A0A3Q0KSM3_SCHMA Loading...

Putative bromodomain containing protein

AlphaFold DB (A0A5K4EWD9), UniProt , Accession A0A3Q0KSM3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,339 aa.

						>A0A3Q0KSM3_SCHMA|A0A3Q0KSM3
MDNQANQNKSNTELTMTTDKSNVLHISPLQSTSELSSPSTSSSRKRRSILYAISRLKQMKMAQQEMHLESNISSDNIDSTPSLTNAQSDNTSDNNTVQLNNNNNPTQLSTIINSDSIQQSIPTDFSSDALSLSQLQQPSPQRNPSQSYNSLPDDHINVSNSSSTTIQLKISPKESSSHIKIKSLPNYTTRHDNSLNCVVARNNSSRIFIQCLSDSESDEYIDLDDTKMTTPINDVTNHSIHMNHYNHTITEQIPTQLSNHESIQKNDIQSNELVSSYETTDNIISSNSNNSEIKCINDNNHSNNKIIESDDYCWICHKPGEVVICSYCPRVFHAICLCATDFPDIWLCPECQDVMLAECSLYQLESWCKITKDQLKRMLFFLLDRLSRQSWAWYFREPVDSTIVKHYKELIKYPIDLHTLYSRVKSGEYASLQAFLGDFRWILHNCIIFNGASSSITSSARLLDRTFHREFNLMRACPICYLNRMPAIHLLPSTTRKLPPLTENEPESYLNVASVQSSNESNEIIESDNISVVNGVNNECNSSNTHTNTTSNNSESKSSSSSSSSSISTLDPWWFCKLCDVIHPIVWIRLQNYPRWPAKVIAHDGNFLLVSFFGDYDVTIAPIGSAKLHSSNQSKSLSKLSIITMDINTTTNNNSSDKENRSDYDGTKSMTSMDNNDISNDPSVVTSQLSSKRTSSLLTSSMDPIVQENFHKAITELNYHVNLIYQRYPNFKLPVNQLRFTKRHVKKYYGPFTETPSSSLSETTNLTKETNSVIDMTRTVNATQVTCNTTSSSINTTTTTNASVTNSEKMDNSVKLNRIPSSNDAYREPVLTRVAASLRNSPVISSESSSVLQTSCPPVISVNTMKRKHNDTSLSASSSPAVTLELESVSSEDIRATVDHSKKKRKKSKHHNLKKITFKPLSEDETTTIITSSASNDETDSNNNNNSSDTTVVIKDNALTIETGPTVTITTSEMQPFSDIIIPSTSNTSDNVHMVLDDFRNSINEALQKLQEKLAPTINATDNAVVYPTTTSELPNLHPIYCDIAIQTNDDLPILDHVHSLKPLNVMNESKSIQTDGMELSTNLSISNDDRPSTLQERMMEAEILHMEQEIQRLNILVRYTRAEMGLEMQRRISELRRIWNDELIAIMEAASRIWEYDVVRIVDVVKRRQWCAYCGRIAYYYCCWNTSYCNSICQSKHWPFHMASCVQAKSQLNNNNNSSVRRHSQSPNLTNSSNIIDQSHFSLTQPSAIQHLSQNHPYPPSGAAPAPPPPPHHYHHHHHNHHQQQQQRMILPNTSNSSIGGIYPLNNNGNSITTNNIPFQRSLLLSSSSGTQSRTFKN
					

Structure Viewer

Loading PAE data...

(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	36	Very low	34.8	Very low	232 Å²	232	140.6 Å²	140.6	100%	1.143	74%	0.739	S	S	*	*				0	99.1	0	-65.8	174.1	180	0	0	108.9
2	D	29.2	Very low	34.8	Very low	134 Å²	134	137.5 Å²	137.5	72%	0.717	73%	0.73	S	S	*	*			cis	140	98.3	-7.8	-89	-67.6	0	0	0	109.4
3	N	30	Very low	34.7	Very low	115 Å²	115	139.2 Å²	139.2	62%	0.615	73%	0.731	S	S	*	*				68.5	124.8	120.9	-82.4	-59.9	0	0	0	122.2
4	Q	33.8	Very low	34.5	Very low	171 Å²	171	139.1 Å²	139.1	80%	0.799	73%	0.731	S	S	*	*			trans	79	162	135.2	-64	168.8	37.2	0	0	117
5	A	40.1	Very low	34.3	Very low	73 Å²	73	136.9 Å²	136.9	60%	0.603	73%	0.725	S	S	*	*			cis	-149.9	177.9	17.9	0	0	0	0	0	115.7
6	N	37.4	Very low	33.9	Very low	136 Å²	136	138.9 Å²	138.9	73%	0.727	73%	0.732	S	S	*	*			trans	74.9	114.3	161.3	-54.7	-28.2	0	0	0	117.2
7	Q	35.8	Very low	33.9	Very low	163 Å²	163	138 Å²	138	76%	0.762	73%	0.733	S	S	*	*			cis	79.7	126.4	32.2	-57.2	-168.9	3.2	0	0	117
8	N	35.1	Very low	33.8	Very low	114 Å²	114	136.5 Å²	136.5	61%	0.61	73%	0.73	S	S	*	*				-179.2	118.6	113.3	-92.3	-68.1	0	0	0	109
9	K	37.1	Very low	33.9	Very low	178 Å²	178	135.3 Å²	135.3	77%	0.774	72%	0.724	S	S	*	*				81	143.3	104.7	-74.2	-176.4	-173.5	131.1	0	115.8
10	S	35.2	Very low	33.9	Very low	88 Å²	88	137.1 Å²	137.1	62%	0.615	73%	0.725	S	S	*	*			cis	-170.9	142.8	-1.9	43.1	0	0	0	0	114.5
11	N	32.9	Very low	33.8	Very low	143 Å²	143	134.9 Å²	134.9	77%	0.765	72%	0.721	S	S	*	*			trans	64	164.7	141.8	-55.2	15.1	0	0	0	118.8
12	T	35.6	Very low	33.7	Very low	103 Å²	103	131.1 Å²	131.1	63%	0.632	71%	0.705	S	S	*	*			cis	-158.9	140.8	17.4	-22.5	0	0	0	0	112.4
13	E	33.2	Very low	33.8	Very low	160 Å²	160	130.7 Å²	130.7	75%	0.748	71%	0.707	S	S	*	*			trans	34.4	158.4	140.4	-61.8	169.2	-130.9	0	0	122.9
14	L	31.8	Very low	33.8	Very low	138 Å²	138	132.3 Å²	132.3	72%	0.723	72%	0.715	S	S	*	*			cis	-170.3	-171.3	-13	-98.8	171.2	0	0	0	106.4
15	T	30.9	Very low	33.6	Very low	105 Å²	105	131.8 Å²	131.8	64%	0.644	71%	0.712	S	S	*	*			cis	-162.1	140.4	6.8	-11.7	0	0	0	0	110
16	M	28.7	Very low	33	Very low	170 Å²	170	134.9 Å²	134.9	84%	0.837	72%	0.717	S	S	*	*			trans	47.7	164.3	139.9	-71.1	-178.5	152.5	0	0	122.5
17	T	33.6	Very low	32.7	Very low	123 Å²	123	133.4 Å²	133.4	76%	0.755	72%	0.717	S	S	*	*			cis	-150.1	-174.5	12.1	-16.1	0	0	0	0	113.1
18	T	33	Very low	32.8	Very low	111 Å²	111	131.3 Å²	131.3	68%	0.681	72%	0.718	S	S	*	*			trans	-70.6	-179	-176.2	56.2	0	0	0	0	115
19	D	34.3	Very low	32.4	Very low	114 Å²	114	133.6 Å²	133.6	61%	0.61	73%	0.729	S	S	*	*			cis	-163.5	-177.9	34.2	-132.5	-49.9	0	0	0	118.1
20	K	33.7	Very low	32	Very low	171 Å²	171	133.3 Å²	133.3	74%	0.743	73%	0.731	S	S	*	*			trans	-55.9	175.1	176.5	-69.5	171.1	-146.4	81.8	0	116.2
21	S	32.9	Very low	31.5	Very low	90 Å²	90	134.3 Å²	134.3	63%	0.629	74%	0.738	S	S	*	*			cis	-175.6	166.4	-19.6	55	0	0	0	0	109.7
22	N	33.3	Very low	31.2	Very low	153 Å²	153	133.9 Å²	133.9	82%	0.818	74%	0.74	S	S	*	*			trans	161.8	174.5	132.8	-78.6	-10.2	0	0	0	114.1
23	V	32.1	Very low	30.9	Very low	126 Å²	126	134.5 Å²	134.5	76%	0.764	75%	0.749	S	S	*	*			trans	-141.6	176.3	-152.8	-165.9	0	0	0	0	111.4
24	L	29.3	Very low	30.6	Very low	149 Å²	149	136.4 Å²	136.4	78%	0.78	76%	0.758	S	S	*	*			trans	87.3	141.1	163.7	-50.3	177.9	0	0	0	115.6
25	H	29.4	Very low	30.5	Very low	160 Å²	160	138.2 Å²	138.2	74%	0.741	77%	0.767	S	S	*	*			cis	-169.7	167.9	-13.5	-147.8	-50	0	0	0	111.1
26	I	28.3	Very low	30.3	Very low	138 Å²	138	138.9 Å²	138.9	71%	0.708	78%	0.776	S	S	*	*			trans	88.8	95	153.2	-59.8	170.1	0	0	0	119.8
27	S	29.8	Very low	30.6	Very low	104 Å²	104	136 Å²	136	73%	0.727	77%	0.773	S	S	*	*				66.2	175.9	117.3	-34.4	0	0	0	0	120.8
28	P	37.7	Very low	30.4	Very low	119 Å²	119	135.5 Å²	135.5	77%	0.773	77%	0.772	S	S	*	*				-137.7	176.3	-110.7	35.8	-12.2	0	0	0	116.9
29	L	28.6	Very low	30.1	Very low	162 Å²	162	135.6 Å²	135.6	85%	0.848	78%	0.777	S	S	*	*			trans	-160.3	169.2	154.7	-111.6	165.3	0	0	0	111.6
30	Q	28.5	Very low	30.2	Very low	173 Å²	173	134.6 Å²	134.6	81%	0.808	78%	0.775	S	S	*	*			trans	-94.4	140.3	-157.8	-58.6	146	-73.2	0	0	115.3
31	S	24.8	Very low	30.2	Very low	108 Å²	108	130.3 Å²	130.3	76%	0.755	77%	0.767	S	S	*	*			trans	-174.1	125.2	131.8	50.7	0	0	0	0	114.4
32	T	26.3	Very low	30.1	Very low	134 Å²	134	130.4 Å²	130.4	82%	0.822	77%	0.767	S	S	*	*			trans	39.3	110.9	148.4	57.8	0	0	0	0	121.3
33	S	28.6	Very low	30.3	Very low	116 Å²	116	126.1 Å²	126.1	81%	0.811	75%	0.749	S	S	*	*			trans	-160	143.3	133.3	4.8	0	0	0	0	109.7
34	E	27.5	Very low	30.5	Very low	201 Å²	201	128.9 Å²	128.9	94%	0.939	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-84.4	135.2	-179.8	-64.5	175.9	130.8	0	0	110.7
35	L	28.6	Very low	31	Very low	175 Å²	175	128 Å²	128	92%	0.916	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-80.5	123.9	-179	-115.3	72.8	0	0	0	111.5
36	S	28.3	Very low	31.7	Very low	119 Å²	119	128.9 Å²	128.9	83%	0.832	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-77.7	139	166.2	47.5	0	0	0	0	111
37	S	33	Very low	32.5	Very low	111 Å²	111	131 Å²	131	78%	0.776	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-91.6	149	-176.9	51.7	0	0	0	0	112.9
38	P	29.8	Very low	33.1	Very low	112 Å²	112	127.8 Å²	127.8	73%	0.727	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-77.5	161.2	-169.9	29.6	-35.5	0	0	0	115	T40	P38-T40 PolarHBondContact O-N 3.06Å
39	S	27.9	Very low	33.7	Very low	112 Å²	112	125.3 Å²	125.3	78%	0.783	69%	0.689	S	S	*	*			trans	-50.3	114.9	-171.7	51.8	0	0	0	0	116.3
40	T	35.5	Very low	34.6	Very low	94 Å²	94	122.7 Å²	122.7	58%	0.577	68%	0.675	S	S	*	*			trans	-95.1	-15.5	-177.5	56.4	0	0	0	0	115.6	P38 R44	P38-T40 PolarHBondContact O-N 3.06Å; T40-R44 WeakPolarHBondContact O-CG 3.38Å; T40-R44 PolarHBondContact O-N 3.44Å
41	S	33.1	Very low	35.6	Very low	81 Å²	81	121.2 Å²	121.2	57%	0.566	66%	0.663	S	S	*	*	H	α-helix	trans	-72.7	-42.3	-166.5	61.4	0	0	0	0	115	R44 K45	S41-R44 PolarHBondContact O-N 3.09Å; S41-K45 PolarHBondContact O-N 2.92Å
42	S	32.2	Very low	36.7	Very low	92 Å²	92	117.5 Å²	117.5	64%	0.643	64%	0.639	S	S	*	*	H	α-helix	trans	-63.7	-43.8	179.6	-177.8	0	0	0	0	111.7	R44 K45 R46	S42-R44 VanDerWaalsContact C-N 3.34Å; S42-R44 PolarHBondContact O-N 3.14Å; S42-K45 PolarHBondContact O-N 3.19Å; S42-R46 PolarHBondContact O-N 3.35Å
43	S	36.3	Very low	38.1	Very low	62 Å²	62	113 Å²	113	43%	0.434	61%	0.61	S	S	.	*	H	α-helix	trans	-63.4	-37.4	176.3	-163.3	0	0	0	0	112.1	R47	S43-R47 VanDerWaalsContact O-CB 3.31Å; S43-R47 WeakPolarHBondContact O-CB 3.47Å; S43-R47 VanDerWaalsContact O-CG 3.31Å; S43-R47 WeakPolarHBondContact O-CG 3.5Å; S43-R47 PolarHBondContact O-N 3.42Å
44	R	37.3	Very low	39.1	Very low	184 Å²	184	110.3 Å²	110.3	69%	0.694	59%	0.59	S	S	*	*	H	α-helix	trans	-61.3	-46.7	170.9	-77	-175.6	179.5	-162.5	1	112.4	T40 S41 S42 R47 S48	T40-R44 WeakPolarHBondContact O-CG 3.38Å; T40-R44 PolarHBondContact O-N 3.44Å; S41-R44 PolarHBondContact O-N 3.09Å; S42-R44 VanDerWaalsContact C-N 3.34Å; S42-R44 PolarHBondContact O-N 3.14Å; R44-R47 PolarHBondContact O-N 3.39Å; R44-S48 VanDerWaalsContact O-CB 3.32Å; R44-S48 WeakPolarHBondContact O-CB 3.4Å; R44-S48 PolarHBondContact O-N 3.19Å
45	K	39.9	Very low	40.2	Very low	131 Å²	131	106.3 Å²	106.3	57%	0.57	57%	0.567	S	S	*	*	H	α-helix	trans	-59.5	-48.1	177.5	-74.3	-170.1	175.1	-171	0	111.8	S41 S42 S48 I49	S41-K45 PolarHBondContact O-N 2.92Å; S42-K45 PolarHBondContact O-N 3.19Å; K45-S48 PolarHBondContact O-N 2.93Å; K45-I49 WeakPolarHBondContact O-CG1 3.21Å; K45-I49 PolarHBondContact O-N 3.49Å; K45-I49 VanDerWaalsContact O-N 3.11Å
46	R	44.5	Very low	41.3	Very low	178 Å²	178	99.7 Å²	99.7	67%	0.672	53%	0.532	S	S	*	.	H	α-helix	trans	-65	-42.3	179.6	-154.8	177.1	-168.7	-168.1	4.4	111.9	S42 L50	S42-R46 PolarHBondContact O-N 3.35Å; R46-L50 HydrophobicContact CG-CD1 4.42Å; R46-L50 WeakPolarHBondContact O-CB 3.33Å; R46-L50 VanDerWaalsContact O-CG 3.3Å; R46-L50 WeakPolarHBondContact O-CG 3.24Å; R46-L50 PolarHBondContact O-N 3.27Å
47	R	43.3	Very low	42.5	Very low	184 Å²	184	99.1 Å²	99.1	69%	0.694	52%	0.515	S	S	*	.	H	α-helix	trans	-64.2	-39.4	174.8	-75.2	179.8	177.4	-172.9	-0.3	112.8	S43 R44 L50 Y51	S43-R47 VanDerWaalsContact O-CB 3.31Å; S43-R47 WeakPolarHBondContact O-CB 3.47Å; S43-R47 VanDerWaalsContact O-CG 3.31Å; S43-R47 WeakPolarHBondContact O-CG 3.5Å; S43-R47 PolarHBondContact O-N 3.42Å; R44-R47 PolarHBondContact O-N 3.39Å; R47-L50 PolarHBondContact O-N 2.85Å; R47-Y51 VanDerWaalsContact O-CB 3.29Å; R47-Y51 WeakPolarHBondContact O-CB 3.25Å; R47-Y51 PolarHBondContact O-N 3.5Å
48	S	44.1	Very low	43.4	Very low	36 Å²	36	99.6 Å²	99.6	25%	0.252	51%	0.505	S	S	.	.	H	α-helix	trans	-65.2	-43.8	178.5	-179.7	0	0	0	0	112.2	R44 K45 Y51 A52	R44-S48 VanDerWaalsContact O-CB 3.32Å; R44-S48 WeakPolarHBondContact O-CB 3.4Å; R44-S48 PolarHBondContact O-N 3.19Å; K45-S48 PolarHBondContact O-N 2.93Å; S48-Y51 PolarHBondContact O-N 3.26Å; S48-A52 PolarHBondContact O-N 3.4Å
49	I	49	Very low	44.3	Very low	67 Å²	67	98.4 Å²	98.4	34%	0.344	49%	0.491	S	S	.	.	H	α-helix	trans	-62.7	-46.6	174.7	-67.1	166.7	0	0	0	110.8	K45 Y51 A52 I53	K45-I49 WeakPolarHBondContact O-CG1 3.21Å; K45-I49 PolarHBondContact O-N 3.49Å; K45-I49 VanDerWaalsContact O-N 3.11Å; I49-Y51 VanDerWaalsContact C-N 3.33Å; I49-Y51 PolarHBondContact O-N 3.26Å; I49-A52 PolarHBondContact O-N 2.95Å; I49-I53 HydrophobicContact CG2-CD1 3.75Å; I49-I53 VanDerWaalsContact O-CG1 3.31Å; I49-I53 WeakPolarHBondContact O-CG1 3.42Å; I49-I53 PolarHBondContact O-N 2.86Å
50	L	47.5	Very low	45.4	Very low	106 Å²	106	95.7 Å²	95.7	56%	0.555	46%	0.464	S	S	*	.	H	α-helix	trans	-63.2	-36.7	176.9	-71.3	169.7	0	0	0	112.6	R46 R47 S54	R46-L50 HydrophobicContact CG-CD1 4.42Å; R46-L50 WeakPolarHBondContact O-CB 3.33Å; R46-L50 VanDerWaalsContact O-CG 3.3Å; R46-L50 WeakPolarHBondContact O-CG 3.24Å; R46-L50 PolarHBondContact O-N 3.27Å; R47-L50 PolarHBondContact O-N 2.85Å; L50-S54 VanDerWaalsContact O-CB 3.23Å; L50-S54 WeakPolarHBondContact O-CB 3.41Å; L50-S54 PolarHBondContact O-N 3.38Å
51	Y	50.3	Low	46.3	Very low	142 Å²	142	96.6 Å²	96.6	56%	0.557	46%	0.464	S	S	*	.	H	α-helix	trans	-65.6	-45.4	175	178.7	-98.5	0	0	0	111.9	R47 S48 I49 S54 R55	R47-Y51 VanDerWaalsContact O-CB 3.29Å; R47-Y51 WeakPolarHBondContact O-CB 3.25Å; R47-Y51 PolarHBondContact O-N 3.5Å; S48-Y51 PolarHBondContact O-N 3.26Å; I49-Y51 VanDerWaalsContact C-N 3.33Å; I49-Y51 PolarHBondContact O-N 3.26Å; Y51-S54 PolarHBondContact O-N 3.23Å; Y51-R55 WeakPolarHBondContact O-CB 3.31Å; Y51-R55 PolarHBondContact O-N 2.96Å; Y51-R55 PolarHBondContact OH-NH1 2.98Å
52	A	47.3	Very low	47.1	Very low	31 Å²	31	94.3 Å²	94.3	26%	0.256	45%	0.449	S	S	.	.	H	α-helix	trans	-60.3	-47.8	175	0	0	0	0	0	111.6	S48 I49 S54 R55 L56	S48-A52 PolarHBondContact O-N 3.4Å; I49-A52 PolarHBondContact O-N 2.95Å; A52-S54 VanDerWaalsContact C-N 3.34Å; A52-S54 PolarHBondContact O-N 3.03Å; A52-R55 PolarHBondContact O-N 3.38Å; A52-L56 WeakPolarHBondContact O-CB 3.33Å; A52-L56 VanDerWaalsContact O-CG 3.23Å; A52-L56 WeakPolarHBondContact O-CG 3.28Å; A52-L56 PolarHBondContact O-N 3.49Å
53	I	55.6	Low	47.9	Very low	40 Å²	40	94.4 Å²	94.4	21%	0.205	44%	0.44	C	S	.	.	H	α-helix	trans	-61.2	-41.4	176.3	-67.8	168.6	0	0	0	111.3	I49 L56 K57 I293	I49-I53 HydrophobicContact CG2-CD1 3.75Å; I49-I53 VanDerWaalsContact O-CG1 3.31Å; I49-I53 WeakPolarHBondContact O-CG1 3.42Å; I49-I53 PolarHBondContact O-N 2.86Å; I53-L56 PolarHBondContact O-N 2.83Å; I53-K57 WeakPolarHBondContact O-CB 3.46Å; I53-K57 WeakPolarHBondContact O-CG 3.35Å; I53-K57 PolarHBondContact O-N 3.41Å; I53-I293 HydrophobicContact CD1-CD1 4.18Å
54	S	49.5	Very low	48.4	Very low	58 Å²	58	96.4 Å²	96.4	41%	0.406	44%	0.442	S	S	.	.	H	α-helix	trans	-65.3	-45.7	178.8	-169.8	0	0	0	0	112.1	L50 Y51 A52 L56 K57 Q58	L50-S54 VanDerWaalsContact O-CB 3.23Å; L50-S54 WeakPolarHBondContact O-CB 3.41Å; L50-S54 PolarHBondContact O-N 3.38Å; Y51-S54 PolarHBondContact O-N 3.23Å; A52-S54 VanDerWaalsContact C-N 3.34Å; A52-S54 PolarHBondContact O-N 3.03Å; S54-L56 VanDerWaalsContact C-N 3.34Å; S54-L56 PolarHBondContact O-N 3.22Å; S54-K57 WeakPolarHBondContact O-CB 3.14Å; S54-K57 PolarHBondContact O-N 3.32Å; S54-Q58 WeakPolarHBondContact O-CG 3.31Å; S54-Q58 PolarHBondContact O-N 3.2Å
55	R	50.5	Low	48.9	Very low	117 Å²	117	91.6 Å²	91.6	44%	0.442	43%	0.428	S	S	.	.	H	α-helix	trans	-65.5	-37.8	178.4	-153.9	175.9	-165.4	178	5.9	111.7	Y51 A52 Q58 M59	Y51-R55 WeakPolarHBondContact O-CB 3.31Å; Y51-R55 PolarHBondContact O-N 2.96Å; Y51-R55 PolarHBondContact OH-NH1 2.98Å; A52-R55 PolarHBondContact O-N 3.38Å; R55-Q58 PolarHBondContact O-N 3.17Å; R55-M59 WeakPolarHBondContact O-CG 3.44Å; R55-M59 PolarHBondContact O-N 3.46Å
56	L	52.3	Low	49	Very low	36 Å²	36	87.8 Å²	87.8	19%	0.188	41%	0.413	C	S	.	.	H	α-helix	trans	-66	-39.1	172.3	-71.8	169.7	0	0	0	112.4	A52 I53 S54 M59 K60 M355 Y362	A52-L56 WeakPolarHBondContact O-CB 3.33Å; A52-L56 VanDerWaalsContact O-CG 3.23Å; A52-L56 WeakPolarHBondContact O-CG 3.28Å; A52-L56 PolarHBondContact O-N 3.49Å; I53-L56 PolarHBondContact O-N 2.83Å; S54-L56 VanDerWaalsContact C-N 3.34Å; S54-L56 PolarHBondContact O-N 3.22Å; L56-M59 PolarHBondContact O-N 3.05Å; L56-K60 PolarHBondContact O-N 3.35Å; L56-M355 HydrophobicContact CD1-CE 4.27Å; L56-Y362 HydrophobicContact CB-CE2 4Å; L56-Y362 HydrophobicContact CD1-CE2 4.25Å; L56-Y362 HydrophobicContact CD2-CE2 3.97Å; L56-Y362 WeakPolarHBondContact CD2-OH 3.44Å; L56-Y362 HydrophobicContact CG-CE2 4.29Å; L56-Y362 PolarHBondContact O-OH 3.08Å
57	K	54.2	Low	48.8	Very low	107 Å²	107	83.7 Å²	83.7	47%	0.465	40%	0.401	S	S	.	.	H	α-helix	trans	-59.3	-46.9	171.3	-82.5	-177.5	174.6	-168.2	0	111.8	I53 S54 M59 K60 M61 L361	I53-K57 WeakPolarHBondContact O-CB 3.46Å; I53-K57 WeakPolarHBondContact O-CG 3.35Å; I53-K57 PolarHBondContact O-N 3.41Å; S54-K57 WeakPolarHBondContact O-CB 3.14Å; S54-K57 PolarHBondContact O-N 3.32Å; K57-M59 PolarHBondContact O-N 3.36Å; K57-K60 PolarHBondContact O-N 3.32Å; K57-M61 WeakPolarHBondContact O-CG 3.5Å; K57-M61 PolarHBondContact O-N 2.88Å; K57-L361 HydrophobicContact CD-CD1 4.47Å; K57-L361 HydrophobicContact CG-CD1 3.48Å; K57-L361 VanDerWaalsContact CG-CD1 3.48Å
58	Q	51	Low	48.8	Very low	122 Å²	122	80.5 Å²	80.5	57%	0.57	40%	0.397	S	S	*	.	H	α-helix	trans	-59.8	-45.2	176.7	-71.5	173.1	-23.9	0	0	111.8	S54 R55 K60 M61 A62	S54-Q58 WeakPolarHBondContact O-CG 3.31Å; S54-Q58 PolarHBondContact O-N 3.2Å; R55-Q58 PolarHBondContact O-N 3.17Å; Q58-K60 VanDerWaalsContact C-N 3.32Å; Q58-K60 PolarHBondContact O-N 3.24Å; Q58-M61 PolarHBondContact O-N 3.36Å; Q58-A62 PolarHBondContact O-N 3.1Å
59	M	48.7	Very low	48.5	Very low	87 Å²	87	82 Å²	82	43%	0.429	40%	0.4	S	S	.	.	H	α-helix	trans	-63.2	-35.9	175.6	-69.2	179.1	75.1	0	0	112.6	R55 L56 K57 Q63 V198	R55-M59 WeakPolarHBondContact O-CG 3.44Å; R55-M59 PolarHBondContact O-N 3.46Å; L56-M59 PolarHBondContact O-N 3.05Å; K57-M59 PolarHBondContact O-N 3.36Å; M59-Q63 WeakPolarHBondContact O-CG 3.39Å; M59-Q63 PolarHBondContact O-N 3.33Å; M59-Q63 VanDerWaalsContact O-N 3.11Å; M59-V198 HydrophobicContact CE-CG1 4.46Å
60	K	50.6	Low	47.9	Very low	54 Å²	54	82 Å²	82	24%	0.235	41%	0.406	C	S	.	.	H	α-helix	trans	-71.9	-38.7	175	-173.9	173.5	176.7	173	0	112.4	L56 K57 Q58 Q63 Q64 L361	L56-K60 PolarHBondContact O-N 3.35Å; K57-K60 PolarHBondContact O-N 3.32Å; Q58-K60 VanDerWaalsContact C-N 3.32Å; Q58-K60 PolarHBondContact O-N 3.24Å; K60-Q63 PolarHBondContact O-N 2.85Å; K60-Q64 VanDerWaalsContact CE-OE1 3.31Å; K60-Q64 HydrophobicContact CG-CG 4.26Å; K60-Q64 WeakPolarHBondContact O-CG 3.34Å; K60-Q64 PolarHBondContact O-N 3.46Å; K60-L361 HydrophobicContact CD-CB 3.92Å; K60-L361 HydrophobicContact CD-CD2 4.35Å; K60-L361 PolarHBondContact NZ-O 3.35Å
61	M	55.6	Low	47.4	Very low	114 Å²	114	81.3 Å²	81.3	56%	0.562	40%	0.403	S	S	*	.	H	α-helix	trans	-59.5	-49.8	174.1	-77.2	166.2	153.6	0	0	110.7	K57 Q58 Q63 Q64 E65	K57-M61 WeakPolarHBondContact O-CG 3.5Å; K57-M61 PolarHBondContact O-N 2.88Å; Q58-M61 PolarHBondContact O-N 3.36Å; M61-Q63 VanDerWaalsContact C-N 3.28Å; M61-Q63 PolarHBondContact O-N 3.11Å; M61-Q64 PolarHBondContact O-N 2.93Å; M61-E65 WeakPolarHBondContact O-CB 3.3Å; M61-E65 WeakPolarHBondContact O-CG 3.48Å; M61-E65 PolarHBondContact O-N 3.37Å
62	A	49.7	Very low	46.7	Very low	32 Å²	32	81.1 Å²	81.1	26%	0.264	41%	0.41	S	S	.	.	H	α-helix	trans	-56.7	-38.6	173.7	0	0	0	0	0	113.1	Q58 M66	Q58-A62 PolarHBondContact O-N 3.1Å; A62-M66 WeakPolarHBondContact O-CG 3.15Å; A62-M66 PolarHBondContact O-N 3.08Å
63	Q	49.4	Very low	45.9	Very low	94 Å²	94	84.1 Å²	84.1	44%	0.439	43%	0.429	S	S	.	.	H	α-helix	trans	-69.6	-38.4	174.4	-76	176.1	-15	0	0	113.5	M59 K60 M61 M66 H67	M59-Q63 WeakPolarHBondContact O-CG 3.39Å; M59-Q63 PolarHBondContact O-N 3.33Å; M59-Q63 VanDerWaalsContact O-N 3.11Å; K60-Q63 PolarHBondContact O-N 2.85Å; M61-Q63 VanDerWaalsContact C-N 3.28Å; M61-Q63 PolarHBondContact O-N 3.11Å; Q63-M66 HydrophobicContact CG-CE 4.13Å; Q63-H67 PolarHBondContact O-CD2 2.9Å; Q63-H67 VanDerWaalsContact O-CD2 3.31Å; Q63-H67 PolarHBondContact O-N 2.93Å
64	Q	46.5	Very low	44.7	Very low	104 Å²	104	86.3 Å²	86.3	49%	0.486	45%	0.448	S	S	.	.	H	α-helix	trans	-70	-37.6	177.1	-73.1	-176	-98.6	0	0	111.5	K60 M61 H67 L68	K60-Q64 VanDerWaalsContact CE-OE1 3.31Å; K60-Q64 HydrophobicContact CG-CG 4.26Å; K60-Q64 WeakPolarHBondContact O-CG 3.34Å; K60-Q64 PolarHBondContact O-N 3.46Å; M61-Q64 PolarHBondContact O-N 2.93Å; Q64-H67 PolarHBondContact O-N 3.48Å; Q64-L68 WeakPolarHBondContact O-CB 3.41Å; Q64-L68 PolarHBondContact O-N 3.35Å
