51.2	Low	54.8	Low	1 Å²	1	40.9 Å²	40.9	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-60.2	-35.2	177.1	0	0	0	0	0	112.9	I1067	G1063-I1067 WeakPolarHBondContact O-CD1 3.46Å; G1063-I1067 WeakPolarHBondContact O-CG1 3.48Å; G1063-I1067 PolarHBondContact O-N 3.04Å
1064	V	56.5	Low	55.2	Low	6 Å²	6	38 Å²	38	4%	0.036	20%	0.195	C	C	.	.	H	α-helix	trans	-61.6	-46	175.1	-158.8	0	0	0	0	111.2	Y1017 I1055 N1060 L1061 N1062 I1066 I1067 L1068 I1118	Y1017-V1064 HydrophobicContact CE2-CG2 3.73Å; I1055-V1064 HydrophobicContact CG2-CB 4.03Å; I1055-V1064 HydrophobicContact CG2-CG1 3.61Å; I1055-V1064 HydrophobicContact CG2-CG2 3.34Å; N1060-V1064 WeakPolarHBondContact O-CG2 3.43Å; L1061-V1064 WeakPolarHBondContact O-CB 3.27Å; L1061-V1064 PolarHBondContact O-N 3.25Å; N1062-V1064 VanDerWaalsContact C-N 3.25Å; N1062-V1064 PolarHBondContact O-N 3.24Å; V1064-I1066 VanDerWaalsContact C-N 3.32Å; V1064-I1066 PolarHBondContact O-N 3.43Å; V1064-I1067 PolarHBondContact O-N 3.01Å; V1064-I1067 VanDerWaalsContact O-N 3.13Å; V1064-L1068 HydrophobicContact CG1-CD1 3.83Å; V1064-L1068 HydrophobicContact CG1-CG 4.14Å; V1064-L1068 WeakPolarHBondContact O-CB 3.46Å; V1064-L1068 VanDerWaalsContact O-CG 3.31Å; V1064-L1068 WeakPolarHBondContact O-CG 3.47Å; V1064-L1068 PolarHBondContact O-N 3.15Å; V1064-I1118 HydrophobicContact CB-CD1 4.25Å; V1064-I1118 HydrophobicContact CG1-CD1 4.29Å
1065	K	58.1	Low	55.7	Low	64 Å²	64	36.6 Å²	36.6	28%	0.278	19%	0.189	S	C	.	.	H	α-helix	trans	-60.3	-39	-176.9	-156.6	167.5	-171.2	147.2	0	112.3	L1061 N1062 N1069 F1115 I1118 D1119	L1061-K1065 PolarHBondContact O-N 3.49Å; N1062-K1065 WeakPolarHBondContact O-CB 3.29Å; N1062-K1065 PolarHBondContact O-N 2.83Å; N1062-K1065 VanDerWaalsContact O-N 3.15Å; K1065-N1069 PolarHBondContact O-N 3.28Å; K1065-N1069 VanDerWaalsContact O-N 3.12Å; K1065-N1069 PolarHBondContact O-ND2 3.49Å; K1065-F1115 HydrophobicContact CG-CE1 3.9Å; K1065-I1118 HydrophobicContact CD-CG2 4.42Å; K1065-D1119 IonicContact NZ-OD1 2.65Å; K1065-D1119 PolarHBondContact NZ-OD1 3.35Å
1066	I	58.6	Low	56.1	Low	67 Å²	67	37.4 Å²	37.4	34%	0.344	19%	0.193	S	C	.	.	H	α-helix	trans	-65.3	-44.7	176	-61.9	173.4	0	0	0	110.7	D996 N1062 V1064 N1069 N1070	D996-I1066 HydrophobicContact CB-CD1 4.28Å; N1062-I1066 PolarHBondContact O-N 3.05Å; V1064-I1066 VanDerWaalsContact C-N 3.32Å; V1064-I1066 PolarHBondContact O-N 3.43Å; I1066-N1069 PolarHBondContact O-N 3.28Å; I1066-N1070 PolarHBondContact O-N 2.85Å; I1066-N1070 VanDerWaalsContact O-N 3.13Å; I1066-N1070 PolarHBondContact O-ND2 3.29Å
1067	I	58.8	Low	56.9	Low	2 Å²	2	39.8 Å²	39.8	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-70.5	-39.9	-177.7	-58.3	160.5	0	0	0	111.1	L992 I1021 L1024 G1063 V1064 N1070 L1071	L992-I1067 HydrophobicContact CD1-CD1 4.15Å; L992-I1067 HydrophobicContact CD2-CD1 4.27Å; L992-I1067 HydrophobicContact CD2-CG1 4.1Å; I1021-I1067 HydrophobicContact CB-CD1 4.17Å; I1021-I1067 HydrophobicContact CD1-CD1 4.2Å; I1021-I1067 HydrophobicContact CG1-CD1 3.86Å; I1021-I1067 HydrophobicContact CG2-CD1 3.54Å; L1024-I1067 HydrophobicContact CD2-CG2 3.54Å; L1024-I1067 HydrophobicContact CG-CG2 3.85Å; G1063-I1067 WeakPolarHBondContact O-CD1 3.46Å; G1063-I1067 WeakPolarHBondContact O-CG1 3.48Å; G1063-I1067 PolarHBondContact O-N 3.04Å; V1064-I1067 PolarHBondContact O-N 3.01Å; V1064-I1067 VanDerWaalsContact O-N 3.13Å; I1067-N1070 PolarHBondContact O-N 3.34Å; I1067-L1071 HydrophobicContact CG2-CD1 4.05Å; I1067-L1071 WeakPolarHBondContact O-CB 3.4Å; I1067-L1071 WeakPolarHBondContact O-CD1 3.32Å; I1067-L1071 WeakPolarHBondContact O-CG 3.36Å; I1067-L1071 PolarHBondContact O-N 2.84Å
1068	L	60.3	Low	57.6	Low	2 Å²	2	34.8 Å²	34.8	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-62.4	-39.5	174.8	-70.7	171.9	0	0	0	112.6	I1052 V1064 L1071 E1072 I1111 F1115 I1118	I1052-L1068 HydrophobicContact CG1-CD2 4.46Å; I1052-L1068 HydrophobicContact CG2-CD2 3.87Å; V1064-L1068 HydrophobicContact CG1-CD1 3.83Å; V1064-L1068 HydrophobicContact CG1-CG 4.14Å; V1064-L1068 WeakPolarHBondContact O-CB 3.46Å; V1064-L1068 VanDerWaalsContact O-CG 3.31Å; V1064-L1068 WeakPolarHBondContact O-CG 3.47Å; V1064-L1068 PolarHBondContact O-N 3.15Å; L1068-L1071 HydrophobicContact CD2-CD1 4.3Å; L1068-L1071 WeakPolarHBondContact O-CB 3.37Å; L1068-L1071 PolarHBondContact O-N 3.11Å; L1068-E1072 PolarHBondContact O-N 3.12Å; L1068-I1111 HydrophobicContact CD2-CB 4.32Å; L1068-I1111 HydrophobicContact CD2-CG1 3.93Å; L1068-I1111 HydrophobicContact CD2-CG2 4.26Å; L1068-F1115 HydrophobicContact CB-CE1 4.27Å; L1068-F1115 HydrophobicContact CB-CE2 3.82Å; L1068-F1115 HydrophobicContact CB-CZ 3.62Å; L1068-F1115 HydrophobicContact CD1-CD1 4.49Å; L1068-F1115 HydrophobicContact CD1-CD2 4.49Å; L1068-F1115 HydrophobicContact CD1-CE1 4.46Å; L1068-F1115 HydrophobicContact CD1-CE2 4.46Å; L1068-F1115 HydrophobicContact CD1-CZ 4.44Å; L1068-I1118 HydrophobicContact CD1-CD1 3.69Å
1069	N	62.5	Low	58.2	Low	47 Å²	47	35.3 Å²	35.3	25%	0.251	18%	0.182	S	C	.	.	H	α-helix	trans	-62.7	-46.1	172.9	-78.6	-44.9	0	0	0	111.5	K1065 I1066 L1071 E1072 F1073	K1065-N1069 PolarHBondContact O-N 3.28Å; K1065-N1069 VanDerWaalsContact O-N 3.12Å; K1065-N1069 PolarHBondContact O-ND2 3.49Å; I1066-N1069 PolarHBondContact O-N 3.28Å; N1069-L1071 VanDerWaalsContact C-N 3.3Å; N1069-L1071 PolarHBondContact O-N 3.08Å; N1069-E1072 WeakPolarHBondContact O-CB 3.13Å; N1069-E1072 PolarHBondContact O-N 3.02Å; N1069-F1073 VanDerWaalsContact O-CD2 3.24Å; N1069-F1073 WeakPolarHBondContact O-CD2 3.27Å; N1069-F1073 PolarHBondContact O-N 3.02Å; N1069-F1073 VanDerWaalsContact O-N 3.15Å
1070	N	60	Low	59.1	Low	47 Å²	47	31.2 Å²	31.2	25%	0.251	16%	0.159	S	C	.	.	H	α-helix	trans	-64.8	-35	178	-70.6	-26.9	0	0	0	112.3	I990 I1066 I1067 F1073 I1074	I990-N1070 HydrophobicContact CD1-CB 3.9Å; I990-N1070 HydrophobicContact CG1-CB 4.36Å; I1066-N1070 PolarHBondContact O-N 2.85Å; I1066-N1070 VanDerWaalsContact O-N 3.13Å; I1066-N1070 PolarHBondContact O-ND2 3.29Å; I1067-N1070 PolarHBondContact O-N 3.34Å; N1070-F1073 PolarHBondContact O-N 3.32Å; N1070-I1074 WeakPolarHBondContact O-CG1 3.48Å; N1070-I1074 PolarHBondContact O-N 3.24Å; N1070-I1074 VanDerWaalsContact O-N 3.08Å
1071	L	62	Low	59.9	Low	3 Å²	3	29.8 Å²	29.8	2%	0.016	15%	0.151	C	C	.	.	H	α-helix	trans	-60	-49.4	169.9	-89.3	155.8	0	0	0	112.2	M1028 V1048 I1052 I1067 L1068 N1069 F1073 I1074 L1075 I1111	M1028-L1071 HydrophobicContact CE-CD2 3.46Å; M1028-L1071 VanDerWaalsContact CE-CD2 3.46Å; M1028-L1071 HydrophobicContact CE-CG 3.86Å; M1028-L1071 HydrophobicContact CG-CD2 4.5Å; M1028-L1071 HydrophobicContact SD-CD2 3.42Å; M1028-L1071 WeakPolarHBondContact SD-CD2 3.19Å; M1028-L1071 HydrophobicContact SD-CG 4.07Å; V1048-L1071 HydrophobicContact CG1-CD1 4.49Å; V1048-L1071 HydrophobicContact CG1-CD2 3.45Å; V1048-L1071 VanDerWaalsContact CG1-CD2 3.45Å; I1052-L1071 HydrophobicContact CD1-CD1 3.52Å; I1052-L1071 HydrophobicContact CD1-CD2 4.35Å; I1052-L1071 HydrophobicContact CG1-CD1 3.93Å; I1067-L1071 HydrophobicContact CG2-CD1 4.05Å; I1067-L1071 WeakPolarHBondContact O-CB 3.4Å; I1067-L1071 WeakPolarHBondContact O-CD1 3.32Å; I1067-L1071 WeakPolarHBondContact O-CG 3.36Å; I1067-L1071 PolarHBondContact O-N 2.84Å; L1068-L1071 HydrophobicContact CD2-CD1 4.3Å; L1068-L1071 WeakPolarHBondContact O-CB 3.37Å; L1068-L1071 PolarHBondContact O-N 3.11Å; N1069-L1071 VanDerWaalsContact C-N 3.3Å; N1069-L1071 PolarHBondContact O-N 3.08Å; L1071-F1073 VanDerWaalsContact C-N 3.29Å; L1071-F1073 PolarHBondContact O-N 2.87Å; L1071-I1074 PolarHBondContact O-N 3.05Å; L1071-I1074 VanDerWaalsContact O-N 3.11Å; L1071-L1075 WeakPolarHBondContact O-CG 3.39Å; L1071-L1075 PolarHBondContact O-N 3.32Å; L1071-I1111 HydrophobicContact CB-CD1 3.99Å
1072	E	63.1	Low	60.5	Low	5 Å²	5	28.9 Å²	28.9	2%	0.023	15%	0.147	C	C	.	.	H	α-helix	trans	-55.4	-44.4	177.5	-163.2	-158.5	129.6	0	0	111.1	L1068 N1069 L1075 L1076 R1171 K1175	L1068-E1072 PolarHBondContact O-N 3.12Å; N1069-E1072 WeakPolarHBondContact O-CB 3.13Å; N1069-E1072 PolarHBondContact O-N 3.02Å; E1072-L1075 PolarHBondContact O-N 2.97Å; E1072-L1076 HydrophobicContact CG-CD1 4.28Å; E1072-L1076 WeakPolarHBondContact O-CD1 3.47Å; E1072-L1076 VanDerWaalsContact O-CG 3.25Å; E1072-L1076 WeakPolarHBondContact O-CG 3.45Å; E1072-L1076 PolarHBondContact O-N 3.12Å; E1072-L1076 VanDerWaalsContact O-N 3.12Å; E1072-R1171 IonicContact OE2-NH1 3.95Å; E1072-K1175 IonicContact OE1-NZ 2.77Å; E1072-K1175 PolarHBondContact OE1-NZ 3.26Å
1073	F	63.2	Low	60.7	Low	98 Å²	98	26.8 Å²	26.8	43%	0.43	14%	0.138	S	C	.	.	H	α-helix	trans	-65.6	-36.4	176.5	-78.8	-69.5	0	0	0	113.9	I987 N1069 N1070 L1071 L1076 H1077	I987-F1073 HydrophobicContact CD1-CB 4.45Å; N1069-F1073 VanDerWaalsContact O-CD2 3.24Å; N1069-F1073 WeakPolarHBondContact O-CD2 3.27Å; N1069-F1073 PolarHBondContact O-N 3.02Å; N1069-F1073 VanDerWaalsContact O-N 3.15Å; N1070-F1073 PolarHBondContact O-N 3.32Å; L1071-F1073 VanDerWaalsContact C-N 3.29Å; L1071-F1073 PolarHBondContact O-N 2.87Å; F1073-L1076 PolarHBondContact O-N 2.93Å; F1073-H1077 PolarHBondContact O-N 2.87Å
1074	I	61.8	Low	60.9	Low	14 Å²	14	26.9 Å²	26.9	7%	0.072	14%	0.138	C	C	.	.	H	α-helix	trans	-72	-36.1	177.6	-71.8	167.3	0	0	0	111.2	I987 I990 M1028 V1032 N1070 L1071 L1076 H1077 F1080	I987-I1074 HydrophobicContact CG2-CD1 4.25Å; I987-I1074 HydrophobicContact CG2-CG1 4.31Å; I990-I1074 HydrophobicContact CD1-CD1 4.47Å; M1028-I1074 HydrophobicContact CE-CB 4.09Å; M1028-I1074 HydrophobicContact CE-CD1 3.4Å; M1028-I1074 HydrophobicContact CE-CG1 4.32Å; M1028-I1074 HydrophobicContact CE-CG2 4Å; V1032-I1074 HydrophobicContact CG2-CD1 3.8Å; V1032-I1074 HydrophobicContact CG2-CG1 4.42Å; N1070-I1074 WeakPolarHBondContact O-CG1 3.48Å; N1070-I1074 PolarHBondContact O-N 3.24Å; N1070-I1074 VanDerWaalsContact O-N 3.08Å; L1071-I1074 PolarHBondContact O-N 3.05Å; L1071-I1074 VanDerWaalsContact O-N 3.11Å; I1074-L1076 VanDerWaalsContact C-N 3.28Å; I1074-L1076 PolarHBondContact O-N 3.33Å; I1074-H1077 WeakPolarHBondContact O-CB 3.2Å; I1074-H1077 PolarHBondContact O-N 2.9Å; I1074-F1080 HydrophobicContact CG2-CD2 4.21Å; I1074-F1080 HydrophobicContact CG2-CE2 4.27Å
1075	L	63.2	Low	60.9	Low	3 Å²	3	26.6 Å²	26.6	2%	0.016	14%	0.136	C	C	.	.	H	α-helix	trans	-66.3	-28.5	173.2	-66.7	177.5	0	0	0	113.1	L1071 E1072 H1077 F1080 L1081 L1104 L1107 W1108 I1111	L1071-L1075 WeakPolarHBondContact O-CG 3.39Å; L1071-L1075 PolarHBondContact O-N 3.32Å; E1072-L1075 PolarHBondContact O-N 2.97Å; L1075-H1077 VanDerWaalsContact C-N 3.32Å; L1075-F1080 HydrophobicContact CD2-CD1 4.43Å; L1075-F1080 HydrophobicContact CD2-CE1 3.66Å; L1075-F1080 HydrophobicContact CD2-CZ 4.28Å; L1075-L1081 VanDerWaalsContact O-CD2 3.25Å; L1075-L1081 WeakPolarHBondContact O-CD2 3.34Å; L1075-L1081 WeakPolarHBondContact O-CG 3.27Å; L1075-L1104 HydrophobicContact CD2-CD2 4.3Å; L1075-L1107 HydrophobicContact CD1-CB 3.97Å; L1075-L1107 HydrophobicContact CD2-CB 4.35Å; L1075-L1107 HydrophobicContact CD2-CD1 3.52Å; L1075-L1107 HydrophobicContact CD2-CG 4.35Å; L1075-W1108 HydrophobicContact CB-CH2 4.08Å; L1075-W1108 HydrophobicContact CB-CZ2 3.89Å; L1075-W1108 HydrophobicContact CD1-CD2 4.38Å; L1075-I1111 HydrophobicContact CD1-CD1 3.43Å; L1075-I1111 VanDerWaalsContact CD1-CD1 3.43Å
1076	L	65.2	Low	60.7	Low	17 Å²	17	25.2 Å²	25.2	9%	0.089	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-4.4	176.6	-70.4	165.3	0	0	0	113.8	E1072 F1073 I1074 W1108 K1175 L1176	E1072-L1076 HydrophobicContact CG-CD1 4.28Å; E1072-L1076 WeakPolarHBondContact O-CD1 3.47Å; E1072-L1076 VanDerWaalsContact O-CG 3.25Å; E1072-L1076 WeakPolarHBondContact O-CG 3.45Å; E1072-L1076 PolarHBondContact O-N 3.12Å; E1072-L1076 VanDerWaalsContact O-N 3.12Å; F1073-L1076 PolarHBondContact O-N 2.93Å; I1074-L1076 VanDerWaalsContact C-N 3.28Å; I1074-L1076 PolarHBondContact O-N 3.33Å; L1076-W1108 HydrophobicContact CD2-CZ2 3.98Å; L1076-W1108 HydrophobicContact CG-CZ2 4.24Å; L1076-K1175 HydrophobicContact CD1-CB 4.13Å; L1076-K1175 HydrophobicContact CD1-CD 3.45Å; L1076-K1175 VanDerWaalsContact CD1-CD 3.45Å; L1076-K1175 HydrophobicContact CD1-CG 4.48Å; L1076-K1175 HydrophobicContact CD2-CB 4.18Å; L1076-L1176 HydrophobicContact CD2-CD2 3.76Å; L1076-L1176 HydrophobicContact CD2-CG 3.73Å
1077	H	65	Low	60.1	Low	76 Å²	76	23.8 Å²	23.8	35%	0.352	13%	0.125	S	C	.	.			trans	-73.9	125.6	-178.2	-169.6	-77.7	0	0	0	111.1	F1073 I1074 L1075 C1079 F1080 L1081	F1073-H1077 PolarHBondContact O-N 2.87Å; I1074-H1077 WeakPolarHBondContact O-CB 3.2Å; I1074-H1077 PolarHBondContact O-N 2.9Å; L1075-H1077 VanDerWaalsContact C-N 3.32Å; H1077-C1079 PolarHBondContact ND1-N 3.14Å; H1077-C1079 PolarHBondContact O-N 3.48Å; H1077-F1080 HydrophobicContact CB-CB 4.08Å; H1077-F1080 WeakPolarHBondContact O-CA 3.44Å; H1077-F1080 WeakPolarHBondContact O-CB 3.24Å; H1077-F1080 PolarHBondContact O-N 3.13Å; H1077-L1081 PolarHBondContact O-N 3.35Å
1078	P	62.9	Low	59.4	Low	20 Å²	20	27.2 Å²	27.2	13%	0.13	15%	0.146	C	C	.	.	H	α-helix	trans	-61.3	-41.8	-170.6	22.2	-33	0	0	0	113.1	F1080 L1081 L1082 L1210 L1222	P1078-F1080 VanDerWaalsContact C-N 3.25Å; P1078-F1080 PolarHBondContact O-N 2.84Å; P1078-L1081 PolarHBondContact O-N 3.5Å; P1078-L1082 WeakPolarHBondContact O-CD1 3.4Å; P1078-L1082 VanDerWaalsContact O-CG 3.3Å; P1078-L1082 WeakPolarHBondContact O-CG 3.38Å; P1078-L1082 PolarHBondContact O-N 2.88Å; P1078-L1210 HydrophobicContact CB-CD1 4.11Å; P1078-L1210 HydrophobicContact CG-CD1 4.48Å; P1078-L1222 HydrophobicContact CB-CD1 4.06Å; P1078-L1222 HydrophobicContact CB-CD2 3.75Å
1079	C	57.9	Low	58.3	Low	41 Å²	41	30 Å²	30	28%	0.277	16%	0.157	S	C	.	.	H	α-helix	trans	-64.6	-27.9	175.3	-47.6	0	0	0	0	113.3	H1077 C1083 L1210	H1077-C1079 PolarHBondContact ND1-N 3.14Å; H1077-C1079 PolarHBondContact O-N 3.48Å; C1079-C1083 VanDerWaalsContact O-CB 3.28Å; C1079-C1083 WeakPolarHBondContact O-CB 3.32Å; C1079-C1083 PolarHBondContact O-N 3.17Å; C1079-C1083 VanDerWaalsContact O-N 3.08Å; C1079-C1083 PolarHBondContact O-SG 2.95Å; C1079-C1083 VanDerWaalsContact O-SG 3.33Å; C1079-L1210 VanDerWaalsContact SG-CD2 3.55Å
1080	F	61	Low	56.9	Low	17 Å²	17	31.5 Å²	31.5	8%	0.075	18%	0.176	C	C	.	.	H	α-helix	trans	-75.6	-43.1	177	-176.1	-86.3	0	0	0	110.3	L1031 Y1041 I1074 L1075 H1077 P1078 L1082 L1084 L1104	L1031-F1080 HydrophobicContact CD2-CE2 4.31Å; Y1041-F1080 HydrophobicContact CD1-CD2 4.18Å; Y1041-F1080 AromaticContact CD1-CE2 3.71Å; Y1041-F1080 HydrophobicContact CD1-CE2 3.71Å; Y1041-F1080 AromaticContact CE1-CD2 3.87Å; Y1041-F1080 HydrophobicContact CE1-CD2 3.87Å; Y1041-F1080 AromaticContact CE1-CE2 3.71Å; Y1041-F1080 HydrophobicContact CE1-CE2 3.71Å; I1074-F1080 HydrophobicContact CG2-CD2 4.21Å; I1074-F1080 HydrophobicContact CG2-CE2 4.27Å; L1075-F1080 HydrophobicContact CD2-CD1 4.43Å; L1075-F1080 HydrophobicContact CD2-CE1 3.66Å; L1075-F1080 HydrophobicContact CD2-CZ 4.28Å; H1077-F1080 HydrophobicContact CB-CB 4.08Å; H1077-F1080 WeakPolarHBondContact O-CA 3.44Å; H1077-F1080 WeakPolarHBondContact O-CB 3.24Å; H1077-F1080 PolarHBondContact O-N 3.13Å; P1078-F1080 VanDerWaalsContact C-N 3.25Å; P1078-F1080 PolarHBondContact O-N 2.84Å; F1080-L1082 PolarHBondContact O-N 3.39Å; F1080-L1084 HydrophobicContact CD1-CB 4.47Å; F1080-L1084 HydrophobicContact CE1-CB 4.27Å; F1080-L1084 HydrophobicContact CE1-CD1 3.74Å; F1080-L1084 HydrophobicContact CE1-CG 4.5Å; F1080-L1084 HydrophobicContact CE2-CD1 4.26Å; F1080-L1084 HydrophobicContact CZ-CD1 3.51Å; F1080-L1084 WeakPolarHBondContact O-CB 3.4Å; F1080-L1084 PolarHBondContact O-N 3.23Å; F1080-L1104 HydrophobicContact CE1-CD2 4.35Å
1081	L	65.5	Low	55.5	Low	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-56.8	-49.2	173.2	-72.2	172.3	0	0	0	111.3	L1075 H1077 P1078 A1085 L1104 W1108 L1176 L1222 L1229	L1075-L1081 VanDerWaalsContact O-CD2 3.25Å; L1075-L1081 WeakPolarHBondContact O-CD2 3.34Å; L1075-L1081 WeakPolarHBondContact O-CG 3.27Å; H1077-L1081 PolarHBondContact O-N 3.35Å; P1078-L1081 PolarHBondContact O-N 3.5Å; L1081-A1085 WeakPolarHBondContact O-CB 3.36Å; L1081-A1085 PolarHBondContact O-N 3Å; L1081-L1104 HydrophobicContact CD2-CD1 4.24Å; L1081-L1104 HydrophobicContact CD2-CD2 4.18Å; L1081-W1108 HydrophobicContact CD2-CH2 4.16Å; L1081-W1108 HydrophobicContact CD2-CZ3 4.37Å; L1081-L1176 HydrophobicContact CD1-CD2 4.28Å; L1081-L1222 HydrophobicContact CB-CD1 4.4Å; L1081-L1229 HydrophobicContact CD2-CD1 3.7Å
1082	L	61	Low	54.3	Low	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.4	-54.4	179.1	-66.2	162.9	0	0	0	111.8	P1078 F1080 L1084 A1085 F1086 Y1089 L1210 L1222 I1225	P1078-L1082 WeakPolarHBondContact O-CD1 3.4Å; P1078-L1082 VanDerWaalsContact O-CG 3.3Å; P1078-L1082 WeakPolarHBondContact O-CG 3.38Å; P1078-L1082 PolarHBondContact O-N 2.88Å; F1080-L1082 PolarHBondContact O-N 3.39Å; L1082-L1084 VanDerWaalsContact C-N 3.34Å; L1082-L1084 PolarHBondContact O-N 3.44Å; L1082-A1085 PolarHBondContact O-N 3.3Å; L1082-F1086 PolarHBondContact O-N 3.45Å; L1082-Y1089 HydrophobicContact CB-CE2 3.79Å; L1082-Y1089 HydrophobicContact CD2-CE2 4.44Å; L1082-Y1089 WeakPolarHBondContact CD2-OH 3.49Å; L1082-Y1089 WeakPolarHBondContact O-CE2 3.42Å; L1082-L1210 HydrophobicContact CD1-CD1 4.46Å; L1082-L1210 HydrophobicContact CD1-CD2 3.72Å; L1082-L1222 HydrophobicContact CD1-CD1 4.31Å; L1082-L1222 HydrophobicContact CD2-CB 3.93Å; L1082-L1222 HydrophobicContact CD2-CD1 4.13Å; L1082-L1222 HydrophobicContact CG-CD1 4Å; L1082-I1225 HydrophobicContact CD2-CD1 3.74Å
1083	C	56.6	Low	53.1	Low	33 Å²	33	42.4 Å²	42.4	22%	0.223	24%	0.237	C	C	.	.	H	α-helix	trans	-65.9	-30.9	-178.2	-72.3	0	0	0	0	114.2	C1079	C1079-C1083 VanDerWaalsContact O-CB 3.28Å; C1079-C1083 WeakPolarHBondContact O-CB 3.32Å; C1079-C1083 PolarHBondContact O-N 3.17Å; C1079-C1083 VanDerWaalsContact O-N 3.08Å; C1079-C1083 PolarHBondContact O-SG 2.95Å; C1079-C1083 VanDerWaalsContact O-SG 3.33Å
1084	L	56.6	Low	52.4	Low	2 Å²	2	38.5 Å²	38.5	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-85.6	-36.6	179	-158.6	138	0	0	0	111.7	Y1041 T1045 F1080 L1082 F1086 N1100 L1103 L1104	Y1041-L1084 HydrophobicContact CD1-CD1 4.48Å; T1045-L1084 HydrophobicContact CG2-CD1 4.19Å; T1045-L1084 VanDerWaalsContact OG1-CD1 3.27Å; T1045-L1084 WeakPolarHBondContact OG1-CD1 3.45Å; F1080-L1084 HydrophobicContact CD1-CB 4.47Å; F1080-L1084 HydrophobicContact CE1-CB 4.27Å; F1080-L1084 HydrophobicContact CE1-CD1 3.74Å; F1080-L1084 HydrophobicContact CE1-CG 4.5Å; F1080-L1084 HydrophobicContact CE2-CD1 4.26Å; F1080-L1084 HydrophobicContact CZ-CD1 3.51Å; F1080-L1084 WeakPolarHBondContact O-CB 3.4Å; F1080-L1084 PolarHBondContact O-N 3.23Å; L1082-L1084 VanDerWaalsContact C-N 3.34Å; L1082-L1084 PolarHBondContact O-N 3.44Å; L1084-F1086 VanDerWaalsContact C-N 3.33Å; L1084-F1086 PolarHBondContact O-N 2.85Å; L1084-N1100 HydrophobicContact CD2-CB 4.08Å; L1084-N1100 VanDerWaalsContact O-CB 3.24Å; L1084-N1100 WeakPolarHBondContact O-CB 3.34Å; L1084-N1100 PolarHBondContact O-ND2 3.19Å; L1084-L1103 HydrophobicContact CD2-CB 4.46Å; L1084-L1104 HydrophobicContact CD2-CD1 4.26Å; L1084-L1104 HydrophobicContact CD2-CD2 3.91Å; L1084-L1104 HydrophobicContact CD2-CG 3.74Å
1085	A	54.8	Low	51.6	Low	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-58.9	-43.6	171.8	0	0	0	0	0	112.1	L1081 L1082 I1098 Q1099 I1225	L1081-A1085 WeakPolarHBondContact O-CB 3.36Å; L1081-A1085 PolarHBondContact O-N 3Å; L1082-A1085 PolarHBondContact O-N 3.3Å; A1085-I1098 HydrophobicContact CB-CG2 3.62Å; A1085-Q1099 PolarHBondContact O-N 2.98Å; A1085-I1225 HydrophobicContact CB-CD1 3.85Å; A1085-I1225 HydrophobicContact CB-CG1 4.27Å; A1085-I1225 HydrophobicContact CB-CG2 4.27Å
1086	F	55.6	Low	50.8	Low	36 Å²	36	42 Å²	42	16%	0.158	25%	0.248	C	C	.	.			trans	-127.8	97.5	-176.2	-78.9	-87.3	0	0	0	112.8	L1082 L1084 T1088 Y1089 F1094 S1097 I1098 I1225	L1082-F1086 PolarHBondContact O-N 3.45Å; L1084-F1086 VanDerWaalsContact C-N 3.33Å; L1084-F1086 PolarHBondContact O-N 2.85Å; F1086-T1088 PolarHBondContact O-N 2.88Å; F1086-Y1089 HydrophobicContact CB-CD2 3.86Å; F1086-Y1089 HydrophobicContact CB-CE2 4.06Å; F1086-F1094 HydrophobicContact CD2-CE2 4.16Å; F1086-F1094 HydrophobicContact CE2-CD2 4.04Å; F1086-F1094 AromaticContact CE2-CE2 3.33Å; F1086-F1094 HydrophobicContact CE2-CE2 3.33Å; F1086-F1094 AromaticContact CE2-CZ 3.92Å; F1086-F1094 HydrophobicContact CE2-CZ 3.92Å; F1086-F1094 HydrophobicContact CZ-CD2 4.19Å; F1086-F1094 AromaticContact CZ-CE2 3.76Å; F1086-F1094 HydrophobicContact CZ-CE2 3.76Å; F1086-F1094 HydrophobicContact CZ-CZ 4.17Å; F1086-S1097 WeakPolarHBondContact CZ-O 3.49Å; F1086-I1098 HydrophobicContact CE2-CG1 4.26Å; F1086-I1225 HydrophobicContact CD2-CD1 4.25Å; F1086-I1225 HydrophobicContact CE2-CD1 4.42Å
1087	P	45.6	Very low	50.1	Low	37 Å²	37	45.3 Å²	45.3	24%	0.24	27%	0.272	C	S	.	.	S	Bend	trans	-69.6	-11.4	176.1	28	-35	0	0	0	114.2	P1038 Q1099	P1038-P1087 HydrophobicContact CB-CB 3.55Å; P1038-P1087 VanDerWaalsContact CB-O 3.24Å; P1038-P1087 WeakPolarHBondContact CB-O 3.4Å; P1038-P1087 HydrophobicContact CG-CB 4.45Å; P1038-P1087 WeakPolarHBondContact CG-O 3.36Å; P1087-Q1099 VanDerWaalsContact CD-OE1 3.25Å
1088	T	43.4	Very low	49.7	Very low	73 Å²	73	42.1 Å²	42.1	45%	0.448	26%	0.257	S	S	.	.			trans	-117.6	58.7	-179.9	54.1	0	0	0	0	111.7	F1086 A1090 L1524	F1086-T1088 PolarHBondContact O-N 2.88Å; T1088-A1090 PolarHBondContact O-N 3.01Å; T1088-L1524 HydrophobicContact CG2-CD2 4.5Å
1089	Y	36.9	Very low	49.2	Very low	62 Å²	62	45.4 Å²	45.4	24%	0.243	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	14	-173.9	-133.6	-82.1	0	0	0	116.1	L1082 F1086	L1082-Y1089 HydrophobicContact CB-CE2 3.79Å; L1082-Y1089 HydrophobicContact CD2-CE2 4.44Å; L1082-Y1089 WeakPolarHBondContact CD2-OH 3.49Å; L1082-Y1089 WeakPolarHBondContact O-CE2 3.42Å; F1086-Y1089 HydrophobicContact CB-CD2 3.86Å; F1086-Y1089 HydrophobicContact CB-CE2 4.06Å
1090	A	33.3	Very low	49	Very low	78 Å²	78	44.9 Å²	44.9	65%	0.645	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-21.4	-158.4	0	0	0	0	0	116.6	T1088	T1088-A1090 PolarHBondContact O-N 3.01Å
1091	T	31.5	Very low	48.7	Very low	113 Å²	113	44.9 Å²	44.9	69%	0.693	27%	0.268	S	S	*	.	S	Bend	trans	-147.6	-14.8	-160.2	50.2	0	0	0	0	120.4
1092	E	35.5	Very low	48	Very low	118 Å²	118	49.9 Å²	49.9	55%	0.551	29%	0.291	S	S	*	.			trans	-138.1	149.9	-169.2	-73.6	-177.3	-142.5	0	0	116
1093	V	38	Very low	47.5	Very low	52 Å²	52	50.4 Å²	50.4	32%	0.315	29%	0.294	S	S	.	.			trans	-61.5	137.3	177.2	-177.5	0	0	0	0	110.8	T1095 L1262 Q1263	V1093-T1095 WeakPolarHBondContact O-CG2 3.33Å; V1093-T1095 PolarHBondContact O-N 3.36Å; V1093-T1095 VanDerWaalsContact O-N 3.12Å; V1093-T1095 PolarHBondContact O-OG1 2.89Å; V1093-L1262 HydrophobicContact CB-CD2 4.17Å; V1093-L1262 HydrophobicContact CG1-CD2 3.97Å; V1093-Q1263 HydrophobicContact CG1-CG 3.63Å
1094	F	48.3	Very low	47.7	Very low	17 Å²	17	48.9 Å²	48.9	8%	0.075	28%	0.283	C	S	.	.			trans	-55.9	113	-180	-162.9	-81.1	0	0	0	112.5	F1086 W1224 I1225	F1086-F1094 HydrophobicContact CD2-CE2 4.16Å; F1086-F1094 HydrophobicContact CE2-CD2 4.04Å; F1086-F1094 AromaticContact CE2-CE2 3.33Å; F1086-F1094 HydrophobicContact CE2-CE2 3.33Å; F1086-F1094 AromaticContact CE2-CZ 3.92Å; F1086-F1094 HydrophobicContact CE2-CZ 3.92Å; F1086-F1094 HydrophobicContact CZ-CD2 4.19Å; F1086-F1094 AromaticContact CZ-CE2 3.76Å; F1086-F1094 HydrophobicContact CZ-CE2 3.76Å; F1086-F1094 HydrophobicContact CZ-CZ 4.17Å; F1094-W1224 AromaticContact CD1-CD2 3.7Å; F1094-W1224 HydrophobicContact CD1-CD2 3.7Å; F1094-W1224 AromaticContact CD1-CE3 3.42Å; F1094-W1224 HydrophobicContact CD1-CE3 3.42Å; F1094-W1224 VanDerWaalsContact CD1-CE3 3.42Å; F1094-W1224 HydrophobicContact CD1-CG 4.41Å; F1094-W1224 HydrophobicContact CD1-CH2 4Å; F1094-W1224 HydrophobicContact CD1-CZ2 4.24Å; F1094-W1224 AromaticContact CD1-CZ3 3.6Å; F1094-W1224 HydrophobicContact CD1-CZ3 3.6Å; F1094-W1224 HydrophobicContact CE1-CB 4.41Å; F1094-W1224 AromaticContact CE1-CD2 3.36Å; F1094-W1224 HydrophobicContact CE1-CD2 3.36Å; F1094-W1224 AromaticContact CE1-CE2 3.59Å; F1094-W1224 AromaticContact CE1-CE3 3.65Å; F1094-W1224 HydrophobicContact CE1-CE3 3.65Å; F1094-W1224 AromaticContact CE1-CG 3.73Å; F1094-W1224 HydrophobicContact CE1-CG 3.73Å; F1094-W1224 HydrophobicContact CE1-CH2 4.28Å; F1094-W1224 HydrophobicContact CE1-CZ2 4.05Å; F1094-W1224 HydrophobicContact CE1-CZ3 4.1Å; F1094-W1224 HydrophobicContact CG-CE3 4.33Å; F1094-W1224 HydrophobicContact CZ-CB 4.47Å; F1094-W1224 HydrophobicContact CZ-CD2 4.23Å; F1094-W1224 HydrophobicContact CZ-CG 4.15Å; F1094-I1225 HydrophobicContact CE2-CD1 4.1Å; F1094-I1225 HydrophobicContact CE2-CG1 3.86Å; F1094-I1225 HydrophobicContact CZ-CG1 4.08Å
1095	T	45.3	Very low	47.8	Very low	62 Å²	62	49.6 Å²	49.6	38%	0.38	29%	0.287	S	S	.	.			trans	-114.1	20.6	-172.4	35.8	0	0	0	0	114.2	V1093 L1262	V1093-T1095 WeakPolarHBondContact O-CG2 3.33Å; V1093-T1095 PolarHBondContact O-N 3.36Å; V1093-T1095 VanDerWaalsContact O-N 3.12Å; V1093-T1095 PolarHBondContact O-OG1 2.89Å; T1095-L1262 HydrophobicContact CG2-CD2 4.2Å
1096	G	47.5	Very low	47.7	Very low	29 Å²	29	51.1 Å²	51.1	30%	0.299	30%	0.3	S	S	.	.	S	Bend	trans	95.9	15.9	155.7	0	0	0	0	0	118.9
1097	S	50.1	Low	47.9	Very low	85 Å²	85	49.5 Å²	49.5	59%	0.594	29%	0.293	S	S	*	.			trans	-140.3	125.7	168.2	63	0	0	0	0	113.2	F1086 Q1099	F1086-S1097 WeakPolarHBondContact CZ-O 3.49Å; S1097-Q1099 PolarHBondContact O-N 3.25Å
1098	I	56.9	Low	48.8	Very low	9 Å²	9	48.1 Å²	48.1	5%	0.046	28%	0.283	C	S	.	.			trans	-80.3	113.4	177.4	-60	171	0	0	0	109.2	A1085 F1086 N1100 S1101 I1225 E1228	A1085-I1098 HydrophobicContact CB-CG2 3.62Å; F1086-I1098 HydrophobicContact CE2-CG1 4.26Å; I1098-N1100 PolarHBondContact O-N 3.01Å; I1098-N1100 VanDerWaalsContact O-N 3.11Å; I1098-S1101 PolarHBondContact O-N 2.98Å; I1098-S1101 PolarHBondContact O-OG 3.41Å; I1098-I1225 HydrophobicContact CD1-CB 4.27Å; I1098-I1225 HydrophobicContact CD1-CG1 4.13Å; I1098-I1225 HydrophobicContact CD1-CG2 4.1Å; I1098-I1225 HydrophobicContact CG1-CG1 4.28Å; I1098-E1228 HydrophobicContact CD1-CB 3.47Å; I1098-E1228 VanDerWaalsContact CD1-CB 3.47Å; I1098-E1228 HydrophobicContact CD1-CG 3.82Å; I1098-E1228 HydrophobicContact CG1-CB 4.49Å; I1098-E1228 HydrophobicContact CG1-CG 4.38Å
1099	Q	51.5	Low	49.5	Very low	89 Å²	89	48.3 Å²	48.3	42%	0.416	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-29.6	-174.8	-66.1	-177.9	-6.1	0	0	113.9	A1085 P1087 S1097	A1085-Q1099 PolarHBondContact O-N 2.98Å; P1087-Q1099 VanDerWaalsContact CD-OE1 3.25Å; S1097-Q1099 PolarHBondContact O-N 3.25Å
1100	N	53.9	Low	50.4	Low	31 Å²	31	46.4 Å²	46.4	17%	0.166	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.4	22.7	-176.5	-66	-49.1	0	0	0	114.4	L1084 I1098 H1102 L1103 L1104	L1084-N1100 HydrophobicContact CD2-CB 4.08Å; L1084-N1100 VanDerWaalsContact O-CB 3.24Å; L1084-N1100 WeakPolarHBondContact O-CB 3.34Å; L1084-N1100 PolarHBondContact O-ND2 3.19Å; I1098-N1100 PolarHBondContact O-N 3.01Å; I1098-N1100 VanDerWaalsContact O-N 3.11Å; N1100-H1102 PolarHBondContact O-N 3.05Å; N1100-L1103 HydrophobicContact CB-CD1 4.18Å; N1100-L1103 PolarHBondContact O-N 3.15Å; N1100-L1104 PolarHBondContact O-N 3.5Å
1101	S	55.1	Low	51.7	Low	17 Å²	17	42.9 Å²	42.9	12%	0.119	24%	0.244	C	C	.	.	H	α-helix	trans	-53.6	-44.2	178.7	51.8	0	0	0	0	111.5	I1098 L1103 L1104 V1105	I1098-S1101 PolarHBondContact O-N 2.98Å; I1098-S1101 PolarHBondContact O-OG 3.41Å; S1101-L1103 PolarHBondContact O-N 3.07Å; S1101-L1103 VanDerWaalsContact O-N 3.16Å; S1101-L1104 PolarHBondContact O-N 3.18Å; S1101-L1104 VanDerWaalsContact O-N 3.07Å; S1101-V1105 VanDerWaalsContact O-CG2 3.28Å; S1101-V1105 WeakPolarHBondContact O-CG2 3.22Å; S1101-V1105 PolarHBondContact O-N 3.34Å
1102	H	50.4	Low	53.1	Low	104 Å²	104	38 Å²	38	48%	0.481	21%	0.213	S	C	.	.	H	α-helix	trans	-54.8	-31.7	176.1	69.6	-84	0	0	0	113.9	N1100 A1106	N1100-H1102 PolarHBondContact O-N 3.05Å; H1102-A1106 WeakPolarHBondContact O-CB 3.42Å; H1102-A1106 PolarHBondContact O-N 2.96Å
1103	L	50.8	Low	54	Low	12 Å²	12	35 Å²	35	6%	0.063	20%	0.202	C	C	.	.	H	α-helix	trans	-77.2	-39.4	176.3	-68.2	173.5	0	0	0	112.1	R1046 L1084 N1100 S1101 L1107	R1046-L1103 HydrophobicContact CG-CD2 4.12Å; L1084-L1103 HydrophobicContact CD2-CB 4.46Å; N1100-L1103 HydrophobicContact CB-CD1 4.18Å; N1100-L1103 PolarHBondContact O-N 3.15Å; S1101-L1103 PolarHBondContact O-N 3.07Å; S1101-L1103 VanDerWaalsContact O-N 3.16Å; L1103-L1107 WeakPolarHBondContact O-CB 3.39Å; L1103-L1107 WeakPolarHBondContact O-CD1 3.43Å; L1103-L1107 VanDerWaalsContact O-CG 3.28Å; L1103-L1107 WeakPolarHBondContact O-CG 3.48Å; L1103-L1107 PolarHBondContact O-N 3.07Å
1104	L	60.9	Low	54.8	Low	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-66.6	-44.8	175.8	-73.5	166.3	0	0	0	111.2	L1075 F1080 L1081 L1084 N1100 S1101 L1107 W1108 L1229	L1075-L1104 HydrophobicContact CD2-CD2 4.3Å; F1080-L1104 HydrophobicContact CE1-CD2 4.35Å; L1081-L1104 HydrophobicContact CD2-CD1 4.24Å; L1081-L1104 HydrophobicContact CD2-CD2 4.18Å; L1084-L1104 HydrophobicContact CD2-CD1 4.26Å; L1084-L1104 HydrophobicContact CD2-CD2 3.91Å; L1084-L1104 HydrophobicContact CD2-CG 3.74Å; N1100-L1104 PolarHBondContact O-N 3.5Å; S1101-L1104 PolarHBondContact O-N 3.18Å; S1101-L1104 VanDerWaalsContact O-N 3.07Å; L1104-L1107 HydrophobicContact CD2-CD1 4.5Å; L1104-L1107 WeakPolarHBondContact O-CB 3.48Å; L1104-L1107 PolarHBondContact O-N 2.9Å; L1104-W1108 HydrophobicContact CB-CE3 4.39Å; L1104-W1108 HydrophobicContact CB-CZ3 4.3Å; L1104-W1108 HydrophobicContact CD2-CZ3 4.34Å; L1104-W1108 PolarHBondContact O-N 2.78Å; L1104-L1229 HydrophobicContact CB-CD2 3.74Å; L1104-L1229 HydrophobicContact CD1-CD1 4.15Å; L1104-L1229 HydrophobicContact CD1-CD2 3.9Å; L1104-L1229 HydrophobicContact CG-CD2 4.45Å
1105	V	59.4	Low	55.3	Low	17 Å²	17	32.3 Å²	32.3	10%	0.103	19%	0.186	C	C	.	.	H	α-helix	trans	-64.7	-44.8	176.5	177.5	0	0	0	0	110.4	S1101 L1107 W1108 Q1109 Y1232	S1101-V1105 VanDerWaalsContact O-CG2 3.28Å; S1101-V1105 WeakPolarHBondContact O-CG2 3.22Å; S1101-V1105 PolarHBondContact O-N 3.34Å; V1105-L1107 PolarHBondContact O-N 3.17Å; V1105-W1108 PolarHBondContact O-N 3.16Å; V1105-Q1109 HydrophobicContact CG1-CG 4.36Å; V1105-Q1109 WeakPolarHBondContact O-CB 3.3Å; V1105-Q1109 WeakPolarHBondContact O-CG 3.5Å; V1105-Q1109 PolarHBondContact O-N 3.32Å; V1105-Y1232 VanDerWaalsContact CG2-CB 3.44Å; V1105-Y1232 HydrophobicContact CG2-CD2 4.45Å; V1105-Y1232 HydrophobicContact CG2-CG 4.11Å
1106	A	50.9	Low	55.8	Low	33 Å²	33	32.1 Å²	32.1	27%	0.273	18%	0.182	S	C	.	.	H	α-helix	trans	-61.1	-42.1	175.3	0	0	0	0	0	112.3	H1102 Q1109 T1110	H1102-A1106 WeakPolarHBondContact O-CB 3.42Å; H1102-A1106 PolarHBondContact O-N 2.96Å; A1106-Q1109 PolarHBondContact O-N 3.13Å; A1106-T1110 WeakPolarHBondContact O-CB 3.2Å; A1106-T1110 PolarHBondContact O-N 3.41Å; A1106-T1110 PolarHBondContact O-OG1 2.82Å
1107	L	60.4	Low	55.9	Low	2 Å²	2	34.6 Å²	34.6	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-56.8	-52.3	173.2	-83.2	157.5	0	0	0	111.8	T1045 V1048 I1049 L1075 L1103 L1104 V1105 Q1109 T1110 I1111	T1045-L1107 HydrophobicContact CG2-CD1 3.22Å; T1045-L1107 HydrophobicContact CG2-CD2 4.02Å; T1045-L1107 HydrophobicContact CG2-CG 3.85Å; V1048-L1107 HydrophobicContact CG1-CD2 4Å; I1049-L1107 HydrophobicContact CD1-CD2 4.28Å; I1049-L1107 HydrophobicContact CD1-CG 4.11Å; I1049-L1107 HydrophobicContact CG1-CD2 3.65Å; I1049-L1107 HydrophobicContact CG1-CG 4Å; L1075-L1107 HydrophobicContact CD1-CB 3.97Å; L1075-L1107 HydrophobicContact CD2-CB 4.35Å; L1075-L1107 HydrophobicContact CD2-CD1 3.52Å; L1075-L1107 HydrophobicContact CD2-CG 4.35Å; L1103-L1107 WeakPolarHBondContact O-CB 3.39Å; L1103-L1107 WeakPolarHBondContact O-CD1 3.43Å; L1103-L1107 VanDerWaalsContact O-CG 3.28Å; L1103-L1107 WeakPolarHBondContact O-CG 3.48Å; L1103-L1107 PolarHBondContact O-N 3.07Å; L1104-L1107 HydrophobicContact CD2-CD1 4.5Å; L1104-L1107 WeakPolarHBondContact O-CB 3.48Å; L1104-L1107 PolarHBondContact O-N 2.9Å; V1105-L1107 PolarHBondContact O-N 3.17Å; L1107-Q1109 PolarHBondContact O-N 2.81Å; L1107-T1110 PolarHBondContact O-N 2.95Å; L1107-I1111 WeakPolarHBondContact O-CB 3.43Å; L1107-I1111 VanDerWaalsContact O-CG1 3.28Å; L1107-I1111 WeakPolarHBondContact O-CG1 3.35Å; L1107-I1111 PolarHBondContact O-N 3.3Å
1108	W	64.3	Low	56.1	Low	7 Å²	7	30.7 Å²	30.7	3%	0.027	16%	0.16	C	C	.	.	H	α-helix	trans	-61.6	-43.1	-180	-100.6	-62.3	0	0	0	112.1	L1075 L1076 L1081 L1104 V1105 I1111 Q1112 L1176 L1229 L1233	L1075-W1108 HydrophobicContact CB-CH2 4.08Å; L1075-W1108 HydrophobicContact CB-CZ2 3.89Å; L1075-W1108 HydrophobicContact CD1-CD2 4.38Å; L1076-W1108 HydrophobicContact CD2-CZ2 3.98Å; L1076-W1108 HydrophobicContact CG-CZ2 4.24Å; L1081-W1108 HydrophobicContact CD2-CH2 4.16Å; L1081-W1108 HydrophobicContact CD2-CZ3 4.37Å; L1104-W1108 HydrophobicContact CB-CE3 4.39Å; L1104-W1108 HydrophobicContact CB-CZ3 4.3Å; L1104-W1108 HydrophobicContact CD2-CZ3 4.34Å; L1104-W1108 PolarHBondContact O-N 2.78Å; V1105-W1108 PolarHBondContact O-N 3.16Å; W1108-I1111 PolarHBondContact O-N 2.81Å; W1108-Q1112 VanDerWaalsContact O-CB 3.32Å; W1108-Q1112 WeakPolarHBondContact O-CB 3.34Å; W1108-Q1112 PolarHBondContact O-N 3.47Å; W1108-L1176 HydrophobicContact CH2-CD1 4.14Å; W1108-L1176 HydrophobicContact CH2-CD2 4.3Å; W1108-L1176 HydrophobicContact CZ2-CD1 4.21Å; W1108-L1229 HydrophobicContact CZ3-CD1 4.36Å; W1108-L1229 HydrophobicContact CZ3-CD2 4.44Å; W1108-L1233 HydrophobicContact CB-CD2 4.07Å; W1108-L1233 HydrophobicContact CG-CD2 4.41Å
1109	Q	58.8	Low	56	Low	78 Å²	78	32.8 Å²	32.8	36%	0.364	17%	0.171	S	C	.	.	H	α-helix	trans	-64.5	-39.5	174.3	-73	177.3	-6.6	0	0	112.4	V1105 A1106 L1107 Q1112 N1113	V1105-Q1109 HydrophobicContact CG1-CG 4.36Å; V1105-Q1109 WeakPolarHBondContact O-CB 3.3Å; V1105-Q1109 WeakPolarHBondContact O-CG 3.5Å; V1105-Q1109 PolarHBondContact O-N 3.32Å; A1106-Q1109 PolarHBondContact O-N 3.13Å; L1107-Q1109 PolarHBondContact O-N 2.81Å; Q1109-Q1112 PolarHBondContact O-N 3.49Å; Q1109-N1113 VanDerWaalsContact O-CB 3.31Å; Q1109-N1113 WeakPolarHBondContact O-CB 3.33Å; Q1109-N1113 PolarHBondContact O-N 2.98Å; Q1109-N1113 PolarHBondContact O-ND2 3.46Å
1110	T	54.7	Low	56	Low	21 Å²	21	35 Å²	35	13%	0.129	18%	0.179	C	C	.	.	H	α-helix	trans	-62.3	-50.4	176.3	-49.1	0	0	0	0	109.2	I1049 I1052 E1053 A1106 L1107 Q1112 N1113 S1114	I1049-T1110 HydrophobicContact CG2-CG2 4.38Å; I1052-T1110 HydrophobicContact CB-CG2 4.31Å; I1052-T1110 HydrophobicContact CG2-CG2 3.85Å; E1053-T1110 HydrophobicContact CG-CG2 4.07Å; A1106-T1110 WeakPolarHBondContact O-CB 3.2Å; A1106-T1110 PolarHBondContact O-N 3.41Å; A1106-T1110 PolarHBondContact O-OG1 2.82Å; L1107-T1110 PolarHBondContact O-N 2.95Å; T1110-Q1112 PolarHBondContact O-N 2.88Å; T1110-N1113 PolarHBondContact O-N 3.08Å; T1110-S1114 WeakPolarHBondContact O-CB 3.18Å; T1110-S1114 PolarHBondContact O-N 2.86Å; T1110-S1114 PolarHBondContact O-OG 3.08Å
1111	I	60.7	Low	55.6	Low	5 Å²	5	37.8 Å²	37.8	3%	0.026	19%	0.188	C	C	.	.	H	α-helix	trans	-58.2	-45.1	177.3	-69.5	165.2	0	0	0	111.3	I1052 L1068 L1071 L1075 L1107 W1108 S1114 F1115	I1052-I1111 HydrophobicContact CD1-CG1 4.43Å; L1068-I1111 HydrophobicContact CD2-CB 4.32Å; L1068-I1111 HydrophobicContact CD2-CG1 3.93Å; L1068-I1111 HydrophobicContact CD2-CG2 4.26Å; L1071-I1111 HydrophobicContact CB-CD1 3.99Å; L1075-I1111 HydrophobicContact CD1-CD1 3.43Å; L1075-I1111 VanDerWaalsContact CD1-CD1 3.43Å; L1107-I1111 WeakPolarHBondContact O-CB 3.43Å; L1107-I1111 VanDerWaalsContact O-CG1 3.28Å; L1107-I1111 WeakPolarHBondContact O-CG1 3.35Å; L1107-I1111 PolarHBondContact O-N 3.3Å; W1108-I1111 PolarHBondContact O-N 2.81Å; I1111-S1114 WeakPolarHBondContact O-CB 3.26Å; I1111-S1114 PolarHBondContact O-N 3.24Å; I1111-F1115 HydrophobicContact CG2-CD2 3.67Å; I1111-F1115 HydrophobicContact CG2-CE2 3.49Å; I1111-F1115 VanDerWaalsContact CG2-CE2 3.49Å; I1111-F1115 WeakPolarHBondContact O-CD2 3.47Å; I1111-F1115 PolarHBondContact O-N 3.02Å
1112	Q	61.2	Low	55.5	Low	9 Å²	9	40.1 Å²	40.1	4%	0.042	20%	0.197	C	C	.	.	H	α-helix	trans	-62.6	-46.1	177.4	179	177.3	-0.7	0	0	112.1	W1108 Q1109 T1110 S1114 F1115 M1116 M1169	W1108-Q1112 VanDerWaalsContact O-CB 3.32Å; W1108-Q1112 WeakPolarHBondContact O-CB 3.34Å; W1108-Q1112 PolarHBondContact O-N 3.47Å; Q1109-Q1112 PolarHBondContact O-N 3.49Å; T1110-Q1112 PolarHBondContact O-N 2.88Å; Q1112-S1114 VanDerWaalsContact C-N 3.31Å; Q1112-S1114 PolarHBondContact O-N 3.49Å; Q1112-F1115 PolarHBondContact O-N 2.89Å; Q1112-M1116 WeakPolarHBondContact O-CG 3.48Å; Q1112-M1116 PolarHBondContact O-N 3.37Å; Q1112-M1169 PolarHBondContact OE1-SD 3.5Å
1113	N	54.8	Low	55.3	Low	57 Å²	57	40.9 Å²	40.9	31%	0.305	20%	0.201	S	C	.	.	H	α-helix	trans	-62.7	-39.3	176.2	-71.5	-24	0	0	0	111.3	Q1109 T1110 M1116 L1117	Q1109-N1113 VanDerWaalsContact O-CB 3.31Å; Q1109-N1113 WeakPolarHBondContact O-CB 3.33Å; Q1109-N1113 PolarHBondContact O-N 2.98Å; Q1109-N1113 PolarHBondContact O-ND2 3.46Å; T1110-N1113 PolarHBondContact O-N 3.08Å; N1113-M1116 PolarHBondContact O-N 3.46Å; N1113-M1116 WeakPolarHBondContact OD1-CE 3.49Å; N1113-L1117 WeakPolarHBondContact O-CG 3.2Å; N1113-L1117 PolarHBondContact O-N 3.34Å
1114	S	55.5	Low	54.9	Low	4 Å²	4	44.7 Å²	44.7	3%	0.028	22%	0.221	C	C	.	.	H	α-helix	trans	-59.8	-47.4	172.9	-56.7	0	0	0	0	112.1	I1052 C1056 T1110 I1111 Q1112 L1117 I1118	I1052-S1114 WeakPolarHBondContact CG2-OG 3.31Å; C1056-S1114 WeakPolarHBondContact SG-CB 3.4Å; C1056-S1114 PolarHBondContact SG-OG 3.04Å; T1110-S1114 WeakPolarHBondContact O-CB 3.18Å; T1110-S1114 PolarHBondContact O-N 2.86Å; T1110-S1114 PolarHBondContact O-OG 3.08Å; I1111-S1114 WeakPolarHBondContact O-CB 3.26Å; I1111-S1114 PolarHBondContact O-N 3.24Å; Q1112-S1114 VanDerWaalsContact C-N 3.31Å; Q1112-S1114 PolarHBondContact O-N 3.49Å; S1114-L1117 PolarHBondContact O-N 3.03Å; S1114-I1118 WeakPolarHBondContact O-CD1 3.27Å; S1114-I1118 VanDerWaalsContact O-CG1 3.28Å; S1114-I1118 WeakPolarHBondContact O-CG1 3.5Å; S1114-I1118 PolarHBondContact O-N 2.78Å
1115	F	59.1	Low	54.1	Low	7 Å²	7	48.7 Å²	48.7	3%	0.031	24%	0.243	C	C	.	.	H	α-helix	trans	-62.8	-44.3	175.7	-80.6	-66.9	0	0	0	112.2	K1065 L1068 I1111 Q1112 L1117 I1118 D1119 T1168	K1065-F1115 HydrophobicContact CG-CE1 3.9Å; L1068-F1115 HydrophobicContact CB-CE1 4.27Å; L1068-F1115 HydrophobicContact CB-CE2 3.82Å; L1068-F1115 HydrophobicContact CB-CZ 3.62Å; L1068-F1115 HydrophobicContact CD1-CD1 4.49Å; L1068-F1115 HydrophobicContact CD1-CD2 4.49Å; L1068-F1115 HydrophobicContact CD1-CE1 4.46Å; L1068-F1115 HydrophobicContact CD1-CE2 4.46Å; L1068-F1115 HydrophobicContact CD1-CZ 4.44Å; I1111-F1115 HydrophobicContact CG2-CD2 3.67Å; I1111-F1115 HydrophobicContact CG2-CE2 3.49Å; I1111-F1115 VanDerWaalsContact CG2-CE2 3.49Å; I1111-F1115 WeakPolarHBondContact O-CD2 3.47Å; I1111-F1115 PolarHBondContact O-N 3.02Å; Q1112-F1115 PolarHBondContact O-N 2.89Å; F1115-L1117 VanDerWaalsContact C-N 3.28Å; F1115-L1117 PolarHBondContact O-N 3.3Å; F1115-I1118 PolarHBondContact O-N 3.24Å; F1115-D1119 PolarHBondContact O-N 3.15Å; F1115-T1168 HydrophobicContact CB-CG2 3.96Å; F1115-T1168 HydrophobicContact CD1-CG2 4.39Å; F1115-T1168 HydrophobicContact CD2-CG2 3.75Å; F1115-T1168 HydrophobicContact CE2-CG2 4.28Å; F1115-T1168 HydrophobicContact CG-CG2 3.81Å
1116	M	54.9	Low	53.4	Low	59 Å²	59	56 Å²	56	29%	0.291	27%	0.273	S	S	.	.	H	α-helix	trans	-61.7	-34.1	176.2	-71.9	-158.8	-56.2	0	0	113.1	Q1112 N1113 K1120	Q1112-M1116 WeakPolarHBondContact O-CG 3.48Å; Q1112-M1116 PolarHBondContact O-N 3.37Å; N1113-M1116 PolarHBondContact O-N 3.46Å; N1113-M1116 WeakPolarHBondContact OD1-CE 3.49Å; M1116-K1120 WeakPolarHBondContact O-CB 3.28Å; M1116-K1120 VanDerWaalsContact O-CG 3.31Å; M1116-K1120 WeakPolarHBondContact O-CG 3.39Å; M1116-K1120 PolarHBondContact O-N 3.19Å; M1116-K1120 VanDerWaalsContact O-N 3.16Å
1117	L	49.1	Very low	52.8	Low	80 Å²	80	60.2 Å²	60.2	42%	0.419	29%	0.291	S	S	.	.	H	α-helix	trans	-68.3	-47.5	173.8	-75.1	165.5	0	0	0	111	C1056 N1113 S1114 F1115 D1119 K1120 Y1121	C1056-L1117 HydrophobicContact CB-CD1 4.41Å; N1113-L1117 WeakPolarHBondContact O-CG 3.2Å; N1113-L1117 PolarHBondContact O-N 3.34Å; S1114-L1117 PolarHBondContact O-N 3.03Å; F1115-L1117 VanDerWaalsContact C-N 3.28Å; F1115-L1117 PolarHBondContact O-N 3.3Å; L1117-D1119 VanDerWaalsContact C-N 3.35Å; L1117-D1119 PolarHBondContact O-N 3.33Å; L1117-K1120 PolarHBondContact O-N 2.78Å; L1117-Y1121 VanDerWaalsContact O-CD2 3.27Å; L1117-Y1121 WeakPolarHBondContact O-CD2 3.49Å; L1117-Y1121 PolarHBondContact O-N 2.86Å; L1117-Y1121 VanDerWaalsContact O-N 3.15Å
1118	I	54.4	Low	51.7	Low	3 Å²	3	65.9 Å²	65.9	2%	0.015	32%	0.321	C	S	.	.	H	α-helix	trans	-55.9	-48.7	176.5	-70.1	160.8	0	0	0	111.1	L1061 V1064 K1065 L1068 S1114 F1115 Y1121 H1122	L1061-I1118 HydrophobicContact CB-CG1 4.24Å; L1061-I1118 HydrophobicContact CB-CG2 4.14Å; L1061-I1118 HydrophobicContact CD2-CG1 3.9Å; V1064-I1118 HydrophobicContact CB-CD1 4.25Å; V1064-I1118 HydrophobicContact CG1-CD1 4.29Å; K1065-I1118 HydrophobicContact CD-CG2 4.42Å; L1068-I1118 HydrophobicContact CD1-CD1 3.69Å; S1114-I1118 WeakPolarHBondContact O-CD1 3.27Å; S1114-I1118 VanDerWaalsContact O-CG1 3.28Å; S1114-I1118 WeakPolarHBondContact O-CG1 3.5Å; S1114-I1118 PolarHBondContact O-N 2.78Å; F1115-I1118 PolarHBondContact O-N 3.24Å; I1118-Y1121 PolarHBondContact O-N 3.45Å; I1118-H1122 PolarHBondContact O-CD2 3.37Å; I1118-H1122 PolarHBondContact O-N 2.96Å
1119	D	55.2	Low	50.4	Low	54 Å²	54	72 Å²	72	29%	0.289	35%	0.354	S	S	.	.	H	α-helix	trans	-69.8	-35.2	-175.8	-65	-26.5	0	0	0	111.6	K1065 F1115 L1117 Y1121 H1122 E1123	K1065-D1119 IonicContact NZ-OD1 2.65Å; K1065-D1119 PolarHBondContact NZ-OD1 3.35Å; F1115-D1119 PolarHBondContact O-N 3.15Å; L1117-D1119 VanDerWaalsContact C-N 3.35Å; L1117-D1119 PolarHBondContact O-N 3.33Å; D1119-Y1121 PolarHBondContact O-N 3.47Å; D1119-H1122 PolarHBondContact O-N 3.2Å; D1119-E1123 PolarHBondContact O-N 3.42Å; D1119-E1123 VanDerWaalsContact O-N 3.16Å
1120	K	51	Low	49.3	Very low	134 Å²	134	77.3 Å²	77.3	58%	0.583	38%	0.376	S	S	*	.	H	α-helix	trans	-63.4	-36.5	172.9	-82.9	179.7	177.9	179.7	0	114.1	M1116 L1117 E1123 N1124	M1116-K1120 WeakPolarHBondContact O-CB 3.28Å; M1116-K1120 VanDerWaalsContact O-CG 3.31Å; M1116-K1120 WeakPolarHBondContact O-CG 3.39Å; M1116-K1120 PolarHBondContact O-N 3.19Å; M1116-K1120 VanDerWaalsContact O-N 3.16Å; L1117-K1120 PolarHBondContact O-N 2.78Å; K1120-E1123 PolarHBondContact O-N 3.41Å; K1120-N1124 PolarHBondContact O-N 3.34Å; K1120-N1124 PolarHBondContact O-ND2 3.12Å
1121	Y	47.1	Very low	47.9	Very low	91 Å²	91	81.9 Å²	81.9	36%	0.357	40%	0.404	S	S	.	.	H	α-helix	trans	-68.3	-43.4	175.7	-83.7	-68.4	0	0	0	111.2	N1059 L1061 L1117 I1118 D1119 E1123 N1124 D1125	N1059-Y1121 PolarHBondContact OD1-OH 3.48Å; L1061-Y1121 HydrophobicContact CD1-CD2 4.42Å; L1061-Y1121 HydrophobicContact CD1-CG 4.25Å; L1061-Y1121 HydrophobicContact CD2-CD2 4.47Å; L1117-Y1121 VanDerWaalsContact O-CD2 3.27Å; L1117-Y1121 WeakPolarHBondContact O-CD2 3.49Å; L1117-Y1121 PolarHBondContact O-N 2.86Å; L1117-Y1121 VanDerWaalsContact O-N 3.15Å; I1118-Y1121 PolarHBondContact O-N 3.45Å; D1119-Y1121 PolarHBondContact O-N 3.47Å; Y1121-E1123 PolarHBondContact O-N 2.89Å; Y1121-N1124 PolarHBondContact O-N 3.07Å; Y1121-D1125 PolarHBondContact O-N 3.1Å; Y1121-D1125 VanDerWaalsContact O-N 3.16Å