65	E	47.9	Very low	43.7	Very low	84 Å²	84	90 Å²	90	39%	0.393	46%	0.463	S	S	.	.	H	α-helix	trans	-65.4	-44	172.6	-70.4	166.6	-152.6	0	0	112.4	M61 H67 L68 E69 R1122	M61-E65 WeakPolarHBondContact O-CB 3.3Å; M61-E65 WeakPolarHBondContact O-CG 3.48Å; M61-E65 PolarHBondContact O-N 3.37Å; E65-H67 PolarHBondContact O-N 2.6Å; E65-L68 PolarHBondContact O-N 2.85Å; E65-E69 PolarHBondContact O-N 3.24Å; E65-R1122 IonicContact OE2-CZ 2.79Å; E65-R1122 IonicContact OE2-NH2 3.6Å; E65-R1122 PolarHBondContact OE2-NH2 2.72Å
66	M	41	Very low	42.6	Very low	51 Å²	51	92.2 Å²	92.2	25%	0.251	48%	0.484	S	S	.	.	H	α-helix	trans	-56.9	-40.2	170.4	-77.2	-165.7	-54.3	0	0	111.8	A62 Q63 S70 R1122 M1125	A62-M66 WeakPolarHBondContact O-CG 3.15Å; A62-M66 PolarHBondContact O-N 3.08Å; Q63-M66 HydrophobicContact CG-CE 4.13Å; M66-S70 VanDerWaalsContact O-CB 3.23Å; M66-S70 WeakPolarHBondContact O-CB 3.29Å; M66-S70 PolarHBondContact O-N 3.01Å; M66-S70 PolarHBondContact O-OG 3.15Å; M66-R1122 HydrophobicContact CG-CG 3.86Å; M66-M1125 HydrophobicContact CE-CE 4.38Å; M66-M1125 HydrophobicContact CG-CE 4.36Å; M66-M1125 HydrophobicContact SD-CE 3.72Å
67	H	41.9	Very low	41.5	Very low	92 Å²	92	98 Å²	98	43%	0.426	51%	0.513	S	S	.	.	H	α-helix	trans	-70.2	-40.3	176.2	-87.8	-62	0	0	0	113.1	Q63 Q64 E65 S70 N71	Q63-H67 PolarHBondContact O-CD2 2.9Å; Q63-H67 VanDerWaalsContact O-CD2 3.31Å; Q63-H67 PolarHBondContact O-N 2.93Å; Q64-H67 PolarHBondContact O-N 3.48Å; E65-H67 PolarHBondContact O-N 2.6Å; H67-S70 WeakPolarHBondContact CA-OG 3.41Å; H67-S70 PolarHBondContact O-N 3.33Å; H67-S70 PolarHBondContact O-OG 3.31Å; H67-N71 PolarHBondContact O-N 3.36Å; H67-N71 PolarHBondContact O-ND2 3.08Å
68	L	41.5	Very low	40.2	Very low	117 Å²	117	98.5 Å²	98.5	61%	0.613	52%	0.521	S	S	*	.	H	α-helix	trans	-60.4	-50	176.8	-85.3	156.3	0	0	0	111.6	Q64 E65 S70 N71	Q64-L68 WeakPolarHBondContact O-CB 3.41Å; Q64-L68 PolarHBondContact O-N 3.35Å; E65-L68 PolarHBondContact O-N 2.85Å; L68-S70 PolarHBondContact O-N 3.15Å; L68-N71 PolarHBondContact O-N 3.38Å
69	E	38.3	Very low	38.9	Very low	67 Å²	67	98.3 Å²	98.3	31%	0.313	53%	0.533	S	S	.	.	H	α-helix	trans	-70.5	-30.8	178.7	-69.9	-172.2	173.4	0	0	112.8	E65 N71 I72 R1122	E65-E69 PolarHBondContact O-N 3.24Å; E69-N71 PolarHBondContact O-N 3.36Å; E69-N71 VanDerWaalsContact O-N 3.16Å; E69-I72 PolarHBondContact O-N 3.44Å; E69-R1122 IonicContact OE1-CZ 3.49Å; E69-R1122 IonicContact OE1-NH1 2.69Å; E69-R1122 PolarHBondContact OE1-NH1 3.41Å; E69-R1122 WeakPolarHBondContact OE2-CD 3.44Å; E69-R1122 IonicContact OE2-CZ 2.72Å; E69-R1122 IonicContact OE2-NE 3.45Å; E69-R1122 IonicContact OE2-NH1 3.1Å; E69-R1122 PolarHBondContact OE2-NH1 3.25Å
70	S	37.7	Very low	38	Very low	68 Å²	68	99.8 Å²	99.8	48%	0.476	55%	0.547	S	S	.	.	H	α-helix	trans	-65.2	-14.8	173.9	73.9	0	0	0	0	114.8	M66 H67 L68	M66-S70 VanDerWaalsContact O-CB 3.23Å; M66-S70 WeakPolarHBondContact O-CB 3.29Å; M66-S70 PolarHBondContact O-N 3.01Å; M66-S70 PolarHBondContact O-OG 3.15Å; H67-S70 WeakPolarHBondContact CA-OG 3.41Å; H67-S70 PolarHBondContact O-N 3.33Å; H67-S70 PolarHBondContact O-OG 3.31Å; L68-S70 PolarHBondContact O-N 3.15Å
71	N	35.6	Very low	37	Very low	91 Å²	91	101.2 Å²	101.2	49%	0.487	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105	8.2	178.7	-67.5	-62.6	0	0	0	113.1	H67 L68 E69	H67-N71 PolarHBondContact O-N 3.36Å; H67-N71 PolarHBondContact O-ND2 3.08Å; L68-N71 PolarHBondContact O-N 3.38Å; E69-N71 PolarHBondContact O-N 3.36Å; E69-N71 VanDerWaalsContact O-N 3.16Å
72	I	35.4	Very low	35.7	Very low	137 Å²	137	101.5 Å²	101.5	70%	0.703	58%	0.575	S	S	*	*	S	Bend	trans	-102.1	-0.5	176.8	-66.4	170.1	0	0	0	111.5	E69	E69-I72 PolarHBondContact O-N 3.44Å
73	S	32	Very low	34.6	Very low	95 Å²	95	106.5 Å²	106.5	66%	0.664	60%	0.597	S	S	*	*	S	Bend	trans	-130.8	54	-176.2	-56	0	0	0	0	113.2
74	S	30.4	Very low	33.6	Very low	85 Å²	85	107.4 Å²	107.4	59%	0.594	61%	0.609	S	S	*	*	S	Bend	trans	-152.8	-16.8	168	63.5	0	0	0	0	116.9
75	D	27.5	Very low	32.8	Very low	137 Å²	137	110.1 Å²	110.1	73%	0.733	63%	0.627	S	S	*	*	S	Bend	trans	-142.6	81.6	-169.3	-67.9	-91.1	0	0	0	112.8
76	N	28.2	Very low	31.8	Very low	163 Å²	163	110 Å²	110	87%	0.872	64%	0.64	S	S	*	*			trans	173.2	165.4	152.3	-93.2	-40	0	0	0	111
77	I	28	Very low	31.3	Very low	157 Å²	157	116.7 Å²	116.7	81%	0.805	67%	0.671	S	S	*	*			trans	71	124.8	171.8	-57.8	171.9	0	0	0	114.6
78	D	27.5	Very low	30.6	Very low	118 Å²	118	116.4 Å²	116.4	63%	0.631	68%	0.679	S	S	*	*			cis	-156.8	174.1	-18.2	-128.3	-41.3	0	0	0	112.7	T80	D78-T80 HydrophobicContact CB-CG2 4.33Å
79	S	24.5	Very low	30.1	Very low	117 Å²	117	117 Å²	117	82%	0.818	68%	0.683	S	S	*	*			trans	-137.1	79.4	165.2	-71.6	0	0	0	0	110.6
80	T	29.7	Very low	29.6	Very low	119 Å²	119	119.7 Å²	119.7	73%	0.73	70%	0.7	S	S	*	*			trans	-93.9	121.9	-176.3	40.1	0	0	0	0	112.3	D78	D78-T80 HydrophobicContact CB-CG2 4.33Å
81	P	28.2	Very low	29.3	Very low	83 Å²	83	122.6 Å²	122.6	54%	0.539	71%	0.714	S	S	.	*			trans	-101.7	147.9	174.6	36.8	-31.3	0	0	0	112.5
82	S	29.6	Very low	29.1	Very low	120 Å²	120	122.2 Å²	122.2	84%	0.839	72%	0.719	S	S	*	*			trans	-151.7	127.4	161.3	47	0	0	0	0	111.8
83	L	26.5	Very low	29	Very low	137 Å²	137	121.9 Å²	121.9	72%	0.717	72%	0.719	S	S	*	*			trans	-76.1	160.4	161.2	-60.3	96.1	0	0	0	107.5
84	T	27.5	Very low	28.9	Very low	113 Å²	113	123.2 Å²	123.2	69%	0.693	72%	0.718	S	S	*	*			cis	-161.8	147.1	48.9	44.9	0	0	0	0	113
85	N	30.1	Very low	29.1	Very low	162 Å²	162	126.2 Å²	126.2	87%	0.866	73%	0.728	S	S	*	*				-173.7	172.1	104.1	-97.3	-41.4	0	0	0	111.8
86	A	27.5	Very low	29.1	Very low	82 Å²	82	124.4 Å²	124.4	68%	0.678	72%	0.722	S	S	*	*			trans	-111.3	-176.7	-163.1	0	0	0	0	0	113.8
87	Q	29.4	Very low	29.2	Very low	190 Å²	190	123.8 Å²	123.8	89%	0.888	72%	0.724	S	S	*	*			trans	77.5	142.5	176	-48.9	175.3	-98.3	0	0	115.3
88	S	27.5	Very low	29.3	Very low	86 Å²	86	123.3 Å²	123.3	60%	0.601	72%	0.718	S	S	*	*			cis	-164.7	171.6	-26.4	52.7	0	0	0	0	108.4
89	D	30.1	Very low	29.4	Very low	131 Å²	131	124.1 Å²	124.1	70%	0.701	72%	0.722	S	S	*	*			trans	68.6	149.7	160	-60.3	-62.5	0	0	0	118.5
90	N	28.4	Very low	29.8	Very low	123 Å²	123	124.8 Å²	124.8	66%	0.658	72%	0.716	S	S	*	*			cis	-164.7	165	-35.3	-133.7	-51.7	0	0	0	109.2
91	T	31	Very low	29.7	Very low	128 Å²	128	125.1 Å²	125.1	79%	0.785	71%	0.713	S	S	*	*			trans	60.4	151.6	162.2	53.7	0	0	0	0	120
92	S	31.4	Very low	29.8	Very low	84 Å²	84	126.9 Å²	126.9	59%	0.587	72%	0.718	S	S	*	*			cis	-167.2	168.5	-23.4	56.2	0	0	0	0	111.2
93	D	33.4	Very low	30	Very low	130 Å²	130	127.6 Å²	127.6	70%	0.695	71%	0.713	S	S	*	*			trans	68.7	147.2	152.8	-51.3	-41.1	0	0	0	120.3
94	N	31.1	Very low	30.2	Very low	122 Å²	122	127.9 Å²	127.9	65%	0.652	72%	0.715	S	S	*	*			cis	-164.7	-179.4	-23.4	-109.6	-35.8	0	0	0	111.1
95	N	33.3	Very low	30.5	Very low	148 Å²	148	128.1 Å²	128.1	79%	0.791	72%	0.719	S	S	*	*			trans	102.1	53.4	161.8	-54.6	-34.1	0	0	0	119.7
96	T	27.7	Very low	30.6	Very low	99 Å²	99	127 Å²	127	61%	0.607	72%	0.718	S	S	*	*				35.6	114.1	107.3	-44.5	0	0	0	0	120.1	Q98	T96-Q98 HydrophobicContact CG2-CG 3.98Å
97	V	31.3	Very low	30.7	Very low	151 Å²	151	131.2 Å²	131.2	92%	0.915	72%	0.723	S	S	*	*				-132.4	136.3	128.8	179.6	0	0	0	0	107.6
98	Q	28.7	Very low	30.5	Very low	146 Å²	146	128.9 Å²	128.9	68%	0.682	72%	0.716	S	S	*	*			trans	-110.9	160.8	-175.5	-63.2	179.3	-4.6	0	0	111.8	T96	T96-Q98 HydrophobicContact CG2-CG 3.98Å
99	L	30.8	Very low	30.3	Very low	136 Å²	136	129.4 Å²	129.4	71%	0.712	72%	0.72	S	S	*	*				170.4	117.6	105.7	-87.8	166.4	0	0	0	113.6
100	N	31.7	Very low	30.2	Very low	131 Å²	131	129.4 Å²	129.4	70%	0.701	73%	0.725	S	S	*	*			trans	58.8	151.6	137.2	-72.5	-14.7	0	0	0	123.4
101	N	28.3	Very low	30	Very low	125 Å²	125	130.9 Å²	130.9	67%	0.668	73%	0.731	S	S	*	*			cis	-170.5	174.6	-34.5	-137.8	-31.3	0	0	0	111.1
102	N	31.1	Very low	29.7	Very low	120 Å²	120	131.5 Å²	131.5	64%	0.642	73%	0.728	S	S	*	*			trans	66.4	105.3	152.3	-65.1	-3.3	0	0	0	120.9
103	N	33.3	Very low	29.6	Very low	135 Å²	135	134.7 Å²	134.7	72%	0.722	74%	0.738	S	S	*	*				162.7	134	92.9	-90.1	-21.4	0	0	0	117.2
104	N	31	Very low	29.2	Very low	143 Å²	143	133.3 Å²	133.3	77%	0.765	74%	0.739	S	S	*	*			trans	65.7	115.1	144.3	-62.8	-2.5	0	0	0	123.9
105	P	33.4	Very low	29.1	Very low	119 Å²	119	134.2 Å²	134.2	77%	0.773	74%	0.744	S	S	*	*			trans	-122.8	142.3	152.1	37.7	-25.5	0	0	0	114.2
106	T	32.5	Very low	28.7	Very low	138 Å²	138	131.8 Å²	131.8	85%	0.847	74%	0.738	S	S	*	*			trans	-166.8	163.6	169.1	31.2	0	0	0	0	110.6
107	Q	28.7	Very low	28.8	Very low	171 Å²	171	135.2 Å²	135.2	80%	0.799	75%	0.751	S	S	*	*				-177.1	165.6	-54.9	-113.8	-167.2	18.1	0	0	109
108	L	24.8	Very low	28.5	Very low	141 Å²	141	136.3 Å²	136.3	74%	0.738	75%	0.746	S	S	*	*			trans	67.8	109.5	161.5	-93.7	69.8	0	0	0	121.8
109	S	24.2	Very low	28.4	Very low	96 Å²	96	138.3 Å²	138.3	67%	0.671	76%	0.756	S	S	*	*				5.1	152.4	126	59.8	0	0	0	0	121.9
110	T	28	Very low	28.3	Very low	131 Å²	131	136.7 Å²	136.7	80%	0.804	76%	0.756	S	S	*	*				-166.2	159.6	103.8	-70.5	0	0	0	0	111.4
111	I	24	Very low	28	Very low	154 Å²	154	137.3 Å²	137.3	79%	0.79	76%	0.758	S	S	*	*			trans	-91.8	164.7	-177.6	-54	156.8	0	0	0	109.7
112	I	25.1	Very low	28	Very low	141 Å²	141	136.9 Å²	136.9	72%	0.723	76%	0.762	S	S	*	*			trans	157	142.6	132.2	-82	164.1	0	0	0	114.5
113	N	28.7	Very low	27.7	Very low	151 Å²	151	135.9 Å²	135.9	81%	0.807	76%	0.76	S	S	*	*			trans	76	114.4	163.4	-75.6	-3	0	0	0	122.3
114	S	25.9	Very low	27.4	Very low	101 Å²	101	135.5 Å²	135.5	71%	0.706	76%	0.758	S	S	*	*			trans	-49.8	162.2	142.5	-31.9	0	0	0	0	111.6
115	D	28.5	Very low	27.2	Very low	141 Å²	141	137.9 Å²	137.9	75%	0.754	76%	0.762	S	S	*	*				-171.7	154.6	70.7	-124.9	-42.6	0	0	0	114.4
116	S	25.1	Very low	26.8	Very low	97 Å²	97	136.9 Å²	136.9	68%	0.678	76%	0.758	S	S	*	*			trans	31.2	128.3	145.6	-61.1	0	0	0	0	122.3
117	I	29.3	Very low	26.5	Very low	172 Å²	172	134.9 Å²	134.9	88%	0.882	75%	0.75	S	S	*	*				-162.3	150.5	112.8	-101.2	157.3	0	0	0	111.4
118	Q	25.1	Very low	26.6	Very low	173 Å²	173	134.4 Å²	134.4	81%	0.808	75%	0.753	S	S	*	*			trans	-98.6	152.8	-171	-52.7	156.7	-46.5	0	0	112.8
119	Q	27.9	Very low	26.7	Very low	188 Å²	188	131.5 Å²	131.5	88%	0.879	75%	0.749	S	S	*	*			trans	166	145.4	140.4	-93.1	153.4	56.3	0	0	110.1
120	S	28.6	Very low	26.9	Very low	103 Å²	103	134.3 Å²	134.3	72%	0.72	76%	0.756	S	S	*	*			cis	-166.4	150	-19.1	44.4	0	0	0	0	109.4
121	I	25.4	Very low	26.8	Very low	143 Å²	143	132.3 Å²	132.3	73%	0.733	75%	0.747	S	S	*	*			trans	-85.8	143.9	-175.1	-58	163.6	0	0	0	111.1	T123	I121-T123 HydrophobicContact CG2-CG2 3.68Å
122	P	28.5	Very low	26.9	Very low	117 Å²	117	132.2 Å²	132.2	76%	0.76	75%	0.747	S	S	*	*				-120.8	144.5	115.3	-1.8	22.5	0	0	0	110.4
123	T	24.5	Very low	27	Very low	98 Å²	98	129.4 Å²	129.4	60%	0.601	74%	0.74	S	S	*	*			cis	51.2	101.3	26.5	63.3	0	0	0	0	115.1	I121	I121-T123 HydrophobicContact CG2-CG2 3.68Å
124	D	26.2	Very low	26.9	Very low	127 Å²	127	130.3 Å²	130.3	68%	0.679	74%	0.739	S	S	*	*				176.3	164.6	101.7	-82.7	-29.7	0	0	0	112.6
125	F	26.8	Very low	26.9	Very low	194 Å²	194	132 Å²	132	85%	0.851	74%	0.74	S	S	*	*			trans	64.5	147.8	162.8	-57.1	-61.2	0	0	0	118.9
126	S	26	Very low	26.9	Very low	98 Å²	98	132.8 Å²	132.8	69%	0.685	74%	0.739	S	S	*	*			cis	-157.6	154.2	-21.5	179.7	0	0	0	0	108.8
127	S	25.7	Very low	27.1	Very low	96 Å²	96	136.6 Å²	136.6	67%	0.671	75%	0.746	S	S	*	*			trans	-57.2	144.5	158.4	52.2	0	0	0	0	111.8
128	D	29.7	Very low	27.2	Very low	161 Å²	161	134 Å²	134	86%	0.861	74%	0.74	S	S	*	*			trans	-121.6	125	131.6	-109.3	-32.8	0	0	0	108.2
129	A	27.4	Very low	27.3	Very low	80 Å²	80	130.7 Å²	130.7	66%	0.661	74%	0.736	S	S	*	*			trans	-106.8	-146.9	171.6	0	0	0	0	0	108
130	L	28.7	Very low	27.5	Very low	155 Å²	155	127.1 Å²	127.1	81%	0.812	73%	0.729	S	S	*	*			trans	76.1	133.7	-178.4	-46.9	170.5	0	0	0	113
131	S	26.5	Very low	27.4	Very low	89 Å²	89	129.1 Å²	129.1	62%	0.622	73%	0.727	S	S	*	*			cis	-159	161.2	-3	-118.4	0	0	0	0	113.7
132	L	25.7	Very low	27.4	Very low	152 Å²	152	132.1 Å²	132.1	80%	0.796	73%	0.729	S	S	*	*			trans	10	145.6	143.1	-79.8	71	0	0	0	118.9
133	S	26	Very low	27.3	Very low	81 Å²	81	132.9 Å²	132.9	57%	0.566	73%	0.727	S	S	*	*			cis	176.5	-179.4	-3.1	51.5	0	0	0	0	109.3
134	Q	28.1	Very low	27.8	Very low	171 Å²	171	133.3 Å²	133.3	80%	0.799	73%	0.731	S	S	*	*			trans	73.7	145.3	160.3	-62.4	173	5.7	0	0	117.2
135	L	25.9	Very low	27.8	Very low	137 Å²	137	131.7 Å²	131.7	72%	0.717	73%	0.73	S	S	*	*			cis	-162.9	173.9	-21.9	-117.6	174.2	0	0	0	109.3
136	Q	29	Very low	27.7	Very low	157 Å²	157	131.3 Å²	131.3	73%	0.734	73%	0.731	S	S	*	*			trans	60.3	104.3	163.4	-106.2	87.1	5	0	0	120.4
137	Q	29.1	Very low	27.7	Very low	177 Å²	177	131.3 Å²	131.3	83%	0.827	73%	0.731	S	S	*	*			trans	-66.2	172.5	130.2	-72.9	-170.8	7.9	0	0	109.7
138	P	29.6	Very low	27.6	Very low	116 Å²	116	136.8 Å²	136.8	75%	0.753	74%	0.738	S	S	*	*			cis	-152.5	-173.9	31.3	42.3	-18.7	0	0	0	118.9
139	S	27.6	Very low	27.5	Very low	104 Å²	104	135.5 Å²	135.5	73%	0.727	73%	0.732	S	S	*	*			trans	-69.2	-171.7	158	-32.1	0	0	0	0	111.9
140	P	33.3	Very low	27.5	Very low	113 Å²	113	137.1 Å²	137.1	73%	0.734	74%	0.738	S	S	*	*			cis	-136.4	-155.8	-9.1	32.4	-7.7	0	0	0	113.7
141	Q	26.4	Very low	27.9	Very low	146 Å²	146	136 Å²	136	68%	0.682	73%	0.732	S	S	*	*			trans	113	106.7	152.5	-59	-77.3	3.6	0	0	120.5
142	R	24.4	Very low	28.3	Very low	206 Å²	206	137.4 Å²	137.4	78%	0.777	74%	0.739	S	S	*	*			trans	45.6	118.8	131.4	-62.8	-178.3	-170.4	-127.9	-4.2	123.9
143	N	27.2	Very low	28.5	Very low	133 Å²	133	135.8 Å²	135.8	71%	0.711	73%	0.731	S	S	*	*				72.4	161.1	128.1	-59.5	3.2	0	0	0	120.4
144	P	34.7	Very low	28.9	Very low	106 Å²	106	139.8 Å²	139.8	69%	0.688	75%	0.746	S	S	*	*				-139.5	-167.8	-55.8	42	-25	0	0	0	113.7
145	S	25.1	Very low	29	Very low	94 Å²	94	138.8 Å²	138.8	66%	0.657	74%	0.742	S	S	*	*			trans	71.3	126.9	154.1	54.1	0	0	0	0	122.7
146	Q	26	Very low	29.3	Very low	186 Å²	186	140.8 Å²	140.8	87%	0.869	75%	0.751	S	S	*	*			trans	68.6	147.2	146.6	-67.8	174.1	12.1	0	0	118.3
147	S	25.3	Very low	29.2	Very low	98 Å²	98	140 Å²	140	69%	0.685	75%	0.752	S	S	*	*			cis	-163	146.1	-5.5	48.6	0	0	0	0	113.2
148	Y	24.3	Very low	29.2	Very low	210 Å²	210	137.6 Å²	137.6	82%	0.824	75%	0.749	S	S	*	*			trans	36	142.2	145	-80.8	-77.8	0	0	0	124.8
149	N	27.1	Very low	29.3	Very low	135 Å²	135	135.8 Å²	135.8	72%	0.722	74%	0.739	S	S	*	*			trans	77.2	153.7	154.1	-58.5	-18.7	0	0	0	117.4
150	S	27.1	Very low	29.2	Very low	114 Å²	114	138.4 Å²	138.4	80%	0.797	75%	0.745	S	S	*	*			cis	-139.1	172.1	18.6	-59.8	0	0	0	0	114.8
151	L	38.3	Very low	29	Very low	130 Å²	130	137.9 Å²	137.9	68%	0.681	74%	0.744	S	S	*	*			trans	-79.5	-175.8	162.5	-63.8	81.9	0	0	0	110.9
152	P	34.8	Very low	29.2	Very low	120 Å²	120	136 Å²	136	78%	0.779	75%	0.747	S	S	*	*				-120.7	143.7	83.8	3.1	18.7	0	0	0	112
153	D	30	Very low	29.2	Very low	117 Å²	117	131.7 Å²	131.7	63%	0.626	75%	0.749	S	S	*	*				72.2	118.8	57.1	-69.8	-51.8	0	0	0	114.1
154	D	33.6	Very low	29.2	Very low	165 Å²	165	131.7 Å²	131.7	88%	0.882	75%	0.754	S	S	*	*			trans	-142.8	139.9	146	-147.4	-16.5	0	0	0	108.6
155	H	30.9	Very low	28.6	Very low	151 Å²	151	133 Å²	133	70%	0.699	76%	0.76	S	S	*	*			trans	-99.8	151.9	-161.5	-70.8	-69.1	0	0	0	114.1
156	I	31	Very low	28.7	Very low	179 Å²	179	135.8 Å²	135.8	92%	0.918	77%	0.766	S	S	*	*				-146.4	150.2	128.4	-102.9	150.5	0	0	0	108.7
157	N	26.8	Very low	28.6	Very low	139 Å²	139	135.7 Å²	135.7	74%	0.743	77%	0.765	S	S	*	*			trans	-122.9	175.5	-158.8	-164.7	-7	0	0	0	111.4
158	V	30.3	Very low	28.5	Very low	128 Å²	128	138.9 Å²	138.9	78%	0.776	77%	0.774	S	S	*	*			trans	147.4	89	143.1	170.7	0	0	0	0	112.6
159	S	30.6	Very low	28.5	Very low	78 Å²	78	138.8 Å²	138.8	55%	0.545	78%	0.778	S	S	.	*			trans	59.4	123.9	134.9	77.3	0	0	0	0	123.3
160	N	26	Very low	28.4	Very low	158 Å²	158	139.6 Å²	139.6	85%	0.845	78%	0.781	S	S	*	*				56.8	144.5	115.7	-55.2	-9.4	0	0	0	120.9
161	S	28.8	Very low	28.3	Very low	103 Å²	103	139.7 Å²	139.7	72%	0.72	78%	0.781	S	S	*	*			cis	-169.6	-174	-10.9	53.5	0	0	0	0	107
162	S	31.3	Very low	27.9	Very low	107 Å²	107	139 Å²	139	75%	0.748	79%	0.785	S	S	*	*			cis	-156.4	165.2	17.7	-32.3	0	0	0	0	111
163	S	23.4	Very low	27.5	Very low	115 Å²	115	140.5 Å²	140.5	80%	0.804	78%	0.779	S	S	*	*			trans	-102.3	150.3	174.8	-52.7	0	0	0	0	112.5
164	T	27.7	Very low	27.3	Very low	133 Å²	133	142.3 Å²	142.3	82%	0.816	78%	0.783	S	S	*	*			trans	-136.2	116	162.4	-52	0	0	0	0	110.5
165	T	22.5	Very low	27	Very low	134 Å²	134	140 Å²	140	82%	0.822	78%	0.78	S	S	*	*			trans	-99.5	122.7	179.7	-57.8	0	0	0	0	110.4
166	I	26.1	Very low	26.7	Very low	152 Å²	152	138 Å²	138	78%	0.779	78%	0.783	S	S	*	*			trans	-131.3	114.9	166.3	-58.5	-175.7	0	0	0	111.9
167	Q	25.3	Very low	26.4	Very low	183 Å²	183	134.7 Å²	134.7	86%	0.855	78%	0.776	S	S	*	*			trans	-7.7	150	165.7	-58.1	-173.6	-6.7	0	0	122.8
168	L	22.4	Very low	26.4	Very low	166 Å²	166	137 Å²	137	87%	0.869	78%	0.782	S	S	*	*			trans	-56.2	146	163.7	-64.5	156.6	0	0	0	113.4
169	K	24.2	Very low	26.2	Very low	207 Å²	207	138.9 Å²	138.9	90%	0.9	79%	0.786	S	S	*	*			trans	-148.6	121.3	150.4	-158.4	167.7	-172.7	174.2	0	111.7
170	I	24.5	Very low	26.1	Very low	153 Å²	153	144.3 Å²	144.3	79%	0.785	80%	0.8	S	S	*	*			trans	-86.8	134.9	-178.5	-61.1	165.3	0	0	0	110
171	S	24.8	Very low	26.1	Very low	116 Å²	116	144.2 Å²	144.2	81%	0.811	80%	0.797	S	S	*	*			trans	-163.9	155.2	150.1	-81.4	0	0	0	0	111.1
172	P	31.6	Very low	26.1	Very low	116 Å²	116	149.2 Å²	149.2	75%	0.753	81%	0.806	S	S	*	*			trans	-122.3	-168.3	-160.2	37.9	-20.3	0	0	0	115
173	K	25.3	Very low	25.8	Very low	151 Å²	151	148.9 Å²	148.9	66%	0.657	80%	0.804	S	S	*	*			trans	92.1	114.8	170	-60.6	178.1	150.4	-76	0	115.4
174	E	26.1	Very low	25.9	Very low	155 Å²	155	151 Å²	151	72%	0.724	81%	0.805	S	S	*	*				84.1	143	95.9	-72.6	157.7	-159.5	0	0	113
175	S	26.8	Very low	25.9	Very low	115 Å²	115	149.8 Å²	149.8	80%	0.804	80%	0.799	S	S	*	*			cis	-171	178.7	-19.7	73.7	0	0	0	0	107
176	S	25.3	Very low	26.1	Very low	109 Å²	109	150.6 Å²	150.6	76%	0.762	80%	0.799	S	S	*	*			cis	-162.9	144.1	-4.2	-172.4	0	0	0	0	108.1
177	S	24.7	Very low	26	Very low	110 Å²	110	154.4 Å²	154.4	77%	0.769	81%	0.805	S	S	*	*			trans	-164.2	52.2	172.2	55.9	0	0	0	0	117.3
178	H	27.4	Very low	25.8	Very low	188 Å²	188	151.1 Å²	151.1	87%	0.87	80%	0.797	S	S	*	*			trans	-131.1	140.9	166.1	-86.1	-92	0	0	0	112.8
179	I	26.2	Very low	25.9	Very low	168 Å²	168	149.7 Å²	149.7	86%	0.862	80%	0.796	S	S	*	*			trans	-118.3	133.7	-168.3	-66.7	174	0	0	0	108.2
180	K	27.2	Very low	25.9	Very low	192 Å²	192	150.1 Å²	150.1	84%	0.835	79%	0.792	S	S	*	*			cis	-162.2	138.2	-12.8	-176.8	173.5	-173.4	176.4	0	108.5
181	I	26.6	Very low	25.9	Very low	156 Å²	156	151.7 Å²	151.7	80%	0.8	80%	0.795	S	S	*	*			trans	-81.7	148.6	-173.9	-64	166.3	0	0	0	112.3
182	K	27.8	Very low	26	Very low	208 Å²	208	152.8 Å²	152.8	90%	0.904	79%	0.793	S	S	*	*			trans	-130	130.9	143.6	-85.2	-167.3	173.7	-174.6	0	110.9
183	S	25.8	Very low	25.8	Very low	100 Å²	100	154.4 Å²	154.4	70%	0.699	80%	0.795	S	S	*	*			trans	-81.7	173.5	170.4	45	0	0	0	0	110.9
184	L	25.2	Very low	26	Very low	159 Å²	159	152.2 Å²	152.2	83%	0.832	80%	0.798	S	S	*	*			cis	-161.7	-169.4	3.6	-141.1	68.9	0	0	0	105
185	P	29.1	Very low	26.1	Very low	107 Å²	107	150.6 Å²	150.6	70%	0.695	79%	0.794	S	S	*	*			cis	-124.2	-170.9	-29.3	41.4	-25.3	0	0	0	113.4
186	N	25.5	Very low	26.1	Very low	151 Å²	151	151.9 Å²	151.9	81%	0.807	79%	0.792	S	S	*	*			trans	-34.7	139.8	174.4	-49.8	-13.1	0	0	0	118.2
187	Y	23.7	Very low	26.1	Very low	233 Å²	233	152.7 Å²	152.7	91%	0.914	80%	0.796	S	S	*	*			trans	-148.8	162.1	138.8	-117.2	-83.7	0	0	0	111
188	T	22.7	Very low	26.1	Very low	113 Å²	113	152.6 Å²	152.6	69%	0.693	79%	0.791	S	S	*	*			trans	-105.3	163.1	-175	43.9	0	0	0	0	113.4
189	T	23.6	Very low	26.2	Very low	137 Å²	137	148.9 Å²	148.9	84%	0.84	78%	0.781	S	S	*	*			trans	70.4	154.8	-176	78.4	0	0	0	0	113.7
190	R	23.7	Very low	26.2	Very low	216 Å²	216	144.5 Å²	144.5	82%	0.815	77%	0.77	S	S	*	*			cis	-134.6	162.2	11.2	-136.9	170.5	-168.4	159	-0.2	110.4	D192	R190-D192 PolarHBondContact O-N 3.08Å
191	H	25.2	Very low	26.3	Very low	185 Å²	185	141 Å²	141	86%	0.856	75%	0.752	S	S	*	*			trans	-91.3	93.2	174.2	-95.9	-77.7	0	0	0	110.5
192	D	26.2	Very low	26.5	Very low	140 Å²	140	139.4 Å²	139.4	75%	0.749	75%	0.745	S	S	*	*			trans	-97.9	116.7	174.8	-68.7	-49.5	0	0	0	111.6	R190	R190-D192 PolarHBondContact O-N 3.08Å
193	N	27.2	Very low	26.8	Very low	149 Å²	149	131.9 Å²	131.9	80%	0.797	71%	0.714	S	S	*	*			trans	-87.3	112.6	177.9	-74.1	-69	0	0	0	110.3
194	S	30.8	Very low	27.1	Very low	105 Å²	105	129.1 Å²	129.1	73%	0.734	70%	0.695	S	S	*	*			trans	-114.6	113.9	171.6	-175.4	0	0	0	0	110.7
195	L	27.5	Very low	27.4	Very low	121 Å²	121	123.7 Å²	123.7	63%	0.634	67%	0.671	S	S	*	*			trans	-91.6	123.9	178.4	-69	88.7	0	0	0	110.5
196	N	27.2	Very low	27.6	Very low	142 Å²	142	123.4 Å²	123.4	76%	0.759	66%	0.656	S	S	*	*			trans	-150.9	51.1	172.5	-99.6	-44.5	0	0	0	114.4
197	C	24.8	Very low	28.1	Very low	126 Å²	126	117.6 Å²	117.6	85%	0.851	62%	0.624	S	S	*	*			trans	-157.4	67.3	162.9	-157.5	0	0	0	0	113.8
198	V	25.7	Very low	28.3	Very low	108 Å²	108	107.1 Å²	107.1	66%	0.655	58%	0.584	S	S	*	*			trans	-138.5	94.6	168.8	-174.1	0	0	0	0	110.4	M59	M59-V198 HydrophobicContact CE-CG1 4.46Å
199	V	28.7	Very low	28.9	Very low	110 Å²	110	105.4 Å²	105.4	67%	0.667	57%	0.569	S	S	*	*			trans	-133.2	85.3	163.3	-163.1	0	0	0	0	109	R201	V199-R201 VanDerWaalsContact C-N 3.3Å; V199-R201 HydrophobicContact CG1-CG 3.8Å; V199-R201 PolarHBondContact O-N 3.24Å
200	A	26.1	Very low	29.5	Very low	77 Å²	77	102.4 Å²	102.4	64%	0.636	55%	0.546	S	S	*	.			trans	-69.1	84.8	175	0	0	0	0	0	110.6
201	R	28.6	Very low	30.1	Very low	118 Å²	118	92.8 Å²	92.8	45%	0.445	51%	0.511	S	S	.	.			trans	-84.8	110.7	175.2	-68.3	-177	166.4	162.2	-9.6	109.2	V199 N203 L838	V199-R201 VanDerWaalsContact C-N 3.3Å; V199-R201 HydrophobicContact CG1-CG 3.8Å; V199-R201 PolarHBondContact O-N 3.24Å; R201-N203 PolarHBondContact O-N 3.45Å; R201-L838 PolarHBondContact NH1-O 2.77Å
202	N	32	Very low	30.6	Very low	123 Å²	123	85.8 Å²	85.8	66%	0.658	48%	0.48	S	S	*	.			trans	-55.8	102.9	176.2	-84.2	-29.4	0	0	0	111.7	S204 S205	N202-S204 PolarHBondContact O-N 3.34Å; N202-S204 VanDerWaalsContact O-N 3.1Å; N202-S205 PolarHBondContact O-N 3.32Å; N202-S205 PolarHBondContact O-OG 3.42Å; N202-S205 VanDerWaalsContact O-OG 3.05Å
203	N	34.4	Very low	31	Very low	49 Å²	49	82.7 Å²	82.7	26%	0.262	47%	0.469	S	S	.	.	H	α-helix	trans	-60	-21.7	176.7	-74.5	-41.7	0	0	0	113.1	R201 S205 R206 I207 D353	R201-N203 PolarHBondContact O-N 3.45Å; N203-S205 VanDerWaalsContact C-N 3.28Å; N203-S205 PolarHBondContact O-N 3.35Å; N203-R206 PolarHBondContact O-N 3.12Å; N203-I207 HydrophobicContact CB-CD1 4.49Å; N203-I207 WeakPolarHBondContact O-CG1 3.5Å; N203-I207 PolarHBondContact O-N 3.33Å; N203-I207 VanDerWaalsContact O-N 3.14Å; N203-D353 PolarHBondContact ND2-OD2 3.16Å
204	S	31.9	Very low	31.3	Very low	42 Å²	42	79.7 Å²	79.7	29%	0.294	45%	0.453	S	S	.	.	H	α-helix	trans	-55.6	-35.4	179.8	-54.8	0	0	0	0	114.1	N202 F208 R475	N202-S204 PolarHBondContact O-N 3.34Å; N202-S204 VanDerWaalsContact O-N 3.1Å; S204-F208 PolarHBondContact O-N 3.33Å; S204-R475 PolarHBondContact OG-NE 3.26Å; S204-R475 PolarHBondContact OG-NH2 3.45Å
205	S	31.8	Very low	31.2	Very low	46 Å²	46	77.2 Å²	77.2	32%	0.322	44%	0.436	S	S	.	.	H	α-helix	trans	-72.2	-39	178.4	52	0	0	0	0	112.6	N202 N203 F208 I209 D604	N202-S205 PolarHBondContact O-N 3.32Å; N202-S205 PolarHBondContact O-OG 3.42Å; N202-S205 VanDerWaalsContact O-OG 3.05Å; N203-S205 VanDerWaalsContact C-N 3.28Å; N203-S205 PolarHBondContact O-N 3.35Å; S205-F208 WeakPolarHBondContact O-CB 3.21Å; S205-F208 PolarHBondContact O-N 3.36Å; S205-I209 PolarHBondContact O-N 3.2Å; S205-D604 WeakPolarHBondContact CA-OD2 3.43Å; S205-D604 WeakPolarHBondContact CB-OD2 3.49Å
206	R	33.3	Very low	31.5	Very low	100 Å²	100	80.3 Å²	80.3	38%	0.377	45%	0.447	S	S	.	.	H	α-helix	trans	-63.8	-44.6	176.5	-73	-179.6	166.6	-178.3	-7.5	111.6	N203 F208 I209 Q210	N203-R206 PolarHBondContact O-N 3.12Å; R206-F208 VanDerWaalsContact C-N 3.29Å; R206-F208 PolarHBondContact O-N 2.87Å; R206-I209 PolarHBondContact O-N 3.01Å; R206-Q210 VanDerWaalsContact O-CB 3.27Å; R206-Q210 WeakPolarHBondContact O-CB 3.45Å; R206-Q210 PolarHBondContact O-N 2.94Å
207	I	35.1	Very low	31.5	Very low	29 Å²	29	78.7 Å²	78.7	15%	0.149	45%	0.447	C	S	.	.	H	α-helix	trans	-59.7	-40.6	177.6	-64.4	162.3	0	0	0	110.9	N203 I209 Q210 C211	N203-I207 HydrophobicContact CB-CD1 4.49Å; N203-I207 WeakPolarHBondContact O-CG1 3.5Å; N203-I207 PolarHBondContact O-N 3.33Å; N203-I207 VanDerWaalsContact O-N 3.14Å; I207-I209 VanDerWaalsContact C-N 3.33Å; I207-I209 PolarHBondContact O-N 3.44Å; I207-Q210 PolarHBondContact O-N 2.73Å; I207-C211 PolarHBondContact O-N 2.88Å; I207-C211 VanDerWaalsContact O-N 3.13Å; I207-C211 PolarHBondContact O-SG 2.97Å; I207-C211 VanDerWaalsContact O-SG 3.34Å
208	F	27.3	Very low	31.7	Very low	14 Å²	14	80.5 Å²	80.5	6%	0.061	45%	0.448	C	S	.	.	H	α-helix	trans	-58.1	-41.3	-179.1	-166.9	-105.3	0	0	0	113.5	S204 S205 R206 D604 F607 L609 I620	S204-F208 PolarHBondContact O-N 3.33Å; S205-F208 WeakPolarHBondContact O-CB 3.21Å; S205-F208 PolarHBondContact O-N 3.36Å; R206-F208 VanDerWaalsContact C-N 3.29Å; R206-F208 PolarHBondContact O-N 2.87Å; F208-D604 HydrophobicContact CD1-CB 3.7Å; F208-D604 HydrophobicContact CE1-CB 3.97Å; F208-D604 HydrophobicContact CG-CB 4.35Å; F208-F607 HydrophobicContact CE1-CB 3.85Å; F208-L609 HydrophobicContact CE2-CB 3.86Å; F208-L609 HydrophobicContact CE2-CD2 4.46Å; F208-L609 HydrophobicContact CZ-CB 3.86Å; F208-I620 HydrophobicContact CD1-CD1 4.17Å; F208-I620 HydrophobicContact CD2-CD1 3.98Å; F208-I620 HydrophobicContact CE1-CD1 3.78Å; F208-I620 HydrophobicContact CE1-CG2 4.2Å; F208-I620 HydrophobicContact CE2-CD1 3.55Å; F208-I620 HydrophobicContact CE2-CG1 4.32Å; F208-I620 HydrophobicContact CG-CD1 4.28Å; F208-I620 HydrophobicContact CZ-CD1 3.44Å; F208-I620 VanDerWaalsContact CZ-CD1 3.44Å; F208-I620 HydrophobicContact CZ-CG1 3.97Å; F208-I620 HydrophobicContact CZ-CG2 4.33Å
209	I	36.3	Very low	32	Very low	76 Å²	76	84.2 Å²	84.2	39%	0.39	46%	0.458	S	S	.	.	H	α-helix	trans	-83.2	-37.1	178.1	-60.6	177.7	0	0	0	111.2	S205 R206 I207 C211 S213 F607	S205-I209 PolarHBondContact O-N 3.2Å; R206-I209 PolarHBondContact O-N 3.01Å; I207-I209 VanDerWaalsContact C-N 3.33Å; I207-I209 PolarHBondContact O-N 3.44Å; I209-C211 PolarHBondContact O-N 3.27Å; I209-S213 PolarHBondContact O-N 3.23Å; I209-S213 PolarHBondContact O-OG 3.45Å; I209-F607 HydrophobicContact CD1-CD2 4.43Å; I209-F607 HydrophobicContact CD1-CE2 4.49Å; I209-F607 HydrophobicContact CG1-CD2 4.28Å; I209-F607 HydrophobicContact CG1-CE2 4.47Å
210	Q	36.4	Very low	31.8	Very low	75 Å²	75	87 Å²	87	35%	0.35	46%	0.458	S	S	.	.	H	α-helix	trans	-56.7	-52.9	-179.8	-170.5	83.9	32.1	0	0	112	R206 I207 L212 S213	R206-Q210 VanDerWaalsContact O-CB 3.27Å; R206-Q210 WeakPolarHBondContact O-CB 3.45Å; R206-Q210 PolarHBondContact O-N 2.94Å; I207-Q210 PolarHBondContact O-N 2.73Å; Q210-L212 PolarHBondContact O-N 3.22Å; Q210-S213 PolarHBondContact O-N 3.04Å; Q210-S213 VanDerWaalsContact O-N 3.15Å
211	C	34.7	Very low	32	Very low	14 Å²	14	90.3 Å²	90.3	10%	0.095	46%	0.464	C	S	.	.	H	α-helix	trans	-68.2	-8.3	-167.4	-64.7	0	0	0	0	115.2	I207 I209 H468	I207-C211 PolarHBondContact O-N 2.88Å; I207-C211 VanDerWaalsContact O-N 3.13Å; I207-C211 PolarHBondContact O-SG 2.97Å; I207-C211 VanDerWaalsContact O-SG 3.34Å; I209-C211 PolarHBondContact O-N 3.27Å; C211-H468 HydrophobicContact CB-CB 4.28Å; C211-H468 VanDerWaalsContact SG-CB 3.59Å
212	L	36.7	Very low	31.9	Very low	38 Å²	38	89.6 Å²	89.6	20%	0.199	47%	0.468	C	S	.	.	H	α-helix	trans	-122.9	-2	173.8	-65.6	-172.4	0	0	0	114.7	Q210 D214 S215 I620	Q210-L212 PolarHBondContact O-N 3.22Å; L212-D214 PolarHBondContact O-N 2.73Å; L212-S215 WeakPolarHBondContact O-CB 3.26Å; L212-S215 PolarHBondContact O-N 3.18Å; L212-S215 PolarHBondContact O-OG 3.1Å; L212-I620 HydrophobicContact CD1-CB 3.51Å; L212-I620 HydrophobicContact CD1-CD1 3.57Å; L212-I620 HydrophobicContact CD1-CG1 3.59Å; L212-I620 HydrophobicContact CG-CD1 4.35Å
213	S	34.4	Very low	31.8	Very low	75 Å²	75	91 Å²	91	52%	0.524	48%	0.475	S	S	.	.	H	α-helix	trans	-65.9	-19.4	174.1	-65.7	0	0	0	0	112.6	I209 Q210	I209-S213 PolarHBondContact O-N 3.23Å; I209-S213 PolarHBondContact O-OG 3.45Å; Q210-S213 PolarHBondContact O-N 3.04Å; Q210-S213 VanDerWaalsContact O-N 3.15Å
214	D	34.2	Very low	31.7	Very low	86 Å²	86	96.6 Å²	96.6	46%	0.46	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	26.5	176.3	-55.9	-10.4	0	0	0	113.7	L212 R465	L212-D214 PolarHBondContact O-N 2.73Å; D214-R465 VanDerWaalsContact CB-CZ 3.47Å; D214-R465 VanDerWaalsContact CG-NH2 3.34Å; D214-R465 IonicContact OD2-CZ 3.18Å; D214-R465 IonicContact OD2-NE 2.76Å; D214-R465 IonicContact OD2-NH2 2.83Å; D214-R465 PolarHBondContact OD2-NH2 2.94Å
215	S	28.7	Very low	31.5	Very low	52 Å²	52	102.2 Å²	102.2	36%	0.364	53%	0.532	S	S	.	.			trans	-86.3	134.6	-171.9	-58.5	0	0	0	0	114	L212 S217	L212-S215 WeakPolarHBondContact O-CB 3.26Å; L212-S215 PolarHBondContact O-N 3.18Å; L212-S215 PolarHBondContact O-OG 3.1Å; S215-S217 PolarHBondContact O-N 3.01Å; S215-S217 VanDerWaalsContact O-N 3.16Å
216	E	33.2	Very low	31.5	Very low	186 Å²	186	106.9 Å²	106.9	87%	0.869	56%	0.558	S	S	*	*	S	Bend	trans	70.4	-6.3	156.4	-63.1	177.1	-177.4	0	0	120.2	D218	E216-D218 PolarHBondContact O-N 3.13Å
217	S	28	Very low	31.2	Very low	108 Å²	108	110.5 Å²	110.5	76%	0.755	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-1.2	-173.4	65.8	0	0	0	0	118.1	S215	S215-S217 PolarHBondContact O-N 3.01Å; S215-S217 VanDerWaalsContact O-N 3.16Å
218	D	28.6	Very low	30.8	Very low	164 Å²	164	117.4 Å²	117.4	88%	0.877	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.5	1.8	-174.4	-79.7	-35.2	0	0	0	115.2	E216	E216-D218 PolarHBondContact O-N 3.13Å
219	E	31.2	Very low	30.7	Very low	186 Å²	186	122.8 Å²	122.8	87%	0.869	65%	0.645	S	S	*	*	S	Bend	trans	-100.1	115.5	168.3	-73.9	-155	140.5	0	0	112.2	I221	E219-I221 PolarHBondContact O-N 2.93Å
220	Y	25.8	Very low	30.3	Very low	170 Å²	170	124.6 Å²	124.6	67%	0.667	66%	0.66	S	S	*	*			trans	-83.4	97.6	-173.6	173	-96.7	0	0	0	112.6
221	I	28.3	Very low	29.8	Very low	146 Å²	146	127.1 Å²	127.1	75%	0.749	68%	0.682	S	S	*	*			trans	-139.5	143.7	162.8	-60.6	-174.6	0	0	0	110	E219	E219-I221 PolarHBondContact O-N 2.93Å
222	D	27.2	Very low	29.5	Very low	102 Å²	102	133.6 Å²	133.6	55%	0.545	72%	0.715	S	S	.	*			trans	-61.6	147.7	-176.5	-57.5	-75.7	0	0	0	114.9
223	L	30.8	Very low	28.9	Very low	153 Å²	153	139.3 Å²	139.3	80%	0.801	75%	0.745	S	S	*	*			trans	-125	114.2	161.8	-78.3	173	0	0	0	109.1
224	D	32.2	Very low	28.6	Very low	167 Å²	167	142.8 Å²	142.8	89%	0.893	76%	0.758	S	S	*	*			trans	-74.2	150	170.5	-95.8	-46.9	0	0	0	111.6	T226	D224-T226 PolarHBondContact O-N 2.95Å
225	D	27.5	Very low	28.4	Very low	160 Å²	160	144.9 Å²	144.9	86%	0.856	77%	0.774	S	S	*	*			trans	-61.6	129.5	-175.9	-90.1	-56	0	0	0	113.8
226	T	31.6	Very low	28.3	Very low	143 Å²	143	147.8 Å²	147.8	88%	0.877	79%	0.79	S	S	*	*			trans	-151.1	123.1	141.2	-12.7	0	0	0	0	112.3	D224	D224-T226 PolarHBondContact O-N 2.95Å
227	K	27.1	Very low	27.9	Very low	177 Å²	177	145.9 Å²	145.9	77%	0.77	79%	0.785	S	S	*	*			trans	-65.9	143	-173.3	-58.9	168	-178.7	170.2	0	113.1
228	M	27.2	Very low	27.9	Very low	173 Å²	173	148.9 Å²	148.9	85%	0.852	79%	0.787	S	S	*	*				-152.5	117.5	128.2	-107.1	-57.7	171.2	0	0	110.7
229	T	24.6	Very low	27.7	Very low	127 Å²	127	145.4 Å²	145.4	78%	0.779	78%	0.776	S	S	*	*			trans	-121.8	120.6	176.8	48.5	0	0	0	0	109.6
230	T	28.1	Very low	27.4	Very low	115 Å²	115	140.8 Å²	140.8	71%	0.706	76%	0.756	S	S	*	*			trans	-133.8	119.1	170.3	52.1	0	0	0	0	108.8
231	P	24.8	Very low	27.4	Very low	127 Å²	127	138.9 Å²	138.9	83%	0.825	75%	0.753	S	S	*	*			trans	-74.7	158.1	178.2	32.9	-35.2	0	0	0	111.2
232	I	29	Very low	27.3	Very low	150 Å²	150	138.5 Å²	138.5	77%	0.769	75%	0.749	S	S	*	*			trans	-130.9	94.2	167.7	-56.5	178.6	0	0	0	107.9
233	N	25	Very low	27.3	Very low	158 Å²	158	138.1 Å²	138.1	85%	0.845	75%	0.747	S	S	*	*			trans	-93.7	108.9	147.9	-77.6	0.1	0	0	0	105.4
234	D	27.8	Very low	27.2	Very low	148 Å²	148	137.9 Å²	137.9	79%	0.791	74%	0.742	S	S	*	*			trans	-176.9	163.2	155.4	-108	-27.8	0	0	0	112.9
235	V	29.3	Very low	27.1	Very low	130 Å²	130	136 Å²	136	79%	0.788	72%	0.723	S	S	*	*			trans	68.4	92.4	174	-163.4	0	0	0	0	116.4
236	T	27.1	Very low	27	Very low	114 Å²	114	132.5 Å²	132.5	70%	0.699	70%	0.704	S	S	*	*			trans	-61.2	168.6	164.2	47.7	0	0	0	0	114.5
237	N	24.6	Very low	26.9	Very low	145 Å²	145	131 Å²	131	78%	0.775	69%	0.687	S	S	*	*			trans	50.2	84.5	152.5	-64.4	-13.1	0	0	0	117.9
238	H	28	Very low	26.9	Very low	172 Å²	172	127.6 Å²	127.6	80%	0.796	68%	0.682	S	S	*	*			trans	-134.1	114.5	156.1	-100.1	57.8	0	0	0	112.2	I240	H238-I240 PolarHBondContact O-N 3.32Å
239	S	25.1	Very low	26.9	Very low	91 Å²	91	125.9 Å²	125.9	64%	0.636	67%	0.674	S	S	*	*			trans	-55.3	112.7	177	-75.7	0	0	0	0	112.7	H241 R1137	S239-H241 PolarHBondContact O-N 3.12Å; S239-R1137 PolarHBondContact OG-NH1 3Å
240	I	24.8	Very low	27	Very low	88 Å²	88	125.4 Å²	125.4	45%	0.451	67%	0.672	S	S	.	*			trans	-75.3	96.5	160.6	-59.1	-178.5	0	0	0	107.6	H238 R1137	H238-I240 PolarHBondContact O-N 3.32Å; I240-R1137 PolarHBondContact O-NH2 3Å
241	H	25.6	Very low	27.1	Very low	131 Å²	131	127.2 Å²	127.2	61%	0.606	67%	0.672	S	S	*	*			trans	-88.1	126.5	161	-154.6	-106.9	0	0	0	107.6	S239 N243	S239-H241 PolarHBondContact O-N 3.12Å; H241-N243 VanDerWaalsContact C-N 3.3Å; H241-N243 PolarHBondContact ND1-OD1 3.23Å; H241-N243 PolarHBondContact O-N 2.71Å; H241-N243 VanDerWaalsContact O-N 3.08Å
242	M	25.1	Very low	27.2	Very low	137 Å²	137	129.7 Å²	129.7	68%	0.675	67%	0.672	S	S	*	*			trans	-81.1	85	170.9	-77.6	-61.3	-164.6	0	0	108.1	H244	M242-H244 PolarHBondContact O-N 2.96Å
243	N	27.5	Very low	27	Very low	94 Å²	94	128.3 Å²	128.3	50%	0.503	67%	0.666	S	S	.	*			trans	-65	105.5	173.1	-68.5	-12.5	0	0	0	109	H241	H241-N243 VanDerWaalsContact C-N 3.3Å; H241-N243 PolarHBondContact ND1-OD1 3.23Å; H241-N243 PolarHBondContact O-N 2.71Å; H241-N243 VanDerWaalsContact O-N 3.08Å
244	H	29.3	Very low	27.2	Very low	148 Å²	148	126.4 Å²	126.4	69%	0.685	66%	0.662	S	S	*	*			trans	-53.1	143.8	149.8	-79.4	-97	0	0	0	108.4	M242 N246	M242-H244 PolarHBondContact O-N 2.96Å; H244-N246 PolarHBondContact O-N 3.02Å
245	Y	29	Very low	27	Very low	128 Å²	128	125.5 Å²	125.5	50%	0.502	66%	0.662	S	S	.	*			trans	-74.1	117.8	168.5	-90.2	-116.4	0	0	0	107.3	H247 Y749 P751	Y245-H247 PolarHBondContact O-N 3.37Å; Y245-Y749 PolarHBondContact OH-O 3.46Å; Y245-P751 HydrophobicContact CD1-CB 4.11Å; Y245-P751 HydrophobicContact CD1-CG 4.31Å; Y245-P751 HydrophobicContact CE1-CB 4.4Å
246	N	27.1	Very low	27	Very low	86 Å²	86	127.8 Å²	127.8	46%	0.46	66%	0.664	S	S	.	*			trans	-67.9	115.6	168	-67.9	7.8	0	0	0	107.3	H244	H244-N246 PolarHBondContact O-N 3.02Å
247	H	29.1	Very low	26.8	Very low	111 Å²	111	129.9 Å²	129.9	51%	0.514	67%	0.67	S	S	.	*			trans	-96.9	115.7	162.8	-151.8	-53.5	0	0	0	107.6	Y245 I249 E365	Y245-H247 PolarHBondContact O-N 3.37Å; H247-I249 PolarHBondContact O-N 3.32Å; H247-E365 IonicContact CD2-OE1 2.68Å; H247-E365 IonicContact CD2-OE2 3.62Å
248	T	27.5	Very low	26.8	Very low	107 Å²	107	127.7 Å²	127.7	66%	0.656	67%	0.666	S	S	*	*			trans	-65.9	124.5	173	-48.8	0	0	0	0	108.3
249	I	26.3	Very low	26.8	Very low	136 Å²	136	126.9 Å²	126.9	70%	0.697	67%	0.667	S	S	*	*			trans	-110.6	104.3	167.8	-58.3	179.9	0	0	0	106.4	H247 E251	H247-I249 PolarHBondContact O-N 3.32Å; I249-E251 HydrophobicContact CG2-CG 3.84Å; I249-E251 PolarHBondContact O-N 3.29Å
250	T	26	Very low	26.9	Very low	118 Å²	118	130.7 Å²	130.7	72%	0.724	68%	0.675	S	S	*	*			trans	-84.9	88	172.4	-51.7	0	0	0	0	108.2	Q252	T250-Q252 PolarHBondContact O-N 3.31Å; T250-Q252 VanDerWaalsContact O-N 3.09Å
251	E	30.5	Very low	27.1	Very low	152 Å²	152	134.8 Å²	134.8	71%	0.71	69%	0.692	S	S	*	*			trans	-71.5	103	171.3	-70.1	-159.6	156.3	0	0	110	I249 I253	I249-E251 HydrophobicContact CG2-CG 3.84Å; I249-E251 PolarHBondContact O-N 3.29Å; E251-I253 VanDerWaalsContact C-N 3.34Å; E251-I253 HydrophobicContact CB-CG1 4.33Å; E251-I253 PolarHBondContact O-N 2.86Å
252	Q	27.1	Very low	27	Very low	179 Å²	179	132.6 Å²	132.6	84%	0.836	69%	0.692	S	S	*	*			trans	-71.6	90.5	163.6	-70.1	-179.2	-41.6	0	0	108.8	T250 P254	T250-Q252 PolarHBondContact O-N 3.31Å; T250-Q252 VanDerWaalsContact O-N 3.09Å; Q252-P254 WeakPolarHBondContact O-CD 3.43Å
253	I	26.2	Very low	27	Very low	122 Å²	122	133 Å²	133	63%	0.626	70%	0.695	S	S	*	*			trans	-84.3	115.7	168.3	-60.4	178.6	0	0	0	108.1	E251 T255	E251-I253 VanDerWaalsContact C-N 3.34Å; E251-I253 HydrophobicContact CB-CG1 4.33Å; E251-I253 PolarHBondContact O-N 2.86Å; I253-T255 PolarHBondContact O-N 3.28Å
254	P	27.6	Very low	27.1	Very low	118 Å²	118	136.1 Å²	136.1	77%	0.766	71%	0.707	S	S	*	*			trans	-77.7	90.5	-179.5	-14.1	31.6	0	0	0	111.3	Q252 Q256	Q252-P254 WeakPolarHBondContact O-CD 3.43Å; P254-Q256 PolarHBondContact O-N 2.96Å; P254-Q256 VanDerWaalsContact O-N 3.09Å
255	T	25.2	Very low	27	Very low	128 Å²	128	137.8 Å²	137.8	79%	0.785	71%	0.712	S	S	*	*			trans	-77	88	164.7	50.4	0	0	0	0	109.9	I253	I253-T255 PolarHBondContact O-N 3.28Å
256	Q	27.3	Very low	26.9	Very low	179 Å²	179	137.5 Å²	137.5	84%	0.836	72%	0.719	S	S	*	*			trans	-118.9	111.8	163.9	-81.6	-70.1	-12.6	0	0	108.1	P254	P254-Q256 PolarHBondContact O-N 2.96Å; P254-Q256 VanDerWaalsContact O-N 3.09Å
257	L	23.9	Very low	27	Very low	157 Å²	157	139.2 Å²	139.2	82%	0.822	73%	0.728	S	S	*	*			trans	-128.3	146.6	-177.3	-123	159.1	0	0	0	107.9