1122	H	52.3	Low	46.3	Very low	66 Å²	66	86.8 Å²	86.8	31%	0.306	44%	0.439	S	S	.	.	H	α-helix	trans	-62.7	-24.6	175.5	-76.1	-53.6	0	0	0	114.7	I1118 D1119 K1126	I1118-H1122 PolarHBondContact O-CD2 3.37Å; I1118-H1122 PolarHBondContact O-N 2.96Å; D1119-H1122 PolarHBondContact O-N 3.2Å; H1122-K1126 WeakPolarHBondContact O-CG 3.44Å
1123	E	45.9	Very low	44.5	Very low	120 Å²	120	94 Å²	94	56%	0.561	48%	0.477	S	S	*	.	H	α-helix	trans	-76.6	-30	170.9	-73.2	-168.1	150.7	0	0	113.2	D1119 K1120 Y1121 N1127	D1119-E1123 PolarHBondContact O-N 3.42Å; D1119-E1123 VanDerWaalsContact O-N 3.16Å; K1120-E1123 PolarHBondContact O-N 3.41Å; Y1121-E1123 PolarHBondContact O-N 2.89Å; E1123-N1127 PolarHBondContact O-ND2 3.25Å
1124	N	43.2	Very low	43.2	Very low	91 Å²	91	101 Å²	101	49%	0.487	51%	0.505	S	S	.	.	H	α-helix	trans	-74.2	-42.7	177.9	-75.5	-31.6	0	0	0	112.1	K1120 Y1121 K1126 N1127 N1128	K1120-N1124 PolarHBondContact O-N 3.34Å; K1120-N1124 PolarHBondContact O-ND2 3.12Å; Y1121-N1124 PolarHBondContact O-N 3.07Å; N1124-K1126 VanDerWaalsContact C-N 3.33Å; N1124-K1126 PolarHBondContact O-N 3.27Å; N1124-N1127 PolarHBondContact O-N 3.16Å; N1124-N1128 PolarHBondContact O-N 3.15Å
1125	D	43	Very low	41.7	Very low	85 Å²	85	109.2 Å²	109.2	46%	0.455	54%	0.543	S	S	.	.	H	α-helix	trans	-60.2	-44.1	179.4	-63.2	-25.7	0	0	0	111.3	Y1121 N1127 N1128 D1129	Y1121-D1125 PolarHBondContact O-N 3.1Å; Y1121-D1125 VanDerWaalsContact O-N 3.16Å; D1125-N1127 PolarHBondContact O-N 3.46Å; D1125-N1127 VanDerWaalsContact O-N 3.07Å; D1125-N1128 PolarHBondContact O-N 3.16Å; D1125-N1128 VanDerWaalsContact O-N 3.09Å; D1125-D1129 PolarHBondContact O-N 3.26Å
1126	K	44.3	Very low	40.1	Very low	170 Å²	170	115.4 Å²	115.4	74%	0.739	58%	0.577	S	S	*	*	H	α-helix	trans	-60.5	-18.7	175.7	-75.2	178.6	179.6	174.6	0	115	H1122 N1124	H1122-K1126 WeakPolarHBondContact O-CG 3.44Å; N1124-K1126 VanDerWaalsContact C-N 3.33Å; N1124-K1126 PolarHBondContact O-N 3.27Å
1127	N	39.8	Very low	38.7	Very low	121 Å²	121	119.4 Å²	119.4	65%	0.647	60%	0.599	S	S	*	*	H	α-helix	trans	-94.3	-19.2	178.4	-78.5	-54.5	0	0	0	113.3	E1123 N1124 D1125	E1123-N1127 PolarHBondContact O-ND2 3.25Å; N1124-N1127 PolarHBondContact O-N 3.16Å; D1125-N1127 PolarHBondContact O-N 3.46Å; D1125-N1127 VanDerWaalsContact O-N 3.07Å
1128	N	37.3	Very low	37.8	Very low	121 Å²	121	122.1 Å²	122.1	65%	0.647	62%	0.619	S	S	*	*	H	α-helix	trans	-90.1	-31.4	179.7	-71.4	-22.9	0	0	0	112.7	N1124 D1125 K1130	N1124-N1128 PolarHBondContact O-N 3.15Å; D1125-N1128 PolarHBondContact O-N 3.16Å; D1125-N1128 VanDerWaalsContact O-N 3.09Å; N1128-K1130 PolarHBondContact O-N 3.25Å
1129	D	36.9	Very low	36.4	Very low	135 Å²	135	133.9 Å²	133.9	72%	0.722	66%	0.663	S	S	*	*			trans	-79.3	60.9	179.9	-71	-18.8	0	0	0	113.5	D1125	D1125-D1129 PolarHBondContact O-N 3.26Å
1130	K	34.6	Very low	35	Very low	191 Å²	191	136.5 Å²	136.5	83%	0.83	69%	0.685	S	S	*	*			trans	-104.5	11.6	166.1	-96.6	-178	178.6	172	0	114.2	N1128	N1128-K1130 PolarHBondContact O-N 3.25Å
1131	T	26.3	Very low	33.8	Very low	116 Å²	116	135 Å²	135	71%	0.712	69%	0.692	S	S	*	*	S	Bend	trans	-137.1	133.3	174.4	41.9	0	0	0	0	112
1132	S	26	Very low	32.8	Very low	108 Å²	108	139.5 Å²	139.5	76%	0.755	72%	0.72	S	S	*	*	S	Bend	trans	65.5	92.1	173.7	45.1	0	0	0	0	119.4
1133	L	24.7	Very low	31.5	Very low	161 Å²	161	139.5 Å²	139.5	84%	0.843	74%	0.738	S	S	*	*				53.3	90.2	124.6	-70.9	155.6	0	0	0	118.4
1134	F	26.3	Very low	30.4	Very low	203 Å²	203	142.9 Å²	142.9	89%	0.89	75%	0.751	S	S	*	*			trans	-157.8	53.5	131.3	-103.5	-65.9	0	0	0	111.7
1135	E	25.1	Very low	29.5	Very low	177 Å²	177	146.6 Å²	146.6	83%	0.827	77%	0.77	S	S	*	*			trans	-81.4	132.8	154	-73.6	-171.4	141.1	0	0	108.5
1136	N	25.5	Very low	28.5	Very low	138 Å²	138	149.5 Å²	149.5	74%	0.738	79%	0.785	S	S	*	*	S	Bend	trans	77.6	95.3	-175.3	-41.5	-66.7	0	0	0	115.2
1137	D	25.1	Very low	27.6	Very low	142 Å²	142	147.3 Å²	147.3	76%	0.759	79%	0.79	S	S	*	*	S	Bend		176.1	11.8	128.7	-93.2	-7	0	0	0	116.6
1138	V	30.2	Very low	26.8	Very low	138 Å²	138	146.6 Å²	146.6	84%	0.836	80%	0.795	S	S	*	*			trans	-104.4	63.1	165.9	-165.9	0	0	0	0	111.4
1139	R	25.4	Very low	26.3	Very low	249 Å²	249	150 Å²	150	94%	0.94	81%	0.806	S	S	*	*			trans	-125.2	29	173.8	-143.9	178.7	-166	177.9	5.5	113.1
1140	S	25.4	Very low	25.6	Very low	109 Å²	109	151.2 Å²	151.2	76%	0.762	81%	0.808	S	S	*	*			trans	-155.3	58.6	-178.6	60.7	0	0	0	0	115
1141	S	25.7	Very low	25.1	Very low	102 Å²	102	149 Å²	149	71%	0.713	81%	0.805	S	S	*	*			trans	-142.9	25.9	165.7	51.9	0	0	0	0	113.7	G1143	S1141-G1143 PolarHBondContact O-N 2.92Å
1142	I	25.9	Very low	24.9	Very low	187 Å²	187	148.5 Å²	148.5	96%	0.959	81%	0.806	S	S	*	*			trans	-77.9	95.4	162.7	-63.4	169.9	0	0	0	107.3
1143	G	24.2	Very low	24.8	Very low	66 Å²	66	153.7 Å²	153.7	68%	0.68	82%	0.816	S	S	*	*			trans	-149.3	82.3	-168.3	0	0	0	0	0	115.3	S1141	S1141-G1143 PolarHBondContact O-N 2.92Å
1144	K	23.4	Very low	24.7	Very low	191 Å²	191	152.9 Å²	152.9	83%	0.83	81%	0.812	S	S	*	*			trans	55.2	89.9	157.1	-61.1	176.5	179.9	174.6	0	117.7
1145	L	25.3	Very low	24.6	Very low	169 Å²	169	149.7 Å²	149.7	89%	0.885	80%	0.803	S	S	*	*			trans	-112.5	86.6	142.6	-102.7	164.9	0	0	0	109.3	C1147	L1145-C1147 PolarHBondContact O-N 3.02Å
1146	N	21.6	Very low	24.5	Very low	145 Å²	145	145.8 Å²	145.8	78%	0.775	80%	0.801	S	S	*	*			trans	-77.8	102.3	170.3	-80	1	0	0	0	109.5
1147	C	26	Very low	24.4	Very low	124 Å²	124	146.3 Å²	146.3	84%	0.838	80%	0.804	S	S	*	*			trans	-133	89.4	152.4	-83.6	0	0	0	0	108.5	L1145 H1149	L1145-C1147 PolarHBondContact O-N 3.02Å; C1147-H1149 PolarHBondContact O-N 3.39Å
1148	S	22.3	Very low	24.3	Very low	107 Å²	107	143.1 Å²	143.1	75%	0.748	80%	0.797	S	S	*	*			trans	-70.1	119.4	176.5	49.5	0	0	0	0	111.5
1149	H	27.2	Very low	24	Very low	191 Å²	191	141.1 Å²	141.1	88%	0.884	79%	0.789	S	S	*	*				-147.1	129.3	127.9	-107.9	-63.9	0	0	0	110.3	C1147	C1147-H1149 PolarHBondContact O-N 3.39Å
1150	E	22	Very low	24	Very low	161 Å²	161	138 Å²	138	75%	0.752	78%	0.779	S	S	*	*			trans	-86.3	129.5	-171.8	-55.6	153.6	129.7	0	0	110.4
1151	N	23.2	Very low	23.9	Very low	145 Å²	145	139.6 Å²	139.6	78%	0.775	78%	0.779	S	S	*	*				167.2	150.9	102.9	-89.4	-54.5	0	0	0	113.5
1152	S	22.9	Very low	23.8	Very low	105 Å²	105	141.1 Å²	141.1	73%	0.734	77%	0.773	S	S	*	*	S	Bend	trans	52.5	84.5	169.7	62.2	0	0	0	0	117.9
1153	F	23.8	Very low	23.9	Very low	218 Å²	218	136.9 Å²	136.9	96%	0.956	76%	0.76	S	S	*	*				-164.6	101.3	107	-109.9	-73.6	0	0	0	108.8
1154	N	21.5	Very low	24.1	Very low	143 Å²	143	137 Å²	137	77%	0.765	76%	0.76	S	S	*	*			trans	-140	149.5	-178.3	-150.5	-4	0	0	0	109.4
1155	I	24.9	Very low	24.5	Very low	137 Å²	137	134 Å²	134	70%	0.703	75%	0.754	S	S	*	*			trans	70.9	80.7	173.3	-40.4	176.9	0	0	0	115.9
1156	A	23.6	Very low	25.2	Very low	95 Å²	95	129.2 Å²	129.2	79%	0.785	73%	0.729	S	S	*	*				-121.7	65.2	126	0	0	0	0	0	108.5	A1158	A1156-A1158 PolarHBondContact O-N 3.43Å
1157	N	22.7	Very low	26.8	Very low	149 Å²	149	125.2 Å²	125.2	80%	0.797	71%	0.71	S	S	*	*			trans	-71.3	73.5	169.5	-83.4	-17.8	0	0	0	109.5
1158	A	23.8	Very low	27.9	Very low	74 Å²	74	120.5 Å²	120.5	61%	0.612	68%	0.677	S	S	*	*			trans	-94.1	123.7	159.5	0	0	0	0	0	107.6	A1156 Y1160	A1156-A1158 PolarHBondContact O-N 3.43Å; A1158-Y1160 PolarHBondContact O-N 2.87Å; A1158-Y1160 VanDerWaalsContact O-N 3.13Å
1159	S	23.6	Very low	29.4	Very low	97 Å²	97	116.9 Å²	116.9	68%	0.678	65%	0.649	S	S	*	*			trans	-51	116.7	174.8	50.1	0	0	0	0	110.9	N1161	S1159-N1161 PolarHBondContact O-N 3.13Å
1160	Y	25.5	Very low	31.1	Very low	184 Å²	184	114.5 Å²	114.5	72%	0.722	64%	0.636	S	S	*	*			trans	-70.5	70.8	174.6	-81.9	-88.8	0	0	0	111.4	A1158 F1162	A1158-Y1160 PolarHBondContact O-N 2.87Å; A1158-Y1160 VanDerWaalsContact O-N 3.13Å; Y1160-F1162 HydrophobicContact CD1-CD2 4.21Å; Y1160-F1162 AromaticContact CD1-CE2 3.52Å; Y1160-F1162 HydrophobicContact CD1-CE2 3.52Å; Y1160-F1162 HydrophobicContact CD1-CZ 4.14Å; Y1160-F1162 HydrophobicContact CE1-CE2 4.35Å; Y1160-F1162 HydrophobicContact CG-CE2 4.16Å; Y1160-F1162 PolarHBondContact O-N 3.1Å
1161	N	22.1	Very low	33.1	Very low	142 Å²	142	111.8 Å²	111.8	76%	0.759	62%	0.619	S	S	*	*			trans	-73.3	83.2	162.6	-75.6	-7.3	0	0	0	108	S1159 S1163	S1159-N1161 PolarHBondContact O-N 3.13Å; N1161-S1163 PolarHBondContact O-N 3.4Å
1162	F	25.3	Very low	35	Very low	134 Å²	134	105 Å²	105	59%	0.588	58%	0.582	S	S	*	*			trans	-62.8	103.3	168	-87.3	-92.6	0	0	0	109.2	Y1160	Y1160-F1162 HydrophobicContact CD1-CD2 4.21Å; Y1160-F1162 AromaticContact CD1-CE2 3.52Å; Y1160-F1162 HydrophobicContact CD1-CE2 3.52Å; Y1160-F1162 HydrophobicContact CD1-CZ 4.14Å; Y1160-F1162 HydrophobicContact CE1-CE2 4.35Å; Y1160-F1162 HydrophobicContact CG-CE2 4.16Å; Y1160-F1162 PolarHBondContact O-N 3.1Å
1163	S	27.2	Very low	37.1	Very low	98 Å²	98	100.9 Å²	100.9	69%	0.685	55%	0.552	S	S	*	*			trans	-102.7	106.5	170.9	56.1	0	0	0	0	110.4	N1161 D1165	N1161-S1163 PolarHBondContact O-N 3.4Å; S1163-D1165 VanDerWaalsContact C-N 3.32Å; S1163-D1165 PolarHBondContact O-N 2.68Å
1164	G	27.5	Very low	39.4	Very low	67 Å²	67	94.1 Å²	94.1	69%	0.691	53%	0.529	S	S	*	.	S	Bend	trans	62.5	-60.5	152.3	0	0	0	0	0	119.8
1165	D	32.2	Very low	41.7	Very low	130 Å²	130	89.4 Å²	89.4	70%	0.695	50%	0.501	S	S	*	.	S	Bend	trans	-120.2	109.8	-146.4	-63.7	-43.8	0	0	0	114.4	S1163 T1167	S1163-D1165 VanDerWaalsContact C-N 3.32Å; S1163-D1165 PolarHBondContact O-N 2.68Å; D1165-T1167 PolarHBondContact O-N 2.86Å
1166	N	41.3	Very low	44	Very low	67 Å²	67	82.9 Å²	82.9	36%	0.358	47%	0.468	S	S	.	.			trans	53.5	51	154.3	-68.3	-33.3	0	0	0	117.4	K1170	N1166-K1170 WeakPolarHBondContact O-CG 3.47Å
1167	T	53.6	Low	46.4	Very low	61 Å²	61	80.2 Å²	80.2	37%	0.374	44%	0.44	S	S	.	.	H	α-helix	trans	-86.6	-34.6	-176.7	57.6	0	0	0	0	115.4	D1165 R1171	D1165-T1167 PolarHBondContact O-N 2.86Å; T1167-R1171 VanDerWaalsContact O-CB 3.31Å; T1167-R1171 WeakPolarHBondContact O-CB 3.46Å; T1167-R1171 PolarHBondContact O-N 2.93Å
1168	T	49.3	Very low	49	Very low	26 Å²	26	77.6 Å²	77.6	16%	0.16	42%	0.423	C	S	.	.	H	α-helix	trans	-70	-44.2	-172.7	51.2	0	0	0	0	113.2	F1115 R1171 S1172	F1115-T1168 HydrophobicContact CB-CG2 3.96Å; F1115-T1168 HydrophobicContact CD1-CG2 4.39Å; F1115-T1168 HydrophobicContact CD2-CG2 3.75Å; F1115-T1168 HydrophobicContact CE2-CG2 4.28Å; F1115-T1168 HydrophobicContact CG-CG2 3.81Å; T1168-R1171 WeakPolarHBondContact O-CB 3.08Å; T1168-R1171 PolarHBondContact O-N 3.27Å; T1168-S1172 PolarHBondContact O-N 2.89Å; T1168-S1172 PolarHBondContact O-OG 3.44Å
1169	M	53.7	Low	51.5	Low	30 Å²	30	75.5 Å²	75.5	15%	0.148	40%	0.402	C	S	.	.	H	α-helix	trans	-65.6	-42.3	176.4	-159	-177.8	-159.7	0	0	111.9	Q1112 R1171 S1172 I1173 L1233	Q1112-M1169 PolarHBondContact OE1-SD 3.5Å; M1169-R1171 VanDerWaalsContact C-N 3.32Å; M1169-R1171 PolarHBondContact O-N 2.96Å; M1169-S1172 PolarHBondContact O-N 2.93Å; M1169-S1172 PolarHBondContact O-OG 3.46Å; M1169-I1173 HydrophobicContact CG-CD1 4.17Å; M1169-I1173 WeakPolarHBondContact O-CB 3.42Å; M1169-I1173 VanDerWaalsContact O-CG1 3.26Å; M1169-I1173 WeakPolarHBondContact O-CG1 3.38Å; M1169-I1173 PolarHBondContact O-N 3Å; M1169-L1233 HydrophobicContact CE-CB 3.99Å; M1169-L1233 HydrophobicContact CE-CD2 3.59Å; M1169-L1233 HydrophobicContact CE-CG 4.41Å; M1169-L1233 WeakPolarHBondContact CE-O 3.45Å
1170	K	62.7	Low	54	Low	141 Å²	141	70.9 Å²	70.9	61%	0.613	37%	0.37	S	S	*	.	H	α-helix	trans	-60.1	-42.3	172.9	-76.1	-176.3	176.8	178.2	0	111.5	N1166 S1172 I1173 T1174	N1166-K1170 WeakPolarHBondContact O-CG 3.47Å; K1170-S1172 PolarHBondContact O-N 2.82Å; K1170-I1173 PolarHBondContact O-N 3.32Å; K1170-T1174 WeakPolarHBondContact O-CG2 3.22Å; K1170-T1174 PolarHBondContact O-N 2.95Å; K1170-T1174 PolarHBondContact O-OG1 3.4Å
1171	R	64.1	Low	56.5	Low	105 Å²	105	64.2 Å²	64.2	40%	0.396	35%	0.345	S	S	.	.	H	α-helix	trans	-63.9	-38	177.8	-170.5	-171.4	-166	-162	9.2	112.9	E1072 T1167 T1168 M1169 T1174 K1175	E1072-R1171 IonicContact OE2-NH1 3.95Å; T1167-R1171 VanDerWaalsContact O-CB 3.31Å; T1167-R1171 WeakPolarHBondContact O-CB 3.46Å; T1167-R1171 PolarHBondContact O-N 2.93Å; T1168-R1171 WeakPolarHBondContact O-CB 3.08Å; T1168-R1171 PolarHBondContact O-N 3.27Å; M1169-R1171 VanDerWaalsContact C-N 3.32Å; M1169-R1171 PolarHBondContact O-N 2.96Å; R1171-T1174 PolarHBondContact O-OG1 2.86Å; R1171-T1174 VanDerWaalsContact O-OG1 3.13Å; R1171-K1175 WeakPolarHBondContact O-CB 3.45Å; R1171-K1175 VanDerWaalsContact O-CG 3.26Å; R1171-K1175 WeakPolarHBondContact O-CG 3.44Å; R1171-K1175 PolarHBondContact O-N 3.5Å; R1171-K1175 VanDerWaalsContact O-N 3.14Å
1172	S	64.3	Low	58.9	Low	2 Å²	2	63.4 Å²	63.4	1%	0.014	33%	0.331	C	S	.	.	H	α-helix	trans	-73.6	-38.5	175.1	49.7	0	0	0	0	112	T1168 M1169 K1170 K1175 L1176	T1168-S1172 PolarHBondContact O-N 2.89Å; T1168-S1172 PolarHBondContact O-OG 3.44Å; M1169-S1172 PolarHBondContact O-N 2.93Å; M1169-S1172 PolarHBondContact O-OG 3.46Å; K1170-S1172 PolarHBondContact O-N 2.82Å; S1172-K1175 PolarHBondContact O-N 3.35Å; S1172-L1176 VanDerWaalsContact O-CB 3.31Å; S1172-L1176 WeakPolarHBondContact O-CB 3.43Å; S1172-L1176 VanDerWaalsContact O-CG 3.27Å; S1172-L1176 WeakPolarHBondContact O-CG 3.28Å; S1172-L1176 PolarHBondContact O-N 3.3Å
1173	I	66.5	Low	61.2	Low	19 Å²	19	57 Å²	57	10%	0.097	30%	0.303	C	S	.	.	H	α-helix	trans	-61.9	-45.2	173	-67.3	164.3	0	0	0	111.1	M1169 K1170 L1176 N1177 I1230 L1233 D1235	M1169-I1173 HydrophobicContact CG-CD1 4.17Å; M1169-I1173 WeakPolarHBondContact O-CB 3.42Å; M1169-I1173 VanDerWaalsContact O-CG1 3.26Å; M1169-I1173 WeakPolarHBondContact O-CG1 3.38Å; M1169-I1173 PolarHBondContact O-N 3Å; K1170-I1173 PolarHBondContact O-N 3.32Å; I1173-L1176 PolarHBondContact O-N 2.75Å; I1173-N1177 WeakPolarHBondContact O-CB 3.32Å; I1173-N1177 PolarHBondContact O-N 2.76Å; I1173-I1230 HydrophobicContact CG2-CG2 4.44Å; I1173-L1233 HydrophobicContact CD1-CB 4.16Å; I1173-L1233 HydrophobicContact CG1-CB 4.16Å; I1173-L1233 HydrophobicContact CG1-CD1 4.08Å; I1173-D1235 HydrophobicContact CD1-CB 4.44Å; I1173-D1235 HydrophobicContact CG2-CB 4.47Å
1174	T	70.9	Confident	63.4	Low	76 Å²	76	52.5 Å²	52.5	47%	0.466	27%	0.272	S	S	.	.	H	α-helix	trans	-65.4	-42.5	178.3	56.9	0	0	0	0	112.1	K1170 R1171 L1176 N1177 E1178	K1170-T1174 WeakPolarHBondContact O-CG2 3.22Å; K1170-T1174 PolarHBondContact O-N 2.95Å; K1170-T1174 PolarHBondContact O-OG1 3.4Å; R1171-T1174 PolarHBondContact O-OG1 2.86Å; R1171-T1174 VanDerWaalsContact O-OG1 3.13Å; T1174-L1176 PolarHBondContact O-N 2.84Å; T1174-N1177 PolarHBondContact O-N 3.1Å; T1174-E1178 WeakPolarHBondContact O-CB 3.05Å; T1174-E1178 WeakPolarHBondContact O-CG 3.26Å; T1174-E1178 PolarHBondContact O-N 3.4Å
1175	K	70.6	Confident	65.6	Low	43 Å²	43	53.5 Å²	53.5	19%	0.187	26%	0.261	C	S	.	.	H	α-helix	trans	-63.5	-39.1	174.5	-73.3	176.9	-174	173.4	0	112.7	E1072 L1076 R1171 S1172 L1179	E1072-K1175 IonicContact OE1-NZ 2.77Å; E1072-K1175 PolarHBondContact OE1-NZ 3.26Å; L1076-K1175 HydrophobicContact CD1-CB 4.13Å; L1076-K1175 HydrophobicContact CD1-CD 3.45Å; L1076-K1175 VanDerWaalsContact CD1-CD 3.45Å; L1076-K1175 HydrophobicContact CD1-CG 4.48Å; L1076-K1175 HydrophobicContact CD2-CB 4.18Å; R1171-K1175 WeakPolarHBondContact O-CB 3.45Å; R1171-K1175 VanDerWaalsContact O-CG 3.26Å; R1171-K1175 WeakPolarHBondContact O-CG 3.44Å; R1171-K1175 PolarHBondContact O-N 3.5Å; R1171-K1175 VanDerWaalsContact O-N 3.14Å; S1172-K1175 PolarHBondContact O-N 3.35Å; K1175-L1179 WeakPolarHBondContact O-CB 3.25Å; K1175-L1179 PolarHBondContact O-N 3.22Å
1176	L	72.6	Confident	67.4	Low	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.4	-45.8	174.8	-79.8	171.4	0	0	0	111	L1076 L1081 W1108 S1172 I1173 T1174 L1179 A1180 I1226 I1230 L1233	L1076-L1176 HydrophobicContact CD2-CD2 3.76Å; L1076-L1176 HydrophobicContact CD2-CG 3.73Å; L1081-L1176 HydrophobicContact CD1-CD2 4.28Å; W1108-L1176 HydrophobicContact CH2-CD1 4.14Å; W1108-L1176 HydrophobicContact CH2-CD2 4.3Å; W1108-L1176 HydrophobicContact CZ2-CD1 4.21Å; S1172-L1176 VanDerWaalsContact O-CB 3.31Å; S1172-L1176 WeakPolarHBondContact O-CB 3.43Å; S1172-L1176 VanDerWaalsContact O-CG 3.27Å; S1172-L1176 WeakPolarHBondContact O-CG 3.28Å; S1172-L1176 PolarHBondContact O-N 3.3Å; I1173-L1176 PolarHBondContact O-N 2.75Å; T1174-L1176 PolarHBondContact O-N 2.84Å; L1176-L1179 PolarHBondContact O-N 3.2Å; L1176-A1180 PolarHBondContact O-N 3.37Å; L1176-I1226 HydrophobicContact CB-CG2 3.94Å; L1176-I1226 HydrophobicContact CD2-CG1 4.3Å; L1176-I1226 HydrophobicContact CD2-CG2 4.22Å; L1176-I1226 WeakPolarHBondContact O-CG2 3.01Å; L1176-I1230 HydrophobicContact CB-CD1 4.06Å; L1176-I1230 HydrophobicContact CB-CG1 4.18Å; L1176-I1230 HydrophobicContact CD1-CG1 4.38Å; L1176-L1233 HydrophobicContact CD1-CD1 3.88Å
1177	N	75.5	Confident	68.8	Low	39 Å²	39	45.9 Å²	45.9	21%	0.209	22%	0.22	C	C	.	.	H	α-helix	trans	-62.5	-47.2	176	-170.6	5.3	0	0	0	111.2	I1173 T1174 L1179 A1180 Q1181 I1230 V1238 I1242	I1173-N1177 WeakPolarHBondContact O-CB 3.32Å; I1173-N1177 PolarHBondContact O-N 2.76Å; T1174-N1177 PolarHBondContact O-N 3.1Å; N1177-L1179 VanDerWaalsContact C-N 3.28Å; N1177-L1179 PolarHBondContact O-N 2.94Å; N1177-A1180 PolarHBondContact O-N 3.42Å; N1177-A1180 VanDerWaalsContact O-N 3.12Å; N1177-Q1181 WeakPolarHBondContact O-CG 3.29Å; N1177-Q1181 PolarHBondContact O-N 3.21Å; N1177-Q1181 PolarHBondContact OD1-NE2 2.9Å; N1177-I1230 HydrophobicContact CB-CD1 4.42Å; N1177-V1238 HydrophobicContact CB-CG1 4.25Å; N1177-V1238 WeakPolarHBondContact ND2-CG1 3.47Å; N1177-I1242 HydrophobicContact CB-CD1 4.4Å
1178	E	77.1	Confident	69.5	Low	94 Å²	94	47 Å²	47	44%	0.439	22%	0.221	S	C	.	.	H	α-helix	trans	-54.8	-42.2	173.1	-81.3	-174.2	-134.5	0	0	112.6	T1174 R1182	T1174-E1178 WeakPolarHBondContact O-CB 3.05Å; T1174-E1178 WeakPolarHBondContact O-CG 3.26Å; T1174-E1178 PolarHBondContact O-N 3.4Å; E1178-R1182 WeakPolarHBondContact O-CB 3.43Å; E1178-R1182 WeakPolarHBondContact O-CG 3.26Å; E1178-R1182 PolarHBondContact O-N 3.47Å; E1178-R1182 IonicContact OE2-CZ 3.73Å; E1178-R1182 IonicContact OE2-NH2 2.77Å; E1178-R1182 PolarHBondContact OE2-NH2 3.26Å
1179	L	75.5	Confident	70.2	Confident	31 Å²	31	48.6 Å²	48.6	16%	0.162	23%	0.233	C	C	.	.	H	α-helix	trans	-68.1	-39.9	178.1	-165.5	147.1	0	0	0	111.3	K1175 L1176 N1177 V1183 L1222 I1226	K1175-L1179 WeakPolarHBondContact O-CB 3.25Å; K1175-L1179 PolarHBondContact O-N 3.22Å; L1176-L1179 PolarHBondContact O-N 3.2Å; N1177-L1179 VanDerWaalsContact C-N 3.28Å; N1177-L1179 PolarHBondContact O-N 2.94Å; L1179-V1183 HydrophobicContact CD2-CG2 4.33Å; L1179-V1183 VanDerWaalsContact O-CG2 3.29Å; L1179-V1183 WeakPolarHBondContact O-CG2 3.24Å; L1179-V1183 PolarHBondContact O-N 3.46Å; L1179-V1183 VanDerWaalsContact O-N 3.13Å; L1179-L1222 HydrophobicContact CD2-CD2 4.21Å; L1179-I1226 HydrophobicContact CD2-CD1 3.44Å; L1179-I1226 VanDerWaalsContact CD2-CD1 3.44Å
1180	A	76	Confident	70.2	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.1	-45.3	174.1	0	0	0	0	0	112.7	L1176 N1177 V1183 L1184 I1226 I1242	L1176-A1180 PolarHBondContact O-N 3.37Å; N1177-A1180 PolarHBondContact O-N 3.42Å; N1177-A1180 VanDerWaalsContact O-N 3.12Å; A1180-V1183 PolarHBondContact O-N 3.05Å; A1180-L1184 WeakPolarHBondContact O-CG 3.14Å; A1180-L1184 PolarHBondContact O-N 2.88Å; A1180-I1226 HydrophobicContact CB-CB 4.37Å; A1180-I1226 HydrophobicContact CB-CD1 4.24Å; A1180-I1226 HydrophobicContact CB-CG2 3.87Å; A1180-I1242 HydrophobicContact CB-CD1 4.04Å; A1180-I1242 HydrophobicContact CB-CG1 4.4Å; A1180-I1242 HydrophobicContact CB-CG2 4Å
1181	Q	78.2	Confident	69.3	Low	43 Å²	43	50.3 Å²	50.3	20%	0.201	24%	0.24	C	C	.	.	H	α-helix	trans	-61.1	-48	175.9	-59.7	-51.8	-46.1	0	0	110.8	N1177 V1183 L1184 D1185	N1177-Q1181 WeakPolarHBondContact O-CG 3.29Å; N1177-Q1181 PolarHBondContact O-N 3.21Å; N1177-Q1181 PolarHBondContact OD1-NE2 2.9Å; Q1181-V1183 PolarHBondContact O-N 3.26Å; Q1181-L1184 WeakPolarHBondContact O-CB 2.98Å; Q1181-L1184 PolarHBondContact O-N 2.91Å; Q1181-D1185 PolarHBondContact O-N 3.23Å
1182	R	73.7	Confident	67.7	Low	125 Å²	125	54.3 Å²	54.3	47%	0.472	26%	0.257	S	S	.	.	H	α-helix	trans	-59.6	-30.5	178.3	-70.3	174.4	-157.1	-167.9	8.6	113.5	E1178 H1186	E1178-R1182 WeakPolarHBondContact O-CB 3.43Å; E1178-R1182 WeakPolarHBondContact O-CG 3.26Å; E1178-R1182 PolarHBondContact O-N 3.47Å; E1178-R1182 IonicContact OE2-CZ 3.73Å; E1178-R1182 IonicContact OE2-NH2 2.77Å; E1178-R1182 PolarHBondContact OE2-NH2 3.26Å; R1182-H1186 WeakPolarHBondContact O-CB 3.22Å; R1182-H1186 PolarHBondContact O-N 3.27Å
1183	V	71.7	Confident	66.2	Low	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-76.8	-41.5	174.2	176.9	0	0	0	0	111	L1179 A1180 Q1181 H1186 V1187 F1207 L1219 L1222 V1223	L1179-V1183 HydrophobicContact CD2-CG2 4.33Å; L1179-V1183 VanDerWaalsContact O-CG2 3.29Å; L1179-V1183 WeakPolarHBondContact O-CG2 3.24Å; L1179-V1183 PolarHBondContact O-N 3.46Å; L1179-V1183 VanDerWaalsContact O-N 3.13Å; A1180-V1183 PolarHBondContact O-N 3.05Å; Q1181-V1183 PolarHBondContact O-N 3.26Å; V1183-H1186 PolarHBondContact O-N 2.93Å; V1183-V1187 WeakPolarHBondContact O-CG2 3.21Å; V1183-V1187 PolarHBondContact O-N 3.27Å; V1183-F1207 HydrophobicContact CG2-CD1 4.27Å; V1183-F1207 HydrophobicContact CG2-CE1 3.57Å; V1183-F1207 HydrophobicContact CG2-CE2 4.05Å; V1183-F1207 HydrophobicContact CG2-CZ 3.44Å; V1183-F1207 VanDerWaalsContact CG2-CZ 3.44Å; V1183-L1219 HydrophobicContact CG1-CB 3.85Å; V1183-L1219 HydrophobicContact CG1-CD2 4.17Å; V1183-L1222 HydrophobicContact CG2-CD2 4.08Å; V1183-V1223 HydrophobicContact CB-CG2 3.68Å; V1183-V1223 HydrophobicContact CG1-CG2 3.46Å; V1183-V1223 VanDerWaalsContact CG1-CG2 3.46Å
1184	L	73.8	Confident	64.6	Low	4 Å²	4	69.2 Å²	69.2	2%	0.021	33%	0.33	C	S	.	.	H	α-helix	trans	-59	-48.9	173.2	-74.1	165.4	0	0	0	111.4	A1180 Q1181 H1186 V1187 E1188 V1223 K1245 L1246	A1180-L1184 WeakPolarHBondContact O-CG 3.14Å; A1180-L1184 PolarHBondContact O-N 2.88Å; Q1181-L1184 WeakPolarHBondContact O-CB 2.98Å; Q1181-L1184 PolarHBondContact O-N 2.91Å; L1184-H1186 PolarHBondContact O-N 3.44Å; L1184-V1187 PolarHBondContact O-N 3.26Å; L1184-E1188 PolarHBondContact O-N 3.47Å; L1184-V1223 HydrophobicContact CD1-CG1 4.21Å; L1184-V1223 HydrophobicContact CD2-CG1 4.09Å; L1184-V1223 HydrophobicContact CG-CG1 4.03Å; L1184-V1223 HydrophobicContact CG-CG2 4.26Å; L1184-K1245 HydrophobicContact CD1-CB 3.88Å; L1184-K1245 HydrophobicContact CD1-CD 4.01Å; L1184-K1245 HydrophobicContact CD2-CB 4.45Å; L1184-L1246 HydrophobicContact CD2-CD1 4.18Å
1185	D	73.6	Confident	62.7	Low	87 Å²	87	72.9 Å²	72.9	47%	0.465	34%	0.341	S	S	.	.	H	α-helix	trans	-57	-35.7	175.5	-58.6	-25	0	0	0	111.5	Q1181 S1189	Q1181-D1185 PolarHBondContact O-N 3.23Å; D1185-S1189 VanDerWaalsContact O-CB 3.29Å; D1185-S1189 WeakPolarHBondContact O-CB 3.3Å; D1185-S1189 PolarHBondContact O-N 3.25Å; D1185-S1189 PolarHBondContact O-OG 3.02Å
1186	H	71.2	Confident	60.8	Low	19 Å²	19	78.6 Å²	78.6	9%	0.088	37%	0.374	C	S	.	.	H	α-helix	trans	-73.8	-32.8	175.9	-170.8	57.3	0	0	0	113.4	R1182 V1183 L1184 S1189 K1190	R1182-H1186 WeakPolarHBondContact O-CB 3.22Å; R1182-H1186 PolarHBondContact O-N 3.27Å; V1183-H1186 PolarHBondContact O-N 2.93Å; L1184-H1186 PolarHBondContact O-N 3.44Å; H1186-S1189 WeakPolarHBondContact CA-OG 3.31Å; H1186-S1189 PolarHBondContact O-OG 2.97Å; H1186-K1190 PolarHBondContact O-N 3.34Å
1187	V	70.3	Confident	58.7	Low	18 Å²	18	83.7 Å²	83.7	11%	0.109	41%	0.408	C	S	.	.	H	α-helix	trans	-72.6	-40.3	174.4	171.1	0	0	0	0	110.8	V1183 L1184 L1219	V1183-V1187 WeakPolarHBondContact O-CG2 3.21Å; V1183-V1187 PolarHBondContact O-N 3.27Å; L1184-V1187 PolarHBondContact O-N 3.26Å; V1187-L1219 HydrophobicContact CG2-CB 4.1Å; V1187-L1219 HydrophobicContact CG2-CD1 4.43Å
1188	E	67.6	Low	56.9	Low	84 Å²	84	86.5 Å²	86.5	39%	0.393	43%	0.431	S	S	.	.	H	α-helix	trans	-69.1	-44.1	175.9	-69.3	-171.5	169.6	0	0	112.3	L1184 K1190 K1191 C1249	L1184-E1188 PolarHBondContact O-N 3.47Å; E1188-K1190 PolarHBondContact O-N 3.36Å; E1188-K1191 WeakPolarHBondContact O-CB 3.32Å; E1188-K1191 PolarHBondContact O-N 3.23Å; E1188-C1249 PolarHBondContact OE1-SG 3.3Å
1189	S	64.1	Low	55	Low	60 Å²	60	89 Å²	89	42%	0.42	45%	0.447	S	S	.	.	H	α-helix	trans	-64.1	-24.9	177.8	52	0	0	0	0	113.8	D1185 H1186 K1191 Y1192	D1185-S1189 VanDerWaalsContact O-CB 3.29Å; D1185-S1189 WeakPolarHBondContact O-CB 3.3Å; D1185-S1189 PolarHBondContact O-N 3.25Å; D1185-S1189 PolarHBondContact O-OG 3.02Å; H1186-S1189 WeakPolarHBondContact CA-OG 3.31Å; H1186-S1189 PolarHBondContact O-OG 2.97Å; S1189-K1191 PolarHBondContact O-N 3.06Å; S1189-Y1192 PolarHBondContact O-N 3.02Å; S1189-Y1192 VanDerWaalsContact O-N 3.12Å
1190	K	54.3	Low	53.2	Low	119 Å²	119	89.8 Å²	89.8	52%	0.517	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-18.2	170.4	-84.3	-178.8	178.3	177.3	0	114	H1186 E1188 N1211	H1186-K1190 PolarHBondContact O-N 3.34Å; E1188-K1190 PolarHBondContact O-N 3.36Å; K1190-N1211 PolarHBondContact NZ-OD1 2.91Å
1191	K	43	Very low	51.5	Low	89 Å²	89	93.4 Å²	93.4	39%	0.387	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-31.2	171.4	-65.5	-176.5	-178.4	174.7	0	112.4	E1188 S1189 T1193 C1249 N1252	E1188-K1191 WeakPolarHBondContact O-CB 3.32Å; E1188-K1191 PolarHBondContact O-N 3.23Å; S1189-K1191 PolarHBondContact O-N 3.06Å; K1191-T1193 PolarHBondContact O-N 3.35Å; K1191-C1249 PolarHBondContact NZ-O 3.05Å; K1191-N1252 PolarHBondContact NZ-O 3.49Å
1192	Y	30.9	Very low	50	Low	189 Å²	189	97.9 Å²	97.9	74%	0.741	50%	0.504	S	S	*	.	S	Bend	trans	-91.8	85	179.1	-69.5	-79.4	0	0	0	110.9	S1189	S1189-Y1192 PolarHBondContact O-N 3.02Å; S1189-Y1192 VanDerWaalsContact O-N 3.12Å
1193	T	33.3	Very low	48.4	Very low	110 Å²	110	95.2 Å²	95.2	68%	0.675	50%	0.499	S	S	*	.			trans	35.1	129.8	155.3	49.7	0	0	0	0	119.5	K1191 E1195	K1191-T1193 PolarHBondContact O-N 3.35Å; T1193-E1195 PolarHBondContact O-N 2.95Å
1194	K	32.7	Very low	46.9	Very low	223 Å²	223	97.9 Å²	97.9	97%	0.97	52%	0.517	S	S	*	.	S	Bend	trans	-55.4	9.3	175	-98.9	177	176.7	173.2	0	118
1195	E	30.5	Very low	45.6	Very low	153 Å²	153	102.7 Å²	102.7	72%	0.715	54%	0.543	S	S	*	.	S	Bend	trans	-119.7	123.5	-174.2	-62.6	-178.9	168.4	0	0	109.3	T1193	T1193-E1195 PolarHBondContact O-N 2.95Å
1196	N	30.6	Very low	44.5	Very low	164 Å²	164	100.1 Å²	100.1	88%	0.877	53%	0.532	S	S	*	.	S	Bend	trans	83	44.9	174.3	-45.2	-40.3	0	0	0	118.8
1197	C	29.3	Very low	43.7	Very low	106 Å²	106	99.8 Å²	99.8	72%	0.716	53%	0.53	S	S	*	.			trans	-123.3	73.9	162.9	-149.2	0	0	0	0	112
1198	S	38.2	Very low	43	Very low	98 Å²	98	101.3 Å²	101.3	69%	0.685	54%	0.541	S	S	*	.			trans	-81.7	-19.2	177.6	47.1	0	0	0	0	114.4
1199	D	37.4	Very low	42.3	Very low	146 Å²	146	100.3 Å²	100.3	78%	0.781	54%	0.536	S	S	*	.	S	Bend	trans	-106.5	7.3	-156	-66.6	10.3	0	0	0	114.5
1200	S	35.8	Very low	41.7	Very low	48 Å²	48	97.6 Å²	97.6	34%	0.336	52%	0.517	S	S	.	.			trans	-134.2	46.1	176.9	69.1	0	0	0	0	115.7	N1202 I1203	S1200-N1202 PolarHBondContact O-N 2.82Å; S1200-N1202 VanDerWaalsContact O-N 3.09Å; S1200-I1203 PolarHBondContact O-N 2.65Å
1201	P	42	Very low	41.5	Very low	76 Å²	76	95.7 Å²	95.7	49%	0.494	51%	0.513	S	S	.	.	H	α-helix	trans	-60.3	-24.3	-176.8	25.5	-35.1	0	0	0	114	N1205	P1201-N1205 WeakPolarHBondContact O-CB 3.45Å; P1201-N1205 VanDerWaalsContact O-CG 3.31Å; P1201-N1205 PolarHBondContact O-N 2.8Å; P1201-N1205 PolarHBondContact O-ND2 2.68Å
1202	N	46	Very low	41.7	Very low	137 Å²	137	98.1 Å²	98.1	73%	0.733	53%	0.53	S	S	*	.	H	α-helix	trans	-72.2	-27.1	-178.2	-70.7	-11.2	0	0	0	113.9	S1200 S1206	S1200-N1202 PolarHBondContact O-N 2.82Å; S1200-N1202 VanDerWaalsContact O-N 3.09Å; N1202-S1206 PolarHBondContact O-OG 3.41Å
1203	I	41	Very low	42.5	Very low	70 Å²	70	91.9 Å²	91.9	36%	0.359	51%	0.509	S	S	.	.	H	α-helix	trans	-84.2	-48.2	-178.8	-57.8	178.8	0	0	0	110.3	S1200 N1205 S1206 F1207	S1200-I1203 PolarHBondContact O-N 2.65Å; I1203-N1205 VanDerWaalsContact C-N 3.27Å; I1203-N1205 PolarHBondContact O-N 3.21Å; I1203-S1206 PolarHBondContact O-N 3.41Å; I1203-S1206 PolarHBondContact O-OG 3.42Å; I1203-F1207 HydrophobicContact CG2-CD2 4.11Å; I1203-F1207 HydrophobicContact CG2-CE2 4.02Å; I1203-F1207 PolarHBondContact O-N 2.9Å
1204	C	38.7	Very low	43	Very low	56 Å²	56	91.3 Å²	91.3	38%	0.378	51%	0.51	S	S	.	.	H	α-helix	trans	-58.3	-37.7	176.5	-72.8	0	0	0	0	112.8	S1206 S1208	C1204-S1206 VanDerWaalsContact C-N 3.31Å; C1204-S1206 PolarHBondContact O-N 2.86Å; C1204-S1208 WeakPolarHBondContact O-CB 3.46Å; C1204-S1208 PolarHBondContact O-N 3.47Å; C1204-S1208 VanDerWaalsContact O-N 3.09Å
1205	N	47.8	Very low	43.6	Very low	105 Å²	105	82.9 Å²	82.9	56%	0.561	49%	0.486	S	S	*	.	H	α-helix	trans	-72.2	-21	176.6	-75.1	-22.4	0	0	0	114.1	P1201 I1203 S1208	P1201-N1205 WeakPolarHBondContact O-CB 3.45Å; P1201-N1205 VanDerWaalsContact O-CG 3.31Å; P1201-N1205 PolarHBondContact O-N 2.8Å; P1201-N1205 PolarHBondContact O-ND2 2.68Å; I1203-N1205 VanDerWaalsContact C-N 3.27Å; I1203-N1205 PolarHBondContact O-N 3.21Å; N1205-S1208 PolarHBondContact O-OG 2.88Å
1206	S	49.8	Very low	44.7	Very low	33 Å²	33	82.5 Å²	82.5	23%	0.231	48%	0.484	C	S	.	.	H	α-helix	trans	-80.8	-25.6	178.4	61.7	0	0	0	0	114.1	N1202 I1203 C1204	N1202-S1206 PolarHBondContact O-OG 3.41Å; I1203-S1206 PolarHBondContact O-N 3.41Å; I1203-S1206 PolarHBondContact O-OG 3.42Å; C1204-S1206 VanDerWaalsContact C-N 3.31Å; C1204-S1206 PolarHBondContact O-N 2.86Å
1207	F	55.1	Low	46.3	Very low	12 Å²	12	75.8 Å²	75.8	5%	0.053	45%	0.448	C	S	.	.	H	α-helix	trans	-109.1	-8.1	179.2	-61.3	-59.9	0	0	0	114.4	V1183 I1203 Q1209 L1210 N1211 L1219	V1183-F1207 HydrophobicContact CG2-CD1 4.27Å; V1183-F1207 HydrophobicContact CG2-CE1 3.57Å; V1183-F1207 HydrophobicContact CG2-CE2 4.05Å; V1183-F1207 HydrophobicContact CG2-CZ 3.44Å; V1183-F1207 VanDerWaalsContact CG2-CZ 3.44Å; I1203-F1207 HydrophobicContact CG2-CD2 4.11Å; I1203-F1207 HydrophobicContact CG2-CE2 4.02Å; I1203-F1207 PolarHBondContact O-N 2.9Å; F1207-Q1209 VanDerWaalsContact C-N 3.29Å; F1207-Q1209 PolarHBondContact O-N 3.46Å; F1207-L1210 HydrophobicContact CD1-CD1 3.88Å; F1207-L1210 PolarHBondContact O-N 3.36Å; F1207-N1211 PolarHBondContact O-ND2 3.26Å; F1207-L1219 HydrophobicContact CB-CD2 4.32Å; F1207-L1219 HydrophobicContact CD1-CD2 4.45Å
1208	S	54.8	Low	47.9	Very low	49 Å²	49	71.3 Å²	71.3	34%	0.343	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-53.4	-45.3	177.6	56	0	0	0	0	112.3	C1204 N1205 L1210 N1211	C1204-S1208 WeakPolarHBondContact O-CB 3.46Å; C1204-S1208 PolarHBondContact O-N 3.47Å; C1204-S1208 VanDerWaalsContact O-N 3.09Å; N1205-S1208 PolarHBondContact O-OG 2.88Å; S1208-L1210 PolarHBondContact O-N 3.38Å; S1208-N1211 WeakPolarHBondContact O-CB 3.37Å; S1208-N1211 PolarHBondContact O-N 3.08Å; S1208-N1211 PolarHBondContact O-ND2 3.06Å; S1208-N1211 VanDerWaalsContact O-ND2 3.15Å
1209	Q	52.4	Low	49.4	Very low	63 Å²	63	67 Å²	67	29%	0.294	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-65	-16.4	179	-64.8	-179.4	-5	0	0	114.7	S980 F1207	S980-Q1209 PolarHBondContact O-OE1 2.72Å; F1207-Q1209 VanDerWaalsContact C-N 3.29Å; F1207-Q1209 PolarHBondContact O-N 3.46Å
1210	L	51.8	Low	51	Low	3 Å²	3	61 Å²	61	2%	0.016	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-80.8	-19.8	172.7	-68.1	179.2	0	0	0	112.6	P1078 C1079 L1082 F1207 S1208 D1212 L1213 N1218 L1219 L1222	P1078-L1210 HydrophobicContact CB-CD1 4.11Å; P1078-L1210 HydrophobicContact CG-CD1 4.48Å; C1079-L1210 VanDerWaalsContact SG-CD2 3.55Å; L1082-L1210 HydrophobicContact CD1-CD1 4.46Å; L1082-L1210 HydrophobicContact CD1-CD2 3.72Å; F1207-L1210 HydrophobicContact CD1-CD1 3.88Å; F1207-L1210 PolarHBondContact O-N 3.36Å; S1208-L1210 PolarHBondContact O-N 3.38Å; L1210-D1212 VanDerWaalsContact C-N 3.27Å; L1210-L1213 HydrophobicContact CD2-CD1 3.7Å; L1210-N1218 PolarHBondContact O-ND2 3.2Å; L1210-L1219 HydrophobicContact CB-CD2 4.2Å; L1210-L1219 HydrophobicContact CD1-CD2 3.89Å; L1210-L1222 HydrophobicContact CD1-CD2 4Å
1211	N	50.4	Low	52.6	Low	80 Å²	80	59.1 Å²	59.1	43%	0.428	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-15.9	171.5	-49.4	-81.2	0	0	0	111.7	K1190 F1207 S1208 L1213	K1190-N1211 PolarHBondContact NZ-OD1 2.91Å; F1207-N1211 PolarHBondContact O-ND2 3.26Å; S1208-N1211 WeakPolarHBondContact O-CB 3.37Å; S1208-N1211 PolarHBondContact O-N 3.08Å; S1208-N1211 PolarHBondContact O-ND2 3.06Å; S1208-N1211 VanDerWaalsContact O-ND2 3.15Å; N1211-L1213 VanDerWaalsContact C-N 3.3Å
1212	D	46.7	Very low	54	Low	139 Å²	139	55.5 Å²	55.5	74%	0.743	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-10.4	173.9	-64.4	-31.1	0	0	0	112.8	L1210	L1210-D1212 VanDerWaalsContact C-N 3.27Å
1213	L	47.9	Very low	55.4	Low	59 Å²	59	49 Å²	49	31%	0.309	28%	0.283	S	S	.	.	S	Bend	trans	-78.5	131.2	172.6	-71	166.7	0	0	0	109.8	L1210 N1211 G1215 N1218	L1210-L1213 HydrophobicContact CD2-CD1 3.7Å; N1211-L1213 VanDerWaalsContact C-N 3.3Å; L1213-G1215 PolarHBondContact O-N 3.14Å; L1213-N1218 PolarHBondContact O-ND2 3Å
1214	S	43.3	Very low	57.1	Low	98 Å²	98	45.9 Å²	45.9	69%	0.685	27%	0.266	S	S	*	.	S	Bend	trans	-67.6	98.2	-179.3	55.7	0	0	0	0	112.1
1215	G	47	Very low	58.6	Low	46 Å²	46	43.2 Å²	43.2	47%	0.474	25%	0.248	S	C	.	.			trans	174.7	138.1	174.4	0	0	0	0	0	112.4	L1213 N1218	L1213-G1215 PolarHBondContact O-N 3.14Å; G1215-N1218 PolarHBondContact O-ND2 2.77Å
1216	E	52.5	Low	59.9	Low	145 Å²	145	38.2 Å²	38.2	68%	0.678	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.9	147.3	168.3	-66.6	-176.8	169.1	0	0	110.2	N1218 S1259	E1216-N1218 VanDerWaalsContact C-N 3.34Å; E1216-N1218 PolarHBondContact O-N 3.03Å; E1216-S1259 PolarHBondContact OE2-OG 3.29Å
1217	N	63.8	Low	61	Low	22 Å²	22	36.7 Å²	36.7	12%	0.118	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	56	36.6	178.2	-61.9	-20.7	0	0	0	115.3	L1219 E1220 S1221 R1253 D1260 Q1263	N1217-L1219 VanDerWaalsContact C-N 3.32Å; N1217-L1219 PolarHBondContact O-N 2.62Å; N1217-E1220 VanDerWaalsContact CA-OE2 3.24Å; N1217-E1220 WeakPolarHBondContact CA-OE2 3.26Å; N1217-E1220 HydrophobicContact CB-CB 4.19Å; N1217-E1220 PolarHBondContact O-N 3.27Å; N1217-S1221 VanDerWaalsContact O-CB 3.32Å; N1217-S1221 WeakPolarHBondContact O-CB 3.13Å; N1217-S1221 PolarHBondContact O-N 3.18Å; N1217-S1221 PolarHBondContact O-OG 3.03Å; N1217-R1253 PolarHBondContact OD1-NH1 3.19Å; N1217-R1253 PolarHBondContact OD1-NH2 3.26Å; N1217-D1260 PolarHBondContact ND2-OD1 3.49Å; N1217-Q1263 PolarHBondContact ND2-OE1 3.31Å
1218	N	63.9	Low	61.7	Low	12 Å²	12	36.6 Å²	36.6	6%	0.064	21%	0.21	C	C	.	.	H	α-helix	trans	-60.3	-35.9	177.6	-78.3	-24.1	0	0	0	113.8	L1210 L1213 G1215 E1216 L1222	L1210-N1218 PolarHBondContact O-ND2 3.2Å; L1213-N1218 PolarHBondContact O-ND2 3Å; G1215-N1218 PolarHBondContact O-ND2 2.77Å; E1216-N1218 VanDerWaalsContact C-N 3.34Å; E1216-N1218 PolarHBondContact O-N 3.03Å; N1218-L1222 PolarHBondContact O-N 2.96Å
1219	L	68.6	Low	62.4	Low	7 Å²	7	34.2 Å²	34.2	4%	0.037	19%	0.194	C	C	.	.	H	α-helix	trans	-75.5	-41.2	-178	-68.5	173	0	0	0	110.8	V1183 V1187 F1207 L1210 N1217 S1221 L1222 V1223	V1183-L1219 HydrophobicContact CG1-CB 3.85Å; V1183-L1219 HydrophobicContact CG1-CD2 4.17Å; V1187-L1219 HydrophobicContact CG2-CB 4.1Å; V1187-L1219 HydrophobicContact CG2-CD1 4.43Å; F1207-L1219 HydrophobicContact CB-CD2 4.32Å; F1207-L1219 HydrophobicContact CD1-CD2 4.45Å; L1210-L1219 HydrophobicContact CB-CD2 4.2Å; L1210-L1219 HydrophobicContact CD1-CD2 3.89Å; N1217-L1219 VanDerWaalsContact C-N 3.32Å; N1217-L1219 PolarHBondContact O-N 2.62Å; L1219-S1221 VanDerWaalsContact C-N 3.34Å; L1219-L1222 WeakPolarHBondContact O-CB 3.3Å; L1219-L1222 PolarHBondContact O-N 3.17Å; L1219-V1223 WeakPolarHBondContact O-CG2 3.5Å; L1219-V1223 PolarHBondContact O-N 3.46Å
1220	E	72.9	Confident	63.4	Low	21 Å²	21	31.2 Å²	31.2	10%	0.098	18%	0.18	C	C	.	.	H	α-helix	trans	-64.3	-40.1	173.7	-63.5	83.6	168.4	0	0	110.9	N1217 L1222 V1223 W1224 L1246 F1250 R1253	N1217-E1220 VanDerWaalsContact CA-OE2 3.24Å; N1217-E1220 WeakPolarHBondContact CA-OE2 3.26Å; N1217-E1220 HydrophobicContact CB-CB 4.19Å; N1217-E1220 PolarHBondContact O-N 3.27Å; E1220-L1222 VanDerWaalsContact C-N 3.35Å; E1220-L1222 PolarHBondContact O-N 2.62Å; E1220-V1223 PolarHBondContact O-N 2.93Å; E1220-W1224 PolarHBondContact O-N 2.88Å; E1220-L1246 HydrophobicContact CB-CD1 3.99Å; E1220-L1246 HydrophobicContact CG-CD1 4.3Å; E1220-F1250 HydrophobicContact CB-CE2 4.17Å; E1220-F1250 HydrophobicContact CB-CZ 3.93Å; E1220-F1250 HydrophobicContact CG-CE2 4.21Å; E1220-F1250 HydrophobicContact CG-CZ 3.89Å; E1220-R1253 IonicContact OE1-NH2 3.13Å; E1220-R1253 PolarHBondContact OE1-NH2 3.11Å
1221	S	68	Low	64.2	Low	9 Å²	9	31.5 Å²	31.5	6%	0.063	18%	0.181	C	C	.	.	H	α-helix	trans	-63.7	-37.3	173.2	-58.7	0	0	0	0	112.4	N1217 L1219 W1224 I1225	N1217-S1221 VanDerWaalsContact O-CB 3.32Å; N1217-S1221 WeakPolarHBondContact O-CB 3.13Å; N1217-S1221 PolarHBondContact O-N 3.18Å; N1217-S1221 PolarHBondContact O-OG 3.03Å; L1219-S1221 VanDerWaalsContact C-N 3.34Å; S1221-W1224 PolarHBondContact O-N 2.78Å; S1221-I1225 WeakPolarHBondContact O-CB 3.47Å; S1221-I1225 WeakPolarHBondContact O-CD1 3.36Å; S1221-I1225 VanDerWaalsContact O-CG1 3.27Å; S1221-I1225 WeakPolarHBondContact O-CG1 3.29Å; S1221-I1225 PolarHBondContact O-N 2.9Å
1222	L	72.5	Confident	64.8	Low	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63.8	-45.7	173.2	176.2	67.2	0	0	0	111.6	P1078 L1081 L1082 L1179 V1183 L1210 N1218 L1219 E1220 W1224 I1225 I1226	P1078-L1222 HydrophobicContact CB-CD1 4.06Å; P1078-L1222 HydrophobicContact CB-CD2 3.75Å; L1081-L1222 HydrophobicContact CB-CD1 4.4Å; L1082-L1222 HydrophobicContact CD1-CD1 4.31Å; L1082-L1222 HydrophobicContact CD2-CB 3.93Å; L1082-L1222 HydrophobicContact CD2-CD1 4.13Å; L1082-L1222 HydrophobicContact CG-CD1 4Å; L1179-L1222 HydrophobicContact CD2-CD2 4.21Å; V1183-L1222 HydrophobicContact CG2-CD2 4.08Å; L1210-L1222 HydrophobicContact CD1-CD2 4Å; N1218-L1222 PolarHBondContact O-N 2.96Å; L1219-L1222 WeakPolarHBondContact O-CB 3.3Å; L1219-L1222 PolarHBondContact O-N 3.17Å; E1220-L1222 VanDerWaalsContact C-N 3.35Å; E1220-L1222 PolarHBondContact O-N 2.62Å; L1222-W1224 VanDerWaalsContact C-N 3.34Å; L1222-W1224 PolarHBondContact O-N 3.32Å; L1222-I1225 PolarHBondContact O-N 3.44Å; L1222-I1226 HydrophobicContact CD1-CD1 4.18Å; L1222-I1226 HydrophobicContact CG-CD1 3.99Å; L1222-I1226 WeakPolarHBondContact O-CD1 3.24Å; L1222-I1226 VanDerWaalsContact O-CG1 3.27Å; L1222-I1226 WeakPolarHBondContact O-CG1 3.12Å; L1222-I1226 PolarHBondContact O-N 3.26Å
1223	V	75.3	Confident	65.5	Low	1 Å²	1	25.3 Å²	25.3	1%	0.006	14%	0.142	C	C	.	.	H	α-helix	trans	-63.1	-40.3	177	173.7	0	0	0	0	111.3	V1183 L1184 L1219 E1220 I1226 G1227 I1242 L1246	V1183-V1223 HydrophobicContact CB-CG2 3.68Å; V1183-V1223 HydrophobicContact CG1-CG2 3.46Å; V1183-V1223 VanDerWaalsContact CG1-CG2 3.46Å; L1184-V1223 HydrophobicContact CD1-CG1 4.21Å; L1184-V1223 HydrophobicContact CD2-CG1 4.09Å; L1184-V1223 HydrophobicContact CG-CG1 4.03Å; L1184-V1223 HydrophobicContact CG-CG2 4.26Å; L1219-V1223 WeakPolarHBondContact O-CG2 3.5Å; L1219-V1223 PolarHBondContact O-N 3.46Å; E1220-V1223 PolarHBondContact O-N 2.93Å; V1223-I1226 PolarHBondContact O-N 3.39Å; V1223-G1227 PolarHBondContact O-N 2.94Å; V1223-I1242 HydrophobicContact CG1-CG2 3.54Å; V1223-L1246 HydrophobicContact CB-CD1 3.84Å; V1223-L1246 HydrophobicContact CG1-CD1 3.75Å
1224	W	75.8	Confident	66	Low	4 Å²	4	25.4 Å²	25.4	2%	0.015	16%	0.157	C	C	.	.	H	α-helix	trans	-61.8	-48.6	172.8	-167	-15.9	0	0	0	111.2	F1094 E1220 S1221 L1222 I1226 G1227 E1228 L1243 L1246 Q1263 H1266 L1267 N1270	F1094-W1224 AromaticContact CD1-CD2 3.7Å; F1094-W1224 HydrophobicContact CD1-CD2 3.7Å; F1094-W1224 AromaticContact CD1-CE3 3.42Å; F1094-W1224 HydrophobicContact CD1-CE3 3.42Å; F1094-W1224 VanDerWaalsContact CD1-CE3 3.42Å; F1094-W1224 HydrophobicContact CD1-CG 4.41Å; F1094-W1224 HydrophobicContact CD1-CH2 4Å; F1094-W1224 HydrophobicContact CD1-CZ2 4.24Å; F1094-W1224 AromaticContact CD1-CZ3 3.6Å; F1094-W1224 HydrophobicContact CD1-CZ3 3.6Å; F1094-W1224 HydrophobicContact CE1-CB 4.41Å; F1094-W1224 AromaticContact CE1-CD2 3.36Å; F1094-W1224 HydrophobicContact CE1-CD2 3.36Å; F1094-W1224 AromaticContact CE1-CE2 3.59Å; F1094-W1224 AromaticContact CE1-CE3 3.65Å; F1094-W1224 HydrophobicContact CE1-CE3 3.65Å; F1094-W1224 AromaticContact CE1-CG 3.73Å; F1094-W1224 HydrophobicContact CE1-CG 3.73Å; F1094-W1224 HydrophobicContact CE1-CH2 4.28Å; F1094-W1224 HydrophobicContact CE1-CZ2 4.05Å; F1094-W1224 HydrophobicContact CE1-CZ3 4.1Å; F1094-W1224 HydrophobicContact CG-CE3 4.33Å; F1094-W1224 HydrophobicContact CZ-CB 4.47Å; F1094-W1224 HydrophobicContact CZ-CD2 4.23Å; F1094-W1224 HydrophobicContact CZ-CG 4.15Å; E1220-W1224 PolarHBondContact O-N 2.88Å; S1221-W1224 PolarHBondContact O-N 2.78Å; L1222-W1224 VanDerWaalsContact C-N 3.34Å; L1222-W1224 PolarHBondContact O-N 3.32Å; W1224-I1226 PolarHBondContact O-N 3.17Å; W1224-G1227 WeakPolarHBondContact O-CA 3.42Å; W1224-G1227 PolarHBondContact O-N 3.37Å; W1224-E1228 PolarHBondContact NE1-OE1 3.3Å; W1224-E1228 PolarHBondContact O-N 3.05Å; W1224-L1243 HydrophobicContact CB-CD2 4.42Å; W1224-L1243 HydrophobicContact CG-CD2 4.05Å; W1224-L1246 HydrophobicContact CB-CD2 4.23Å; W1224-Q1263 HydrophobicContact CZ3-CB 4.48Å; W1224-H1266 HydrophobicContact CH2-CB 3.71Å; W1224-H1266 HydrophobicContact CZ2-CB 4.47Å; W1224-L1267 HydrophobicContact CD2-CD1 4.03Å; W1224-L1267 HydrophobicContact CE3-CD1 4.19Å; W1224-L1267 HydrophobicContact CG-CD1 4.47Å; W1224-L1267 HydrophobicContact CH2-CB 4.17Å; W1224-L1267 HydrophobicContact CZ2-CD1 4.39Å; W1224-L1267 HydrophobicContact CZ3-CB 4.28Å; W1224-L1267 HydrophobicContact CZ3-CD1 4.44Å; W1224-N1270 HydrophobicContact CZ2-CB 4.42Å; W1224-N1270 PolarHBondContact NE1-ND2 3.49Å
1225	I	71.3	Confident	67.2	Low	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-54.4	-41	176.4	-74.5	162.3	0	0	0	111.6	L1082 A1085 F1086 F1094 I1098 S1221 L1222 E1228 L1229	L1082-I1225 HydrophobicContact CD2-CD1 3.74Å; A1085-I1225 HydrophobicContact CB-CD1 3.85Å; A1085-I1225 HydrophobicContact CB-CG1 4.27Å; A1085-I1225 HydrophobicContact CB-CG2 4.27Å; F1086-I1225 HydrophobicContact CD2-CD1 4.25Å; F1086-I1225 HydrophobicContact CE2-CD1 4.42Å; F1094-I1225 HydrophobicContact CE2-CD1 4.1Å; F1094-I1225 HydrophobicContact CE2-CG1 3.86Å; F1094-I1225 HydrophobicContact CZ-CG1 4.08Å; I1098-I1225 HydrophobicContact CD1-CB 4.27Å; I1098-I1225 HydrophobicContact CD1-CG1 4.13Å; I1098-I1225 HydrophobicContact CD1-CG2 4.1Å; I1098-I1225 HydrophobicContact CG1-CG1 4.28Å; S1221-I1225 WeakPolarHBondContact O-CB 3.47Å; S1221-I1225 WeakPolarHBondContact O-CD1 3.36Å; S1221-I1225 VanDerWaalsContact O-CG1 3.27Å; S1221-I1225 WeakPolarHBondContact O-CG1 3.29Å; S1221-I1225 PolarHBondContact O-N 2.9Å; L1222-I1225 PolarHBondContact O-N 3.44Å; I1225-E1228 PolarHBondContact O-N 3.45Å; I1225-L1229 HydrophobicContact CG2-CD1 3.81Å; I1225-L1229 VanDerWaalsContact O-CG 3.27Å; I1225-L1229 WeakPolarHBondContact O-CG 3.23Å; I1225-L1229 PolarHBondContact O-N 3.17Å