258	S	24.4	Very low	26.9	Very low	99 Å²	99	139.4 Å²	139.4	69%	0.692	73%	0.732	S	S	*	*			trans	58.6	110.3	-175.8	59	0	0	0	0	116.9
259	N	28.6	Very low	26.8	Very low	155 Å²	155	142.2 Å²	142.2	83%	0.829	74%	0.737	S	S	*	*				-152.8	163.3	103.9	-102.2	-40.8	0	0	0	111.6
260	H	27.3	Very low	26.7	Very low	172 Å²	172	139.9 Å²	139.9	80%	0.796	73%	0.733	S	S	*	*			trans	-56.6	154.7	-173.9	-77.2	-136.6	0	0	0	112.8
261	E	28	Very low	26.7	Very low	173 Å²	173	140.7 Å²	140.7	81%	0.808	73%	0.733	S	S	*	*				-155.6	146.7	55.9	-81.4	-166.4	105.5	0	0	117.1
262	S	24.9	Very low	26.5	Very low	86 Å²	86	141.1 Å²	141.1	60%	0.601	74%	0.735	S	S	*	*			trans	64.1	126.5	132.2	-61.8	0	0	0	0	124.2
263	I	24.6	Very low	26.4	Very low	144 Å²	144	139.5 Å²	139.5	74%	0.738	73%	0.731	S	S	*	*			trans	72.2	128	139.3	-68.4	167.4	0	0	0	117.3
264	Q	28.5	Very low	26.3	Very low	161 Å²	161	139.5 Å²	139.5	75%	0.752	74%	0.737	S	S	*	*			cis	-148.4	132.8	-10.9	-101.3	164	31.1	0	0	106.2
265	K	27.4	Very low	26	Very low	183 Å²	183	139.5 Å²	139.5	80%	0.796	74%	0.739	S	S	*	*				89.5	145.1	66.9	-144.9	-172.9	-172.9	-178.7	0	112.9
266	N	28.6	Very low	26	Very low	121 Å²	121	138.3 Å²	138.3	65%	0.647	74%	0.736	S	S	*	*			trans	75.1	146.4	175.2	-60.4	49.7	0	0	0	115.6
267	D	28.7	Very low	25.8	Very low	122 Å²	122	140 Å²	140	65%	0.652	74%	0.736	S	S	*	*			cis	-167.9	160.9	-11.6	-95.7	-18.4	0	0	0	108.3
268	I	26.6	Very low	25.8	Very low	116 Å²	116	140.9 Å²	140.9	60%	0.595	74%	0.736	S	S	*	*			cis	-171.2	139.7	-23.9	-169.7	166.6	0	0	0	110
269	Q	26.2	Very low	25.8	Very low	166 Å²	166	142 Å²	142	78%	0.776	74%	0.739	S	S	*	*			trans	61	163.1	159	-77.9	162.3	-4	0	0	119.6
270	S	23.9	Very low	25.6	Very low	87 Å²	87	140.5 Å²	140.5	61%	0.608	74%	0.736	S	S	*	*			cis	-175.4	161.2	-22.7	54.6	0	0	0	0	111
271	N	24.7	Very low	25.5	Very low	134 Å²	134	139.1 Å²	139.1	72%	0.717	74%	0.735	S	S	*	*			trans	67.9	157.6	155	-68.8	24.3	0	0	0	117.8
272	E	27.7	Very low	25.4	Very low	161 Å²	161	137.5 Å²	137.5	75%	0.752	73%	0.732	S	S	*	*			cis	-151	-172.9	-6.8	-127.6	167.7	125.9	0	0	114.3
273	L	24	Very low	25.4	Very low	146 Å²	146	139.9 Å²	139.9	76%	0.764	74%	0.736	S	S	*	*			trans	-85.6	143.6	-158.9	-69.3	157.1	0	0	0	117.5
274	V	23.4	Very low	25.5	Very low	122 Å²	122	139.6 Å²	139.6	74%	0.739	73%	0.734	S	S	*	*				65.3	138	128.8	176.4	0	0	0	0	121.9
275	S	23	Very low	25.3	Very low	117 Å²	117	137.2 Å²	137.2	82%	0.818	74%	0.736	S	S	*	*			trans	75.5	150.6	169.7	82.5	0	0	0	0	116
276	S	24.2	Very low	25.3	Very low	103 Å²	103	133.8 Å²	133.8	72%	0.72	74%	0.735	S	S	*	*			cis	-136.7	-157.7	6.8	66.6	0	0	0	0	112.6
277	Y	22.9	Very low	25.2	Very low	214 Å²	214	135.6 Å²	135.6	84%	0.839	74%	0.744	S	S	*	*			trans	-84.7	171.3	-157.8	-49.1	-87.5	0	0	0	115.8
278	E	24.1	Very low	25.2	Very low	176 Å²	176	135.3 Å²	135.3	82%	0.822	75%	0.752	S	S	*	*			trans	84.6	111.7	158.1	-56.6	-162.6	147.1	0	0	121.4
279	T	24.2	Very low	25.1	Very low	123 Å²	123	137.8 Å²	137.8	76%	0.755	77%	0.766	S	S	*	*			trans	80.3	150.5	139.8	55.6	0	0	0	0	123.2
280	T	25.5	Very low	25.2	Very low	124 Å²	124	137 Å²	137	76%	0.761	77%	0.768	S	S	*	*			trans	67.5	98.7	167.2	50.5	0	0	0	0	120.2
281	D	23.8	Very low	25.4	Very low	143 Å²	143	138.5 Å²	138.5	77%	0.765	78%	0.778	S	S	*	*				40.7	134.7	123.3	-68.2	-14.9	0	0	0	123
282	N	26	Very low	25.5	Very low	139 Å²	139	140 Å²	140	74%	0.743	78%	0.781	S	S	*	*			trans	91.8	119	140.2	-78.2	-36.7	0	0	0	122.4
283	I	25.6	Very low	25.5	Very low	135 Å²	135	138.1 Å²	138.1	69%	0.692	78%	0.775	S	S	*	*				103.4	119.2	126.4	-76.4	170.4	0	0	0	120.1
284	I	25.9	Very low	25.7	Very low	138 Å²	138	140.4 Å²	140.4	71%	0.708	78%	0.778	S	S	*	*			trans	66.9	109.4	161.8	-69	162.4	0	0	0	115.9
285	S	25.5	Very low	26	Very low	112 Å²	112	138.7 Å²	138.7	78%	0.783	77%	0.771	S	S	*	*			cis	93.8	114.2	37.7	-65.1	0	0	0	0	114.7
286	S	27.8	Very low	26.2	Very low	110 Å²	110	139.2 Å²	139.2	77%	0.769	76%	0.763	S	S	*	*			trans	-161.2	113.3	148.7	54.6	0	0	0	0	113.3
287	N	26	Very low	26.3	Very low	159 Å²	159	141 Å²	141	85%	0.85	76%	0.764	S	S	*	*			trans	50.4	104.4	145.4	-55.7	-2.3	0	0	0	121.2
288	S	28.6	Very low	26.6	Very low	117 Å²	117	137.5 Å²	137.5	82%	0.818	76%	0.76	S	S	*	*			trans	-142.9	135.2	140.6	-92.7	0	0	0	0	108.6	N290	S288-N290 PolarHBondContact O-N 3.27Å
289	N	25.2	Very low	26.6	Very low	167 Å²	167	136.9 Å²	136.9	89%	0.893	76%	0.763	S	S	*	*			trans	-70.6	127.7	-165.5	-63	-39.2	0	0	0	113.1
290	N	26.6	Very low	26.8	Very low	150 Å²	150	139 Å²	139	80%	0.802	77%	0.769	S	S	*	*			trans	-143.7	137.5	167	-97.5	-76.5	0	0	0	109.7	S288 E292	S288-N290 PolarHBondContact O-N 3.27Å; N290-E292 PolarHBondContact O-N 3.01Å
291	S	28.1	Very low	26.9	Very low	118 Å²	118	142 Å²	142	83%	0.825	78%	0.775	S	S	*	*			trans	-74.9	116.6	-176.5	37.5	0	0	0	0	111.8	I293	S291-I293 PolarHBondContact O-N 3.04Å
292	E	27.2	Very low	26.9	Very low	165 Å²	165	140.1 Å²	140.1	77%	0.771	77%	0.772	S	S	*	*			trans	-67.1	119.9	-180	-70.8	-162.5	117.8	0	0	112.2	N290 K294	N290-E292 PolarHBondContact O-N 3.01Å; E292-K294 PolarHBondContact O-N 3.15Å
293	I	29	Very low	26.9	Very low	123 Å²	123	140.9 Å²	140.9	63%	0.631	78%	0.776	S	S	*	*			trans	-68.5	97.9	164.6	-59.6	175.2	0	0	0	107.1	I53 S291 C295	I53-I293 HydrophobicContact CD1-CD1 4.18Å; S291-I293 PolarHBondContact O-N 3.04Å; I293-C295 VanDerWaalsContact C-N 3.25Å; I293-C295 PolarHBondContact O-N 3.39Å
294	K	27.6	Very low	27	Very low	193 Å²	193	142.5 Å²	142.5	84%	0.839	79%	0.787	S	S	*	*			trans	-78.1	74.7	-176.1	-152.7	168.8	-168.1	172	0	111	E292	E292-K294 PolarHBondContact O-N 3.15Å
295	C	28.8	Very low	27.6	Very low	86 Å²	86	145 Å²	145	58%	0.581	79%	0.793	S	S	*	*			trans	-53.7	138.5	170	-58.1	0	0	0	0	110.1	I293 N297	I293-C295 VanDerWaalsContact C-N 3.25Å; I293-C295 PolarHBondContact O-N 3.39Å; C295-N297 PolarHBondContact O-N 3.29Å; C295-N297 VanDerWaalsContact O-N 3.12Å
296	I	28	Very low	29	Very low	129 Å²	129	147.1 Å²	147.1	66%	0.662	79%	0.793	S	S	*	*	S	Bend	trans	-71.8	108.9	178.4	-60.9	175.2	0	0	0	109.4	E428	I296-E428 VanDerWaalsContact CD1-O 3.29Å; I296-E428 WeakPolarHBondContact CD1-O 3.48Å
297	N	27	Very low	31	Very low	139 Å²	139	146.3 Å²	146.3	74%	0.743	78%	0.779	S	S	*	*			trans	-165.5	175.3	153	-116.8	10	0	0	0	110.6	C295	C295-N297 PolarHBondContact O-N 3.29Å; C295-N297 VanDerWaalsContact O-N 3.12Å
298	D	27.6	Very low	33.9	Very low	141 Å²	141	144 Å²	144	75%	0.754	76%	0.764	S	S	*	*			trans	66.1	69.7	165.5	-53.4	-19.1	0	0	0	116.3
299	N	25.2	Very low	37	Very low	164 Å²	164	139.8 Å²	139.8	88%	0.877	73%	0.734	S	S	*	*	S	Bend	trans	-145.9	57.1	146.5	-117	-15	0	0	0	112.1
300	N	28	Very low	40.3	Very low	166 Å²	166	132.1 Å²	132.1	89%	0.888	69%	0.693	S	S	*	*	S	Bend	trans	-166.3	119.4	148.7	-101.1	-32.2	0	0	0	109.8
301	H	26.8	Very low	43.6	Very low	188 Å²	188	128.6 Å²	128.6	87%	0.87	67%	0.674	S	S	*	*			trans	-69.3	159	176.3	-108.6	-81.7	0	0	0	111.4
302	S	25	Very low	46.9	Very low	103 Å²	103	124.8 Å²	124.8	72%	0.72	64%	0.642	S	S	*	*	S	Bend	trans	69.1	69.8	170.6	67.2	0	0	0	0	117.9
303	N	25.5	Very low	50.3	Low	155 Å²	155	117 Å²	117	83%	0.829	61%	0.605	S	S	*	*				-177	132.8	124	-97.9	-53.7	0	0	0	112.1	K305	N303-K305 PolarHBondContact O-N 3.27Å
304	N	27.2	Very low	53.5	Low	170 Å²	170	112 Å²	112	91%	0.909	58%	0.579	S	S	*	*			trans	-75.9	71	166.3	-87	-26	0	0	0	109.9	I306	N304-I306 PolarHBondContact O-N 3.23Å; N304-I306 VanDerWaalsContact O-N 3.08Å
305	K	39.7	Very low	56.7	Low	191 Å²	191	106.5 Å²	106.5	83%	0.83	56%	0.557	S	S	*	*			trans	-66.7	109.1	168.5	-100.7	-168.3	173.5	-172.2	0	109.1	N303 I307	N303-K305 PolarHBondContact O-N 3.27Å; K305-I307 PolarHBondContact O-N 2.9Å
306	I	54.8	Low	60	Low	156 Å²	156	103.7 Å²	103.7	80%	0.8	54%	0.538	S	S	*	.			trans	-53.5	129.9	161	-61.1	171.1	0	0	0	106.5	N304 E308	N304-I306 PolarHBondContact O-N 3.23Å; N304-I306 VanDerWaalsContact O-N 3.08Å; I306-E308 PolarHBondContact O-N 3.36Å
307	I	69.5	Low	63.2	Low	92 Å²	92	99.6 Å²	99.6	47%	0.472	52%	0.517	S	S	.	.			trans	-67.9	107.7	174.2	-61.1	175.7	0	0	0	106.1	K305 S309 P329	K305-I307 PolarHBondContact O-N 2.9Å; I307-S309 PolarHBondContact O-N 2.88Å; I307-P329 HydrophobicContact CG2-CB 3.97Å; I307-P329 HydrophobicContact CG2-CG 4.45Å
308	E	87.8	Confident	66.6	Low	112 Å²	112	98.1 Å²	98.1	52%	0.523	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-64.1	127.2	178.7	-163.4	-179.3	157.9	0	0	108.8	I306 P329 K412 Y413	I306-E308 PolarHBondContact O-N 3.36Å; E308-P329 WeakPolarHBondContact O-CB 3.48Å; E308-K412 HydrophobicContact CG-CD 4.14Å; E308-K412 VanDerWaalsContact OE1-CD 3.32Å; E308-K412 WeakPolarHBondContact OE1-CD 3.32Å; E308-K412 WeakPolarHBondContact OE1-CE 3.26Å; E308-K412 IonicContact OE1-NZ 3.74Å; E308-K412 PolarHBondContact OE1-NZ 3.4Å; E308-Y413 WeakPolarHBondContact O-CE2 3.42Å; E308-Y413 PolarHBondContact O-OH 3.27Å
309	S	92.9	Very high	69.8	Low	28 Å²	28	95.2 Å²	95.2	20%	0.196	49%	0.493	C	S	.	.	P	Polyproline II helix	trans	-77.9	144.9	178.6	-58.4	0	0	0	0	109.8	I307 I324 K412	I307-S309 PolarHBondContact O-N 2.88Å; S309-I324 VanDerWaalsContact OG-CG2 3.25Å; S309-I324 WeakPolarHBondContact OG-CG2 3.22Å; S309-K412 WeakPolarHBondContact O-CD 3.5Å; S309-K412 PolarHBondContact O-NZ 3.22Å
310	D	95.1	Very high	73.1	Confident	5 Å²	5	89.9 Å²	89.9	3%	0.027	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-64	153.5	167.3	-169.3	10.2	0	0	0	110.2	Y312 P329 V331 W441 H444	D310-Y312 PolarHBondContact OD1-N 3.06Å; D310-P329 WeakPolarHBondContact CB-O 3.48Å; D310-P329 PolarHBondContact N-O 3.32Å; D310-V331 HydrophobicContact CB-CG2 4.36Å; D310-V331 WeakPolarHBondContact O-CG1 3.35Å; D310-V331 WeakPolarHBondContact O-CG2 3.21Å; D310-W441 HydrophobicContact CB-CH2 4.03Å; D310-W441 HydrophobicContact CB-CZ3 4.46Å; D310-W441 WeakPolarHBondContact OD2-CZ3 3.33Å; D310-H444 IonicContact OD1-NE2 3.67Å; D310-H444 PolarHBondContact OD1-NE2 2.96Å; D310-H444 IonicContact OD2-CD2 3.74Å; D310-H444 IonicContact OD2-CE1 3.69Å; D310-H444 CovalentContact OD2-NE2 1.73Å; D310-H444 IonicContact OD2-NE2 3.32Å; D310-H444 PolarHBondContact OD2-NE2 2.85Å
311	D	95.6	Very high	76.2	Confident	76 Å²	76	90.7 Å²	90.7	41%	0.406	48%	0.475	S	S	.	.	S	Bend	trans	-96	-9.5	179.6	-55.9	-38.8	0	0	0	111.8	P319 K412	D311-P319 WeakPolarHBondContact O-CA 3.41Å; D311-K412 IonicContact OD1-NZ 3.38Å; D311-K412 PolarHBondContact OD1-NZ 2.94Å; D311-K412 WeakPolarHBondContact OD2-CE 3.46Å; D311-K412 IonicContact OD2-NZ 3.79Å; D311-K412 PolarHBondContact OD2-NZ 2.87Å
312	Y	97.6	Very high	79.4	Confident	39 Å²	39	83.7 Å²	83.7	15%	0.153	45%	0.445	C	S	.	.	B	Isolated β-bridge	trans	-112.6	132	-173.2	-60.6	-91.1	0	0	0	112.1	D310 W314 P319 V331 L410 H444 I448	D310-Y312 PolarHBondContact OD1-N 3.06Å; Y312-W314 PolarHBondContact O-N 2.86Å; Y312-P319 HydrophobicContact CD1-CB 4.34Å; Y312-P319 HydrophobicContact CE1-CB 4.25Å; Y312-P319 HydrophobicContact CE1-CG 4.27Å; Y312-V331 VanDerWaalsContact O-CG2 3.26Å; Y312-V331 WeakPolarHBondContact O-CG2 3.32Å; Y312-L410 WeakPolarHBondContact CE2-O 3.44Å; Y312-L410 WeakPolarHBondContact OH-CD2 3.43Å; Y312-H444 PolarHBondContact O-CE1 3.34Å; Y312-I448 VanDerWaalsContact CB-CD1 3.48Å; Y312-I448 HydrophobicContact CD1-CD1 4.17Å; Y312-I448 HydrophobicContact CD1-CG1 3.92Å; Y312-I448 HydrophobicContact CD1-CG2 4.01Å; Y312-I448 HydrophobicContact CD2-CD1 3.83Å; Y312-I448 HydrophobicContact CD2-CG1 4.36Å; Y312-I448 HydrophobicContact CD2-CG2 4.05Å; Y312-I448 HydrophobicContact CE1-CG2 3.81Å; Y312-I448 HydrophobicContact CE2-CG2 3.86Å; Y312-I448 HydrophobicContact CG-CD1 3.55Å; Y312-I448 HydrophobicContact CG-CG1 3.84Å; Y312-I448 HydrophobicContact CG-CG2 4.15Å
313	C	97.7	Very high	82.7	Confident	0 Å²	0	80.2 Å²	80.2	0%	0	42%	0.419	C	S	.	.	B	Isolated β-bridge	trans	-64.6	125.3	179.3	170.1	0	0	0	0	112.3	I315 C316 H317 K318 V322 V331 H333 H444	C313-I315 PolarHBondContact O-N 2.88Å; C313-I315 PolarHBondContact SG-N 3.04Å; C313-C316 PolarHBondContact O-N 3.04Å; C313-H317 WeakPolarHBondContact O-CA 3.11Å; C313-H317 PolarHBondContact O-N 2.97Å; C313-K318 PolarHBondContact N-O 3.12Å; C313-V322 HydrophobicContact CB-CG1 4.43Å; C313-V331 WeakPolarHBondContact CA-O 3.44Å; C313-H333 WeakPolarHBondContact CB-CE1 3.31Å; C313-H333 WeakPolarHBondContact CB-ND1 3.35Å; C313-H333 PolarHBondContact SG-N 2.98Å; C313-H333 VanDerWaalsContact SG-N 3.41Å; C313-H444 PolarHBondContact O-CE1 3.02Å
314	W	97.1	Very high	85.9	Confident	20 Å²	20	77 Å²	77	8%	0.076	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-24.4	180	-167.6	-110.1	0	0	0	115.6	Y312 H317 R330 V331 F332 E350 R440 W441 H444	Y312-W314 PolarHBondContact O-N 2.86Å; W314-H317 PolarHBondContact O-CE1 3.26Å; W314-R330 HydrophobicContact CD2-CB 4.37Å; W314-R330 HydrophobicContact CD2-CG 3.93Å; W314-R330 HydrophobicContact CE3-CB 4.38Å; W314-R330 HydrophobicContact CE3-CG 3.76Å; W314-R330 HydrophobicContact CG-CB 4.46Å; W314-R330 HydrophobicContact CG-CG 4.49Å; W314-R330 HydrophobicContact CH2-CG 4.39Å; W314-R330 VanDerWaalsContact CH2-NE 3.32Å; W314-R330 HydrophobicContact CZ3-CG 4.02Å; W314-V331 PolarHBondContact N-O 3.25Å; W314-F332 HydrophobicContact CB-CD1 4.1Å; W314-F332 HydrophobicContact CB-CE1 3.66Å; W314-F332 HydrophobicContact CB-CE2 4.22Å; W314-F332 HydrophobicContact CB-CZ 3.7Å; W314-F332 AromaticContact CD1-CE1 3.8Å; W314-F332 AromaticContact CD1-CZ 3.74Å; W314-F332 HydrophobicContact CG-CE1 4.06Å; W314-F332 AromaticContact CG-CZ 3.89Å; W314-F332 HydrophobicContact CG-CZ 3.89Å; W314-E350 PolarHBondContact NE1-OE1 3.2Å; W314-R440 HydrophobicContact CH2-CB 3.91Å; W314-R440 HydrophobicContact CZ2-CB 3.54Å; W314-W441 HydrophobicContact CE3-CH2 4.32Å; W314-W441 HydrophobicContact CE3-CZ2 4.34Å; W314-W441 HydrophobicContact CE3-CZ3 4.49Å; W314-W441 AromaticContact CH2-CD1 3.8Å; W314-W441 AromaticContact CH2-CD2 3.8Å; W314-W441 HydrophobicContact CH2-CD2 3.8Å; W314-W441 AromaticContact CH2-CE2 3.74Å; W314-W441 HydrophobicContact CH2-CE3 4.46Å; W314-W441 AromaticContact CH2-CG 3.81Å; W314-W441 HydrophobicContact CH2-CG 3.81Å; W314-W441 HydrophobicContact CH2-CZ2 4.3Å; W314-W441 AromaticContact CH2-NE1 3.77Å; W314-W441 AromaticContact CZ3-CD2 3.46Å; W314-W441 HydrophobicContact CZ3-CD2 3.46Å; W314-W441 VanDerWaalsContact CZ3-CD2 3.46Å; W314-W441 AromaticContact CZ3-CE2 3.45Å; W314-W441 VanDerWaalsContact CZ3-CE2 3.45Å; W314-W441 AromaticContact CZ3-CE3 3.71Å; W314-W441 HydrophobicContact CZ3-CE3 3.71Å; W314-W441 AromaticContact CZ3-CG 3.97Å; W314-W441 HydrophobicContact CZ3-CG 3.97Å; W314-W441 AromaticContact CZ3-CH2 3.87Å; W314-W441 HydrophobicContact CZ3-CH2 3.87Å; W314-W441 AromaticContact CZ3-CZ2 3.67Å; W314-W441 HydrophobicContact CZ3-CZ2 3.67Å; W314-W441 AromaticContact CZ3-CZ3 3.9Å; W314-W441 HydrophobicContact CZ3-CZ3 3.9Å; W314-W441 AromaticContact CZ3-NE1 3.99Å; W314-H444 WeakPolarHBondContact CA-CE1 3.32Å; W314-H444 HydrophobicContact CE3-CB 4.49Å; W314-H444 AromaticContact CE3-CG 3.94Å; W314-H444 AromaticContact CE3-ND1 3.81Å; W314-H444 HydrophobicContact CZ3-CB 4.16Å; W314-H444 AromaticContact CZ3-CD2 3.99Å; W314-H444 AromaticContact CZ3-CG 3.94Å; W314-H444 PolarHBondContact N-CE1 3.34Å
315	I	94.8	Very high	89.2	Confident	76 Å²	76	69.1 Å²	69.1	39%	0.39	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-31.5	-175.5	-66.8	175.4	0	0	0	112.8	C313 F332 C336 L337	C313-I315 PolarHBondContact O-N 2.88Å; C313-I315 PolarHBondContact SG-N 3.04Å; I315-F332 HydrophobicContact CD1-CD1 3.7Å; I315-F332 HydrophobicContact CD1-CE1 4.03Å; I315-F332 HydrophobicContact CG1-CD1 3.89Å; I315-F332 HydrophobicContact CG1-CE1 3.98Å; I315-C336 HydrophobicContact CB-CB 4.05Å; I315-C336 HydrophobicContact CD1-CB 4.24Å; I315-C336 WeakPolarHBondContact CD1-O 3.4Å; I315-C336 HydrophobicContact CG2-CB 4.15Å; I315-L337 HydrophobicContact CD1-CD2 4.19Å
316	C	96.3	Very high	91.7	Very high	27 Å²	27	62.4 Å²	62.4	18%	0.182	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.3	-4.4	-173.5	77.5	0	0	0	0	114.8	C313 K318 H333 C336	C313-C316 PolarHBondContact O-N 3.04Å; C316-K318 PolarHBondContact O-N 2.91Å; C316-H333 PolarHBondContact SG-CE1 3.22Å; C316-H333 PolarHBondContact SG-ND1 3.1Å; C316-H333 VanDerWaalsContact SG-ND1 3.38Å; C316-C336 VanDerWaalsContact SG-SG 3.65Å
317	H	96.9	Very high	93.3	Very high	44 Å²	44	58.8 Å²	58.8	20%	0.204	31%	0.313	C	S	.	.			trans	59.1	25.7	176	-39.3	-66	0	0	0	114.3	C313 W314 H444 I447 I448	C313-H317 WeakPolarHBondContact O-CA 3.11Å; C313-H317 PolarHBondContact O-N 2.97Å; W314-H317 PolarHBondContact O-CE1 3.26Å; H317-H444 AromaticContact CE1-ND1 3.61Å; H317-H444 AromaticContact ND1-CG 3.68Å; H317-H444 AromaticContact ND1-ND1 2.9Å; H317-H444 PolarHBondContact ND1-ND1 3.25Å; H317-I447 HydrophobicContact CB-CB 4.13Å; H317-I447 HydrophobicContact CB-CG2 3.55Å; H317-I447 VanDerWaalsContact CD2-CD1 3.44Å; H317-I447 WeakPolarHBondContact CD2-CD1 2.98Å; H317-I448 HydrophobicContact CB-CG1 4.15Å
318	K	96.7	Very high	94.5	Very high	107 Å²	107	55 Å²	55	47%	0.465	30%	0.295	S	S	.	.			trans	-111.3	148.9	176.7	-61.6	164	-168.7	167	0	110	C313 C316 H333 E828	C313-K318 PolarHBondContact N-O 3.12Å; C316-K318 PolarHBondContact O-N 2.91Å; K318-H333 PolarHBondContact O-CE1 3.28Å; K318-H333 VanDerWaalsContact O-CE1 3.24Å; K318-E828 IonicContact NZ-OE1 3.25Å; K318-E828 PolarHBondContact NZ-OE1 3.2Å
319	P	96	Very high	94.9	Very high	81 Å²	81	50.5 Å²	50.5	53%	0.526	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	-72.7	172.7	170.6	33	-35.7	0	0	0	111.6	D311 Y312 H333	D311-P319 WeakPolarHBondContact O-CA 3.41Å; Y312-P319 HydrophobicContact CD1-CB 4.34Å; Y312-P319 HydrophobicContact CE1-CB 4.25Å; Y312-P319 HydrophobicContact CE1-CG 4.27Å; P319-H333 PolarHBondContact O-NE2 3.18Å
320	G	93.6	Very high	95.1	Very high	51 Å²	51	50.1 Å²	50.1	53%	0.526	27%	0.269	S	S	.	.	S	Bend	trans	149.1	-160.7	172.3	0	0	0	0	0	112.9	V322	G320-V322 PolarHBondContact O-N 3.05Å
321	E	93.4	Very high	95.2	Very high	184 Å²	184	49.9 Å²	49.9	86%	0.86	27%	0.268	S	S	*	.	S	Bend	trans	-73.9	117.7	172.7	-176.9	173.4	-153.2	0	0	110.4	H333	E321-H333 PolarHBondContact O-CD2 3.46Å; E321-H333 VanDerWaalsContact O-CD2 3.26Å
322	V	94.1	Very high	95.3	Very high	41 Å²	41	46.4 Å²	46.4	25%	0.248	25%	0.249	C	C	.	.			trans	-133.1	139.5	-167.6	-68.2	0	0	0	0	113.2	C313 G320 V331 F332	C313-V322 HydrophobicContact CB-CG1 4.43Å; G320-V322 PolarHBondContact O-N 3.05Å; V322-V331 HydrophobicContact CB-CB 3.86Å; V322-V331 HydrophobicContact CB-CG2 3.99Å; V322-V331 HydrophobicContact CG1-CB 4.46Å; V322-V331 HydrophobicContact CG1-CG2 4.08Å; V322-V331 HydrophobicContact CG2-CB 3.76Å; V322-V331 HydrophobicContact CG2-CG1 4.29Å; V322-V331 HydrophobicContact CG2-CG2 3.81Å; V322-F332 CarbonylContact C-O 3.51Å; V322-F332 WeakPolarHBondContact CA-O 3.3Å
323	V	93.6	Very high	95.2	Very high	29 Å²	29	46 Å²	46	18%	0.176	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	130	168.7	-172.9	0	0	0	0	108.6	V331 F332 A334 F342 W346	V323-V331 CarbonylContact O-C 3.55Å; V323-V331 WeakPolarHBondContact O-CA 3.29Å; V323-F332 PolarHBondContact N-O 3.38Å; V323-F332 PolarHBondContact O-N 2.97Å; V323-A334 HydrophobicContact CG2-CB 4.35Å; V323-F342 HydrophobicContact CG1-CB 4.35Å; V323-F342 HydrophobicContact CG1-CD1 3.92Å; V323-F342 HydrophobicContact CG1-CD2 4.26Å; V323-F342 HydrophobicContact CG1-CE1 4.3Å; V323-F342 HydrophobicContact CG1-CG 3.9Å; V323-F342 HydrophobicContact CG2-CD2 3.81Å; V323-F342 HydrophobicContact CG2-CE1 4.39Å; V323-F342 HydrophobicContact CG2-CE2 3.61Å; V323-F342 HydrophobicContact CG2-CG 4.29Å; V323-F342 HydrophobicContact CG2-CZ 3.92Å; V323-W346 HydrophobicContact CG1-CD2 4.19Å; V323-W346 HydrophobicContact CG1-CE3 3.72Å; V323-W346 HydrophobicContact CG1-CZ3 4Å
324	I	94.3	Very high	95	Very high	88 Å²	88	47.7 Å²	47.7	45%	0.451	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	133.8	-176.3	-60.5	170.6	0	0	0	109.6	S309 V331	S309-I324 VanDerWaalsContact OG-CG2 3.25Å; S309-I324 WeakPolarHBondContact OG-CG2 3.22Å; I324-V331 HydrophobicContact CB-CG1 4.48Å; I324-V331 HydrophobicContact CG1-CG1 3.94Å
325	C	95.3	Very high	94.9	Very high	5 Å²	5	53.4 Å²	53.4	3%	0.034	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-71.7	128.5	171.5	-178.5	0	0	0	0	111.1	Y327 C328 R330 W346 C348 C351	C325-Y327 PolarHBondContact O-N 2.87Å; C325-C328 WeakPolarHBondContact CB-O 3.24Å; C325-C328 VanDerWaalsContact O-O 3.09Å; C325-R330 WeakPolarHBondContact CB-O 3.42Å; C325-R330 PolarHBondContact N-O 3.13Å; C325-W346 HydrophobicContact CB-CZ3 4.32Å; C325-C348 HydrophobicContact CB-CB 3.82Å; C325-C348 PolarHBondContact SG-N 2.7Å; C325-C348 VanDerWaalsContact SG-N 3.39Å; C325-C351 VanDerWaalsContact SG-SG 3.7Å
326	S	93	Very high	94.8	Very high	49 Å²	49	50.6 Å²	50.6	34%	0.343	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-3.6	-179.1	-46.6	0	0	0	0	114.6	I345 W346	S326-I345 WeakPolarHBondContact OG-CA 3.5Å; S326-W346 PolarHBondContact N-O 3.15Å; S326-W346 PolarHBondContact OG-N 3.22Å; S326-W346 PolarHBondContact OG-O 3.05Å
327	Y	89	Confident	94.6	Very high	80 Å²	80	50.3 Å²	50.3	31%	0.314	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.1	-9.8	-171.5	-73.3	-97.6	0	0	0	115	C325 I345 L347	C325-Y327 PolarHBondContact O-N 2.87Å; Y327-I345 HydrophobicContact CE2-CG2 3.84Å; Y327-L347 HydrophobicContact CD1-CD2 4.39Å; Y327-L347 HydrophobicContact CD2-CD2 3.34Å; Y327-L347 HydrophobicContact CD2-CG 3.94Å; Y327-L347 HydrophobicContact CE2-CD2 3.86Å; Y327-L347 HydrophobicContact CE2-CG 4.1Å; Y327-L347 HydrophobicContact CG-CD2 3.65Å
328	C	94.3	Very high	94.2	Very high	13 Å²	13	49 Å²	49	9%	0.088	27%	0.273	C	S	.	.	S	Bend	trans	-154	160.2	177.7	82.8	0	0	0	0	110.3	C325 R330 C351	C325-C328 WeakPolarHBondContact CB-O 3.24Å; C325-C328 VanDerWaalsContact O-O 3.09Å; C328-R330 PolarHBondContact O-N 2.9Å; C328-R330 VanDerWaalsContact O-N 3.07Å; C328-R330 PolarHBondContact SG-NH1 3.26Å; C328-R330 VanDerWaalsContact SG-NH1 3.41Å; C328-C351 PolarHBondContact SG-SG 2.75Å
329	P	95.9	Very high	93.7	Very high	17 Å²	17	46 Å²	46	11%	0.11	27%	0.268	C	S	.	.	S	Bend	trans	-70.4	-4	-175.3	29.4	-37.4	0	0	0	115.1	I307 E308 D310 Y413 W441	I307-P329 HydrophobicContact CG2-CB 3.97Å; I307-P329 HydrophobicContact CG2-CG 4.45Å; E308-P329 WeakPolarHBondContact O-CB 3.48Å; D310-P329 WeakPolarHBondContact CB-O 3.48Å; D310-P329 PolarHBondContact N-O 3.32Å; P329-Y413 HydrophobicContact CB-CD2 3.89Å; P329-Y413 HydrophobicContact CB-CE1 4.25Å; P329-Y413 HydrophobicContact CB-CE2 3.25Å; P329-Y413 VanDerWaalsContact CB-CZ 3.48Å; P329-Y413 HydrophobicContact CG-CD1 4.11Å; P329-Y413 HydrophobicContact CG-CD2 3.93Å; P329-Y413 HydrophobicContact CG-CE1 3.79Å; P329-Y413 HydrophobicContact CG-CE2 3.61Å; P329-Y413 HydrophobicContact CG-CG 4.19Å; P329-W441 HydrophobicContact CG-CZ2 4.01Å
330	R	96.8	Very high	93	Very high	20 Å²	20	47.8 Å²	47.8	8%	0.075	28%	0.277	C	S	.	.			trans	-69.6	131.6	-176.9	-59.6	175	-176.8	87	6.2	111.1	W314 C325 C328 F332 G437 W441	W314-R330 HydrophobicContact CD2-CB 4.37Å; W314-R330 HydrophobicContact CD2-CG 3.93Å; W314-R330 HydrophobicContact CE3-CB 4.38Å; W314-R330 HydrophobicContact CE3-CG 3.76Å; W314-R330 HydrophobicContact CG-CB 4.46Å; W314-R330 HydrophobicContact CG-CG 4.49Å; W314-R330 HydrophobicContact CH2-CG 4.39Å; W314-R330 VanDerWaalsContact CH2-NE 3.32Å; W314-R330 HydrophobicContact CZ3-CG 4.02Å; C325-R330 WeakPolarHBondContact CB-O 3.42Å; C325-R330 PolarHBondContact N-O 3.13Å; C328-R330 PolarHBondContact O-N 2.9Å; C328-R330 VanDerWaalsContact O-N 3.07Å; C328-R330 PolarHBondContact SG-NH1 3.26Å; C328-R330 VanDerWaalsContact SG-NH1 3.41Å; R330-F332 HydrophobicContact CB-CE2 3.8Å; R330-F332 HydrophobicContact CB-CZ 4.29Å; R330-G437 PolarHBondContact NH2-O 3.4Å; R330-W441 HydrophobicContact CG-CH2 4.33Å; R330-W441 HydrophobicContact CG-CZ2 3.7Å
331	V	97	Very high	92.6	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	158.6	179.1	-54.6	0	0	0	0	111.9	D310 Y312 C313 W314 V322 V323 I324	D310-V331 HydrophobicContact CB-CG2 4.36Å; D310-V331 WeakPolarHBondContact O-CG1 3.35Å; D310-V331 WeakPolarHBondContact O-CG2 3.21Å; Y312-V331 VanDerWaalsContact O-CG2 3.26Å; Y312-V331 WeakPolarHBondContact O-CG2 3.32Å; C313-V331 WeakPolarHBondContact CA-O 3.44Å; W314-V331 PolarHBondContact N-O 3.25Å; V322-V331 HydrophobicContact CB-CB 3.86Å; V322-V331 HydrophobicContact CB-CG2 3.99Å; V322-V331 HydrophobicContact CG1-CB 4.46Å; V322-V331 HydrophobicContact CG1-CG2 4.08Å; V322-V331 HydrophobicContact CG2-CB 3.76Å; V322-V331 HydrophobicContact CG2-CG1 4.29Å; V322-V331 HydrophobicContact CG2-CG2 3.81Å; V323-V331 CarbonylContact O-C 3.55Å; V323-V331 WeakPolarHBondContact O-CA 3.29Å; I324-V331 HydrophobicContact CB-CG1 4.48Å; I324-V331 HydrophobicContact CG1-CG1 3.94Å
332	F	97.4	Very high	92.2	Very high	3 Å²	3	45.9 Å²	45.9	1%	0.013	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	129.4	-170.6	-62.7	-103.1	0	0	0	111.6	W314 I315 V322 V323 R330 A334 L337 W346 C348	W314-F332 HydrophobicContact CB-CD1 4.1Å; W314-F332 HydrophobicContact CB-CE1 3.66Å; W314-F332 HydrophobicContact CB-CE2 4.22Å; W314-F332 HydrophobicContact CB-CZ 3.7Å; W314-F332 AromaticContact CD1-CE1 3.8Å; W314-F332 AromaticContact CD1-CZ 3.74Å; W314-F332 HydrophobicContact CG-CE1 4.06Å; W314-F332 AromaticContact CG-CZ 3.89Å; W314-F332 HydrophobicContact CG-CZ 3.89Å; I315-F332 HydrophobicContact CD1-CD1 3.7Å; I315-F332 HydrophobicContact CD1-CE1 4.03Å; I315-F332 HydrophobicContact CG1-CD1 3.89Å; I315-F332 HydrophobicContact CG1-CE1 3.98Å; V322-F332 CarbonylContact C-O 3.51Å; V322-F332 WeakPolarHBondContact CA-O 3.3Å; V323-F332 PolarHBondContact N-O 3.38Å; V323-F332 PolarHBondContact O-N 2.97Å; R330-F332 HydrophobicContact CB-CE2 3.8Å; R330-F332 HydrophobicContact CB-CZ 4.29Å; F332-A334 PolarHBondContact O-N 2.93Å; F332-L337 HydrophobicContact CB-CD1 3.54Å; F332-L337 HydrophobicContact CB-CD2 4.22Å; F332-L337 HydrophobicContact CB-CG 3.73Å; F332-L337 HydrophobicContact CD1-CD2 3.7Å; F332-L337 HydrophobicContact CD1-CG 4.13Å; F332-L337 HydrophobicContact CE1-CD2 4.34Å; F332-L337 HydrophobicContact CG-CD1 4.11Å; F332-L337 HydrophobicContact CG-CD2 4.11Å; F332-L337 HydrophobicContact CG-CG 4.18Å; F332-W346 HydrophobicContact CB-CH2 4.46Å; F332-W346 AromaticContact CD2-CH2 3.71Å; F332-W346 HydrophobicContact CD2-CH2 3.71Å; F332-W346 AromaticContact CD2-CZ3 3.85Å; F332-W346 HydrophobicContact CD2-CZ3 3.85Å; F332-W346 HydrophobicContact CE2-CH2 4.15Å; F332-W346 HydrophobicContact CE2-CZ3 4.34Å; F332-W346 HydrophobicContact CG-CH2 4.08Å; F332-C348 HydrophobicContact CD2-CB 4.1Å; F332-C348 HydrophobicContact CE2-CB 3.32Å; F332-C348 HydrophobicContact CZ-CB 3.7Å
333	H	96.2	Very high	91.9	Very high	30 Å²	30	48 Å²	48	14%	0.139	27%	0.273	C	S	.	.			trans	-62.1	140.1	167.1	-53.3	107.2	0	0	0	109.3	C313 C316 K318 P319 E321 I335 C336 L337	C313-H333 WeakPolarHBondContact CB-CE1 3.31Å; C313-H333 WeakPolarHBondContact CB-ND1 3.35Å; C313-H333 PolarHBondContact SG-N 2.98Å; C313-H333 VanDerWaalsContact SG-N 3.41Å; C316-H333 PolarHBondContact SG-CE1 3.22Å; C316-H333 PolarHBondContact SG-ND1 3.1Å; C316-H333 VanDerWaalsContact SG-ND1 3.38Å; K318-H333 PolarHBondContact O-CE1 3.28Å; K318-H333 VanDerWaalsContact O-CE1 3.24Å; P319-H333 PolarHBondContact O-NE2 3.18Å; E321-H333 PolarHBondContact O-CD2 3.46Å; E321-H333 VanDerWaalsContact O-CD2 3.26Å; H333-I335 PolarHBondContact O-N 3.3Å; H333-C336 HydrophobicContact CB-CB 4Å; H333-C336 PolarHBondContact ND1-SG 3.3Å; H333-C336 VanDerWaalsContact ND1-SG 3.43Å; H333-C336 WeakPolarHBondContact O-CA 3.37Å; H333-C336 WeakPolarHBondContact O-CB 3.26Å; H333-C336 PolarHBondContact O-N 2.94Å; H333-L337 PolarHBondContact O-N 3.33Å
334	A	94	Very high	91.3	Very high	36 Å²	36	54.4 Å²	54.4	30%	0.298	31%	0.306	S	S	.	.	H	α-helix	trans	-51.8	-41.4	173	0	0	0	0	0	111.4	V323 F332 C336 L337 C338 A339 F342	V323-A334 HydrophobicContact CG2-CB 4.35Å; F332-A334 PolarHBondContact O-N 2.93Å; A334-C336 PolarHBondContact O-N 3.39Å; A334-L337 CarbonylContact O-C 3.56Å; A334-L337 PolarHBondContact O-N 3.45Å; A334-C338 WeakPolarHBondContact O-CA 3.4Å; A334-C338 PolarHBondContact O-N 2.92Å; A334-A339 PolarHBondContact O-N 3.11Å; A334-F342 HydrophobicContact CB-CE2 4.05Å; A334-F342 HydrophobicContact CB-CZ 4.48Å
335	I	93.4	Very high	91	Very high	141 Å²	141	54.6 Å²	54.6	72%	0.723	31%	0.307	S	S	*	.	H	α-helix	trans	-66.1	-33.6	175.1	-56.9	173.5	0	0	0	112.5	H333 L337 C338	H333-I335 PolarHBondContact O-N 3.3Å; I335-L337 VanDerWaalsContact C-N 3.3Å; I335-L337 PolarHBondContact O-N 3.41Å; I335-C338 PolarHBondContact O-N 3.45Å; I335-C338 PolarHBondContact O-SG 2.81Å
336	C	93.6	Very high	90.8	Very high	17 Å²	17	56.1 Å²	56.1	12%	0.115	31%	0.312	C	S	.	.	H	α-helix	trans	-71.6	-27.9	175.3	-72.7	0	0	0	0	112.1	I315 C316 H333 A334 R839	I315-C336 HydrophobicContact CB-CB 4.05Å; I315-C336 HydrophobicContact CD1-CB 4.24Å; I315-C336 WeakPolarHBondContact CD1-O 3.4Å; I315-C336 HydrophobicContact CG2-CB 4.15Å; C316-C336 VanDerWaalsContact SG-SG 3.65Å; H333-C336 HydrophobicContact CB-CB 4Å; H333-C336 PolarHBondContact ND1-SG 3.3Å; H333-C336 VanDerWaalsContact ND1-SG 3.43Å; H333-C336 WeakPolarHBondContact O-CA 3.37Å; H333-C336 WeakPolarHBondContact O-CB 3.26Å; H333-C336 PolarHBondContact O-N 2.94Å; A334-C336 PolarHBondContact O-N 3.39Å; C336-R839 VanDerWaalsContact O-CZ 3.28Å; C336-R839 PolarHBondContact O-NH1 3Å; C336-R839 PolarHBondContact O-NH2 3.03Å
337	L	91.2	Very high	90.7	Very high	20 Å²	20	56.2 Å²	56.2	11%	0.105	31%	0.309	C	S	.	.	H	α-helix	trans	-84.5	-15.6	168.9	-68.5	170.8	0	0	0	113.9	I315 F332 H333 A334 I335 A339 F342 W346 P349 R839	I315-L337 HydrophobicContact CD1-CD2 4.19Å; F332-L337 HydrophobicContact CB-CD1 3.54Å; F332-L337 HydrophobicContact CB-CD2 4.22Å; F332-L337 HydrophobicContact CB-CG 3.73Å; F332-L337 HydrophobicContact CD1-CD2 3.7Å; F332-L337 HydrophobicContact CD1-CG 4.13Å; F332-L337 HydrophobicContact CE1-CD2 4.34Å; F332-L337 HydrophobicContact CG-CD1 4.11Å; F332-L337 HydrophobicContact CG-CD2 4.11Å; F332-L337 HydrophobicContact CG-CG 4.18Å; H333-L337 PolarHBondContact O-N 3.33Å; A334-L337 CarbonylContact O-C 3.56Å; A334-L337 PolarHBondContact O-N 3.45Å; I335-L337 VanDerWaalsContact C-N 3.3Å; I335-L337 PolarHBondContact O-N 3.41Å; L337-A339 VanDerWaalsContact C-N 3.26Å; L337-A339 PolarHBondContact O-N 2.85Å; L337-F342 HydrophobicContact CB-CZ 4.29Å; L337-F342 HydrophobicContact CD1-CE1 3.62Å; L337-F342 HydrophobicContact CD1-CZ 3.82Å; L337-W346 HydrophobicContact CD1-CH2 3.45Å; L337-W346 VanDerWaalsContact CD1-CH2 3.45Å; L337-W346 HydrophobicContact CD1-CZ2 3.5Å; L337-W346 HydrophobicContact CD1-CZ3 4.36Å; L337-W346 HydrophobicContact CD2-CH2 4.19Å; L337-W346 HydrophobicContact CD2-CZ2 4.13Å; L337-W346 HydrophobicContact CG-CH2 4.46Å; L337-W346 HydrophobicContact CG-CZ2 4.48Å; L337-P349 HydrophobicContact CD2-CG 4.36Å; L337-R839 VanDerWaalsContact CA-NH1 3.31Å; L337-R839 WeakPolarHBondContact O-CD 3.25Å; L337-R839 VanDerWaalsContact O-CZ 3.28Å; L337-R839 PolarHBondContact O-NE 2.86Å; L337-R839 PolarHBondContact O-NH1 3.25Å
338	C	89.4	Confident	91	Very high	17 Å²	17	52.4 Å²	52.4	12%	0.115	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	15.5	69.9	-149.8	-8.9	0	0	0	0	113.9	A334 I335 R839 N840	A334-C338 WeakPolarHBondContact O-CA 3.4Å; A334-C338 PolarHBondContact O-N 2.92Å; I335-C338 PolarHBondContact O-N 3.45Å; I335-C338 PolarHBondContact O-SG 2.81Å; C338-R839 HydrophobicContact CB-CB 3.51Å; C338-R839 HydrophobicContact CB-CG 4.42Å; C338-R839 WeakPolarHBondContact O-CB 3.19Å; C338-R839 PolarHBondContact SG-NE 3.48Å; C338-R839 PolarHBondContact SG-NH2 3.49Å; C338-N840 WeakPolarHBondContact CB-OD1 3.12Å
339	A	85.5	Confident	90.8	Very high	44 Å²	44	53.8 Å²	53.8	36%	0.364	30%	0.303	S	S	.	.			trans	-127	147.6	150.6	0	0	0	0	0	106.3	A334 L337 F342	A334-A339 PolarHBondContact O-N 3.11Å; L337-A339 VanDerWaalsContact C-N 3.26Å; L337-A339 PolarHBondContact O-N 2.85Å; A339-F342 HydrophobicContact CB-CE1 3.96Å; A339-F342 HydrophobicContact CB-CE2 4.36Å; A339-F342 HydrophobicContact CB-CZ 3.68Å; A339-F342 WeakPolarHBondContact O-CE2 3.37Å; A339-F342 VanDerWaalsContact O-CZ 3.25Å; A339-F342 WeakPolarHBondContact O-CZ 3.31Å
340	T	82.3	Confident	90.6	Very high	119 Å²	119	53.7 Å²	53.7	73%	0.73	30%	0.301	S	S	*	.	S	Bend	trans	-89.7	-38.7	175.4	36.1	0	0	0	0	111.4
341	D	85.2	Confident	90.4	Very high	137 Å²	137	53.7 Å²	53.7	73%	0.733	30%	0.303	S	S	*	.			trans	-110.8	131.1	-167.2	-52.8	-82.8	0	0	0	111
342	F	85.5	Confident	90	Very high	57 Å²	57	57.6 Å²	57.6	25%	0.25	32%	0.322	C	S	.	.			trans	-134.7	136.2	-175.5	-61	-86.2	0	0	0	110.3	V323 A334 L337 A339 W346	V323-F342 HydrophobicContact CG1-CB 4.35Å; V323-F342 HydrophobicContact CG1-CD1 3.92Å; V323-F342 HydrophobicContact CG1-CD2 4.26Å; V323-F342 HydrophobicContact CG1-CE1 4.3Å; V323-F342 HydrophobicContact CG1-CG 3.9Å; V323-F342 HydrophobicContact CG2-CD2 3.81Å; V323-F342 HydrophobicContact CG2-CE1 4.39Å; V323-F342 HydrophobicContact CG2-CE2 3.61Å; V323-F342 HydrophobicContact CG2-CG 4.29Å; V323-F342 HydrophobicContact CG2-CZ 3.92Å; A334-F342 HydrophobicContact CB-CE2 4.05Å; A334-F342 HydrophobicContact CB-CZ 4.48Å; L337-F342 HydrophobicContact CB-CZ 4.29Å; L337-F342 HydrophobicContact CD1-CE1 3.62Å; L337-F342 HydrophobicContact CD1-CZ 3.82Å; A339-F342 HydrophobicContact CB-CE1 3.96Å; A339-F342 HydrophobicContact CB-CE2 4.36Å; A339-F342 HydrophobicContact CB-CZ 3.68Å; A339-F342 WeakPolarHBondContact O-CE2 3.37Å; A339-F342 VanDerWaalsContact O-CZ 3.25Å; A339-F342 WeakPolarHBondContact O-CZ 3.31Å; F342-W346 AromaticContact CD1-CD1 3.89Å; F342-W346 HydrophobicContact CD1-CD2 4.18Å; F342-W346 AromaticContact CD1-CE2 3.97Å; F342-W346 HydrophobicContact CD1-CG 4.15Å; F342-W346 AromaticContact CD1-NE1 3.77Å; F342-W346 HydrophobicContact CE1-CZ2 4.36Å
343	P	86.6	Confident	89.5	Confident	85 Å²	85	59.1 Å²	59.1	55%	0.552	33%	0.33	S	S	*	.			trans	-74.4	152.8	175.4	31.4	-35.2	0	0	0	111.8	I345 W346	P343-I345 CarbonylContact O-C 3.49Å; P343-I345 PolarHBondContact O-N 3.26Å; P343-W346 HydrophobicContact CG-CB 4.34Å; P343-W346 PolarHBondContact O-N 3.07Å
344	D	82	Confident	89.1	Confident	165 Å²	165	59.2 Å²	59.2	88%	0.882	33%	0.332	S	S	*	.	S	Bend	trans	-47	-30.9	176.4	-61.3	-4.9	0	0	0	114.6
345	I	87.6	Confident	88.7	Confident	92 Å²	92	60.8 Å²	60.8	47%	0.472	34%	0.335	S	S	.	.	S	Bend	trans	-116.4	96.5	173.5	-56.3	178.6	0	0	0	107.4	S326 Y327 P343	S326-I345 WeakPolarHBondContact OG-CA 3.5Å; Y327-I345 HydrophobicContact CE2-CG2 3.84Å; P343-I345 CarbonylContact O-C 3.49Å; P343-I345 PolarHBondContact O-N 3.26Å
346	W	92	Very high	88.2	Confident	37 Å²	37	56.5 Å²	56.5	14%	0.14	31%	0.313	C	S	.	.			trans	-111.6	128.9	-179.3	-179.4	72.3	0	0	0	111.6	V323 C325 S326 F332 L337 F342 P343 C348	V323-W346 HydrophobicContact CG1-CD2 4.19Å; V323-W346 HydrophobicContact CG1-CE3 3.72Å; V323-W346 HydrophobicContact CG1-CZ3 4Å; C325-W346 HydrophobicContact CB-CZ3 4.32Å; S326-W346 PolarHBondContact N-O 3.15Å; S326-W346 PolarHBondContact OG-N 3.22Å; S326-W346 PolarHBondContact OG-O 3.05Å; F332-W346 HydrophobicContact CB-CH2 4.46Å; F332-W346 AromaticContact CD2-CH2 3.71Å; F332-W346 HydrophobicContact CD2-CH2 3.71Å; F332-W346 AromaticContact CD2-CZ3 3.85Å; F332-W346 HydrophobicContact CD2-CZ3 3.85Å; F332-W346 HydrophobicContact CE2-CH2 4.15Å; F332-W346 HydrophobicContact CE2-CZ3 4.34Å; F332-W346 HydrophobicContact CG-CH2 4.08Å; L337-W346 HydrophobicContact CD1-CH2 3.45Å; L337-W346 VanDerWaalsContact CD1-CH2 3.45Å; L337-W346 HydrophobicContact CD1-CZ2 3.5Å; L337-W346 HydrophobicContact CD1-CZ3 4.36Å; L337-W346 HydrophobicContact CD2-CH2 4.19Å; L337-W346 HydrophobicContact CD2-CZ2 4.13Å; L337-W346 HydrophobicContact CG-CH2 4.46Å; L337-W346 HydrophobicContact CG-CZ2 4.48Å; F342-W346 AromaticContact CD1-CD1 3.89Å; F342-W346 HydrophobicContact CD1-CD2 4.18Å; F342-W346 AromaticContact CD1-CE2 3.97Å; F342-W346 HydrophobicContact CD1-CG 4.15Å; F342-W346 AromaticContact CD1-NE1 3.77Å; F342-W346 HydrophobicContact CE1-CZ2 4.36Å; P343-W346 HydrophobicContact CG-CB 4.34Å; P343-W346 PolarHBondContact O-N 3.07Å; W346-C348 HydrophobicContact CE3-CB 4.4Å; W346-C348 VanDerWaalsContact CH2-CA 3.48Å; W346-C348 HydrophobicContact CH2-CB 3.43Å; W346-C348 VanDerWaalsContact CH2-CB 3.43Å; W346-C348 HydrophobicContact CZ2-CB 4.15Å; W346-C348 HydrophobicContact CZ3-CB 3.59Å
347	L	90.3	Very high	87.6	Confident	51 Å²	51	57.3 Å²	57.3	27%	0.267	32%	0.321	S	S	.	.			trans	-94.9	123.9	171.3	-79.8	162.6	0	0	0	108.9	Y327 C351 M355	Y327-L347 HydrophobicContact CD1-CD2 4.39Å; Y327-L347 HydrophobicContact CD2-CD2 3.34Å; Y327-L347 HydrophobicContact CD2-CG 3.94Å; Y327-L347 HydrophobicContact CE2-CD2 3.86Å; Y327-L347 HydrophobicContact CE2-CG 4.1Å; Y327-L347 HydrophobicContact CG-CD2 3.65Å; L347-C351 HydrophobicContact CD2-CB 3.75Å; L347-M355 HydrophobicContact CD1-CE 4.36Å; L347-M355 HydrophobicContact CD1-SD 4.25Å
348	C	94.1	Very high	87.3	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	34%	0.335	C	S	.	.			trans	-70.8	159.5	171.6	76	0	0	0	0	111.9	C325 F332 W346 E350 C351 Q352	C325-C348 HydrophobicContact CB-CB 3.82Å; C325-C348 PolarHBondContact SG-N 2.7Å; C325-C348 VanDerWaalsContact SG-N 3.39Å; F332-C348 HydrophobicContact CD2-CB 4.1Å; F332-C348 HydrophobicContact CE2-CB 3.32Å; F332-C348 HydrophobicContact CZ-CB 3.7Å; W346-C348 HydrophobicContact CE3-CB 4.4Å; W346-C348 VanDerWaalsContact CH2-CA 3.48Å; W346-C348 HydrophobicContact CH2-CB 3.43Å; W346-C348 VanDerWaalsContact CH2-CB 3.43Å; W346-C348 HydrophobicContact CZ2-CB 4.15Å; W346-C348 HydrophobicContact CZ3-CB 3.59Å; C348-E350 VanDerWaalsContact C-N 3.26Å; C348-E350 PolarHBondContact O-N 3.24Å; C348-E350 VanDerWaalsContact O-N 3.17Å; C348-C351 PolarHBondContact O-N 3.02Å; C348-Q352 PolarHBondContact O-N 3.48Å