1226	I	74.6	Confident	68.2	Low	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-67.7	-43.4	176.8	-65	159.9	0	0	0	111.4	L1176 L1179 A1180 L1222 V1223 W1224 E1228 L1229 I1230	L1176-I1226 HydrophobicContact CB-CG2 3.94Å; L1176-I1226 HydrophobicContact CD2-CG1 4.3Å; L1176-I1226 HydrophobicContact CD2-CG2 4.22Å; L1176-I1226 WeakPolarHBondContact O-CG2 3.01Å; L1179-I1226 HydrophobicContact CD2-CD1 3.44Å; L1179-I1226 VanDerWaalsContact CD2-CD1 3.44Å; A1180-I1226 HydrophobicContact CB-CB 4.37Å; A1180-I1226 HydrophobicContact CB-CD1 4.24Å; A1180-I1226 HydrophobicContact CB-CG2 3.87Å; L1222-I1226 HydrophobicContact CD1-CD1 4.18Å; L1222-I1226 HydrophobicContact CG-CD1 3.99Å; L1222-I1226 WeakPolarHBondContact O-CD1 3.24Å; L1222-I1226 VanDerWaalsContact O-CG1 3.27Å; L1222-I1226 WeakPolarHBondContact O-CG1 3.12Å; L1222-I1226 PolarHBondContact O-N 3.26Å; V1223-I1226 PolarHBondContact O-N 3.39Å; W1224-I1226 PolarHBondContact O-N 3.17Å; I1226-E1228 VanDerWaalsContact C-N 3.32Å; I1226-E1228 PolarHBondContact O-N 3.44Å; I1226-L1229 PolarHBondContact O-N 3.35Å; I1226-I1230 HydrophobicContact CG2-CD1 3.66Å; I1226-I1230 HydrophobicContact CG2-CG1 4.28Å; I1226-I1230 WeakPolarHBondContact O-CB 3.21Å; I1226-I1230 WeakPolarHBondContact O-CG1 3.41Å; I1226-I1230 PolarHBondContact O-N 3.48Å
1227	G	72.1	Confident	69.1	Low	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-57.6	-41.8	173.9	0	0	0	0	0	112.7	V1223 W1224 Y1231 S1239	V1223-G1227 PolarHBondContact O-N 2.94Å; W1224-G1227 WeakPolarHBondContact O-CA 3.42Å; W1224-G1227 PolarHBondContact O-N 3.37Å; G1227-Y1231 PolarHBondContact O-N 3.18Å; G1227-Y1231 VanDerWaalsContact O-N 3.17Å; G1227-S1239 WeakPolarHBondContact O-CB 3.17Å; G1227-S1239 PolarHBondContact O-OG 3.36Å
1228	E	70.3	Confident	69.5	Low	10 Å²	10	17 Å²	17	5%	0.047	10%	0.098	C	C	.	.	H	α-helix	trans	-63.1	-46.9	171.6	-68.1	-46.9	131.9	0	0	112.7	I1098 W1224 I1225 I1226 I1230 Y1231 Y1232 N1270 K1274	I1098-E1228 HydrophobicContact CD1-CB 3.47Å; I1098-E1228 VanDerWaalsContact CD1-CB 3.47Å; I1098-E1228 HydrophobicContact CD1-CG 3.82Å; I1098-E1228 HydrophobicContact CG1-CB 4.49Å; I1098-E1228 HydrophobicContact CG1-CG 4.38Å; W1224-E1228 PolarHBondContact NE1-OE1 3.3Å; W1224-E1228 PolarHBondContact O-N 3.05Å; I1225-E1228 PolarHBondContact O-N 3.45Å; I1226-E1228 VanDerWaalsContact C-N 3.32Å; I1226-E1228 PolarHBondContact O-N 3.44Å; E1228-I1230 VanDerWaalsContact C-N 3.32Å; E1228-I1230 PolarHBondContact O-N 2.85Å; E1228-Y1231 WeakPolarHBondContact O-CB 3.48Å; E1228-Y1231 PolarHBondContact O-N 3.25Å; E1228-Y1232 HydrophobicContact CB-CD2 4.38Å; E1228-Y1232 HydrophobicContact CB-CE2 4.03Å; E1228-Y1232 WeakPolarHBondContact O-CD2 3.27Å; E1228-Y1232 PolarHBondContact O-N 3.01Å; E1228-N1270 PolarHBondContact OE1-ND2 2.77Å; E1228-K1274 IonicContact OE1-NZ 3.88Å; E1228-K1274 PolarHBondContact OE1-NZ 3.44Å; E1228-K1274 IonicContact OE2-NZ 3.99Å; E1228-K1274 PolarHBondContact OE2-NZ 3.13Å
1229	L	69.9	Low	70.1	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-63.4	-38.9	-178.7	-73	165.8	0	0	0	112	L1081 L1104 W1108 I1225 I1226 Y1231 Y1232 L1233	L1081-L1229 HydrophobicContact CD2-CD1 3.7Å; L1104-L1229 HydrophobicContact CB-CD2 3.74Å; L1104-L1229 HydrophobicContact CD1-CD1 4.15Å; L1104-L1229 HydrophobicContact CD1-CD2 3.9Å; L1104-L1229 HydrophobicContact CG-CD2 4.45Å; W1108-L1229 HydrophobicContact CZ3-CD1 4.36Å; W1108-L1229 HydrophobicContact CZ3-CD2 4.44Å; I1225-L1229 HydrophobicContact CG2-CD1 3.81Å; I1225-L1229 VanDerWaalsContact O-CG 3.27Å; I1225-L1229 WeakPolarHBondContact O-CG 3.23Å; I1225-L1229 PolarHBondContact O-N 3.17Å; I1226-L1229 PolarHBondContact O-N 3.35Å; L1229-Y1231 VanDerWaalsContact C-N 3.34Å; L1229-Y1232 PolarHBondContact O-N 3.3Å; L1229-L1233 WeakPolarHBondContact O-CB 3.36Å; L1229-L1233 WeakPolarHBondContact O-CG 3.5Å; L1229-L1233 PolarHBondContact O-N 2.92Å
1230	I	72	Confident	70.3	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-64.7	-38.6	175.2	-69.7	170.1	0	0	0	111.1	I1173 L1176 N1177 I1226 E1228 L1233 G1234 D1235 V1238 I1242	I1173-I1230 HydrophobicContact CG2-CG2 4.44Å; L1176-I1230 HydrophobicContact CB-CD1 4.06Å; L1176-I1230 HydrophobicContact CB-CG1 4.18Å; L1176-I1230 HydrophobicContact CD1-CG1 4.38Å; N1177-I1230 HydrophobicContact CB-CD1 4.42Å; I1226-I1230 HydrophobicContact CG2-CD1 3.66Å; I1226-I1230 HydrophobicContact CG2-CG1 4.28Å; I1226-I1230 WeakPolarHBondContact O-CB 3.21Å; I1226-I1230 WeakPolarHBondContact O-CG1 3.41Å; I1226-I1230 PolarHBondContact O-N 3.48Å; E1228-I1230 VanDerWaalsContact C-N 3.32Å; E1228-I1230 PolarHBondContact O-N 2.85Å; I1230-L1233 CarbonylContact O-C 3.4Å; I1230-L1233 PolarHBondContact O-N 3.29Å; I1230-G1234 PolarHBondContact O-N 3.34Å; I1230-D1235 HydrophobicContact CG2-CB 3.95Å; I1230-D1235 WeakPolarHBondContact CG2-O 3.49Å; I1230-D1235 PolarHBondContact O-N 3.43Å; I1230-V1238 HydrophobicContact CD1-CG1 4.33Å; I1230-V1238 HydrophobicContact CG2-CB 4.04Å; I1230-V1238 HydrophobicContact CG2-CG1 4.03Å; I1230-I1242 HydrophobicContact CD1-CD1 3.44Å; I1230-I1242 VanDerWaalsContact CD1-CD1 3.44Å
1231	Y	69.3	Low	70.6	Confident	8 Å²	8	17.8 Å²	17.8	3%	0.031	10%	0.102	C	C	.	.	H	α-helix	trans	-61.4	-48.7	172	-178.3	-97.1	0	0	0	111.9	G1227 E1228 L1229 L1233 G1234 E1236 S1239 K1274 Y1277	G1227-Y1231 PolarHBondContact O-N 3.18Å; G1227-Y1231 VanDerWaalsContact O-N 3.17Å; E1228-Y1231 WeakPolarHBondContact O-CB 3.48Å; E1228-Y1231 PolarHBondContact O-N 3.25Å; L1229-Y1231 VanDerWaalsContact C-N 3.34Å; Y1231-L1233 PolarHBondContact O-N 2.97Å; Y1231-G1234 PolarHBondContact O-N 3.3Å; Y1231-E1236 HydrophobicContact CD2-CB 4.18Å; Y1231-E1236 HydrophobicContact CD2-CG 3.84Å; Y1231-E1236 HydrophobicContact CE2-CB 4.26Å; Y1231-E1236 HydrophobicContact CE2-CG 3.69Å; Y1231-S1239 WeakPolarHBondContact CB-OG 3.33Å; Y1231-K1274 HydrophobicContact CD2-CB 4.48Å; Y1231-K1274 HydrophobicContact CD2-CD 3.77Å; Y1231-K1274 HydrophobicContact CD2-CG 3.85Å; Y1231-K1274 HydrophobicContact CE2-CB 4.19Å; Y1231-K1274 HydrophobicContact CE2-CD 4.14Å; Y1231-K1274 HydrophobicContact CE2-CG 3.68Å; Y1231-K1274 HydrophobicContact CG-CD 4.13Å; Y1231-Y1277 WeakPolarHBondContact OH-CD2 3.36Å
1232	Y	62.2	Low	71.1	Confident	80 Å²	80	17.4 Å²	17.4	31%	0.314	10%	0.099	S	C	.	.	H	α-helix	trans	-67.5	-20.1	177.2	-64.3	-61.5	0	0	0	113.9	V1105 E1228 L1229 G1234	V1105-Y1232 VanDerWaalsContact CG2-CB 3.44Å; V1105-Y1232 HydrophobicContact CG2-CD2 4.45Å; V1105-Y1232 HydrophobicContact CG2-CG 4.11Å; E1228-Y1232 HydrophobicContact CB-CD2 4.38Å; E1228-Y1232 HydrophobicContact CB-CE2 4.03Å; E1228-Y1232 WeakPolarHBondContact O-CD2 3.27Å; E1228-Y1232 PolarHBondContact O-N 3.01Å; L1229-Y1232 PolarHBondContact O-N 3.3Å; Y1232-G1234 VanDerWaalsContact C-N 3.28Å
1233	L	62.9	Low	71.4	Confident	9 Å²	9	17.4 Å²	17.4	5%	0.047	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-0.7	171	-70.4	168.9	0	0	0	112.8	W1108 M1169 I1173 L1176 L1229 I1230 Y1231	W1108-L1233 HydrophobicContact CB-CD2 4.07Å; W1108-L1233 HydrophobicContact CG-CD2 4.41Å; M1169-L1233 HydrophobicContact CE-CB 3.99Å; M1169-L1233 HydrophobicContact CE-CD2 3.59Å; M1169-L1233 HydrophobicContact CE-CG 4.41Å; M1169-L1233 WeakPolarHBondContact CE-O 3.45Å; I1173-L1233 HydrophobicContact CD1-CB 4.16Å; I1173-L1233 HydrophobicContact CG1-CB 4.16Å; I1173-L1233 HydrophobicContact CG1-CD1 4.08Å; L1176-L1233 HydrophobicContact CD1-CD1 3.88Å; L1229-L1233 WeakPolarHBondContact O-CB 3.36Å; L1229-L1233 WeakPolarHBondContact O-CG 3.5Å; L1229-L1233 PolarHBondContact O-N 2.92Å; I1230-L1233 CarbonylContact O-C 3.4Å; I1230-L1233 PolarHBondContact O-N 3.29Å; Y1231-L1233 PolarHBondContact O-N 2.97Å
1234	G	58.4	Low	71.5	Confident	61 Å²	61	17.7 Å²	17.7	63%	0.629	10%	0.101	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.8	18.5	171.4	0	0	0	0	0	115.7	I1230 Y1231 Y1232	I1230-G1234 PolarHBondContact O-N 3.34Å; Y1231-G1234 PolarHBondContact O-N 3.3Å; Y1232-G1234 VanDerWaalsContact C-N 3.28Å
1235	D	68.4	Low	71.6	Confident	50 Å²	50	22 Å²	22	27%	0.267	12%	0.12	S	C	.	.			trans	-110.5	77.9	170.7	-166.7	-23.8	0	0	0	109.8	I1173 I1230 L1237 V1238 S1239	I1173-D1235 HydrophobicContact CD1-CB 4.44Å; I1173-D1235 HydrophobicContact CG2-CB 4.47Å; I1230-D1235 HydrophobicContact CG2-CB 3.95Å; I1230-D1235 WeakPolarHBondContact CG2-O 3.49Å; I1230-D1235 PolarHBondContact O-N 3.43Å; D1235-L1237 VanDerWaalsContact C-N 3.27Å; D1235-L1237 PolarHBondContact O-N 3.46Å; D1235-V1238 WeakPolarHBondContact OD1-CB 3.49Å; D1235-V1238 VanDerWaalsContact OD1-CG2 3.3Å; D1235-V1238 WeakPolarHBondContact OD1-CG2 3.42Å; D1235-V1238 PolarHBondContact OD1-N 3.41Å; D1235-V1238 VanDerWaalsContact OD1-N 3.11Å; D1235-V1238 WeakPolarHBondContact OD2-CG2 3.47Å; D1235-S1239 PolarHBondContact O-N 3.09Å; D1235-S1239 VanDerWaalsContact O-N 3.15Å
1236	E	68.3	Low	72	Confident	21 Å²	21	22.1 Å²	22.1	10%	0.098	12%	0.12	C	C	.	.	H	α-helix	trans	-63.8	-33.6	-174.6	-57.1	-165.8	175.4	0	0	112.2	Y1231 S1239 V1240 Y1277 L1278	Y1231-E1236 HydrophobicContact CD2-CB 4.18Å; Y1231-E1236 HydrophobicContact CD2-CG 3.84Å; Y1231-E1236 HydrophobicContact CE2-CB 4.26Å; Y1231-E1236 HydrophobicContact CE2-CG 3.69Å; E1236-S1239 WeakPolarHBondContact O-CB 3.46Å; E1236-S1239 PolarHBondContact O-N 3.11Å; E1236-V1240 WeakPolarHBondContact O-CG2 3.41Å; E1236-V1240 PolarHBondContact O-N 2.72Å; E1236-Y1277 WeakPolarHBondContact OE2-CB 3.4Å; E1236-L1278 HydrophobicContact CB-CD1 4.43Å; E1236-L1278 HydrophobicContact CB-CD2 3.72Å; E1236-L1278 HydrophobicContact CB-CG 3.83Å; E1236-L1278 PolarHBondContact OE2-N 3.35Å
1237	L	70.8	Confident	72	Confident	44 Å²	44	22.1 Å²	22.1	23%	0.23	12%	0.12	C	C	.	.	H	α-helix	trans	-69.2	-47	-177.7	-163.7	98.6	0	0	0	111.6	D1235 S1239 V1240 Q1241 L1278 I1286	D1235-L1237 VanDerWaalsContact C-N 3.27Å; D1235-L1237 PolarHBondContact O-N 3.46Å; L1237-S1239 VanDerWaalsContact C-N 3.3Å; L1237-S1239 PolarHBondContact O-N 3.07Å; L1237-V1240 PolarHBondContact O-N 3.01Å; L1237-Q1241 WeakPolarHBondContact O-CG 3.34Å; L1237-Q1241 PolarHBondContact O-N 3.28Å; L1237-L1278 HydrophobicContact CB-CD2 4.31Å; L1237-L1278 HydrophobicContact CD1-CD2 4.23Å; L1237-I1286 HydrophobicContact CD1-CG2 4.11Å
1238	V	72.7	Confident	72.2	Confident	20 Å²	20	24 Å²	24	12%	0.121	13%	0.132	C	C	.	.	H	α-helix	trans	-67.5	-33.3	177	175.7	0	0	0	0	111	N1177 I1230 D1235 Q1241 I1242	N1177-V1238 HydrophobicContact CB-CG1 4.25Å; N1177-V1238 WeakPolarHBondContact ND2-CG1 3.47Å; I1230-V1238 HydrophobicContact CD1-CG1 4.33Å; I1230-V1238 HydrophobicContact CG2-CB 4.04Å; I1230-V1238 HydrophobicContact CG2-CG1 4.03Å; D1235-V1238 WeakPolarHBondContact OD1-CB 3.49Å; D1235-V1238 VanDerWaalsContact OD1-CG2 3.3Å; D1235-V1238 WeakPolarHBondContact OD1-CG2 3.42Å; D1235-V1238 PolarHBondContact OD1-N 3.41Å; D1235-V1238 VanDerWaalsContact OD1-N 3.11Å; D1235-V1238 WeakPolarHBondContact OD2-CG2 3.47Å; V1238-Q1241 PolarHBondContact O-N 3.29Å; V1238-I1242 HydrophobicContact CG1-CD1 3.85Å; V1238-I1242 HydrophobicContact CG1-CG1 4.49Å; V1238-I1242 WeakPolarHBondContact O-CG1 3.5Å; V1238-I1242 PolarHBondContact O-N 3.25Å
1239	S	75.8	Confident	72.4	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-59.3	-52.7	171.4	-178.4	0	0	0	0	112	G1227 Y1231 D1235 E1236 L1237 Q1241 I1242 L1243	G1227-S1239 WeakPolarHBondContact O-CB 3.17Å; G1227-S1239 PolarHBondContact O-OG 3.36Å; Y1231-S1239 WeakPolarHBondContact CB-OG 3.33Å; D1235-S1239 PolarHBondContact O-N 3.09Å; D1235-S1239 VanDerWaalsContact O-N 3.15Å; E1236-S1239 WeakPolarHBondContact O-CB 3.46Å; E1236-S1239 PolarHBondContact O-N 3.11Å; L1237-S1239 VanDerWaalsContact C-N 3.3Å; L1237-S1239 PolarHBondContact O-N 3.07Å; S1239-Q1241 VanDerWaalsContact C-N 3.32Å; S1239-Q1241 PolarHBondContact O-N 2.91Å; S1239-I1242 PolarHBondContact O-N 3.25Å; S1239-L1243 WeakPolarHBondContact O-CG 3.31Å; S1239-L1243 PolarHBondContact O-N 3.2Å
1240	V	72.7	Confident	72.5	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-63.4	-37.9	180	170	0	0	0	0	111.3	E1236 L1237 L1243 S1244 I1271 K1274 L1275 L1278 Y1293	E1236-V1240 WeakPolarHBondContact O-CG2 3.41Å; E1236-V1240 PolarHBondContact O-N 2.72Å; L1237-V1240 PolarHBondContact O-N 3.01Å; V1240-L1243 PolarHBondContact O-N 2.99Å; V1240-S1244 VanDerWaalsContact O-CB 3.24Å; V1240-S1244 WeakPolarHBondContact O-CB 3.31Å; V1240-S1244 PolarHBondContact O-N 3.38Å; V1240-S1244 PolarHBondContact O-OG 3.49Å; V1240-I1271 HydrophobicContact CG1-CG2 4.45Å; V1240-K1274 HydrophobicContact CG2-CB 3.75Å; V1240-L1275 HydrophobicContact CG1-CD2 3.94Å; V1240-L1275 HydrophobicContact CG1-CG 4.39Å; V1240-L1278 HydrophobicContact CB-CD1 4.12Å; V1240-L1278 HydrophobicContact CG2-CD1 3.7Å; V1240-Y1293 HydrophobicContact CG1-CD1 3.98Å; V1240-Y1293 HydrophobicContact CG1-CD2 3.55Å; V1240-Y1293 HydrophobicContact CG1-CE1 4.34Å; V1240-Y1293 HydrophobicContact CG1-CE2 3.93Å; V1240-Y1293 HydrophobicContact CG1-CG 3.62Å
1241	Q	79.1	Confident	72.5	Confident	57 Å²	57	25.5 Å²	25.5	27%	0.266	14%	0.14	S	C	.	.	H	α-helix	trans	-57.9	-47.6	172.8	-79.1	173	12.1	0	0	113.3	L1237 V1238 S1239 S1244 K1245 Y1293	L1237-Q1241 WeakPolarHBondContact O-CG 3.34Å; L1237-Q1241 PolarHBondContact O-N 3.28Å; V1238-Q1241 PolarHBondContact O-N 3.29Å; S1239-Q1241 VanDerWaalsContact C-N 3.32Å; S1239-Q1241 PolarHBondContact O-N 2.91Å; Q1241-S1244 PolarHBondContact O-OG 3.42Å; Q1241-S1244 VanDerWaalsContact O-OG 3.04Å; Q1241-K1245 WeakPolarHBondContact O-CG 3.32Å; Q1241-K1245 PolarHBondContact O-N 3.18Å; Q1241-K1245 VanDerWaalsContact O-N 3.08Å; Q1241-Y1293 HydrophobicContact CG-CE1 4.39Å; Q1241-Y1293 WeakPolarHBondContact CG-OH 3.27Å
1242	I	78.1	Confident	72.7	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-67.4	-43.5	-179.2	-69.4	165.1	0	0	0	110.6	N1177 A1180 V1223 I1230 V1238 S1239 K1245 L1246	N1177-I1242 HydrophobicContact CB-CD1 4.4Å; A1180-I1242 HydrophobicContact CB-CD1 4.04Å; A1180-I1242 HydrophobicContact CB-CG1 4.4Å; A1180-I1242 HydrophobicContact CB-CG2 4Å; V1223-I1242 HydrophobicContact CG1-CG2 3.54Å; I1230-I1242 HydrophobicContact CD1-CD1 3.44Å; I1230-I1242 VanDerWaalsContact CD1-CD1 3.44Å; V1238-I1242 HydrophobicContact CG1-CD1 3.85Å; V1238-I1242 HydrophobicContact CG1-CG1 4.49Å; V1238-I1242 WeakPolarHBondContact O-CG1 3.5Å; V1238-I1242 PolarHBondContact O-N 3.25Å; S1239-I1242 PolarHBondContact O-N 3.25Å; I1242-K1245 PolarHBondContact O-N 3.34Å; I1242-L1246 PolarHBondContact O-N 3.33Å
1243	L	78.6	Confident	73.1	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-69.6	-36.1	-179.9	-65	168.6	0	0	0	112	W1224 S1239 V1240 L1246 A1247 L1267 I1271 K1274	W1224-L1243 HydrophobicContact CB-CD2 4.42Å; W1224-L1243 HydrophobicContact CG-CD2 4.05Å; S1239-L1243 WeakPolarHBondContact O-CG 3.31Å; S1239-L1243 PolarHBondContact O-N 3.2Å; V1240-L1243 PolarHBondContact O-N 2.99Å; L1243-L1246 WeakPolarHBondContact O-CB 3.48Å; L1243-L1246 PolarHBondContact O-N 3.49Å; L1243-A1247 PolarHBondContact O-N 3.27Å; L1243-L1267 HydrophobicContact CB-CD1 4.29Å; L1243-L1267 HydrophobicContact CD2-CD1 3.81Å; L1243-I1271 HydrophobicContact CB-CD1 4.23Å; L1243-I1271 HydrophobicContact CB-CG1 3.84Å; L1243-K1274 HydrophobicContact CD1-CD 4.01Å
1244	S	77.8	Confident	72.9	Confident	7 Å²	7	37.9 Å²	37.9	5%	0.049	20%	0.201	C	C	.	.	H	α-helix	trans	-68.2	-38.5	174.9	72	0	0	0	0	112.1	V1240 Q1241 L1246 A1247 V1248 Y1293	V1240-S1244 VanDerWaalsContact O-CB 3.24Å; V1240-S1244 WeakPolarHBondContact O-CB 3.31Å; V1240-S1244 PolarHBondContact O-N 3.38Å; V1240-S1244 PolarHBondContact O-OG 3.49Å; Q1241-S1244 PolarHBondContact O-OG 3.42Å; Q1241-S1244 VanDerWaalsContact O-OG 3.04Å; S1244-L1246 VanDerWaalsContact C-N 3.34Å; S1244-A1247 WeakPolarHBondContact O-CB 3.37Å; S1244-A1247 PolarHBondContact O-N 3.19Å; S1244-V1248 WeakPolarHBondContact O-CG2 3.37Å; S1244-V1248 PolarHBondContact O-N 2.89Å; S1244-V1248 VanDerWaalsContact O-N 3.08Å; S1244-Y1293 WeakPolarHBondContact OG-CD1 3.48Å; S1244-Y1293 WeakPolarHBondContact OG-CE1 3.41Å
1245	K	78.8	Confident	72.9	Confident	95 Å²	95	40.7 Å²	40.7	41%	0.413	21%	0.206	S	C	.	.	H	α-helix	trans	-60.3	-44.2	171	-77.2	-171.6	175.5	-158.3	0	111.4	L1184 Q1241 I1242 A1247 V1248 C1249	L1184-K1245 HydrophobicContact CD1-CB 3.88Å; L1184-K1245 HydrophobicContact CD1-CD 4.01Å; L1184-K1245 HydrophobicContact CD2-CB 4.45Å; Q1241-K1245 WeakPolarHBondContact O-CG 3.32Å; Q1241-K1245 PolarHBondContact O-N 3.18Å; Q1241-K1245 VanDerWaalsContact O-N 3.08Å; I1242-K1245 PolarHBondContact O-N 3.34Å; K1245-A1247 VanDerWaalsContact C-N 3.29Å; K1245-A1247 PolarHBondContact O-N 3.41Å; K1245-V1248 PolarHBondContact O-N 3.09Å; K1245-C1249 PolarHBondContact O-N 2.7Å; K1245-C1249 PolarHBondContact O-SG 3.49Å
1246	L	79.7	Confident	72.7	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.016	21%	0.206	C	C	.	.	H	α-helix	trans	-57	-43.1	174.7	-166.6	86	0	0	0	111.8	L1184 E1220 V1223 W1224 I1242 L1243 S1244 V1248 C1249 F1250 L1267	L1184-L1246 HydrophobicContact CD2-CD1 4.18Å; E1220-L1246 HydrophobicContact CB-CD1 3.99Å; E1220-L1246 HydrophobicContact CG-CD1 4.3Å; V1223-L1246 HydrophobicContact CB-CD1 3.84Å; V1223-L1246 HydrophobicContact CG1-CD1 3.75Å; W1224-L1246 HydrophobicContact CB-CD2 4.23Å; I1242-L1246 PolarHBondContact O-N 3.33Å; L1243-L1246 WeakPolarHBondContact O-CB 3.48Å; L1243-L1246 PolarHBondContact O-N 3.49Å; S1244-L1246 VanDerWaalsContact C-N 3.34Å; L1246-V1248 PolarHBondContact O-N 3.43Å; L1246-C1249 WeakPolarHBondContact O-CB 3.28Å; L1246-C1249 PolarHBondContact O-N 3.33Å; L1246-F1250 HydrophobicContact CD2-CE2 4.16Å; L1246-F1250 HydrophobicContact CG-CD2 4.31Å; L1246-F1250 HydrophobicContact CG-CE2 4.04Å; L1246-F1250 WeakPolarHBondContact O-CD2 3.41Å; L1246-F1250 PolarHBondContact O-N 3.11Å; L1246-L1267 HydrophobicContact CB-CD2 4.23Å; L1246-L1267 HydrophobicContact CD2-CD1 3.77Å; L1246-L1267 HydrophobicContact CD2-CD2 3.86Å; L1246-L1267 HydrophobicContact CD2-CG 4.47Å; L1246-L1267 HydrophobicContact CG-CD2 4.26Å
1247	A	74.6	Confident	72.6	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60.3	-46.1	177.4	0	0	0	0	0	111.8	L1243 S1244 K1245 C1249 F1250 I1251 L1267 I1271 I1296 T1300	L1243-A1247 PolarHBondContact O-N 3.27Å; S1244-A1247 WeakPolarHBondContact O-CB 3.37Å; S1244-A1247 PolarHBondContact O-N 3.19Å; K1245-A1247 VanDerWaalsContact C-N 3.29Å; K1245-A1247 PolarHBondContact O-N 3.41Å; A1247-C1249 VanDerWaalsContact C-N 3.33Å; A1247-C1249 PolarHBondContact O-N 3.2Å; A1247-F1250 PolarHBondContact O-N 3.2Å; A1247-I1251 WeakPolarHBondContact O-CG1 3.36Å; A1247-I1251 PolarHBondContact O-N 3.46Å; A1247-L1267 HydrophobicContact CB-CD2 3.65Å; A1247-I1271 HydrophobicContact CB-CD1 4.12Å; A1247-I1296 HydrophobicContact CB-CG2 3.98Å; A1247-T1300 HydrophobicContact CB-CG2 4.27Å
1248	V	76.8	Confident	72.3	Confident	40 Å²	40	44.4 Å²	44.4	24%	0.242	23%	0.228	C	C	.	.	H	α-helix	trans	-62.3	-37.9	176.2	174	0	0	0	0	111.8	S1244 K1245 L1246 F1250 I1251 N1252 I1296	S1244-V1248 WeakPolarHBondContact O-CG2 3.37Å; S1244-V1248 PolarHBondContact O-N 2.89Å; S1244-V1248 VanDerWaalsContact O-N 3.08Å; K1245-V1248 PolarHBondContact O-N 3.09Å; L1246-V1248 PolarHBondContact O-N 3.43Å; V1248-F1250 VanDerWaalsContact C-N 3.3Å; V1248-F1250 PolarHBondContact O-N 3.09Å; V1248-I1251 PolarHBondContact O-N 3.37Å; V1248-N1252 WeakPolarHBondContact CG1-ND2 3.31Å; V1248-N1252 WeakPolarHBondContact O-CB 3.2Å; V1248-N1252 VanDerWaalsContact O-CG 3.31Å; V1248-N1252 PolarHBondContact O-N 2.81Å; V1248-N1252 PolarHBondContact O-ND2 3.15Å; V1248-I1296 HydrophobicContact CG2-CD1 4.02Å; V1248-I1296 HydrophobicContact CG2-CG1 4.15Å; V1248-I1296 HydrophobicContact CG2-CG2 4.15Å
1249	C	74.1	Confident	71.7	Confident	5 Å²	5	44.5 Å²	44.5	3%	0.034	23%	0.229	C	C	.	.	H	α-helix	trans	-59.2	-40.1	175.5	-64.2	0	0	0	0	112.5	E1188 K1191 K1245 L1246 A1247	E1188-C1249 PolarHBondContact OE1-SG 3.3Å; K1191-C1249 PolarHBondContact NZ-O 3.05Å; K1245-C1249 PolarHBondContact O-N 2.7Å; K1245-C1249 PolarHBondContact O-SG 3.49Å; L1246-C1249 WeakPolarHBondContact O-CB 3.28Å; L1246-C1249 PolarHBondContact O-N 3.33Å; A1247-C1249 VanDerWaalsContact C-N 3.33Å; A1247-C1249 PolarHBondContact O-N 3.2Å
1250	F	72.1	Confident	71.2	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.018	23%	0.231	C	C	.	.	H	α-helix	trans	-71.3	-49.8	174.7	-79	-73.5	0	0	0	112.4	E1220 L1246 A1247 V1248 N1252 R1253 D1260 Q1263 L1264	E1220-F1250 HydrophobicContact CB-CE2 4.17Å; E1220-F1250 HydrophobicContact CB-CZ 3.93Å; E1220-F1250 HydrophobicContact CG-CE2 4.21Å; E1220-F1250 HydrophobicContact CG-CZ 3.89Å; L1246-F1250 HydrophobicContact CD2-CE2 4.16Å; L1246-F1250 HydrophobicContact CG-CD2 4.31Å; L1246-F1250 HydrophobicContact CG-CE2 4.04Å; L1246-F1250 WeakPolarHBondContact O-CD2 3.41Å; L1246-F1250 PolarHBondContact O-N 3.11Å; A1247-F1250 PolarHBondContact O-N 3.2Å; V1248-F1250 VanDerWaalsContact C-N 3.3Å; V1248-F1250 PolarHBondContact O-N 3.09Å; F1250-N1252 PolarHBondContact O-N 3.27Å; F1250-N1252 VanDerWaalsContact O-N 3.16Å; F1250-R1253 WeakPolarHBondContact O-CB 3.38Å; F1250-R1253 PolarHBondContact O-N 3.01Å; F1250-D1260 HydrophobicContact CD1-CB 4.04Å; F1250-D1260 HydrophobicContact CE1-CB 4.1Å; F1250-Q1263 HydrophobicContact CZ-CB 4.47Å; F1250-L1264 HydrophobicContact CB-CD1 3.52Å; F1250-L1264 HydrophobicContact CG-CD1 4.31Å
1251	I	71.2	Confident	70.9	Confident	32 Å²	32	44.9 Å²	44.9	16%	0.164	23%	0.232	C	C	.	.	H	α-helix	trans	-51.7	-40.9	177.7	-69.4	163.1	0	0	0	110.8	A1247 V1248 R1253 L1264 E1299 T1300 T1303	A1247-I1251 WeakPolarHBondContact O-CG1 3.36Å; A1247-I1251 PolarHBondContact O-N 3.46Å; V1248-I1251 PolarHBondContact O-N 3.37Å; I1251-R1253 VanDerWaalsContact C-N 3.27Å; I1251-R1253 PolarHBondContact O-N 2.73Å; I1251-L1264 HydrophobicContact CG1-CD1 4.26Å; I1251-E1299 HydrophobicContact CD1-CB 4.05Å; I1251-T1300 HydrophobicContact CD1-CG2 3.87Å; I1251-T1300 HydrophobicContact CG1-CG2 4.4Å; I1251-T1303 HydrophobicContact CG2-CG2 4.41Å
1252	N	73.7	Confident	70.1	Confident	98 Å²	98	42.5 Å²	42.5	52%	0.524	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	12.4	-179.4	-67.1	-18.5	0	0	0	114.5	K1191 V1248 F1250	K1191-N1252 PolarHBondContact NZ-O 3.49Å; V1248-N1252 WeakPolarHBondContact CG1-ND2 3.31Å; V1248-N1252 WeakPolarHBondContact O-CB 3.2Å; V1248-N1252 VanDerWaalsContact O-CG 3.31Å; V1248-N1252 PolarHBondContact O-N 2.81Å; V1248-N1252 PolarHBondContact O-ND2 3.15Å; F1250-N1252 PolarHBondContact O-N 3.27Å; F1250-N1252 VanDerWaalsContact O-N 3.16Å
1253	R	71.5	Confident	69.5	Low	59 Å²	59	42.9 Å²	42.9	22%	0.223	22%	0.222	C	C	.	.			trans	-83.5	131.8	174.6	-73.8	-174.4	175.4	-172.5	0.9	109.6	N1217 E1220 F1250 I1251 T1255 L1256 D1260	N1217-R1253 PolarHBondContact OD1-NH1 3.19Å; N1217-R1253 PolarHBondContact OD1-NH2 3.26Å; E1220-R1253 IonicContact OE1-NH2 3.13Å; E1220-R1253 PolarHBondContact OE1-NH2 3.11Å; F1250-R1253 WeakPolarHBondContact O-CB 3.38Å; F1250-R1253 PolarHBondContact O-N 3.01Å; I1251-R1253 VanDerWaalsContact C-N 3.27Å; I1251-R1253 PolarHBondContact O-N 2.73Å; R1253-T1255 VanDerWaalsContact C-N 3.26Å; R1253-T1255 PolarHBondContact O-N 3.47Å; R1253-L1256 HydrophobicContact CB-CD2 4.2Å; R1253-D1260 IonicContact CZ-OD1 2.74Å; R1253-D1260 IonicContact CZ-OD2 3.85Å; R1253-D1260 IonicContact NH1-OD1 3.86Å; R1253-D1260 PolarHBondContact NH1-OD1 3.14Å; R1253-D1260 IonicContact NH1-OD2 2.71Å; R1253-D1260 PolarHBondContact NH1-OD2 3.04Å
1254	E	58.7	Low	69.1	Low	200 Å²	200	43 Å²	43	94%	0.935	22%	0.223	S	C	*	.	S	Bend	trans	-64.3	-28.7	-179.3	-64.9	-176.6	157.4	0	0	113.7
1255	T	57.3	Low	68.4	Low	120 Å²	120	42.6 Å²	42.6	74%	0.736	22%	0.22	S	C	*	.	S	Bend	trans	-133.7	133.6	171.4	50.7	0	0	0	0	109.4	R1253	R1253-T1255 VanDerWaalsContact C-N 3.26Å; R1253-T1255 PolarHBondContact O-N 3.47Å
1256	L	64	Low	67.8	Low	51 Å²	51	39.9 Å²	39.9	27%	0.267	21%	0.209	S	C	.	.			trans	-111.7	123.4	-179.7	-78.2	167.9	0	0	0	110.1	R1253 D1260 I1261	R1253-L1256 HydrophobicContact CB-CD2 4.2Å; L1256-D1260 HydrophobicContact CD2-CB 3.73Å; L1256-I1261 HydrophobicContact CB-CD1 4.03Å; L1256-I1261 HydrophobicContact CB-CG1 3.94Å; L1256-I1261 HydrophobicContact CD1-CG1 4.47Å
1257	C	66.5	Low	67.3	Low	69 Å²	69	39.8 Å²	39.8	47%	0.466	21%	0.208	S	C	.	.			trans	-78.5	160	174.1	-74	0	0	0	0	111.7	S1259 D1260 I1261	C1257-S1259 WeakPolarHBondContact CB-OG 3.46Å; C1257-S1259 PolarHBondContact O-N 2.94Å; C1257-S1259 VanDerWaalsContact O-N 3.17Å; C1257-D1260 PolarHBondContact N-OD2 2.75Å; C1257-D1260 WeakPolarHBondContact O-CB 3.26Å; C1257-D1260 PolarHBondContact O-N 2.93Å; C1257-I1261 PolarHBondContact O-N 2.96Å; C1257-I1261 VanDerWaalsContact O-N 3.08Å
1258	K	63.6	Low	66.9	Low	73 Å²	73	39.8 Å²	39.8	32%	0.317	21%	0.208	S	C	.	.	H	α-helix	trans	-56.3	-33	174.1	-69.1	-158.1	176.7	-161.6	0	112.5	L1262 W1307 N1322 E1326	K1258-L1262 WeakPolarHBondContact O-CB 3.38Å; K1258-L1262 PolarHBondContact O-N 3.07Å; K1258-L1262 VanDerWaalsContact O-N 3.12Å; K1258-W1307 HydrophobicContact CD-CH2 4.16Å; K1258-W1307 HydrophobicContact CD-CZ2 4.18Å; K1258-W1307 HydrophobicContact CG-CH2 4.09Å; K1258-W1307 HydrophobicContact CG-CZ2 3.78Å; K1258-N1322 VanDerWaalsContact NZ-CG 3.3Å; K1258-N1322 PolarHBondContact NZ-OD1 3.33Å; K1258-E1326 IonicContact NZ-OE1 2.67Å; K1258-E1326 PolarHBondContact NZ-OE1 3.04Å
1259	S	61	Low	66.4	Low	21 Å²	21	39.3 Å²	39.3	15%	0.147	20%	0.204	C	C	.	.	H	α-helix	trans	-64.5	-44.5	172.9	39.7	0	0	0	0	112.6	E1216 C1257 L1262 Q1263	E1216-S1259 PolarHBondContact OE2-OG 3.29Å; C1257-S1259 WeakPolarHBondContact CB-OG 3.46Å; C1257-S1259 PolarHBondContact O-N 2.94Å; C1257-S1259 VanDerWaalsContact O-N 3.17Å; S1259-L1262 PolarHBondContact O-N 3.1Å; S1259-Q1263 WeakPolarHBondContact O-CG 3.36Å; S1259-Q1263 PolarHBondContact O-N 3.41Å
1260	D	65.5	Low	66.1	Low	5 Å²	5	40 Å²	40	3%	0.027	21%	0.208	C	C	.	.	H	α-helix	trans	-62.4	-42.8	177.2	-64.2	-20.6	0	0	0	111.7	N1217 F1250 R1253 L1256 C1257 Q1263 L1264	N1217-D1260 PolarHBondContact ND2-OD1 3.49Å; F1250-D1260 HydrophobicContact CD1-CB 4.04Å; F1250-D1260 HydrophobicContact CE1-CB 4.1Å; R1253-D1260 IonicContact CZ-OD1 2.74Å; R1253-D1260 IonicContact CZ-OD2 3.85Å; R1253-D1260 IonicContact NH1-OD1 3.86Å; R1253-D1260 PolarHBondContact NH1-OD1 3.14Å; R1253-D1260 IonicContact NH1-OD2 2.71Å; R1253-D1260 PolarHBondContact NH1-OD2 3.04Å; L1256-D1260 HydrophobicContact CD2-CB 3.73Å; C1257-D1260 PolarHBondContact N-OD2 2.75Å; C1257-D1260 WeakPolarHBondContact O-CB 3.26Å; C1257-D1260 PolarHBondContact O-N 2.93Å; D1260-Q1263 PolarHBondContact O-N 3.26Å; D1260-L1264 WeakPolarHBondContact O-CB 3.4Å; D1260-L1264 PolarHBondContact O-N 3.19Å
1261	I	66.2	Low	65.9	Low	4 Å²	4	39.9 Å²	39.9	2%	0.021	21%	0.207	C	C	.	.	H	α-helix	trans	-71	-37	-177.9	-61.4	176.8	0	0	0	111.1	L1256 C1257 L1264 S1265 I1304 W1307 I1329	L1256-I1261 HydrophobicContact CB-CD1 4.03Å; L1256-I1261 HydrophobicContact CB-CG1 3.94Å; L1256-I1261 HydrophobicContact CD1-CG1 4.47Å; C1257-I1261 PolarHBondContact O-N 2.96Å; C1257-I1261 VanDerWaalsContact O-N 3.08Å; I1261-L1264 PolarHBondContact O-N 3.13Å; I1261-S1265 WeakPolarHBondContact O-CB 3.28Å; I1261-S1265 PolarHBondContact O-N 2.88Å; I1261-S1265 PolarHBondContact O-OG 3.43Å; I1261-I1304 HydrophobicContact CG2-CG1 4.3Å; I1261-I1304 HydrophobicContact CG2-CG2 4.49Å; I1261-W1307 HydrophobicContact CD1-CB 3.94Å; I1261-W1307 HydrophobicContact CD1-CD2 3.38Å; I1261-W1307 HydrophobicContact CD1-CE3 4.1Å; I1261-W1307 HydrophobicContact CD1-CG 3.25Å; I1261-W1307 HydrophobicContact CD1-CZ2 4.4Å; I1261-W1307 HydrophobicContact CG2-CD2 4.48Å; I1261-W1307 HydrophobicContact CG2-CE3 4.19Å; I1261-I1329 HydrophobicContact CB-CD1 4.49Å; I1261-I1329 HydrophobicContact CG2-CD1 3.96Å; I1261-I1329 HydrophobicContact CG2-CG1 4.45Å; I1261-I1329 HydrophobicContact CG2-CG2 4.22Å
1262	L	62.4	Low	65.7	Low	7 Å²	7	38.6 Å²	38.6	4%	0.037	20%	0.201	C	C	.	.	H	α-helix	trans	-59.6	-47.1	169.8	-167.8	81.3	0	0	0	110.7	V1093 T1095 K1258 S1259 S1265 H1266 R1328 I1329	V1093-L1262 HydrophobicContact CB-CD2 4.17Å; V1093-L1262 HydrophobicContact CG1-CD2 3.97Å; T1095-L1262 HydrophobicContact CG2-CD2 4.2Å; K1258-L1262 WeakPolarHBondContact O-CB 3.38Å; K1258-L1262 PolarHBondContact O-N 3.07Å; K1258-L1262 VanDerWaalsContact O-N 3.12Å; S1259-L1262 PolarHBondContact O-N 3.1Å; L1262-S1265 PolarHBondContact O-N 2.98Å; L1262-S1265 PolarHBondContact O-OG 3.36Å; L1262-H1266 PolarHBondContact O-CD2 3.04Å; L1262-H1266 VanDerWaalsContact O-CD2 3.24Å; L1262-H1266 PolarHBondContact O-N 3.48Å; L1262-H1266 VanDerWaalsContact O-N 3.11Å; L1262-R1328 HydrophobicContact CD1-CB 3.69Å; L1262-I1329 HydrophobicContact CD1-CG1 3.95Å
1263	Q	66.5	Low	65.3	Low	7 Å²	7	35.8 Å²	35.8	3%	0.033	19%	0.186	C	C	.	.	H	α-helix	trans	-62.5	-44.7	176.8	-74.3	-178	-15.2	0	0	112.2	V1093 N1217 W1224 F1250 S1259 D1260 S1265 H1266 L1267	V1093-Q1263 HydrophobicContact CG1-CG 3.63Å; N1217-Q1263 PolarHBondContact ND2-OE1 3.31Å; W1224-Q1263 HydrophobicContact CZ3-CB 4.48Å; F1250-Q1263 HydrophobicContact CZ-CB 4.47Å; S1259-Q1263 WeakPolarHBondContact O-CG 3.36Å; S1259-Q1263 PolarHBondContact O-N 3.41Å; D1260-Q1263 PolarHBondContact O-N 3.26Å; Q1263-S1265 VanDerWaalsContact C-N 3.31Å; Q1263-S1265 PolarHBondContact O-N 3.18Å; Q1263-H1266 PolarHBondContact O-N 3.05Å; Q1263-L1267 WeakPolarHBondContact O-CB 3.4Å; Q1263-L1267 PolarHBondContact O-N 3.4Å
1264	L	68.5	Low	65.2	Low	2 Å²	2	33.2 Å²	33.2	1%	0.01	18%	0.176	C	C	.	.	H	α-helix	trans	-58.4	-42.7	176.2	-163.4	85.9	0	0	0	111.4	F1250 I1251 D1260 I1261 L1267 G1268 T1300 I1304	F1250-L1264 HydrophobicContact CB-CD1 3.52Å; F1250-L1264 HydrophobicContact CG-CD1 4.31Å; I1251-L1264 HydrophobicContact CG1-CD1 4.26Å; D1260-L1264 WeakPolarHBondContact O-CB 3.4Å; D1260-L1264 PolarHBondContact O-N 3.19Å; I1261-L1264 PolarHBondContact O-N 3.13Å; L1264-L1267 PolarHBondContact O-N 3.26Å; L1264-G1268 PolarHBondContact O-N 3.44Å; L1264-T1300 HydrophobicContact CD1-CG2 4.06Å; L1264-T1300 HydrophobicContact CD2-CG2 4.1Å; L1264-T1300 HydrophobicContact CG-CG2 3.94Å; L1264-I1304 HydrophobicContact CD2-CD1 4.25Å; L1264-I1304 HydrophobicContact CD2-CG1 4Å
1265	S	63.9	Low	65.5	Low	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-65.7	-41.5	179.5	77.1	0	0	0	0	112.8	I1261 L1262 Q1263 L1269	I1261-S1265 WeakPolarHBondContact O-CB 3.28Å; I1261-S1265 PolarHBondContact O-N 2.88Å; I1261-S1265 PolarHBondContact O-OG 3.43Å; L1262-S1265 PolarHBondContact O-N 2.98Å; L1262-S1265 PolarHBondContact O-OG 3.36Å; Q1263-S1265 VanDerWaalsContact C-N 3.31Å; Q1263-S1265 PolarHBondContact O-N 3.18Å; S1265-L1269 WeakPolarHBondContact O-CB 3.4Å; S1265-L1269 PolarHBondContact O-N 2.91Å
1266	H	65.8	Low	65.6	Low	38 Å²	38	20.3 Å²	20.3	18%	0.176	11%	0.106	C	C	.	.	H	α-helix	trans	-72.6	-32	174.6	-73.1	-64.4	0	0	0	112.4	W1224 L1262 Q1263 N1270	W1224-H1266 HydrophobicContact CH2-CB 3.71Å; W1224-H1266 HydrophobicContact CZ2-CB 4.47Å; L1262-H1266 PolarHBondContact O-CD2 3.04Å; L1262-H1266 VanDerWaalsContact O-CD2 3.24Å; L1262-H1266 PolarHBondContact O-N 3.48Å; L1262-H1266 VanDerWaalsContact O-N 3.11Å; Q1263-H1266 PolarHBondContact O-N 3.05Å; H1266-N1270 VanDerWaalsContact O-CB 3.24Å; H1266-N1270 WeakPolarHBondContact O-CB 3.25Å; H1266-N1270 PolarHBondContact O-N 3.04Å
1267	L	69.9	Low	65.3	Low	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-68.5	-47.2	176.4	-174.5	73.8	0	0	0	111.5	W1224 L1243 L1246 A1247 Q1263 L1264 L1269 N1270 I1271	W1224-L1267 HydrophobicContact CD2-CD1 4.03Å; W1224-L1267 HydrophobicContact CE3-CD1 4.19Å; W1224-L1267 HydrophobicContact CG-CD1 4.47Å; W1224-L1267 HydrophobicContact CH2-CB 4.17Å; W1224-L1267 HydrophobicContact CZ2-CD1 4.39Å; W1224-L1267 HydrophobicContact CZ3-CB 4.28Å; W1224-L1267 HydrophobicContact CZ3-CD1 4.44Å; L1243-L1267 HydrophobicContact CB-CD1 4.29Å; L1243-L1267 HydrophobicContact CD2-CD1 3.81Å; L1246-L1267 HydrophobicContact CB-CD2 4.23Å; L1246-L1267 HydrophobicContact CD2-CD1 3.77Å; L1246-L1267 HydrophobicContact CD2-CD2 3.86Å; L1246-L1267 HydrophobicContact CD2-CG 4.47Å; L1246-L1267 HydrophobicContact CG-CD2 4.26Å; A1247-L1267 HydrophobicContact CB-CD2 3.65Å; Q1263-L1267 WeakPolarHBondContact O-CB 3.4Å; Q1263-L1267 PolarHBondContact O-N 3.4Å; L1264-L1267 PolarHBondContact O-N 3.26Å; L1267-L1269 VanDerWaalsContact C-N 3.33Å; L1267-L1269 PolarHBondContact O-N 3.12Å; L1267-N1270 PolarHBondContact O-N 2.97Å; L1267-N1270 VanDerWaalsContact O-N 3.12Å; L1267-I1271 HydrophobicContact CG-CD1 4.04Å; L1267-I1271 WeakPolarHBondContact O-CG1 3.47Å; L1267-I1271 PolarHBondContact O-N 3.15Å
1268	G	66	Low	64.8	Low	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-59.9	-42.4	176.1	0	0	0	0	0	112.2	L1264 N1270 M1272	L1264-G1268 PolarHBondContact O-N 3.44Å; G1268-N1270 VanDerWaalsContact C-N 3.33Å; G1268-N1270 PolarHBondContact O-N 2.79Å; G1268-M1272 WeakPolarHBondContact O-CB 3.45Å; G1268-M1272 PolarHBondContact O-N 3.27Å
1269	L	65.6	Low	64.3	Low	30 Å²	30	14.9 Å²	14.9	16%	0.157	7%	0.071	C	C	.	.	H	α-helix	trans	-58.4	-44.1	172.3	175.4	57.3	0	0	0	112.1	S1265 L1267 M1272 N1273 Y1335 I1336 Y1339	S1265-L1269 WeakPolarHBondContact O-CB 3.4Å; S1265-L1269 PolarHBondContact O-N 2.91Å; L1267-L1269 VanDerWaalsContact C-N 3.33Å; L1267-L1269 PolarHBondContact O-N 3.12Å; L1269-M1272 PolarHBondContact O-N 2.71Å; L1269-N1273 WeakPolarHBondContact O-CB 3.45Å; L1269-N1273 PolarHBondContact O-N 3.42Å; L1269-N1273 PolarHBondContact O-ND2 3.1Å; L1269-Y1335 VanDerWaalsContact CD1-CB 3.48Å; L1269-Y1335 HydrophobicContact CD1-CG 4.29Å; L1269-I1336 HydrophobicContact CB-CG1 4.14Å; L1269-Y1339 HydrophobicContact CD1-CD2 3.85Å; L1269-Y1339 HydrophobicContact CD1-CE2 3.81Å
1270	N	67.7	Low	63.6	Low	21 Å²	21	18.5 Å²	18.5	11%	0.112	9%	0.088	C	C	.	.	H	α-helix	trans	-72.4	-40.5	-176.7	-167	0.5	0	0	0	112.4	W1224 E1228 H1266 L1267 G1268 M1272 N1273 K1274	W1224-N1270 HydrophobicContact CZ2-CB 4.42Å; W1224-N1270 PolarHBondContact NE1-ND2 3.49Å; E1228-N1270 PolarHBondContact OE1-ND2 2.77Å; H1266-N1270 VanDerWaalsContact O-CB 3.24Å; H1266-N1270 WeakPolarHBondContact O-CB 3.25Å; H1266-N1270 PolarHBondContact O-N 3.04Å; L1267-N1270 PolarHBondContact O-N 2.97Å; L1267-N1270 VanDerWaalsContact O-N 3.12Å; G1268-N1270 VanDerWaalsContact C-N 3.33Å; G1268-N1270 PolarHBondContact O-N 2.79Å; N1270-M1272 VanDerWaalsContact C-N 3.31Å; N1270-M1272 PolarHBondContact O-N 3.04Å; N1270-N1273 PolarHBondContact O-N 3.18Å; N1270-K1274 WeakPolarHBondContact O-CG 3.26Å; N1270-K1274 PolarHBondContact O-N 2.8Å; N1270-K1274 VanDerWaalsContact OD1-CE 3.27Å; N1270-K1274 WeakPolarHBondContact OD1-CE 3.35Å
1271	I	67.6	Low	62.5	Low	1 Å²	1	24.1 Å²	24.1	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-57.1	-46.8	169.1	-68.2	165.7	0	0	0	109.8	V1240 L1243 A1247 L1267 N1273 K1274 L1275 V1297	V1240-I1271 HydrophobicContact CG1-CG2 4.45Å; L1243-I1271 HydrophobicContact CB-CD1 4.23Å; L1243-I1271 HydrophobicContact CB-CG1 3.84Å; A1247-I1271 HydrophobicContact CB-CD1 4.12Å; L1267-I1271 HydrophobicContact CG-CD1 4.04Å; L1267-I1271 WeakPolarHBondContact O-CG1 3.47Å; L1267-I1271 PolarHBondContact O-N 3.15Å; I1271-N1273 PolarHBondContact O-N 3.31Å; I1271-K1274 PolarHBondContact O-N 3.19Å; I1271-L1275 HydrophobicContact CG2-CD1 3.79Å; I1271-L1275 HydrophobicContact CG2-CG 4.2Å; I1271-L1275 WeakPolarHBondContact O-CG 3.28Å; I1271-L1275 PolarHBondContact O-N 3.21Å; I1271-V1297 HydrophobicContact CB-CG2 4.28Å; I1271-V1297 HydrophobicContact CG2-CG2 3.7Å
1272	M	68	Low	61.4	Low	5 Å²	5	26.1 Å²	26.1	3%	0.025	13%	0.127	C	C	.	.	H	α-helix	trans	-66.8	-39.3	-178.3	-158.3	67.2	-155.8	0	0	112.8	G1268 L1269 N1270 K1274 L1275 R1276 V1297 S1343	G1268-M1272 WeakPolarHBondContact O-CB 3.45Å; G1268-M1272 PolarHBondContact O-N 3.27Å; L1269-M1272 PolarHBondContact O-N 2.71Å; N1270-M1272 VanDerWaalsContact C-N 3.31Å; N1270-M1272 PolarHBondContact O-N 3.04Å; M1272-K1274 VanDerWaalsContact C-N 3.28Å; M1272-K1274 PolarHBondContact O-N 3.44Å; M1272-L1275 PolarHBondContact O-N 2.97Å; M1272-L1275 HydrophobicContact SD-CD1 4.12Å; M1272-R1276 PolarHBondContact O-N 2.97Å; M1272-R1276 VanDerWaalsContact O-N 3.08Å; M1272-V1297 HydrophobicContact SD-CG1 4.13Å; M1272-V1297 HydrophobicContact SD-CG2 4.44Å; M1272-S1343 WeakPolarHBondContact CE-OG 3.26Å
1273	N	65.2	Low	60.4	Low	39 Å²	39	31 Å²	31	21%	0.209	15%	0.153	C	C	.	.	H	α-helix	trans	-59.3	-38.2	172.1	-78.3	-21.7	0	0	0	112.1	L1269 N1270 I1271 R1276 Y1277 Y1339	L1269-N1273 WeakPolarHBondContact O-CB 3.45Å; L1269-N1273 PolarHBondContact O-N 3.42Å; L1269-N1273 PolarHBondContact O-ND2 3.1Å; N1270-N1273 PolarHBondContact O-N 3.18Å; I1271-N1273 PolarHBondContact O-N 3.31Å; N1273-R1276 WeakPolarHBondContact O-CB 3.15Å; N1273-Y1277 WeakPolarHBondContact O-CD2 3.22Å; N1273-Y1277 WeakPolarHBondContact O-CE2 3.27Å; N1273-Y1339 VanDerWaalsContact OD1-CE2 3.3Å; N1273-Y1339 WeakPolarHBondContact OD1-CE2 3.48Å
1274	K	69.2	Low	59.3	Low	5 Å²	5	39.2 Å²	39.2	2%	0.022	19%	0.191	C	C	.	.	H	α-helix	trans	-76.9	-38.4	178.6	-69	175.5	175.8	177.5	0	113	E1228 Y1231 V1240 L1243 N1270 I1271 M1272 R1276 Y1277 L1278	E1228-K1274 IonicContact OE1-NZ 3.88Å; E1228-K1274 PolarHBondContact OE1-NZ 3.44Å; E1228-K1274 IonicContact OE2-NZ 3.99Å; E1228-K1274 PolarHBondContact OE2-NZ 3.13Å; Y1231-K1274 HydrophobicContact CD2-CB 4.48Å; Y1231-K1274 HydrophobicContact CD2-CD 3.77Å; Y1231-K1274 HydrophobicContact CD2-CG 3.85Å; Y1231-K1274 HydrophobicContact CE2-CB 4.19Å; Y1231-K1274 HydrophobicContact CE2-CD 4.14Å; Y1231-K1274 HydrophobicContact CE2-CG 3.68Å; Y1231-K1274 HydrophobicContact CG-CD 4.13Å; V1240-K1274 HydrophobicContact CG2-CB 3.75Å; L1243-K1274 HydrophobicContact CD1-CD 4.01Å; N1270-K1274 WeakPolarHBondContact O-CG 3.26Å; N1270-K1274 PolarHBondContact O-N 2.8Å; N1270-K1274 VanDerWaalsContact OD1-CE 3.27Å; N1270-K1274 WeakPolarHBondContact OD1-CE 3.35Å; I1271-K1274 PolarHBondContact O-N 3.19Å; M1272-K1274 VanDerWaalsContact C-N 3.28Å; M1272-K1274 PolarHBondContact O-N 3.44Å; K1274-R1276 PolarHBondContact O-N 3.32Å; K1274-Y1277 PolarHBondContact O-N 3.34Å; K1274-L1278 PolarHBondContact O-N 2.9Å; K1274-L1278 VanDerWaalsContact O-N 3.15Å
1275	L	65.6	Low	58.4	Low	4 Å²	4	43.4 Å²	43.4	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-59.7	-30.7	171.7	-73.9	171.8	0	0	0	112.5	V1240 I1271 M1272 Y1277 L1278 R1279 L1290 Y1293 V1297	V1240-L1275 HydrophobicContact CG1-CD2 3.94Å; V1240-L1275 HydrophobicContact CG1-CG 4.39Å; I1271-L1275 HydrophobicContact CG2-CD1 3.79Å; I1271-L1275 HydrophobicContact CG2-CG 4.2Å; I1271-L1275 WeakPolarHBondContact O-CG 3.28Å; I1271-L1275 PolarHBondContact O-N 3.21Å; M1272-L1275 PolarHBondContact O-N 2.97Å; M1272-L1275 HydrophobicContact SD-CD1 4.12Å; L1275-Y1277 PolarHBondContact O-N 3.16Å; L1275-L1278 HydrophobicContact CD2-CD1 4.41Å; L1275-R1279 PolarHBondContact O-N 3.21Å; L1275-L1290 HydrophobicContact CD2-CG 4.24Å; L1275-Y1293 HydrophobicContact CD2-CD2 3.9Å; L1275-Y1293 HydrophobicContact CD2-CG 4.23Å; L1275-V1297 HydrophobicContact CD1-CG2 4.41Å
1276	R	59.2	Low	58	Low	45 Å²	45	45.1 Å²	45.1	17%	0.17	23%	0.229	C	C	.	.	H	α-helix	trans	-63.2	-27.3	173.9	-162.8	173.2	-178.3	-105	-6.7	112.4	M1272 N1273 K1274 E1342	M1272-R1276 PolarHBondContact O-N 2.97Å; M1272-R1276 VanDerWaalsContact O-N 3.08Å; N1273-R1276 WeakPolarHBondContact O-CB 3.15Å; K1274-R1276 PolarHBondContact O-N 3.32Å; R1276-E1342 IonicContact CZ-OE1 3.39Å; R1276-E1342 IonicContact CZ-OE2 2.77Å; R1276-E1342 IonicContact NE-OE1 3.14Å; R1276-E1342 IonicContact NE-OE2 3.92Å; R1276-E1342 PolarHBondContact NE-OE2 3.14Å; R1276-E1342 VanDerWaalsContact NH2-CD 3.3Å; R1276-E1342 IonicContact NH2-OE1 3.76Å; R1276-E1342 PolarHBondContact NH2-OE1 3Å; R1276-E1342 IonicContact NH2-OE2 3.58Å; R1276-E1342 PolarHBondContact NH2-OE2 3.11Å
1277	Y	56.7	Low	57.5	Low	16 Å²	16	46.8 Å²	46.8	6%	0.063	24%	0.24	C	C	.	.	H	α-helix	trans	-89.3	-47.1	178.6	-64.9	-50.6	0	0	0	113.8	Y1231 E1236 N1273 K1274 L1275 R1279 N1280 N1538 L1539 N1540	Y1231-Y1277 WeakPolarHBondContact OH-CD2 3.36Å; E1236-Y1277 WeakPolarHBondContact OE2-CB 3.4Å; N1273-Y1277 WeakPolarHBondContact O-CD2 3.22Å; N1273-Y1277 WeakPolarHBondContact O-CE2 3.27Å; K1274-Y1277 PolarHBondContact O-N 3.34Å; L1275-Y1277 PolarHBondContact O-N 3.16Å; Y1277-R1279 PolarHBondContact O-N 3.27Å; Y1277-N1280 PolarHBondContact O-N 3.2Å; Y1277-N1538 HydrophobicContact CE2-CB 4.06Å; Y1277-N1538 VanDerWaalsContact OH-C 3.22Å; Y1277-N1538 WeakPolarHBondContact OH-CB 3.22Å; Y1277-N1538 PolarHBondContact OH-O 2.67Å; Y1277-L1539 HydrophobicContact CE1-CB 3.92Å; Y1277-L1539 WeakPolarHBondContact CE1-O 3.13Å; Y1277-L1539 HydrophobicContact CE2-CB 4.22Å; Y1277-L1539 PolarHBondContact OH-O 3.24Å; Y1277-N1540 HydrophobicContact CD1-CB 3.38Å; Y1277-N1540 HydrophobicContact CE1-CB 3.62Å; Y1277-N1540 VanDerWaalsContact CE1-N 3.26Å; Y1277-N1540 HydrophobicContact CG-CB 4.22Å
1278	L	57.5	Low	56.9	Low	9 Å²	9	53 Å²	53	5%	0.047	27%	0.273	C	S	.	.	H	α-helix	trans	-48.4	-35.6	174	-87	166.6	0	0	0	112.9	E1236 L1237 V1240 K1274 L1275 N1280 E1281 V1282	E1236-L1278 HydrophobicContact CB-CD1 4.43Å; E1236-L1278 HydrophobicContact CB-CD2 3.72Å; E1236-L1278 HydrophobicContact CB-CG 3.83Å; E1236-L1278 PolarHBondContact OE2-N 3.35Å; L1237-L1278 HydrophobicContact CB-CD2 4.31Å; L1237-L1278 HydrophobicContact CD1-CD2 4.23Å; V1240-L1278 HydrophobicContact CB-CD1 4.12Å; V1240-L1278 HydrophobicContact CG2-CD1 3.7Å; K1274-L1278 PolarHBondContact O-N 2.9Å; K1274-L1278 VanDerWaalsContact O-N 3.15Å; L1275-L1278 HydrophobicContact CD2-CD1 4.41Å; L1278-N1280 PolarHBondContact O-N 3.4Å; L1278-N1280 VanDerWaalsContact O-N 3.16Å; L1278-E1281 PolarHBondContact O-N 3.08Å; L1278-E1281 VanDerWaalsContact O-N 3.13Å; L1278-V1282 VanDerWaalsContact O-CG2 3.31Å; L1278-V1282 WeakPolarHBondContact O-CG2 3.46Å
1279	R	51.9	Low	56.7	Low	54 Å²	54	56.5 Å²	56.5	20%	0.204	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-59.4	-23.6	-179.3	-127.5	-170.7	-154.2	-170.5	12.9	115.4	L1275 Y1277 E1281 L1290 S1343 L1347	L1275-R1279 PolarHBondContact O-N 3.21Å; Y1277-R1279 PolarHBondContact O-N 3.27Å; R1279-E1281 VanDerWaalsContact C-N 3.3Å; R1279-L1290 HydrophobicContact CG-CD1 3.92Å; R1279-S1343 PolarHBondContact NH1-O 3.2Å; R1279-S1343 VanDerWaalsContact NH2-C 3.33Å; R1279-S1343 PolarHBondContact NH2-O 3.38Å; R1279-L1347 VanDerWaalsContact NH2-CG 3.32Å
1280	N	46.9	Very low	56.5	Low	96 Å²	96	55.4 Å²	55.4	51%	0.513	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-82.2	-6.3	-179.4	-70	-6.9	0	0	0	112.9	Y1277 L1278	Y1277-N1280 PolarHBondContact O-N 3.2Å; L1278-N1280 PolarHBondContact O-N 3.4Å; L1278-N1280 VanDerWaalsContact O-N 3.16Å
1281	E	43.2	Very low	56.5	Low	123 Å²	123	60 Å²	60	58%	0.575	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-110.3	5.9	-174.2	-57	-158.1	138	0	0	114.8	L1278 R1279	L1278-E1281 PolarHBondContact O-N 3.08Å; L1278-E1281 VanDerWaalsContact O-N 3.13Å; R1279-E1281 VanDerWaalsContact C-N 3.3Å
1282	V	42.5	Very low	56.5	Low	47 Å²	47	64.9 Å²	64.9	29%	0.285	33%	0.332	S	S	.	.			trans	-82.2	123.5	-154.6	174	0	0	0	0	115.8	L1278 I1286 L1290	L1278-V1282 VanDerWaalsContact O-CG2 3.31Å; L1278-V1282 WeakPolarHBondContact O-CG2 3.46Å; V1282-I1286 HydrophobicContact CG1-CB 4.05Å; V1282-I1286 HydrophobicContact CG2-CB 4.23Å; V1282-I1286 HydrophobicContact CG2-CD1 4.42Å; V1282-I1286 HydrophobicContact CG2-CG2 4.27Å; V1282-L1290 HydrophobicContact CG2-CD1 4.43Å
1283	N	40.6	Very low	56.5	Low	109 Å²	109	65.7 Å²	65.7	58%	0.583	34%	0.335	S	S	*	.			trans	-88.2	149.7	150.6	-63.2	-79.9	0	0	0	109.4	S1285 I1286	N1283-S1285 PolarHBondContact O-N 3.01Å; N1283-I1286 PolarHBondContact O-N 3.32Å; N1283-I1286 VanDerWaalsContact O-N 3.07Å
1284	E	44.3	Very low	56.6	Low	179 Å²	179	65.3 Å²	65.3	84%	0.836	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44	-20.5	-173.6	-61.3	176.6	150.6	0	0	117.3
1285	S	49.5	Very low	56.8	Low	91 Å²	91	67.7 Å²	67.7	64%	0.636	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-22.1	178.5	57.9	0	0	0	0	114.9	N1283	N1283-S1285 PolarHBondContact O-N 3.01Å
1286	I	54.2	Low	56.9	Low	35 Å²	35	68.2 Å²	68.2	18%	0.179	35%	0.352	C	S	.	.	S	Bend	trans	-82.7	-25.6	-175.6	-55.2	175.2	0	0	0	111.5	L1237 V1282 N1283 N1288 Q1289 L1290	L1237-I1286 HydrophobicContact CD1-CG2 4.11Å; V1282-I1286 HydrophobicContact CG1-CB 4.05Å; V1282-I1286 HydrophobicContact CG2-CB 4.23Å; V1282-I1286 HydrophobicContact CG2-CD1 4.42Å; V1282-I1286 HydrophobicContact CG2-CG2 4.27Å; N1283-I1286 PolarHBondContact O-N 3.32Å; N1283-I1286 VanDerWaalsContact O-N 3.07Å; I1286-N1288 VanDerWaalsContact C-N 3.27Å; I1286-N1288 PolarHBondContact O-N 2.94Å; I1286-Q1289 WeakPolarHBondContact O-CA 3.48Å; I1286-Q1289 WeakPolarHBondContact O-CB 3.48Å; I1286-Q1289 PolarHBondContact O-N 3.44Å; I1286-L1290 HydrophobicContact CG2-CD1 4.48Å; I1286-L1290 PolarHBondContact O-N 2.95Å
1287	D	55.7	Low	57.3	Low	73 Å²	73	66.1 Å²	66.1	39%	0.39	34%	0.344	S	S	.	.	H	α-helix	trans	-55.6	-39.1	-176.3	-71.2	-37.1	0	0	0	113.2	Q1289 L1290 M1291	D1287-Q1289 VanDerWaalsContact C-N 3.34Å; D1287-Q1289 PolarHBondContact O-N 2.86Å; D1287-L1290 PolarHBondContact O-N 3.32Å; D1287-M1291 WeakPolarHBondContact O-CG 3.19Å; D1287-M1291 PolarHBondContact O-N 3.39Å
1288	N	57.8	Low	58.1	Low	132 Å²	132	70.6 Å²	70.6	71%	0.706	36%	0.361	S	S	*	.	H	α-helix	trans	-63	-37.7	175.4	-74.6	-34.7	0	0	0	112.9	I1286 L1292	I1286-N1288 VanDerWaalsContact C-N 3.27Å; I1286-N1288 PolarHBondContact O-N 2.94Å; N1288-L1292 PolarHBondContact O-N 3.5Å
1289	Q	60.8	Low	58.9	Low	72 Å²	72	74.8 Å²	74.8	34%	0.336	38%	0.381	S	S	.	.	H	α-helix	trans	-74.4	-38	175.9	-62.9	-174	-8.2	0	0	110.7	I1286 D1287 M1291 L1292 Y1293	I1286-Q1289 WeakPolarHBondContact O-CA 3.48Å; I1286-Q1289 WeakPolarHBondContact O-CB 3.48Å; I1286-Q1289 PolarHBondContact O-N 3.44Å; D1287-Q1289 VanDerWaalsContact C-N 3.34Å; D1287-Q1289 PolarHBondContact O-N 2.86Å; Q1289-M1291 PolarHBondContact O-N 3.46Å; Q1289-L1292 WeakPolarHBondContact O-CB 3.22Å; Q1289-L1292 PolarHBondContact O-N 3.4Å; Q1289-L1292 VanDerWaalsContact O-N 3.09Å; Q1289-Y1293 HydrophobicContact CB-CE2 3.83Å; Q1289-Y1293 WeakPolarHBondContact O-CD2 3.5Å; Q1289-Y1293 WeakPolarHBondContact O-CE2 3.27Å; Q1289-Y1293 PolarHBondContact O-N 2.86Å
1290	L	63	Low	59.7	Low	7 Å²	7	72.2 Å²	72.2	4%	0.037	37%	0.371	C	S	.	.	H	α-helix	trans	-63.3	-42	179.5	-148.1	146.4	0	0	0	111.4	L1275 R1279 V1282 I1286 D1287 L1292 Y1293 Q1294	L1275-L1290 HydrophobicContact CD2-CG 4.24Å; R1279-L1290 HydrophobicContact CG-CD1 3.92Å; V1282-L1290 HydrophobicContact CG2-CD1 4.43Å; I1286-L1290 HydrophobicContact CG2-CD1 4.48Å; I1286-L1290 PolarHBondContact O-N 2.95Å; D1287-L1290 PolarHBondContact O-N 3.32Å; L1290-L1292 VanDerWaalsContact C-N 3.32Å; L1290-L1292 PolarHBondContact O-N 3.46Å; L1290-Y1293 PolarHBondContact O-N 2.72Å; L1290-Q1294 HydrophobicContact CD2-CG 4.41Å; L1290-Q1294 WeakPolarHBondContact O-CG 3.41Å; L1290-Q1294 PolarHBondContact O-N 3.03Å
1291	M	66.8	Low	60.9	Low	117 Å²	117	68.3 Å²	68.3	58%	0.576	35%	0.35	S	S	*	.	H	α-helix	trans	-60.7	-38.6	170.8	-71.9	-66.1	-70.9	0	0	112.7	D1287 Q1289 Q1294 S1295	D1287-M1291 WeakPolarHBondContact O-CG 3.19Å; D1287-M1291 PolarHBondContact O-N 3.39Å; Q1289-M1291 PolarHBondContact O-N 3.46Å; M1291-Q1294 PolarHBondContact O-N 3.37Å; M1291-S1295 PolarHBondContact O-N 3.3Å
1292	L	67.2	Low	62.5	Low	105 Å²	105	65.6 Å²	65.6	55%	0.55	34%	0.338	S	S	.	.	H	α-helix	trans	-71.2	-34.5	-179.3	-148.2	157.2	0	0	0	111.9	N1288 Q1289 L1290 S1295 I1296	N1288-L1292 PolarHBondContact O-N 3.5Å; Q1289-L1292 WeakPolarHBondContact O-CB 3.22Å; Q1289-L1292 PolarHBondContact O-N 3.4Å; Q1289-L1292 VanDerWaalsContact O-N 3.09Å; L1290-L1292 VanDerWaalsContact C-N 3.32Å; L1290-L1292 PolarHBondContact O-N 3.46Å; L1292-S1295 PolarHBondContact O-OG 2.74Å; L1292-I1296 HydrophobicContact CD2-CD1 4.21Å; L1292-I1296 WeakPolarHBondContact O-CG1 3.38Å; L1292-I1296 PolarHBondContact O-N 3.26Å
1293	Y	68.6	Low	64	Low	22 Å²	22	65.1 Å²	65.1	9%	0.086	34%	0.335	C	S	.	.	H	α-helix	trans	-73.5	-33.9	170.2	-55.4	-48.8	0	0	0	112.3	V1240 Q1241 S1244 L1275 Q1289 L1290 I1296 V1297	V1240-Y1293 HydrophobicContact CG1-CD1 3.98Å; V1240-Y1293 HydrophobicContact CG1-CD2 3.55Å; V1240-Y1293 HydrophobicContact CG1-CE1 4.34Å; V1240-Y1293 HydrophobicContact CG1-CE2 3.93Å; V1240-Y1293 HydrophobicContact CG1-CG 3.62Å; Q1241-Y1293 HydrophobicContact CG-CE1 4.39Å; Q1241-Y1293 WeakPolarHBondContact CG-OH 3.27Å; S1244-Y1293 WeakPolarHBondContact OG-CD1 3.48Å; S1244-Y1293 WeakPolarHBondContact OG-CE1 3.41Å; L1275-Y1293 HydrophobicContact CD2-CD2 3.9Å; L1275-Y1293 HydrophobicContact CD2-CG 4.23Å; Q1289-Y1293 HydrophobicContact CB-CE2 3.83Å; Q1289-Y1293 WeakPolarHBondContact O-CD2 3.5Å; Q1289-Y1293 WeakPolarHBondContact O-CE2 3.27Å; Q1289-Y1293 PolarHBondContact O-N 2.86Å; L1290-Y1293 PolarHBondContact O-N 2.72Å; Y1293-I1296 HydrophobicContact CD1-CD1 4.46Å; Y1293-I1296 PolarHBondContact O-N 3.2Å; Y1293-V1297 WeakPolarHBondContact O-CG2 3.15Å; Y1293-V1297 PolarHBondContact O-N 3.02Å
1294	Q	68.3	Low	65.4	Low	30 Å²	30	60 Å²	60	14%	0.14	31%	0.307	C	S	.	.	H	α-helix	trans	-65.1	-35.3	173	-75.2	-170.2	-12.9	0	0	112.8	L1290 M1291 V1297 Y1298 S1343	L1290-Q1294 HydrophobicContact CD2-CG 4.41Å; L1290-Q1294 WeakPolarHBondContact O-CG 3.41Å; L1290-Q1294 PolarHBondContact O-N 3.03Å; M1291-Q1294 PolarHBondContact O-N 3.37Å; Q1294-V1297 PolarHBondContact O-N 3.41Å; Q1294-Y1298 PolarHBondContact O-N 2.98Å; Q1294-S1343 PolarHBondContact NE2-OG 2.93Å; Q1294-S1343 VanDerWaalsContact NE2-OG 3.07Å
1295	S	72.3	Confident	66.8	Low	56 Å²	56	52.6 Å²	52.6	39%	0.392	28%	0.275	S	S	.	.	H	α-helix	trans	-67.3	-40.2	173.6	61.2	0	0	0	0	112.2	M1291 L1292 V1297 Y1298 E1299	M1291-S1295 PolarHBondContact O-N 3.3Å; L1292-S1295 PolarHBondContact O-OG 2.74Å; S1295-V1297 VanDerWaalsContact C-N 3.35Å; S1295-V1297 PolarHBondContact O-N 2.67Å; S1295-Y1298 WeakPolarHBondContact O-CB 3.49Å; S1295-Y1298 PolarHBondContact O-N 3.08Å; S1295-Y1298 VanDerWaalsContact O-N 3.14Å; S1295-E1299 PolarHBondContact O-N 3.12Å
1296	I	67.6	Low	68	Low	15 Å²	15	53.2 Å²	53.2	8%	0.077	27%	0.267	C	S	.	.	H	α-helix	trans	-61.8	-42.7	174.2	-66.1	166.8	0	0	0	110.8	A1247 V1248 L1292 Y1293 Y1298 E1299 T1300	A1247-I1296 HydrophobicContact CB-CG2 3.98Å; V1248-I1296 HydrophobicContact CG2-CD1 4.02Å; V1248-I1296 HydrophobicContact CG2-CG1 4.15Å; V1248-I1296 HydrophobicContact CG2-CG2 4.15Å; L1292-I1296 HydrophobicContact CD2-CD1 4.21Å; L1292-I1296 WeakPolarHBondContact O-CG1 3.38Å; L1292-I1296 PolarHBondContact O-N 3.26Å; Y1293-I1296 HydrophobicContact CD1-CD1 4.46Å; Y1293-I1296 PolarHBondContact O-N 3.2Å; I1296-Y1298 VanDerWaalsContact C-N 3.3Å; I1296-Y1298 PolarHBondContact O-N 3.15Å; I1296-E1299 PolarHBondContact O-N 3.19Å; I1296-T1300 PolarHBondContact O-N 2.92Å
1297	V	68	Low	68.9	Low	1 Å²	1	53.7 Å²	53.7	1%	0.006	27%	0.267	C	S	.	.	H	α-helix	trans	-62.9	-37.8	174.6	173.8	0	0	0	0	111.3	I1271 M1272 L1275 Y1293 Q1294 S1295 T1300 E1301 I1336	I1271-V1297 HydrophobicContact CB-CG2 4.28Å; I1271-V1297 HydrophobicContact CG2-CG2 3.7Å; M1272-V1297 HydrophobicContact SD-CG1 4.13Å; M1272-V1297 HydrophobicContact SD-CG2 4.44Å; L1275-V1297 HydrophobicContact CD1-CG2 4.41Å; Y1293-V1297 WeakPolarHBondContact O-CG2 3.15Å; Y1293-V1297 PolarHBondContact O-N 3.02Å; Q1294-V1297 PolarHBondContact O-N 3.41Å; S1295-V1297 VanDerWaalsContact C-N 3.35Å; S1295-V1297 PolarHBondContact O-N 2.67Å; V1297-T1300 WeakPolarHBondContact CA-OG1 3.47Å; V1297-T1300 PolarHBondContact O-N 3.29Å; V1297-T1300 PolarHBondContact O-OG1 3.31Å; V1297-E1301 PolarHBondContact O-N 3.24Å; V1297-I1336 HydrophobicContact CG1-CG2 3.69Å
1298	Y	73.9	Confident	69.4	Low	109 Å²	109	50.7 Å²	50.7	43%	0.427	25%	0.251	S	S	.	.	H	α-helix	trans	-65.7	-38.1	174.6	-173.7	-106.6	0	0	0	112.9	Q1294 S1295 I1296 E1301 M1302	Q1294-Y1298 PolarHBondContact O-N 2.98Å; S1295-Y1298 WeakPolarHBondContact O-CB 3.49Å; S1295-Y1298 PolarHBondContact O-N 3.08Å; S1295-Y1298 VanDerWaalsContact O-N 3.14Å; I1296-Y1298 VanDerWaalsContact C-N 3.3Å; I1296-Y1298 PolarHBondContact O-N 3.15Å; Y1298-E1301 WeakPolarHBondContact O-CB 3.41Å; Y1298-E1301 PolarHBondContact O-N 3.37Å; Y1298-M1302 HydrophobicContact CD1-CG 4.29Å; Y1298-M1302 HydrophobicContact CE1-CG 3.9Å; Y1298-M1302 HydrophobicContact CE1-SD 4.47Å; Y1298-M1302 WeakPolarHBondContact O-CG 3.13Å; Y1298-M1302 PolarHBondContact O-N 2.95Å
1299	E	73	Confident	70	Confident	98 Å²	98	50.8 Å²	50.8	46%	0.458	25%	0.245	S	C	.	.	H	α-helix	trans	-64.6	-37.5	171.8	-71.5	176.9	165.2	0	0	112.1	I1251 S1295 I1296 M1302 T1303	I1251-E1299 HydrophobicContact CD1-CB 4.05Å; S1295-E1299 PolarHBondContact O-N 3.12Å; I1296-E1299 PolarHBondContact O-N 3.19Å; E1299-M1302 PolarHBondContact O-N 3.29Å; E1299-T1303 WeakPolarHBondContact O-CG2 3.16Å; E1299-T1303 PolarHBondContact O-N 3.11Å; E1299-T1303 PolarHBondContact O-OG1 2.93Å
1300	T	68.8	Low	70.1	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-64.3	-38.2	170.5	65.7	0	0	0	0	112.4	A1247 I1251 L1264 I1296 V1297 T1303 I1304	A1247-T1300 HydrophobicContact CB-CG2 4.27Å; I1251-T1300 HydrophobicContact CD1-CG2 3.87Å; I1251-T1300 HydrophobicContact CG1-CG2 4.4Å; L1264-T1300 HydrophobicContact CD1-CG2 4.06Å; L1264-T1300 HydrophobicContact CD2-CG2 4.1Å; L1264-T1300 HydrophobicContact CG-CG2 3.94Å; I1296-T1300 PolarHBondContact O-N 2.92Å; V1297-T1300 WeakPolarHBondContact CA-OG1 3.47Å; V1297-T1300 PolarHBondContact O-N 3.29Å; V1297-T1300 PolarHBondContact O-OG1 3.31Å; T1300-T1303 WeakPolarHBondContact CA-OG1 3.38Å; T1300-T1303 PolarHBondContact O-OG1 3.34Å; T1300-I1304 WeakPolarHBondContact O-CB 3.39Å; T1300-I1304 VanDerWaalsContact O-CD1 3.26Å; T1300-I1304 WeakPolarHBondContact O-CD1 3.43Å; T1300-I1304 WeakPolarHBondContact O-CG1 3.28Å; T1300-I1304 PolarHBondContact O-N 3.21Å
1301	E	73	Confident	69.8	Low	14 Å²	14	53.5 Å²	53.5	7%	0.065	26%	0.258	C	S	.	.	H	α-helix	trans	-63.1	-46.8	175.7	-170.1	-173.5	141.5	0	0	110.8	V1297 Y1298 T1305 L1333 K1337 R1340	V1297-E1301 PolarHBondContact O-N 3.24Å; Y1298-E1301 WeakPolarHBondContact O-CB 3.41Å; Y1298-E1301 PolarHBondContact O-N 3.37Å; E1301-T1305 WeakPolarHBondContact O-CG2 3.45Å; E1301-T1305 PolarHBondContact O-N 2.91Å; E1301-T1305 PolarHBondContact O-OG1 3.12Å; E1301-L1333 HydrophobicContact CG-CD1 4.03Å; E1301-K1337 HydrophobicContact CG-CG 4.23Å; E1301-K1337 WeakPolarHBondContact OE1-CE 3.13Å; E1301-K1337 WeakPolarHBondContact OE1-CG 3.28Å; E1301-R1340 IonicContact OE1-CZ 3.52Å; E1301-R1340 IonicContact OE1-NH2 2.67Å; E1301-R1340 PolarHBondContact OE1-NH2 3.03Å; E1301-R1340 IonicContact OE2-CZ 3.38Å; E1301-R1340 IonicContact OE2-NE 3.66Å; E1301-R1340 PolarHBondContact OE2-NE 2.94Å; E1301-R1340 IonicContact OE2-NH2 2.83Å; E1301-R1340 PolarHBondContact OE2-NH2 3.15Å
1302	M	77	Confident	69.1	Low	66 Å²	66	53.5 Å²	53.5	33%	0.325	26%	0.255	S	S	.	.	H	α-helix	trans	-61.9	-54	180	-74.9	-59.5	-54.7	0	0	112.1	Y1298 E1299 I1304 T1305 E1306	Y1298-M1302 HydrophobicContact CD1-CG 4.29Å; Y1298-M1302 HydrophobicContact CE1-CG 3.9Å; Y1298-M1302 HydrophobicContact CE1-SD 4.47Å; Y1298-M1302 WeakPolarHBondContact O-CG 3.13Å; Y1298-M1302 PolarHBondContact O-N 2.95Å; E1299-M1302 PolarHBondContact O-N 3.29Å; M1302-I1304 VanDerWaalsContact C-N 3.32Å; M1302-I1304 PolarHBondContact O-N 3.09Å; M1302-T1305 PolarHBondContact O-N 3.38Å; M1302-T1305 PolarHBondContact O-OG1 3.22Å; M1302-E1306 PolarHBondContact O-N 3.26Å
1303	T	74	Confident	68.2	Low	37 Å²	37	55.2 Å²	55.2	23%	0.227	26%	0.263	C	S	.	.	H	α-helix	trans	-58.5	-40.3	-179.6	45.7	0	0	0	0	112.7	I1251 E1299 T1300 E1306 W1307	I1251-T1303 HydrophobicContact CG2-CG2 4.41Å; E1299-T1303 WeakPolarHBondContact O-CG2 3.16Å; E1299-T1303 PolarHBondContact O-N 3.11Å; E1299-T1303 PolarHBondContact O-OG1 2.93Å; T1300-T1303 WeakPolarHBondContact CA-OG1 3.38Å; T1300-T1303 PolarHBondContact O-OG1 3.34Å; T1303-E1306 PolarHBondContact O-N 2.91Å; T1303-W1307 PolarHBondContact O-N 3.11Å; T1303-W1307 VanDerWaalsContact O-N 3.09Å
1304	I	70	Confident	66.9	Low	1 Å²	1	60.8 Å²	60.8	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-66.1	-41.1	173.9	-62	164.5	0	0	0	110.9	I1261 L1264 T1300 M1302 W1307 L1308 I1329 L1333	I1261-I1304 HydrophobicContact CG2-CG1 4.3Å; I1261-I1304 HydrophobicContact CG2-CG2 4.49Å; L1264-I1304 HydrophobicContact CD2-CD1 4.25Å; L1264-I1304 HydrophobicContact CD2-CG1 4Å; T1300-I1304 WeakPolarHBondContact O-CB 3.39Å; T1300-I1304 VanDerWaalsContact O-CD1 3.26Å; T1300-I1304 WeakPolarHBondContact O-CD1 3.43Å; T1300-I1304 WeakPolarHBondContact O-CG1 3.28Å; T1300-I1304 PolarHBondContact O-N 3.21Å; M1302-I1304 VanDerWaalsContact C-N 3.32Å; M1302-I1304 PolarHBondContact O-N 3.09Å; I1304-W1307 PolarHBondContact O-N 3.34Å; I1304-L1308 HydrophobicContact CG2-CD1 3.96Å; I1304-L1308 HydrophobicContact CG2-CG 4.33Å; I1304-L1308 WeakPolarHBondContact O-CB 3.29Å; I1304-L1308 VanDerWaalsContact O-CG 3.29Å; I1304-L1308 WeakPolarHBondContact O-CG 3.16Å; I1304-L1308 PolarHBondContact O-N 3.12Å; I1304-I1329 HydrophobicContact CG2-CG2 3.37Å; I1304-L1333 HydrophobicContact CB-CD1 3.71Å; I1304-L1333 HydrophobicContact CD1-CD1 4.39Å; I1304-L1333 HydrophobicContact CG2-CD1 3.63Å
1305	T	72.5	Confident	65.7	Low	24 Å²	24	62 Å²	62	15%	0.147	30%	0.303	C	S	.	.	H	α-helix	trans	-69.9	-29.9	178.3	59.3	0	0	0	0	114.4	E1301 M1302 K1309 L1333	E1301-T1305 WeakPolarHBondContact O-CG2 3.45Å; E1301-T1305 PolarHBondContact O-N 2.91Å; E1301-T1305 PolarHBondContact O-OG1 3.12Å; M1302-T1305 PolarHBondContact O-N 3.38Å; M1302-T1305 PolarHBondContact O-OG1 3.22Å; T1305-K1309 WeakPolarHBondContact O-CG 3.43Å; T1305-K1309 PolarHBondContact O-N 3.41Å; T1305-L1333 HydrophobicContact CG2-CD1 3.92Å; T1305-L1333 HydrophobicContact CG2-CD2 3.72Å; T1305-L1333 HydrophobicContact CG2-CG 4.45Å
1306	E	75.7	Confident	64.2	Low	104 Å²	104	67.1 Å²	67.1	49%	0.486	33%	0.326	S	S	.	.	H	α-helix	trans	-69.1	-48.6	173.2	-72.8	-180	163.1	0	0	110.2	M1302 T1303 L1308 K1309 E1310	M1302-E1306 PolarHBondContact O-N 3.26Å; T1303-E1306 PolarHBondContact O-N 2.91Å; E1306-L1308 VanDerWaalsContact C-N 3.32Å; E1306-L1308 PolarHBondContact O-N 3.15Å; E1306-K1309 WeakPolarHBondContact O-CB 3.46Å; E1306-K1309 PolarHBondContact O-N 2.84Å; E1306-E1310 PolarHBondContact O-N 3.47Å
1307	W	72	Confident	62.7	Low	45 Å²	45	71.6 Å²	71.6	17%	0.17	36%	0.357	C	S	.	.	H	α-helix	trans	-59.3	-40.6	175.1	-175.4	82.1	0	0	0	113	K1258 I1261 T1303 I1304 K1309 E1310 S1311 E1326 I1329	K1258-W1307 HydrophobicContact CD-CH2 4.16Å; K1258-W1307 HydrophobicContact CD-CZ2 4.18Å; K1258-W1307 HydrophobicContact CG-CH2 4.09Å; K1258-W1307 HydrophobicContact CG-CZ2 3.78Å; I1261-W1307 HydrophobicContact CD1-CB 3.94Å; I1261-W1307 HydrophobicContact CD1-CD2 3.38Å; I1261-W1307 HydrophobicContact CD1-CE3 4.1Å; I1261-W1307 HydrophobicContact CD1-CG 3.25Å; I1261-W1307 HydrophobicContact CD1-CZ2 4.4Å; I1261-W1307 HydrophobicContact CG2-CD2 4.48Å; I1261-W1307 HydrophobicContact CG2-CE3 4.19Å; T1303-W1307 PolarHBondContact O-N 3.11Å; T1303-W1307 VanDerWaalsContact O-N 3.09Å; I1304-W1307 PolarHBondContact O-N 3.34Å; W1307-K1309 VanDerWaalsContact C-N 3.25Å; W1307-K1309 PolarHBondContact O-N 3.09Å; W1307-E1310 PolarHBondContact O-N 3.47Å; W1307-S1311 WeakPolarHBondContact O-CB 3.22Å; W1307-S1311 PolarHBondContact O-N 2.92Å; W1307-S1311 PolarHBondContact O-OG 3.4Å; W1307-E1326 HydrophobicContact CH2-CG 4.25Å; W1307-E1326 HydrophobicContact CZ3-CG 4.26Å; W1307-I1329 HydrophobicContact CH2-CD1 4.38Å; W1307-I1329 HydrophobicContact CZ3-CD1 3.86Å
1308	L	67.2	Low	61.5	Low	9 Å²	9	76.8 Å²	76.8	5%	0.047	39%	0.385	C	S	.	.	H	α-helix	trans	-63.8	-28.5	176.3	-75.9	172	0	0	0	113.1	I1304 E1306 S1311 F1312 I1329 F1330	I1304-L1308 HydrophobicContact CG2-CD1 3.96Å; I1304-L1308 HydrophobicContact CG2-CG 4.33Å; I1304-L1308 WeakPolarHBondContact O-CB 3.29Å; I1304-L1308 VanDerWaalsContact O-CG 3.29Å; I1304-L1308 WeakPolarHBondContact O-CG 3.16Å; I1304-L1308 PolarHBondContact O-N 3.12Å; E1306-L1308 VanDerWaalsContact C-N 3.32Å; E1306-L1308 PolarHBondContact O-N 3.15Å; L1308-S1311 WeakPolarHBondContact CA-OG 3.42Å; L1308-S1311 PolarHBondContact O-OG 3.09Å; L1308-F1312 WeakPolarHBondContact O-CB 3.28Å; L1308-F1312 PolarHBondContact O-N 3.35Å; L1308-I1329 HydrophobicContact CD1-CG2 4.23Å; L1308-I1329 HydrophobicContact CD2-CG2 4.22Å; L1308-I1329 HydrophobicContact CG-CG2 4.37Å; L1308-F1330 HydrophobicContact CB-CE2 4.44Å; L1308-F1330 HydrophobicContact CD1-CD2 3.88Å; L1308-F1330 HydrophobicContact CD1-CE1 4.44Å; L1308-F1330 HydrophobicContact CD1-CE2 3.8Å; L1308-F1330 HydrophobicContact CD1-CG 4.25Å; L1308-F1330 HydrophobicContact CD1-CZ 4.09Å; L1308-F1330 HydrophobicContact CD2-CD2 3.82Å; L1308-F1330 HydrophobicContact CD2-CE2 3.78Å; L1308-F1330 HydrophobicContact CG-CD2 4.47Å; L1308-F1330 HydrophobicContact CG-CE2 4.23Å
1309	K	69.9	Low	60.6	Low	135 Å²	135	75.1 Å²	75.1	59%	0.587	39%	0.386	S	S	*	.	H	α-helix	trans	-74.5	-42.6	173	-71	165.3	-176.2	169.4	0	111.3	T1305 E1306 W1307 F1312 I1313	T1305-K1309 WeakPolarHBondContact O-CG 3.43Å; T1305-K1309 PolarHBondContact O-N 3.41Å; E1306-K1309 WeakPolarHBondContact O-CB 3.46Å; E1306-K1309 PolarHBondContact O-N 2.84Å; W1307-K1309 VanDerWaalsContact C-N 3.25Å; W1307-K1309 PolarHBondContact O-N 3.09Å; K1309-F1312 PolarHBondContact O-N 3.48Å; K1309-I1313 WeakPolarHBondContact O-CG1 3.38Å; K1309-I1313 PolarHBondContact O-N 2.89Å
1310	E	63.4	Low	59.7	Low	127 Å²	127	78.2 Å²	78.2	59%	0.593	40%	0.401	S	S	*	.	H	α-helix	trans	-67.6	-41.9	177.7	-67.1	-171.7	155.2	0	0	112.2	E1306 W1307 F1312 I1313 L1314	E1306-E1310 PolarHBondContact O-N 3.47Å; W1307-E1310 PolarHBondContact O-N 3.47Å; E1310-F1312 VanDerWaalsContact C-N 3.31Å; E1310-F1312 PolarHBondContact O-N 3.3Å; E1310-I1313 WeakPolarHBondContact O-CB 3.48Å; E1310-I1313 PolarHBondContact O-N 2.92Å; E1310-I1313 VanDerWaalsContact O-N 3.13Å; E1310-L1314 PolarHBondContact O-N 2.97Å
1311	S	57.5	Low	59	Low	8 Å²	8	85.7 Å²	85.7	6%	0.056	44%	0.435	C	S	.	.	H	α-helix	trans	-63.3	-37.9	176.8	67	0	0	0	0	111.5	W1307 L1308 I1313 L1314 T1315	W1307-S1311 WeakPolarHBondContact O-CB 3.22Å; W1307-S1311 PolarHBondContact O-N 2.92Å; W1307-S1311 PolarHBondContact O-OG 3.4Å; L1308-S1311 WeakPolarHBondContact CA-OG 3.42Å; L1308-S1311 PolarHBondContact O-OG 3.09Å; S1311-I1313 PolarHBondContact O-N 3.42Å; S1311-L1314 CarbonylContact O-C 3.59Å; S1311-L1314 WeakPolarHBondContact O-CA 3.42Å; S1311-L1314 PolarHBondContact O-N 3.47Å; S1311-T1315 WeakPolarHBondContact O-CG2 3.34Å; S1311-T1315 PolarHBondContact O-N 2.91Å; S1311-T1315 PolarHBondContact O-OG1 3.41Å
1312	F	51.7	Low	58.3	Low	117 Å²	117	87.5 Å²	87.5	51%	0.513	45%	0.446	S	S	.	.	H	α-helix	trans	-60	-28.1	174.6	-115.8	-88.5	0	0	0	114.1	L1308 K1309 E1310 T1315 F1330 F1372	L1308-F1312 WeakPolarHBondContact O-CB 3.28Å; L1308-F1312 PolarHBondContact O-N 3.35Å; K1309-F1312 PolarHBondContact O-N 3.48Å; E1310-F1312 VanDerWaalsContact C-N 3.31Å; E1310-F1312 PolarHBondContact O-N 3.3Å; F1312-T1315 WeakPolarHBondContact CA-OG1 3.42Å; F1312-T1315 PolarHBondContact O-OG1 3.15Å; F1312-F1330 HydrophobicContact CE2-CE2 4.46Å; F1312-F1372 AromaticContact CE2-CE1 3.54Å; F1312-F1372 HydrophobicContact CE2-CE1 3.54Å; F1312-F1372 AromaticContact CE2-CZ 3.52Å; F1312-F1372 HydrophobicContact CE2-CZ 3.52Å; F1312-F1372 AromaticContact CZ-CE1 3.51Å; F1312-F1372 HydrophobicContact CZ-CE1 3.51Å; F1312-F1372 AromaticContact CZ-CZ 3.48Å; F1312-F1372 HydrophobicContact CZ-CZ 3.48Å; F1312-F1372 VanDerWaalsContact CZ-CZ 3.48Å
1313	I	48.2	Very low	57.6	Low	141 Å²	141	91 Å²	91	72%	0.723	46%	0.455	S	S	*	.	H	α-helix	trans	-79.3	-23.4	175.7	-63.2	166.5	0	0	0	110.8	K1309 E1310 S1311	K1309-I1313 WeakPolarHBondContact O-CG1 3.38Å; K1309-I1313 PolarHBondContact O-N 2.89Å; E1310-I1313 WeakPolarHBondContact O-CB 3.48Å; E1310-I1313 PolarHBondContact O-N 2.92Å; E1310-I1313 VanDerWaalsContact O-N 3.13Å; S1311-I1313 PolarHBondContact O-N 3.42Å
1314	L	41.2	Very low	56.8	Low	139 Å²	139	93.5 Å²	93.5	73%	0.728	47%	0.467	S	S	*	.	H	α-helix	trans	-97	-18.7	-178.3	-71.5	163.6	0	0	0	114.3	E1310 S1311 L1316	E1310-L1314 PolarHBondContact O-N 2.97Å; S1311-L1314 CarbonylContact O-C 3.59Å; S1311-L1314 WeakPolarHBondContact O-CA 3.42Å; S1311-L1314 PolarHBondContact O-N 3.47Å; L1314-L1316 PolarHBondContact O-N 3Å
1315	T	41.8	Very low	56.4	Low	55 Å²	55	95.2 Å²	95.2	34%	0.337	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	59.8	-178.3	46.8	0	0	0	0	113.7	S1311 F1312	S1311-T1315 WeakPolarHBondContact O-CG2 3.34Å; S1311-T1315 PolarHBondContact O-N 2.91Å; S1311-T1315 PolarHBondContact O-OG1 3.41Å; F1312-T1315 WeakPolarHBondContact CA-OG1 3.42Å; F1312-T1315 PolarHBondContact O-OG1 3.15Å
1316	L	41.6	Very low	55.9	Low	165 Å²	165	95.1 Å²	95.1	86%	0.864	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	-2.4	162.1	-91.1	162.8	0	0	0	112.9	L1314	L1314-L1316 PolarHBondContact O-N 3Å
1317	C	36.3	Very low	55.4	Low	109 Å²	109	95.7 Å²	95.7	74%	0.736	47%	0.473	S	S	*	.	S	Bend	trans	-117.8	101.3	178.8	-69.8	0	0	0	0	110.8
1318	D	42.6	Very low	54.8	Low	109 Å²	109	98.8 Å²	98.8	58%	0.583	49%	0.485	S	S	*	.			trans	-75.1	125.9	-174.9	-87.8	-35.2	0	0	0	114.2	R1323	D1318-R1323 IonicContact OD1-CZ 2.85Å; D1318-R1323 IonicContact OD1-NE 2.82Å; D1318-R1323 PolarHBondContact OD1-NE 3.07Å; D1318-R1323 IonicContact OD1-NH2 3.16Å; D1318-R1323 PolarHBondContact OD1-NH2 3.37Å; D1318-R1323 IonicContact OD2-CZ 3.73Å; D1318-R1323 IonicContact OD2-NH2 3.95Å; D1318-R1323 PolarHBondContact OD2-NH2 2.85Å
1319	T	55.6	Low	54.7	Low	74 Å²	74	98.3 Å²	98.3	45%	0.454	48%	0.482	S	S	.	.			trans	-136.2	143.2	152.7	63	0	0	0	0	109.5	E1321 N1322 R1323	T1319-E1321 VanDerWaalsContact C-N 3.3Å; T1319-E1321 PolarHBondContact O-N 2.94Å; T1319-N1322 WeakPolarHBondContact O-CB 3.48Å; T1319-N1322 PolarHBondContact O-N 3.49Å; T1319-N1322 PolarHBondContact OG1-ND2 3.14Å; T1319-R1323 PolarHBondContact O-N 3.02Å
1320	E	54.4	Low	54.5	Low	164 Å²	164	94.5 Å²	94.5	77%	0.766	47%	0.466	S	S	*	.	H	α-helix	trans	-64.2	-32.9	-174.5	-67.1	-163	135.4	0	0	113.4	N1322 R1323 L1324	E1320-N1322 VanDerWaalsContact C-N 3.31Å; E1320-N1322 PolarHBondContact O-N 3.27Å; E1320-R1323 PolarHBondContact O-N 3.45Å; E1320-L1324 WeakPolarHBondContact O-CB 3.18Å; E1320-L1324 PolarHBondContact O-N 3.48Å
1321	E	52.9	Low	54.5	Low	156 Å²	156	90.3 Å²	90.3	73%	0.729	45%	0.449	S	S	*	.	H	α-helix	trans	-63	-35.1	176.2	-66.4	-175.5	148.7	0	0	112.6	T1319 L1324 T1325	T1319-E1321 VanDerWaalsContact C-N 3.3Å; T1319-E1321 PolarHBondContact O-N 2.94Å; E1321-L1324 PolarHBondContact O-N 3.28Å; E1321-T1325 PolarHBondContact O-N 3.44Å; E1321-T1325 PolarHBondContact O-OG1 3.05Å
1322	N	59.3	Low	54.7	Low	53 Å²	53	90.1 Å²	90.1	28%	0.283	45%	0.448	S	S	.	.	H	α-helix	trans	-65.8	-45.5	174.6	-81.2	-34.9	0	0	0	110.9	K1258 T1319 E1320 L1324 T1325 E1326	K1258-N1322 VanDerWaalsContact NZ-CG 3.3Å; K1258-N1322 PolarHBondContact NZ-OD1 3.33Å; T1319-N1322 WeakPolarHBondContact O-CB 3.48Å; T1319-N1322 PolarHBondContact O-N 3.49Å; T1319-N1322 PolarHBondContact OG1-ND2 3.14Å; E1320-N1322 VanDerWaalsContact C-N 3.31Å; E1320-N1322 PolarHBondContact O-N 3.27Å; N1322-L1324 VanDerWaalsContact C-N 3.32Å; N1322-L1324 PolarHBondContact O-N 3.29Å; N1322-T1325 WeakPolarHBondContact CA-OG1 3.21Å; N1322-T1325 PolarHBondContact O-N 3.31Å; N1322-T1325 PolarHBondContact O-OG1 2.84Å; N1322-E1326 WeakPolarHBondContact O-CB 3.27Å; N1322-E1326 WeakPolarHBondContact O-CG 3.43Å; N1322-E1326 PolarHBondContact O-N 3.49Å
1323	R	61.4	Low	55.6	Low	138 Å²	138	84.8 Å²	84.8	52%	0.521	43%	0.425	S	S	.	.	H	α-helix	trans	-64.3	-34.9	175.5	-66.1	-178.9	176.9	-170.3	-5	112.5	D1318 T1319 E1320 R1327	D1318-R1323 IonicContact OD1-CZ 2.85Å; D1318-R1323 IonicContact OD1-NE 2.82Å; D1318-R1323 PolarHBondContact OD1-NE 3.07Å; D1318-R1323 IonicContact OD1-NH2 3.16Å; D1318-R1323 PolarHBondContact OD1-NH2 3.37Å; D1318-R1323 IonicContact OD2-CZ 3.73Å; D1318-R1323 IonicContact OD2-NH2 3.95Å; D1318-R1323 PolarHBondContact OD2-NH2 2.85Å; T1319-R1323 PolarHBondContact O-N 3.02Å; E1320-R1323 PolarHBondContact O-N 3.45Å; R1323-R1327 WeakPolarHBondContact O-CB 3.31Å; R1323-R1327 WeakPolarHBondContact O-CG 3.4Å; R1323-R1327 PolarHBondContact O-N 3.1Å
1324	L	58.4	Low	56.4	Low	90 Å²	90	78.5 Å²	78.5	47%	0.471	39%	0.394	S	S	.	.	H	α-helix	trans	-69.9	-41.1	175.9	-89	162.5	0	0	0	112.9	E1320 E1321 N1322 R1328	E1320-L1324 WeakPolarHBondContact O-CB 3.18Å; E1320-L1324 PolarHBondContact O-N 3.48Å; E1321-L1324 PolarHBondContact O-N 3.28Å; N1322-L1324 VanDerWaalsContact C-N 3.32Å; N1322-L1324 PolarHBondContact O-N 3.29Å; L1324-R1328 WeakPolarHBondContact O-CG 3.32Å; L1324-R1328 PolarHBondContact O-N 3.22Å
1325	T	60.1	Low	57.5	Low	37 Å²	37	72.2 Å²	72.2	23%	0.227	36%	0.36	C	S	.	.	H	α-helix	trans	-69.8	-43.2	176.6	44.2	0	0	0	0	111.7	E1321 N1322 R1327 R1328 I1329	E1321-T1325 PolarHBondContact O-N 3.44Å; E1321-T1325 PolarHBondContact O-OG1 3.05Å; N1322-T1325 WeakPolarHBondContact CA-OG1 3.21Å; N1322-T1325 PolarHBondContact O-N 3.31Å; N1322-T1325 PolarHBondContact O-OG1 2.84Å; T1325-R1327 VanDerWaalsContact C-N 3.35Å; T1325-R1327 PolarHBondContact O-N 3.36Å; T1325-R1328 PolarHBondContact O-N 3.48Å; T1325-R1328 VanDerWaalsContact O-N 3.14Å; T1325-I1329 WeakPolarHBondContact O-CG1 3.47Å; T1325-I1329 PolarHBondContact O-N 2.88Å
1326	E	63.9	Low	58.6	Low	23 Å²	23	69.6 Å²	69.6	11%	0.107	34%	0.344	C	S	.	.	H	α-helix	trans	-60.6	-41	173	-77.4	154.8	-151.2	0	0	112.1	K1258 W1307 N1322 I1329 F1330	K1258-E1326 IonicContact NZ-OE1 2.67Å; K1258-E1326 PolarHBondContact NZ-OE1 3.04Å; W1307-E1326 HydrophobicContact CH2-CG 4.25Å; W1307-E1326 HydrophobicContact CZ3-CG 4.26Å; N1322-E1326 WeakPolarHBondContact O-CB 3.27Å; N1322-E1326 WeakPolarHBondContact O-CG 3.43Å; N1322-E1326 PolarHBondContact O-N 3.49Å; E1326-I1329 PolarHBondContact O-N 2.66Å; E1326-F1330 WeakPolarHBondContact O-CB 3.25Å; E1326-F1330 PolarHBondContact O-N 2.97Å
1327	R	63.8	Low	60	Low	115 Å²	115	63.9 Å²	63.9	43%	0.434	31%	0.312	S	S	.	.	H	α-helix	trans	-59.2	-45	171	-84.5	178	169.8	166.7	0.7	112.8	R1323 T1325 I1329 F1330 T1331 N1373	R1323-R1327 WeakPolarHBondContact O-CB 3.31Å; R1323-R1327 WeakPolarHBondContact O-CG 3.4Å; R1323-R1327 PolarHBondContact O-N 3.1Å; T1325-R1327 VanDerWaalsContact C-N 3.35Å; T1325-R1327 PolarHBondContact O-N 3.36Å; R1327-I1329 PolarHBondContact O-N 3.19Å; R1327-F1330 PolarHBondContact O-N 2.85Å; R1327-T1331 PolarHBondContact O-N 2.95Å; R1327-T1331 PolarHBondContact O-OG1 2.88Å; R1327-T1331 VanDerWaalsContact O-OG1 3.08Å; R1327-N1373 PolarHBondContact NE-OD1 3.27Å
1328	R	60.4	Low	61.7	Low	110 Å²	110	58.7 Å²	58.7	42%	0.415	28%	0.277	S	S	.	.	H	α-helix	trans	-60.9	-43.9	177.3	-76.1	178.1	173.1	-177.2	-1.7	111.6	L1262 L1324 T1325 T1331 A1332	L1262-R1328 HydrophobicContact CD1-CB 3.69Å; L1324-R1328 WeakPolarHBondContact O-CG 3.32Å; L1324-R1328 PolarHBondContact O-N 3.22Å; T1325-R1328 PolarHBondContact O-N 3.48Å; T1325-R1328 VanDerWaalsContact O-N 3.14Å; R1328-T1331 PolarHBondContact O-N 2.76Å; R1328-A1332 WeakPolarHBondContact O-CB 3.49Å; R1328-A1332 PolarHBondContact O-N 2.86Å
1329	I	64.4	Low	62.7	Low	0 Å²	0	54 Å²	54	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.2	-46.6	177.4	-65.4	164.3	0	0	0	110.7	I1261 L1262 I1304 W1307 L1308 T1325 E1326 R1327 T1331 A1332 L1333	I1261-I1329 HydrophobicContact CB-CD1 4.49Å; I1261-I1329 HydrophobicContact CG2-CD1 3.96Å; I1261-I1329 HydrophobicContact CG2-CG1 4.45Å; I1261-I1329 HydrophobicContact CG2-CG2 4.22Å; L1262-I1329 HydrophobicContact CD1-CG1 3.95Å; I1304-I1329 HydrophobicContact CG2-CG2 3.37Å; W1307-I1329 HydrophobicContact CH2-CD1 4.38Å; W1307-I1329 HydrophobicContact CZ3-CD1 3.86Å; L1308-I1329 HydrophobicContact CD1-CG2 4.23Å; L1308-I1329 HydrophobicContact CD2-CG2 4.22Å; L1308-I1329 HydrophobicContact CG-CG2 4.37Å; T1325-I1329 WeakPolarHBondContact O-CG1 3.47Å; T1325-I1329 PolarHBondContact O-N 2.88Å; E1326-I1329 PolarHBondContact O-N 2.66Å; R1327-I1329 PolarHBondContact O-N 3.19Å; I1329-T1331 PolarHBondContact O-N 3.24Å; I1329-A1332 PolarHBondContact O-N 3.23Å; I1329-L1333 WeakPolarHBondContact O-CB 3.31Å; I1329-L1333 PolarHBondContact O-N 3.4Å
1330	F	66.4	Low	63.5	Low	55 Å²	55	53.5 Å²	53.5	24%	0.241	24%	0.242	C	C	.	.	H	α-helix	trans	-60.7	-43.9	176.9	-109	-76.7	0	0	0	112.7	L1308 F1312 E1326 R1327 L1333 A1334 F1372	L1308-F1330 HydrophobicContact CB-CE2 4.44Å; L1308-F1330 HydrophobicContact CD1-CD2 3.88Å; L1308-F1330 HydrophobicContact CD1-CE1 4.44Å; L1308-F1330 HydrophobicContact CD1-CE2 3.8Å; L1308-F1330 HydrophobicContact CD1-CG 4.25Å; L1308-F1330 HydrophobicContact CD1-CZ 4.09Å; L1308-F1330 HydrophobicContact CD2-CD2 3.82Å; L1308-F1330 HydrophobicContact CD2-CE2 3.78Å; L1308-F1330 HydrophobicContact CG-CD2 4.47Å; L1308-F1330 HydrophobicContact CG-CE2 4.23Å; F1312-F1330 HydrophobicContact CE2-CE2 4.46Å; E1326-F1330 WeakPolarHBondContact O-CB 3.25Å; E1326-F1330 PolarHBondContact O-N 2.97Å; R1327-F1330 PolarHBondContact O-N 2.85Å; F1330-L1333 PolarHBondContact O-N 3.36Å; F1330-A1334 WeakPolarHBondContact O-CB 3.15Å; F1330-A1334 PolarHBondContact O-N 3.12Å; F1330-F1372 HydrophobicContact CD2-CE1 4.37Å; F1330-F1372 HydrophobicContact CE1-CD2 4.41Å; F1330-F1372 HydrophobicContact CE1-CE2 4.17Å; F1330-F1372 HydrophobicContact CE1-CZ 4.38Å; F1330-F1372 HydrophobicContact CE2-CD1 4.41Å; F1330-F1372 AromaticContact CE2-CE1 3.84Å; F1330-F1372 HydrophobicContact CE2-CE1 3.84Å; F1330-F1372 HydrophobicContact CE2-CE2 4.45Å; F1330-F1372 AromaticContact CE2-CZ 3.86Å; F1330-F1372 HydrophobicContact CE2-CZ 3.86Å; F1330-F1372 HydrophobicContact CZ-CD2 4.46Å; F1330-F1372 HydrophobicContact CZ-CE1 4.09Å; F1330-F1372 AromaticContact CZ-CE2 3.87Å; F1330-F1372 HydrophobicContact CZ-CE2 3.87Å; F1330-F1372 AromaticContact CZ-CZ 3.66Å; F1330-F1372 HydrophobicContact CZ-CZ 3.66Å
1331	T	63.3	Low	64.3	Low	39 Å²	39	46.3 Å²	46.3	24%	0.239	21%	0.208	C	C	.	.	H	α-helix	trans	-63.3	-45.8	176.8	-60.9	0	0	0	0	111.1	R1327 R1328 I1329 L1333 A1334 Y1335	R1327-T1331 PolarHBondContact O-N 2.95Å; R1327-T1331 PolarHBondContact O-OG1 2.88Å; R1327-T1331 VanDerWaalsContact O-OG1 3.08Å; R1328-T1331 PolarHBondContact O-N 2.76Å; I1329-T1331 PolarHBondContact O-N 3.24Å; T1331-L1333 PolarHBondContact O-N 3.22Å; T1331-A1334 WeakPolarHBondContact O-CB 3.1Å; T1331-A1334 PolarHBondContact O-N 3.36Å; T1331-Y1335 HydrophobicContact CG2-CD2 3.95Å; T1331-Y1335 HydrophobicContact CG2-CE2 3.63Å; T1331-Y1335 VanDerWaalsContact O-CD2 3.26Å; T1331-Y1335 WeakPolarHBondContact O-CD2 3.34Å; T1331-Y1335 PolarHBondContact O-N 3.44Å
1332	A	61.6	Low	64.9	Low	4 Å²	4	39.6 Å²	39.6	3%	0.033	18%	0.177	C	C	.	.	H	α-helix	trans	-61.5	-43	176.8	0	0	0	0	0	112.3	R1328 I1329 A1334 Y1335 I1336	R1328-A1332 WeakPolarHBondContact O-CB 3.49Å; R1328-A1332 PolarHBondContact O-N 2.86Å; I1329-A1332 PolarHBondContact O-N 3.23Å; A1332-A1334 VanDerWaalsContact C-N 3.32Å; A1332-A1334 PolarHBondContact O-N 3.16Å; A1332-Y1335 PolarHBondContact O-N 3.25Å; A1332-I1336 WeakPolarHBondContact O-CG1 3.45Å; A1332-I1336 PolarHBondContact O-N 2.84Å
1333	L	69.7	Low	65.2	Low	5 Å²	5	37.8 Å²	37.8	3%	0.026	17%	0.168	C	C	.	.	H	α-helix	trans	-60.5	-40.1	174.1	-170.6	100.7	0	0	0	111.9	E1301 I1304 T1305 I1329 F1330 T1331 I1336 K1337	E1301-L1333 HydrophobicContact CG-CD1 4.03Å; I1304-L1333 HydrophobicContact CB-CD1 3.71Å; I1304-L1333 HydrophobicContact CD1-CD1 4.39Å; I1304-L1333 HydrophobicContact CG2-CD1 3.63Å; T1305-L1333 HydrophobicContact CG2-CD1 3.92Å; T1305-L1333 HydrophobicContact CG2-CD2 3.72Å; T1305-L1333 HydrophobicContact CG2-CG 4.45Å; I1329-L1333 WeakPolarHBondContact O-CB 3.31Å; I1329-L1333 PolarHBondContact O-N 3.4Å; F1330-L1333 PolarHBondContact O-N 3.36Å; T1331-L1333 PolarHBondContact O-N 3.22Å; L1333-I1336 PolarHBondContact O-N 3.33Å; L1333-K1337 HydrophobicContact CD2-CD 4.35Å; L1333-K1337 PolarHBondContact O-N 2.96Å
1334	A	64.8	Low	65.4	Low	9 Å²	9	33.2 Å²	33.2	7%	0.074	16%	0.156	C	C	.	.	H	α-helix	trans	-63.3	-42.3	176.2	0	0	0	0	0	112	F1330 T1331 A1332 K1337 M1338 I1369 L1381	F1330-A1334 WeakPolarHBondContact O-CB 3.15Å; F1330-A1334 PolarHBondContact O-N 3.12Å; T1331-A1334 WeakPolarHBondContact O-CB 3.1Å; T1331-A1334 PolarHBondContact O-N 3.36Å; A1332-A1334 VanDerWaalsContact C-N 3.32Å; A1332-A1334 PolarHBondContact O-N 3.16Å; A1334-K1337 PolarHBondContact O-N 3.15Å; A1334-M1338 WeakPolarHBondContact O-CG 3.49Å; A1334-M1338 PolarHBondContact O-N 2.89Å; A1334-I1369 HydrophobicContact CB-CD1 4.11Å; A1334-I1369 HydrophobicContact CB-CG1 4.31Å; A1334-L1381 HydrophobicContact CB-CD1 3.74Å; A1334-L1381 HydrophobicContact CB-CD2 4.18Å
1335	Y	63.9	Low	65.7	Low	7 Å²	7	29.2 Å²	29.2	3%	0.027	13%	0.134	C	C	.	.	H	α-helix	trans	-63.7	-42.4	174	-80.1	-78.3	0	0	0	111.6	L1269 T1331 A1332 K1337 M1338 Y1339 D1378 T1380 L1381 I1384 T1535	L1269-Y1335 VanDerWaalsContact CD1-CB 3.48Å; L1269-Y1335 HydrophobicContact CD1-CG 4.29Å; T1331-Y1335 HydrophobicContact CG2-CD2 3.95Å; T1331-Y1335 HydrophobicContact CG2-CE2 3.63Å; T1331-Y1335 VanDerWaalsContact O-CD2 3.26Å; T1331-Y1335 WeakPolarHBondContact O-CD2 3.34Å; T1331-Y1335 PolarHBondContact O-N 3.44Å; A1332-Y1335 PolarHBondContact O-N 3.25Å; Y1335-K1337 PolarHBondContact O-N 2.91Å; Y1335-M1338 PolarHBondContact O-N 2.94Å; Y1335-Y1339 AromaticContact CD1-CE2 3.73Å; Y1335-Y1339 HydrophobicContact CD1-CE2 3.73Å; Y1335-Y1339 HydrophobicContact CG-CE2 4.37Å; Y1335-Y1339 WeakPolarHBondContact O-CD2 3.22Å; Y1335-Y1339 PolarHBondContact O-N 3.41Å; Y1335-D1378 WeakPolarHBondContact CE2-OD2 3.18Å; Y1335-D1378 PolarHBondContact OH-OD2 3.37Å; Y1335-T1380 PolarHBondContact OH-OG1 3.09Å; Y1335-L1381 HydrophobicContact CD1-CD1 3.68Å; Y1335-L1381 HydrophobicContact CD1-CG 4.48Å; Y1335-L1381 HydrophobicContact CD2-CD1 3.53Å; Y1335-L1381 HydrophobicContact CE1-CB 4.13Å; Y1335-L1381 HydrophobicContact CE1-CD1 3.78Å; Y1335-L1381 HydrophobicContact CE1-CG 4.27Å; Y1335-L1381 HydrophobicContact CE2-CB 4.36Å; Y1335-L1381 HydrophobicContact CE2-CD1 3.6Å; Y1335-L1381 HydrophobicContact CG-CD1 3.52Å; Y1335-I1384 HydrophobicContact CD1-CD1 4.28Å; Y1335-I1384 HydrophobicContact CE1-CD1 3.81Å; Y1335-T1535 HydrophobicContact CE2-CG2 4.47Å; Y1335-T1535 PolarHBondContact OH-OG1 2.99Å
1336	I	66.5	Low	65.5	Low	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-57	-49.3	175.7	-69.6	166.3	0	0	0	110.6	L1269 V1297 A1332 L1333 M1338 Y1339 R1340	L1269-I1336 HydrophobicContact CB-CG1 4.14Å; V1297-I1336 HydrophobicContact CG1-CG2 3.69Å; A1332-I1336 WeakPolarHBondContact O-CG1 3.45Å; A1332-I1336 PolarHBondContact O-N 2.84Å; L1333-I1336 PolarHBondContact O-N 3.33Å; I1336-M1338 PolarHBondContact O-N 3.33Å; I1336-Y1339 PolarHBondContact O-N 3.25Å; I1336-R1340 VanDerWaalsContact O-CB 3.27Å; I1336-R1340 WeakPolarHBondContact O-CB 3.41Å; I1336-R1340 PolarHBondContact O-N 3.35Å
1337	K	71.4	Confident	65	Low	44 Å²	44	33.6 Å²	33.6	19%	0.191	17%	0.168	C	C	.	.	H	α-helix	trans	-58.8	-48	177	-77.3	178.1	175.1	179.5	0	112.3	E1301 L1333 A1334 Y1335 R1340 L1341 T1365	E1301-K1337 HydrophobicContact CG-CG 4.23Å; E1301-K1337 WeakPolarHBondContact OE1-CE 3.13Å; E1301-K1337 WeakPolarHBondContact OE1-CG 3.28Å; L1333-K1337 HydrophobicContact CD2-CD 4.35Å; L1333-K1337 PolarHBondContact O-N 2.96Å; A1334-K1337 PolarHBondContact O-N 3.15Å; Y1335-K1337 PolarHBondContact O-N 2.91Å; K1337-R1340 PolarHBondContact O-N 3.18Å; K1337-L1341 WeakPolarHBondContact O-CB 3.39Å; K1337-L1341 WeakPolarHBondContact O-CD1 3.37Å; K1337-L1341 VanDerWaalsContact O-CG 3.31Å; K1337-L1341 WeakPolarHBondContact O-CG 3.47Å; K1337-L1341 PolarHBondContact O-N 3Å; K1337-T1365 HydrophobicContact CB-CG2 4.28Å; K1337-T1365 HydrophobicContact CD-CG2 3.74Å
1338	M	70.2	Confident	64.3	Low	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.5	-45.3	-179.8	-72.9	-65.1	-176.3	0	0	112.4	A1334 Y1335 I1336 L1341 E1342 I1362 T1365 I1366 L1381 I1384 L1388	A1334-M1338 WeakPolarHBondContact O-CG 3.49Å; A1334-M1338 PolarHBondContact O-N 2.89Å; Y1335-M1338 PolarHBondContact O-N 2.94Å; I1336-M1338 PolarHBondContact O-N 3.33Å; M1338-L1341 PolarHBondContact O-N 3.48Å; M1338-E1342 PolarHBondContact O-N 2.91Å; M1338-I1362 HydrophobicContact CE-CG2 4.19Å; M1338-I1362 HydrophobicContact SD-CG2 4.36Å; M1338-T1365 VanDerWaalsContact CE-OG1 3.26Å; M1338-T1365 WeakPolarHBondContact CE-OG1 3.46Å; M1338-I1366 HydrophobicContact CE-CD1 4.48Å; M1338-I1366 HydrophobicContact CE-CG1 3.89Å; M1338-L1381 HydrophobicContact CE-CD2 4.17Å; M1338-L1381 HydrophobicContact CG-CD2 4.19Å; M1338-L1381 HydrophobicContact CG-CG 4.31Å; M1338-I1384 HydrophobicContact CB-CG2 4.17Å; M1338-L1388 HydrophobicContact CB-CD1 4.43Å; M1338-L1388 WeakPolarHBondContact O-CD1 3.44Å; M1338-L1388 HydrophobicContact SD-CD1 4.05Å
1339	Y	65.5	Low	63.6	Low	10 Å²	10	35 Å²	35	4%	0.039	19%	0.187	C	C	.	.	H	α-helix	trans	-71.1	-32.2	177.9	-67.3	-50.3	0	0	0	112.8	L1269 N1273 Y1335 I1336 E1342 S1343 I1384	L1269-Y1339 HydrophobicContact CD1-CD2 3.85Å; L1269-Y1339 HydrophobicContact CD1-CE2 3.81Å; N1273-Y1339 VanDerWaalsContact OD1-CE2 3.3Å; N1273-Y1339 WeakPolarHBondContact OD1-CE2 3.48Å; Y1335-Y1339 AromaticContact CD1-CE2 3.73Å; Y1335-Y1339 HydrophobicContact CD1-CE2 3.73Å; Y1335-Y1339 HydrophobicContact CG-CE2 4.37Å; Y1335-Y1339 WeakPolarHBondContact O-CD2 3.22Å; Y1335-Y1339 PolarHBondContact O-N 3.41Å; I1336-Y1339 PolarHBondContact O-N 3.25Å; Y1339-E1342 PolarHBondContact O-N 3.48Å; Y1339-S1343 PolarHBondContact O-N 3.12Å; Y1339-I1384 HydrophobicContact CE1-CD1 4.35Å
1340	R	72.1	Confident	62.8	Low	65 Å²	65	36 Å²	36	25%	0.245	19%	0.194	C	C	.	.	H	α-helix	trans	-59.9	-48.9	169.2	-174	165.6	68.2	95.9	-4.6	110.6	E1301 I1336 K1337 S1343 V1344	E1301-R1340 IonicContact OE1-CZ 3.52Å; E1301-R1340 IonicContact OE1-NH2 2.67Å; E1301-R1340 PolarHBondContact OE1-NH2 3.03Å; E1301-R1340 IonicContact OE2-CZ 3.38Å; E1301-R1340 IonicContact OE2-NE 3.66Å; E1301-R1340 PolarHBondContact OE2-NE 2.94Å; E1301-R1340 IonicContact OE2-NH2 2.83Å; E1301-R1340 PolarHBondContact OE2-NH2 3.15Å; I1336-R1340 VanDerWaalsContact O-CB 3.27Å; I1336-R1340 WeakPolarHBondContact O-CB 3.41Å; I1336-R1340 PolarHBondContact O-N 3.35Å; K1337-R1340 PolarHBondContact O-N 3.18Å; R1340-S1343 WeakPolarHBondContact O-CB 3.48Å; R1340-S1343 PolarHBondContact O-N 2.9Å; R1340-S1343 VanDerWaalsContact O-N 3.16Å; R1340-S1343 PolarHBondContact O-OG 3.45Å; R1340-V1344 WeakPolarHBondContact O-CG2 3.42Å; R1340-V1344 PolarHBondContact O-N 3.28Å
1341	L	69.8	Low	62.1	Low	13 Å²	13	36.4 Å²	36.4	7%	0.068	20%	0.204	C	C	.	.	H	α-helix	trans	-60.4	-45.1	176	-73.3	163.2	0	0	0	112.3	K1337 M1338 S1343 V1344 I1345 F1358 Q1361 I1362	K1337-L1341 WeakPolarHBondContact O-CB 3.39Å; K1337-L1341 WeakPolarHBondContact O-CD1 3.37Å; K1337-L1341 VanDerWaalsContact O-CG 3.31Å; K1337-L1341 WeakPolarHBondContact O-CG 3.47Å; K1337-L1341 PolarHBondContact O-N 3Å; M1338-L1341 PolarHBondContact O-N 3.48Å; L1341-S1343 PolarHBondContact O-N 3.48Å; L1341-V1344 PolarHBondContact O-N 3.05Å; L1341-V1344 VanDerWaalsContact O-N 3.13Å; L1341-I1345 WeakPolarHBondContact O-CB 3.21Å; L1341-I1345 WeakPolarHBondContact O-CD1 3.42Å; L1341-I1345 VanDerWaalsContact O-CG1 3.25Å; L1341-I1345 WeakPolarHBondContact O-CG1 3.32Å; L1341-I1345 PolarHBondContact O-N 2.96Å; L1341-F1358 HydrophobicContact CD2-CD1 3.81Å; L1341-Q1361 HydrophobicContact CD1-CB 4.31Å; L1341-Q1361 HydrophobicContact CD2-CB 4.28Å; L1341-I1362 HydrophobicContact CD1-CG1 3.97Å
1342	E	66.6	Low	62	Low	15 Å²	15	39.3 Å²	39.3	7%	0.07	22%	0.218	C	C	.	.	H	α-helix	trans	-55.2	-42.9	174.2	-170.7	174.3	-167.1	0	0	111.8	R1276 M1338 Y1339 G1346 Y1387 L1388 K1391	R1276-E1342 IonicContact CZ-OE1 3.39Å; R1276-E1342 IonicContact CZ-OE2 2.77Å; R1276-E1342 IonicContact NE-OE1 3.14Å; R1276-E1342 IonicContact NE-OE2 3.92Å; R1276-E1342 PolarHBondContact NE-OE2 3.14Å; R1276-E1342 VanDerWaalsContact NH2-CD 3.3Å; R1276-E1342 IonicContact NH2-OE1 3.76Å; R1276-E1342 PolarHBondContact NH2-OE1 3Å; R1276-E1342 IonicContact NH2-OE2 3.58Å; R1276-E1342 PolarHBondContact NH2-OE2 3.11Å; M1338-E1342 PolarHBondContact O-N 2.91Å; Y1339-E1342 PolarHBondContact O-N 3.48Å; E1342-G1346 PolarHBondContact O-N 3.48Å; E1342-Y1387 VanDerWaalsContact OE1-CE1 3.25Å; E1342-Y1387 WeakPolarHBondContact OE1-CE1 3.16Å; E1342-Y1387 PolarHBondContact OE1-OH 3.14Å; E1342-L1388 HydrophobicContact CB-CD1 4.37Å; E1342-L1388 HydrophobicContact CB-CD2 3.56Å; E1342-L1388 HydrophobicContact CG-CD2 3.59Å; E1342-K1391 IonicContact OE1-NZ 3.38Å
1343	S	64.3	Low	62.1	Low	14 Å²	14	46.7 Å²	46.7	10%	0.098	25%	0.252	C	S	.	.	H	α-helix	trans	-64.9	-42.1	178.8	86.4	0	0	0	0	111.5	M1272 R1279 Q1294 Y1339 R1340 L1341 G1346 L1347	M1272-S1343 WeakPolarHBondContact CE-OG 3.26Å; R1279-S1343 PolarHBondContact NH1-O 3.2Å; R1279-S1343 VanDerWaalsContact NH2-C 3.33Å; R1279-S1343 PolarHBondContact NH2-O 3.38Å; Q1294-S1343 PolarHBondContact NE2-OG 2.93Å; Q1294-S1343 VanDerWaalsContact NE2-OG 3.07Å; Y1339-S1343 PolarHBondContact O-N 3.12Å; R1340-S1343 WeakPolarHBondContact O-CB 3.48Å; R1340-S1343 PolarHBondContact O-N 2.9Å; R1340-S1343 VanDerWaalsContact O-N 3.16Å; R1340-S1343 PolarHBondContact O-OG 3.45Å; L1341-S1343 PolarHBondContact O-N 3.48Å; S1343-G1346 PolarHBondContact O-N 2.8Å; S1343-L1347 PolarHBondContact O-N 2.95Å