349	P	91.2	Very high	86.7	Confident	42 Å²	42	60.7 Å²	60.7	27%	0.273	34%	0.336	S	S	.	.	H	α-helix	trans	-54.6	-37.9	-176.9	-28.5	36.2	0	0	0	114.1	L337 Q352 D353	L337-P349 HydrophobicContact CD2-CG 4.36Å; P349-Q352 PolarHBondContact O-N 3.44Å; P349-D353 WeakPolarHBondContact O-CB 3.49Å; P349-D353 PolarHBondContact O-N 3.1Å
350	E	91	Very high	86.3	Confident	15 Å²	15	62.7 Å²	62.7	7%	0.07	35%	0.348	C	S	.	.	H	α-helix	trans	-63.5	-43	177.2	-58.6	-74.1	-165.1	0	0	111.6	W314 C348 D353 V354 R440	W314-E350 PolarHBondContact NE1-OE1 3.2Å; C348-E350 VanDerWaalsContact C-N 3.26Å; C348-E350 PolarHBondContact O-N 3.24Å; C348-E350 VanDerWaalsContact O-N 3.17Å; E350-D353 PolarHBondContact O-N 3.27Å; E350-V354 VanDerWaalsContact O-CG2 3.3Å; E350-V354 WeakPolarHBondContact O-CG2 3.48Å; E350-V354 PolarHBondContact O-N 2.81Å; E350-R440 VanDerWaalsContact CD-NH1 3.33Å; E350-R440 WeakPolarHBondContact OE1-CD 3.48Å; E350-R440 IonicContact OE1-CZ 2.76Å; E350-R440 IonicContact OE1-NE 3.4Å; E350-R440 IonicContact OE1-NH1 2.76Å; E350-R440 PolarHBondContact OE1-NH1 2.77Å; E350-R440 IonicContact OE2-NH1 2.69Å; E350-R440 PolarHBondContact OE2-NH1 3.23Å; E350-R440 VanDerWaalsContact OE2-NH1 3.11Å
351	C	92.8	Very high	85.4	Confident	19 Å²	19	59.4 Å²	59.4	13%	0.128	33%	0.325	C	S	.	.	H	α-helix	trans	-69.2	-34.3	176.4	-71.8	0	0	0	0	112.4	C325 C328 L347 C348 M355	C325-C351 VanDerWaalsContact SG-SG 3.7Å; C328-C351 PolarHBondContact SG-SG 2.75Å; L347-C351 HydrophobicContact CD2-CB 3.75Å; C348-C351 PolarHBondContact O-N 3.02Å; C351-M355 WeakPolarHBondContact O-CB 3.33Å; C351-M355 PolarHBondContact O-N 3.44Å
352	Q	89.4	Confident	84.6	Confident	83 Å²	83	56.3 Å²	56.3	39%	0.388	30%	0.304	S	S	.	.	H	α-helix	trans	-65.8	-46.1	173.7	-176.2	176.5	1.9	0	0	111.2	C348 P349 V354 M355 L356	C348-Q352 PolarHBondContact O-N 3.48Å; P349-Q352 PolarHBondContact O-N 3.44Å; Q352-V354 VanDerWaalsContact C-N 3.34Å; Q352-V354 PolarHBondContact O-N 3.17Å; Q352-M355 PolarHBondContact O-N 3.23Å; Q352-L356 HydrophobicContact CG-CD1 4.22Å; Q352-L356 WeakPolarHBondContact O-CG 3.18Å; Q352-L356 PolarHBondContact O-N 2.84Å
353	D	86.8	Confident	83.8	Confident	35 Å²	35	57 Å²	57	19%	0.187	31%	0.308	C	S	.	.	H	α-helix	trans	-62.2	-39.9	176.7	-76.1	-26.7	0	0	0	110.9	N203 P349 E350 L356 A357 Q433	N203-D353 PolarHBondContact ND2-OD2 3.16Å; P349-D353 WeakPolarHBondContact O-CB 3.49Å; P349-D353 PolarHBondContact O-N 3.1Å; E350-D353 PolarHBondContact O-N 3.27Å; D353-L356 PolarHBondContact O-N 2.92Å; D353-A357 WeakPolarHBondContact O-CB 3.4Å; D353-A357 PolarHBondContact O-N 2.97Å; D353-Q433 HydrophobicContact CB-CG 3.88Å
354	V	87.7	Confident	82.9	Confident	31 Å²	31	57.3 Å²	57.3	19%	0.188	30%	0.304	C	S	.	.	H	α-helix	trans	-62.5	-50	173.8	171.3	0	0	0	0	111.3	E350 Q352 L356 A357 E358 Q433 A434	E350-V354 VanDerWaalsContact O-CG2 3.3Å; E350-V354 WeakPolarHBondContact O-CG2 3.48Å; E350-V354 PolarHBondContact O-N 2.81Å; Q352-V354 VanDerWaalsContact C-N 3.34Å; Q352-V354 PolarHBondContact O-N 3.17Å; V354-L356 VanDerWaalsContact C-N 3.26Å; V354-L356 PolarHBondContact O-N 3.13Å; V354-A357 PolarHBondContact O-N 3.15Å; V354-A357 VanDerWaalsContact O-N 3.1Å; V354-E358 PolarHBondContact O-N 3.15Å; V354-Q433 HydrophobicContact CB-CG 4.38Å; V354-Q433 HydrophobicContact CG2-CB 4.19Å; V354-Q433 HydrophobicContact CG2-CG 3.71Å; V354-A434 HydrophobicContact CG1-CB 4.48Å
355	M	85.9	Confident	82.3	Confident	70 Å²	70	54.3 Å²	54.3	35%	0.345	29%	0.285	S	S	.	.	H	α-helix	trans	-60	-35.6	-179.6	-175	-175	70.7	0	0	112.3	L56 L347 C351 Q352 C359	L56-M355 HydrophobicContact CD1-CE 4.27Å; L347-M355 HydrophobicContact CD1-CE 4.36Å; L347-M355 HydrophobicContact CD1-SD 4.25Å; C351-M355 WeakPolarHBondContact O-CB 3.33Å; C351-M355 PolarHBondContact O-N 3.44Å; Q352-M355 PolarHBondContact O-N 3.23Å; M355-C359 WeakPolarHBondContact O-CB 3.4Å; M355-C359 PolarHBondContact O-N 3.1Å
356	L	82.4	Confident	81.6	Confident	50 Å²	50	52.2 Å²	52.2	26%	0.262	28%	0.279	S	S	.	.	H	α-helix	trans	-71.9	-40.6	174.3	-70.6	171.1	0	0	0	112.1	Q352 D353 V354 E358 C359 Y362	Q352-L356 HydrophobicContact CG-CD1 4.22Å; Q352-L356 WeakPolarHBondContact O-CG 3.18Å; Q352-L356 PolarHBondContact O-N 2.84Å; D353-L356 PolarHBondContact O-N 2.92Å; V354-L356 VanDerWaalsContact C-N 3.26Å; V354-L356 PolarHBondContact O-N 3.13Å; L356-E358 VanDerWaalsContact C-N 3.32Å; L356-E358 PolarHBondContact O-N 2.86Å; L356-C359 PolarHBondContact O-N 3Å; L356-Y362 HydrophobicContact CD2-CD2 3.86Å; L356-Y362 HydrophobicContact CD2-CE2 4.21Å; L356-Y362 HydrophobicContact CD2-CG 4.18Å
357	A	81.6	Confident	81.1	Confident	34 Å²	34	51.9 Å²	51.9	28%	0.281	28%	0.277	S	S	.	.	H	α-helix	trans	-68.1	-28.3	178.8	0	0	0	0	0	113.7	D353 V354 Q433	D353-A357 WeakPolarHBondContact O-CB 3.4Å; D353-A357 PolarHBondContact O-N 2.97Å; V354-A357 PolarHBondContact O-N 3.15Å; V354-A357 VanDerWaalsContact O-N 3.1Å; A357-Q433 HydrophobicContact CB-CB 3.74Å
358	E	84.2	Confident	80.4	Confident	87 Å²	87	52.7 Å²	52.7	41%	0.407	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-5.8	178.8	-69.1	174.4	-169.7	0	0	113	V354 L356 S360 A430 S431	V354-E358 PolarHBondContact O-N 3.15Å; L356-E358 VanDerWaalsContact C-N 3.32Å; L356-E358 PolarHBondContact O-N 2.86Å; E358-S360 PolarHBondContact O-N 3Å; E358-A430 HydrophobicContact CG-CB 4.3Å; E358-S431 VanDerWaalsContact CG-CB 3.44Å; E358-S431 WeakPolarHBondContact CG-OG 3.02Å; E358-S431 VanDerWaalsContact OE1-CB 3.32Å; E358-S431 WeakPolarHBondContact OE1-CB 3.48Å; E358-S431 PolarHBondContact OE1-N 3.38Å; E358-S431 PolarHBondContact OE1-OG 3.26Å
359	C	77.3	Confident	79.8	Confident	22 Å²	22	58.3 Å²	58.3	15%	0.149	31%	0.311	C	S	.	.			trans	-84.6	111.4	173	-168.6	0	0	0	0	110.4	M355 L356 L361 Y362 Q363	M355-C359 WeakPolarHBondContact O-CB 3.4Å; M355-C359 PolarHBondContact O-N 3.1Å; L356-C359 PolarHBondContact O-N 3Å; C359-L361 PolarHBondContact O-N 3.49Å; C359-Y362 HydrophobicContact CB-CD2 4.03Å; C359-Y362 PolarHBondContact O-N 3.48Å; C359-Q363 PolarHBondContact O-N 3.47Å
360	S	75.6	Confident	79.6	Confident	86 Å²	86	57.3 Å²	57.3	60%	0.601	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-12.3	175.5	56.3	0	0	0	0	114.7	E358	E358-S360 PolarHBondContact O-N 3Å
361	L	64.8	Low	79.6	Confident	49 Å²	49	60 Å²	60	26%	0.257	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-23.4	173.7	-57.9	176	0	0	0	113.5	K57 K60 C359	K57-L361 HydrophobicContact CD-CD1 4.47Å; K57-L361 HydrophobicContact CG-CD1 3.48Å; K57-L361 VanDerWaalsContact CG-CD1 3.48Å; K60-L361 HydrophobicContact CD-CB 3.92Å; K60-L361 HydrophobicContact CD-CD2 4.35Å; K60-L361 PolarHBondContact NZ-O 3.35Å; C359-L361 PolarHBondContact O-N 3.49Å
362	Y	67	Low	79.4	Confident	72 Å²	72	67.2 Å²	67.2	28%	0.282	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-6.8	-179.7	-61.8	-71.7	0	0	0	113.7	L56 L356 C359 L364	L56-Y362 HydrophobicContact CB-CE2 4Å; L56-Y362 HydrophobicContact CD1-CE2 4.25Å; L56-Y362 HydrophobicContact CD2-CE2 3.97Å; L56-Y362 WeakPolarHBondContact CD2-OH 3.44Å; L56-Y362 HydrophobicContact CG-CE2 4.29Å; L56-Y362 PolarHBondContact O-OH 3.08Å; L356-Y362 HydrophobicContact CD2-CD2 3.86Å; L356-Y362 HydrophobicContact CD2-CE2 4.21Å; L356-Y362 HydrophobicContact CD2-CG 4.18Å; C359-Y362 HydrophobicContact CB-CD2 4.03Å; C359-Y362 PolarHBondContact O-N 3.48Å; Y362-L364 PolarHBondContact O-N 2.96Å
363	Q	68.8	Low	79.5	Confident	71 Å²	71	67.2 Å²	67.2	33%	0.332	35%	0.353	S	S	.	.	S	Bend	trans	-54.6	126.3	169.2	-169.9	172.4	-0.5	0	0	109.7	C359 W367	C359-Q363 PolarHBondContact O-N 3.47Å; Q363-W367 HydrophobicContact CG-CB 3.94Å; Q363-W367 PolarHBondContact NE2-O 3Å
364	L	68.3	Low	79.8	Confident	92 Å²	92	67.7 Å²	67.7	48%	0.482	35%	0.354	S	S	.	.			trans	-62.8	143.5	175.9	-70.4	165.5	0	0	0	109.5	Y362 S366 W367 C368	Y362-L364 PolarHBondContact O-N 2.96Å; L364-S366 VanDerWaalsContact C-N 3.25Å; L364-S366 PolarHBondContact O-N 3.48Å; L364-W367 HydrophobicContact CB-CB 4.49Å; L364-W367 CarbonylContact O-C 3.2Å; L364-W367 VanDerWaalsContact O-CA 3.3Å; L364-W367 WeakPolarHBondContact O-CA 3.4Å; L364-W367 WeakPolarHBondContact O-CB 3.34Å; L364-W367 PolarHBondContact O-N 2.96Å; L364-C368 PolarHBondContact O-N 3.02Å; L364-C368 PolarHBondContact O-SG 3.43Å; L364-C368 VanDerWaalsContact O-SG 3.39Å
365	E	69.5	Low	80	Confident	102 Å²	102	67 Å²	67	48%	0.477	35%	0.349	S	S	.	.	H	α-helix	trans	-55.3	-40.1	-178.3	-171	-174.8	171.9	0	0	112.9	H247 W367 C368	H247-E365 IonicContact CD2-OE1 2.68Å; H247-E365 IonicContact CD2-OE2 3.62Å; E365-W367 PolarHBondContact O-N 2.89Å; E365-W367 VanDerWaalsContact O-N 3.13Å; E365-C368 WeakPolarHBondContact O-CB 3.44Å; E365-C368 PolarHBondContact O-N 3.35Å
366	S	72.9	Confident	80.4	Confident	49 Å²	49	66.7 Å²	66.7	34%	0.343	35%	0.346	S	S	.	.	H	α-helix	trans	-61.7	-17.4	173.9	58.6	0	0	0	0	114.3	L364 I370 P478	L364-S366 VanDerWaalsContact C-N 3.25Å; L364-S366 PolarHBondContact O-N 3.48Å; S366-I370 WeakPolarHBondContact O-CG1 3.43Å; S366-P478 WeakPolarHBondContact O-CG 3.41Å
367	W	81.5	Confident	80.9	Confident	29 Å²	29	67 Å²	67	11%	0.11	34%	0.343	C	S	.	.	H	α-helix	trans	-101.1	-21.9	173.7	-79.3	88.7	0	0	0	113.1	Q363 L364 E365 K369 I370 L375 M378 L432 M474 R475 P478	Q363-W367 HydrophobicContact CG-CB 3.94Å; Q363-W367 PolarHBondContact NE2-O 3Å; L364-W367 HydrophobicContact CB-CB 4.49Å; L364-W367 CarbonylContact O-C 3.2Å; L364-W367 VanDerWaalsContact O-CA 3.3Å; L364-W367 WeakPolarHBondContact O-CA 3.4Å; L364-W367 WeakPolarHBondContact O-CB 3.34Å; L364-W367 PolarHBondContact O-N 2.96Å; E365-W367 PolarHBondContact O-N 2.89Å; E365-W367 VanDerWaalsContact O-N 3.13Å; W367-K369 VanDerWaalsContact C-N 3.27Å; W367-K369 PolarHBondContact O-N 3.04Å; W367-I370 HydrophobicContact CE3-CB 4.3Å; W367-I370 HydrophobicContact CE3-CG1 4.32Å; W367-I370 HydrophobicContact CE3-CG2 4.35Å; W367-I370 HydrophobicContact CZ3-CG2 4.24Å; W367-I370 PolarHBondContact O-N 2.75Å; W367-L375 HydrophobicContact CZ3-CD1 4.19Å; W367-M378 HydrophobicContact CH2-CE 4.07Å; W367-M378 HydrophobicContact CZ3-CE 4.15Å; W367-L432 HydrophobicContact CH2-CB 4.17Å; W367-L432 HydrophobicContact CH2-CD2 3.64Å; W367-L432 HydrophobicContact CH2-CG 4.45Å; W367-L432 HydrophobicContact CZ2-CD2 3.61Å; W367-L432 HydrophobicContact CZ3-CB 4.45Å; W367-M474 HydrophobicContact CH2-CG 4.12Å; W367-M474 HydrophobicContact CH2-SD 4.19Å; W367-M474 HydrophobicContact CZ2-CG 4.31Å; W367-M474 WeakPolarHBondContact CZ2-O 3.25Å; W367-R475 PolarHBondContact NE1-O 2.98Å; W367-P478 HydrophobicContact CD2-CG 4.3Å; W367-P478 HydrophobicContact CH2-CB 4.22Å; W367-P478 HydrophobicContact CZ2-CB 4.04Å; W367-P478 HydrophobicContact CZ2-CG 4.27Å
368	C	75.8	Confident	81.5	Confident	69 Å²	69	65.3 Å²	65.3	47%	0.466	33%	0.33	S	S	.	.	H	α-helix	trans	-64.3	-31.4	174.7	-64.5	0	0	0	0	112.4	L364 E365 I370	L364-C368 PolarHBondContact O-N 3.02Å; L364-C368 PolarHBondContact O-SG 3.43Å; L364-C368 VanDerWaalsContact O-SG 3.39Å; E365-C368 WeakPolarHBondContact O-CB 3.44Å; E365-C368 PolarHBondContact O-N 3.35Å; C368-I370 VanDerWaalsContact C-N 3.28Å; C368-I370 PolarHBondContact O-N 2.81Å
369	K	81.1	Confident	82	Confident	117 Å²	117	61.3 Å²	61.3	51%	0.509	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-5.3	175.9	-58.1	-174.2	-172.4	-180	0	114	W367 D580	W367-K369 VanDerWaalsContact C-N 3.27Å; W367-K369 PolarHBondContact O-N 3.04Å; K369-D580 WeakPolarHBondContact CD-OD2 3.34Å; K369-D580 IonicContact NZ-OD2 1.73Å; K369-D580 PolarHBondContact NZ-OD2 2.78Å
370	I	87.6	Confident	82.8	Confident	22 Å²	22	61.4 Å²	61.4	11%	0.113	31%	0.309	C	S	.	.			trans	-91.4	122.3	-173.2	-59.8	-60.5	0	0	0	111.4	S366 W367 C368 Q374 M378 P478 I479 L482	S366-I370 WeakPolarHBondContact O-CG1 3.43Å; W367-I370 HydrophobicContact CE3-CB 4.3Å; W367-I370 HydrophobicContact CE3-CG1 4.32Å; W367-I370 HydrophobicContact CE3-CG2 4.35Å; W367-I370 HydrophobicContact CZ3-CG2 4.24Å; W367-I370 PolarHBondContact O-N 2.75Å; C368-I370 VanDerWaalsContact C-N 3.28Å; C368-I370 PolarHBondContact O-N 2.81Å; I370-Q374 HydrophobicContact CG2-CB 3.96Å; I370-M378 HydrophobicContact CG2-CE 3.8Å; I370-P478 HydrophobicContact CD1-CB 3.73Å; I370-P478 HydrophobicContact CD1-CG 3.77Å; I370-P478 HydrophobicContact CG1-CB 3.89Å; I370-P478 HydrophobicContact CG1-CG 3.69Å; I370-I479 HydrophobicContact CD1-CD1 3.83Å; I370-L482 HydrophobicContact CD1-CD1 4.19Å
371	T	90.3	Very high	83.6	Confident	70 Å²	70	57.3 Å²	57.3	43%	0.429	28%	0.28	S	S	.	.			trans	-78.1	159	178.8	76.9	0	0	0	0	112.1	D373 Q374 L375	T371-D373 PolarHBondContact O-N 3.21Å; T371-Q374 PolarHBondContact O-N 3.31Å; T371-Q374 VanDerWaalsContact O-N 3.16Å; T371-Q374 WeakPolarHBondContact OG1-CG 3.28Å; T371-Q374 PolarHBondContact OG1-N 3.07Å; T371-Q374 VanDerWaalsContact OG1-N 3.11Å; T371-L375 PolarHBondContact O-N 3.44Å
372	K	88.9	Confident	84.9	Confident	172 Å²	172	55 Å²	55	75%	0.748	27%	0.268	S	S	*	.	H	α-helix	trans	-61.3	-30.5	174.6	-65.3	-171.2	177.9	-172.7	0	112.9	K376	K372-K376 PolarHBondContact O-N 3.15Å
373	D	91.1	Very high	86.2	Confident	83 Å²	83	51.6 Å²	51.6	44%	0.444	26%	0.255	S	S	.	.	H	α-helix	trans	-65.4	-51.1	171.1	164.3	72	0	0	0	111.4	T371 L375 K376 R377	T371-D373 PolarHBondContact O-N 3.21Å; D373-L375 VanDerWaalsContact C-N 3.26Å; D373-L375 PolarHBondContact O-N 2.98Å; D373-K376 PolarHBondContact O-N 3.2Å; D373-K376 VanDerWaalsContact O-N 3.08Å; D373-R377 PolarHBondContact O-N 3.07Å; D373-R377 IonicContact OD1-NE 3.59Å; D373-R377 PolarHBondContact OD1-NE 2.84Å; D373-R377 IonicContact OD2-CZ 3.75Å; D373-R377 VanDerWaalsContact OD2-CZ 3.23Å; D373-R377 IonicContact OD2-NE 2.71Å; D373-R377 PolarHBondContact OD2-NE 3.39Å; D373-R377 IonicContact OD2-NH2 3.88Å; D373-R377 PolarHBondContact OD2-NH2 3.29Å
374	Q	92.8	Very high	87.2	Confident	45 Å²	45	48.8 Å²	48.8	21%	0.21	24%	0.242	C	C	.	.	H	α-helix	trans	-57.4	-41.5	177.6	-74	166.8	-13.7	0	0	111.2	I370 T371 R377 M378 L482	I370-Q374 HydrophobicContact CG2-CB 3.96Å; T371-Q374 PolarHBondContact O-N 3.31Å; T371-Q374 VanDerWaalsContact O-N 3.16Å; T371-Q374 WeakPolarHBondContact OG1-CG 3.28Å; T371-Q374 PolarHBondContact OG1-N 3.07Å; T371-Q374 VanDerWaalsContact OG1-N 3.11Å; Q374-R377 PolarHBondContact O-N 3.45Å; Q374-M378 WeakPolarHBondContact O-CB 3.46Å; Q374-M378 VanDerWaalsContact O-CG 3.27Å; Q374-M378 WeakPolarHBondContact O-CG 3.44Å; Q374-M378 PolarHBondContact O-N 3.4Å; Q374-L482 HydrophobicContact CB-CD1 4.23Å; Q374-L482 HydrophobicContact CB-CD2 4.14Å; Q374-L482 HydrophobicContact CG-CD1 4.08Å; Q374-L482 HydrophobicContact CG-CD2 4.23Å
375	L	92.6	Very high	88.1	Confident	15 Å²	15	45.7 Å²	45.7	8%	0.079	22%	0.224	C	C	.	.	H	α-helix	trans	-59.2	-50.7	172.5	177.9	60.6	0	0	0	112	W367 T371 D373 R377 M378 L379 L432	W367-L375 HydrophobicContact CZ3-CD1 4.19Å; T371-L375 PolarHBondContact O-N 3.44Å; D373-L375 VanDerWaalsContact C-N 3.26Å; D373-L375 PolarHBondContact O-N 2.98Å; L375-R377 PolarHBondContact O-N 3.21Å; L375-M378 PolarHBondContact O-N 2.92Å; L375-L379 HydrophobicContact CD1-CD1 3.88Å; L375-L379 HydrophobicContact CD1-CG 4.04Å; L375-L379 HydrophobicContact CG-CD1 4.02Å; L375-L379 WeakPolarHBondContact O-CB 3.46Å; L375-L379 VanDerWaalsContact O-CG 3.32Å; L375-L379 WeakPolarHBondContact O-CG 3.47Å; L375-L379 PolarHBondContact O-N 3.48Å; L375-L432 HydrophobicContact CD1-CB 4.41Å
376	K	93.6	Very high	89.2	Confident	64 Å²	64	41 Å²	41	28%	0.278	20%	0.202	S	C	.	.	H	α-helix	trans	-56.4	-47.9	176.6	-78.7	-168.7	175.6	-165.1	0	111.7	K372 D373 L379 F380 V424 K425 S426	K372-K376 PolarHBondContact O-N 3.15Å; D373-K376 PolarHBondContact O-N 3.2Å; D373-K376 VanDerWaalsContact O-N 3.08Å; K376-L379 PolarHBondContact O-N 3.11Å; K376-F380 HydrophobicContact CB-CE2 4.37Å; K376-F380 VanDerWaalsContact O-CD2 3.22Å; K376-F380 WeakPolarHBondContact O-CD2 3.46Å; K376-F380 WeakPolarHBondContact O-CG 3.45Å; K376-F380 PolarHBondContact O-N 3.25Å; K376-V424 HydrophobicContact CB-CG1 4.25Å; K376-V424 WeakPolarHBondContact CD-O 3.46Å; K376-V424 WeakPolarHBondContact CE-O 3.35Å; K376-V424 HydrophobicContact CG-CG1 4.29Å; K376-V424 PolarHBondContact NZ-O 3.33Å; K376-K425 PolarHBondContact NZ-O 2.85Å; K376-S426 PolarHBondContact NZ-O 2.65Å
377	R	93.5	Very high	90.1	Very high	56 Å²	56	38.6 Å²	38.6	21%	0.211	19%	0.186	C	C	.	.	H	α-helix	trans	-64.4	-41.1	-179	-70.6	-166.7	-66.5	113.7	-1.8	112.3	D373 Q374 L375 F380 F381 M485	D373-R377 PolarHBondContact O-N 3.07Å; D373-R377 IonicContact OD1-NE 3.59Å; D373-R377 PolarHBondContact OD1-NE 2.84Å; D373-R377 IonicContact OD2-CZ 3.75Å; D373-R377 VanDerWaalsContact OD2-CZ 3.23Å; D373-R377 IonicContact OD2-NE 2.71Å; D373-R377 PolarHBondContact OD2-NE 3.39Å; D373-R377 IonicContact OD2-NH2 3.88Å; D373-R377 PolarHBondContact OD2-NH2 3.29Å; Q374-R377 PolarHBondContact O-N 3.45Å; L375-R377 PolarHBondContact O-N 3.21Å; R377-F380 PolarHBondContact O-N 3.13Å; R377-F381 PolarHBondContact O-N 3.28Å; R377-F381 VanDerWaalsContact O-N 3.09Å; R377-M485 HydrophobicContact CB-CE 3.94Å; R377-M485 VanDerWaalsContact O-CE 3.28Å; R377-M485 WeakPolarHBondContact O-CE 3.49Å
378	M	94.4	Very high	90.3	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63	-40.4	172.9	-72.6	-169.9	-69	0	0	112.9	W367 I370 Q374 L375 L382 M474 P478 Y481 L482 M485	W367-M378 HydrophobicContact CH2-CE 4.07Å; W367-M378 HydrophobicContact CZ3-CE 4.15Å; I370-M378 HydrophobicContact CG2-CE 3.8Å; Q374-M378 WeakPolarHBondContact O-CB 3.46Å; Q374-M378 VanDerWaalsContact O-CG 3.27Å; Q374-M378 WeakPolarHBondContact O-CG 3.44Å; Q374-M378 PolarHBondContact O-N 3.4Å; L375-M378 PolarHBondContact O-N 2.92Å; M378-L382 WeakPolarHBondContact O-CB 3.49Å; M378-L382 PolarHBondContact O-N 2.81Å; M378-M474 HydrophobicContact CB-CE 4.02Å; M378-M474 HydrophobicContact CB-SD 4.02Å; M378-M474 HydrophobicContact CE-CG 4.47Å; M378-M474 HydrophobicContact SD-CG 3.82Å; M378-M474 HydrophobicContact SD-SD 4.35Å; M378-P478 HydrophobicContact CE-CB 4Å; M378-P478 HydrophobicContact SD-CB 3.96Å; M378-Y481 HydrophobicContact CB-CD1 4.07Å; M378-Y481 HydrophobicContact CB-CE1 4.06Å; M378-Y481 HydrophobicContact CG-CD1 3.81Å; M378-Y481 HydrophobicContact CG-CE1 4.28Å; M378-Y481 HydrophobicContact SD-CD1 3.88Å; M378-L482 HydrophobicContact CG-CD2 3.59Å; M378-L482 HydrophobicContact CG-CG 3.95Å; M378-L482 HydrophobicContact SD-CD2 4.13Å; M378-L482 HydrophobicContact SD-CG 3.84Å; M378-M485 HydrophobicContact CG-SD 4.06Å