1344	V	66.9	Low	62	Low	43 Å²	43	51 Å²	51	26%	0.261	27%	0.272	S	S	.	.	H	α-helix	trans	-70.7	-39.6	-179.7	-178.3	0	0	0	0	111.4	R1340 L1341 G1346 L1347 T1348 F1358	R1340-V1344 WeakPolarHBondContact O-CG2 3.42Å; R1340-V1344 PolarHBondContact O-N 3.28Å; L1341-V1344 PolarHBondContact O-N 3.05Å; L1341-V1344 VanDerWaalsContact O-N 3.13Å; V1344-G1346 PolarHBondContact O-N 3.41Å; V1344-L1347 PolarHBondContact O-N 2.75Å; V1344-T1348 HydrophobicContact CG1-CG2 4.42Å; V1344-T1348 PolarHBondContact O-OG1 2.74Å; V1344-T1348 VanDerWaalsContact O-OG1 3.13Å; V1344-F1358 HydrophobicContact CB-CE1 4.46Å; V1344-F1358 HydrophobicContact CB-CZ 4.35Å; V1344-F1358 HydrophobicContact CG1-CE1 3.8Å; V1344-F1358 HydrophobicContact CG1-CE2 4.1Å; V1344-F1358 HydrophobicContact CG1-CZ 3.36Å
1345	I	63.8	Low	62.2	Low	5 Å²	5	50.8 Å²	50.8	3%	0.026	27%	0.269	C	S	.	.	H	α-helix	trans	-60.7	-31.7	174.1	-65.6	162	0	0	0	111.2	L1341 F1358 I1362 K1391 I1392 L1395	L1341-I1345 WeakPolarHBondContact O-CB 3.21Å; L1341-I1345 WeakPolarHBondContact O-CD1 3.42Å; L1341-I1345 VanDerWaalsContact O-CG1 3.25Å; L1341-I1345 WeakPolarHBondContact O-CG1 3.32Å; L1341-I1345 PolarHBondContact O-N 2.96Å; I1345-F1358 HydrophobicContact CD1-CB 4.41Å; I1345-F1358 HydrophobicContact CG1-CB 4.37Å; I1345-F1358 HydrophobicContact CG1-CD2 4.06Å; I1345-F1358 HydrophobicContact CG1-CG 4.29Å; I1345-I1362 HydrophobicContact CD1-CD1 4.15Å; I1345-K1391 HydrophobicContact CG2-CD 4.33Å; I1345-K1391 HydrophobicContact CG2-CG 4.33Å; I1345-I1392 HydrophobicContact CD1-CD1 3.93Å; I1345-I1392 HydrophobicContact CD1-CG1 4.06Å; I1345-I1392 HydrophobicContact CG1-CG1 4.49Å; I1345-L1395 HydrophobicContact CG2-CD1 3.9Å
1346	G	56.8	Low	62.6	Low	47 Å²	47	54.4 Å²	54.4	49%	0.485	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-12.3	178.3	0	0	0	0	0	116.6	E1342 S1343 V1344	E1342-G1346 PolarHBondContact O-N 3.48Å; S1343-G1346 PolarHBondContact O-N 2.8Å; V1344-G1346 PolarHBondContact O-N 3.41Å
1347	L	52.2	Low	63.1	Low	105 Å²	105	59.2 Å²	59.2	55%	0.55	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-15.8	-178.9	-86.6	178.5	0	0	0	114.7	R1279 S1343 V1344	R1279-L1347 VanDerWaalsContact NH2-CG 3.32Å; S1343-L1347 PolarHBondContact O-N 2.95Å; V1344-L1347 PolarHBondContact O-N 2.75Å
1348	T	49.7	Very low	63.3	Low	45 Å²	45	58.3 Å²	58.3	28%	0.276	31%	0.311	S	S	.	.			trans	-103.3	121.3	-164.3	49.9	0	0	0	0	112.3	V1344 S1350	V1344-T1348 HydrophobicContact CG1-CG2 4.42Å; V1344-T1348 PolarHBondContact O-OG1 2.74Å; V1344-T1348 VanDerWaalsContact O-OG1 3.13Å; T1348-S1350 WeakPolarHBondContact CB-OG 3.41Å; T1348-S1350 PolarHBondContact O-N 3.17Å; T1348-S1350 PolarHBondContact O-OG 2.83Å; T1348-S1350 WeakPolarHBondContact OG1-CB 3.48Å; T1348-S1350 PolarHBondContact OG1-OG 3.43Å
1349	E	46	Very low	63.5	Low	210 Å²	210	59.9 Å²	59.9	98%	0.981	32%	0.318	S	S	*	.			trans	-69.1	61.8	150.5	-66.8	-172.1	158	0	0	108.4
1350	S	47.7	Very low	64.2	Low	21 Å²	21	66.6 Å²	66.6	15%	0.147	34%	0.344	C	S	.	.			trans	-78.7	140.3	-168.5	28.5	0	0	0	0	112.1	T1348 L1355	T1348-S1350 WeakPolarHBondContact CB-OG 3.41Å; T1348-S1350 PolarHBondContact O-N 3.17Å; T1348-S1350 PolarHBondContact O-OG 2.83Å; T1348-S1350 WeakPolarHBondContact OG1-CB 3.48Å; T1348-S1350 PolarHBondContact OG1-OG 3.43Å; S1350-L1355 WeakPolarHBondContact OG-CD2 3.46Å
1351	S	52.1	Low	64.3	Low	63 Å²	63	67.2 Å²	67.2	44%	0.441	35%	0.35	S	S	.	.			trans	-64	154.3	166.3	60.8	0	0	0	0	110.5	E1353 Q1354 L1355	S1351-E1353 PolarHBondContact O-N 3Å; S1351-Q1354 PolarHBondContact O-N 3.35Å; S1351-L1355 PolarHBondContact O-N 3.16Å
1352	N	60.3	Low	64.5	Low	100 Å²	100	66.6 Å²	66.6	54%	0.535	35%	0.346	S	S	.	.	H	α-helix	trans	-53.2	-27.9	179.3	-79.1	-13.4	0	0	0	113.5	L1355 N1356	N1352-L1355 PolarHBondContact O-N 3.23Å; N1352-N1356 WeakPolarHBondContact O-CB 3.33Å; N1352-N1356 PolarHBondContact O-N 3.49Å; N1352-N1356 PolarHBondContact O-ND2 2.75Å; N1352-N1356 PolarHBondContact O-OD1 3.15Å
1353	E	63.2	Low	65	Low	159 Å²	159	68.4 Å²	68.4	74%	0.743	36%	0.36	S	S	*	.	H	α-helix	trans	-66.1	-42.2	176.7	-64	179.8	158.7	0	0	113	S1351 N1356 L1357	S1351-E1353 PolarHBondContact O-N 3Å; E1353-N1356 PolarHBondContact O-N 3.16Å; E1353-L1357 PolarHBondContact O-N 3.15Å; E1353-L1357 VanDerWaalsContact O-N 3.09Å
1354	Q	68.5	Low	65.6	Low	96 Å²	96	71.7 Å²	71.7	45%	0.449	37%	0.374	S	S	.	.	H	α-helix	trans	-68.3	-39.4	175.9	-72.3	-177.5	-14.1	0	0	111.2	S1351 N1356 L1357 F1358	S1351-Q1354 PolarHBondContact O-N 3.35Å; Q1354-N1356 VanDerWaalsContact C-N 3.34Å; Q1354-N1356 PolarHBondContact O-N 3.35Å; Q1354-L1357 WeakPolarHBondContact O-CB 3.1Å; Q1354-L1357 PolarHBondContact O-N 3.35Å; Q1354-L1357 VanDerWaalsContact O-N 3.15Å; Q1354-F1358 HydrophobicContact CB-CE2 4.26Å; Q1354-F1358 WeakPolarHBondContact O-CD2 3.48Å; Q1354-F1358 WeakPolarHBondContact O-CG 3.49Å; Q1354-F1358 PolarHBondContact O-N 3.48Å
1355	L	68.3	Low	65.8	Low	4 Å²	4	70.2 Å²	70.2	2%	0.021	37%	0.365	C	S	.	.	H	α-helix	trans	-60.7	-41.3	174.5	-69.9	173.7	0	0	0	112.1	S1350 S1351 N1352 L1357 F1358 E1359 I1392 L1395 Q1396	S1350-L1355 WeakPolarHBondContact OG-CD2 3.46Å; S1351-L1355 PolarHBondContact O-N 3.16Å; N1352-L1355 PolarHBondContact O-N 3.23Å; L1355-L1357 VanDerWaalsContact C-N 3.33Å; L1355-L1357 PolarHBondContact O-N 2.72Å; L1355-F1358 PolarHBondContact O-N 3.29Å; L1355-E1359 PolarHBondContact O-N 3.24Å; L1355-I1392 HydrophobicContact CB-CG2 4.14Å; L1355-I1392 HydrophobicContact CD2-CG1 4.35Å; L1355-I1392 HydrophobicContact CD2-CG2 4.44Å; L1355-L1395 HydrophobicContact CD1-CB 4.11Å; L1355-L1395 HydrophobicContact CD2-CD1 3.97Å; L1355-Q1396 HydrophobicContact CD1-CG 4.04Å
1356	N	73.6	Confident	66	Low	83 Å²	83	70.8 Å²	70.8	44%	0.444	37%	0.368	S	S	.	.	H	α-helix	trans	-65.6	-34.8	174.5	-68.9	-9.6	0	0	0	112.3	N1352 E1353 Q1354 E1359 Y1360 Q1396	N1352-N1356 WeakPolarHBondContact O-CB 3.33Å; N1352-N1356 PolarHBondContact O-N 3.49Å; N1352-N1356 PolarHBondContact O-ND2 2.75Å; N1352-N1356 PolarHBondContact O-OD1 3.15Å; E1353-N1356 PolarHBondContact O-N 3.16Å; Q1354-N1356 VanDerWaalsContact C-N 3.34Å; Q1354-N1356 PolarHBondContact O-N 3.35Å; N1356-E1359 PolarHBondContact O-N 3.23Å; N1356-Y1360 PolarHBondContact O-N 3.13Å; N1356-Q1396 PolarHBondContact OD1-NE2 2.89Å; N1356-Q1396 VanDerWaalsContact OD1-NE2 3.1Å
1357	L	75.7	Confident	66.8	Low	102 Å²	102	74.5 Å²	74.5	53%	0.534	37%	0.373	S	S	.	.	H	α-helix	trans	-66.5	-41.1	175.3	-157.5	88	0	0	0	111.7	E1353 Q1354 L1355 Y1360 Q1361	E1353-L1357 PolarHBondContact O-N 3.15Å; E1353-L1357 VanDerWaalsContact O-N 3.09Å; Q1354-L1357 WeakPolarHBondContact O-CB 3.1Å; Q1354-L1357 PolarHBondContact O-N 3.35Å; Q1354-L1357 VanDerWaalsContact O-N 3.15Å; L1355-L1357 VanDerWaalsContact C-N 3.33Å; L1355-L1357 PolarHBondContact O-N 2.72Å; L1357-Y1360 PolarHBondContact O-N 3.03Å; L1357-Q1361 WeakPolarHBondContact O-CG 3.37Å; L1357-Q1361 PolarHBondContact O-N 3.22Å; L1357-Q1361 VanDerWaalsContact O-N 3.09Å
1358	F	75.8	Confident	67.4	Low	25 Å²	25	72.1 Å²	72.1	11%	0.11	36%	0.361	C	S	.	.	H	α-helix	trans	-66.9	-40.5	174	-60.2	-45.7	0	0	0	111.9	L1341 V1344 I1345 Q1354 L1355 Y1360 Q1361 I1362 I1392	L1341-F1358 HydrophobicContact CD2-CD1 3.81Å; V1344-F1358 HydrophobicContact CB-CE1 4.46Å; V1344-F1358 HydrophobicContact CB-CZ 4.35Å; V1344-F1358 HydrophobicContact CG1-CE1 3.8Å; V1344-F1358 HydrophobicContact CG1-CE2 4.1Å; V1344-F1358 HydrophobicContact CG1-CZ 3.36Å; I1345-F1358 HydrophobicContact CD1-CB 4.41Å; I1345-F1358 HydrophobicContact CG1-CB 4.37Å; I1345-F1358 HydrophobicContact CG1-CD2 4.06Å; I1345-F1358 HydrophobicContact CG1-CG 4.29Å; Q1354-F1358 HydrophobicContact CB-CE2 4.26Å; Q1354-F1358 WeakPolarHBondContact O-CD2 3.48Å; Q1354-F1358 WeakPolarHBondContact O-CG 3.49Å; Q1354-F1358 PolarHBondContact O-N 3.48Å; L1355-F1358 PolarHBondContact O-N 3.29Å; F1358-Y1360 VanDerWaalsContact C-N 3.32Å; F1358-Y1360 PolarHBondContact O-N 2.99Å; F1358-Q1361 PolarHBondContact O-N 3.43Å; F1358-I1362 VanDerWaalsContact O-CG1 3.28Å; F1358-I1362 WeakPolarHBondContact O-CG1 3.28Å; F1358-I1362 PolarHBondContact O-N 3.36Å; F1358-I1392 HydrophobicContact CB-CD1 4.07Å
1359	E	75.5	Confident	68.1	Low	33 Å²	33	71.2 Å²	71.2	15%	0.154	35%	0.354	C	S	.	.	H	α-helix	trans	-58.2	-43	173.5	172.4	160.8	-135.7	0	0	111.8	L1355 N1356 I1362 C1363 L1389 I1392 R1393	L1355-E1359 PolarHBondContact O-N 3.24Å; N1356-E1359 PolarHBondContact O-N 3.23Å; E1359-I1362 PolarHBondContact O-N 3.44Å; E1359-C1363 WeakPolarHBondContact O-CB 3.5Å; E1359-C1363 PolarHBondContact O-N 3.4Å; E1359-C1363 PolarHBondContact O-SG 3.18Å; E1359-L1389 HydrophobicContact CB-CD2 4.45Å; E1359-L1389 HydrophobicContact CG-CD2 3.7Å; E1359-L1389 WeakPolarHBondContact OE1-CD2 3.35Å; E1359-I1392 HydrophobicContact CB-CD1 4.25Å; E1359-R1393 IonicContact OE1-CZ 3.75Å; E1359-R1393 IonicContact OE1-NE 3.66Å; E1359-R1393 IonicContact OE1-NH2 3.88Å; E1359-R1393 PolarHBondContact OE1-NH2 2.98Å; E1359-R1393 IonicContact OE2-CZ 2.7Å; E1359-R1393 IonicContact OE2-NH1 2.85Å; E1359-R1393 IonicContact OE2-NH2 2.68Å; E1359-R1393 PolarHBondContact OE2-NH2 3.47Å
1360	Y	78.8	Confident	69	Low	151 Å²	151	66.5 Å²	66.5	59%	0.592	33%	0.33	S	S	*	.	H	α-helix	trans	-61.1	-44.9	174.1	-179.8	-93.6	0	0	0	112.2	N1356 L1357 F1358 I1362 C1363 Q1364	N1356-Y1360 PolarHBondContact O-N 3.13Å; L1357-Y1360 PolarHBondContact O-N 3.03Å; F1358-Y1360 VanDerWaalsContact C-N 3.32Å; F1358-Y1360 PolarHBondContact O-N 2.99Å; Y1360-I1362 PolarHBondContact O-N 2.65Å; Y1360-C1363 PolarHBondContact O-N 3.02Å; Y1360-Q1364 WeakPolarHBondContact O-CB 3.16Å; Y1360-Q1364 PolarHBondContact O-N 2.86Å
1361	Q	75	Confident	69.6	Low	77 Å²	77	72.8 Å²	72.8	36%	0.36	36%	0.357	S	S	.	.	H	α-helix	trans	-65.1	-36.4	178.6	-71.5	175.4	-9	0	0	113.1	L1341 L1357 F1358 T1365	L1341-Q1361 HydrophobicContact CD1-CB 4.31Å; L1341-Q1361 HydrophobicContact CD2-CB 4.28Å; L1357-Q1361 WeakPolarHBondContact O-CG 3.37Å; L1357-Q1361 PolarHBondContact O-N 3.22Å; L1357-Q1361 VanDerWaalsContact O-N 3.09Å; F1358-Q1361 PolarHBondContact O-N 3.43Å; Q1361-T1365 PolarHBondContact O-N 2.99Å; Q1361-T1365 VanDerWaalsContact O-N 3.07Å; Q1361-T1365 PolarHBondContact O-OG1 3.26Å
1362	I	73.9	Confident	69.5	Low	0 Å²	0	73.6 Å²	73.6	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-67.3	-46.8	173.3	-65.4	161.2	0	0	0	110.4	M1338 L1341 I1345 F1358 E1359 Y1360 Q1364 T1365 I1366 L1388 L1389 I1392	M1338-I1362 HydrophobicContact CE-CG2 4.19Å; M1338-I1362 HydrophobicContact SD-CG2 4.36Å; L1341-I1362 HydrophobicContact CD1-CG1 3.97Å; I1345-I1362 HydrophobicContact CD1-CD1 4.15Å; F1358-I1362 VanDerWaalsContact O-CG1 3.28Å; F1358-I1362 WeakPolarHBondContact O-CG1 3.28Å; F1358-I1362 PolarHBondContact O-N 3.36Å; E1359-I1362 PolarHBondContact O-N 3.44Å; Y1360-I1362 PolarHBondContact O-N 2.65Å; I1362-Q1364 VanDerWaalsContact C-N 3.34Å; I1362-Q1364 PolarHBondContact O-N 3.27Å; I1362-T1365 WeakPolarHBondContact CA-OG1 3.17Å; I1362-T1365 PolarHBondContact O-N 3.31Å; I1362-T1365 PolarHBondContact O-OG1 2.96Å; I1362-I1366 HydrophobicContact CG2-CD1 3.85Å; I1362-I1366 VanDerWaalsContact O-CG1 3.29Å; I1362-I1366 WeakPolarHBondContact O-CG1 3.49Å; I1362-I1366 PolarHBondContact O-N 3.43Å; I1362-L1388 HydrophobicContact CD1-CB 3.71Å; I1362-L1389 HydrophobicContact CG2-CD1 4.11Å; I1362-L1389 HydrophobicContact CG2-CG 4Å; I1362-I1392 HydrophobicContact CD1-CD1 3.61Å
1363	C	76.3	Confident	69.1	Low	53 Å²	53	69.9 Å²	69.9	36%	0.358	33%	0.333	S	S	.	.	H	α-helix	trans	-61.5	-41.4	177.8	-74.7	0	0	0	0	112.3	E1359 Y1360 I1366 Q1367	E1359-C1363 WeakPolarHBondContact O-CB 3.5Å; E1359-C1363 PolarHBondContact O-N 3.4Å; E1359-C1363 PolarHBondContact O-SG 3.18Å; Y1360-C1363 PolarHBondContact O-N 3.02Å; C1363-I1366 PolarHBondContact O-N 2.93Å; C1363-Q1367 PolarHBondContact O-N 2.88Å
1364	Q	78.3	Confident	68.1	Low	83 Å²	83	67 Å²	67	39%	0.388	33%	0.331	S	S	.	.	H	α-helix	trans	-66.3	-46.1	178.5	-172.5	170	0.6	0	0	111.6	Y1360 I1362 I1366 Q1367 D1368	Y1360-Q1364 WeakPolarHBondContact O-CB 3.16Å; Y1360-Q1364 PolarHBondContact O-N 2.86Å; I1362-Q1364 VanDerWaalsContact C-N 3.34Å; I1362-Q1364 PolarHBondContact O-N 3.27Å; Q1364-I1366 VanDerWaalsContact C-N 3.31Å; Q1364-I1366 PolarHBondContact O-N 3.35Å; Q1364-Q1367 WeakPolarHBondContact O-CB 3.41Å; Q1364-Q1367 PolarHBondContact O-N 3.13Å; Q1364-D1368 VanDerWaalsContact O-CG 3.29Å; Q1364-D1368 PolarHBondContact O-N 3.21Å
1365	T	69.5	Low	66.9	Low	13 Å²	13	70.6 Å²	70.6	8%	0.08	35%	0.347	C	S	.	.	H	α-helix	trans	-60.3	-39.4	175	38.5	0	0	0	0	112.3	K1337 M1338 Q1361 I1362 Q1367 D1368 I1369	K1337-T1365 HydrophobicContact CB-CG2 4.28Å; K1337-T1365 HydrophobicContact CD-CG2 3.74Å; M1338-T1365 VanDerWaalsContact CE-OG1 3.26Å; M1338-T1365 WeakPolarHBondContact CE-OG1 3.46Å; Q1361-T1365 PolarHBondContact O-N 2.99Å; Q1361-T1365 VanDerWaalsContact O-N 3.07Å; Q1361-T1365 PolarHBondContact O-OG1 3.26Å; I1362-T1365 WeakPolarHBondContact CA-OG1 3.17Å; I1362-T1365 PolarHBondContact O-N 3.31Å; I1362-T1365 PolarHBondContact O-OG1 2.96Å; T1365-Q1367 VanDerWaalsContact C-N 3.34Å; T1365-Q1367 PolarHBondContact O-N 3.34Å; T1365-D1368 PolarHBondContact O-N 3.36Å; T1365-I1369 WeakPolarHBondContact O-CD1 3.4Å; T1365-I1369 VanDerWaalsContact O-CG1 3.27Å; T1365-I1369 WeakPolarHBondContact O-CG1 3.48Å; T1365-I1369 PolarHBondContact O-N 3.11Å
1366	I	69.9	Low	65.8	Low	17 Å²	17	73.5 Å²	73.5	9%	0.087	36%	0.363	C	S	.	.	H	α-helix	trans	-62.3	-38	172.9	-67.9	167	0	0	0	112	M1338 I1362 C1363 Q1364 K1370 L1382 L1389	M1338-I1366 HydrophobicContact CE-CD1 4.48Å; M1338-I1366 HydrophobicContact CE-CG1 3.89Å; I1362-I1366 HydrophobicContact CG2-CD1 3.85Å; I1362-I1366 VanDerWaalsContact O-CG1 3.29Å; I1362-I1366 WeakPolarHBondContact O-CG1 3.49Å; I1362-I1366 PolarHBondContact O-N 3.43Å; C1363-I1366 PolarHBondContact O-N 2.93Å; Q1364-I1366 VanDerWaalsContact C-N 3.31Å; Q1364-I1366 PolarHBondContact O-N 3.35Å; I1366-K1370 HydrophobicContact CG2-CD 4.38Å; I1366-K1370 WeakPolarHBondContact O-CG 3.16Å; I1366-K1370 PolarHBondContact O-N 2.96Å; I1366-L1382 HydrophobicContact CG2-CD1 3.75Å; I1366-L1389 HydrophobicContact CD1-CD1 4.32Å
1367	Q	71.7	Confident	64.7	Low	124 Å²	124	72.3 Å²	72.3	58%	0.579	36%	0.356	S	S	*	.	H	α-helix	trans	-67	-45.2	175.4	-79.6	-176.9	-25.6	0	0	112.2	C1363 Q1364 T1365 I1369 K1370 Q1371	C1363-Q1367 PolarHBondContact O-N 2.88Å; Q1364-Q1367 WeakPolarHBondContact O-CB 3.41Å; Q1364-Q1367 PolarHBondContact O-N 3.13Å; T1365-Q1367 VanDerWaalsContact C-N 3.34Å; T1365-Q1367 PolarHBondContact O-N 3.34Å; Q1367-I1369 VanDerWaalsContact C-N 3.3Å; Q1367-I1369 PolarHBondContact O-N 2.99Å; Q1367-K1370 WeakPolarHBondContact O-CB 3.29Å; Q1367-K1370 PolarHBondContact O-N 3.12Å; Q1367-K1370 VanDerWaalsContact O-N 3.1Å; Q1367-Q1371 PolarHBondContact O-N 3.44Å
1368	D	66.5	Low	64	Low	56 Å²	56	68.3 Å²	68.3	30%	0.299	34%	0.335	S	S	.	.	H	α-helix	trans	-55.4	-46.6	177.9	-63.6	-21.4	0	0	0	110.5	Q1364 T1365 K1370 Q1371 F1372	Q1364-D1368 VanDerWaalsContact O-CG 3.29Å; Q1364-D1368 PolarHBondContact O-N 3.21Å; T1365-D1368 PolarHBondContact O-N 3.36Å; D1368-K1370 PolarHBondContact O-N 2.93Å; D1368-Q1371 PolarHBondContact O-N 2.89Å; D1368-F1372 WeakPolarHBondContact O-CD2 3.41Å; D1368-F1372 PolarHBondContact O-N 3.46Å; D1368-F1372 VanDerWaalsContact O-N 3.12Å
1369	I	63.9	Low	63.3	Low	26 Å²	26	71 Å²	71	13%	0.133	34%	0.344	C	S	.	.	H	α-helix	trans	-63.8	-39.3	178.4	-61.2	150.9	0	0	0	111.9	A1334 T1365 Q1367 Q1371 F1372 N1373 L1381	A1334-I1369 HydrophobicContact CB-CD1 4.11Å; A1334-I1369 HydrophobicContact CB-CG1 4.31Å; T1365-I1369 WeakPolarHBondContact O-CD1 3.4Å; T1365-I1369 VanDerWaalsContact O-CG1 3.27Å; T1365-I1369 WeakPolarHBondContact O-CG1 3.48Å; T1365-I1369 PolarHBondContact O-N 3.11Å; Q1367-I1369 VanDerWaalsContact C-N 3.3Å; Q1367-I1369 PolarHBondContact O-N 2.99Å; I1369-Q1371 VanDerWaalsContact C-N 3.29Å; I1369-Q1371 PolarHBondContact O-N 3.24Å; I1369-F1372 PolarHBondContact O-N 2.88Å; I1369-N1373 PolarHBondContact O-N 2.98Å; I1369-L1381 HydrophobicContact CD1-CD2 3.19Å; I1369-L1381 HydrophobicContact CG1-CD2 4.49Å
1370	K	63.8	Low	62.6	Low	110 Å²	110	70 Å²	70	48%	0.478	34%	0.34	S	S	.	.	H	α-helix	trans	-64.7	-33.6	177.3	-78.2	176.9	178.4	178.8	0	112.2	I1366 Q1367 D1368 I1377	I1366-K1370 HydrophobicContact CG2-CD 4.38Å; I1366-K1370 WeakPolarHBondContact O-CG 3.16Å; I1366-K1370 PolarHBondContact O-N 2.96Å; Q1367-K1370 WeakPolarHBondContact O-CB 3.29Å; Q1367-K1370 PolarHBondContact O-N 3.12Å; Q1367-K1370 VanDerWaalsContact O-N 3.1Å; D1368-K1370 PolarHBondContact O-N 2.93Å; K1370-I1377 HydrophobicContact CG-CD1 4.12Å; K1370-I1377 HydrophobicContact CG-CG1 4.42Å
1371	Q	60.1	Low	61.9	Low	154 Å²	154	62.9 Å²	62.9	72%	0.72	31%	0.313	S	S	*	.	H	α-helix	trans	-71.1	-40.1	175.1	-68.9	-175.7	-1.2	0	0	112	Q1367 D1368 I1369	Q1367-Q1371 PolarHBondContact O-N 3.44Å; D1368-Q1371 PolarHBondContact O-N 2.89Å; I1369-Q1371 VanDerWaalsContact C-N 3.29Å; I1369-Q1371 PolarHBondContact O-N 3.24Å
1372	F	50.1	Low	61.7	Low	80 Å²	80	60.6 Å²	60.6	35%	0.351	30%	0.303	S	S	.	.	H	α-helix	trans	-81.2	-30	-177.5	-86.9	-90	0	0	0	115.3	F1312 F1330 D1368 I1369	F1312-F1372 AromaticContact CE2-CE1 3.54Å; F1312-F1372 HydrophobicContact CE2-CE1 3.54Å; F1312-F1372 AromaticContact CE2-CZ 3.52Å; F1312-F1372 HydrophobicContact CE2-CZ 3.52Å; F1312-F1372 AromaticContact CZ-CE1 3.51Å; F1312-F1372 HydrophobicContact CZ-CE1 3.51Å; F1312-F1372 AromaticContact CZ-CZ 3.48Å; F1312-F1372 HydrophobicContact CZ-CZ 3.48Å; F1312-F1372 VanDerWaalsContact CZ-CZ 3.48Å; F1330-F1372 HydrophobicContact CD2-CE1 4.37Å; F1330-F1372 HydrophobicContact CE1-CD2 4.41Å; F1330-F1372 HydrophobicContact CE1-CE2 4.17Å; F1330-F1372 HydrophobicContact CE1-CZ 4.38Å; F1330-F1372 HydrophobicContact CE2-CD1 4.41Å; F1330-F1372 AromaticContact CE2-CE1 3.84Å; F1330-F1372 HydrophobicContact CE2-CE1 3.84Å; F1330-F1372 HydrophobicContact CE2-CE2 4.45Å; F1330-F1372 AromaticContact CE2-CZ 3.86Å; F1330-F1372 HydrophobicContact CE2-CZ 3.86Å; F1330-F1372 HydrophobicContact CZ-CD2 4.46Å; F1330-F1372 HydrophobicContact CZ-CE1 4.09Å; F1330-F1372 AromaticContact CZ-CE2 3.87Å; F1330-F1372 HydrophobicContact CZ-CE2 3.87Å; F1330-F1372 AromaticContact CZ-CZ 3.66Å; F1330-F1372 HydrophobicContact CZ-CZ 3.66Å; D1368-F1372 WeakPolarHBondContact O-CD2 3.41Å; D1368-F1372 PolarHBondContact O-N 3.46Å; D1368-F1372 VanDerWaalsContact O-N 3.12Å; I1369-F1372 PolarHBondContact O-N 2.88Å
1373	N	51.7	Low	61.4	Low	21 Å²	21	60.6 Å²	60.6	11%	0.112	30%	0.303	C	S	.	.			trans	-117.8	58.4	-175.8	-80.6	-32.2	0	0	0	112.7	R1327 I1369 Q1375 L1376 I1377	R1327-N1373 PolarHBondContact NE-OD1 3.27Å; I1369-N1373 PolarHBondContact O-N 2.98Å; N1373-Q1375 PolarHBondContact O-N 3.43Å; N1373-L1376 PolarHBondContact O-N 2.87Å; N1373-I1377 PolarHBondContact O-N 3.08Å
1374	S	43.5	Very low	61	Low	100 Å²	100	58.2 Å²	58.2	70%	0.699	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-17.1	180	60.2	0	0	0	0	115.8
1375	Q	42.5	Very low	60.6	Low	170 Å²	170	54.2 Å²	54.2	79%	0.794	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114	-12	179.3	-70.2	178	-22.4	0	0	114.5	N1373	N1373-Q1375 PolarHBondContact O-N 3.43Å
1376	L	45.3	Very low	60.7	Low	65 Å²	65	54.8 Å²	54.8	34%	0.34	27%	0.27	S	S	.	.			trans	-157.3	60.8	-172	-103.4	146.5	0	0	0	112.8	N1373 D1378 R1533	N1373-L1376 PolarHBondContact O-N 2.87Å; L1376-D1378 PolarHBondContact O-N 3.13Å; L1376-D1378 VanDerWaalsContact O-N 3.14Å; L1376-R1533 HydrophobicContact CD2-CG 4.12Å
1377	I	51.5	Low	61	Low	59 Å²	59	54.3 Å²	54.3	30%	0.303	27%	0.267	S	S	.	.			trans	-53.6	113.2	174.9	-59	166.5	0	0	0	110.7	K1370 N1373 R1379 L1382 R1533	K1370-I1377 HydrophobicContact CG-CD1 4.12Å; K1370-I1377 HydrophobicContact CG-CG1 4.42Å; N1373-I1377 PolarHBondContact O-N 3.08Å; I1377-R1379 PolarHBondContact O-N 3.33Å; I1377-L1382 HydrophobicContact CG2-CD2 4.46Å; I1377-R1533 PolarHBondContact O-NE 3.35Å; I1377-R1533 PolarHBondContact O-NH2 3.31Å
1378	D	60.4	Low	61	Low	18 Å²	18	48.4 Å²	48.4	10%	0.096	24%	0.239	C	C	.	.			trans	-59.6	102.2	-175	-154.4	29.3	0	0	0	111.6	Y1335 L1376 T1380 L1381 L1382 R1533	Y1335-D1378 WeakPolarHBondContact CE2-OD2 3.18Å; Y1335-D1378 PolarHBondContact OH-OD2 3.37Å; L1376-D1378 PolarHBondContact O-N 3.13Å; L1376-D1378 VanDerWaalsContact O-N 3.14Å; D1378-T1380 VanDerWaalsContact C-N 3.34Å; D1378-T1380 PolarHBondContact O-N 3.12Å; D1378-L1381 HydrophobicContact CB-CB 4.35Å; D1378-L1381 PolarHBondContact O-N 2.88Å; D1378-L1382 PolarHBondContact O-N 3.46Å; D1378-R1533 WeakPolarHBondContact OD1-CD 3.5Å; D1378-R1533 VanDerWaalsContact OD1-CG 3.28Å; D1378-R1533 WeakPolarHBondContact OD1-CG 3.49Å; D1378-R1533 IonicContact OD1-NE 3.68Å
1379	R	61.4	Low	61.5	Low	80 Å²	80	46.3 Å²	46.3	30%	0.302	23%	0.228	S	C	.	.	H	α-helix	trans	-70.4	-30.5	-164.1	-91	-177.1	176	150.1	-9.1	113.3	I1377 L1382 A1383 E1412 A1415 D1416	I1377-R1379 PolarHBondContact O-N 3.33Å; R1379-L1382 PolarHBondContact O-N 3.46Å; R1379-A1383 VanDerWaalsContact O-CB 3.27Å; R1379-A1383 WeakPolarHBondContact O-CB 3.42Å; R1379-A1383 PolarHBondContact O-N 2.77Å; R1379-E1412 IonicContact NE-OE2 3.76Å; R1379-E1412 PolarHBondContact NE-OE2 3.2Å; R1379-A1415 PolarHBondContact NH1-O 3.32Å; R1379-D1416 WeakPolarHBondContact CB-OD2 3.32Å; R1379-D1416 WeakPolarHBondContact CD-OD1 3.47Å; R1379-D1416 IonicContact CZ-OD1 3.48Å; R1379-D1416 IonicContact NE-OD1 2.88Å; R1379-D1416 IonicContact NH1-OD1 2.76Å; R1379-D1416 PolarHBondContact NH1-OD1 3.16Å
1380	T	60.5	Low	61.9	Low	12 Å²	12	45 Å²	45	7%	0.074	22%	0.222	C	C	.	.	H	α-helix	trans	-64.9	-40.5	172.8	39.3	0	0	0	0	111.2	Y1335 D1378 A1383 I1384 T1535	Y1335-T1380 PolarHBondContact OH-OG1 3.09Å; D1378-T1380 VanDerWaalsContact C-N 3.34Å; D1378-T1380 PolarHBondContact O-N 3.12Å; T1380-A1383 WeakPolarHBondContact O-CB 3.19Å; T1380-A1383 PolarHBondContact O-N 3.14Å; T1380-I1384 VanDerWaalsContact O-CG1 3.3Å; T1380-I1384 WeakPolarHBondContact O-CG1 3.38Å; T1380-I1384 PolarHBondContact O-N 3.03Å; T1380-T1535 WeakPolarHBondContact CB-OG1 3.49Å; T1380-T1535 VanDerWaalsContact CG2-O 3.29Å; T1380-T1535 WeakPolarHBondContact CG2-O 3.21Å; T1380-T1535 PolarHBondContact OG1-OG1 3.4Å
1381	L	65	Low	62.2	Low	3 Å²	3	42.6 Å²	42.6	2%	0.016	21%	0.211	C	C	.	.	H	α-helix	trans	-72.9	-34.4	174.2	-161.9	139.7	0	0	0	112.8	A1334 Y1335 M1338 I1369 D1378 A1383 I1384 G1385	A1334-L1381 HydrophobicContact CB-CD1 3.74Å; A1334-L1381 HydrophobicContact CB-CD2 4.18Å; Y1335-L1381 HydrophobicContact CD1-CD1 3.68Å; Y1335-L1381 HydrophobicContact CD1-CG 4.48Å; Y1335-L1381 HydrophobicContact CD2-CD1 3.53Å; Y1335-L1381 HydrophobicContact CE1-CB 4.13Å; Y1335-L1381 HydrophobicContact CE1-CD1 3.78Å; Y1335-L1381 HydrophobicContact CE1-CG 4.27Å; Y1335-L1381 HydrophobicContact CE2-CB 4.36Å; Y1335-L1381 HydrophobicContact CE2-CD1 3.6Å; Y1335-L1381 HydrophobicContact CG-CD1 3.52Å; M1338-L1381 HydrophobicContact CE-CD2 4.17Å; M1338-L1381 HydrophobicContact CG-CD2 4.19Å; M1338-L1381 HydrophobicContact CG-CG 4.31Å; I1369-L1381 HydrophobicContact CD1-CD2 3.19Å; I1369-L1381 HydrophobicContact CG1-CD2 4.49Å; D1378-L1381 HydrophobicContact CB-CB 4.35Å; D1378-L1381 PolarHBondContact O-N 2.88Å; L1381-A1383 VanDerWaalsContact C-N 3.34Å; L1381-I1384 PolarHBondContact O-N 3.31Å; L1381-G1385 PolarHBondContact O-N 3.24Å
1382	L	69.8	Low	62.8	Low	28 Å²	28	35.2 Å²	35.2	15%	0.147	18%	0.177	C	C	.	.	H	α-helix	trans	-60.6	-44.2	168	-171	72.3	0	0	0	110.9	I1366 I1377 D1378 R1379 G1385 M1386 E1412	I1366-L1382 HydrophobicContact CG2-CD1 3.75Å; I1377-L1382 HydrophobicContact CG2-CD2 4.46Å; D1378-L1382 PolarHBondContact O-N 3.46Å; R1379-L1382 PolarHBondContact O-N 3.46Å; L1382-G1385 PolarHBondContact O-N 3.23Å; L1382-M1386 VanDerWaalsContact O-CG 3.24Å; L1382-M1386 WeakPolarHBondContact O-CG 3.31Å; L1382-M1386 PolarHBondContact O-N 2.97Å; L1382-E1412 HydrophobicContact CD2-CG 4.11Å
1383	A	67.4	Low	63.9	Low	0 Å²	0	34 Å²	34	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-63.3	-42.6	177.2	0	0	0	0	0	112.3	R1379 T1380 L1381 M1386 Y1387 A1409 E1412 C1413 W1427	R1379-A1383 VanDerWaalsContact O-CB 3.27Å; R1379-A1383 WeakPolarHBondContact O-CB 3.42Å; R1379-A1383 PolarHBondContact O-N 2.77Å; T1380-A1383 WeakPolarHBondContact O-CB 3.19Å; T1380-A1383 PolarHBondContact O-N 3.14Å; L1381-A1383 VanDerWaalsContact C-N 3.34Å; A1383-M1386 PolarHBondContact O-N 3.18Å; A1383-Y1387 WeakPolarHBondContact O-CB 3.36Å; A1383-Y1387 PolarHBondContact O-N 3.4Å; A1383-A1409 VanDerWaalsContact CB-O 3.27Å; A1383-A1409 WeakPolarHBondContact CB-O 3.45Å; A1383-A1409 WeakPolarHBondContact O-CB 3.06Å; A1383-E1412 HydrophobicContact CB-CB 4.22Å; A1383-C1413 HydrophobicContact CB-CB 3.87Å; A1383-W1427 HydrophobicContact CB-CH2 4.1Å; A1383-W1427 HydrophobicContact CB-CZ3 4.1Å
1384	I	67.7	Low	64.7	Low	3 Å²	3	35.9 Å²	35.9	2%	0.015	18%	0.18	C	C	.	.	H	α-helix	trans	-60.7	-46.4	173.4	-70.1	161.8	0	0	0	110.3	Y1335 M1338 Y1339 T1380 L1381 M1386 Y1387 L1388 W1427	Y1335-I1384 HydrophobicContact CD1-CD1 4.28Å; Y1335-I1384 HydrophobicContact CE1-CD1 3.81Å; M1338-I1384 HydrophobicContact CB-CG2 4.17Å; Y1339-I1384 HydrophobicContact CE1-CD1 4.35Å; T1380-I1384 VanDerWaalsContact O-CG1 3.3Å; T1380-I1384 WeakPolarHBondContact O-CG1 3.38Å; T1380-I1384 PolarHBondContact O-N 3.03Å; L1381-I1384 PolarHBondContact O-N 3.31Å; I1384-M1386 VanDerWaalsContact C-N 3.34Å; I1384-M1386 PolarHBondContact O-N 3.39Å; I1384-Y1387 PolarHBondContact O-N 3.23Å; I1384-L1388 HydrophobicContact CG2-CD1 4.32Å; I1384-L1388 WeakPolarHBondContact O-CG 3.29Å; I1384-L1388 PolarHBondContact O-N 3.27Å; I1384-W1427 HydrophobicContact CG1-CH2 4.22Å; I1384-W1427 HydrophobicContact CG1-CZ2 4.25Å
1385	G	70.6	Confident	65.8	Low	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-58.3	-43.4	175.4	0	0	0	0	0	112.9	L1381 L1382 L1388 L1389	L1381-G1385 PolarHBondContact O-N 3.24Å; L1382-G1385 PolarHBondContact O-N 3.23Å; G1385-L1388 PolarHBondContact O-N 3.42Å; G1385-L1389 WeakPolarHBondContact O-CG 3.21Å; G1385-L1389 PolarHBondContact O-N 2.94Å
1386	M	71.7	Confident	67.1	Low	24 Å²	24	28.7 Å²	28.7	12%	0.118	14%	0.137	C	C	.	.	H	α-helix	trans	-67.4	-34.3	176.1	-65.7	-63.6	-82.4	0	0	112.8	L1382 A1383 I1384 L1389 A1390 L1405 Q1408 A1409	L1382-M1386 VanDerWaalsContact O-CG 3.24Å; L1382-M1386 WeakPolarHBondContact O-CG 3.31Å; L1382-M1386 PolarHBondContact O-N 2.97Å; A1383-M1386 PolarHBondContact O-N 3.18Å; I1384-M1386 VanDerWaalsContact C-N 3.34Å; I1384-M1386 PolarHBondContact O-N 3.39Å; M1386-L1389 HydrophobicContact SD-CD1 3.97Å; M1386-A1390 WeakPolarHBondContact O-CB 3.31Å; M1386-A1390 PolarHBondContact O-N 2.82Å; M1386-L1405 HydrophobicContact CE-CD2 3.47Å; M1386-L1405 VanDerWaalsContact CE-CD2 3.47Å; M1386-L1405 HydrophobicContact SD-CD2 4.25Å; M1386-Q1408 HydrophobicContact CE-CB 4.1Å; M1386-Q1408 HydrophobicContact CE-CG 3.82Å; M1386-A1409 HydrophobicContact CB-CB 3.94Å
1387	Y	75.9	Confident	67.8	Low	7 Å²	7	32.8 Å²	32.8	3%	0.027	16%	0.156	C	C	.	.	H	α-helix	trans	-67	-40	171.1	153.7	-101.4	0	0	0	112	E1342 A1383 I1384 A1390 K1391 M1406 W1427 I1430	E1342-Y1387 VanDerWaalsContact OE1-CE1 3.25Å; E1342-Y1387 WeakPolarHBondContact OE1-CE1 3.16Å; E1342-Y1387 PolarHBondContact OE1-OH 3.14Å; A1383-Y1387 WeakPolarHBondContact O-CB 3.36Å; A1383-Y1387 PolarHBondContact O-N 3.4Å; I1384-Y1387 PolarHBondContact O-N 3.23Å; Y1387-A1390 CarbonylContact O-C 3.31Å; Y1387-A1390 WeakPolarHBondContact O-CB 3.48Å; Y1387-A1390 PolarHBondContact O-N 3.26Å; Y1387-K1391 HydrophobicContact CE2-CD 4.49Å; Y1387-K1391 WeakPolarHBondContact O-CB 3.38Å; Y1387-K1391 PolarHBondContact O-N 3.38Å; Y1387-K1391 PolarHBondContact OH-NZ 2.65Å; Y1387-K1391 VanDerWaalsContact OH-NZ 3.15Å; Y1387-M1406 HydrophobicContact CD2-CE 4.45Å; Y1387-M1406 HydrophobicContact CD2-SD 3.96Å; Y1387-W1427 AromaticContact CD1-CE2 3.95Å; Y1387-W1427 AromaticContact CD1-CZ2 3.84Å; Y1387-W1427 HydrophobicContact CD1-CZ2 3.84Å; Y1387-W1427 AromaticContact CD1-NE1 3.75Å; Y1387-W1427 AromaticContact CD2-CD1 3.65Å; Y1387-W1427 HydrophobicContact CD2-CD2 4.28Å; Y1387-W1427 AromaticContact CD2-CE2 3.78Å; Y1387-W1427 HydrophobicContact CD2-CG 4.21Å; Y1387-W1427 HydrophobicContact CD2-CZ2 4.39Å; Y1387-W1427 AromaticContact CD2-NE1 3.33Å; Y1387-W1427 VanDerWaalsContact CD2-NE1 3.33Å; Y1387-W1427 AromaticContact CE1-NE1 3.87Å; Y1387-W1427 AromaticContact CE2-CD1 3.7Å; Y1387-W1427 AromaticContact CE2-NE1 3.49Å; Y1387-W1427 HydrophobicContact CG-CD2 4.33Å; Y1387-W1427 AromaticContact CG-CE2 3.55Å; Y1387-W1427 AromaticContact CG-CZ2 3.7Å; Y1387-W1427 HydrophobicContact CG-CZ2 3.7Å; Y1387-W1427 AromaticContact CG-NE1 3.48Å; Y1387-W1427 AromaticContact CZ-NE1 3.76Å; Y1387-I1430 HydrophobicContact CE2-CD1 4.41Å
1388	L	72.3	Confident	68.4	Low	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-66.6	-41.1	175.8	-65.3	178.9	0	0	0	112	M1338 E1342 I1362 I1384 G1385 A1390 K1391 I1392	M1338-L1388 HydrophobicContact CB-CD1 4.43Å; M1338-L1388 WeakPolarHBondContact O-CD1 3.44Å; M1338-L1388 HydrophobicContact SD-CD1 4.05Å; E1342-L1388 HydrophobicContact CB-CD1 4.37Å; E1342-L1388 HydrophobicContact CB-CD2 3.56Å; E1342-L1388 HydrophobicContact CG-CD2 3.59Å; I1362-L1388 HydrophobicContact CD1-CB 3.71Å; I1384-L1388 HydrophobicContact CG2-CD1 4.32Å; I1384-L1388 WeakPolarHBondContact O-CG 3.29Å; I1384-L1388 PolarHBondContact O-N 3.27Å; G1385-L1388 PolarHBondContact O-N 3.42Å; L1388-A1390 VanDerWaalsContact C-N 3.34Å; L1388-K1391 WeakPolarHBondContact O-CB 3.09Å; L1388-K1391 PolarHBondContact O-N 2.76Å; L1388-I1392 WeakPolarHBondContact O-CG1 3.4Å; L1388-I1392 PolarHBondContact O-N 2.76Å
1389	L	77.2	Confident	68.4	Low	12 Å²	12	36.7 Å²	36.7	6%	0.063	18%	0.181	C	C	.	.	H	α-helix	trans	-57.2	-46.5	168.2	-77	158.7	0	0	0	111.2	E1359 I1362 I1366 G1385 M1386 K1391 I1392 R1393 L1405	E1359-L1389 HydrophobicContact CB-CD2 4.45Å; E1359-L1389 HydrophobicContact CG-CD2 3.7Å; E1359-L1389 WeakPolarHBondContact OE1-CD2 3.35Å; I1362-L1389 HydrophobicContact CG2-CD1 4.11Å; I1362-L1389 HydrophobicContact CG2-CG 4Å; I1366-L1389 HydrophobicContact CD1-CD1 4.32Å; G1385-L1389 WeakPolarHBondContact O-CG 3.21Å; G1385-L1389 PolarHBondContact O-N 2.94Å; M1386-L1389 HydrophobicContact SD-CD1 3.97Å; L1389-K1391 VanDerWaalsContact C-N 3.28Å; L1389-K1391 PolarHBondContact O-N 2.9Å; L1389-I1392 PolarHBondContact O-N 3.45Å; L1389-R1393 WeakPolarHBondContact O-CG 3.34Å; L1389-R1393 PolarHBondContact O-N 3.04Å; L1389-L1405 HydrophobicContact CB-CD1 4.15Å
1390	A	71.1	Confident	68.3	Low	0 Å²	0	37 Å²	37	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61.6	-35	176.4	0	0	0	0	0	112.9	M1386 Y1387 L1388 L1394 H1402 L1405 M1406	M1386-A1390 WeakPolarHBondContact O-CB 3.31Å; M1386-A1390 PolarHBondContact O-N 2.82Å; Y1387-A1390 CarbonylContact O-C 3.31Å; Y1387-A1390 WeakPolarHBondContact O-CB 3.48Å; Y1387-A1390 PolarHBondContact O-N 3.26Å; L1388-A1390 VanDerWaalsContact C-N 3.34Å; A1390-L1394 WeakPolarHBondContact O-CB 3.23Å; A1390-L1394 PolarHBondContact O-N 3.42Å; A1390-H1402 PolarHBondContact O-ND1 2.82Å; A1390-L1405 HydrophobicContact CB-CB 3.62Å; A1390-M1406 HydrophobicContact CB-CG 3.8Å; A1390-M1406 HydrophobicContact CB-SD 3.78Å
1391	K	71.4	Confident	68.6	Low	58 Å²	58	40.4 Å²	40.4	25%	0.252	21%	0.211	S	C	.	.	H	α-helix	trans	-70.4	-40.4	176.8	-164.5	171.7	-173.6	169	0	111.4	E1342 I1345 Y1387 L1388 L1389 L1394 L1395	E1342-K1391 IonicContact OE1-NZ 3.38Å; I1345-K1391 HydrophobicContact CG2-CD 4.33Å; I1345-K1391 HydrophobicContact CG2-CG 4.33Å; Y1387-K1391 HydrophobicContact CE2-CD 4.49Å; Y1387-K1391 WeakPolarHBondContact O-CB 3.38Å; Y1387-K1391 PolarHBondContact O-N 3.38Å; Y1387-K1391 PolarHBondContact OH-NZ 2.65Å; Y1387-K1391 VanDerWaalsContact OH-NZ 3.15Å; L1388-K1391 WeakPolarHBondContact O-CB 3.09Å; L1388-K1391 PolarHBondContact O-N 2.76Å; L1389-K1391 VanDerWaalsContact C-N 3.28Å; L1389-K1391 PolarHBondContact O-N 2.9Å; K1391-L1394 WeakPolarHBondContact O-CB 3.43Å; K1391-L1394 PolarHBondContact O-N 3.24Å; K1391-L1395 WeakPolarHBondContact O-CG 3.36Å; K1391-L1395 PolarHBondContact O-N 3.1Å; K1391-L1395 VanDerWaalsContact O-N 3.08Å
1392	I	71.6	Confident	68.8	Low	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.7	-47.6	171	-69.6	169	0	0	0	110.7	I1345 L1355 F1358 E1359 I1362 L1388 L1389 L1394 L1395 Q1396	I1345-I1392 HydrophobicContact CD1-CD1 3.93Å; I1345-I1392 HydrophobicContact CD1-CG1 4.06Å; I1345-I1392 HydrophobicContact CG1-CG1 4.49Å; L1355-I1392 HydrophobicContact CB-CG2 4.14Å; L1355-I1392 HydrophobicContact CD2-CG1 4.35Å; L1355-I1392 HydrophobicContact CD2-CG2 4.44Å; F1358-I1392 HydrophobicContact CB-CD1 4.07Å; E1359-I1392 HydrophobicContact CB-CD1 4.25Å; I1362-I1392 HydrophobicContact CD1-CD1 3.61Å; L1388-I1392 WeakPolarHBondContact O-CG1 3.4Å; L1388-I1392 PolarHBondContact O-N 2.76Å; L1389-I1392 PolarHBondContact O-N 3.45Å; I1392-L1394 VanDerWaalsContact C-N 3.27Å; I1392-L1394 PolarHBondContact O-N 3.31Å; I1392-L1395 WeakPolarHBondContact O-CB 3.41Å; I1392-L1395 PolarHBondContact O-N 3.2Å; I1392-L1395 VanDerWaalsContact O-N 3.11Å; I1392-Q1396 HydrophobicContact CG2-CG 4.45Å; I1392-Q1396 WeakPolarHBondContact O-CG 3.47Å; I1392-Q1396 PolarHBondContact O-N 3.27Å
1393	R	72.9	Confident	68.5	Low	54 Å²	54	41.7 Å²	41.7	20%	0.204	22%	0.216	C	C	.	.	H	α-helix	trans	-63.9	-30.5	177.5	-64.1	-59.4	174.8	-174.7	3.6	113.1	E1359 L1389 Q1396 M1397 N1398 E1401 L1405	E1359-R1393 IonicContact OE1-CZ 3.75Å; E1359-R1393 IonicContact OE1-NE 3.66Å; E1359-R1393 IonicContact OE1-NH2 3.88Å; E1359-R1393 PolarHBondContact OE1-NH2 2.98Å; E1359-R1393 IonicContact OE2-CZ 2.7Å; E1359-R1393 IonicContact OE2-NH1 2.85Å; E1359-R1393 IonicContact OE2-NH2 2.68Å; E1359-R1393 PolarHBondContact OE2-NH2 3.47Å; L1389-R1393 WeakPolarHBondContact O-CG 3.34Å; L1389-R1393 PolarHBondContact O-N 3.04Å; R1393-Q1396 CarbonylContact O-C 3.48Å; R1393-Q1396 PolarHBondContact O-N 2.91Å; R1393-M1397 PolarHBondContact O-N 3.27Å; R1393-N1398 HydrophobicContact CB-CB 4.47Å; R1393-N1398 PolarHBondContact O-N 3.13Å; R1393-E1401 HydrophobicContact CG-CB 4.37Å; R1393-E1401 IonicContact NE-OE2 3.86Å; R1393-L1405 HydrophobicContact CB-CD1 4.45Å; R1393-L1405 HydrophobicContact CG-CD1 3.76Å
1394	L	68.4	Low	68.6	Low	61 Å²	61	46.5 Å²	46.5	32%	0.319	24%	0.237	S	C	.	.	H	α-helix	trans	-66.4	-43	171.5	-172.1	66.4	0	0	0	112.1	A1390 K1391 I1392 Q1396 M1397	A1390-L1394 WeakPolarHBondContact O-CB 3.23Å; A1390-L1394 PolarHBondContact O-N 3.42Å; K1391-L1394 WeakPolarHBondContact O-CB 3.43Å; K1391-L1394 PolarHBondContact O-N 3.24Å; I1392-L1394 VanDerWaalsContact C-N 3.27Å; I1392-L1394 PolarHBondContact O-N 3.31Å; L1394-Q1396 VanDerWaalsContact C-N 3.32Å; L1394-M1397 PolarHBondContact O-N 3.36Å; L1394-M1397 VanDerWaalsContact O-N 3.16Å
1395	L	67.1	Low	68.5	Low	84 Å²	84	47.5 Å²	47.5	44%	0.44	24%	0.242	S	C	.	.	H	α-helix	trans	-65.4	-35.4	175.2	-68.6	168.8	0	0	0	111.8	I1345 L1355 K1391 I1392 M1397	I1345-L1395 HydrophobicContact CG2-CD1 3.9Å; L1355-L1395 HydrophobicContact CD1-CB 4.11Å; L1355-L1395 HydrophobicContact CD2-CD1 3.97Å; K1391-L1395 WeakPolarHBondContact O-CG 3.36Å; K1391-L1395 PolarHBondContact O-N 3.1Å; K1391-L1395 VanDerWaalsContact O-N 3.08Å; I1392-L1395 WeakPolarHBondContact O-CB 3.41Å; I1392-L1395 PolarHBondContact O-N 3.2Å; I1392-L1395 VanDerWaalsContact O-N 3.11Å; L1395-M1397 PolarHBondContact O-N 3.38Å
1396	Q	70.6	Confident	68.3	Low	34 Å²	34	47.5 Å²	47.5	16%	0.159	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	4.1	173	-66.9	178.4	-13.6	0	0	114.4	L1355 N1356 I1392 R1393 L1394 N1398	L1355-Q1396 HydrophobicContact CD1-CG 4.04Å; N1356-Q1396 PolarHBondContact OD1-NE2 2.89Å; N1356-Q1396 VanDerWaalsContact OD1-NE2 3.1Å; I1392-Q1396 HydrophobicContact CG2-CG 4.45Å; I1392-Q1396 WeakPolarHBondContact O-CG 3.47Å; I1392-Q1396 PolarHBondContact O-N 3.27Å; R1393-Q1396 CarbonylContact O-C 3.48Å; R1393-Q1396 PolarHBondContact O-N 2.91Å; L1394-Q1396 VanDerWaalsContact C-N 3.32Å; Q1396-N1398 VanDerWaalsContact C-N 3.27Å; Q1396-N1398 PolarHBondContact O-N 2.83Å
1397	M	58.8	Low	68	Low	152 Å²	152	48.9 Å²	48.9	75%	0.749	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	65	12.1	-178.6	-60	-77.6	-178.8	0	0	116.6	R1393 L1394 L1395 T1399	R1393-M1397 PolarHBondContact O-N 3.27Å; L1394-M1397 PolarHBondContact O-N 3.36Å; L1394-M1397 VanDerWaalsContact O-N 3.16Å; L1395-M1397 PolarHBondContact O-N 3.38Å; M1397-T1399 PolarHBondContact O-N 2.65Å; M1397-T1399 VanDerWaalsContact O-N 3.11Å
1398	N	65.1	Low	67.6	Low	69 Å²	69	51.8 Å²	51.8	37%	0.369	26%	0.262	S	S	.	.			trans	-83.1	81.2	176.1	-90	6.8	0	0	0	112	R1393 Q1396 S1400 E1401 H1402	R1393-N1398 HydrophobicContact CB-CB 4.47Å; R1393-N1398 PolarHBondContact O-N 3.13Å; Q1396-N1398 VanDerWaalsContact C-N 3.27Å; Q1396-N1398 PolarHBondContact O-N 2.83Å; N1398-S1400 PolarHBondContact O-N 2.79Å; N1398-E1401 HydrophobicContact CB-CB 4.43Å; N1398-E1401 PolarHBondContact ND2-OE2 3.45Å; N1398-E1401 PolarHBondContact O-N 3.29Å; N1398-H1402 WeakPolarHBondContact O-CB 3.5Å; N1398-H1402 PolarHBondContact O-N 2.98Å
1399	T	59.7	Low	67.2	Low	89 Å²	89	51.8 Å²	51.8	55%	0.546	26%	0.262	S	S	.	.	H	α-helix	trans	-64.7	-35.4	-173.4	56.6	0	0	0	0	114.7	M1397 H1402 E1403	M1397-T1399 PolarHBondContact O-N 2.65Å; M1397-T1399 VanDerWaalsContact O-N 3.11Å; T1399-H1402 PolarHBondContact O-N 2.88Å; T1399-E1403 PolarHBondContact O-N 3.21Å
1400	S	60.2	Low	66.6	Low	88 Å²	88	51.7 Å²	51.7	62%	0.615	26%	0.261	S	S	*	.	H	α-helix	trans	-69.6	-37.3	-179.5	50.9	0	0	0	0	113.3	N1398 F1404	N1398-S1400 PolarHBondContact O-N 2.79Å; S1400-F1404 PolarHBondContact O-N 3.3Å
1401	E	66.1	Low	66.3	Low	83 Å²	83	55 Å²	55	39%	0.388	28%	0.284	S	S	.	.	H	α-helix	trans	-75.5	-37.8	175.9	-64.5	-178.5	143.7	0	0	110.9	R1393 N1398 F1404 L1405	R1393-E1401 HydrophobicContact CG-CB 4.37Å; R1393-E1401 IonicContact NE-OE2 3.86Å; N1398-E1401 HydrophobicContact CB-CB 4.43Å; N1398-E1401 PolarHBondContact ND2-OE2 3.45Å; N1398-E1401 PolarHBondContact O-N 3.29Å; E1401-F1404 PolarHBondContact O-N 3.48Å; E1401-L1405 WeakPolarHBondContact O-CB 3.31Å; E1401-L1405 VanDerWaalsContact O-CG 3.26Å; E1401-L1405 WeakPolarHBondContact O-CG 3.48Å; E1401-L1405 PolarHBondContact O-N 3.14Å
1402	H	69.1	Low	65.8	Low	3 Å²	3	54.4 Å²	54.4	1%	0.014	28%	0.282	C	S	.	.	H	α-helix	trans	-55.7	-51	171.3	169.1	75.4	0	0	0	112	A1390 N1398 T1399 F1404 L1405 M1406 S1434	A1390-H1402 PolarHBondContact O-ND1 2.82Å; N1398-H1402 WeakPolarHBondContact O-CB 3.5Å; N1398-H1402 PolarHBondContact O-N 2.98Å; T1399-H1402 PolarHBondContact O-N 2.88Å; H1402-F1404 VanDerWaalsContact C-N 3.34Å; H1402-F1404 PolarHBondContact O-N 3.49Å; H1402-L1405 PolarHBondContact O-N 2.79Å; H1402-M1406 VanDerWaalsContact CE1-CG 3.44Å; H1402-M1406 WeakPolarHBondContact CE1-CG 3.47Å; H1402-M1406 WeakPolarHBondContact O-CB 3.33Å; H1402-M1406 VanDerWaalsContact O-CG 3.29Å; H1402-M1406 WeakPolarHBondContact O-CG 3.44Å; H1402-M1406 PolarHBondContact O-N 3.04Å; H1402-S1434 PolarHBondContact NE2-OG 3.43Å
1403	E	64	Low	65.4	Low	54 Å²	54	54.8 Å²	54.8	25%	0.252	29%	0.285	S	S	.	.	H	α-helix	trans	-57.4	-47	176.7	-80.4	-173.7	-145.3	0	0	111.4	T1399 M1406 F1407 L1431 L1435 R1460	T1399-E1403 PolarHBondContact O-N 3.21Å; E1403-M1406 PolarHBondContact O-N 2.98Å; E1403-F1407 WeakPolarHBondContact O-CD2 3.49Å; E1403-F1407 PolarHBondContact O-N 3.39Å; E1403-L1431 HydrophobicContact CG-CD1 4.41Å; E1403-L1435 HydrophobicContact CG-CD2 4.37Å; E1403-R1460 IonicContact OE2-NH1 3.96Å
1404	F	68.6	Low	64.5	Low	101 Å²	101	55.7 Å²	55.7	44%	0.443	29%	0.292	S	S	.	.	H	α-helix	trans	-60.5	-49.2	-180	178	-96.8	0	0	0	112.4	S1400 E1401 H1402 F1407 Q1408	S1400-F1404 PolarHBondContact O-N 3.3Å; E1401-F1404 PolarHBondContact O-N 3.48Å; H1402-F1404 VanDerWaalsContact C-N 3.34Å; H1402-F1404 PolarHBondContact O-N 3.49Å; F1404-F1407 PolarHBondContact O-N 3.49Å; F1404-Q1408 WeakPolarHBondContact O-CB 3.35Å; F1404-Q1408 PolarHBondContact O-N 2.88Å
1405	L	65.9	Low	63.7	Low	24 Å²	24	54.8 Å²	54.8	13%	0.126	29%	0.293	C	S	.	.	H	α-helix	trans	-66.3	-37.6	-179.8	-68.4	167.9	0	0	0	112	M1386 L1389 A1390 R1393 E1401 H1402 Q1408 A1409	M1386-L1405 HydrophobicContact CE-CD2 3.47Å; M1386-L1405 VanDerWaalsContact CE-CD2 3.47Å; M1386-L1405 HydrophobicContact SD-CD2 4.25Å; L1389-L1405 HydrophobicContact CB-CD1 4.15Å; A1390-L1405 HydrophobicContact CB-CB 3.62Å; R1393-L1405 HydrophobicContact CB-CD1 4.45Å; R1393-L1405 HydrophobicContact CG-CD1 3.76Å; E1401-L1405 WeakPolarHBondContact O-CB 3.31Å; E1401-L1405 VanDerWaalsContact O-CG 3.26Å; E1401-L1405 WeakPolarHBondContact O-CG 3.48Å; E1401-L1405 PolarHBondContact O-N 3.14Å; H1402-L1405 PolarHBondContact O-N 2.79Å; L1405-Q1408 PolarHBondContact O-N 3.4Å; L1405-A1409 WeakPolarHBondContact O-CB 3.35Å; L1405-A1409 PolarHBondContact O-N 2.99Å
1406	M	66.8	Low	62.7	Low	1 Å²	1	52.6 Å²	52.6	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-63.5	-45.3	172.4	-75.4	-60.6	-67.8	0	0	112.2	Y1387 A1390 H1402 E1403 Q1408 A1409 I1410 W1427 I1430 L1431	Y1387-M1406 HydrophobicContact CD2-CE 4.45Å; Y1387-M1406 HydrophobicContact CD2-SD 3.96Å; A1390-M1406 HydrophobicContact CB-CG 3.8Å; A1390-M1406 HydrophobicContact CB-SD 3.78Å; H1402-M1406 VanDerWaalsContact CE1-CG 3.44Å; H1402-M1406 WeakPolarHBondContact CE1-CG 3.47Å; H1402-M1406 WeakPolarHBondContact O-CB 3.33Å; H1402-M1406 VanDerWaalsContact O-CG 3.29Å; H1402-M1406 WeakPolarHBondContact O-CG 3.44Å; H1402-M1406 PolarHBondContact O-N 3.04Å; E1403-M1406 PolarHBondContact O-N 2.98Å; M1406-Q1408 VanDerWaalsContact C-N 3.28Å; M1406-Q1408 PolarHBondContact O-N 3.28Å; M1406-A1409 PolarHBondContact O-N 2.8Å; M1406-I1410 WeakPolarHBondContact O-CB 3.32Å; M1406-I1410 WeakPolarHBondContact O-CG1 3.43Å; M1406-I1410 PolarHBondContact O-N 3.33Å; M1406-W1427 HydrophobicContact CE-CB 3.59Å; M1406-W1427 HydrophobicContact CE-CG 4.06Å; M1406-W1427 WeakPolarHBondContact CE-O 3.49Å; M1406-I1430 HydrophobicContact CE-CG2 4.49Å; M1406-L1431 HydrophobicContact CB-CD1 3.9Å; M1406-L1431 HydrophobicContact CE-CB 4.46Å; M1406-L1431 HydrophobicContact CG-CD1 4.35Å
1407	F	65.7	Low	61.2	Low	53 Å²	53	60.9 Å²	60.9	23%	0.232	32%	0.321	C	S	.	.	H	α-helix	trans	-63	-36.4	175.4	-81.6	-60.9	0	0	0	111.8	E1403 F1404 S1411 L1431	E1403-F1407 WeakPolarHBondContact O-CD2 3.49Å; E1403-F1407 PolarHBondContact O-N 3.39Å; F1404-F1407 PolarHBondContact O-N 3.49Å; F1407-S1411 VanDerWaalsContact O-CB 3.23Å; F1407-S1411 WeakPolarHBondContact O-CB 3.27Å; F1407-S1411 PolarHBondContact O-N 3.38Å; F1407-L1431 HydrophobicContact CD1-CD2 4.19Å; F1407-L1431 HydrophobicContact CE1-CD2 3.76Å; F1407-L1431 HydrophobicContact CE2-CD2 4.33Å; F1407-L1431 HydrophobicContact CZ-CD2 3.83Å
1408	Q	67.1	Low	60.1	Low	68 Å²	68	55 Å²	55	32%	0.318	30%	0.3	S	S	.	.	H	α-helix	trans	-70.2	-41.4	176.3	-164.9	166.2	1.5	0	0	112	M1386 F1404 L1405 M1406 S1411 E1412	M1386-Q1408 HydrophobicContact CE-CB 4.1Å; M1386-Q1408 HydrophobicContact CE-CG 3.82Å; F1404-Q1408 WeakPolarHBondContact O-CB 3.35Å; F1404-Q1408 PolarHBondContact O-N 2.88Å; L1405-Q1408 PolarHBondContact O-N 3.4Å; M1406-Q1408 VanDerWaalsContact C-N 3.28Å; M1406-Q1408 PolarHBondContact O-N 3.28Å; Q1408-S1411 PolarHBondContact O-N 2.96Å; Q1408-E1412 WeakPolarHBondContact O-CG 3.4Å; Q1408-E1412 PolarHBondContact O-N 2.84Å