379	L	95.4	Very high	90.9	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.016	17%	0.169	C	C	.	.	H	α-helix	trans	-69.9	-36.7	177.8	-69.9	175.5	0	0	0	112.5	L375 K376 L382 L383 V424 L432 F435 M474	L375-L379 HydrophobicContact CD1-CD1 3.88Å; L375-L379 HydrophobicContact CD1-CG 4.04Å; L375-L379 HydrophobicContact CG-CD1 4.02Å; L375-L379 WeakPolarHBondContact O-CB 3.46Å; L375-L379 VanDerWaalsContact O-CG 3.32Å; L375-L379 WeakPolarHBondContact O-CG 3.47Å; L375-L379 PolarHBondContact O-N 3.48Å; K376-L379 PolarHBondContact O-N 3.11Å; L379-L382 HydrophobicContact CD2-CD2 4.46Å; L379-L382 WeakPolarHBondContact O-CB 3.33Å; L379-L382 PolarHBondContact O-N 2.77Å; L379-L383 WeakPolarHBondContact O-CG 3.27Å; L379-L383 PolarHBondContact O-N 3.37Å; L379-V424 HydrophobicContact CB-CG1 3.88Å; L379-V424 HydrophobicContact CB-CG2 3.83Å; L379-V424 HydrophobicContact CD1-CG2 4.1Å; L379-L432 HydrophobicContact CD2-CD1 3.85Å; L379-F435 HydrophobicContact CD1-CB 4.34Å; L379-F435 HydrophobicContact CD1-CD2 3.97Å; L379-F435 HydrophobicContact CD1-CG 4.3Å; L379-F435 HydrophobicContact CD2-CB 4.12Å; L379-F435 HydrophobicContact CD2-CD1 3.91Å; L379-F435 HydrophobicContact CD2-CD2 3.81Å; L379-F435 HydrophobicContact CD2-CE1 4.3Å; L379-F435 HydrophobicContact CD2-CE2 4.19Å; L379-F435 HydrophobicContact CD2-CG 3.66Å; L379-F435 HydrophobicContact CD2-CZ 4.43Å; L379-F435 HydrophobicContact CG-CD2 4.36Å; L379-M474 HydrophobicContact CD2-CE 4.36Å
380	F	93.5	Very high	91.2	Very high	23 Å²	23	33.9 Å²	33.9	10%	0.101	17%	0.165	C	C	.	.	H	α-helix	trans	-63.7	-46.7	172.8	-74.5	-48.9	0	0	0	112.3	K376 R377 L382 L383 D384 Y421 V424 K425 Y509	K376-F380 HydrophobicContact CB-CE2 4.37Å; K376-F380 VanDerWaalsContact O-CD2 3.22Å; K376-F380 WeakPolarHBondContact O-CD2 3.46Å; K376-F380 WeakPolarHBondContact O-CG 3.45Å; K376-F380 PolarHBondContact O-N 3.25Å; R377-F380 PolarHBondContact O-N 3.13Å; F380-L382 VanDerWaalsContact C-N 3.29Å; F380-L382 PolarHBondContact O-N 3.09Å; F380-L383 PolarHBondContact O-N 2.98Å; F380-D384 VanDerWaalsContact O-CB 3.3Å; F380-D384 WeakPolarHBondContact O-CB 3.26Å; F380-D384 PolarHBondContact O-N 3.49Å; F380-Y421 AromaticContact CD1-CD2 3.58Å; F380-Y421 HydrophobicContact CD1-CD2 3.58Å; F380-Y421 AromaticContact CD1-CE2 3.41Å; F380-Y421 HydrophobicContact CD1-CE2 3.41Å; F380-Y421 VanDerWaalsContact CD1-CE2 3.41Å; F380-Y421 HydrophobicContact CD1-CG 4.43Å; F380-Y421 AromaticContact CE1-CD2 3.79Å; F380-Y421 HydrophobicContact CE1-CD2 3.79Å; F380-Y421 HydrophobicContact CE1-CE1 4.35Å; F380-Y421 AromaticContact CE1-CE2 3.59Å; F380-Y421 HydrophobicContact CE1-CE2 3.59Å; F380-Y421 HydrophobicContact CE1-CG 4.25Å; F380-Y421 AromaticContact CE1-CZ 3.89Å; F380-Y421 HydrophobicContact CG-CE2 4.42Å; F380-V424 HydrophobicContact CD1-CB 4.18Å; F380-V424 HydrophobicContact CD1-CG1 3.69Å; F380-V424 HydrophobicContact CD2-CG1 4.1Å; F380-V424 HydrophobicContact CE1-CB 3.88Å; F380-V424 HydrophobicContact CE1-CG1 3.61Å; F380-V424 HydrophobicContact CE2-CG1 4.02Å; F380-V424 HydrophobicContact CG-CG1 3.95Å; F380-V424 HydrophobicContact CZ-CB 4.36Å; F380-V424 HydrophobicContact CZ-CG1 3.8Å; F380-K425 HydrophobicContact CE1-CB 4.19Å; F380-K425 HydrophobicContact CZ-CB 3.86Å; F380-K425 HydrophobicContact CZ-CG 4.36Å; F380-Y509 HydrophobicContact CB-CD1 3.86Å; F380-Y509 HydrophobicContact CB-CG 4.32Å
381	F	92.2	Very high	91.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.8	-35.4	175.4	165.7	-97	0	0	0	112.6	R377 R385 Y481 R484 M485 I488 L491 Y509	R377-F381 PolarHBondContact O-N 3.28Å; R377-F381 VanDerWaalsContact O-N 3.09Å; F381-R385 HydrophobicContact CD2-CG 4.45Å; F381-R385 HydrophobicContact CE2-CG 4.29Å; F381-R385 WeakPolarHBondContact O-CB 3.34Å; F381-R385 WeakPolarHBondContact O-CG 3.11Å; F381-R385 PolarHBondContact O-N 3Å; F381-Y481 HydrophobicContact CD1-CD1 4.47Å; F381-Y481 AromaticContact CD1-CE1 3.54Å; F381-Y481 HydrophobicContact CD1-CE1 3.54Å; F381-Y481 AromaticContact CD1-CZ 3.67Å; F381-Y481 WeakPolarHBondContact CD1-OH 3.18Å; F381-Y481 AromaticContact CE1-CE1 3.82Å; F381-Y481 HydrophobicContact CE1-CE1 3.82Å; F381-Y481 HydrophobicContact CE1-CE2 4.26Å; F381-Y481 AromaticContact CE1-CZ 3.66Å; F381-R484 HydrophobicContact CZ-CG 4.24Å; F381-M485 HydrophobicContact CB-CE 3.89Å; F381-M485 HydrophobicContact CB-CG 4.11Å; F381-M485 HydrophobicContact CB-SD 4.36Å; F381-M485 HydrophobicContact CD1-CG 3.9Å; F381-M485 HydrophobicContact CD2-CB 4.16Å; F381-M485 HydrophobicContact CD2-CG 4.05Å; F381-M485 HydrophobicContact CE1-CG 4.24Å; F381-M485 HydrophobicContact CE2-CB 4.36Å; F381-M485 HydrophobicContact CE2-CG 4.37Å; F381-M485 HydrophobicContact CG-CB 4.38Å; F381-M485 HydrophobicContact CG-CG 3.78Å; F381-M485 HydrophobicContact CZ-CG 4.45Å; F381-I488 HydrophobicContact CD2-CD1 4.29Å; F381-I488 HydrophobicContact CE2-CB 4.02Å; F381-I488 HydrophobicContact CE2-CD1 4.29Å; F381-I488 HydrophobicContact CE2-CG1 4.27Å; F381-L491 HydrophobicContact CE2-CD1 4.26Å; F381-L491 HydrophobicContact CZ-CD1 3.8Å; F381-Y509 HydrophobicContact CB-CD1 4.42Å; F381-Y509 HydrophobicContact CB-CD2 3.95Å; F381-Y509 HydrophobicContact CB-CE1 4.35Å; F381-Y509 HydrophobicContact CB-CE2 3.89Å; F381-Y509 HydrophobicContact CB-CG 4.21Å; F381-Y509 HydrophobicContact CD2-CD2 4.48Å; F381-Y509 AromaticContact CD2-CE2 3.72Å; F381-Y509 HydrophobicContact CD2-CE2 3.72Å; F381-Y509 HydrophobicContact CG-CE2 4.29Å
382	L	93.3	Very high	91.4	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-62.5	-52.4	172.3	178.2	59	0	0	0	111.6	M378 L379 F380 D384 R385 L386 F435 F467 E470 M474	M378-L382 WeakPolarHBondContact O-CB 3.49Å; M378-L382 PolarHBondContact O-N 2.81Å; L379-L382 HydrophobicContact CD2-CD2 4.46Å; L379-L382 WeakPolarHBondContact O-CB 3.33Å; L379-L382 PolarHBondContact O-N 2.77Å; F380-L382 VanDerWaalsContact C-N 3.29Å; F380-L382 PolarHBondContact O-N 3.09Å; L382-D384 VanDerWaalsContact C-N 3.35Å; L382-D384 PolarHBondContact O-N 3.45Å; L382-R385 PolarHBondContact O-N 3.46Å; L382-L386 HydrophobicContact CD1-CD1 3.85Å; L382-L386 HydrophobicContact CD1-CG 4.23Å; L382-L386 HydrophobicContact CG-CD1 3.99Å; L382-L386 VanDerWaalsContact O-CG 3.27Å; L382-L386 WeakPolarHBondContact O-CG 3.46Å; L382-L386 PolarHBondContact O-N 3.23Å; L382-F435 HydrophobicContact CD2-CE1 4.23Å; L382-F467 HydrophobicContact CD1-CD2 4.38Å; L382-F467 HydrophobicContact CD2-CD2 3.92Å; L382-F467 HydrophobicContact CD2-CE2 3.85Å; L382-F467 HydrophobicContact CG-CD2 4.41Å; L382-E470 HydrophobicContact CD1-CB 3.52Å; L382-E470 HydrophobicContact CD1-CG 4.36Å; L382-M474 HydrophobicContact CB-CE 4.18Å; L382-M474 HydrophobicContact CD2-CE 3.84Å
383	L	93.8	Very high	91.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.7	-41.2	179.6	-77.5	168.4	0	0	0	112.7	L379 F380 L386 S387 L417 L420 Y421 V424 F435 L501	L379-L383 WeakPolarHBondContact O-CG 3.27Å; L379-L383 PolarHBondContact O-N 3.37Å; F380-L383 PolarHBondContact O-N 2.98Å; L383-L386 PolarHBondContact O-N 2.63Å; L383-S387 VanDerWaalsContact O-CB 3.28Å; L383-S387 WeakPolarHBondContact O-CB 3.27Å; L383-S387 PolarHBondContact O-N 2.94Å; L383-S387 PolarHBondContact O-OG 3.36Å; L383-L417 HydrophobicContact CD2-CB 4.44Å; L383-L417 HydrophobicContact CD2-CD2 3.8Å; L383-L420 HydrophobicContact CD1-CB 4.22Å; L383-L420 HydrophobicContact CD2-CB 3.86Å; L383-L420 HydrophobicContact CD2-CD1 4.11Å; L383-Y421 HydrophobicContact CD1-CD2 4.42Å; L383-V424 HydrophobicContact CD1-CG2 4.01Å; L383-F435 HydrophobicContact CD1-CE2 4.09Å; L383-F435 HydrophobicContact CD1-CZ 4.23Å; L383-F435 HydrophobicContact CD2-CE2 4.5Å; L383-F435 HydrophobicContact CD2-CZ 3.92Å; L383-F435 HydrophobicContact CG-CE2 4.33Å; L383-F435 HydrophobicContact CG-CZ 3.98Å; L383-L501 HydrophobicContact CB-CD1 4.25Å
384	D	88.9	Confident	91.6	Very high	12 Å²	12	32 Å²	32	6%	0.064	14%	0.138	C	C	.	.	H	α-helix	trans	-62.5	-45.1	176.8	-175.2	37.7	0	0	0	111.5	F380 L382 L386 S387 R388 Y509	F380-D384 VanDerWaalsContact O-CB 3.3Å; F380-D384 WeakPolarHBondContact O-CB 3.26Å; F380-D384 PolarHBondContact O-N 3.49Å; L382-D384 VanDerWaalsContact C-N 3.35Å; L382-D384 PolarHBondContact O-N 3.45Å; D384-L386 VanDerWaalsContact C-N 3.35Å; D384-L386 PolarHBondContact O-N 3.06Å; D384-S387 PolarHBondContact O-OG 3.19Å; D384-S387 VanDerWaalsContact O-OG 3.14Å; D384-R388 VanDerWaalsContact CG-NH2 3.3Å; D384-R388 VanDerWaalsContact O-CG 3.28Å; D384-R388 WeakPolarHBondContact O-CG 3.3Å; D384-R388 PolarHBondContact O-N 2.98Å; D384-R388 IonicContact OD1-CZ 3.78Å; D384-R388 IonicContact OD1-NE 2.73Å; D384-R388 PolarHBondContact OD1-NE 3.19Å; D384-R388 IonicContact OD1-NH2 3.47Å; D384-R388 PolarHBondContact OD1-NH2 3.15Å; D384-R388 VanDerWaalsContact OD1-NH2 3.09Å; D384-R388 IonicContact OD2-CZ 3.68Å; D384-R388 IonicContact OD2-NE 3.2Å; D384-R388 PolarHBondContact OD2-NE 3.47Å; D384-R388 IonicContact OD2-NH2 2.73Å; D384-R388 PolarHBondContact OD2-NH2 3.41Å; D384-Y509 HydrophobicContact CB-CE1 3.89Å; D384-Y509 WeakPolarHBondContact OD2-CE1 3.43Å; D384-Y509 PolarHBondContact OD2-OH 3.32Å
385	R	88.3	Confident	91.8	Very high	28 Å²	28	30.7 Å²	30.7	11%	0.106	13%	0.132	C	C	.	.	H	α-helix	trans	-71.4	-24.5	177.7	-75.2	-177.1	59.3	-125	-9.6	114.4	F381 L382 Q389 E470 I488	F381-R385 HydrophobicContact CD2-CG 4.45Å; F381-R385 HydrophobicContact CE2-CG 4.29Å; F381-R385 WeakPolarHBondContact O-CB 3.34Å; F381-R385 WeakPolarHBondContact O-CG 3.11Å; F381-R385 PolarHBondContact O-N 3Å; L382-R385 PolarHBondContact O-N 3.46Å; R385-Q389 WeakPolarHBondContact O-CG 3.2Å; R385-Q389 PolarHBondContact O-NE2 3.43Å; R385-E470 IonicContact CZ-OE1 3.47Å; R385-E470 IonicContact CZ-OE2 3.61Å; R385-E470 IonicContact NH1-OE1 2.61Å; R385-E470 PolarHBondContact NH1-OE1 2.86Å; R385-E470 IonicContact NH1-OE2 3.91Å; R385-E470 PolarHBondContact NH1-OE2 3.42Å; R385-E470 IonicContact NH2-OE1 3.93Å; R385-E470 PolarHBondContact NH2-OE1 3.41Å; R385-E470 IonicContact NH2-OE2 2.75Å; R385-I488 HydrophobicContact CG-CD1 3.57Å; R385-I488 HydrophobicContact CG-CG1 4.04Å
386	L	92.1	Very high	91.9	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-78.7	-47.4	172.8	-66.2	169	0	0	0	111.8	L382 L383 D384 R388 Q389 W391 A392 F439 L463 T466 F467	L382-L386 HydrophobicContact CD1-CD1 3.85Å; L382-L386 HydrophobicContact CD1-CG 4.23Å; L382-L386 HydrophobicContact CG-CD1 3.99Å; L382-L386 VanDerWaalsContact O-CG 3.27Å; L382-L386 WeakPolarHBondContact O-CG 3.46Å; L382-L386 PolarHBondContact O-N 3.23Å; L383-L386 PolarHBondContact O-N 2.63Å; D384-L386 VanDerWaalsContact C-N 3.35Å; D384-L386 PolarHBondContact O-N 3.06Å; L386-R388 VanDerWaalsContact C-N 3.33Å; L386-R388 PolarHBondContact O-N 3.26Å; L386-Q389 WeakPolarHBondContact O-CG 3.42Å; L386-Q389 PolarHBondContact O-N 3.32Å; L386-W391 HydrophobicContact CD2-CH2 4.17Å; L386-A392 VanDerWaalsContact O-CB 3.25Å; L386-A392 WeakPolarHBondContact O-CB 3.3Å; L386-F439 HydrophobicContact CD1-CE2 4.13Å; L386-L463 HydrophobicContact CB-CD1 4.09Å; L386-L463 HydrophobicContact CD1-CD1 4.32Å; L386-L463 HydrophobicContact CD2-CD1 4.2Å; L386-L463 HydrophobicContact CG-CD1 4.43Å; L386-T466 HydrophobicContact CD2-CG2 3.74Å; L386-F467 HydrophobicContact CD1-CB 3.83Å; L386-F467 HydrophobicContact CD1-CD2 4Å; L386-F467 HydrophobicContact CD1-CG 4.39Å; L386-F467 HydrophobicContact CD2-CB 4.03Å
387	S	91.6	Very high	91.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-69.2	-24.5	-175.9	57.3	0	0	0	0	114.9	L383 D384 Q389 L501	L383-S387 VanDerWaalsContact O-CB 3.28Å; L383-S387 WeakPolarHBondContact O-CB 3.27Å; L383-S387 PolarHBondContact O-N 2.94Å; L383-S387 PolarHBondContact O-OG 3.36Å; D384-S387 PolarHBondContact O-OG 3.19Å; D384-S387 VanDerWaalsContact O-OG 3.14Å; S387-Q389 PolarHBondContact O-N 2.88Å; S387-L501 VanDerWaalsContact CB-CG 3.43Å; S387-L501 WeakPolarHBondContact OG-CD1 3.23Å; S387-L501 WeakPolarHBondContact OG-CG 3.4Å
388	R	86.6	Confident	92	Very high	38 Å²	38	32.9 Å²	32.9	14%	0.143	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-8.4	173.4	-72.2	-176.4	-161.7	-150	23.1	114	D384 L386 K497 L498 E507	D384-R388 VanDerWaalsContact CG-NH2 3.3Å; D384-R388 VanDerWaalsContact O-CG 3.28Å; D384-R388 WeakPolarHBondContact O-CG 3.3Å; D384-R388 PolarHBondContact O-N 2.98Å; D384-R388 IonicContact OD1-CZ 3.78Å; D384-R388 IonicContact OD1-NE 2.73Å; D384-R388 PolarHBondContact OD1-NE 3.19Å; D384-R388 IonicContact OD1-NH2 3.47Å; D384-R388 PolarHBondContact OD1-NH2 3.15Å; D384-R388 VanDerWaalsContact OD1-NH2 3.09Å; D384-R388 IonicContact OD2-CZ 3.68Å; D384-R388 IonicContact OD2-NE 3.2Å; D384-R388 PolarHBondContact OD2-NE 3.47Å; D384-R388 IonicContact OD2-NH2 2.73Å; D384-R388 PolarHBondContact OD2-NH2 3.41Å; L386-R388 VanDerWaalsContact C-N 3.33Å; L386-R388 PolarHBondContact O-N 3.26Å; R388-K497 CarbonylContact O-C 3.58Å; R388-K497 WeakPolarHBondContact O-CA 3.33Å; R388-L498 PolarHBondContact O-N 3.09Å; R388-E507 IonicContact CZ-OE1 2.99Å; R388-E507 IonicContact NH1-OE1 2.94Å; R388-E507 PolarHBondContact NH1-OE1 3.13Å; R388-E507 VanDerWaalsContact NH1-OE1 3.1Å; R388-E507 IonicContact NH2-OE1 2.8Å; R388-E507 PolarHBondContact NH2-OE1 2.91Å
389	Q	86.9	Confident	92	Very high	19 Å²	19	35.4 Å²	35.4	9%	0.089	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-89.1	141.1	-178.1	-45.3	-56.9	-32.7	0	0	111.3	R385 L386 S387 W391 A392 T494 L498	R385-Q389 WeakPolarHBondContact O-CG 3.2Å; R385-Q389 PolarHBondContact O-NE2 3.43Å; L386-Q389 WeakPolarHBondContact O-CG 3.42Å; L386-Q389 PolarHBondContact O-N 3.32Å; S387-Q389 PolarHBondContact O-N 2.88Å; Q389-W391 VanDerWaalsContact C-N 3.27Å; Q389-W391 HydrophobicContact CB-CD2 3.83Å; Q389-W391 HydrophobicContact CB-CE3 4.18Å; Q389-W391 HydrophobicContact CB-CG 4.47Å; Q389-W391 HydrophobicContact CB-CH2 3.77Å; Q389-W391 HydrophobicContact CB-CZ2 3.41Å; Q389-W391 VanDerWaalsContact CB-CZ2 3.41Å; Q389-W391 HydrophobicContact CB-CZ3 4.1Å; Q389-W391 HydrophobicContact CG-CH2 3.71Å; Q389-W391 HydrophobicContact CG-CZ2 3.46Å; Q389-W391 VanDerWaalsContact CG-CZ2 3.46Å; Q389-W391 HydrophobicContact CG-CZ3 4.44Å; Q389-W391 PolarHBondContact O-N 3.03Å; Q389-W391 VanDerWaalsContact O-N 3.13Å; Q389-A392 VanDerWaalsContact O-CB 3.25Å; Q389-A392 WeakPolarHBondContact O-CB 3.39Å; Q389-A392 PolarHBondContact O-N 3Å; Q389-T494 PolarHBondContact OE1-OG1 2.89Å; Q389-L498 WeakPolarHBondContact O-CD1 3.48Å
390	S	89	Confident	91.8	Very high	59 Å²	59	38.7 Å²	38.7	41%	0.413	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-58.7	-32.7	-171.6	60.9	0	0	0	0	115	A392 W393	S390-A392 VanDerWaalsContact C-N 3.25Å; S390-A392 PolarHBondContact O-N 3.41Å; S390-W393 WeakPolarHBondContact O-CB 3.33Å
391	W	88.5	Confident	91.5	Very high	26 Å²	26	39.3 Å²	39.3	10%	0.098	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-72.6	-14.3	177	43.1	-105.6	0	0	0	113.8	L386 Q389 W393 L462 L463 T466	L386-W391 HydrophobicContact CD2-CH2 4.17Å; Q389-W391 VanDerWaalsContact C-N 3.27Å; Q389-W391 HydrophobicContact CB-CD2 3.83Å; Q389-W391 HydrophobicContact CB-CE3 4.18Å; Q389-W391 HydrophobicContact CB-CG 4.47Å; Q389-W391 HydrophobicContact CB-CH2 3.77Å; Q389-W391 HydrophobicContact CB-CZ2 3.41Å; Q389-W391 VanDerWaalsContact CB-CZ2 3.41Å; Q389-W391 HydrophobicContact CB-CZ3 4.1Å; Q389-W391 HydrophobicContact CG-CH2 3.71Å; Q389-W391 HydrophobicContact CG-CZ2 3.46Å; Q389-W391 VanDerWaalsContact CG-CZ2 3.46Å; Q389-W391 HydrophobicContact CG-CZ3 4.44Å; Q389-W391 PolarHBondContact O-N 3.03Å; Q389-W391 VanDerWaalsContact O-N 3.13Å; W391-W393 VanDerWaalsContact C-N 3.25Å; W391-W393 PolarHBondContact O-N 2.92Å; W391-L462 HydrophobicContact CB-CD2 4.34Å; W391-L462 HydrophobicContact CD2-CB 4.46Å; W391-L462 HydrophobicContact CD2-CD2 4.33Å; W391-L462 HydrophobicContact CD2-CG 4.06Å; W391-L462 HydrophobicContact CG-CB 4.42Å; W391-L462 HydrophobicContact CG-CD2 3.74Å; W391-L462 HydrophobicContact CG-CG 3.99Å; W391-L462 HydrophobicContact CZ2-CG 4.46Å; W391-L463 HydrophobicContact CE3-CB 3.79Å; W391-L463 HydrophobicContact CH2-CB 4.49Å; W391-L463 HydrophobicContact CH2-CD1 4.47Å; W391-L463 HydrophobicContact CZ3-CB 3.56Å; W391-L463 HydrophobicContact CZ3-CD1 3.74Å; W391-L463 HydrophobicContact CZ3-CG 4.22Å; W391-T466 HydrophobicContact CH2-CG2 3.93Å; W391-T466 HydrophobicContact CZ2-CG2 3.95Å; W391-T466 VanDerWaalsContact CZ2-OG1 3.32Å; W391-T466 WeakPolarHBondContact CZ2-OG1 3.5Å
392	A	92.4	Very high	91.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-76.7	-13.1	178.1	0	0	0	0	0	112.9	L386 Q389 S390 Y394 F395 R396 L417	L386-A392 VanDerWaalsContact O-CB 3.25Å; L386-A392 WeakPolarHBondContact O-CB 3.3Å; Q389-A392 VanDerWaalsContact O-CB 3.25Å; Q389-A392 WeakPolarHBondContact O-CB 3.39Å; Q389-A392 PolarHBondContact O-N 3Å; S390-A392 VanDerWaalsContact C-N 3.25Å; S390-A392 PolarHBondContact O-N 3.41Å; A392-Y394 VanDerWaalsContact C-N 3.3Å; A392-Y394 PolarHBondContact O-N 3.47Å; A392-Y394 VanDerWaalsContact O-N 3.16Å; A392-F395 CarbonylContact O-C 3.49Å; A392-F395 PolarHBondContact O-N 3.14Å; A392-R396 PolarHBondContact O-N 3.01Å; A392-L417 HydrophobicContact CB-CD1 4.1Å
393	W	92	Very high	91	Very high	162 Å²	162	51 Å²	51	61%	0.614	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-44.1	-49.4	-176.3	177.1	-96.5	0	0	0	113.9	S390 W391 F395 R396 L498	S390-W393 WeakPolarHBondContact O-CB 3.33Å; W391-W393 VanDerWaalsContact C-N 3.25Å; W391-W393 PolarHBondContact O-N 2.92Å; W393-F395 PolarHBondContact O-N 3.08Å; W393-F395 VanDerWaalsContact O-N 3.11Å; W393-R396 PolarHBondContact O-N 3.28Å; W393-L498 HydrophobicContact CB-CD1 4.2Å; W393-L498 HydrophobicContact CE3-CD1 4.26Å; W393-L498 HydrophobicContact CE3-CD2 4.14Å
394	Y	93.2	Very high	90.8	Very high	119 Å²	119	53.1 Å²	53.1	47%	0.467	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-66.3	-10.5	-178.5	-58.8	-72.8	0	0	0	115	A392 I456	A392-Y394 VanDerWaalsContact C-N 3.3Å; A392-Y394 PolarHBondContact O-N 3.47Å; A392-Y394 VanDerWaalsContact O-N 3.16Å; Y394-I456 HydrophobicContact CD1-CD1 4.31Å; Y394-I456 HydrophobicContact CD1-CG1 4.31Å; Y394-I456 HydrophobicContact CD1-CG2 4.45Å; Y394-I456 HydrophobicContact CD2-CG2 4.31Å; Y394-I456 HydrophobicContact CE1-CD1 4.28Å; Y394-I456 HydrophobicContact CE1-CG1 4.18Å; Y394-I456 HydrophobicContact CE2-CG1 4.43Å; Y394-I456 HydrophobicContact CG-CG1 4.5Å; Y394-I456 HydrophobicContact CG-CG2 4.04Å
395	F	96.1	Very high	90.8	Very high	17 Å²	17	60 Å²	60	8%	0.075	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-126.5	6.8	-171.8	-41.3	-68.7	0	0	0	112.7	A392 W393 L417 I442 C446 I456 A460 L463	A392-F395 CarbonylContact O-C 3.49Å; A392-F395 PolarHBondContact O-N 3.14Å; W393-F395 PolarHBondContact O-N 3.08Å; W393-F395 VanDerWaalsContact O-N 3.11Å; F395-L417 WeakPolarHBondContact O-CB 3.44Å; F395-L417 VanDerWaalsContact O-CG 3.28Å; F395-L417 WeakPolarHBondContact O-CG 3.49Å; F395-L417 PolarHBondContact O-N 2.81Å; F395-I442 HydrophobicContact CB-CG2 4.04Å; F395-I442 HydrophobicContact CD1-CG2 3.66Å; F395-I442 HydrophobicContact CE1-CG2 4.36Å; F395-I442 HydrophobicContact CG-CG2 3.87Å; F395-C446 HydrophobicContact CE1-CB 4.3Å; F395-I456 HydrophobicContact CE1-CG2 4.03Å; F395-I456 HydrophobicContact CZ-CG2 3.82Å; F395-A460 HydrophobicContact CE1-CB 4.03Å; F395-A460 HydrophobicContact CE2-CB 4.11Å; F395-A460 HydrophobicContact CZ-CB 3.56Å; F395-L463 HydrophobicContact CB-CD2 3.92Å; F395-L463 HydrophobicContact CD2-CD2 3.62Å; F395-L463 HydrophobicContact CE2-CD2 4.41Å; F395-L463 HydrophobicContact CG-CD2 3.86Å