1409	A	64.4	Low	58.8	Low	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-59.1	-48.5	173.2	0	0	0	0	0	112	A1383 M1386 L1405 M1406 S1411 E1412 C1413 W1427	A1383-A1409 VanDerWaalsContact CB-O 3.27Å; A1383-A1409 WeakPolarHBondContact CB-O 3.45Å; A1383-A1409 WeakPolarHBondContact O-CB 3.06Å; M1386-A1409 HydrophobicContact CB-CB 3.94Å; L1405-A1409 WeakPolarHBondContact O-CB 3.35Å; L1405-A1409 PolarHBondContact O-N 2.99Å; M1406-A1409 PolarHBondContact O-N 2.8Å; A1409-S1411 VanDerWaalsContact C-N 3.33Å; A1409-S1411 PolarHBondContact O-N 3.38Å; A1409-E1412 PolarHBondContact O-N 2.88Å; A1409-C1413 VanDerWaalsContact O-CB 3.31Å; A1409-C1413 WeakPolarHBondContact O-CB 3.46Å; A1409-C1413 PolarHBondContact O-N 3.13Å; A1409-W1427 HydrophobicContact CB-CE3 4.35Å; A1409-W1427 HydrophobicContact CB-CZ3 4.06Å
1410	I	64.8	Low	58	Low	10 Å²	10	56.4 Å²	56.4	5%	0.051	30%	0.296	C	S	.	.	H	α-helix	trans	-62.8	-40.3	176	-66.9	165	0	0	0	110.7	M1406 C1413 M1414 I1424 W1427 L1428 L1431	M1406-I1410 WeakPolarHBondContact O-CB 3.32Å; M1406-I1410 WeakPolarHBondContact O-CG1 3.43Å; M1406-I1410 PolarHBondContact O-N 3.33Å; I1410-C1413 PolarHBondContact O-N 3.5Å; I1410-M1414 HydrophobicContact CG2-CE 3.81Å; I1410-M1414 HydrophobicContact CG2-SD 4.23Å; I1410-M1414 WeakPolarHBondContact O-CB 3.37Å; I1410-M1414 WeakPolarHBondContact O-CG 3.07Å; I1410-M1414 PolarHBondContact O-N 3.07Å; I1410-I1424 HydrophobicContact CG2-CG2 4.41Å; I1410-W1427 HydrophobicContact CD1-CB 4.45Å; I1410-W1427 HydrophobicContact CG1-CB 4.37Å; I1410-W1427 HydrophobicContact CG1-CE3 4.21Å; I1410-L1428 HydrophobicContact CD1-CD2 4.03Å; I1410-L1428 HydrophobicContact CD1-CG 4.37Å; I1410-L1431 HydrophobicContact CD1-CD2 3.97Å
1411	S	63.5	Low	57.3	Low	68 Å²	68	52.6 Å²	52.6	48%	0.476	27%	0.268	S	S	.	.	H	α-helix	trans	-66.7	-43.1	179.1	-171.3	0	0	0	0	113.2	F1407 Q1408 A1409 C1413 M1414 A1415	F1407-S1411 VanDerWaalsContact O-CB 3.23Å; F1407-S1411 WeakPolarHBondContact O-CB 3.27Å; F1407-S1411 PolarHBondContact O-N 3.38Å; Q1408-S1411 PolarHBondContact O-N 2.96Å; A1409-S1411 VanDerWaalsContact C-N 3.33Å; A1409-S1411 PolarHBondContact O-N 3.38Å; S1411-C1413 VanDerWaalsContact C-N 3.35Å; S1411-M1414 PolarHBondContact O-N 3.06Å; S1411-A1415 WeakPolarHBondContact O-CB 3.47Å; S1411-A1415 PolarHBondContact O-N 2.87Å; S1411-A1415 VanDerWaalsContact O-N 3.16Å
1412	E	62.3	Low	56.5	Low	46 Å²	46	49.6 Å²	49.6	22%	0.215	26%	0.256	C	S	.	.	H	α-helix	trans	-66.9	-38.2	176.7	-70.1	-65.3	167.7	0	0	111	R1379 L1382 A1383 Q1408 A1409 M1414 A1415	R1379-E1412 IonicContact NE-OE2 3.76Å; R1379-E1412 PolarHBondContact NE-OE2 3.2Å; L1382-E1412 HydrophobicContact CD2-CG 4.11Å; A1383-E1412 HydrophobicContact CB-CB 4.22Å; Q1408-E1412 WeakPolarHBondContact O-CG 3.4Å; Q1408-E1412 PolarHBondContact O-N 2.84Å; A1409-E1412 PolarHBondContact O-N 2.88Å; E1412-M1414 VanDerWaalsContact C-N 3.33Å; E1412-M1414 PolarHBondContact O-N 2.9Å; E1412-A1415 PolarHBondContact O-N 3.36Å
1413	C	61.4	Low	55.6	Low	8 Å²	8	49.6 Å²	49.6	5%	0.054	26%	0.256	C	S	.	.	H	α-helix	trans	-67.3	-31.3	176.8	-158.1	0	0	0	0	112.8	A1383 A1409 I1410 S1411 H1421 I1424 W1427	A1383-C1413 HydrophobicContact CB-CB 3.87Å; A1409-C1413 VanDerWaalsContact O-CB 3.31Å; A1409-C1413 WeakPolarHBondContact O-CB 3.46Å; A1409-C1413 PolarHBondContact O-N 3.13Å; I1410-C1413 PolarHBondContact O-N 3.5Å; S1411-C1413 VanDerWaalsContact C-N 3.35Å; C1413-H1421 VanDerWaalsContact SG-CB 3.53Å; C1413-I1424 HydrophobicContact CB-CD1 4.14Å; C1413-I1424 HydrophobicContact CB-CG1 4.22Å; C1413-W1427 HydrophobicContact CB-CZ3 4.33Å
1414	M	55.3	Low	55.2	Low	73 Å²	73	47.1 Å²	47.1	36%	0.36	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-3.2	174.6	-67.6	-168.6	-50.5	0	0	114.7	I1410 S1411 E1412 Y1420 I1424 W1467	I1410-M1414 HydrophobicContact CG2-CE 3.81Å; I1410-M1414 HydrophobicContact CG2-SD 4.23Å; I1410-M1414 WeakPolarHBondContact O-CB 3.37Å; I1410-M1414 WeakPolarHBondContact O-CG 3.07Å; I1410-M1414 PolarHBondContact O-N 3.07Å; S1411-M1414 PolarHBondContact O-N 3.06Å; E1412-M1414 VanDerWaalsContact C-N 3.33Å; E1412-M1414 PolarHBondContact O-N 2.9Å; M1414-Y1420 HydrophobicContact CG-CE1 4.39Å; M1414-Y1420 HydrophobicContact SD-CE1 4.09Å; M1414-I1424 HydrophobicContact CG-CD1 4.15Å; M1414-W1467 HydrophobicContact CE-CZ3 4.44Å; M1414-W1467 HydrophobicContact SD-CZ3 3.76Å
1415	A	52.2	Low	54.3	Low	42 Å²	42	42.3 Å²	42.3	35%	0.347	22%	0.223	S	C	.	.	S	Bend	trans	-83.2	-10.3	-175.3	0	0	0	0	0	114.2	R1379 S1411 E1412	R1379-A1415 PolarHBondContact NH1-O 3.32Å; S1411-A1415 WeakPolarHBondContact O-CB 3.47Å; S1411-A1415 PolarHBondContact O-N 2.87Å; S1411-A1415 VanDerWaalsContact O-N 3.16Å; E1412-A1415 PolarHBondContact O-N 3.36Å
1416	D	45.5	Very low	53.8	Low	38 Å²	38	44.8 Å²	44.8	20%	0.203	23%	0.234	C	C	.	.	S	Bend	trans	-98.9	144.6	172.8	-70.9	-22.3	0	0	0	111.5	R1379 G1418 R1533	R1379-D1416 WeakPolarHBondContact CB-OD2 3.32Å; R1379-D1416 WeakPolarHBondContact CD-OD1 3.47Å; R1379-D1416 IonicContact CZ-OD1 3.48Å; R1379-D1416 IonicContact NE-OD1 2.88Å; R1379-D1416 IonicContact NH1-OD1 2.76Å; R1379-D1416 PolarHBondContact NH1-OD1 3.16Å; D1416-G1418 PolarHBondContact O-N 3.29Å; D1416-G1418 VanDerWaalsContact O-N 3.13Å; D1416-R1533 IonicContact OD1-NH1 3.35Å; D1416-R1533 PolarHBondContact OD1-NH1 2.74Å; D1416-R1533 VanDerWaalsContact OD2-CD 3.24Å; D1416-R1533 WeakPolarHBondContact OD2-CD 3.43Å; D1416-R1533 IonicContact OD2-CZ 2.7Å; D1416-R1533 IonicContact OD2-NE 3.71Å; D1416-R1533 IonicContact OD2-NH1 2.71Å; D1416-R1533 PolarHBondContact OD2-NH1 2.76Å
1417	Q	38	Very low	53.6	Low	209 Å²	209	44.8 Å²	44.8	98%	0.977	23%	0.234	S	C	*	.	S	Bend	trans	-82.5	98.1	-162	-66.4	-168.1	10.5	0	0	113.6
1418	G	37.4	Very low	53.3	Low	29 Å²	29	42.7 Å²	42.7	30%	0.299	23%	0.226	S	C	.	.	S	Bend	trans	121.6	-8.6	143.7	0	0	0	0	0	117.8	D1416	D1416-G1418 PolarHBondContact O-N 3.29Å; D1416-G1418 VanDerWaalsContact O-N 3.13Å
1419	E	37.2	Very low	52.7	Low	133 Å²	133	41.1 Å²	41.1	62%	0.621	22%	0.219	S	C	*	.			trans	-119.4	113	177.6	-70.8	174.9	-162.7	0	0	109.8
1420	Y	41.6	Very low	52.5	Low	54 Å²	54	43.5 Å²	43.5	21%	0.212	23%	0.231	C	C	.	.			trans	-69.9	136.4	170.9	-82.3	-92.8	0	0	0	109.7	M1414 I1424 I1471 I1480 Y1537	M1414-Y1420 HydrophobicContact CG-CE1 4.39Å; M1414-Y1420 HydrophobicContact SD-CE1 4.09Å; Y1420-I1424 HydrophobicContact CD1-CD1 3.79Å; Y1420-I1424 HydrophobicContact CD1-CG2 4.5Å; Y1420-I1471 HydrophobicContact CD1-CD1 3.87Å; Y1420-I1471 HydrophobicContact CD1-CG1 4.38Å; Y1420-I1471 HydrophobicContact CE1-CD1 4.05Å; Y1420-I1480 HydrophobicContact CE2-CD1 4.05Å; Y1420-Y1537 WeakPolarHBondContact O-CE2 3.31Å; Y1420-Y1537 PolarHBondContact O-OH 3.27Å; Y1420-Y1537 VanDerWaalsContact O-OH 3.12Å
1421	H	46.8	Very low	52.5	Low	7 Å²	7	43 Å²	43	3%	0.032	23%	0.228	C	C	.	.			trans	-78.7	135.7	164.5	-149.8	-70.6	0	0	0	108.4	C1413 L1423 I1424 T1535 S1536	C1413-H1421 VanDerWaalsContact SG-CB 3.53Å; H1421-L1423 WeakPolarHBondContact CE1-CD1 3.4Å; H1421-L1423 VanDerWaalsContact ND1-CG 3.32Å; H1421-L1423 WeakPolarHBondContact ND1-CG 3.38Å; H1421-L1423 PolarHBondContact O-N 3.22Å; H1421-I1424 HydrophobicContact CB-CD1 4.22Å; H1421-I1424 HydrophobicContact CB-CG1 4.17Å; H1421-I1424 WeakPolarHBondContact O-CB 3.46Å; H1421-I1424 VanDerWaalsContact O-CG1 3.24Å; H1421-I1424 WeakPolarHBondContact O-CG1 3.48Å; H1421-I1424 PolarHBondContact O-N 3.02Å; H1421-T1535 PolarHBondContact CD2-O 3.34Å; H1421-S1536 PolarHBondContact CD2-N 3.09Å; H1421-S1536 PolarHBondContact CD2-O 3.05Å; H1421-S1536 PolarHBondContact CE1-O 3.07Å; H1421-S1536 PolarHBondContact CE1-OG 2.93Å; H1421-S1536 PolarHBondContact ND1-O 3.4Å; H1421-S1536 VanDerWaalsContact ND1-O 3.11Å; H1421-S1536 PolarHBondContact NE2-N 3.46Å; H1421-S1536 PolarHBondContact NE2-O 3.37Å; H1421-S1536 PolarHBondContact NE2-OG 2.8Å
1422	P	48.9	Very low	52.2	Low	20 Å²	20	39.8 Å²	39.8	13%	0.13	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-22.5	179.9	26.8	-31.6	0	0	0	112.3	I1424 A1425 E1426 S1536 Y1537 N1538	P1422-I1424 PolarHBondContact O-N 3.18Å; P1422-A1425 WeakPolarHBondContact O-CA 3.17Å; P1422-A1425 WeakPolarHBondContact O-CB 3.46Å; P1422-A1425 PolarHBondContact O-N 3.43Å; P1422-E1426 PolarHBondContact O-N 3.22Å; P1422-S1536 WeakPolarHBondContact CD-O 3.35Å; P1422-Y1537 HydrophobicContact CB-CD1 3.44Å; P1422-Y1537 VanDerWaalsContact CB-CD1 3.44Å; P1422-Y1537 HydrophobicContact CB-CE1 3.56Å; P1422-Y1537 HydrophobicContact CB-CG 4.38Å; P1422-Y1537 VanDerWaalsContact CD-CA 3.46Å; P1422-Y1537 HydrophobicContact CG-CD1 3.31Å; P1422-Y1537 HydrophobicContact CG-CE1 3.9Å; P1422-Y1537 HydrophobicContact CG-CG 3.79Å; P1422-N1538 VanDerWaalsContact CG-N 3.29Å; P1422-N1538 WeakPolarHBondContact CG-O 3.4Å
1423	L	50.7	Low	51.8	Low	4 Å²	4	42 Å²	42	2%	0.021	22%	0.219	C	C	.	.	H	α-helix	trans	-56.5	-25.9	167.3	-58.7	-176.9	0	0	0	110.8	H1421 A1425 E1426 W1427	H1421-L1423 WeakPolarHBondContact CE1-CD1 3.4Å; H1421-L1423 VanDerWaalsContact ND1-CG 3.32Å; H1421-L1423 WeakPolarHBondContact ND1-CG 3.38Å; H1421-L1423 PolarHBondContact O-N 3.22Å; L1423-A1425 VanDerWaalsContact C-N 3.3Å; L1423-A1425 PolarHBondContact O-N 2.75Å; L1423-E1426 VanDerWaalsContact CD2-OE2 3.25Å; L1423-E1426 WeakPolarHBondContact CD2-OE2 3.28Å; L1423-E1426 PolarHBondContact O-N 3.42Å; L1423-W1427 HydrophobicContact CB-CD2 4.33Å; L1423-W1427 HydrophobicContact CB-CZ2 4.05Å; L1423-W1427 HydrophobicContact CD1-CZ2 4.23Å; L1423-W1427 WeakPolarHBondContact O-CB 3.14Å; L1423-W1427 PolarHBondContact O-N 3.34Å
1424	I	55.7	Low	51.7	Low	1 Å²	1	42.9 Å²	42.9	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-60	-40.1	170.5	-60.6	167.9	0	0	0	110.9	I1410 C1413 M1414 Y1420 H1421 P1422 W1427 L1428 I1471	I1410-I1424 HydrophobicContact CG2-CG2 4.41Å; C1413-I1424 HydrophobicContact CB-CD1 4.14Å; C1413-I1424 HydrophobicContact CB-CG1 4.22Å; M1414-I1424 HydrophobicContact CG-CD1 4.15Å; Y1420-I1424 HydrophobicContact CD1-CD1 3.79Å; Y1420-I1424 HydrophobicContact CD1-CG2 4.5Å; H1421-I1424 HydrophobicContact CB-CD1 4.22Å; H1421-I1424 HydrophobicContact CB-CG1 4.17Å; H1421-I1424 WeakPolarHBondContact O-CB 3.46Å; H1421-I1424 VanDerWaalsContact O-CG1 3.24Å; H1421-I1424 WeakPolarHBondContact O-CG1 3.48Å; H1421-I1424 PolarHBondContact O-N 3.02Å; P1422-I1424 PolarHBondContact O-N 3.18Å; I1424-W1427 PolarHBondContact O-N 3.15Å; I1424-L1428 HydrophobicContact CG2-CD1 3.79Å; I1424-L1428 HydrophobicContact CG2-CG 4.14Å; I1424-L1428 VanDerWaalsContact O-CB 3.23Å; I1424-L1428 WeakPolarHBondContact O-CB 3.37Å; I1424-L1428 WeakPolarHBondContact O-CD1 3.17Å; I1424-L1428 WeakPolarHBondContact O-CG 3.24Å; I1424-L1428 PolarHBondContact O-N 3.31Å; I1424-I1471 HydrophobicContact CG2-CD1 4.36Å
1425	A	50.1	Low	51.8	Low	1 Å²	1	40.4 Å²	40.4	1%	0.008	21%	0.213	C	C	.	.	H	α-helix	trans	-67	-43	176.7	0	0	0	0	0	111.4	P1422 L1423 L1428 I1429 I1471 M1472	P1422-A1425 WeakPolarHBondContact O-CA 3.17Å; P1422-A1425 WeakPolarHBondContact O-CB 3.46Å; P1422-A1425 PolarHBondContact O-N 3.43Å; L1423-A1425 VanDerWaalsContact C-N 3.3Å; L1423-A1425 PolarHBondContact O-N 2.75Å; A1425-L1428 PolarHBondContact O-N 3.37Å; A1425-I1429 WeakPolarHBondContact O-CD1 3.28Å; A1425-I1429 VanDerWaalsContact O-CG1 3.26Å; A1425-I1429 WeakPolarHBondContact O-CG1 3.37Å; A1425-I1429 PolarHBondContact O-N 3.41Å; A1425-I1471 HydrophobicContact CB-CG2 4.17Å; A1425-M1472 HydrophobicContact CB-CE 4.03Å; A1425-M1472 HydrophobicContact CB-CG 4.14Å
1426	E	53.8	Low	51.9	Low	75 Å²	75	41.9 Å²	41.9	35%	0.35	21%	0.213	S	C	.	.	H	α-helix	trans	-61.9	-45.9	174.5	-166.9	-174.4	-179.7	0	0	111.7	P1422 L1423 I1429 I1430	P1422-E1426 PolarHBondContact O-N 3.22Å; L1423-E1426 VanDerWaalsContact CD2-OE2 3.25Å; L1423-E1426 WeakPolarHBondContact CD2-OE2 3.28Å; L1423-E1426 PolarHBondContact O-N 3.42Å; E1426-I1429 WeakPolarHBondContact O-CB 3.43Å; E1426-I1429 PolarHBondContact O-N 3.31Å; E1426-I1430 HydrophobicContact CG-CD1 4.19Å; E1426-I1430 WeakPolarHBondContact O-CG1 3.45Å; E1426-I1430 PolarHBondContact O-N 3.01Å
1427	W	63.9	Low	52	Low	1 Å²	1	47.3 Å²	47.3	0%	0.004	24%	0.235	C	C	.	.	H	α-helix	trans	-65.1	-38.9	177.8	-67	-2.4	0	0	0	112.4	A1383 I1384 Y1387 M1406 A1409 I1410 C1413 L1423 I1424 I1429 I1430 L1431	A1383-W1427 HydrophobicContact CB-CH2 4.1Å; A1383-W1427 HydrophobicContact CB-CZ3 4.1Å; I1384-W1427 HydrophobicContact CG1-CH2 4.22Å; I1384-W1427 HydrophobicContact CG1-CZ2 4.25Å; Y1387-W1427 AromaticContact CD1-CE2 3.95Å; Y1387-W1427 AromaticContact CD1-CZ2 3.84Å; Y1387-W1427 HydrophobicContact CD1-CZ2 3.84Å; Y1387-W1427 AromaticContact CD1-NE1 3.75Å; Y1387-W1427 AromaticContact CD2-CD1 3.65Å; Y1387-W1427 HydrophobicContact CD2-CD2 4.28Å; Y1387-W1427 AromaticContact CD2-CE2 3.78Å; Y1387-W1427 HydrophobicContact CD2-CG 4.21Å; Y1387-W1427 HydrophobicContact CD2-CZ2 4.39Å; Y1387-W1427 AromaticContact CD2-NE1 3.33Å; Y1387-W1427 VanDerWaalsContact CD2-NE1 3.33Å; Y1387-W1427 AromaticContact CE1-NE1 3.87Å; Y1387-W1427 AromaticContact CE2-CD1 3.7Å; Y1387-W1427 AromaticContact CE2-NE1 3.49Å; Y1387-W1427 HydrophobicContact CG-CD2 4.33Å; Y1387-W1427 AromaticContact CG-CE2 3.55Å; Y1387-W1427 AromaticContact CG-CZ2 3.7Å; Y1387-W1427 HydrophobicContact CG-CZ2 3.7Å; Y1387-W1427 AromaticContact CG-NE1 3.48Å; Y1387-W1427 AromaticContact CZ-NE1 3.76Å; M1406-W1427 HydrophobicContact CE-CB 3.59Å; M1406-W1427 HydrophobicContact CE-CG 4.06Å; M1406-W1427 WeakPolarHBondContact CE-O 3.49Å; A1409-W1427 HydrophobicContact CB-CE3 4.35Å; A1409-W1427 HydrophobicContact CB-CZ3 4.06Å; I1410-W1427 HydrophobicContact CD1-CB 4.45Å; I1410-W1427 HydrophobicContact CG1-CB 4.37Å; I1410-W1427 HydrophobicContact CG1-CE3 4.21Å; C1413-W1427 HydrophobicContact CB-CZ3 4.33Å; L1423-W1427 HydrophobicContact CB-CD2 4.33Å; L1423-W1427 HydrophobicContact CB-CZ2 4.05Å; L1423-W1427 HydrophobicContact CD1-CZ2 4.23Å; L1423-W1427 WeakPolarHBondContact O-CB 3.14Å; L1423-W1427 PolarHBondContact O-N 3.34Å; I1424-W1427 PolarHBondContact O-N 3.15Å; W1427-I1429 VanDerWaalsContact C-N 3.32Å; W1427-I1430 PolarHBondContact O-N 3.08Å; W1427-L1431 WeakPolarHBondContact O-CB 3.43Å; W1427-L1431 PolarHBondContact O-N 3.26Å
1428	L	58.1	Low	52.2	Low	10 Å²	10	41.4 Å²	41.4	5%	0.052	22%	0.215	C	C	.	.	H	α-helix	trans	-65.2	-35.6	172.7	-77	169.3	0	0	0	111.8	I1410 I1424 A1425 A1432 C1464 W1467 I1471	I1410-L1428 HydrophobicContact CD1-CD2 4.03Å; I1410-L1428 HydrophobicContact CD1-CG 4.37Å; I1424-L1428 HydrophobicContact CG2-CD1 3.79Å; I1424-L1428 HydrophobicContact CG2-CG 4.14Å; I1424-L1428 VanDerWaalsContact O-CB 3.23Å; I1424-L1428 WeakPolarHBondContact O-CB 3.37Å; I1424-L1428 WeakPolarHBondContact O-CD1 3.17Å; I1424-L1428 WeakPolarHBondContact O-CG 3.24Å; I1424-L1428 PolarHBondContact O-N 3.31Å; A1425-L1428 PolarHBondContact O-N 3.37Å; L1428-A1432 WeakPolarHBondContact O-CB 3.41Å; L1428-A1432 PolarHBondContact O-N 3.16Å; L1428-C1464 HydrophobicContact CB-CB 4.37Å; L1428-C1464 HydrophobicContact CD2-CB 3.97Å; L1428-W1467 HydrophobicContact CD1-CB 3.79Å; L1428-I1471 HydrophobicContact CD1-CD1 4.25Å
1429	I	55.1	Low	52.5	Low	35 Å²	35	44.1 Å²	44.1	18%	0.179	23%	0.227	C	C	.	.	H	α-helix	trans	-69.3	-46.7	174	-69.1	163.3	0	0	0	110.4	A1425 E1426 W1427 L1431 A1432 L1433 L1465 I1580	A1425-I1429 WeakPolarHBondContact O-CD1 3.28Å; A1425-I1429 VanDerWaalsContact O-CG1 3.26Å; A1425-I1429 WeakPolarHBondContact O-CG1 3.37Å; A1425-I1429 PolarHBondContact O-N 3.41Å; E1426-I1429 WeakPolarHBondContact O-CB 3.43Å; E1426-I1429 PolarHBondContact O-N 3.31Å; W1427-I1429 VanDerWaalsContact C-N 3.32Å; I1429-L1431 VanDerWaalsContact C-N 3.32Å; I1429-L1431 PolarHBondContact O-N 2.91Å; I1429-A1432 PolarHBondContact O-N 2.81Å; I1429-L1433 HydrophobicContact CG2-CD1 3.99Å; I1429-L1433 VanDerWaalsContact O-CG 3.29Å; I1429-L1433 WeakPolarHBondContact O-CG 3.44Å; I1429-L1433 PolarHBondContact O-N 3.16Å; I1429-L1465 HydrophobicContact CG1-CD2 4.26Å; I1429-I1580 HydrophobicContact CD1-CG2 4.06Å
1430	I	60.1	Low	52.5	Low	49 Å²	49	45.9 Å²	45.9	25%	0.251	24%	0.24	S	C	.	.	H	α-helix	trans	-58.2	-44.7	175.7	-68.7	165	0	0	0	110.8	Y1387 M1406 E1426 W1427 L1433 S1434	Y1387-I1430 HydrophobicContact CE2-CD1 4.41Å; M1406-I1430 HydrophobicContact CE-CG2 4.49Å; E1426-I1430 HydrophobicContact CG-CD1 4.19Å; E1426-I1430 WeakPolarHBondContact O-CG1 3.45Å; E1426-I1430 PolarHBondContact O-N 3.01Å; W1427-I1430 PolarHBondContact O-N 3.08Å; I1430-L1433 PolarHBondContact O-N 2.98Å; I1430-S1434 PolarHBondContact O-N 3.22Å; I1430-S1434 PolarHBondContact O-OG 2.74Å
1431	L	64.1	Low	52.2	Low	0 Å²	0	46 Å²	46	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-65.7	-41.2	176.3	-174.1	65.8	0	0	0	112	E1403 M1406 F1407 I1410 W1427 I1429 L1433 S1434 L1435	E1403-L1431 HydrophobicContact CG-CD1 4.41Å; M1406-L1431 HydrophobicContact CB-CD1 3.9Å; M1406-L1431 HydrophobicContact CE-CB 4.46Å; M1406-L1431 HydrophobicContact CG-CD1 4.35Å; F1407-L1431 HydrophobicContact CD1-CD2 4.19Å; F1407-L1431 HydrophobicContact CE1-CD2 3.76Å; F1407-L1431 HydrophobicContact CE2-CD2 4.33Å; F1407-L1431 HydrophobicContact CZ-CD2 3.83Å; I1410-L1431 HydrophobicContact CD1-CD2 3.97Å; W1427-L1431 WeakPolarHBondContact O-CB 3.43Å; W1427-L1431 PolarHBondContact O-N 3.26Å; I1429-L1431 VanDerWaalsContact C-N 3.32Å; I1429-L1431 PolarHBondContact O-N 2.91Å; L1431-L1433 VanDerWaalsContact C-N 3.26Å; L1431-L1433 PolarHBondContact O-N 3.23Å; L1431-S1434 PolarHBondContact O-N 3.35Å; L1431-S1434 PolarHBondContact O-OG 2.9Å; L1431-S1434 VanDerWaalsContact O-OG 3.09Å; L1431-L1435 HydrophobicContact CD1-CD1 4.46Å; L1431-L1435 HydrophobicContact CG-CD1 4.01Å; L1431-L1435 WeakPolarHBondContact O-CB 3.46Å; L1431-L1435 WeakPolarHBondContact O-CD1 3.44Å; L1431-L1435 WeakPolarHBondContact O-CG 3.27Å; L1431-L1435 PolarHBondContact O-N 2.98Å
1432	A	57.9	Low	51.6	Low	0 Å²	0	53.4 Å²	53.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.2	-31.7	175.5	0	0	0	0	0	112.7	L1428 I1429 Q1436 A1461 C1464 L1465	L1428-A1432 WeakPolarHBondContact O-CB 3.41Å; L1428-A1432 PolarHBondContact O-N 3.16Å; I1429-A1432 PolarHBondContact O-N 2.81Å; A1432-Q1436 VanDerWaalsContact O-CG 3.24Å; A1432-Q1436 WeakPolarHBondContact O-CG 3.18Å; A1432-Q1436 PolarHBondContact O-NE2 2.85Å; A1432-A1461 HydrophobicContact CB-CB 4.19Å; A1432-C1464 HydrophobicContact CB-CB 4Å; A1432-L1465 HydrophobicContact CB-CD1 4.27Å; A1432-L1465 HydrophobicContact CB-CD2 3.76Å; A1432-L1465 HydrophobicContact CB-CG 3.67Å
1433	L	53.9	Low	50.8	Low	92 Å²	92	59.5 Å²	59.5	48%	0.482	33%	0.33	S	S	.	.	H	α-helix	trans	-76	-39.7	175.2	-70.1	168.4	0	0	0	112	I1429 I1430 L1431 Q1436	I1429-L1433 HydrophobicContact CG2-CD1 3.99Å; I1429-L1433 VanDerWaalsContact O-CG 3.29Å; I1429-L1433 WeakPolarHBondContact O-CG 3.44Å; I1429-L1433 PolarHBondContact O-N 3.16Å; I1430-L1433 PolarHBondContact O-N 2.98Å; L1431-L1433 VanDerWaalsContact C-N 3.26Å; L1431-L1433 PolarHBondContact O-N 3.23Å; L1433-Q1436 PolarHBondContact O-N 2.9Å
1434	S	58.9	Low	50.1	Low	27 Å²	27	67.3 Å²	67.3	19%	0.189	37%	0.372	C	S	.	.	H	α-helix	trans	-67.1	-38.5	176.5	64.1	0	0	0	0	112.1	H1402 I1430 L1431 Q1436 K1437	H1402-S1434 PolarHBondContact NE2-OG 3.43Å; I1430-S1434 PolarHBondContact O-N 3.22Å; I1430-S1434 PolarHBondContact O-OG 2.74Å; L1431-S1434 PolarHBondContact O-N 3.35Å; L1431-S1434 PolarHBondContact O-OG 2.9Å; L1431-S1434 VanDerWaalsContact O-OG 3.09Å; S1434-Q1436 PolarHBondContact O-N 3.34Å; S1434-K1437 PolarHBondContact O-N 3.09Å
1435	L	58.6	Low	49.3	Very low	21 Å²	21	75.3 Å²	75.3	11%	0.11	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-10.7	174	-73.1	167.7	0	0	0	115.2	E1403 L1431 R1460 A1461	E1403-L1435 HydrophobicContact CG-CD2 4.37Å; L1431-L1435 HydrophobicContact CD1-CD1 4.46Å; L1431-L1435 HydrophobicContact CG-CD1 4.01Å; L1431-L1435 WeakPolarHBondContact O-CB 3.46Å; L1431-L1435 WeakPolarHBondContact O-CD1 3.44Å; L1431-L1435 WeakPolarHBondContact O-CG 3.27Å; L1431-L1435 PolarHBondContact O-N 2.98Å; L1435-R1460 HydrophobicContact CD1-CB 3.74Å; L1435-A1461 HydrophobicContact CB-CB 4.32Å
1436	Q	53.1	Low	48.7	Very low	73 Å²	73	81.1 Å²	81.1	34%	0.341	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-13.6	-177.7	-81.3	174.5	45.8	0	0	114.7	A1432 L1433 S1434 A1461	A1432-Q1436 VanDerWaalsContact O-CG 3.24Å; A1432-Q1436 WeakPolarHBondContact O-CG 3.18Å; A1432-Q1436 PolarHBondContact O-NE2 2.85Å; L1433-Q1436 PolarHBondContact O-N 2.9Å; S1434-Q1436 PolarHBondContact O-N 3.34Å; Q1436-A1461 HydrophobicContact CG-CB 4.04Å
1437	K	49.2	Very low	48.5	Very low	153 Å²	153	82.4 Å²	82.4	67%	0.665	45%	0.448	S	S	*	.	S	Bend	trans	-62.3	128.9	178	-74.3	-174.1	177.1	179.8	0	110.4	S1434	S1434-K1437 PolarHBondContact O-N 3.09Å
1438	P	41.7	Very low	47.5	Very low	85 Å²	85	90.1 Å²	90.1	55%	0.552	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-63.3	140.3	164.7	28.9	-32.5	0	0	0	108.3	N1440 M1454	P1438-N1440 PolarHBondContact O-N 3.35Å; P1438-M1454 HydrophobicContact CB-CE 4.17Å
1439	P	42.7	Very low	46.9	Very low	85 Å²	85	94.2 Å²	94.2	55%	0.552	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-60.4	126.9	170.8	26	-32.7	0	0	0	108.5	G1441	P1439-G1441 PolarHBondContact O-N 2.97Å; P1439-G1441 VanDerWaalsContact O-N 3.1Å
1440	N	37.1	Very low	46.6	Very low	170 Å²	170	95.5 Å²	95.5	91%	0.909	52%	0.517	S	S	*	.			trans	-59	115.6	178.2	-71.1	-15.3	0	0	0	109.2	P1438	P1438-N1440 PolarHBondContact O-N 3.35Å
1441	G	36.3	Very low	45.9	Very low	58 Å²	58	98.4 Å²	98.4	60%	0.598	53%	0.528	S	S	*	.			trans	-171.8	102.7	-178.3	0	0	0	0	0	110.8	P1439 N1443	P1439-G1441 PolarHBondContact O-N 2.97Å; P1439-G1441 VanDerWaalsContact O-N 3.1Å; G1441-N1443 PolarHBondContact O-N 3.33Å
1442	D	34.9	Very low	45	Very low	162 Å²	162	103.5 Å²	103.5	87%	0.866	55%	0.554	S	S	*	*			trans	-72.3	18.6	-178.5	-70.5	-52.4	0	0	0	114.3
1443	N	31.6	Very low	44.5	Very low	147 Å²	147	112.2 Å²	112.2	79%	0.786	59%	0.587	S	S	*	*			trans	-103.2	118.2	-174	-68.5	-14.9	0	0	0	110.9	G1441 E1445	G1441-N1443 PolarHBondContact O-N 3.33Å; N1443-E1445 PolarHBondContact O-N 3.43Å
1444	N	36.5	Very low	44.4	Very low	169 Å²	169	110.2 Å²	110.2	90%	0.904	58%	0.576	S	S	*	*			trans	-75	22.8	-168.9	-73.3	-65.7	0	0	0	115.8
1445	E	37.2	Very low	44.1	Very low	169 Å²	169	115 Å²	115	79%	0.79	59%	0.594	S	S	*	*			trans	-112	105.1	176.8	-69.1	-171.3	160.3	0	0	110.4	N1443 D1447	N1443-E1445 PolarHBondContact O-N 3.43Å; E1445-D1447 VanDerWaalsContact C-N 3.28Å; E1445-D1447 PolarHBondContact O-N 3.06Å
1446	L	38.3	Very low	43.6	Very low	122 Å²	122	118.6 Å²	118.6	64%	0.639	61%	0.609	S	S	*	*			trans	-82.2	73.1	-177.3	-120.3	161.6	0	0	0	109.6	E1448 F1451	L1446-E1448 PolarHBondContact O-N 3.05Å; L1446-F1451 HydrophobicContact CD2-CB 4.1Å; L1446-F1451 HydrophobicContact CD2-CD2 4.23Å
1447	D	49.3	Very low	43.7	Very low	102 Å²	102	115.7 Å²	115.7	55%	0.545	60%	0.598	S	S	.	*			trans	-46.9	137.5	173.6	-86.4	-32.4	0	0	0	111.3	E1445 V1449 N1450 F1451	E1445-D1447 VanDerWaalsContact C-N 3.28Å; E1445-D1447 PolarHBondContact O-N 3.06Å; D1447-V1449 PolarHBondContact O-N 3.19Å; D1447-N1450 HydrophobicContact CB-CB 4.41Å; D1447-N1450 WeakPolarHBondContact O-CA 3.45Å; D1447-N1450 PolarHBondContact O-N 2.98Å; D1447-F1451 PolarHBondContact O-N 2.82Å
1448	E	44.1	Very low	43.9	Very low	164 Å²	164	113.1 Å²	113.1	77%	0.766	58%	0.584	S	S	*	*	H	α-helix	trans	-54.4	-31.9	178.3	-74.2	-164.5	130	0	0	112.1	L1446 F1451 L1452	L1446-E1448 PolarHBondContact O-N 3.05Å; E1448-F1451 PolarHBondContact O-N 3.48Å; E1448-L1452 VanDerWaalsContact O-CB 3.24Å; E1448-L1452 WeakPolarHBondContact O-CB 3.43Å; E1448-L1452 WeakPolarHBondContact O-CG 3.41Å; E1448-L1452 PolarHBondContact O-N 2.92Å
1449	V	44.8	Very low	44.4	Very low	95 Å²	95	112 Å²	112	58%	0.576	58%	0.576	S	S	*	*	H	α-helix	trans	-65.9	-40.7	176.1	-176.7	0	0	0	0	111.8	D1447 L1452 R1453	D1447-V1449 PolarHBondContact O-N 3.19Å; V1449-L1452 PolarHBondContact O-N 3.05Å; V1449-R1453 WeakPolarHBondContact O-CB 3.25Å; V1449-R1453 WeakPolarHBondContact O-CG 3.08Å; V1449-R1453 PolarHBondContact O-N 2.82Å
1450	N	47.7	Very low	44.9	Very low	62 Å²	62	110 Å²	110	33%	0.332	56%	0.558	S	S	.	*	H	α-helix	trans	-72.6	-36.9	175.7	-76.2	-30.2	0	0	0	111.5	D1447 R1453 M1454	D1447-N1450 HydrophobicContact CB-CB 4.41Å; D1447-N1450 WeakPolarHBondContact O-CA 3.45Å; D1447-N1450 PolarHBondContact O-N 2.98Å; N1450-R1453 PolarHBondContact O-N 3.2Å; N1450-M1454 WeakPolarHBondContact O-CB 3.28Å; N1450-M1454 PolarHBondContact O-N 2.68Å
1451	F	46.3	Very low	45.7	Very low	110 Å²	110	102.1 Å²	102.1	48%	0.482	52%	0.516	S	S	.	.	H	α-helix	trans	-63.6	-42.8	171.4	-173.8	-97.9	0	0	0	112	L1446 D1447 E1448 M1454 K1455	L1446-F1451 HydrophobicContact CD2-CB 4.1Å; L1446-F1451 HydrophobicContact CD2-CD2 4.23Å; D1447-F1451 PolarHBondContact O-N 2.82Å; E1448-F1451 PolarHBondContact O-N 3.48Å; F1451-M1454 PolarHBondContact O-N 3.14Å; F1451-K1455 VanDerWaalsContact O-CB 3.31Å; F1451-K1455 WeakPolarHBondContact O-CB 3.38Å; F1451-K1455 PolarHBondContact O-N 3.49Å
1452	L	44.6	Very low	46.4	Very low	107 Å²	107	103 Å²	103	56%	0.56	50%	0.504	S	S	*	.	H	α-helix	trans	-66.3	-41.8	175.5	-76.3	169	0	0	0	111.9	E1448 V1449 K1455 F1456	E1448-L1452 VanDerWaalsContact O-CB 3.24Å; E1448-L1452 WeakPolarHBondContact O-CB 3.43Å; E1448-L1452 WeakPolarHBondContact O-CG 3.41Å; E1448-L1452 PolarHBondContact O-N 2.92Å; V1449-L1452 PolarHBondContact O-N 3.05Å; L1452-K1455 PolarHBondContact O-N 3.46Å; L1452-F1456 WeakPolarHBondContact O-CB 3.48Å; L1452-F1456 PolarHBondContact O-N 3.41Å
1453	R	47.8	Very low	47.2	Very low	183 Å²	183	96.9 Å²	96.9	69%	0.691	47%	0.47	S	S	*	.	H	α-helix	trans	-60.5	-48	172.5	-82.5	-177.8	170.4	-174.4	-3	111.6	V1449 N1450 K1455 F1456 G1457	V1449-R1453 WeakPolarHBondContact O-CB 3.25Å; V1449-R1453 WeakPolarHBondContact O-CG 3.08Å; V1449-R1453 PolarHBondContact O-N 2.82Å; N1450-R1453 PolarHBondContact O-N 3.2Å; R1453-K1455 VanDerWaalsContact C-N 3.32Å; R1453-K1455 PolarHBondContact O-N 2.97Å; R1453-F1456 PolarHBondContact O-N 3.04Å; R1453-G1457 PolarHBondContact O-N 2.81Å
1454	M	52.3	Low	48.3	Very low	50 Å²	50	90.5 Å²	90.5	25%	0.246	44%	0.437	C	S	.	.	H	α-helix	trans	-58.6	-42.5	173.3	-79.7	-161.7	-166.3	0	0	112.1	P1438 N1450 F1451 R1458	P1438-M1454 HydrophobicContact CB-CE 4.17Å; N1450-M1454 WeakPolarHBondContact O-CB 3.28Å; N1450-M1454 PolarHBondContact O-N 2.68Å; F1451-M1454 PolarHBondContact O-N 3.14Å; M1454-R1458 WeakPolarHBondContact O-CB 3.09Å; M1454-R1458 VanDerWaalsContact O-CG 3.23Å; M1454-R1458 WeakPolarHBondContact O-CG 3.39Å; M1454-R1458 PolarHBondContact O-N 3.34Å; M1454-R1458 PolarHBondContact SD-NH2 3.4Å
1455	K	51.8	Low	49	Very low	128 Å²	128	83.3 Å²	83.3	56%	0.557	40%	0.398	S	S	*	.	H	α-helix	trans	-64.4	-41.5	178.9	-169.8	174.9	-177.8	178.4	0	111.3	F1451 L1452 R1453 R1458 T1459	F1451-K1455 VanDerWaalsContact O-CB 3.31Å; F1451-K1455 WeakPolarHBondContact O-CB 3.38Å; F1451-K1455 PolarHBondContact O-N 3.49Å; L1452-K1455 PolarHBondContact O-N 3.46Å; R1453-K1455 VanDerWaalsContact C-N 3.32Å; R1453-K1455 PolarHBondContact O-N 2.97Å; K1455-R1458 PolarHBondContact O-N 3.36Å; K1455-T1459 PolarHBondContact O-N 3.35Å; K1455-T1459 PolarHBondContact O-OG1 3.24Å; K1455-T1459 VanDerWaalsContact O-OG1 3.09Å
1456	F	49.5	Very low	49.6	Very low	97 Å²	97	79.7 Å²	79.7	43%	0.425	38%	0.378	S	S	.	.	H	α-helix	trans	-68.1	-44.7	178.5	-144.7	-88.1	0	0	0	111.9	L1452 R1453 T1459 R1460	L1452-F1456 WeakPolarHBondContact O-CB 3.48Å; L1452-F1456 PolarHBondContact O-N 3.41Å; R1453-F1456 PolarHBondContact O-N 3.04Å; F1456-T1459 WeakPolarHBondContact CA-OG1 3.01Å; F1456-T1459 PolarHBondContact O-N 2.96Å; F1456-T1459 PolarHBondContact O-OG1 3.13Å; F1456-R1460 HydrophobicContact CD1-CG 4.4Å; F1456-R1460 WeakPolarHBondContact O-CG 3.36Å; F1456-R1460 PolarHBondContact O-N 3.26Å
1457	G	55.1	Low	50.4	Low	12 Å²	12	76.1 Å²	76.1	12%	0.124	36%	0.356	C	S	.	.	H	α-helix	trans	-59.7	-42.9	173.4	0	0	0	0	0	112.5	R1453 R1460 A1461	R1453-G1457 PolarHBondContact O-N 2.81Å; G1457-R1460 WeakPolarHBondContact O-CB 3.31Å; G1457-R1460 PolarHBondContact O-N 3.15Å; G1457-A1461 WeakPolarHBondContact O-CB 3.49Å; G1457-A1461 PolarHBondContact O-N 2.88Å
1458	R	51.9	Low	50.5	Low	99 Å²	99	71.3 Å²	71.3	37%	0.374	33%	0.33	S	S	.	.	H	α-helix	trans	-62	-45.7	173.9	-74.4	173.6	-166.7	159.4	13.3	112.9	M1454 K1455 R1460 A1461 Q1462	M1454-R1458 WeakPolarHBondContact O-CB 3.09Å; M1454-R1458 VanDerWaalsContact O-CG 3.23Å; M1454-R1458 WeakPolarHBondContact O-CG 3.39Å; M1454-R1458 PolarHBondContact O-N 3.34Å; M1454-R1458 PolarHBondContact SD-NH2 3.4Å; K1455-R1458 PolarHBondContact O-N 3.36Å; R1458-R1460 VanDerWaalsContact C-N 3.31Å; R1458-R1460 PolarHBondContact O-N 3.22Å; R1458-A1461 PolarHBondContact O-N 3.13Å; R1458-Q1462 WeakPolarHBondContact O-CG 3.41Å; R1458-Q1462 PolarHBondContact O-N 3.46Å
1459	T	52.9	Low	50.5	Low	61 Å²	61	66.2 Å²	66.2	37%	0.374	31%	0.308	S	S	.	.	H	α-helix	trans	-62.5	-37.6	175	40.1	0	0	0	0	112.3	K1455 F1456 E1463	K1455-T1459 PolarHBondContact O-N 3.35Å; K1455-T1459 PolarHBondContact O-OG1 3.24Å; K1455-T1459 VanDerWaalsContact O-OG1 3.09Å; F1456-T1459 WeakPolarHBondContact CA-OG1 3.01Å; F1456-T1459 PolarHBondContact O-N 2.96Å; F1456-T1459 PolarHBondContact O-OG1 3.13Å; T1459-E1463 WeakPolarHBondContact O-CB 3.46Å; T1459-E1463 WeakPolarHBondContact O-CG 3.23Å; T1459-E1463 PolarHBondContact O-N 3.35Å; T1459-E1463 VanDerWaalsContact O-N 3.1Å
1460	R	52.8	Low	50.7	Low	44 Å²	44	65.7 Å²	65.7	17%	0.166	30%	0.302	C	S	.	.	H	α-helix	trans	-63.5	-47.9	173.7	-74.6	173.8	166.7	-174.1	-6.1	111.9	E1403 L1435 F1456 G1457 R1458 Q1462 E1463 C1464 H1503	E1403-R1460 IonicContact OE2-NH1 3.96Å; L1435-R1460 HydrophobicContact CD1-CB 3.74Å; F1456-R1460 HydrophobicContact CD1-CG 4.4Å; F1456-R1460 WeakPolarHBondContact O-CG 3.36Å; F1456-R1460 PolarHBondContact O-N 3.26Å; G1457-R1460 WeakPolarHBondContact O-CB 3.31Å; G1457-R1460 PolarHBondContact O-N 3.15Å; R1458-R1460 VanDerWaalsContact C-N 3.31Å; R1458-R1460 PolarHBondContact O-N 3.22Å; R1460-Q1462 VanDerWaalsContact C-N 3.35Å; R1460-Q1462 PolarHBondContact O-N 2.99Å; R1460-E1463 PolarHBondContact O-N 3.41Å; R1460-C1464 PolarHBondContact O-N 2.94Å; R1460-C1464 PolarHBondContact O-SG 3.39Å; R1460-C1464 VanDerWaalsContact O-SG 3.34Å; R1460-H1503 PolarHBondContact NE-NE2 2.73Å; R1460-H1503 PolarHBondContact NH2-NE2 3.29Å
1461	A	54.1	Low	50.7	Low	3 Å²	3	64.1 Å²	64.1	3%	0.025	29%	0.293	C	S	.	.	H	α-helix	trans	-60.7	-42.4	178.1	0	0	0	0	0	111.9	A1432 L1435 Q1436 G1457 R1458 E1463 C1464 L1465	A1432-A1461 HydrophobicContact CB-CB 4.19Å; L1435-A1461 HydrophobicContact CB-CB 4.32Å; Q1436-A1461 HydrophobicContact CG-CB 4.04Å; G1457-A1461 WeakPolarHBondContact O-CB 3.49Å; G1457-A1461 PolarHBondContact O-N 2.88Å; R1458-A1461 PolarHBondContact O-N 3.13Å; A1461-E1463 VanDerWaalsContact C-N 3.34Å; A1461-E1463 PolarHBondContact O-N 3.21Å; A1461-C1464 PolarHBondContact O-N 3.04Å; A1461-L1465 WeakPolarHBondContact O-CB 3.4Å; A1461-L1465 WeakPolarHBondContact O-CG 3.41Å; A1461-L1465 PolarHBondContact O-N 2.78Å
1462	Q	50.6	Low	50.4	Low	77 Å²	77	61.1 Å²	61.1	36%	0.36	28%	0.281	S	S	.	.	H	α-helix	trans	-58.6	-44	174.2	-74.9	176.7	-58.5	0	0	112.7	R1458 R1460 L1465 R1466 I1595	R1458-Q1462 WeakPolarHBondContact O-CG 3.41Å; R1458-Q1462 PolarHBondContact O-N 3.46Å; R1460-Q1462 VanDerWaalsContact C-N 3.35Å; R1460-Q1462 PolarHBondContact O-N 2.99Å; Q1462-L1465 PolarHBondContact O-N 3.29Å; Q1462-R1466 WeakPolarHBondContact O-CB 3.3Å; Q1462-R1466 PolarHBondContact O-N 2.67Å; Q1462-I1595 HydrophobicContact CG-CD1 3.65Å; Q1462-I1595 HydrophobicContact CG-CG1 4.47Å
1463	E	52.5	Low	50.3	Low	34 Å²	34	58 Å²	58	16%	0.159	27%	0.267	C	S	.	.	H	α-helix	trans	-68.2	-44	179.6	-70.6	-82.1	-169.6	0	0	112	T1459 R1460 A1461 L1465 R1466 W1467 L1507	T1459-E1463 WeakPolarHBondContact O-CB 3.46Å; T1459-E1463 WeakPolarHBondContact O-CG 3.23Å; T1459-E1463 PolarHBondContact O-N 3.35Å; T1459-E1463 VanDerWaalsContact O-N 3.1Å; R1460-E1463 PolarHBondContact O-N 3.41Å; A1461-E1463 VanDerWaalsContact C-N 3.34Å; A1461-E1463 PolarHBondContact O-N 3.21Å; E1463-L1465 VanDerWaalsContact C-N 3.33Å; E1463-L1465 PolarHBondContact O-N 3.26Å; E1463-R1466 PolarHBondContact O-N 3.13Å; E1463-W1467 VanDerWaalsContact O-CD1 3.26Å; E1463-W1467 PolarHBondContact O-N 3.38Å; E1463-L1507 HydrophobicContact CB-CD1 3.86Å; E1463-L1507 HydrophobicContact CB-CD2 3.81Å; E1463-L1507 HydrophobicContact CB-CG 4.3Å; E1463-L1507 HydrophobicContact CG-CB 4.06Å; E1463-L1507 HydrophobicContact CG-CD1 3.85Å; E1463-L1507 HydrophobicContact CG-CD2 4.17Å; E1463-L1507 HydrophobicContact CG-CG 4.23Å
1464	C	55.4	Low	49.7	Very low	13 Å²	13	53.6 Å²	53.6	9%	0.088	25%	0.25	C	S	.	.	H	α-helix	trans	-60.2	-42.4	173.8	-68.9	0	0	0	0	112	L1428 A1432 R1460 A1461 W1467 S1468	L1428-C1464 HydrophobicContact CB-CB 4.37Å; L1428-C1464 HydrophobicContact CD2-CB 3.97Å; A1432-C1464 HydrophobicContact CB-CB 4Å; R1460-C1464 PolarHBondContact O-N 2.94Å; R1460-C1464 PolarHBondContact O-SG 3.39Å; R1460-C1464 VanDerWaalsContact O-SG 3.34Å; A1461-C1464 PolarHBondContact O-N 3.04Å; C1464-W1467 PolarHBondContact O-N 3.11Å; C1464-S1468 PolarHBondContact O-N 3.26Å
1465	L	49.9	Very low	48.6	Very low	17 Å²	17	57.3 Å²	57.3	9%	0.089	27%	0.271	C	S	.	.	H	α-helix	trans	-66.7	-42	176.8	-69.8	172	0	0	0	112.1	I1429 A1432 A1461 Q1462 E1463 W1467 S1468 L1469 L1584	I1429-L1465 HydrophobicContact CG1-CD2 4.26Å; A1432-L1465 HydrophobicContact CB-CD1 4.27Å; A1432-L1465 HydrophobicContact CB-CD2 3.76Å; A1432-L1465 HydrophobicContact CB-CG 3.67Å; A1461-L1465 WeakPolarHBondContact O-CB 3.4Å; A1461-L1465 WeakPolarHBondContact O-CG 3.41Å; A1461-L1465 PolarHBondContact O-N 2.78Å; Q1462-L1465 PolarHBondContact O-N 3.29Å; E1463-L1465 VanDerWaalsContact C-N 3.33Å; E1463-L1465 PolarHBondContact O-N 3.26Å; L1465-W1467 PolarHBondContact O-N 3.17Å; L1465-S1468 WeakPolarHBondContact CA-OG 3.15Å; L1465-S1468 PolarHBondContact O-N 3.48Å; L1465-S1468 PolarHBondContact O-OG 3.25Å; L1465-L1469 WeakPolarHBondContact O-CG 3.5Å; L1465-L1469 PolarHBondContact O-N 3.22Å; L1465-L1584 HydrophobicContact CD1-CD2 3.59Å; L1465-L1584 HydrophobicContact CD2-CD1 4.16Å; L1465-L1584 HydrophobicContact CD2-CD2 3.51Å; L1465-L1584 HydrophobicContact CD2-CG 4.37Å; L1465-L1584 HydrophobicContact CG-CD2 4.06Å
1466	R	50.2	Low	47.5	Very low	94 Å²	94	56.9 Å²	56.9	36%	0.355	27%	0.271	S	S	.	.	H	α-helix	trans	-57.8	-47.8	173.2	179.7	-178.7	174.2	-170.5	-0.7	111.6	Q1462 E1463 S1468 L1469 D1470	Q1462-R1466 WeakPolarHBondContact O-CB 3.3Å; Q1462-R1466 PolarHBondContact O-N 2.67Å; E1463-R1466 PolarHBondContact O-N 3.13Å; R1466-S1468 VanDerWaalsContact C-N 3.34Å; R1466-S1468 PolarHBondContact O-N 3.14Å; R1466-L1469 PolarHBondContact O-N 3.43Å; R1466-D1470 IonicContact NE-OD2 2.9Å; R1466-D1470 PolarHBondContact O-N 3.48Å
1467	W	54.2	Low	46.5	Very low	47 Å²	47	58.9 Å²	58.9	18%	0.178	28%	0.282	C	S	.	.	H	α-helix	trans	-60.5	-41.6	175.8	-83.6	50.5	0	0	0	112	M1414 L1428 E1463 C1464 L1465 L1469 D1470 I1471 I1506	M1414-W1467 HydrophobicContact CE-CZ3 4.44Å; M1414-W1467 HydrophobicContact SD-CZ3 3.76Å; L1428-W1467 HydrophobicContact CD1-CB 3.79Å; E1463-W1467 VanDerWaalsContact O-CD1 3.26Å; E1463-W1467 PolarHBondContact O-N 3.38Å; C1464-W1467 PolarHBondContact O-N 3.11Å; L1465-W1467 PolarHBondContact O-N 3.17Å; W1467-L1469 VanDerWaalsContact C-N 3.32Å; W1467-L1469 PolarHBondContact O-N 2.87Å; W1467-D1470 PolarHBondContact O-N 3.07Å; W1467-I1471 WeakPolarHBondContact O-CD1 3.48Å; W1467-I1471 VanDerWaalsContact O-CG1 3.25Å; W1467-I1471 WeakPolarHBondContact O-CG1 3.24Å; W1467-I1471 PolarHBondContact O-N 2.63Å; W1467-I1506 HydrophobicContact CH2-CG2 3.58Å; W1467-I1506 HydrophobicContact CZ2-CG2 3.33Å
1468	S	51.7	Low	45.3	Very low	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.4	-37.3	175.9	73.1	0	0	0	0	112.8	C1464 L1465 R1466 M1472	C1464-S1468 PolarHBondContact O-N 3.26Å; L1465-S1468 WeakPolarHBondContact CA-OG 3.15Å; L1465-S1468 PolarHBondContact O-N 3.48Å; L1465-S1468 PolarHBondContact O-OG 3.25Å; R1466-S1468 VanDerWaalsContact C-N 3.34Å; R1466-S1468 PolarHBondContact O-N 3.14Å; S1468-M1472 VanDerWaalsContact O-CB 3.28Å; S1468-M1472 WeakPolarHBondContact O-CB 3.38Å; S1468-M1472 VanDerWaalsContact O-CG 3.3Å; S1468-M1472 WeakPolarHBondContact O-CG 3.46Å; S1468-M1472 PolarHBondContact O-N 2.87Å
1469	L	44.8	Very low	44.1	Very low	57 Å²	57	59.2 Å²	59.2	30%	0.298	29%	0.288	S	S	.	.	H	α-helix	trans	-72.6	-40.2	176.8	-69.1	169.2	0	0	0	112.7	L1465 R1466 W1467 I1471 M1472 T1473 C1581 L1584	L1465-L1469 WeakPolarHBondContact O-CG 3.5Å; L1465-L1469 PolarHBondContact O-N 3.22Å; R1466-L1469 PolarHBondContact O-N 3.43Å; W1467-L1469 VanDerWaalsContact C-N 3.32Å; W1467-L1469 PolarHBondContact O-N 2.87Å; L1469-I1471 VanDerWaalsContact C-N 3.27Å; L1469-I1471 PolarHBondContact O-N 3.16Å; L1469-M1472 PolarHBondContact O-N 2.94Å; L1469-T1473 WeakPolarHBondContact O-CB 3.49Å; L1469-T1473 VanDerWaalsContact O-CG2 3.23Å; L1469-T1473 WeakPolarHBondContact O-CG2 3.44Å; L1469-T1473 PolarHBondContact O-N 2.98Å; L1469-T1473 VanDerWaalsContact O-N 3.13Å; L1469-T1473 PolarHBondContact O-OG1 3.18Å; L1469-C1581 WeakPolarHBondContact CD2-SG 3.46Å; L1469-L1584 HydrophobicContact CD2-CD1 4.41Å
1470	D	48.5	Very low	42.9	Very low	85 Å²	85	58.8 Å²	58.8	46%	0.455	28%	0.283	S	S	.	.	H	α-helix	trans	-63.4	-34.7	175.2	-71	-21.6	0	0	0	110.8	R1466 W1467	R1466-D1470 IonicContact NE-OD2 2.9Å; R1466-D1470 PolarHBondContact O-N 3.48Å; W1467-D1470 PolarHBondContact O-N 3.07Å
1471	I	47.5	Very low	41.7	Very low	29 Å²	29	64.3 Å²	64.3	15%	0.149	30%	0.303	C	S	.	.	H	α-helix	trans	-72.6	-46.5	172.7	-66.3	164.5	0	0	0	111.7	Y1420 I1424 A1425 L1428 W1467 L1469 T1473	Y1420-I1471 HydrophobicContact CD1-CD1 3.87Å; Y1420-I1471 HydrophobicContact CD1-CG1 4.38Å; Y1420-I1471 HydrophobicContact CE1-CD1 4.05Å; I1424-I1471 HydrophobicContact CG2-CD1 4.36Å; A1425-I1471 HydrophobicContact CB-CG2 4.17Å; L1428-I1471 HydrophobicContact CD1-CD1 4.25Å; W1467-I1471 WeakPolarHBondContact O-CD1 3.48Å; W1467-I1471 VanDerWaalsContact O-CG1 3.25Å; W1467-I1471 WeakPolarHBondContact O-CG1 3.24Å; W1467-I1471 PolarHBondContact O-N 2.63Å; L1469-I1471 VanDerWaalsContact C-N 3.27Å; L1469-I1471 PolarHBondContact O-N 3.16Å; I1471-T1473 PolarHBondContact O-N 3.29Å
1472	M	41.4	Very low	40.3	Very low	46 Å²	46	67.9 Å²	67.9	23%	0.227	33%	0.326	C	S	.	.	H	α-helix	trans	-77.2	-12.4	-172.2	-77.7	-172	154.6	0	0	115.7	A1425 S1468 L1469 I1580	A1425-M1472 HydrophobicContact CB-CE 4.03Å; A1425-M1472 HydrophobicContact CB-CG 4.14Å; S1468-M1472 VanDerWaalsContact O-CB 3.28Å; S1468-M1472 WeakPolarHBondContact O-CB 3.38Å; S1468-M1472 VanDerWaalsContact O-CG 3.3Å; S1468-M1472 WeakPolarHBondContact O-CG 3.46Å; S1468-M1472 PolarHBondContact O-N 2.87Å; L1469-M1472 PolarHBondContact O-N 2.94Å; M1472-I1580 HydrophobicContact CE-CD1 3.63Å; M1472-I1580 HydrophobicContact SD-CD1 3.76Å; M1472-I1580 HydrophobicContact SD-CG2 4.29Å
1473	T	41.6	Very low	39.2	Very low	43 Å²	43	70.3 Å²	70.3	26%	0.264	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-4.8	-174.6	46.5	0	0	0	0	114.6	L1469 I1471 R1611	L1469-T1473 WeakPolarHBondContact O-CB 3.49Å; L1469-T1473 VanDerWaalsContact O-CG2 3.23Å; L1469-T1473 WeakPolarHBondContact O-CG2 3.44Å; L1469-T1473 PolarHBondContact O-N 2.98Å; L1469-T1473 VanDerWaalsContact O-N 3.13Å; L1469-T1473 PolarHBondContact O-OG1 3.18Å; I1471-T1473 PolarHBondContact O-N 3.29Å; T1473-R1611 PolarHBondContact O-NH1 3.18Å; T1473-R1611 PolarHBondContact O-NH2 3.19Å
1474	Y	34.4	Very low	37.9	Very low	89 Å²	89	74.1 Å²	74.1	35%	0.349	37%	0.366	S	S	.	.			trans	-115.1	120.3	-177.8	-86.7	-97.3	0	0	0	113.5	Q1476 I1478 I1515 R1611	Y1474-Q1476 PolarHBondContact O-N 3.08Å; Y1474-I1478 HydrophobicContact CD1-CD1 4.36Å; Y1474-I1478 HydrophobicContact CD1-CG1 4.41Å; Y1474-I1478 HydrophobicContact CD2-CD1 3.67Å; Y1474-I1478 HydrophobicContact CE2-CD1 4.32Å; Y1474-I1478 HydrophobicContact CG-CD1 3.7Å; Y1474-I1478 HydrophobicContact CG-CG1 4.08Å; Y1474-I1515 HydrophobicContact CE1-CG2 4.32Å; Y1474-R1611 VanDerWaalsContact CD2-NH2 3.28Å; Y1474-R1611 VanDerWaalsContact CE2-NH2 3.27Å
1475	N	30.7	Very low	36.4	Very low	128 Å²	128	78.2 Å²	78.2	68%	0.684	39%	0.393	S	S	*	.	S	Bend	trans	-82.9	22.9	173.4	-76.8	6.3	0	0	0	113.7
1476	Q	28.5	Very low	35.1	Very low	119 Å²	119	81.9 Å²	81.9	56%	0.556	42%	0.417	S	S	*	.	S	Bend	trans	-147.2	135.9	176.2	-67.1	-172.2	-25.2	0	0	109	Y1474 I1478	Y1474-Q1476 PolarHBondContact O-N 3.08Å; Q1476-I1478 PolarHBondContact O-N 3.3Å
1477	E	28.7	Very low	33.9	Very low	139 Å²	139	82.4 Å²	82.4	65%	0.65	43%	0.433	S	S	*	.			trans	-53.4	120.9	-174.8	-68.2	163.3	157.8	0	0	112.2	L1479	E1477-L1479 PolarHBondContact O-N 2.85Å
1478	I	28.7	Very low	32.4	Very low	39 Å²	39	87 Å²	87	20%	0.2	47%	0.467	C	S	.	.			trans	-91.4	105.1	179.2	-47.2	179.1	0	0	0	110	Y1474 Q1476 I1480	Y1474-I1478 HydrophobicContact CD1-CD1 4.36Å; Y1474-I1478 HydrophobicContact CD1-CG1 4.41Å; Y1474-I1478 HydrophobicContact CD2-CD1 3.67Å; Y1474-I1478 HydrophobicContact CE2-CD1 4.32Å; Y1474-I1478 HydrophobicContact CG-CD1 3.7Å; Y1474-I1478 HydrophobicContact CG-CG1 4.08Å; Q1476-I1478 PolarHBondContact O-N 3.3Å; I1478-I1480 HydrophobicContact CB-CG1 4.38Å; I1478-I1480 HydrophobicContact CG2-CD1 4.31Å; I1478-I1480 HydrophobicContact CG2-CG1 3.54Å; I1478-I1480 PolarHBondContact O-N 2.78Å
1479	L	27.7	Very low	31.1	Very low	79 Å²	79	91.7 Å²	91.7	41%	0.414	50%	0.5	S	S	.	.			trans	-80.8	81.5	170.4	-149.9	167.4	0	0	0	110	E1477 R1481	E1477-L1479 PolarHBondContact O-N 2.85Å; L1479-R1481 HydrophobicContact CD2-CG 3.96Å; L1479-R1481 PolarHBondContact O-N 3.48Å
1480	I	28.1	Very low	30.2	Very low	53 Å²	53	93.3 Å²	93.3	27%	0.272	51%	0.512	S	S	.	.			trans	-72.4	104.8	174.3	-54.3	-176.9	0	0	0	109	Y1420 I1478 P1482 Y1513	Y1420-I1480 HydrophobicContact CE2-CD1 4.05Å; I1478-I1480 HydrophobicContact CB-CG1 4.38Å; I1478-I1480 HydrophobicContact CG2-CD1 4.31Å; I1478-I1480 HydrophobicContact CG2-CG1 3.54Å; I1478-I1480 PolarHBondContact O-N 2.78Å; I1480-P1482 WeakPolarHBondContact O-CD 3Å; I1480-Y1513 HydrophobicContact CG2-CD1 4.08Å; I1480-Y1513 HydrophobicContact CG2-CD2 4.35Å; I1480-Y1513 HydrophobicContact CG2-CE1 4.42Å; I1480-Y1513 HydrophobicContact CG2-CG 4.09Å
1481	R	26	Very low	29.2	Very low	160 Å²	160	98 Å²	98	60%	0.604	54%	0.536	S	S	*	.			trans	-80.4	121.6	164.6	-75.2	-169.7	175.2	-162.6	1.1	109.9	Q730 L1479 V1483	Q730-R1481 VanDerWaalsContact NE2-NH1 3.13Å; L1479-R1481 HydrophobicContact CD2-CG 3.96Å; L1479-R1481 PolarHBondContact O-N 3.48Å; R1481-V1483 PolarHBondContact O-N 3.03Å
1482	P	25.3	Very low	28.2	Very low	78 Å²	78	101.1 Å²	101.1	51%	0.506	56%	0.56	S	S	.	*			trans	-68.9	127.9	166	32	-34.3	0	0	0	108.4	I1480 I1484	I1480-P1482 WeakPolarHBondContact O-CD 3Å; P1482-I1484 WeakPolarHBondContact CB-O 3.32Å; P1482-I1484 PolarHBondContact O-N 3.43Å; P1482-I1484 VanDerWaalsContact O-N 3.08Å
1483	V	27.9	Very low	27.5	Very low	127 Å²	127	104.9 Å²	104.9	77%	0.77	58%	0.581	S	S	*	*	S	Bend	trans	-66.4	-8.1	178.4	177.5	0	0	0	0	112.1	R1481	R1481-V1483 PolarHBondContact O-N 3.03Å
1484	I	24.4	Very low	27.1	Very low	115 Å²	115	112 Å²	112	59%	0.59	61%	0.608	S	S	*	*	S	Bend	trans	-136.8	125.2	176.1	-50.4	175.5	0	0	0	106.3	P1482	P1482-I1484 WeakPolarHBondContact CB-O 3.32Å; P1482-I1484 PolarHBondContact O-N 3.43Å; P1482-I1484 VanDerWaalsContact O-N 3.08Å
1485	P	23.5	Very low	26.7	Very low	98 Å²	98	114.1 Å²	114.1	64%	0.636	63%	0.626	S	S	*	*			trans	-60.1	145	173.8	26.7	-34.1	0	0	0	109.9
1486	P	23.1	Very low	26.8	Very low	94 Å²	94	116.2 Å²	116.2	61%	0.61	63%	0.631	S	S	*	*			trans	-57.3	136.5	166.1	27.2	-33.2	0	0	0	108	T1488	P1486-T1488 PolarHBondContact O-N 2.94Å
1487	P	24.2	Very low	27	Very low	106 Å²	106	117.7 Å²	117.7	69%	0.688	64%	0.638	S	S	*	*			trans	-63.3	108.6	-176.7	24.8	-33.1	0	0	0	109.7	S1489	P1487-S1489 PolarHBondContact O-N 3.29Å
1488	T	24	Very low	27.1	Very low	144 Å²	144	114.9 Å²	114.9	88%	0.883	63%	0.627	S	S	*	*	S	Bend	trans	-72.6	26.8	-174.8	34.9	0	0	0	0	114	P1486	P1486-T1488 PolarHBondContact O-N 2.94Å
1489	S	23.4	Very low	27.1	Very low	98 Å²	98	118.5 Å²	118.5	69%	0.685	64%	0.639	S	S	*	*			trans	-130.7	44.8	-170.9	69.8	0	0	0	0	112.6	P1487	P1487-S1489 PolarHBondContact O-N 3.29Å
1490	V	27.5	Very low	27.4	Very low	91 Å²	91	121.5 Å²	121.5	55%	0.552	65%	0.649	S	S	*	*			trans	-142	68.8	169.2	-165.3	0	0	0	0	110.1
1491	L	25.8	Very low	27.4	Very low	184 Å²	184	126.8 Å²	126.8	96%	0.963	67%	0.669	S	S	*	*	S	Bend	trans	-106.8	9.6	164.9	-109	170.1	0	0	0	112.6
1492	S	26.5	Very low	27.6	Very low	93 Å²	93	123.5 Å²	123.5	65%	0.65	66%	0.664	S	S	*	*	S	Bend	trans	-147.1	144.9	170.3	50	0	0	0	0	110.9
1493	N	27.4	Very low	27.9	Very low	125 Å²	125	121.5 Å²	121.5	67%	0.668	65%	0.647	S	S	*	*			trans	71.7	101.1	175	-58.8	-7.5	0	0	0	117.3
1494	F	32.4	Very low	27.9	Very low	192 Å²	192	123.7 Å²	123.7	84%	0.842	64%	0.642	S	S	*	*			trans	-73.2	142	170.4	-91.6	-107.1	0	0	0	112.2
1495	N	27.3	Very low	28.2	Very low	134 Å²	134	120.5 Å²	120.5	72%	0.717	63%	0.63	S	S	*	*			trans	-156.8	142.5	149.4	-119.6	-35.4	0	0	0	112.9	H1497 I1498	N1495-H1497 PolarHBondContact O-N 3.49Å; N1495-I1498 PolarHBondContact O-N 3.06Å
1496	Q	31.4	Very low	28.7	Very low	172 Å²	172	119.1 Å²	119.1	80%	0.804	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-18.6	-164.9	-68.3	179.7	-8.1	0	0	115.2	I1498 Y1499	Q1496-I1498 VanDerWaalsContact C-N 3.27Å; Q1496-I1498 PolarHBondContact O-N 3.17Å; Q1496-Y1499 VanDerWaalsContact O-CB 3.24Å; Q1496-Y1499 WeakPolarHBondContact O-CB 3.46Å; Q1496-Y1499 PolarHBondContact O-N 2.86Å; Q1496-Y1499 VanDerWaalsContact O-N 3.1Å
1497	H	33.7	Very low	29	Very low	151 Å²	151	116.1 Å²	116.1	70%	0.699	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-27.5	179.5	-116.2	-50.4	0	0	0	113.8	N1495 Y1499 K1500 K1501	N1495-H1497 PolarHBondContact O-N 3.49Å; H1497-Y1499 VanDerWaalsContact C-N 3.29Å; H1497-Y1499 PolarHBondContact O-N 3.05Å; H1497-K1500 PolarHBondContact O-N 3.23Å; H1497-K1501 PolarHBondContact O-N 3.16Å
1498	I	29.9	Very low	29	Very low	80 Å²	80	117.2 Å²	117.2	41%	0.41	59%	0.594	S	S	.	*	H	α-helix	trans	-67.1	-33.6	174	-65.6	177.6	0	0	0	110.3	N1495 Q1496 K1500 K1501 L1502	N1495-I1498 PolarHBondContact O-N 3.06Å; Q1496-I1498 VanDerWaalsContact C-N 3.27Å; Q1496-I1498 PolarHBondContact O-N 3.17Å; I1498-K1500 PolarHBondContact O-N 3.42Å; I1498-K1500 VanDerWaalsContact O-N 3.08Å; I1498-K1501 PolarHBondContact O-N 3.31Å; I1498-L1502 HydrophobicContact CG2-CB 4.38Å; I1498-L1502 HydrophobicContact CG2-CD1 3.9Å; I1498-L1502 HydrophobicContact CG2-CG 4.42Å; I1498-L1502 PolarHBondContact O-N 2.84Å
1499	Y	30.1	Very low	29.1	Very low	115 Å²	115	118.2 Å²	118.2	45%	0.451	58%	0.582	S	S	.	*	H	α-helix	trans	-61.8	-16.9	175	-130.8	-77.5	0	0	0	113.5	Q1496 H1497 H1503	Q1496-Y1499 VanDerWaalsContact O-CB 3.24Å; Q1496-Y1499 WeakPolarHBondContact O-CB 3.46Å; Q1496-Y1499 PolarHBondContact O-N 2.86Å; Q1496-Y1499 VanDerWaalsContact O-N 3.1Å; H1497-Y1499 VanDerWaalsContact C-N 3.29Å; H1497-Y1499 PolarHBondContact O-N 3.05Å; Y1499-H1503 WeakPolarHBondContact O-CB 3.31Å
1500	K	32.7	Very low	29.2	Very low	142 Å²	142	120.7 Å²	120.7	62%	0.617	59%	0.587	S	S	*	*	H	α-helix	trans	-95	-19.4	168.8	-97.5	179	178.5	171	0	114.2	H1497 I1498 R1504	H1497-K1500 PolarHBondContact O-N 3.23Å; I1498-K1500 PolarHBondContact O-N 3.42Å; I1498-K1500 VanDerWaalsContact O-N 3.08Å; K1500-R1504 WeakPolarHBondContact O-CB 3.35Å; K1500-R1504 WeakPolarHBondContact O-CG 3.32Å
1501	K	29.9	Very low	29.1	Very low	163 Å²	163	119.2 Å²	119.2	71%	0.709	58%	0.579	S	S	*	*	H	α-helix	trans	-90	-50	177.5	-85.1	-175.8	174.8	176.9	0	112.2	H1497 I1498 H1503 R1504 S1505	H1497-K1501 PolarHBondContact O-N 3.16Å; I1498-K1501 PolarHBondContact O-N 3.31Å; K1501-H1503 VanDerWaalsContact C-N 3.28Å; K1501-H1503 PolarHBondContact O-N 3.42Å; K1501-R1504 CarbonylContact O-C 3.54Å; K1501-R1504 WeakPolarHBondContact O-CA 3.45Å; K1501-R1504 WeakPolarHBondContact O-CB 3.23Å; K1501-R1504 PolarHBondContact O-N 3.18Å; K1501-S1505 PolarHBondContact O-N 3.32Å; K1501-S1505 PolarHBondContact O-OG 2.99Å
1502	L	28.7	Very low	29	Very low	92 Å²	92	121.8 Å²	121.8	48%	0.482	58%	0.576	S	S	.	*	H	α-helix	trans	-57.7	-44.5	175.2	-117.2	166	0	0	0	110.8	I1498 R1504 S1505 I1506	I1498-L1502 HydrophobicContact CG2-CB 4.38Å; I1498-L1502 HydrophobicContact CG2-CD1 3.9Å; I1498-L1502 HydrophobicContact CG2-CG 4.42Å; I1498-L1502 PolarHBondContact O-N 2.84Å; L1502-R1504 PolarHBondContact O-N 3.42Å; L1502-S1505 WeakPolarHBondContact CA-OG 3.16Å; L1502-S1505 PolarHBondContact O-N 3.31Å; L1502-S1505 VanDerWaalsContact O-N 3.13Å; L1502-S1505 PolarHBondContact O-OG 3.34Å; L1502-I1506 HydrophobicContact CD2-CD1 3.44Å; L1502-I1506 VanDerWaalsContact CD2-CD1 3.44Å; L1502-I1506 HydrophobicContact CD2-CG1 4.03Å; L1502-I1506 WeakPolarHBondContact O-CG1 3.42Å; L1502-I1506 PolarHBondContact O-N 2.74Å
1503	H	31.5	Very low	29	Very low	35 Å²	35	122.3 Å²	122.3	16%	0.162	56%	0.564	C	S	.	*	H	α-helix	trans	-71.3	-12.5	176.6	-156.8	-50.7	0	0	0	114	R1460 Y1499 K1501 L1507	R1460-H1503 PolarHBondContact NE-NE2 2.73Å; R1460-H1503 PolarHBondContact NH2-NE2 3.29Å; Y1499-H1503 WeakPolarHBondContact O-CB 3.31Å; K1501-H1503 VanDerWaalsContact C-N 3.28Å; K1501-H1503 PolarHBondContact O-N 3.42Å; H1503-L1507 WeakPolarHBondContact CE1-CD1 3.38Å; H1503-L1507 WeakPolarHBondContact ND1-CD1 3.32Å
1504	R	28	Very low	28.8	Very low	174 Å²	174	120.4 Å²	120.4	66%	0.657	55%	0.553	S	S	*	*	H	α-helix	trans	-93.3	-28.6	167.4	-94.7	-179.7	166.1	179.3	-3.9	112.7	K1500 K1501 L1502 L1508	K1500-R1504 WeakPolarHBondContact O-CB 3.35Å; K1500-R1504 WeakPolarHBondContact O-CG 3.32Å; K1501-R1504 CarbonylContact O-C 3.54Å; K1501-R1504 WeakPolarHBondContact O-CA 3.45Å; K1501-R1504 WeakPolarHBondContact O-CB 3.23Å; K1501-R1504 PolarHBondContact O-N 3.18Å; L1502-R1504 PolarHBondContact O-N 3.42Å; R1504-L1508 HydrophobicContact CG-CB 4.49Å; R1504-L1508 HydrophobicContact CG-CD1 3.85Å; R1504-L1508 WeakPolarHBondContact O-CA 3.41Å; R1504-L1508 WeakPolarHBondContact O-CB 3.24Å; R1504-L1508 PolarHBondContact O-N 3.02Å
1505	S	31.3	Very low	28.4	Very low	48 Å²	48	115.6 Å²	115.6	34%	0.336	54%	0.536	S	S	.	.	H	α-helix	trans	-82.1	-30.7	178.4	50.7	0	0	0	0	113.9	K1501 L1502	K1501-S1505 PolarHBondContact O-N 3.32Å; K1501-S1505 PolarHBondContact O-OG 2.99Å; L1502-S1505 WeakPolarHBondContact CA-OG 3.16Å; L1502-S1505 PolarHBondContact O-N 3.31Å; L1502-S1505 VanDerWaalsContact O-N 3.13Å; L1502-S1505 PolarHBondContact O-OG 3.34Å
1506	I	34.5	Very low	28.2	Very low	68 Å²	68	110.8 Å²	110.8	35%	0.349	51%	0.509	S	S	.	.	S	Bend	trans	-83.1	-35.3	179.3	-63.4	178.6	0	0	0	111.4	W1467 L1502	W1467-I1506 HydrophobicContact CH2-CG2 3.58Å; W1467-I1506 HydrophobicContact CZ2-CG2 3.33Å; L1502-I1506 HydrophobicContact CD2-CD1 3.44Å; L1502-I1506 VanDerWaalsContact CD2-CD1 3.44Å; L1502-I1506 HydrophobicContact CD2-CG1 4.03Å; L1502-I1506 WeakPolarHBondContact O-CG1 3.42Å; L1502-I1506 PolarHBondContact O-N 2.74Å
1507	L	28	Very low	27.9	Very low	32 Å²	32	107.3 Å²	107.3	17%	0.168	50%	0.502	C	S	.	.	S	Bend	trans	-105.1	-46.2	-172.8	-56.6	-170	0	0	0	113.5	E1463 H1503 R1509	E1463-L1507 HydrophobicContact CB-CD1 3.86Å; E1463-L1507 HydrophobicContact CB-CD2 3.81Å; E1463-L1507 HydrophobicContact CB-CG 4.3Å; E1463-L1507 HydrophobicContact CG-CB 4.06Å; E1463-L1507 HydrophobicContact CG-CD1 3.85Å; E1463-L1507 HydrophobicContact CG-CD2 4.17Å; E1463-L1507 HydrophobicContact CG-CG 4.23Å; H1503-L1507 WeakPolarHBondContact CE1-CD1 3.38Å; H1503-L1507 WeakPolarHBondContact ND1-CD1 3.32Å; L1507-R1509 PolarHBondContact O-N 2.92Å
1508	L	26.1	Very low	27.6	Very low	128 Å²	128	103.5 Å²	103.5	67%	0.67	48%	0.484	S	S	*	.	S	Bend	trans	-91.5	10.7	-172	-86.8	162.1	0	0	0	115.5	R1504	R1504-L1508 HydrophobicContact CG-CB 4.49Å; R1504-L1508 HydrophobicContact CG-CD1 3.85Å; R1504-L1508 WeakPolarHBondContact O-CA 3.41Å; R1504-L1508 WeakPolarHBondContact O-CB 3.24Å; R1504-L1508 PolarHBondContact O-N 3.02Å
1509	R	25.8	Very low	27.3	Very low	165 Å²	165	106.8 Å²	106.8	62%	0.623	50%	0.501	S	S	*	.	S	Bend	trans	-101.2	116.9	168.6	-80.2	-175.8	168.5	174.1	-3.7	109.9	L1507 P1511	L1507-R1509 PolarHBondContact O-N 2.92Å; R1509-P1511 VanDerWaalsContact O-CD 3.29Å; R1509-P1511 WeakPolarHBondContact O-CD 3.39Å; R1509-P1511 VanDerWaalsContact O-N 3.08Å
1510	L	25.2	Very low	27.1	Very low	151 Å²	151	106.5 Å²	106.5	79%	0.791	50%	0.504	S	S	*	.			trans	-44.8	116	161.2	-84.7	165.2	0	0	0	108.8	R1512	L1510-R1512 PolarHBondContact O-N 2.84Å
1511	P	25.7	Very low	26.6	Very low	59 Å²	59	104 Å²	104	38%	0.383	50%	0.502	S	S	.	.			trans	-76.9	105.9	-174.2	-8	22.3	0	0	0	110.2	R1509 Y1513	R1509-P1511 VanDerWaalsContact O-CD 3.29Å; R1509-P1511 WeakPolarHBondContact O-CD 3.39Å; R1509-P1511 VanDerWaalsContact O-N 3.08Å; P1511-Y1513 HydrophobicContact CB-CD1 4.26Å; P1511-Y1513 HydrophobicContact CB-CD2 3.24Å; P1511-Y1513 HydrophobicContact CB-CE1 4.42Å; P1511-Y1513 HydrophobicContact CB-CE2 3.44Å; P1511-Y1513 VanDerWaalsContact CB-CE2 3.44Å; P1511-Y1513 HydrophobicContact CB-CG 3.66Å; P1511-Y1513 HydrophobicContact CG-CD2 4.14Å; P1511-Y1513 HydrophobicContact CG-CE2 4.07Å; P1511-Y1513 PolarHBondContact O-N 2.92Å
1512	R	23.3	Very low	26.2	Very low	239 Å²	239	101.1 Å²	101.1	90%	0.902	50%	0.502	S	S	*	.			trans	-70	63.7	148.9	-68.3	-177.3	177.7	179.5	-0.9	108.4	L1510	L1510-R1512 PolarHBondContact O-N 2.84Å
1513	Y	25.5	Very low	26.1	Very low	104 Å²	104	103.6 Å²	103.6	41%	0.408	52%	0.515	S	S	.	.			trans	-91.2	120	166.9	-66.8	-32.8	0	0	0	108	I1480 P1511 I1515	I1480-Y1513 HydrophobicContact CG2-CD1 4.08Å; I1480-Y1513 HydrophobicContact CG2-CD2 4.35Å; I1480-Y1513 HydrophobicContact CG2-CE1 4.42Å; I1480-Y1513 HydrophobicContact CG2-CG 4.09Å; P1511-Y1513 HydrophobicContact CB-CD1 4.26Å; P1511-Y1513 HydrophobicContact CB-CD2 3.24Å; P1511-Y1513 HydrophobicContact CB-CE1 4.42Å; P1511-Y1513 HydrophobicContact CB-CE2 3.44Å; P1511-Y1513 VanDerWaalsContact CB-CE2 3.44Å; P1511-Y1513 HydrophobicContact CB-CG 3.66Å; P1511-Y1513 HydrophobicContact CG-CD2 4.14Å; P1511-Y1513 HydrophobicContact CG-CE2 4.07Å; P1511-Y1513 PolarHBondContact O-N 2.92Å; Y1513-I1515 PolarHBondContact O-N 2.87Å; Y1513-I1515 VanDerWaalsContact O-N 3.14Å
1514	L	23.6	Very low	25.6	Very low	85 Å²	85	107.8 Å²	107.8	45%	0.445	54%	0.539	S	S	.	.			trans	-77	99.8	173.1	-139.1	155.9	0	0	0	106.1	D734 I1516	D734-L1514 VanDerWaalsContact OD1-CD1 3.28Å; D734-L1514 WeakPolarHBondContact OD1-CD1 3.17Å; L1514-I1516 HydrophobicContact CB-CD1 4.32Å; L1514-I1516 HydrophobicContact CD2-CD1 3.91Å; L1514-I1516 HydrophobicContact CD2-CG1 3.74Å; L1514-I1516 WeakPolarHBondContact O-CD1 3.48Å
1515	I	24.1	Very low	25.3	Very low	91 Å²	91	104.6 Å²	104.6	47%	0.467	54%	0.543	S	S	.	.			trans	-76.9	124.8	173.2	-59.3	173.6	0	0	0	106.9	Y1474 Y1513	Y1474-I1515 HydrophobicContact CE1-CG2 4.32Å; Y1513-I1515 PolarHBondContact O-N 2.87Å; Y1513-I1515 VanDerWaalsContact O-N 3.14Å
1516	I	24.6	Very low	24.9	Very low	32 Å²	32	106.9 Å²	106.9	16%	0.164	56%	0.556	C	S	.	*			trans	-121.6	125.7	176.6	-55.9	103.9	0	0	0	110.3	K733 L1514 Q1518	K733-I1516 HydrophobicContact CB-CG1 3.88Å; K733-I1516 HydrophobicContact CB-CG2 4.39Å; K733-I1516 HydrophobicContact CD-CB 4.13Å; K733-I1516 HydrophobicContact CD-CD1 3.75Å; K733-I1516 HydrophobicContact CD-CG1 3.66Å; K733-I1516 HydrophobicContact CD-CG2 3.87Å; K733-I1516 HydrophobicContact CG-CB 4.3Å; K733-I1516 HydrophobicContact CG-CD1 4.43Å; K733-I1516 HydrophobicContact CG-CG1 3.83Å; K733-I1516 HydrophobicContact CG-CG2 3.65Å; L1514-I1516 HydrophobicContact CB-CD1 4.32Å; L1514-I1516 HydrophobicContact CD2-CD1 3.91Å; L1514-I1516 HydrophobicContact CD2-CG1 3.74Å; L1514-I1516 WeakPolarHBondContact O-CD1 3.48Å; I1516-Q1518 PolarHBondContact O-N 3.21Å
1517	P	24.2	Very low	24.4	Very low	100 Å²	100	113 Å²	113	65%	0.649	58%	0.581	S	S	*	*			trans	-70	120.7	167.9	30.2	-33	0	0	0	110.6
1518	Q	27	Very low	24.1	Very low	71 Å²	71	119 Å²	119	33%	0.332	61%	0.612	S	S	.	*			trans	-97.3	99.1	172.2	-164.9	171.2	-5.9	0	0	110.2	I1516 Q1520	I1516-Q1518 PolarHBondContact O-N 3.21Å; Q1518-Q1520 HydrophobicContact CG-CG 3.89Å; Q1518-Q1520 VanDerWaalsContact NE2-NE2 3.15Å; Q1518-Q1520 PolarHBondContact O-N 3.49Å
1519	I	23.5	Very low	23.9	Very low	148 Å²	148	117.8 Å²	117.8	76%	0.759	61%	0.614	S	S	*	*			trans	-81	98.6	162.5	-57.4	173.8	0	0	0	106.5	P1521	I1519-P1521 WeakPolarHBondContact O-CD 3.13Å
1520	Q	25.2	Very low	23.6	Very low	110 Å²	110	118.4 Å²	118.4	51%	0.514	62%	0.624	S	S	.	*			trans	-80.9	124.5	170.2	-76.7	-155.9	13.1	0	0	111.2	Q1518	Q1518-Q1520 HydrophobicContact CG-CG 3.89Å; Q1518-Q1520 VanDerWaalsContact NE2-NE2 3.15Å; Q1518-Q1520 PolarHBondContact O-N 3.49Å
1521	P	23.1	Very low	23.3	Very low	90 Å²	90	115.7 Å²	115.7	58%	0.584	62%	0.618	S	S	*	*			trans	-84.5	123.1	160.3	32.8	-28.6	0	0	0	110	I1519	I1519-P1521 WeakPolarHBondContact O-CD 3.13Å
1522	S	22.3	Very low	23.1	Very low	101 Å²	101	116.6 Å²	116.6	71%	0.706	63%	0.626	S	S	*	*			trans	41.4	96.2	160.9	58.6	0	0	0	0	117.4	L1524	S1522-L1524 PolarHBondContact O-N 3.47Å
1523	L	25.7	Very low	23.1	Very low	144 Å²	144	108.8 Å²	108.8	75%	0.754	60%	0.596	S	S	*	*			trans	-59.3	124.8	165.4	-82.4	159.6	0	0	0	110.9
1524	L	21.5	Very low	22.9	Very low	124 Å²	124	108 Å²	108	65%	0.649	61%	0.606	S	S	*	*			trans	-147.7	77.8	178.3	-121	177.8	0	0	0	110.4	T1088 S1522	T1088-L1524 HydrophobicContact CG2-CD2 4.5Å; S1522-L1524 PolarHBondContact O-N 3.47Å
1525	S	22.2	Very low	22.9	Very low	107 Å²	107	106 Å²	106	75%	0.748	60%	0.597	S	S	*	*			trans	-174.8	135.2	150	45.3	0	0	0	0	110.8
1526	P	22.1	Very low	22.9	Very low	95 Å²	95	103.8 Å²	103.8	62%	0.617	59%	0.59	S	S	*	*			trans	-72.1	158.9	171.5	32.2	-34.5	0	0	0	111.3
1527	F	23.9	Very low	22.7	Very low	197 Å²	197	107.3 Å²	107.3	86%	0.864	60%	0.602	S	S	*	*			trans	-72.8	132.5	-176.1	-80.4	-95.1	0	0	0	112.8
1528	L	22.1	Very low	22.6	Very low	157 Å²	157	106 Å²	106	82%	0.822	59%	0.59	S	S	*	*			trans	-147	135.7	149.5	-100.1	175.5	0	0	0	110.4
1529	S	21.5	Very low	22.4	Very low	103 Å²	103	105 Å²	105	72%	0.72	59%	0.586	S	S	*	*	S	Bend	trans	40.7	108.6	161.3	59.5	0	0	0	0	117.2
1530	E	19.6	Very low	22.4	Very low	178 Å²	178	99.8 Å²	99.8	83%	0.832	56%	0.56	S	S	*	*			cis	-159.9	141.9	45.6	-70.8	177.4	135.9	0	0	112.6
1531	S	19.1	Very low	22.2	Very low	94 Å²	94	96.5 Å²	96.5	66%	0.657	55%	0.549	S	S	*	.			trans	65.3	150.8	161.3	74.8	0	0	0	0	120.4
1532	S	21.9	Very low	22.2	Very low	79 Å²	79	94.5 Å²	94.5	55%	0.552	54%	0.537	S	S	*	.			trans	60.6	85.5	168.2	44	0	0	0	0	119.4
1533	R	22.9	Very low	22.4	Very low	74 Å²	74	91.3 Å²	91.3	28%	0.279	51%	0.514	S	S	.	.				46.5	126.8	126	-59.8	-177.6	-160	119.3	5.3	121.3	L1376 I1377 D1378 D1416	L1376-R1533 HydrophobicContact CD2-CG 4.12Å; I1377-R1533 PolarHBondContact O-NE 3.35Å; I1377-R1533 PolarHBondContact O-NH2 3.31Å; D1378-R1533 WeakPolarHBondContact OD1-CD 3.5Å; D1378-R1533 VanDerWaalsContact OD1-CG 3.28Å; D1378-R1533 WeakPolarHBondContact OD1-CG 3.49Å; D1378-R1533 IonicContact OD1-NE 3.68Å; D1416-R1533 IonicContact OD1-NH1 3.35Å; D1416-R1533 PolarHBondContact OD1-NH1 2.74Å; D1416-R1533 VanDerWaalsContact OD2-CD 3.24Å; D1416-R1533 WeakPolarHBondContact OD2-CD 3.43Å; D1416-R1533 IonicContact OD2-CZ 2.7Å; D1416-R1533 IonicContact OD2-NE 3.71Å; D1416-R1533 IonicContact OD2-NH1 2.71Å; D1416-R1533 PolarHBondContact OD2-NH1 2.76Å
1534	S	21.3	Very low	22.6	Very low	87 Å²	87	86.5 Å²	86.5	61%	0.608	50%	0.499	S	S	*	.			trans	-95.1	-177.1	161.9	51.6	0	0	0	0	112
1535	T	23.3	Very low	22.8	Very low	43 Å²	43	85 Å²	85	26%	0.264	48%	0.484	S	S	.	.			trans	95.8	129.6	166.3	69.7	0	0	0	0	115.8	Y1335 T1380 H1421	Y1335-T1535 HydrophobicContact CE2-CG2 4.47Å; Y1335-T1535 PolarHBondContact OH-OG1 2.99Å; T1380-T1535 WeakPolarHBondContact CB-OG1 3.49Å; T1380-T1535 VanDerWaalsContact CG2-O 3.29Å; T1380-T1535 WeakPolarHBondContact CG2-O 3.21Å; T1380-T1535 PolarHBondContact OG1-OG1 3.4Å; H1421-T1535 PolarHBondContact CD2-O 3.34Å
1536	S	23	Very low	22.9	Very low	45 Å²	45	85.6 Å²	85.6	32%	0.315	47%	0.474	S	S	.	.			cis	-165	151.6	-15.2	28.5	0	0	0	0	108.9	H1421 P1422	H1421-S1536 PolarHBondContact CD2-N 3.09Å; H1421-S1536 PolarHBondContact CD2-O 3.05Å; H1421-S1536 PolarHBondContact CE1-O 3.07Å; H1421-S1536 PolarHBondContact CE1-OG 2.93Å; H1421-S1536 PolarHBondContact ND1-O 3.4Å; H1421-S1536 VanDerWaalsContact ND1-O 3.11Å; H1421-S1536 PolarHBondContact NE2-N 3.46Å; H1421-S1536 PolarHBondContact NE2-O 3.37Å; H1421-S1536 PolarHBondContact NE2-OG 2.8Å; P1422-S1536 WeakPolarHBondContact CD-O 3.35Å
1537	Y	21.7	Very low	22.9	Very low	106 Å²	106	85.9 Å²	85.9	42%	0.416	47%	0.474	S	S	.	.			trans	-98.6	133.1	163.3	-91.6	-94.9	0	0	0	111.7	Y1420 P1422	Y1420-Y1537 WeakPolarHBondContact O-CE2 3.31Å; Y1420-Y1537 PolarHBondContact O-OH 3.27Å; Y1420-Y1537 VanDerWaalsContact O-OH 3.12Å; P1422-Y1537 HydrophobicContact CB-CD1 3.44Å; P1422-Y1537 VanDerWaalsContact CB-CD1 3.44Å; P1422-Y1537 HydrophobicContact CB-CE1 3.56Å; P1422-Y1537 HydrophobicContact CB-CG 4.38Å; P1422-Y1537 VanDerWaalsContact CD-CA 3.46Å; P1422-Y1537 HydrophobicContact CG-CD1 3.31Å; P1422-Y1537 HydrophobicContact CG-CE1 3.9Å; P1422-Y1537 HydrophobicContact CG-CG 3.79Å
1538	N	22.6	Very low	22.9	Very low	73 Å²	73	81 Å²	81	39%	0.39	46%	0.464	S	S	.	.			trans	-168	127.5	142	-85.9	-30.5	0	0	0	108.7	Y1277 P1422	Y1277-N1538 HydrophobicContact CE2-CB 4.06Å; Y1277-N1538 VanDerWaalsContact OH-C 3.22Å; Y1277-N1538 WeakPolarHBondContact OH-CB 3.22Å; Y1277-N1538 PolarHBondContact OH-O 2.67Å; P1422-N1538 VanDerWaalsContact CG-N 3.29Å; P1422-N1538 WeakPolarHBondContact CG-O 3.4Å
1539	L	22	Very low	23	Very low	49 Å²	49	80.4 Å²	80.4	26%	0.257	46%	0.462	S	S	.	.				66.4	158.9	99.2	-57.4	175.6	0	0	0	113.5	Y1277 Y1573	Y1277-L1539 HydrophobicContact CE1-CB 3.92Å; Y1277-L1539 WeakPolarHBondContact CE1-O 3.13Å; Y1277-L1539 HydrophobicContact CE2-CB 4.22Å; Y1277-L1539 PolarHBondContact OH-O 3.24Å; L1539-Y1573 HydrophobicContact CD1-CE1 4.05Å; L1539-Y1573 HydrophobicContact CD2-CE1 4.08Å
1540	N	22.8	Very low	23.3	Very low	39 Å²	39	80.4 Å²	80.4	21%	0.209	46%	0.459	C	S	.	.			cis	-158.2	142.1	4.8	-147.8	2.4	0	0	0	112.3	Y1277 L1576	Y1277-N1540 HydrophobicContact CD1-CB 3.38Å; Y1277-N1540 HydrophobicContact CE1-CB 3.62Å; Y1277-N1540 VanDerWaalsContact CE1-N 3.26Å; Y1277-N1540 HydrophobicContact CG-CB 4.22Å; N1540-L1576 WeakPolarHBondContact OD1-CD1 3.15Å
1541	S	22.5	Very low	23.5	Very low	42 Å²	42	76.6 Å²	76.6	29%	0.294	45%	0.452	S	S	.	.			trans	62.9	167	141.6	91.6	0	0	0	0	119.6
1542	S	23.1	Very low	23.7	Very low	47 Å²	47	77.8 Å²	77.8	33%	0.329	46%	0.461	S	S	.	.			cis	-160.5	177.7	-0.3	71.2	0	0	0	0	112.5	Q1583	S1542-Q1583 PolarHBondContact O-NE2 3.3Å
1543	T	26.7	Very low	23.8	Very low	35 Å²	35	81.7 Å²	81.7	22%	0.215	48%	0.475	C	S	.	.			trans	73	129.4	143.5	56.3	0	0	0	0	121.5	F1561 F1567 E1579 Q1583	T1543-F1561 WeakPolarHBondContact O-CE1 3.42Å; T1543-F1561 VanDerWaalsContact O-CZ 3.23Å; T1543-F1561 WeakPolarHBondContact O-CZ 3.05Å; T1543-F1567 HydrophobicContact CG2-CZ 3.79Å; T1543-E1579 WeakPolarHBondContact CA-OE1 3.31Å; T1543-E1579 VanDerWaalsContact N-CD 3.28Å; T1543-E1579 PolarHBondContact N-OE1 2.87Å; T1543-E1579 PolarHBondContact N-OE2 2.93Å; T1543-Q1583 PolarHBondContact O-NE2 2.89Å
1544	G	29.2	Very low	23.8	Very low	43 Å²	43	88.5 Å²	88.5	44%	0.443	50%	0.501	S	S	.	.				120.6	174.1	89.9	0	0	0	0	0	117.9	F1561 E1579	G1544-F1561 WeakPolarHBondContact O-CE1 3.42Å; G1544-E1579 PolarHBondContact N-OE1 3.24Å
1545	R	25.8	Very low	23.9	Very low	91 Å²	91	91.3 Å²	91.3	34%	0.343	52%	0.515	S	S	.	.			trans	174	118.2	145.8	-103.6	179.8	179.3	-173.6	4.3	116.3	F1561 N1563	R1545-F1561 HydrophobicContact CG-CE1 4.09Å; R1545-N1563 VanDerWaalsContact C-CB 3.4Å; R1545-N1563 WeakPolarHBondContact O-CB 3.18Å; R1545-N1563 PolarHBondContact O-ND2 3.39Å
1546	K	24.7	Very low	23.9	Very low	121 Å²	121	94.7 Å²	94.7	53%	0.526	53%	0.531	S	S	.	.			trans	75.1	103.7	134.2	-65.8	174.5	177.8	-164.4	0	123.4	N1562 N1563	K1546-N1562 CarbonylContact C-O 3.57Å; K1546-N1562 WeakPolarHBondContact CA-O 3.02Å; K1546-N1562 PolarHBondContact N-O 2.76Å; K1546-N1563 VanDerWaalsContact C-ND2 3.27Å; K1546-N1563 PolarHBondContact O-ND2 2.93Å; K1546-N1563 VanDerWaalsContact O-ND2 3.1Å; K1546-N1563 PolarHBondContact O-OD1 3.37Å
1547	V	20.9	Very low	23.9	Very low	101 Å²	101	100 Å²	100	61%	0.612	55%	0.554	S	S	*	*				-80.3	128.1	126.2	-177.7	0	0	0	0	108.4	N1562 N1563	V1547-N1562 PolarHBondContact N-O 3.11Å; V1547-N1563 VanDerWaalsContact CG2-OD1 3.31Å; V1547-N1563 WeakPolarHBondContact CG2-OD1 3.45Å; V1547-N1563 PolarHBondContact N-OD1 3.18Å
1548	S	24.2	Very low	23.9	Very low	95 Å²	95	100.7 Å²	100.7	66%	0.664	57%	0.57	S	S	*	*			trans	-70.5	137	173.8	44.6	0	0	0	0	111.8
1549	N	24.3	Very low	24	Very low	144 Å²	144	103 Å²	103	77%	0.77	58%	0.581	S	S	*	*				58.9	147	76.4	-107.9	18.6	0	0	0	114
1550	P	28.4	Very low	24	Very low	103 Å²	103	107.6 Å²	107.6	67%	0.669	61%	0.606	S	S	*	*			cis	-145.9	166.4	19.2	39.7	-19	0	0	0	119.8
1551	S	22.6	Very low	24.1	Very low	97 Å²	97	109.4 Å²	109.4	68%	0.678	61%	0.612	S	S	*	*			trans	68.5	117.4	137.6	64.6	0	0	0	0	122.6
1552	S	24.2	Very low	24.1	Very low	120 Å²	120	112.2 Å²	112.2	84%	0.839	62%	0.624	S	S	*	*				-137.7	161.5	105.9	72.9	0	0	0	0	110.3	R1554	S1552-R1554 PolarHBondContact O-N 3.49Å
1553	N	23.6	Very low	24.1	Very low	160 Å²	160	113.4 Å²	113.4	86%	0.856	63%	0.627	S	S	*	*			trans	-81.7	113.9	-157.5	-60.2	-33.7	0	0	0	114.6
1554	R	23.4	Very low	23.9	Very low	218 Å²	218	118.1 Å²	118.1	82%	0.823	65%	0.646	S	S	*	*			trans	-140.3	144.4	146.7	-97.7	-173.9	175.2	171.3	-2.1	109	S1552 D1556	S1552-R1554 PolarHBondContact O-N 3.49Å; R1554-D1556 WeakPolarHBondContact CB-OD2 3.26Å; R1554-D1556 PolarHBondContact O-N 3.03Å
1555	T	22.8	Very low	23.6	Very low	146 Å²	146	125.1 Å²	125.1	90%	0.896	67%	0.667	S	S	*	*			trans	-85.2	54.4	-179.5	49.7	0	0	0	0	112
1556	D	23.2	Very low	23.6	Very low	113 Å²	113	128.8 Å²	128.8	60%	0.604	69%	0.693	S	S	*	*			trans	-99.4	113.6	169.8	-61.4	-51.3	0	0	0	107.6	R1554 T1558	R1554-D1556 WeakPolarHBondContact CB-OD2 3.26Å; R1554-D1556 PolarHBondContact O-N 3.03Å; D1556-T1558 VanDerWaalsContact C-N 3.34Å; D1556-T1558 PolarHBondContact O-N 3.13Å
1557	I	24.1	Very low	23.5	Very low	156 Å²	156	130.5 Å²	130.5	80%	0.8	70%	0.7	S	S	*	*			trans	-91.5	73.7	178.2	-53.4	-178.9	0	0	0	109.1	L1559	I1557-L1559 HydrophobicContact CG2-CG 4.4Å
1558	T	21.9	Very low	23.6	Very low	122 Å²	122	130 Å²	130	75%	0.748	70%	0.702	S	S	*	*			trans	-85	120.5	159.4	45.5	0	0	0	0	108.9	D1556 N1560	D1556-T1558 VanDerWaalsContact C-N 3.34Å; D1556-T1558 PolarHBondContact O-N 3.13Å; T1558-N1560 PolarHBondContact O-N 2.87Å
1559	L	24	Very low	23.6	Very low	121 Å²	121	130.4 Å²	130.4	63%	0.634	70%	0.696	S	S	*	*			trans	-89.2	86.5	-179.4	-82.2	170	0	0	0	110.9	I1557	I1557-L1559 HydrophobicContact CG2-CG 4.4Å
1560	N	22.2	Very low	23.7	Very low	145 Å²	145	126.6 Å²	126.6	78%	0.775	68%	0.679	S	S	*	*			trans	-74.9	122.6	173.9	-121.9	-12.4	0	0	0	111.4	T1558	T1558-N1560 PolarHBondContact O-N 2.87Å
1561	F	25.3	Very low	23.6	Very low	77 Å²	77	128 Å²	128	34%	0.338	67%	0.672	S	S	.	*			trans	-106	82.3	-179.5	-89	-76	0	0	0	112.6	T1543 G1544 R1545	T1543-F1561 WeakPolarHBondContact O-CE1 3.42Å; T1543-F1561 VanDerWaalsContact O-CZ 3.23Å; T1543-F1561 WeakPolarHBondContact O-CZ 3.05Å; G1544-F1561 WeakPolarHBondContact O-CE1 3.42Å; R1545-F1561 HydrophobicContact CG-CE1 4.09Å
1562	N	22.2	Very low	23.8	Very low	101 Å²	101	127 Å²	127	54%	0.54	66%	0.662	S	S	.	*			trans	-96.4	104.8	163.8	-86.8	-24.6	0	0	0	110.3	K1546 V1547	K1546-N1562 CarbonylContact C-O 3.57Å; K1546-N1562 WeakPolarHBondContact CA-O 3.02Å; K1546-N1562 PolarHBondContact N-O 2.76Å; V1547-N1562 PolarHBondContact N-O 3.11Å
1563	N	23.2	Very low	23.9	Very low	72 Å²	72	127 Å²	127	39%	0.385	64%	0.644	S	S	.	*			trans	-148.1	109.1	139.3	-121.1	2.2	0	0	0	111.9	R1545 K1546 V1547	R1545-N1563 VanDerWaalsContact C-CB 3.4Å; R1545-N1563 WeakPolarHBondContact O-CB 3.18Å; R1545-N1563 PolarHBondContact O-ND2 3.39Å; K1546-N1563 VanDerWaalsContact C-ND2 3.27Å; K1546-N1563 PolarHBondContact O-ND2 2.93Å; K1546-N1563 VanDerWaalsContact O-ND2 3.1Å; K1546-N1563 PolarHBondContact O-OD1 3.37Å; V1547-N1563 VanDerWaalsContact CG2-OD1 3.31Å; V1547-N1563 WeakPolarHBondContact CG2-OD1 3.45Å; V1547-N1563 PolarHBondContact N-OD1 3.18Å
1564	Q	22.2	Very low	24.3	Very low	134 Å²	134	122.5 Å²	122.5	63%	0.626	62%	0.618	S	S	*	*			trans	-71.9	141.1	159.4	-63.6	153.1	-11.8	0	0	107.7
1565	H	23.4	Very low	24.7	Very low	190 Å²	190	114.2 Å²	114.2	88%	0.88	59%	0.592	S	S	*	*	S	Bend	trans	133	8.1	166.9	-72.4	-61.1	0	0	0	118.3
1566	L	25.1	Very low	25.1	Very low	169 Å²	169	108.5 Å²	108.5	89%	0.885	56%	0.556	S	S	*	*			trans	-120.7	8.4	170.1	-93.3	157.3	0	0	0	114.9	S1568	L1566-S1568 PolarHBondContact O-N 3.27Å
1567	F	23.3	Very low	25.7	Very low	156 Å²	156	104.8 Å²	104.8	68%	0.684	54%	0.538	S	S	*	.			trans	-90.2	87.2	-177.1	-68.8	-86	0	0	0	112.7	T1543	T1543-F1567 HydrophobicContact CG2-CZ 3.79Å
1568	S	22.4	Very low	26.1	Very low	92 Å²	92	98.1 Å²	98.1	64%	0.643	51%	0.506	S	S	*	.			trans	-155.6	12.4	168.9	61.4	0	0	0	0	116.2	L1566	L1566-S1568 PolarHBondContact O-N 3.27Å
1569	N	23.9	Very low	26.7	Very low	103 Å²	103	95.1 Å²	95.1	55%	0.551	48%	0.483	S	S	*	.			trans	-132.6	118.5	-173.4	-134.6	-22.5	0	0	0	112.3	Y1571	N1569-Y1571 HydrophobicContact CB-CD2 4.49Å; N1569-Y1571 PolarHBondContact O-N 2.84Å; N1569-Y1571 WeakPolarHBondContact OD1-CD2 3.47Å; N1569-Y1571 WeakPolarHBondContact OD1-CE2 3.12Å
1570	P	25.5	Very low	27.4	Very low	63 Å²	63	90.9 Å²	90.9	41%	0.409	46%	0.461	S	S	.	.	S	Bend	trans	-77.8	28	-170	32.7	-37.2	0	0	0	115	V1572	P1570-V1572 VanDerWaalsContact C-N 3.28Å; P1570-V1572 PolarHBondContact O-N 3.3Å
1571	Y	27.1	Very low	28.1	Very low	132 Å²	132	85.4 Å²	85.4	52%	0.518	43%	0.434	S	S	.	.			trans	-85.6	9.8	-179.7	-76.8	-88.8	0	0	0	114.1	N1569 Y1573 Q1574	N1569-Y1571 HydrophobicContact CB-CD2 4.49Å; N1569-Y1571 PolarHBondContact O-N 2.84Å; N1569-Y1571 WeakPolarHBondContact OD1-CD2 3.47Å; N1569-Y1571 WeakPolarHBondContact OD1-CE2 3.12Å; Y1571-Y1573 VanDerWaalsContact C-N 3.35Å; Y1571-Y1573 PolarHBondContact O-N 2.88Å; Y1571-Q1574 PolarHBondContact O-N 3.36Å
1572	V	27.8	Very low	28.6	Very low	77 Å²	77	83.8 Å²	83.8	47%	0.467	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-68.1	-26.5	-162.6	-179.2	0	0	0	0	114.4	P1570 Q1574 T1575	P1570-V1572 VanDerWaalsContact C-N 3.28Å; P1570-V1572 PolarHBondContact O-N 3.3Å; V1572-Q1574 PolarHBondContact O-N 3.38Å; V1572-T1575 WeakPolarHBondContact CA-OG1 3.34Å; V1572-T1575 PolarHBondContact O-N 3.44Å; V1572-T1575 PolarHBondContact O-OG1 3.23Å; V1572-T1575 VanDerWaalsContact O-OG1 3.11Å
1573	Y	25.4	Very low	29.4	Very low	119 Å²	119	82.1 Å²	82.1	47%	0.467	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-63.9	-7	175.9	-86.3	-79.4	0	0	0	114.8	L1539 Y1571	L1539-Y1573 HydrophobicContact CD1-CE1 4.05Å; L1539-Y1573 HydrophobicContact CD2-CE1 4.08Å; Y1571-Y1573 VanDerWaalsContact C-N 3.35Å; Y1571-Y1573 PolarHBondContact O-N 2.88Å
1574	Q	31.4	Very low	30.2	Very low	66 Å²	66	80 Å²	80	31%	0.308	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-111.7	-5.3	171.3	-60	-172.9	-12.8	0	0	113.3	Y1571 V1572 Q1624	Y1571-Q1574 PolarHBondContact O-N 3.36Å; V1572-Q1574 PolarHBondContact O-N 3.38Å; Q1574-Q1624 VanDerWaalsContact C-NE2 3.3Å; Q1574-Q1624 PolarHBondContact O-NE2 3.41Å; Q1574-Q1624 PolarHBondContact O-OE1 3.22Å
1575	T	31.6	Very low	31.1	Very low	44 Å²	44	75 Å²	75	27%	0.27	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-11.9	-174.8	55.9	0	0	0	0	114.8	V1572 A1578 E1579	V1572-T1575 WeakPolarHBondContact CA-OG1 3.34Å; V1572-T1575 PolarHBondContact O-N 3.44Å; V1572-T1575 PolarHBondContact O-OG1 3.23Å; V1572-T1575 VanDerWaalsContact O-OG1 3.11Å; T1575-A1578 WeakPolarHBondContact O-CA 3.32Å; T1575-A1578 WeakPolarHBondContact O-CB 3.34Å; T1575-A1578 PolarHBondContact O-N 3.01Å; T1575-E1579 PolarHBondContact O-N 2.95Å
1576	L	32.2	Very low	31.8	Very low	27 Å²	27	67.7 Å²	67.7	14%	0.141	35%	0.351	C	S	.	.	H	α-helix	trans	-49.6	-51.2	173.4	-119.4	79	0	0	0	113.1	N1540 A1578 E1579 I1580	N1540-L1576 WeakPolarHBondContact OD1-CD1 3.15Å; L1576-A1578 PolarHBondContact O-N 2.91Å; L1576-E1579 PolarHBondContact O-N 3.41Å; L1576-I1580 WeakPolarHBondContact O-CB 3.31Å; L1576-I1580 VanDerWaalsContact O-CG1 3.29Å; L1576-I1580 WeakPolarHBondContact O-CG1 3.36Å; L1576-I1580 PolarHBondContact O-N 3.26Å
1577	P	34.7	Very low	32.3	Very low	35 Å²	35	62.2 Å²	62.2	23%	0.227	33%	0.327	C	S	.	.	H	α-helix	trans	-64.3	-32	179.2	-21.2	34.4	0	0	0	112	C1581	P1577-C1581 VanDerWaalsContact O-CB 3.22Å; P1577-C1581 WeakPolarHBondContact O-CB 3.23Å; P1577-C1581 PolarHBondContact O-N 3.39Å; P1577-C1581 PolarHBondContact O-SG 3.45Å
1578	A	33.6	Very low	32.9	Very low	16 Å²	16	57.9 Å²	57.9	13%	0.132	31%	0.31	C	S	.	.	H	α-helix	trans	-70	-47.3	178.5	0	0	0	0	0	112.1	T1575 L1576 C1581 L1582 I1628	T1575-A1578 WeakPolarHBondContact O-CA 3.32Å; T1575-A1578 WeakPolarHBondContact O-CB 3.34Å; T1575-A1578 PolarHBondContact O-N 3.01Å; L1576-A1578 PolarHBondContact O-N 2.91Å; A1578-C1581 PolarHBondContact O-N 2.93Å; A1578-L1582 WeakPolarHBondContact O-CB 3.26Å; A1578-L1582 PolarHBondContact O-N 3.09Å; A1578-I1628 HydrophobicContact CB-CD1 3.56Å; A1578-I1628 HydrophobicContact CB-CG1 3.74Å
1579	E	35.2	Very low	33.4	Very low	58 Å²	58	57.3 Å²	57.3	27%	0.271	30%	0.3	S	S	.	.	H	α-helix	trans	-66.2	-40.6	176.6	-77.3	-160.8	119.8	0	0	111.7	T1543 G1544 T1575 L1576 L1582 Q1583	T1543-E1579 WeakPolarHBondContact CA-OE1 3.31Å; T1543-E1579 VanDerWaalsContact N-CD 3.28Å; T1543-E1579 PolarHBondContact N-OE1 2.87Å; T1543-E1579 PolarHBondContact N-OE2 2.93Å; G1544-E1579 PolarHBondContact N-OE1 3.24Å; T1575-E1579 PolarHBondContact O-N 2.95Å; L1576-E1579 PolarHBondContact O-N 3.41Å; E1579-L1582 PolarHBondContact O-N 3.21Å; E1579-Q1583 WeakPolarHBondContact O-CB 3.31Å; E1579-Q1583 WeakPolarHBondContact O-CG 3.34Å; E1579-Q1583 PolarHBondContact O-N 2.83Å
1580	I	38	Very low	34.1	Very low	33 Å²	33	58.3 Å²	58.3	17%	0.169	30%	0.299	C	S	.	.	H	α-helix	trans	-66.7	-41	176.7	-67.1	169.9	0	0	0	110.7	I1429 M1472 L1576 Q1583 L1584	I1429-I1580 HydrophobicContact CD1-CG2 4.06Å; M1472-I1580 HydrophobicContact CE-CD1 3.63Å; M1472-I1580 HydrophobicContact SD-CD1 3.76Å; M1472-I1580 HydrophobicContact SD-CG2 4.29Å; L1576-I1580 WeakPolarHBondContact O-CB 3.31Å; L1576-I1580 VanDerWaalsContact O-CG1 3.29Å; L1576-I1580 WeakPolarHBondContact O-CG1 3.36Å; L1576-I1580 PolarHBondContact O-N 3.26Å; I1580-Q1583 PolarHBondContact O-N 3.46Å; I1580-L1584 HydrophobicContact CG2-CD1 4.17Å; I1580-L1584 VanDerWaalsContact O-CB 3.28Å; I1580-L1584 WeakPolarHBondContact O-CB 3.47Å; I1580-L1584 PolarHBondContact O-N 3.25Å
1581	C	36.3	Very low	34.5	Very low	30 Å²	30	60.9 Å²	60.9	20%	0.203	31%	0.31	C	S	.	.	H	α-helix	trans	-61.6	-42.4	171.5	-73.9	0	0	0	0	112.3	L1469 P1577 A1578 L1584 V1585	L1469-C1581 WeakPolarHBondContact CD2-SG 3.46Å; P1577-C1581 VanDerWaalsContact O-CB 3.22Å; P1577-C1581 WeakPolarHBondContact O-CB 3.23Å; P1577-C1581 PolarHBondContact O-N 3.39Å; P1577-C1581 PolarHBondContact O-SG 3.45Å; A1578-C1581 PolarHBondContact O-N 2.93Å; C1581-L1584 WeakPolarHBondContact O-CB 3.3Å; C1581-L1584 PolarHBondContact O-N 3.07Å; C1581-V1585 WeakPolarHBondContact O-CB 3.47Å; C1581-V1585 VanDerWaalsContact O-CG2 3.31Å; C1581-V1585 WeakPolarHBondContact O-CG2 3.42Å; C1581-V1585 PolarHBondContact O-N 2.9Å
1582	L	36.7	Very low	34.8	Very low	42 Å²	42	62.7 Å²	62.7	22%	0.22	32%	0.32	C	S	.	.	H	α-helix	trans	-67.9	-42.6	177.4	-100.1	156.2	0	0	0	112.1	A1578 E1579 L1584 V1585 I1586	A1578-L1582 WeakPolarHBondContact O-CB 3.26Å; A1578-L1582 PolarHBondContact O-N 3.09Å; E1579-L1582 PolarHBondContact O-N 3.21Å; L1582-L1584 VanDerWaalsContact C-N 3.33Å; L1582-V1585 PolarHBondContact O-N 3.43Å; L1582-I1586 HydrophobicContact CD2-CD1 4.49Å; L1582-I1586 WeakPolarHBondContact O-CB 3.32Å; L1582-I1586 WeakPolarHBondContact O-CD1 3.37Å; L1582-I1586 WeakPolarHBondContact O-CG1 2.95Å; L1582-I1586 PolarHBondContact O-N 2.97Å
1583	Q	38.4	Very low	34.9	Very low	67 Å²	67	67.2 Å²	67.2	31%	0.313	33%	0.329	S	S	.	.	H	α-helix	trans	-62.3	-40.9	173.3	-76.4	-171.5	1.3	0	0	111	S1542 T1543 E1579 I1580 I1586 C1587	S1542-Q1583 PolarHBondContact O-NE2 3.3Å; T1543-Q1583 PolarHBondContact O-NE2 2.89Å; E1579-Q1583 WeakPolarHBondContact O-CB 3.31Å; E1579-Q1583 WeakPolarHBondContact O-CG 3.34Å; E1579-Q1583 PolarHBondContact O-N 2.83Å; I1580-Q1583 PolarHBondContact O-N 3.46Å; Q1583-I1586 PolarHBondContact O-N 3.46Å; Q1583-C1587 WeakPolarHBondContact O-CB 3.37Å; Q1583-C1587 PolarHBondContact O-N 2.95Å; Q1583-C1587 PolarHBondContact O-SG 2.91Å; Q1583-C1587 VanDerWaalsContact O-SG 3.37Å
1584	L	39.8	Very low	35.4	Very low	27 Å²	27	71.1 Å²	71.1	14%	0.141	35%	0.351	C	S	.	.	H	α-helix	trans	-59.5	-51.9	172.9	-94.2	162	0	0	0	112.2	L1465 L1469 I1580 C1581 L1582 I1586 C1587 L1588	L1465-L1584 HydrophobicContact CD1-CD2 3.59Å; L1465-L1584 HydrophobicContact CD2-CD1 4.16Å; L1465-L1584 HydrophobicContact CD2-CD2 3.51Å; L1465-L1584 HydrophobicContact CD2-CG 4.37Å; L1465-L1584 HydrophobicContact CG-CD2 4.06Å; L1469-L1584 HydrophobicContact CD2-CD1 4.41Å; I1580-L1584 HydrophobicContact CG2-CD1 4.17Å; I1580-L1584 VanDerWaalsContact O-CB 3.28Å; I1580-L1584 WeakPolarHBondContact O-CB 3.47Å; I1580-L1584 PolarHBondContact O-N 3.25Å; C1581-L1584 WeakPolarHBondContact O-CB 3.3Å; C1581-L1584 PolarHBondContact O-N 3.07Å; L1582-L1584 VanDerWaalsContact C-N 3.33Å; L1584-I1586 VanDerWaalsContact C-N 3.25Å; L1584-I1586 PolarHBondContact O-N 3.39Å; L1584-C1587 PolarHBondContact O-N 3.4Å; L1584-L1588 WeakPolarHBondContact O-CB 3.28Å; L1584-L1588 WeakPolarHBondContact O-CD1 3.3Å; L1584-L1588 WeakPolarHBondContact O-CG 3.4Å; L1584-L1588 PolarHBondContact O-N 3.25Å
1585	V	40.8	Very low	35.6	Very low	30 Å²	30	71.3 Å²	71.3	18%	0.182	35%	0.354	C	S	.	.	H	α-helix	trans	-59	-38.6	175.4	168	0	0	0	0	110.8	C1581 L1582 L1588 L1589 I1632	C1581-V1585 WeakPolarHBondContact O-CB 3.47Å; C1581-V1585 VanDerWaalsContact O-CG2 3.31Å; C1581-V1585 WeakPolarHBondContact O-CG2 3.42Å; C1581-V1585 PolarHBondContact O-N 2.9Å; L1582-V1585 PolarHBondContact O-N 3.43Å; V1585-L1588 PolarHBondContact O-N 3.33Å; V1585-L1589 HydrophobicContact CG1-CD1 3.59Å; V1585-L1589 HydrophobicContact CG1-CG 4.23Å; V1585-L1589 VanDerWaalsContact O-CB 3.23Å; V1585-L1589 WeakPolarHBondContact O-CB 3.42Å; V1585-L1589 WeakPolarHBondContact O-CD1 3.26Å; V1585-L1589 WeakPolarHBondContact O-CG 3.32Å; V1585-L1589 PolarHBondContact O-N 3.3Å; V1585-I1632 HydrophobicContact CG2-CD1 4.31Å
1586	I	38.2	Very low	36.1	Very low	35 Å²	35	72.1 Å²	72.1	18%	0.179	36%	0.361	C	S	.	.	H	α-helix	trans	-68.6	-37.8	177.7	-76.4	166.5	0	0	0	112.7	L1582 Q1583 L1584 K1590	L1582-I1586 HydrophobicContact CD2-CD1 4.49Å; L1582-I1586 WeakPolarHBondContact O-CB 3.32Å; L1582-I1586 WeakPolarHBondContact O-CD1 3.37Å; L1582-I1586 WeakPolarHBondContact O-CG1 2.95Å; L1582-I1586 PolarHBondContact O-N 2.97Å; Q1583-I1586 PolarHBondContact O-N 3.46Å; L1584-I1586 VanDerWaalsContact C-N 3.25Å; L1584-I1586 PolarHBondContact O-N 3.39Å; I1586-K1590 WeakPolarHBondContact O-CB 3.41Å; I1586-K1590 PolarHBondContact O-N 3.07Å
1587	C	36.5	Very low	36.5	Very low	54 Å²	54	73.7 Å²	73.7	37%	0.365	37%	0.37	S	S	.	.	H	α-helix	trans	-69.1	-45.4	173.8	-72.6	0	0	0	0	110.8	Q1583 L1584 L1589 K1590	Q1583-C1587 WeakPolarHBondContact O-CB 3.37Å; Q1583-C1587 PolarHBondContact O-N 2.95Å; Q1583-C1587 PolarHBondContact O-SG 2.91Å; Q1583-C1587 VanDerWaalsContact O-SG 3.37Å; L1584-C1587 PolarHBondContact O-N 3.4Å; C1587-L1589 VanDerWaalsContact C-N 3.31Å; C1587-L1589 PolarHBondContact O-N 3.45Å; C1587-K1590 PolarHBondContact O-N 2.97Å
1588	L	34.8	Very low	36.9	Very low	65 Å²	65	79.4 Å²	79.4	34%	0.34	39%	0.393	S	S	.	.	H	α-helix	trans	-60.3	-37	175	-69.1	168.7	0	0	0	112.8	L1584 V1585 I1595	L1584-L1588 WeakPolarHBondContact O-CB 3.28Å; L1584-L1588 WeakPolarHBondContact O-CD1 3.3Å; L1584-L1588 WeakPolarHBondContact O-CG 3.4Å; L1584-L1588 PolarHBondContact O-N 3.25Å; V1585-L1588 PolarHBondContact O-N 3.33Å; L1588-I1595 HydrophobicContact CD2-CD1 3.59Å; L1588-I1595 HydrophobicContact CD2-CG1 4.44Å
1589	L	33.9	Very low	37.4	Very low	81 Å²	81	83.7 Å²	83.7	42%	0.424	41%	0.41	S	S	.	.	H	α-helix	trans	-78.4	-28.2	178	-74.1	171	0	0	0	113.6	V1585 C1587 L1597	V1585-L1589 HydrophobicContact CG1-CD1 3.59Å; V1585-L1589 HydrophobicContact CG1-CG 4.23Å; V1585-L1589 VanDerWaalsContact O-CB 3.23Å; V1585-L1589 WeakPolarHBondContact O-CB 3.42Å; V1585-L1589 WeakPolarHBondContact O-CD1 3.26Å; V1585-L1589 WeakPolarHBondContact O-CG 3.32Å; V1585-L1589 PolarHBondContact O-N 3.3Å; C1587-L1589 VanDerWaalsContact C-N 3.31Å; C1587-L1589 PolarHBondContact O-N 3.45Å; L1589-L1597 HydrophobicContact CD2-CD1 4.32Å
1590	K	37.8	Very low	37.8	Very low	123 Å²	123	83.8 Å²	83.8	54%	0.535	42%	0.421	S	S	.	.	H	α-helix	trans	-68.5	-36.6	-178.3	-107.4	-177	155.3	-157	0	113.3	I1586 C1587 K1592	I1586-K1590 WeakPolarHBondContact O-CB 3.41Å; I1586-K1590 PolarHBondContact O-N 3.07Å; C1587-K1590 PolarHBondContact O-N 2.97Å; K1590-K1592 VanDerWaalsContact C-N 3.34Å; K1590-K1592 PolarHBondContact O-N 3.26Å
1591	D	34	Very low	38	Very low	118 Å²	118	84.6 Å²	84.6	63%	0.631	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	14.6	-168.4	-74.8	-0.1	0	0	0	114.7	R1593	D1591-R1593 WeakPolarHBondContact O-CG 3.39Å; D1591-R1593 PolarHBondContact O-N 3.35Å
1592	K	33.9	Very low	38.4	Very low	170 Å²	170	86.9 Å²	86.9	74%	0.739	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	32.3	172.2	-67.8	-177	177.3	172.1	0	114.7	K1590 E1644	K1590-K1592 VanDerWaalsContact C-N 3.34Å; K1590-K1592 PolarHBondContact O-N 3.26Å; K1592-E1644 IonicContact NZ-OE2 2.72Å; K1592-E1644 PolarHBondContact NZ-OE2 3.38Å
1593	R	29.6	Very low	38.7	Very low	171 Å²	171	91.5 Å²	91.5	65%	0.645	45%	0.453	S	S	*	.			trans	-133	145	-175.9	-75	-177.2	175.8	-178.9	-1.3	115.3	D1591 I1595	D1591-R1593 WeakPolarHBondContact O-CG 3.39Å; D1591-R1593 PolarHBondContact O-N 3.35Å; R1593-I1595 PolarHBondContact O-N 2.87Å
1594	Q	35.5	Very low	38.8	Very low	201 Å²	201	90 Å²	90	94%	0.939	45%	0.452	S	S	*	.			trans	-72.1	93.9	-167.3	-66.1	174.9	-16.9	0	0	113
1595	I	35.6	Very low	38.9	Very low	71 Å²	71	90.7 Å²	90.7	36%	0.364	46%	0.461	S	S	.	.			trans	-96.1	133.3	138.5	-67.3	177.8	0	0	0	105.6	Q1462 L1588 R1593 L1597	Q1462-I1595 HydrophobicContact CG-CD1 3.65Å; Q1462-I1595 HydrophobicContact CG-CG1 4.47Å; L1588-I1595 HydrophobicContact CD2-CD1 3.59Å; L1588-I1595 HydrophobicContact CD2-CG1 4.44Å; R1593-I1595 PolarHBondContact O-N 2.87Å; I1595-L1597 VanDerWaalsContact C-N 3.3Å; I1595-L1597 PolarHBondContact O-N 3.31Å
1596	S	42.3	Very low	38.9	Very low	60 Å²	60	95.7 Å²	95.7	42%	0.42	48%	0.481	S	S	.	.			trans	-62.8	90.8	179.2	20.2	0	0	0	0	109.2	Q1598 E1599 A1600	S1596-Q1598 PolarHBondContact O-N 2.99Å; S1596-Q1598 VanDerWaalsContact O-N 3.09Å; S1596-E1599 WeakPolarHBondContact O-CA 3.46Å; S1596-E1599 VanDerWaalsContact O-CB 3.3Å; S1596-E1599 WeakPolarHBondContact O-CB 3.46Å; S1596-E1599 PolarHBondContact O-N 2.83Å; S1596-E1599 PolarHBondContact OG-OE2 2.94Å; S1596-A1600 PolarHBondContact O-N 3.33Å
1597	L	40.6	Very low	39	Very low	61 Å²	61	96.6 Å²	96.6	32%	0.319	49%	0.488	S	S	.	.	H	α-helix	trans	-51.7	-33	176.1	176.9	119.8	0	0	0	111.8	L1589 I1595 E1599 A1600 I1601 L1636	L1589-L1597 HydrophobicContact CD2-CD1 4.32Å; I1595-L1597 VanDerWaalsContact C-N 3.3Å; I1595-L1597 PolarHBondContact O-N 3.31Å; L1597-E1599 VanDerWaalsContact C-N 3.28Å; L1597-E1599 PolarHBondContact O-N 3.32Å; L1597-A1600 PolarHBondContact O-N 2.82Å; L1597-I1601 HydrophobicContact CD2-CD1 3.55Å; L1597-I1601 HydrophobicContact CG-CD1 3.81Å; L1597-I1601 WeakPolarHBondContact O-CB 3.33Å; L1597-I1601 VanDerWaalsContact O-CG1 3.28Å; L1597-I1601 WeakPolarHBondContact O-CG1 3.47Å; L1597-I1601 PolarHBondContact O-N 3.42Å; L1597-L1636 HydrophobicContact CD1-CD2 4.04Å; L1597-L1636 HydrophobicContact CD2-CD1 3.66Å; L1597-L1636 HydrophobicContact CD2-CD2 3.42Å; L1597-L1636 VanDerWaalsContact CD2-CD2 3.42Å; L1597-L1636 HydrophobicContact CD2-CG 4.17Å; L1597-L1636 HydrophobicContact CG-CD2 4.37Å
1598	Q	42.8	Very low	39.1	Very low	154 Å²	154	95.3 Å²	95.3	72%	0.72	48%	0.477	S	S	*	.	H	α-helix	trans	-56.9	-34.9	170.7	-169.1	171.7	6.8	0	0	113.8	S1596 T1602	S1596-Q1598 PolarHBondContact O-N 2.99Å; S1596-Q1598 VanDerWaalsContact O-N 3.09Å; Q1598-T1602 WeakPolarHBondContact O-CB 3.27Å; Q1598-T1602 VanDerWaalsContact O-CG2 3.28Å; Q1598-T1602 WeakPolarHBondContact O-CG2 3.3Å; Q1598-T1602 PolarHBondContact O-N 2.76Å; Q1598-T1602 PolarHBondContact O-OG1 2.99Å
1599	E	44.5	Very low	39.3	Very low	106 Å²	106	97.9 Å²	97.9	50%	0.495	49%	0.487	S	S	.	.	H	α-helix	trans	-80.3	-32.3	-179	-164.4	171.1	-169.6	0	0	112.5	S1596 L1597 T1602 R1603	S1596-E1599 WeakPolarHBondContact O-CA 3.46Å; S1596-E1599 VanDerWaalsContact O-CB 3.3Å; S1596-E1599 WeakPolarHBondContact O-CB 3.46Å; S1596-E1599 PolarHBondContact O-N 2.83Å; S1596-E1599 PolarHBondContact OG-OE2 2.94Å; L1597-E1599 VanDerWaalsContact C-N 3.28Å; L1597-E1599 PolarHBondContact O-N 3.32Å; E1599-T1602 WeakPolarHBondContact CA-OG1 3.41Å; E1599-T1602 PolarHBondContact O-OG1 3.25Å; E1599-R1603 PolarHBondContact O-N 2.79Å; E1599-R1603 VanDerWaalsContact O-N 3.14Å
1600	A	42.8	Very low	39.5	Very low	60 Å²	60	98.4 Å²	98.4	50%	0.496	49%	0.488	S	S	.	.	H	α-helix	trans	-69.6	-43	169.7	0	0	0	0	0	111.3	S1596 L1597 R1603 A1604	S1596-A1600 PolarHBondContact O-N 3.33Å; L1597-A1600 PolarHBondContact O-N 2.82Å; A1600-R1603 PolarHBondContact O-N 3.5Å; A1600-A1604 WeakPolarHBondContact O-CB 3.35Å; A1600-A1604 PolarHBondContact O-N 3.21Å
1601	I	44.1	Very low	39.5	Very low	51 Å²	51	94 Å²	94	26%	0.262	47%	0.468	S	S	.	.	H	α-helix	trans	-66.2	-43.7	177.2	-69.2	167.7	0	0	0	111.1	L1597 R1603 A1604 A1605 L1629 I1632 L1636	L1597-I1601 HydrophobicContact CD2-CD1 3.55Å; L1597-I1601 HydrophobicContact CG-CD1 3.81Å; L1597-I1601 WeakPolarHBondContact O-CB 3.33Å; L1597-I1601 VanDerWaalsContact O-CG1 3.28Å; L1597-I1601 WeakPolarHBondContact O-CG1 3.47Å; L1597-I1601 PolarHBondContact O-N 3.42Å; I1601-R1603 PolarHBondContact O-N 3.04Å; I1601-A1604 PolarHBondContact O-N 3.11Å; I1601-A1605 VanDerWaalsContact O-CB 3.29Å; I1601-A1605 WeakPolarHBondContact O-CB 3.32Å; I1601-A1605 PolarHBondContact O-N 3.37Å; I1601-L1629 HydrophobicContact CG2-CD2 4.43Å; I1601-I1632 HydrophobicContact CD1-CG2 3.92Å; I1601-I1632 HydrophobicContact CG1-CG2 4.13Å; I1601-L1636 HydrophobicContact CD1-CD1 3.72Å
1602	T	43.8	Very low	39.8	Very low	78 Å²	78	91.3 Å²	91.3	48%	0.479	45%	0.453	S	S	.	.	H	α-helix	trans	-65.6	-35.9	176.3	50.7	0	0	0	0	112.4	Q1598 E1599 F1606	Q1598-T1602 WeakPolarHBondContact O-CB 3.27Å; Q1598-T1602 VanDerWaalsContact O-CG2 3.28Å; Q1598-T1602 WeakPolarHBondContact O-CG2 3.3Å; Q1598-T1602 PolarHBondContact O-N 2.76Å; Q1598-T1602 PolarHBondContact O-OG1 2.99Å; E1599-T1602 WeakPolarHBondContact CA-OG1 3.41Å; E1599-T1602 PolarHBondContact O-OG1 3.25Å; T1602-F1606 VanDerWaalsContact O-CB 3.29Å; T1602-F1606 WeakPolarHBondContact O-CB 3.29Å; T1602-F1606 PolarHBondContact O-N 3.01Å
1603	R	42	Very low	39.9	Very low	138 Å²	138	88.8 Å²	88.8	52%	0.521	45%	0.447	S	S	.	.	H	α-helix	trans	-64.4	-45.5	171.5	-115.8	72.4	-172.8	-154.1	5.1	112.3	E1599 A1600 I1601 A1605 F1606 V1607	E1599-R1603 PolarHBondContact O-N 2.79Å; E1599-R1603 VanDerWaalsContact O-N 3.14Å; A1600-R1603 PolarHBondContact O-N 3.5Å; I1601-R1603 PolarHBondContact O-N 3.04Å; R1603-A1605 PolarHBondContact O-N 3.19Å; R1603-F1606 WeakPolarHBondContact O-CB 3.34Å; R1603-F1606 PolarHBondContact O-N 3.11Å; R1603-V1607 WeakPolarHBondContact O-CG2 3.21Å; R1603-V1607 PolarHBondContact O-N 2.78Å
1604	A	41.9	Very low	40	Very low	35 Å²	35	88.8 Å²	88.8	29%	0.289	45%	0.452	S	S	.	.	H	α-helix	trans	-63.7	-39.9	177.9	0	0	0	0	0	112.1	A1600 I1601 V1607 L1608 L1629	A1600-A1604 WeakPolarHBondContact O-CB 3.35Å; A1600-A1604 PolarHBondContact O-N 3.21Å; I1601-A1604 PolarHBondContact O-N 3.11Å; A1604-V1607 PolarHBondContact O-N 3.49Å; A1604-L1608 WeakPolarHBondContact O-CB 3.36Å; A1604-L1608 PolarHBondContact O-N 3.31Å; A1604-L1629 HydrophobicContact CB-CD2 3.93Å
1605	A	40.9	Very low	39.9	Very low	42 Å²	42	83.1 Å²	83.1	35%	0.347	43%	0.428	S	S	.	.	H	α-helix	trans	-66.4	-36.5	173.1	0	0	0	0	0	112.5	I1601 R1603 L1608 H1609	I1601-A1605 VanDerWaalsContact O-CB 3.29Å; I1601-A1605 WeakPolarHBondContact O-CB 3.32Å; I1601-A1605 PolarHBondContact O-N 3.37Å; R1603-A1605 PolarHBondContact O-N 3.19Å; A1605-L1608 WeakPolarHBondContact O-CB 3.39Å; A1605-L1608 PolarHBondContact O-N 3.23Å; A1605-H1609 WeakPolarHBondContact O-CB 3.46Å; A1605-H1609 PolarHBondContact O-N 3.32Å
1606	F	41.1	Very low	39.8	Very low	136 Å²	136	81.1 Å²	81.1	60%	0.596	42%	0.424	S	S	*	.	H	α-helix	trans	-65	-44.9	174.9	-163.9	-85	0	0	0	111.5	T1602 R1603 H1609 E1610	T1602-F1606 VanDerWaalsContact O-CB 3.29Å; T1602-F1606 WeakPolarHBondContact O-CB 3.29Å; T1602-F1606 PolarHBondContact O-N 3.01Å; R1603-F1606 WeakPolarHBondContact O-CB 3.34Å; R1603-F1606 PolarHBondContact O-N 3.11Å; F1606-H1609 PolarHBondContact O-N 3.44Å; F1606-E1610 HydrophobicContact CD1-CG 4.39Å; F1606-E1610 HydrophobicContact CE1-CG 4.13Å; F1606-E1610 PolarHBondContact O-N 3.25Å
1607	V	40.5	Very low	39.5	Very low	53 Å²	53	82.5 Å²	82.5	32%	0.321	43%	0.43	S	S	.	.	H	α-helix	trans	-65.9	-38.1	174.9	174.2	0	0	0	0	111.7	R1603 A1604 R1611	R1603-V1607 WeakPolarHBondContact O-CG2 3.21Å; R1603-V1607 PolarHBondContact O-N 2.78Å; A1604-V1607 PolarHBondContact O-N 3.49Å; V1607-R1611 WeakPolarHBondContact O-CB 3.42Å; V1607-R1611 WeakPolarHBondContact O-CG 3.28Å; V1607-R1611 PolarHBondContact O-N 3.46Å
1608	L	38.3	Very low	39.4	Very low	27 Å²	27	85.5 Å²	85.5	14%	0.141	45%	0.446	C	S	.	.	H	α-helix	trans	-59.3	-48.1	170.2	-175.1	83.5	0	0	0	110.4	A1604 A1605 R1611 I1612 T1622 I1625 L1629	A1604-L1608 WeakPolarHBondContact O-CB 3.36Å; A1604-L1608 PolarHBondContact O-N 3.31Å; A1605-L1608 WeakPolarHBondContact O-CB 3.39Å; A1605-L1608 PolarHBondContact O-N 3.23Å; L1608-R1611 CarbonylContact O-C 3.54Å; L1608-R1611 PolarHBondContact O-N 2.87Å; L1608-R1611 VanDerWaalsContact O-N 3.15Å; L1608-I1612 HydrophobicContact CD2-CD1 4.01Å; L1608-I1612 HydrophobicContact CG-CD1 3.87Å; L1608-I1612 HydrophobicContact CG-CG1 4.4Å; L1608-I1612 WeakPolarHBondContact O-CG1 3.29Å; L1608-I1612 PolarHBondContact O-N 3.43Å; L1608-T1622 HydrophobicContact CD1-CG2 4.02Å; L1608-T1622 WeakPolarHBondContact CD1-O 3.44Å; L1608-I1625 HydrophobicContact CB-CG2 3.96Å; L1608-I1625 HydrophobicContact CD1-CB 3.66Å; L1608-I1625 HydrophobicContact CD1-CG2 3.64Å; L1608-I1625 HydrophobicContact CG-CG2 4.41Å; L1608-L1629 HydrophobicContact CB-CD1 4.19Å; L1608-L1629 HydrophobicContact CD2-CD1 3.85Å; L1608-L1629 HydrophobicContact CG-CD1 4.4Å
1609	H	38.9	Very low	39.4	Very low	119 Å²	119	81.6 Å²	81.6	55%	0.551	43%	0.428	S	S	*	.	H	α-helix	trans	-65.6	-43.9	-175.3	-166	-2.7	0	0	0	112.3	A1605 F1606 R1611 I1612 L1613	A1605-H1609 WeakPolarHBondContact O-CB 3.46Å; A1605-H1609 PolarHBondContact O-N 3.32Å; F1606-H1609 PolarHBondContact O-N 3.44Å; H1609-R1611 VanDerWaalsContact C-N 3.31Å; H1609-R1611 PolarHBondContact O-N 2.96Å; H1609-I1612 PolarHBondContact O-N 2.85Å; H1609-L1613 WeakPolarHBondContact O-CB 3.27Å; H1609-L1613 PolarHBondContact O-N 3.46Å
1610	E	39.2	Very low	39.2	Very low	93 Å²	93	79.6 Å²	79.6	44%	0.435	42%	0.424	S	S	.	.	H	α-helix	trans	-60.3	-40.4	171.5	-76.8	-156.7	147.2	0	0	111.5	F1606 L1613 F1614	F1606-E1610 HydrophobicContact CD1-CG 4.39Å; F1606-E1610 HydrophobicContact CE1-CG 4.13Å; F1606-E1610 PolarHBondContact O-N 3.25Å; E1610-L1613 CarbonylContact O-C 3.52Å; E1610-L1613 WeakPolarHBondContact O-CA 3.4Å; E1610-L1613 VanDerWaalsContact O-CB 3.3Å; E1610-L1613 WeakPolarHBondContact O-CB 3.36Å; E1610-L1613 PolarHBondContact O-N 3.42Å; E1610-F1614 WeakPolarHBondContact O-CD2 3.44Å; E1610-F1614 PolarHBondContact O-N 3.06Å
1611	R	37.6	Very low	39	Very low	29 Å²	29	77.7 Å²	77.7	11%	0.109	41%	0.408	C	S	.	.	H	α-helix	trans	-71.8	-34	179.3	-74.2	-173.2	175	-162.7	0.7	113.6	T1473 Y1474 V1607 L1608 H1609 L1613 F1614 L1615 G1616	T1473-R1611 PolarHBondContact O-NH1 3.18Å; T1473-R1611 PolarHBondContact O-NH2 3.19Å; Y1474-R1611 VanDerWaalsContact CD2-NH2 3.28Å; Y1474-R1611 VanDerWaalsContact CE2-NH2 3.27Å; V1607-R1611 WeakPolarHBondContact O-CB 3.42Å; V1607-R1611 WeakPolarHBondContact O-CG 3.28Å; V1607-R1611 PolarHBondContact O-N 3.46Å; L1608-R1611 CarbonylContact O-C 3.54Å; L1608-R1611 PolarHBondContact O-N 2.87Å; L1608-R1611 VanDerWaalsContact O-N 3.15Å; H1609-R1611 VanDerWaalsContact C-N 3.31Å; H1609-R1611 PolarHBondContact O-N 2.96Å; R1611-L1613 VanDerWaalsContact C-N 3.28Å; R1611-L1613 PolarHBondContact O-N 3.49Å; R1611-F1614 PolarHBondContact O-N 3.28Å; R1611-L1615 HydrophobicContact CB-CD1 4.24Å; R1611-L1615 HydrophobicContact CG-CD1 4.15Å; R1611-L1615 WeakPolarHBondContact O-CA 3.44Å; R1611-L1615 WeakPolarHBondContact O-CB 3.02Å; R1611-L1615 PolarHBondContact O-N 3.31Å; R1611-G1616 PolarHBondContact O-N 2.86Å
1612	I	40.8	Very low	38.9	Very low	62 Å²	62	75.4 Å²	75.4	32%	0.318	40%	0.397	S	S	.	.	H	α-helix	trans	-58	-44.9	166.9	-70	166	0	0	0	109.8	L1608 H1609 G1616 V1617 T1622	L1608-I1612 HydrophobicContact CD2-CD1 4.01Å; L1608-I1612 HydrophobicContact CG-CD1 3.87Å; L1608-I1612 HydrophobicContact CG-CG1 4.4Å; L1608-I1612 WeakPolarHBondContact O-CG1 3.29Å; L1608-I1612 PolarHBondContact O-N 3.43Å; H1609-I1612 PolarHBondContact O-N 2.85Å; I1612-G1616 WeakPolarHBondContact O-CA 3.49Å; I1612-G1616 PolarHBondContact O-N 3.35Å; I1612-G1616 VanDerWaalsContact O-N 3.12Å; I1612-V1617 HydrophobicContact CG2-CG2 3.84Å; I1612-T1622 HydrophobicContact CB-CG2 4.42Å; I1612-T1622 HydrophobicContact CD1-CG2 4.32Å; I1612-T1622 HydrophobicContact CG1-CG2 3.35Å
1613	L	34.3	Very low	39	Very low	118 Å²	118	74.9 Å²	74.9	62%	0.618	39%	0.39	S	S	*	.	H	α-helix	trans	-64.2	-38.8	179	-102.7	151.6	0	0	0	113.9	H1609 E1610 R1611	H1609-L1613 WeakPolarHBondContact O-CB 3.27Å; H1609-L1613 PolarHBondContact O-N 3.46Å; E1610-L1613 CarbonylContact O-C 3.52Å; E1610-L1613 WeakPolarHBondContact O-CA 3.4Å; E1610-L1613 VanDerWaalsContact O-CB 3.3Å; E1610-L1613 WeakPolarHBondContact O-CB 3.36Å; E1610-L1613 PolarHBondContact O-N 3.42Å; R1611-L1613 VanDerWaalsContact C-N 3.28Å; R1611-L1613 PolarHBondContact O-N 3.49Å
1614	F	31.8	Very low	39	Very low	170 Å²	170	70.5 Å²	70.5	75%	0.746	38%	0.376	S	S	*	.	H	α-helix	trans	-94.5	-35.3	-175.2	-83.8	-72.8	0	0	0	115.1	E1610 R1611	E1610-F1614 WeakPolarHBondContact O-CD2 3.44Å; E1610-F1614 PolarHBondContact O-N 3.06Å; R1611-F1614 PolarHBondContact O-N 3.28Å
1615	L	34.7	Very low	39.1	Very low	83 Å²	83	70 Å²	70	44%	0.435	37%	0.368	S	S	.	.	H	α-helix	trans	-111.9	-21	-171.5	-60.1	168.2	0	0	0	113.3	R1611 H1619	R1611-L1615 HydrophobicContact CB-CD1 4.24Å; R1611-L1615 HydrophobicContact CG-CD1 4.15Å; R1611-L1615 WeakPolarHBondContact O-CA 3.44Å; R1611-L1615 WeakPolarHBondContact O-CB 3.02Å; R1611-L1615 PolarHBondContact O-N 3.31Å; L1615-H1619 HydrophobicContact CB-CB 3.82Å
1616	G	33.9	Very low	39.4	Very low	28 Å²	28	70.2 Å²	70.2	29%	0.289	37%	0.367	S	S	.	.			trans	96	160.8	-172.7	0	0	0	0	0	113	R1611 I1612 D1618 T1622	R1611-G1616 PolarHBondContact O-N 2.86Å; I1612-G1616 WeakPolarHBondContact O-CA 3.49Å; I1612-G1616 PolarHBondContact O-N 3.35Å; I1612-G1616 VanDerWaalsContact O-N 3.12Å; G1616-D1618 VanDerWaalsContact C-N 3.35Å; G1616-T1622 PolarHBondContact O-OG1 3.48Å; G1616-T1622 VanDerWaalsContact O-OG1 3.09Å
1617	V	35.7	Very low	39.7	Very low	89 Å²	89	69.9 Å²	69.9	54%	0.539	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-42.4	-179.2	-177.2	0	0	0	0	110.8	I1612 H1619	I1612-V1617 HydrophobicContact CG2-CG2 3.84Å; V1617-H1619 VanDerWaalsContact C-N 3.25Å; V1617-H1619 PolarHBondContact O-N 3.31Å
1618	D	37.4	Very low	39.8	Very low	124 Å²	124	68.6 Å²	68.6	66%	0.663	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	4.3	-172.3	-43.2	-68.5	0	0	0	113.8	G1616 I1623	G1616-D1618 VanDerWaalsContact C-N 3.35Å; D1618-I1623 WeakPolarHBondContact O-CD1 3.17Å
1619	H	42.8	Very low	40.2	Very low	73 Å²	73	68.6 Å²	68.6	34%	0.338	36%	0.356	S	S	.	.	S	Bend	trans	-70.4	135.1	177.7	-174.1	-90.7	0	0	0	110.2	L1615 V1617 A1621 T1622 I1623	L1615-H1619 HydrophobicContact CB-CB 3.82Å; V1617-H1619 VanDerWaalsContact C-N 3.25Å; V1617-H1619 PolarHBondContact O-N 3.31Å; H1619-A1621 VanDerWaalsContact C-N 3.3Å; H1619-A1621 PolarHBondContact O-N 3.31Å; H1619-A1621 VanDerWaalsContact O-N 3.12Å; H1619-T1622 WeakPolarHBondContact O-CA 3.37Å; H1619-T1622 VanDerWaalsContact O-CB 3.3Å; H1619-T1622 WeakPolarHBondContact O-CB 3.38Å; H1619-T1622 PolarHBondContact O-N 2.96Å; H1619-I1623 PolarHBondContact O-N 3.41Å; H1619-I1623 VanDerWaalsContact O-N 3.07Å
1620	P	40.2	Very low	40.5	Very low	63 Å²	63	66.4 Å²	66.4	41%	0.409	35%	0.349	S	S	.	.	H	α-helix	trans	-53.5	-42.3	-170.8	-29.8	35.1	0	0	0	114.5	T1622 I1623 Q1624	P1620-T1622 VanDerWaalsContact C-N 3.3Å; P1620-T1622 PolarHBondContact O-N 2.83Å; P1620-I1623 PolarHBondContact O-N 3.18Å; P1620-Q1624 WeakPolarHBondContact O-CG 3.49Å; P1620-Q1624 PolarHBondContact O-N 3.16Å
1621	A	39.3	Very low	40.8	Very low	20 Å²	20	67.3 Å²	67.3	17%	0.165	35%	0.353	C	S	.	.	H	α-helix	trans	-63.9	-33.5	176.7	0	0	0	0	0	113	H1619 I1625	H1619-A1621 VanDerWaalsContact C-N 3.3Å; H1619-A1621 PolarHBondContact O-N 3.31Å; H1619-A1621 VanDerWaalsContact O-N 3.12Å; A1621-I1625 WeakPolarHBondContact O-CD1 3.42Å; A1621-I1625 VanDerWaalsContact O-CG1 3.23Å; A1621-I1625 WeakPolarHBondContact O-CG1 3.38Å; A1621-I1625 PolarHBondContact O-N 2.84Å
1622	T	41.6	Very low	41	Very low	4 Å²	4	66.9 Å²	66.9	3%	0.025	35%	0.352	C	S	.	.	H	α-helix	trans	-71.5	-45.9	178	-45.7	0	0	0	0	110.5	L1608 I1612 G1616 H1619 P1620 Q1624 I1625 S1626	L1608-T1622 HydrophobicContact CD1-CG2 4.02Å; L1608-T1622 WeakPolarHBondContact CD1-O 3.44Å; I1612-T1622 HydrophobicContact CB-CG2 4.42Å; I1612-T1622 HydrophobicContact CD1-CG2 4.32Å; I1612-T1622 HydrophobicContact CG1-CG2 3.35Å; G1616-T1622 PolarHBondContact O-OG1 3.48Å; G1616-T1622 VanDerWaalsContact O-OG1 3.09Å; H1619-T1622 WeakPolarHBondContact O-CA 3.37Å; H1619-T1622 VanDerWaalsContact O-CB 3.3Å; H1619-T1622 WeakPolarHBondContact O-CB 3.38Å; H1619-T1622 PolarHBondContact O-N 2.96Å; P1620-T1622 VanDerWaalsContact C-N 3.3Å; P1620-T1622 PolarHBondContact O-N 2.83Å; T1622-Q1624 VanDerWaalsContact C-N 3.27Å; T1622-Q1624 PolarHBondContact O-N 3.18Å; T1622-I1625 PolarHBondContact O-N 3.26Å; T1622-S1626 WeakPolarHBondContact O-CB 3.45Å; T1622-S1626 PolarHBondContact O-N 3.23Å
1623	I	45.3	Very low	41	Very low	67 Å²	67	68.2 Å²	68.2	34%	0.344	36%	0.357	S	S	.	.	H	α-helix	trans	-59.2	-38.9	174.5	-63.1	172.8	0	0	0	111	D1618 H1619 P1620 S1626 K1627	D1618-I1623 WeakPolarHBondContact O-CD1 3.17Å; H1619-I1623 PolarHBondContact O-N 3.41Å; H1619-I1623 VanDerWaalsContact O-N 3.07Å; P1620-I1623 PolarHBondContact O-N 3.18Å; I1623-S1626 WeakPolarHBondContact O-CB 3.42Å; I1623-K1627 HydrophobicContact CG2-CD 4.17Å; I1623-K1627 WeakPolarHBondContact O-CG 3.36Å; I1623-K1627 PolarHBondContact O-N 2.93Å
1624	Q	43.3	Very low	41.5	Very low	45 Å²	45	67.9 Å²	67.9	21%	0.21	35%	0.352	C	S	.	.	H	α-helix	trans	-69.6	-45.1	176.8	-77.7	-168.9	-42.3	0	0	113.5	Q1574 P1620 T1622 S1626 K1627 I1628	Q1574-Q1624 VanDerWaalsContact C-NE2 3.3Å; Q1574-Q1624 PolarHBondContact O-NE2 3.41Å; Q1574-Q1624 PolarHBondContact O-OE1 3.22Å; P1620-Q1624 WeakPolarHBondContact O-CG 3.49Å; P1620-Q1624 PolarHBondContact O-N 3.16Å; T1622-Q1624 VanDerWaalsContact C-N 3.27Å; T1622-Q1624 PolarHBondContact O-N 3.18Å; Q1624-S1626 PolarHBondContact O-N 3.01Å; Q1624-K1627 PolarHBondContact O-N 2.86Å; Q1624-K1627 VanDerWaalsContact O-N 3.15Å; Q1624-I1628 VanDerWaalsContact O-CG1 3.26Å; Q1624-I1628 WeakPolarHBondContact O-CG1 3.32Å; Q1624-I1628 PolarHBondContact O-N 2.87Å
1625	I	43.8	Very low	41.6	Very low	26 Å²	26	65.8 Å²	65.8	13%	0.133	34%	0.34	C	S	.	.	H	α-helix	trans	-63.3	-36.1	176.8	-62	162.4	0	0	0	109.9	L1608 A1621 T1622 I1628 L1629	L1608-I1625 HydrophobicContact CB-CG2 3.96Å; L1608-I1625 HydrophobicContact CD1-CB 3.66Å; L1608-I1625 HydrophobicContact CD1-CG2 3.64Å; L1608-I1625 HydrophobicContact CG-CG2 4.41Å; A1621-I1625 WeakPolarHBondContact O-CD1 3.42Å; A1621-I1625 VanDerWaalsContact O-CG1 3.23Å; A1621-I1625 WeakPolarHBondContact O-CG1 3.38Å; A1621-I1625 PolarHBondContact O-N 2.84Å; T1622-I1625 PolarHBondContact O-N 3.26Å; I1625-I1628 PolarHBondContact O-N 2.69Å; I1625-L1629 HydrophobicContact CG2-CD1 4.16Å; I1625-L1629 WeakPolarHBondContact O-CG 3.25Å; I1625-L1629 PolarHBondContact O-N 2.99Å
1626	S	46.1	Very low	41.7	Very low	46 Å²	46	64.1 Å²	64.1	32%	0.322	33%	0.332	S	S	.	.	H	α-helix	trans	-57.7	-53.7	169.4	-169.9	0	0	0	0	111.4	T1622 I1623 Q1624 I1628 L1629 D1630	T1622-S1626 WeakPolarHBondContact O-CB 3.45Å; T1622-S1626 PolarHBondContact O-N 3.23Å; I1623-S1626 WeakPolarHBondContact O-CB 3.42Å; Q1624-S1626 PolarHBondContact O-N 3.01Å; S1626-I1628 VanDerWaalsContact C-N 3.27Å; S1626-I1628 PolarHBondContact O-N 2.72Å; S1626-L1629 CarbonylContact O-C 3.49Å; S1626-L1629 WeakPolarHBondContact O-CA 3.4Å; S1626-L1629 WeakPolarHBondContact O-CB 3.34Å; S1626-L1629 PolarHBondContact O-N 3.14Å; S1626-D1630 PolarHBondContact O-N 3.04Å; S1626-D1630 VanDerWaalsContact O-OD2 3.1Å
1627	K	47.8	Very low	41.9	Very low	128 Å²	128	67 Å²	67	56%	0.557	34%	0.339	S	S	*	.	H	α-helix	trans	-60.5	-33.2	179.5	-74.4	172.5	179.7	178.7	0	113.5	I1623 Q1624 H1631	I1623-K1627 HydrophobicContact CG2-CD 4.17Å; I1623-K1627 WeakPolarHBondContact O-CG 3.36Å; I1623-K1627 PolarHBondContact O-N 2.93Å; Q1624-K1627 PolarHBondContact O-N 2.86Å; Q1624-K1627 VanDerWaalsContact O-N 3.15Å; K1627-H1631 WeakPolarHBondContact O-CB 3.47Å; K1627-H1631 PolarHBondContact O-N 3.11Å
1628	I	44.1	Very low	42	Very low	27 Å²	27	68.1 Å²	68.1	14%	0.138	34%	0.338	C	S	.	.	H	α-helix	trans	-66.9	-45.8	173.5	-66.8	161.9	0	0	0	110.1	A1578 Q1624 I1625 S1626 H1631 I1632	A1578-I1628 HydrophobicContact CB-CD1 3.56Å; A1578-I1628 HydrophobicContact CB-CG1 3.74Å; Q1624-I1628 VanDerWaalsContact O-CG1 3.26Å; Q1624-I1628 WeakPolarHBondContact O-CG1 3.32Å; Q1624-I1628 PolarHBondContact O-N 2.87Å; I1625-I1628 PolarHBondContact O-N 2.69Å; S1626-I1628 VanDerWaalsContact C-N 3.27Å; S1626-I1628 PolarHBondContact O-N 2.72Å; I1628-H1631 PolarHBondContact O-N 3.01Å; I1628-I1632 HydrophobicContact CG2-CD1 3.83Å; I1628-I1632 VanDerWaalsContact O-CG1 3.28Å; I1628-I1632 WeakPolarHBondContact O-CG1 3.34Å; I1628-I1632 PolarHBondContact O-N 3.09Å
1629	L	44.8	Very low	41.7	Very low	26 Å²	26	64.4 Å²	64.4	14%	0.136	33%	0.33	C	S	.	.	H	α-helix	trans	-62.6	-45.5	175.9	-74.3	164.2	0	0	0	111.6	I1601 A1604 L1608 I1625 S1626 H1631 I1632 E1633	I1601-L1629 HydrophobicContact CG2-CD2 4.43Å; A1604-L1629 HydrophobicContact CB-CD2 3.93Å; L1608-L1629 HydrophobicContact CB-CD1 4.19Å; L1608-L1629 HydrophobicContact CD2-CD1 3.85Å; L1608-L1629 HydrophobicContact CG-CD1 4.4Å; I1625-L1629 HydrophobicContact CG2-CD1 4.16Å; I1625-L1629 WeakPolarHBondContact O-CG 3.25Å; I1625-L1629 PolarHBondContact O-N 2.99Å; S1626-L1629 CarbonylContact O-C 3.49Å; S1626-L1629 WeakPolarHBondContact O-CA 3.4Å; S1626-L1629 WeakPolarHBondContact O-CB 3.34Å; S1626-L1629 PolarHBondContact O-N 3.14Å; L1629-H1631 VanDerWaalsContact C-N 3.3Å; L1629-H1631 PolarHBondContact O-N 2.91Å; L1629-I1632 PolarHBondContact O-N 2.84Å; L1629-I1632 VanDerWaalsContact O-N 3.13Å; L1629-E1633 WeakPolarHBondContact O-CB 3.39Å; L1629-E1633 PolarHBondContact O-N 3.19Å
1630	D	47.1	Very low	41.1	Very low	74 Å²	74	71.6 Å²	71.6	40%	0.396	35%	0.354	S	S	.	.	H	α-helix	trans	-58.4	-40.9	175.3	-62.5	-39.8	0	0	0	111.5	S1626 H1634	S1626-D1630 PolarHBondContact O-N 3.04Å; S1626-D1630 VanDerWaalsContact O-OD2 3.1Å; D1630-H1634 WeakPolarHBondContact O-CB 3.44Å; D1630-H1634 PolarHBondContact O-N 3.35Å
1631	H	44.7	Very low	40.5	Very low	111 Å²	111	74.1 Å²	74.1	51%	0.514	37%	0.368	S	S	.	.	H	α-helix	trans	-67.6	-39	175.1	-99.1	39.4	0	0	0	113.2	K1627 I1628 L1629 Y1635	K1627-H1631 WeakPolarHBondContact O-CB 3.47Å; K1627-H1631 PolarHBondContact O-N 3.11Å; I1628-H1631 PolarHBondContact O-N 3.01Å; L1629-H1631 VanDerWaalsContact C-N 3.3Å; L1629-H1631 PolarHBondContact O-N 2.91Å; H1631-Y1635 WeakPolarHBondContact O-CB 3.5Å; H1631-Y1635 PolarHBondContact O-N 3.21Å
1632	I	41.2	Very low	39.9	Very low	21 Å²	21	78.1 Å²	78.1	11%	0.108	40%	0.395	C	S	.	.	H	α-helix	trans	-65.4	-46.7	175.2	-70.4	165.4	0	0	0	109.9	V1585 I1601 I1628 L1629 Y1635 L1636	V1585-I1632 HydrophobicContact CG2-CD1 4.31Å; I1601-I1632 HydrophobicContact CD1-CG2 3.92Å; I1601-I1632 HydrophobicContact CG1-CG2 4.13Å; I1628-I1632 HydrophobicContact CG2-CD1 3.83Å; I1628-I1632 VanDerWaalsContact O-CG1 3.28Å; I1628-I1632 WeakPolarHBondContact O-CG1 3.34Å; I1628-I1632 PolarHBondContact O-N 3.09Å; L1629-I1632 PolarHBondContact O-N 2.84Å; L1629-I1632 VanDerWaalsContact O-N 3.13Å; I1632-Y1635 PolarHBondContact O-N 3.34Å; I1632-L1636 HydrophobicContact CG2-CD1 3.8Å; I1632-L1636 WeakPolarHBondContact O-CD1 3.44Å; I1632-L1636 VanDerWaalsContact O-CG 3.22Å; I1632-L1636 WeakPolarHBondContact O-CG 3.35Å; I1632-L1636 PolarHBondContact O-N 3.07Å
1633	E	40.3	Very low	39.2	Very low	89 Å²	89	85.6 Å²	85.6	42%	0.416	44%	0.435	S	S	.	.	H	α-helix	trans	-62.2	-46.1	178	-168.5	176	169.7	0	0	111.5	L1629 Y1635 L1636 I1637 Y1665	L1629-E1633 WeakPolarHBondContact O-CB 3.39Å; L1629-E1633 PolarHBondContact O-N 3.19Å; E1633-Y1635 VanDerWaalsContact C-N 3.33Å; E1633-Y1635 PolarHBondContact O-N 3.07Å; E1633-L1636 PolarHBondContact O-N 3.12Å; E1633-L1636 VanDerWaalsContact O-N 3.1Å; E1633-I1637 HydrophobicContact CG-CD1 3.83Å; E1633-I1637 HydrophobicContact CG-CG1 4.48Å; E1633-I1637 WeakPolarHBondContact O-CG1 3.1Å; E1633-I1637 PolarHBondContact O-N 3.44Å; E1633-Y1665 PolarHBondContact OE1-OH 3.22Å
1634	H	44.7	Very low	38.3	Very low	112 Å²	112	90.1 Å²	90.1	52%	0.519	46%	0.455	S	S	.	.	H	α-helix	trans	-59.8	-40.2	174.8	-173.7	-82.6	0	0	0	112.4	D1630 L1636 H1638	D1630-H1634 WeakPolarHBondContact O-CB 3.44Å; D1630-H1634 PolarHBondContact O-N 3.35Å; H1634-L1636 VanDerWaalsContact C-N 3.33Å; H1634-L1636 PolarHBondContact O-N 3.27Å; H1634-H1638 AromaticContact CD2-CD2 3.71Å; H1634-H1638 AromaticContact CE1-CD2 3.67Å; H1634-H1638 AromaticContact CG-CD2 3.94Å; H1634-H1638 AromaticContact ND1-CD2 3.92Å; H1634-H1638 AromaticContact NE2-CD2 3.54Å; H1634-H1638 AromaticContact NE2-NE2 3.94Å; H1634-H1638 WeakPolarHBondContact O-CB 3.45Å; H1634-H1638 PolarHBondContact O-CD2 3.02Å; H1634-H1638 PolarHBondContact O-N 3.44Å
1635	Y	35.6	Very low	37.6	Very low	125 Å²	125	94.1 Å²	94.1	49%	0.49	48%	0.483	S	S	.	.	H	α-helix	trans	-68	-29.8	175.2	-114.5	-86.2	0	0	0	113.4	H1631 I1632 E1633 G1639	H1631-Y1635 WeakPolarHBondContact O-CB 3.5Å; H1631-Y1635 PolarHBondContact O-N 3.21Å; I1632-Y1635 PolarHBondContact O-N 3.34Å; E1633-Y1635 VanDerWaalsContact C-N 3.33Å; E1633-Y1635 PolarHBondContact O-N 3.07Å; Y1635-G1639 WeakPolarHBondContact O-CA 3.39Å; Y1635-G1639 PolarHBondContact O-N 2.74Å
1636	L	35.5	Very low	36.7	Very low	49 Å²	49	103.8 Å²	103.8	26%	0.257	52%	0.517	S	S	.	.	H	α-helix	trans	-75.9	-40.2	176.5	-68.5	160.4	0	0	0	112.1	L1597 I1601 I1632 E1633 H1634	L1597-L1636 HydrophobicContact CD1-CD2 4.04Å; L1597-L1636 HydrophobicContact CD2-CD1 3.66Å; L1597-L1636 HydrophobicContact CD2-CD2 3.42Å; L1597-L1636 VanDerWaalsContact CD2-CD2 3.42Å; L1597-L1636 HydrophobicContact CD2-CG 4.17Å; L1597-L1636 HydrophobicContact CG-CD2 4.37Å; I1601-L1636 HydrophobicContact CD1-CD1 3.72Å; I1632-L1636 HydrophobicContact CG2-CD1 3.8Å; I1632-L1636 WeakPolarHBondContact O-CD1 3.44Å; I1632-L1636 VanDerWaalsContact O-CG 3.22Å; I1632-L1636 WeakPolarHBondContact O-CG 3.35Å; I1632-L1636 PolarHBondContact O-N 3.07Å; E1633-L1636 PolarHBondContact O-N 3.12Å; E1633-L1636 VanDerWaalsContact O-N 3.1Å; H1634-L1636 VanDerWaalsContact C-N 3.33Å; H1634-L1636 PolarHBondContact O-N 3.27Å
1637	I	39.2	Very low	35.7	Very low	88 Å²	88	108.9 Å²	108.9	45%	0.451	54%	0.541	S	S	.	.	H	α-helix	trans	-69.3	-38.1	179	-67.3	170.6	0	0	0	111.1	E1633	E1633-I1637 HydrophobicContact CG-CD1 3.83Å; E1633-I1637 HydrophobicContact CG-CG1 4.48Å; E1633-I1637 WeakPolarHBondContact O-CG1 3.1Å; E1633-I1637 PolarHBondContact O-N 3.44Å
1638	H	36.7	Very low	34.8	Very low	112 Å²	112	113 Å²	113	52%	0.519	56%	0.559	S	S	.	*	H	α-helix	trans	-104.5	-19.2	-174.6	-65.3	-65.7	0	0	0	115.5	H1634 W1640	H1634-H1638 AromaticContact CD2-CD2 3.71Å; H1634-H1638 AromaticContact CE1-CD2 3.67Å; H1634-H1638 AromaticContact CG-CD2 3.94Å; H1634-H1638 AromaticContact ND1-CD2 3.92Å; H1634-H1638 AromaticContact NE2-CD2 3.54Å; H1634-H1638 AromaticContact NE2-NE2 3.94Å; H1634-H1638 WeakPolarHBondContact O-CB 3.45Å; H1634-H1638 PolarHBondContact O-CD2 3.02Å; H1634-H1638 PolarHBondContact O-N 3.44Å; H1638-W1640 VanDerWaalsContact C-N 3.3Å; H1638-W1640 PolarHBondContact O-N 2.95Å
1639	G	32.5	Very low	33.9	Very low	47 Å²	47	118.3 Å²	118.3	49%	0.485	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.3	-8.2	-177.3	0	0	0	0	0	115.6	Y1635	Y1635-G1639 WeakPolarHBondContact O-CA 3.39Å; Y1635-G1639 PolarHBondContact O-N 2.74Å
1640	W	29.6	Very low	33	Very low	224 Å²	224	124.1 Å²	124.1	85%	0.848	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	0.9	-176.3	-86.3	41.1	0	0	0	114.8	H1638	H1638-W1640 VanDerWaalsContact C-N 3.3Å; H1638-W1640 PolarHBondContact O-N 2.95Å
1641	T	27.2	Very low	31.9	Very low	115 Å²	115	127.1 Å²	127.1	71%	0.706	63%	0.629	S	S	*	*			trans	-121.9	63	-173	55.8	0	0	0	0	114.7
1642	S	26.9	Very low	30.9	Very low	104 Å²	104	127.9 Å²	127.9	73%	0.727	64%	0.636	S	S	*	*	S	Bend	trans	-163.4	95.7	155.6	39.2	0	0	0	0	115
1643	N	26.1	Very low	30.1	Very low	162 Å²	162	133.4 Å²	133.4	87%	0.866	67%	0.671	S	S	*	*			trans	49.2	87.7	141.1	-57.9	-16	0	0	0	120.7
1644	E	27.6	Very low	29.4	Very low	162 Å²	162	137.9 Å²	137.9	76%	0.757	69%	0.689	S	S	*	*			trans	-121.9	131.7	131.4	-84.2	-171.4	145.3	0	0	109.6	K1592	K1592-E1644 IonicContact NZ-OE2 2.72Å; K1592-E1644 PolarHBondContact NZ-OE2 3.38Å
1645	T	27.5	Very low	28.4	Very low	129 Å²	129	137.6 Å²	137.6	79%	0.791	70%	0.7	S	S	*	*			trans	-74.1	134.9	-174.4	44.6	0	0	0	0	111.5
1646	R	25.2	Very low	27.9	Very low	229 Å²	229	137.3 Å²	137.3	86%	0.864	70%	0.701	S	S	*	*				37.9	93.6	85.5	-77.8	-171.3	177.4	170.5	1.7	113.7
1647	D	26.1	Very low	27.4	Very low	153 Å²	153	142.8 Å²	142.8	82%	0.818	73%	0.73	S	S	*	*				-172.3	101.5	123.1	-97.4	-11.7	0	0	0	112.7
1648	K	28.9	Very low	26.6	Very low	214 Å²	214	145.7 Å²	145.7	93%	0.93	75%	0.745	S	S	*	*			trans	-164.5	129.9	130.5	-108.5	169.9	-172.6	176.4	0	109.9
1649	E	24.1	Very low	25.9	Very low	138 Å²	138	146.3 Å²	146.3	65%	0.645	75%	0.753	S	S	*	*			trans	-76.7	129.5	-174.5	-55.6	-173.3	117.2	0	0	111.9	K1651	E1649-K1651 WeakPolarHBondContact OE1-CE 3.29Å; E1649-K1651 IonicContact OE1-NZ 2.77Å; E1649-K1651 PolarHBondContact OE1-NZ 3.39Å; E1649-K1651 IonicContact OE2-NZ 3.81Å; E1649-K1651 PolarHBondContact OE2-NZ 2.85Å
1650	V	26	Very low	25.5	Very low	149 Å²	149	149.6 Å²	149.6	90%	0.903	76%	0.759	S	S	*	*			trans	-118.1	84.9	140.3	-178.1	0	0	0	0	107.9
1651	K	24.9	Very low	25.2	Very low	136 Å²	136	149.6 Å²	149.6	59%	0.591	76%	0.759	S	S	*	*			trans	-54.5	145.3	147.9	-76	159.9	174	149.1	0	107.5	E1649	E1649-K1651 WeakPolarHBondContact OE1-CE 3.29Å; E1649-K1651 IonicContact OE1-NZ 2.77Å; E1649-K1651 PolarHBondContact OE1-NZ 3.39Å; E1649-K1651 IonicContact OE2-NZ 3.81Å; E1649-K1651 PolarHBondContact OE2-NZ 2.85Å
1652	L	23.1	Very low	25.1	Very low	127 Å²	127	154.5 Å²	154.5	67%	0.665	77%	0.771	S	S	*	*			cis	-155.3	155.6	3.4	-98	148.8	0	0	0	104.4	K1654	L1652-K1654 HydrophobicContact CD2-CD 4.39Å; L1652-K1654 HydrophobicContact CD2-CG 4.25Å
1653	T	25.1	Very low	24.9	Very low	138 Å²	138	154.3 Å²	154.3	85%	0.847	77%	0.769	S	S	*	*				-149.7	139.6	53.4	45.9	0	0	0	0	114.6
1654	K	24.8	Very low	24.7	Very low	182 Å²	182	150.4 Å²	150.4	79%	0.791	77%	0.767	S	S	*	*			trans	-53.6	163.5	-178.7	-69.3	165.4	168.1	176.8	0	118.9	L1652	L1652-K1654 HydrophobicContact CD2-CD 4.39Å; L1652-K1654 HydrophobicContact CD2-CG 4.25Å
1655	S	23.1	Very low	24.4	Very low	107 Å²	107	151 Å²	151	75%	0.748	76%	0.763	S	S	*	*			trans	85.3	129.7	157.9	79.5	0	0	0	0	116.9
1656	K	25.8	Very low	24.1	Very low	119 Å²	119	152.9 Å²	152.9	52%	0.517	77%	0.768	S	S	.	*			cis	-128.9	131.8	1.9	-64.9	172.7	167.8	172.9	0	107.8	S1728 N1729	K1656-S1728 VanDerWaalsContact CE-OG 3.28Å; K1656-S1728 WeakPolarHBondContact CE-OG 3.41Å; K1656-S1728 PolarHBondContact NZ-O 3.34Å; K1656-S1728 PolarHBondContact NZ-OG 3.32Å; K1656-N1729 PolarHBondContact NZ-O 2.94Å
1657	L	24.3	Very low	23.8	Very low	164 Å²	164	149.9 Å²	149.9	86%	0.859	76%	0.761	S	S	*	*				69.2	123.4	59.6	-111	172.1	0	0	0	116
1658	L	22.8	Very low	23.6	Very low	148 Å²	148	147.5 Å²	147.5	78%	0.775	76%	0.757	S	S	*	*			trans	-53.1	149.2	-176	-71.1	119.8	0	0	0	117.2
1659	N	22.6	Very low	23.3	Very low	125 Å²	125	143.2 Å²	143.2	67%	0.668	75%	0.749	S	S	*	*				172.8	145.6	122.5	-95.9	27	0	0	0	108.2
1660	D	24.8	Very low	23.2	Very low	116 Å²	116	144.3 Å²	144.3	62%	0.62	76%	0.759	S	S	*	*			cis	-134.5	161	15	-78.8	-49.9	0	0	0	113
1661	R	23.1	Very low	23	Very low	224 Å²	224	148.7 Å²	148.7	85%	0.845	76%	0.759	S	S	*	*			trans	-96.3	147.3	157.4	-80.6	-179.1	170.9	178.3	-4.6	109.5
1662	K	24.6	Very low	23.1	Very low	219 Å²	219	147.3 Å²	147.3	95%	0.952	76%	0.764	S	S	*	*			trans	-128.3	121	133.7	-93.2	-169.1	175.7	-176.9	0	109.1
1663	S	22.9	Very low	23.3	Very low	100 Å²	100	150.3 Å²	150.3	70%	0.699	77%	0.774	S	S	*	*			trans	-121.1	147.2	172	51.8	0	0	0	0	108.1
1664	G	22.4	Very low	23.1	Very low	79 Å²	79	150.4 Å²	150.4	81%	0.814	77%	0.769	S	S	*	*			trans	-157.7	83.2	174.3	0	0	0	0	0	111.5
1665	Y	20.5	Very low	23	Very low	174 Å²	174	149.1 Å²	149.1	68%	0.682	77%	0.767	S	S	*	*			trans	-81.1	145.9	158.4	-87.4	-100.3	0	0	0	108.9	E1633	E1633-Y1665 PolarHBondContact OE1-OH 3.22Å
1666	L	21.6	Very low	23.1	Very low	169 Å²	169	152.5 Å²	152.5	89%	0.885	78%	0.775	S	S	*	*			trans	-153.4	120	158.4	-119.7	162.3	0	0	0	109.2
1667	F	19.2	Very low	23	Very low	166 Å²	166	154.9 Å²	154.9	73%	0.728	79%	0.786	S	S	*	*			trans	-98.2	130.9	173.9	-106.1	-80.7	0	0	0	109.9
1668	S	21	Very low	22.9	Very low	103 Å²	103	150.4 Å²	150.4	72%	0.72	78%	0.779	S	S	*	*			trans	63.2	158.9	157.3	77.3	0	0	0	0	117
1669	T	22.2	Very low	22.9	Very low	125 Å²	125	154.3 Å²	154.3	77%	0.767	78%	0.783	S	S	*	*			cis	-138.2	157.1	11.7	47.9	0	0	0	0	111.8
1670	N	22.1	Very low	22.9	Very low	160 Å²	160	156.7 Å²	156.7	86%	0.856	80%	0.796	S	S	*	*			trans	-57.6	149.2	172.4	-64	-20.1	0	0	0	114.2
1671	R	21.9	Very low	22.9	Very low	242 Å²	242	159.2 Å²	159.2	91%	0.913	80%	0.804	S	S	*	*			trans	-140.5	147.8	133.7	-100.9	-170.6	178.9	-174.9	-1.5	110.1
1672	P	27.9	Very low	22.9	Very low	107 Å²	107	153.5 Å²	153.5	70%	0.695	80%	0.799	S	S	*	*			trans	-94.7	172.4	-167.4	39	-36.8	0	0	0	112.9
1673	H	26.7	Very low	22.9	Very low	190 Å²	190	149.3 Å²	149.3	88%	0.88	79%	0.792	S	S	*	*			trans	-154.3	137.5	143	-111.8	-68.6	0	0	0	111
1674	D	21.9	Very low	23.1	Very low	139 Å²	139	152.1 Å²	152.1	74%	0.743	79%	0.794	S	S	*	*			trans	-68.3	166.6	169.3	-63.4	-68.4	0	0	0	112.9
1675	E	21.9	Very low	23.3	Very low	156 Å²	156	155.8 Å²	155.8	73%	0.729	79%	0.789	S	S	*	*			trans	34.1	104.6	148.7	-65.2	-174	169	0	0	118.8
1676	L	24.9	Very low	23.5	Very low	178 Å²	178	153.1 Å²	153.1	93%	0.932	79%	0.791	S	S	*	*			trans	-123.5	105.8	137.7	-104.8	168.3	0	0	0	110.7
1677	F	23	Very low	23.7	Very low	169 Å²	169	155.6 Å²	155.6	74%	0.741	79%	0.789	S	S	*	*			trans	-44.3	132.6	170	-83.1	-110.6	0	0	0	113.1
1678	G	22.6	Very low	23.9	Very low	69 Å²	69	155.3 Å²	155.3	71%	0.711	79%	0.794	S	S	*	*				73.8	143.1	116.4	0	0	0	0	0	120.5
1679	R	23.9	Very low	24	Very low	230 Å²	230	154.8 Å²	154.8	87%	0.868	79%	0.791	S	S	*	*			trans	64.3	85.8	158.7	-63.7	179.9	170.2	167.8	-2.3	117.6
1680	N	22	Very low	24.1	Very low	176 Å²	176	153.6 Å²	153.6	94%	0.941	79%	0.787	S	S	*	*			trans	-93.9	93.7	131.3	-84.6	-31	0	0	0	109.1
1681	Q	25.6	Very low	24.2	Very low	169 Å²	169	158.1 Å²	158.1	79%	0.79	79%	0.792	S	S	*	*			trans	-129.1	92.6	162.9	-86.3	-169.1	-10.2	0	0	110.4
1682	S	23	Very low	24.2	Very low	104 Å²	104	153.3 Å²	153.3	73%	0.727	79%	0.785	S	S	*	*			trans	23.5	126.1	138.9	59.5	0	0	0	0	120.5
1683	T	24.7	Very low	24	Very low	131 Å²	131	153 Å²	153	80%	0.804	79%	0.785	S	S	*	*				-171.3	145.6	116.7	22	0	0	0	0	106.9
1684	Q	26	Very low	24	Very low	159 Å²	159	151.9 Å²	151.9	74%	0.743	79%	0.785	S	S	*	*			cis	-147.4	153.6	38.5	-77.1	-176.6	-13	0	0	113.4
1685	H	25.9	Very low	23.9	Very low	155 Å²	155	153.8 Å²	153.8	72%	0.718	79%	0.787	S	S	*	*			trans	35.7	134	144.1	-53.4	-57.5	0	0	0	120.4
1686	T	26.5	Very low	24	Very low	119 Å²	119	152.5 Å²	152.5	73%	0.73	79%	0.785	S	S	*	*			cis	-168.1	154	30.6	-14.5	0	0	0	0	112.6
1687	R	24.4	Very low	24	Very low	221 Å²	221	151 Å²	151	83%	0.834	77%	0.773	S	S	*	*			trans	69.5	113.8	165.5	-61.3	-180	178.5	-178	-1.3	116
1688	L	24.8	Very low	24.1	Very low	160 Å²	160	150.1 Å²	150.1	84%	0.838	77%	0.771	S	S	*	*				61.9	133.1	70.2	-65	167.4	0	0	0	112.9
1689	S	22.4	Very low	24.1	Very low	92 Å²	92	155 Å²	155	64%	0.643	78%	0.778	S	S	*	*			cis	-169	168.4	-17.5	56.1	0	0	0	0	108.2
1690	S	23.4	Very low	24.2	Very low	100 Å²	100	148.8 Å²	148.8	70%	0.699	77%	0.77	S	S	*	*			trans	31.8	127.4	146.8	60.5	0	0	0	0	120.4
1691	R	24.7	Very low	24.5	Very low	255 Å²	255	148.8 Å²	148.8	96%	0.962	76%	0.761	S	S	*	*			trans	-117.8	95.9	155.7	-131.5	177.8	-175.3	171.4	0.5	111.1
1692	N	22.5	Very low	24.7	Very low	140 Å²	140	147.3 Å²	147.3	75%	0.749	76%	0.759	S	S	*	*			trans	-69.1	149.9	154.9	-80.1	-6.9	0	0	0	109.1
1693	S	22.8	Very low	24.8	Very low	102 Å²	102	150.7 Å²	150.7	71%	0.713	76%	0.763	S	S	*	*			trans	43.2	122.2	149.9	62.1	0	0	0	0	119.3
1694	L	26.2	Very low	24.9	Very low	165 Å²	165	151 Å²	151	86%	0.864	76%	0.764	S	S	*	*				-171.4	133.9	103	-98.3	154.4	0	0	0	110.8
1695	F	20.2	Very low	25	Very low	180 Å²	180	147.9 Å²	147.9	79%	0.789	76%	0.76	S	S	*	*			trans	-102.2	158.4	159.7	-122.6	-91.4	0	0	0	107.3
1696	D	24.3	Very low	25	Very low	129 Å²	129	146.6 Å²	146.6	69%	0.69	76%	0.763	S	S	*	*			trans	67.5	138.1	163.2	-61.5	-37	0	0	0	117.3
1697	E	25	Very low	24.9	Very low	146 Å²	146	153 Å²	153	68%	0.682	77%	0.774	S	S	*	*			cis	-168.2	169.9	19.2	-131.8	-172.2	142.2	0	0	112.3
1698	Q	25.6	Very low	24.9	Very low	150 Å²	150	146.2 Å²	146.2	70%	0.701	77%	0.765	S	S	*	*			trans	57.2	110.5	151.1	-67.8	179.9	28.5	0	0	120.4
1699	M	22.1	Very low	24.9	Very low	173 Å²	173	144.8 Å²	144.8	85%	0.852	76%	0.763	S	S	*	*				81.3	107.5	76.1	-74.4	-88.2	-86.4	0	0	115.9
1700	S	25.6	Very low	25	Very low	99 Å²	99	145.6 Å²	145.6	69%	0.692	77%	0.769	S	S	*	*				158.8	150.1	101	61.8	0	0	0	0	116.1
1701	K	29.7	Very low	25.1	Very low	175 Å²	175	152.3 Å²	152.3	76%	0.761	78%	0.779	S	S	*	*			trans	85	127.3	149	-78	167.6	-177.5	177.6	0	123
1702	D	28.4	Very low	25.1	Very low	139 Å²	139	144.4 Å²	144.4	74%	0.743	77%	0.768	S	S	*	*			trans	62	145.3	147.1	-45.6	-26	0	0	0	121.6
1703	H	26.1	Very low	25.3	Very low	175 Å²	175	145.5 Å²	145.5	81%	0.81	77%	0.768	S	S	*	*			cis	170.6	162	-46.3	-121	-40.8	0	0	0	106.7
1704	V	26.3	Very low	25.5	Very low	137 Å²	137	147.9 Å²	147.9	83%	0.83	77%	0.768	S	S	*	*			trans	62.9	148.5	170.7	-113.2	0	0	0	0	117.4
1705	S	27.5	Very low	25.4	Very low	93 Å²	93	147.9 Å²	147.9	65%	0.65	77%	0.768	S	S	*	*			cis	-152.7	131	5.4	72.3	0	0	0	0	116.3
1706	T	26.5	Very low	26	Very low	128 Å²	128	144.5 Å²	144.5	79%	0.785	76%	0.764	S	S	*	*			trans	40.5	135.5	132.5	60.3	0	0	0	0	124.6
1707	R	24.4	Very low	25.9	Very low	253 Å²	253	143.2 Å²	143.2	96%	0.955	77%	0.766	S	S	*	*				-142.7	149.3	118.1	-152.2	173.4	-168.5	170.7	5.2	110.3
1708	A	23.7	Very low	26	Very low	80 Å²	80	145.3 Å²	145.3	66%	0.661	77%	0.773	S	S	*	*			trans	-139	-176.8	-165	0	0	0	0	0	114.1
1709	T	26.7	Very low	25.8	Very low	129 Å²	129	149.2 Å²	149.2	79%	0.791	78%	0.781	S	S	*	*			trans	101.6	110.2	156	70.4	0	0	0	0	122.5
1710	S	23.5	Very low	25.9	Very low	109 Å²	109	148.6 Å²	148.6	76%	0.762	78%	0.78	S	S	*	*				81.5	110.9	121.6	68.8	0	0	0	0	125
1711	R	26.2	Very low	25.7	Very low	242 Å²	242	149.8 Å²	149.8	91%	0.913	78%	0.779	S	S	*	*				-172.2	123.5	122.4	-103.9	178.6	163.4	158.2	-4.4	107.2
1712	A	24.9	Very low	25.4	Very low	88 Å²	88	151.9 Å²	151.9	73%	0.727	78%	0.782	S	S	*	*				60	127.4	72.3	0	0	0	0	0	111.9
1713	E	26.5	Very low	25.2	Very low	163 Å²	163	154.4 Å²	154.4	76%	0.762	79%	0.786	S	S	*	*			cis	-153.6	161.3	29.7	-68.2	179.3	115.6	0	0	115.2
1714	Q	26.6	Very low	24.9	Very low	153 Å²	153	154 Å²	154	72%	0.715	78%	0.784	S	S	*	*			trans	45.9	116.5	139.4	-64.1	179.9	29.9	0	0	122
1715	L	24	Very low	24.6	Very low	165 Å²	165	154 Å²	154	86%	0.864	78%	0.779	S	S	*	*				94.7	152.8	77.1	-97.1	129.9	0	0	0	115.1
1716	P	32.7	Very low	24.4	Very low	108 Å²	108	157.7 Å²	157.7	70%	0.701	78%	0.783	S	S	*	*			trans	-124.3	178	-159	43	-29.7	0	0	0	117.1
1717	S	22.9	Very low	24.1	Very low	103 Å²	103	158.1 Å²	158.1	72%	0.72	78%	0.78	S	S	*	*			trans	134.4	155.1	135.3	75.1	0	0	0	0	119.4
1718	K	25.8	Very low	24	Very low	190 Å²	190	149 Å²	149	83%	0.826	75%	0.754	S	S	*	*			trans	81.9	108.2	156.8	-68.4	176.9	-178.1	174.1	0	123.1
1719	R	21.4	Very low	24	Very low	232 Å²	232	151.1 Å²	151.1	88%	0.875	76%	0.755	S	S	*	*				34.2	123.6	118.4	-79.4	-174.1	178.5	172.1	0.7	120.3
1720	L	24.2	Very low	23.8	Very low	160 Å²	160	151.3 Å²	151.3	84%	0.838	76%	0.756	S	S	*	*				173.3	168.9	98.3	-106.1	150.8	0	0	0	115.5
1721	D	22.7	Very low	23.7	Very low	123 Å²	123	153.4 Å²	153.4	66%	0.658	75%	0.751	S	S	*	*			trans	-58.2	153.8	-163	-85.2	-57.2	0	0	0	123.4
1722	R	22.4	Very low	23.6	Very low	219 Å²	219	151.8 Å²	151.8	83%	0.826	75%	0.751	S	S	*	*			trans	53.2	113.3	137.6	-64.1	170.2	172.3	-168.8	-4.8	121.7
1723	K	23.7	Very low	23.5	Very low	192 Å²	192	152.8 Å²	152.8	84%	0.835	74%	0.743	S	S	*	*				175	134.9	101.8	-96.4	178.4	-177.8	179.1	0	114.8
1724	Q	21.2	Very low	23.4	Very low	166 Å²	166	149.9 Å²	149.9	78%	0.776	74%	0.741	S	S	*	*			trans	37.7	129.1	143.7	-77.1	175.8	-27.8	0	0	124.5
1725	L	20.4	Very low	23.3	Very low	137 Å²	137	150 Å²	150	72%	0.717	74%	0.739	S	S	*	*			trans	89.8	101	137.4	-69.7	164.9	0	0	0	123.1
1726	K	21.4	Very low	23.3	Very low	171 Å²	171	151.3 Å²	151.3	74%	0.743	73%	0.734	S	S	*	*				72.4	121.9	126.7	-80.7	-175.7	176.4	-178.3	0	123.5
1727	I	21.6	Very low	22.8	Very low	138 Å²	138	154.1 Å²	154.1	71%	0.708	74%	0.737	S	S	*	*			trans	77.8	135	130.9	-66.1	172.3	0	0	0	118.2
1728	S	22.5	Very low	22.9	Very low	60 Å²	60	154.1 Å²	154.1	42%	0.42	74%	0.737	S	S	.	*			cis	-173	145.3	-15.3	57.2	0	0	0	0	115.5	K1656	K1656-S1728 VanDerWaalsContact CE-OG 3.28Å; K1656-S1728 WeakPolarHBondContact CE-OG 3.41Å; K1656-S1728 PolarHBondContact NZ-O 3.34Å; K1656-S1728 PolarHBondContact NZ-OG 3.32Å
1729	N	22.2	Very low	22.8	Very low	126 Å²	126	152 Å²	152	67%	0.674	74%	0.735	S	S	*	*			trans	13.9	138.5	152.9	-52.7	4.1	0	0	0	124.2	K1656	K1656-N1729 PolarHBondContact NZ-O 2.94Å
1730	T	24.2	Very low	22.9	Very low	132 Å²	132	148.8 Å²	148.8	81%	0.81	74%	0.735	S	S	*	*				-157.2	118.7	127.9	35.4	0	0	0	0	108.6
1731	F	21.6	Very low	22.9	Very low	153 Å²	153	150 Å²	150	67%	0.671	73%	0.733	S	S	*	*				87.1	133	67.3	-98.8	-65.4	0	0	0	116.2	I1733	F1731-I1733 HydrophobicContact CD1-CD1 4.07Å; F1731-I1733 HydrophobicContact CD1-CG1 4.1Å; F1731-I1733 HydrophobicContact CE1-CD1 3.8Å; F1731-I1733 HydrophobicContact CE1-CG1 4.19Å
1732	K	22.9	Very low	22.9	Very low	209 Å²	209	154.4 Å²	154.4	91%	0.909	74%	0.742	S	S	*	*			trans	-148.4	132.2	149.7	-122.1	-179.3	-176.9	-179.2	0	110.4
1733	I	22.8	Very low	23	Very low	109 Å²	109	152.1 Å²	152.1	56%	0.559	75%	0.745	S	S	*	*			trans	-135.8	145.3	175.2	-65	170.4	0	0	0	107.2	F1731	F1731-I1733 HydrophobicContact CD1-CD1 4.07Å; F1731-I1733 HydrophobicContact CD1-CG1 4.1Å; F1731-I1733 HydrophobicContact CE1-CD1 3.8Å; F1731-I1733 HydrophobicContact CE1-CG1 4.19Å
1734	S	24.2	Very low	22.9	Very low	102 Å²	102	146.2 Å²	146.2	71%	0.713	74%	0.739	S	S	*	*			trans	-176.3	145.4	153.9	51.4	0	0	0	0	109.4
1735	K	25.4	Very low	22.9	Very low	155 Å²	155	148.2 Å²	148.2	67%	0.674	75%	0.745	S	S	*	*			cis	-167	-180	-4.5	-106.5	-179.4	179.2	-175.8	0	105.8
1736	Y	23.2	Very low	23.1	Very low	193 Å²	193	149 Å²	149	76%	0.757	75%	0.748	S	S	*	*			cis	-156.3	165.6	35.4	-125.6	-75.2	0	0	0	112.5
1737	E	23.2	Very low	23	Very low	166 Å²	166	150 Å²	150	78%	0.776	76%	0.755	S	S	*	*			trans	-107.6	-174.2	-178.3	-58.9	166.1	101.7	0	0	114
1738	S	24.4	Very low	23	Very low	103 Å²	103	152.9 Å²	152.9	72%	0.72	76%	0.759	S	S	*	*			trans	104.2	138.9	164.5	79	0	0	0	0	115.3
1739	N	24.1	Very low	23	Very low	147 Å²	147	158.7 Å²	158.7	79%	0.786	78%	0.777	S	S	*	*			cis	-134.1	154.5	18.8	-84.9	-71.6	0	0	0	114.9
1740	L	22.3	Very low	23.2	Very low	164 Å²	164	158.7 Å²	158.7	86%	0.859	78%	0.776	S	S	*	*			trans	-114	121.7	161.4	-122.1	165.7	0	0	0	107.6
1741	K	24.1	Very low	23	Very low	185 Å²	185	158.6 Å²	158.6	80%	0.804	78%	0.78	S	S	*	*			trans	-150	147	170.1	-112.6	179.2	-180	178.8	0	109.7
1742	Y	24.2	Very low	23.2	Very low	215 Å²	215	159.6 Å²	159.6	84%	0.843	78%	0.784	S	S	*	*			trans	72.4	116.4	-162.6	-59.1	-82.7	0	0	0	114.4
1743	L	22.9	Very low	23.3	Very low	172 Å²	172	159.8 Å²	159.8	90%	0.901	79%	0.785	S	S	*	*			cis	56.2	116	1.5	-83.9	167.5	0	0	0	116.7
1744	G	21.9	Very low	23.3	Very low	67 Å²	67	161.6 Å²	161.6	69%	0.691	79%	0.794	S	S	*	*			cis	172.7	138.8	-3.7	0	0	0	0	0	110.8
1745	K	22.4	Very low	23.3	Very low	208 Å²	208	163.8 Å²	163.8	90%	0.904	80%	0.798	S	S	*	*	S	Bend	trans	173	122.4	171.3	-102	170	-175.3	-178	0	103.6
1746	I	23.7	Very low	23.4	Very low	153 Å²	153	165.2 Å²	165.2	79%	0.785	81%	0.808	S	S	*	*			cis	-134.7	130.7	16.3	-74.6	150.7	0	0	0	109
1747	H	20.1	Very low	23.6	Very low	194 Å²	194	161.8 Å²	161.8	90%	0.898	81%	0.807	S	S	*	*			trans	-136.3	62.7	164.4	-153.9	-42.5	0	0	0	108.9
1748	Y	21.5	Very low	23.7	Very low	198 Å²	198	158.6 Å²	158.6	78%	0.776	80%	0.803	S	S	*	*			trans	-151.1	76.5	179.9	-161.9	-91	0	0	0	110.9
1749	F	22.9	Very low	23.8	Very low	182 Å²	182	161.1 Å²	161.1	80%	0.798	81%	0.808	S	S	*	*	S	Bend	trans	-161.6	100.1	143.5	-115.8	-82	0	0	0	111
1750	L	25.6	Very low	24	Very low	126 Å²	126	159.1 Å²	159.1	66%	0.66	80%	0.801	S	S	*	*			trans	66.7	76.5	153.2	-56.7	173.4	0	0	0	120.9	K1752	L1750-K1752 VanDerWaalsContact C-N 3.31Å; L1750-K1752 HydrophobicContact CD2-CB 3.62Å; L1750-K1752 HydrophobicContact CD2-CD 4.28Å; L1750-K1752 PolarHBondContact O-N 3.32Å
1751	S	20.3	Very low	24.2	Very low	129 Å²	129	161.3 Å²	161.3	90%	0.902	80%	0.798	S	S	*	*				-76.7	82.9	126.6	49.2	0	0	0	0	109.8
1752	K	24.4	Very low	24.3	Very low	174 Å²	174	159.8 Å²	159.8	76%	0.757	79%	0.791	S	S	*	*			trans	-152.9	64	177.1	-149	-178.2	-174.9	-178.6	0	115.7	L1750	L1750-K1752 VanDerWaalsContact C-N 3.31Å; L1750-K1752 HydrophobicContact CD2-CB 3.62Å; L1750-K1752 HydrophobicContact CD2-CD 4.28Å; L1750-K1752 PolarHBondContact O-N 3.32Å
1753	K	24.9	Very low	24.5	Very low	213 Å²	213	158.1 Å²	158.1	93%	0.926	79%	0.785	S	S	*	*			trans	-152.7	113.1	140.1	-116.8	175.6	-177.8	-177.2	0	110.6
1754	I	24	Very low	24.7	Very low	147 Å²	147	155.4 Å²	155.4	75%	0.754	78%	0.776	S	S	*	*			trans	-113.7	148.4	179	-82.5	172.1	0	0	0	107
1755	N	24.2	Very low	24.9	Very low	149 Å²	149	163.7 Å²	163.7	80%	0.797	80%	0.804	S	S	*	*			trans	64.8	113.4	167.3	-65.4	-14.9	0	0	0	119.3
1756	Q	27.8	Very low	25	Very low	185 Å²	185	161.5 Å²	161.5	86%	0.864	80%	0.799	S	S	*	*				-155.1	113.9	116.4	-109.8	168.7	0.7	0	0	111.8
1757	T	27.4	Very low	25.1	Very low	121 Å²	121	161.9 Å²	161.9	74%	0.742	80%	0.8	S	S	*	*			trans	36.9	121	144.6	56.1	0	0	0	0	120.8
1758	S	24.5	Very low	25.3	Very low	99 Å²	99	160.1 Å²	160.1	69%	0.692	79%	0.794	S	S	*	*			cis	92	106.9	34.9	78.2	0	0	0	0	116.7
1759	N	26.9	Very low	25.6	Very low	155 Å²	155	157.9 Å²	157.9	83%	0.829	80%	0.795	S	S	*	*			trans	167.5	143.2	149.8	-87.3	-20.1	0	0	0	108.1
1760	T	28.5	Very low	25.7	Very low	105 Å²	105	156.4 Å²	156.4	64%	0.644	80%	0.795	S	S	*	*			cis	-160.8	136	2.6	7.9	0	0	0	0	112.6
1761	R	26.2	Very low	25.7	Very low	210 Å²	210	158.4 Å²	158.4	79%	0.792	80%	0.804	S	S	*	*			trans	55.5	118.7	139.3	-66	172.1	-179.4	-176.6	0.2	121.5
1762	K	27	Very low	26.1	Very low	153 Å²	153	160.5 Å²	160.5	67%	0.665	80%	0.797	S	S	*	*				76.4	142.5	95.5	-66.8	-179.1	164.5	-165.8	0	114.1
1763	Y	26.5	Very low	26.3	Very low	181 Å²	181	159.5 Å²	159.5	71%	0.71	80%	0.8	S	S	*	*			cis	-146.8	128.4	26.9	-93.9	-86.1	0	0	0	110.6
1764	T	28	Very low	26.4	Very low	115 Å²	115	155 Å²	155	71%	0.706	79%	0.79	S	S	*	*				52.3	112.9	110.3	69.1	0	0	0	0	119.4
1765	N	25.6	Very low	26.6	Very low	240 Å²	240	155.7 Å²	155.7	100%	1.283	79%	0.793	S	S	*	*				-140	0	95.2	-111.8	-8.3	0	0	0	109.7

Retrieved 1,765 of 1,765 residues in 679.9 ms (Link to these results)

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