396	R	94.2	Very high	90.9	Very high	24 Å²	24	63.9 Å²	63.9	9%	0.091	32%	0.317	C	S	.	.	S	Bend	trans	-68.6	-48.5	178	-70	176.2	88.2	-93.5	14.4	111.7	A392 W393 H418 P499 P500 L501	A392-R396 PolarHBondContact O-N 3.01Å; W393-R396 PolarHBondContact O-N 3.28Å; R396-H418 WeakPolarHBondContact O-CB 3.35Å; R396-H418 PolarHBondContact O-N 3.39Å; R396-P499 PolarHBondContact NH2-O 3.34Å; R396-P500 VanDerWaalsContact NH2-C 3.33Å; R396-P500 PolarHBondContact NH2-O 3.48Å; R396-L501 HydrophobicContact CB-CD2 4.11Å; R396-L501 HydrophobicContact CG-CD2 4.26Å
397	E	94	Very high	90.9	Very high	85 Å²	85	64.6 Å²	64.6	40%	0.397	32%	0.32	S	S	.	.	S	Bend	trans	-110.4	160.8	-174.6	-47.7	-48.3	137.3	0	0	111.6	D416 H418	E397-D416 WeakPolarHBondContact O-CB 3.24Å; E397-H418 IonicContact OE2-CG 2.79Å
398	P	95.2	Very high	90.9	Very high	73 Å²	73	72 Å²	72	47%	0.474	35%	0.352	S	S	.	.			trans	-58.5	140.5	171.5	-19.7	29.2	0	0	0	112.3	D400 D416	P398-D400 PolarHBondContact O-N 3.15Å; P398-D416 WeakPolarHBondContact CA-OD2 3.5Å; P398-D416 WeakPolarHBondContact CG-OD2 3.48Å; P398-D416 VanDerWaalsContact N-CG 3.32Å
399	V	94.5	Very high	91.1	Very high	52 Å²	52	76.6 Å²	76.6	32%	0.315	38%	0.375	S	S	.	.			trans	-68.1	115.8	179	-178.2	0	0	0	0	110.8	S401 V404 Y407	V399-S401 PolarHBondContact O-N 3.25Å; V399-S401 VanDerWaalsContact O-N 3.09Å; V399-V404 HydrophobicContact CG1-CB 3.88Å; V399-V404 HydrophobicContact CG1-CG1 4.11Å; V399-V404 HydrophobicContact CG1-CG2 3.78Å; V399-Y407 HydrophobicContact CB-CD1 4.12Å; V399-Y407 HydrophobicContact CB-CD2 4.33Å; V399-Y407 HydrophobicContact CB-CE1 3.78Å; V399-Y407 HydrophobicContact CB-CE2 4.02Å; V399-Y407 HydrophobicContact CB-CG 4.38Å; V399-Y407 HydrophobicContact CG1-CD1 4.12Å; V399-Y407 HydrophobicContact CG1-CD2 3.75Å; V399-Y407 HydrophobicContact CG1-CE1 4.2Å; V399-Y407 HydrophobicContact CG1-CE2 3.85Å; V399-Y407 HydrophobicContact CG1-CG 3.9Å; V399-Y407 HydrophobicContact CG2-CE1 4.24Å; V399-Y407 HydrophobicContact CG2-CE2 3.97Å
400	D	91.4	Very high	91.4	Very high	73 Å²	73	78.4 Å²	78.4	39%	0.39	39%	0.385	S	S	.	.			trans	-70.7	104.5	179.1	-176.3	-2.4	0	0	0	111.9	P398 T402 I403 V404	P398-D400 PolarHBondContact O-N 3.15Å; D400-T402 PolarHBondContact O-N 3.04Å; D400-T402 VanDerWaalsContact O-N 3.16Å; D400-T402 WeakPolarHBondContact OD1-CB 3.39Å; D400-T402 WeakPolarHBondContact OD1-CG2 3.41Å; D400-T402 PolarHBondContact OD1-N 3.11Å; D400-T402 PolarHBondContact OD1-OG1 3.09Å; D400-T402 PolarHBondContact OD2-OG1 3.25Å; D400-I403 HydrophobicContact CB-CD1 4.26Å; D400-I403 HydrophobicContact CB-CG1 4.44Å; D400-I403 PolarHBondContact O-N 2.75Å; D400-V404 WeakPolarHBondContact O-CB 3.4Å; D400-V404 PolarHBondContact O-N 2.79Å
401	S	87.2	Confident	91.7	Very high	35 Å²	35	75.9 Å²	75.9	25%	0.245	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-12.9	175.9	57.1	0	0	0	0	116	V399 K408	V399-S401 PolarHBondContact O-N 3.25Å; V399-S401 VanDerWaalsContact O-N 3.09Å; S401-K408 VanDerWaalsContact OG-CE 3.27Å; S401-K408 WeakPolarHBondContact OG-CE 3.28Å; S401-K408 PolarHBondContact OG-NZ 3.13Å
402	T	87	Confident	92	Very high	113 Å²	113	77.3 Å²	77.3	69%	0.693	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-34.5	175	72.6	0	0	0	0	111.5	D400	D400-T402 PolarHBondContact O-N 3.04Å; D400-T402 VanDerWaalsContact O-N 3.16Å; D400-T402 WeakPolarHBondContact OD1-CB 3.39Å; D400-T402 WeakPolarHBondContact OD1-CG2 3.41Å; D400-T402 PolarHBondContact OD1-N 3.11Å; D400-T402 PolarHBondContact OD1-OG1 3.09Å; D400-T402 PolarHBondContact OD2-OG1 3.25Å
403	I	89	Confident	92.1	Very high	134 Å²	134	80.7 Å²	80.7	69%	0.687	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-47.6	174	-58.8	173.2	0	0	0	109.5	D400 K405	D400-I403 HydrophobicContact CB-CD1 4.26Å; D400-I403 HydrophobicContact CB-CG1 4.44Å; D400-I403 PolarHBondContact O-N 2.75Å; I403-K405 PolarHBondContact O-N 2.69Å
404	V	89	Confident	92.3	Very high	44 Å²	44	76.5 Å²	76.5	27%	0.267	38%	0.381	S	S	.	.	S	Bend	trans	-95.8	86.1	-175.4	-170.7	0	0	0	0	110	V399 D400 Y407 F449	V399-V404 HydrophobicContact CG1-CB 3.88Å; V399-V404 HydrophobicContact CG1-CG1 4.11Å; V399-V404 HydrophobicContact CG1-CG2 3.78Å; D400-V404 WeakPolarHBondContact O-CB 3.4Å; D400-V404 PolarHBondContact O-N 2.79Å; V404-Y407 HydrophobicContact CG1-CD2 4.18Å; V404-Y407 HydrophobicContact CG1-CG 4.47Å; V404-Y407 WeakPolarHBondContact O-CB 3.29Å; V404-Y407 PolarHBondContact O-N 3.49Å; V404-F449 HydrophobicContact CG1-CD1 4.39Å; V404-F449 HydrophobicContact CG1-CE1 3.38Å; V404-F449 HydrophobicContact CG1-CE2 4.22Å; V404-F449 HydrophobicContact CG1-CZ 3.29Å
405	K	89.1	Confident	92.4	Very high	158 Å²	158	71.4 Å²	71.4	69%	0.687	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	149.2	177.3	-60.9	-177.3	-179.1	-179.6	0	111.8	I403 Y407	I403-K405 PolarHBondContact O-N 2.69Å; K405-Y407 PolarHBondContact O-N 3.05Å
406	H	89.3	Confident	92.5	Very high	108 Å²	108	70.9 Å²	70.9	50%	0.5	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	-0.2	179.5	-48.2	-70.7	0	0	0	116.4	K408 E409 L410	H406-K408 VanDerWaalsContact C-N 3.34Å; H406-K408 PolarHBondContact O-N 2.84Å; H406-E409 WeakPolarHBondContact CA-OE1 3.43Å; H406-E409 IonicContact CE1-OE1 2.79Å; H406-E409 IonicContact CE1-OE2 3.23Å; H406-E409 IonicContact CG-OE1 3.98Å; H406-E409 IonicContact CG-OE2 3.11Å; H406-E409 IonicContact ND1-OE1 2.79Å; H406-E409 PolarHBondContact ND1-OE1 3.17Å; H406-E409 IonicContact ND1-OE2 3.75Å; H406-E409 PolarHBondContact ND1-OE2 3.5Å; H406-E409 WeakPolarHBondContact O-CB 3.12Å; H406-E409 PolarHBondContact O-N 3.05Å; H406-L410 PolarHBondContact O-N 3.06Å
407	Y	93.5	Very high	92.6	Very high	17 Å²	17	69.7 Å²	69.7	7%	0.067	36%	0.355	C	S	.	.	H	α-helix	trans	-57.7	-44.5	-179.6	-169	-95.6	0	0	0	112.8	V399 V404 K405 E409 L410 I411 P414 F449	V399-Y407 HydrophobicContact CB-CD1 4.12Å; V399-Y407 HydrophobicContact CB-CD2 4.33Å; V399-Y407 HydrophobicContact CB-CE1 3.78Å; V399-Y407 HydrophobicContact CB-CE2 4.02Å; V399-Y407 HydrophobicContact CB-CG 4.38Å; V399-Y407 HydrophobicContact CG1-CD1 4.12Å; V399-Y407 HydrophobicContact CG1-CD2 3.75Å; V399-Y407 HydrophobicContact CG1-CE1 4.2Å; V399-Y407 HydrophobicContact CG1-CE2 3.85Å; V399-Y407 HydrophobicContact CG1-CG 3.9Å; V399-Y407 HydrophobicContact CG2-CE1 4.24Å; V399-Y407 HydrophobicContact CG2-CE2 3.97Å; V404-Y407 HydrophobicContact CG1-CD2 4.18Å; V404-Y407 HydrophobicContact CG1-CG 4.47Å; V404-Y407 WeakPolarHBondContact O-CB 3.29Å; V404-Y407 PolarHBondContact O-N 3.49Å; K405-Y407 PolarHBondContact O-N 3.05Å; Y407-E409 VanDerWaalsContact C-N 3.26Å; Y407-E409 PolarHBondContact O-N 3.45Å; Y407-L410 PolarHBondContact O-N 2.94Å; Y407-I411 HydrophobicContact CD1-CB 4.23Å; Y407-I411 HydrophobicContact CD1-CG1 4.49Å; Y407-I411 HydrophobicContact CD2-CG1 4.17Å; Y407-I411 HydrophobicContact CE1-CB 3.87Å; Y407-I411 HydrophobicContact CE1-CG1 4.16Å; Y407-I411 HydrophobicContact CE1-CG2 3.9Å; Y407-I411 HydrophobicContact CE2-CB 4.44Å; Y407-I411 HydrophobicContact CE2-CG1 3.81Å; Y407-I411 HydrophobicContact CG-CG1 4.49Å; Y407-I411 WeakPolarHBondContact O-CB 3.16Å; Y407-I411 PolarHBondContact O-N 3.41Å; Y407-P414 HydrophobicContact CE1-CB 4.32Å; Y407-F449 HydrophobicContact CD2-CB 4.3Å; Y407-F449 AromaticContact CD2-CD1 3.97Å; Y407-F449 HydrophobicContact CD2-CD1 3.97Å; Y407-F449 AromaticContact CD2-CD2 3.55Å; Y407-F449 HydrophobicContact CD2-CD2 3.55Å; Y407-F449 HydrophobicContact CD2-CE1 4.25Å; Y407-F449 AromaticContact CD2-CE2 3.87Å; Y407-F449 HydrophobicContact CD2-CE2 3.87Å; Y407-F449 AromaticContact CD2-CG 3.63Å; Y407-F449 HydrophobicContact CD2-CG 3.63Å; Y407-F449 HydrophobicContact CD2-CZ 4.21Å; Y407-F449 HydrophobicContact CE2-CB 4.15Å; Y407-F449 HydrophobicContact CE2-CD1 4.32Å; Y407-F449 HydrophobicContact CE2-CD2 4.25Å; Y407-F449 AromaticContact CE2-CG 3.95Å; Y407-F449 HydrophobicContact CE2-CG 3.95Å; Y407-F449 HydrophobicContact CG-CD2 4.37Å; Y407-F449 HydrophobicContact CG-CE2 4.43Å
408	K	91.5	Very high	92.7	Very high	156 Å²	156	68.4 Å²	68.4	68%	0.678	35%	0.349	S	S	*	.	H	α-helix	trans	-73.4	-11.7	177.5	-75.8	174.2	172.6	160.5	0	114.6	S401 H406	S401-K408 VanDerWaalsContact OG-CE 3.27Å; S401-K408 WeakPolarHBondContact OG-CE 3.28Å; S401-K408 PolarHBondContact OG-NZ 3.13Å; H406-K408 VanDerWaalsContact C-N 3.34Å; H406-K408 PolarHBondContact O-N 2.84Å
409	E	91.4	Very high	92.7	Very high	134 Å²	134	66.7 Å²	66.7	63%	0.626	34%	0.337	S	S	*	.	H	α-helix	trans	-86.5	-23.9	175.6	-65.7	157.3	-129.9	0	0	111.3	H406 Y407	H406-E409 WeakPolarHBondContact CA-OE1 3.43Å; H406-E409 IonicContact CE1-OE1 2.79Å; H406-E409 IonicContact CE1-OE2 3.23Å; H406-E409 IonicContact CG-OE1 3.98Å; H406-E409 IonicContact CG-OE2 3.11Å; H406-E409 IonicContact ND1-OE1 2.79Å; H406-E409 PolarHBondContact ND1-OE1 3.17Å; H406-E409 IonicContact ND1-OE2 3.75Å; H406-E409 PolarHBondContact ND1-OE2 3.5Å; H406-E409 WeakPolarHBondContact O-CB 3.12Å; H406-E409 PolarHBondContact O-N 3.05Å; Y407-E409 VanDerWaalsContact C-N 3.26Å; Y407-E409 PolarHBondContact O-N 3.45Å
410	L	92.6	Very high	92.8	Very high	58 Å²	58	64.2 Å²	64.2	30%	0.304	32%	0.322	S	S	.	.	H	α-helix	trans	-105.7	-32.6	-179.8	-57.9	176.3	0	0	0	113	Y312 H406 Y407 I448 F449	Y312-L410 WeakPolarHBondContact CE2-O 3.44Å; Y312-L410 WeakPolarHBondContact OH-CD2 3.43Å; H406-L410 PolarHBondContact O-N 3.06Å; Y407-L410 PolarHBondContact O-N 2.94Å; L410-I448 HydrophobicContact CB-CG2 4.46Å; L410-F449 HydrophobicContact CD1-CD2 3.95Å; L410-F449 HydrophobicContact CD1-CE2 4.24Å
411	I	95.6	Very high	93	Very high	5 Å²	5	61.7 Å²	61.7	3%	0.026	31%	0.307	C	S	.	.			trans	-113.2	97.1	-172.2	-53.9	-56	0	0	0	110.7	Y407 N445 I448 F449	Y407-I411 HydrophobicContact CD1-CB 4.23Å; Y407-I411 HydrophobicContact CD1-CG1 4.49Å; Y407-I411 HydrophobicContact CD2-CG1 4.17Å; Y407-I411 HydrophobicContact CE1-CB 3.87Å; Y407-I411 HydrophobicContact CE1-CG1 4.16Å; Y407-I411 HydrophobicContact CE1-CG2 3.9Å; Y407-I411 HydrophobicContact CE2-CB 4.44Å; Y407-I411 HydrophobicContact CE2-CG1 3.81Å; Y407-I411 HydrophobicContact CG-CG1 4.49Å; Y407-I411 WeakPolarHBondContact O-CB 3.16Å; Y407-I411 PolarHBondContact O-N 3.41Å; I411-N445 HydrophobicContact CD1-CB 3.97Å; I411-N445 HydrophobicContact CG1-CB 4.45Å; I411-N445 HydrophobicContact CG2-CB 4.03Å; I411-N445 VanDerWaalsContact CG2-CG 3.45Å; I411-I448 HydrophobicContact CD1-CB 3.89Å; I411-I448 HydrophobicContact CD1-CD1 4.46Å; I411-I448 HydrophobicContact CD1-CG2 3.71Å; I411-F449 HydrophobicContact CD1-CB 4.37Å; I411-F449 HydrophobicContact CG1-CB 4.35Å
412	K	93.5	Very high	93.4	Very high	56 Å²	56	62.6 Å²	62.6	24%	0.243	31%	0.313	C	S	.	.	S	Bend	trans	-73	-29.5	177.3	-59.1	-175	-173.5	-175.3	0	113.6	E308 S309 D311 P414	E308-K412 HydrophobicContact CG-CD 4.14Å; E308-K412 VanDerWaalsContact OE1-CD 3.32Å; E308-K412 WeakPolarHBondContact OE1-CD 3.32Å; E308-K412 WeakPolarHBondContact OE1-CE 3.26Å; E308-K412 IonicContact OE1-NZ 3.74Å; E308-K412 PolarHBondContact OE1-NZ 3.4Å; S309-K412 WeakPolarHBondContact O-CD 3.5Å; S309-K412 PolarHBondContact O-NZ 3.22Å; D311-K412 IonicContact OD1-NZ 3.38Å; D311-K412 PolarHBondContact OD1-NZ 2.94Å; D311-K412 WeakPolarHBondContact OD2-CE 3.46Å; D311-K412 IonicContact OD2-NZ 3.79Å; D311-K412 PolarHBondContact OD2-NZ 2.87Å; K412-P414 VanDerWaalsContact C-CD 3.45Å; K412-P414 VanDerWaalsContact O-CD 3.26Å; K412-P414 WeakPolarHBondContact O-CD 3.44Å
413	Y	94.6	Very high	93.8	Very high	71 Å²	71	60.7 Å²	60.7	28%	0.278	29%	0.293	S	S	.	.	S	Bend	trans	-120.9	71.2	-173.7	-73.3	-78.3	0	0	0	111.8	E308 P329 W441 N445	E308-Y413 WeakPolarHBondContact O-CE2 3.42Å; E308-Y413 PolarHBondContact O-OH 3.27Å; P329-Y413 HydrophobicContact CB-CD2 3.89Å; P329-Y413 HydrophobicContact CB-CE1 4.25Å; P329-Y413 HydrophobicContact CB-CE2 3.25Å; P329-Y413 VanDerWaalsContact CB-CZ 3.48Å; P329-Y413 HydrophobicContact CG-CD1 4.11Å; P329-Y413 HydrophobicContact CG-CD2 3.93Å; P329-Y413 HydrophobicContact CG-CE1 3.79Å; P329-Y413 HydrophobicContact CG-CE2 3.61Å; P329-Y413 HydrophobicContact CG-CG 4.19Å; Y413-W441 HydrophobicContact CD2-CH2 4Å; Y413-W441 HydrophobicContact CD2-CZ2 4.42Å; Y413-W441 HydrophobicContact CD2-CZ3 4.36Å; Y413-W441 HydrophobicContact CG-CH2 4.14Å; Y413-W441 HydrophobicContact CG-CZ2 4.24Å; Y413-W441 HydrophobicContact CG-CZ3 4.36Å; Y413-N445 PolarHBondContact O-ND2 3Å
414	P	96.1	Very high	94.1	Very high	75 Å²	75	54.4 Å²	54.4	49%	0.487	26%	0.261	S	S	.	.			trans	-62.6	142.7	176.3	28	-35.5	0	0	0	111.5	Y407 K412	Y407-P414 HydrophobicContact CE1-CB 4.32Å; K412-P414 VanDerWaalsContact C-CD 3.45Å; K412-P414 VanDerWaalsContact O-CD 3.26Å; K412-P414 WeakPolarHBondContact O-CD 3.44Å
415	I	96.5	Very high	94.3	Very high	12 Å²	12	57.3 Å²	57.3	6%	0.062	27%	0.27	C	S	.	.			trans	-151	157.6	175.4	-160.2	69.7	0	0	0	109	T419 L420 W441 I442	I415-T419 HydrophobicContact CD1-CG2 3.7Å; I415-L420 HydrophobicContact CD1-CD2 3.98Å; I415-L420 HydrophobicContact CD1-CG 4.36Å; I415-L420 HydrophobicContact CG1-CD2 3.93Å; I415-L420 HydrophobicContact CG1-CG 4.08Å; I415-W441 HydrophobicContact CB-CB 4.07Å; I415-W441 VanDerWaalsContact CG2-C 3.44Å; I415-W441 HydrophobicContact CG2-CB 3.32Å; I415-I442 HydrophobicContact CG2-CB 4.27Å; I415-I442 HydrophobicContact CG2-CG1 3.54Å; I415-I442 VanDerWaalsContact CG2-N 3.26Å
416	D	97.2	Very high	94.5	Very high	5 Å²	5	53 Å²	53	3%	0.027	26%	0.26	C	S	.	.			trans	-164.2	169.6	-178.8	59.2	88.7	0	0	0	109	E397 P398 H418 T419 L420	E397-D416 WeakPolarHBondContact O-CB 3.24Å; P398-D416 WeakPolarHBondContact CA-OD2 3.5Å; P398-D416 WeakPolarHBondContact CG-OD2 3.48Å; P398-D416 VanDerWaalsContact N-CG 3.32Å; D416-H418 PolarHBondContact O-N 3.48Å; D416-H418 WeakPolarHBondContact OD1-CA 3.4Å; D416-H418 WeakPolarHBondContact OD1-CB 3.43Å; D416-H418 PolarHBondContact OD1-N 3.21Å; D416-T419 VanDerWaalsContact CG-OG1 3.31Å; D416-T419 PolarHBondContact O-N 3.25Å; D416-T419 PolarHBondContact OD1-N 3.35Å; D416-T419 PolarHBondContact OD1-OG1 3.04Å; D416-T419 VanDerWaalsContact OD2-CB 3.25Å; D416-T419 WeakPolarHBondContact OD2-CB 3.42Å; D416-T419 PolarHBondContact OD2-OG1 2.9Å; D416-L420 WeakPolarHBondContact O-CG 3.36Å; D416-L420 PolarHBondContact O-N 2.79Å
417	L	96.8	Very high	94.6	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-67.5	-31.3	-175.2	-62.6	168.7	0	0	0	112.9	L383 A392 F395 L420 Y421 F439 I442 L463 L501	L383-L417 HydrophobicContact CD2-CB 4.44Å; L383-L417 HydrophobicContact CD2-CD2 3.8Å; A392-L417 HydrophobicContact CB-CD1 4.1Å; F395-L417 WeakPolarHBondContact O-CB 3.44Å; F395-L417 VanDerWaalsContact O-CG 3.28Å; F395-L417 WeakPolarHBondContact O-CG 3.49Å; F395-L417 PolarHBondContact O-N 2.81Å; L417-L420 HydrophobicContact CD2-CD1 4.33Å; L417-Y421 VanDerWaalsContact O-CB 3.31Å; L417-Y421 WeakPolarHBondContact O-CB 3.4Å; L417-Y421 PolarHBondContact O-N 3.2Å; L417-F439 HydrophobicContact CD2-CE2 4.43Å; L417-I442 HydrophobicContact CD2-CD1 4.05Å; L417-I442 HydrophobicContact CG-CD1 4.43Å; L417-L463 HydrophobicContact CD2-CD1 4.36Å; L417-L501 HydrophobicContact CB-CD1 4.25Å; L417-L501 HydrophobicContact CB-CD2 4.09Å
418	H	95	Very high	94.6	Very high	58 Å²	58	53.1 Å²	53.1	27%	0.269	27%	0.271	S	S	.	.	H	α-helix	trans	-73.3	-37.3	175.4	-178.2	-85.3	0	0	0	112.1	R396 E397 D416 Y421 S422	R396-H418 WeakPolarHBondContact O-CB 3.35Å; R396-H418 PolarHBondContact O-N 3.39Å; E397-H418 IonicContact OE2-CG 2.79Å; D416-H418 PolarHBondContact O-N 3.48Å; D416-H418 WeakPolarHBondContact OD1-CA 3.4Å; D416-H418 WeakPolarHBondContact OD1-CB 3.43Å; D416-H418 PolarHBondContact OD1-N 3.21Å; H418-Y421 WeakPolarHBondContact O-CB 3.34Å; H418-Y421 PolarHBondContact O-N 3.49Å; H418-S422 WeakPolarHBondContact O-CB 3.42Å; H418-S422 PolarHBondContact O-N 3.16Å; H418-S422 PolarHBondContact O-OG 3.43Å
419	T	96.4	Very high	94.7	Very high	36 Å²	36	46.5 Å²	46.5	22%	0.221	24%	0.242	C	C	.	.	H	α-helix	trans	-64.6	-43.8	170.7	-64.6	0	0	0	0	110.8	I415 D416 Y421 S422 R423	I415-T419 HydrophobicContact CD1-CG2 3.7Å; D416-T419 VanDerWaalsContact CG-OG1 3.31Å; D416-T419 PolarHBondContact O-N 3.25Å; D416-T419 PolarHBondContact OD1-N 3.35Å; D416-T419 PolarHBondContact OD1-OG1 3.04Å; D416-T419 VanDerWaalsContact OD2-CB 3.25Å; D416-T419 WeakPolarHBondContact OD2-CB 3.42Å; D416-T419 PolarHBondContact OD2-OG1 2.9Å; T419-Y421 PolarHBondContact O-N 3.02Å; T419-S422 WeakPolarHBondContact O-CB 3.38Å; T419-S422 PolarHBondContact O-N 3.31Å; T419-R423 WeakPolarHBondContact O-CG 3.23Å; T419-R423 PolarHBondContact O-N 2.99Å
420	L	97.2	Very high	94.5	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-59.4	-44.9	172.6	-69.4	176.5	0	0	0	111.6	L383 I415 D416 L417 S422 R423 V424 Y429 F435 D438 F439 I442	L383-L420 HydrophobicContact CD1-CB 4.22Å; L383-L420 HydrophobicContact CD2-CB 3.86Å; L383-L420 HydrophobicContact CD2-CD1 4.11Å; I415-L420 HydrophobicContact CD1-CD2 3.98Å; I415-L420 HydrophobicContact CD1-CG 4.36Å; I415-L420 HydrophobicContact CG1-CD2 3.93Å; I415-L420 HydrophobicContact CG1-CG 4.08Å; D416-L420 WeakPolarHBondContact O-CG 3.36Å; D416-L420 PolarHBondContact O-N 2.79Å; L417-L420 HydrophobicContact CD2-CD1 4.33Å; L420-S422 VanDerWaalsContact C-N 3.33Å; L420-S422 PolarHBondContact O-N 3.43Å; L420-R423 PolarHBondContact O-N 2.69Å; L420-V424 WeakPolarHBondContact O-CG2 3.48Å; L420-V424 PolarHBondContact O-N 3.24Å; L420-Y429 WeakPolarHBondContact CD2-OH 3.47Å; L420-F435 HydrophobicContact CB-CE2 4.23Å; L420-F435 HydrophobicContact CB-CZ 4.44Å; L420-F435 HydrophobicContact CD1-CZ 4.18Å; L420-F435 HydrophobicContact CD2-CE2 4.46Å; L420-D438 HydrophobicContact CD2-CB 3.88Å; L420-F439 HydrophobicContact CD1-CB 4.26Å; L420-F439 HydrophobicContact CD1-CD2 3.83Å; L420-I442 HydrophobicContact CD1-CD1 3.9Å
421	Y	95.2	Very high	94.4	Very high	20 Å²	20	40.4 Å²	40.4	8%	0.078	22%	0.222	C	C	.	.	H	α-helix	trans	-58.7	-43.3	175.8	-178.5	-90	0	0	0	112.1	F380 L383 L417 H418 T419 R423 V424 K425 L501 T502 E505	F380-Y421 AromaticContact CD1-CD2 3.58Å; F380-Y421 HydrophobicContact CD1-CD2 3.58Å; F380-Y421 AromaticContact CD1-CE2 3.41Å; F380-Y421 HydrophobicContact CD1-CE2 3.41Å; F380-Y421 VanDerWaalsContact CD1-CE2 3.41Å; F380-Y421 HydrophobicContact CD1-CG 4.43Å; F380-Y421 AromaticContact CE1-CD2 3.79Å; F380-Y421 HydrophobicContact CE1-CD2 3.79Å; F380-Y421 HydrophobicContact CE1-CE1 4.35Å; F380-Y421 AromaticContact CE1-CE2 3.59Å; F380-Y421 HydrophobicContact CE1-CE2 3.59Å; F380-Y421 HydrophobicContact CE1-CG 4.25Å; F380-Y421 AromaticContact CE1-CZ 3.89Å; F380-Y421 HydrophobicContact CG-CE2 4.42Å; L383-Y421 HydrophobicContact CD1-CD2 4.42Å; L417-Y421 VanDerWaalsContact O-CB 3.31Å; L417-Y421 WeakPolarHBondContact O-CB 3.4Å; L417-Y421 PolarHBondContact O-N 3.2Å; H418-Y421 WeakPolarHBondContact O-CB 3.34Å; H418-Y421 PolarHBondContact O-N 3.49Å; T419-Y421 PolarHBondContact O-N 3.02Å; Y421-R423 PolarHBondContact O-N 2.99Å; Y421-V424 PolarHBondContact O-N 3.02Å; Y421-K425 PolarHBondContact O-N 2.99Å; Y421-L501 HydrophobicContact CD2-CD1 4.43Å; Y421-T502 HydrophobicContact CD1-CG2 4.04Å; Y421-T502 HydrophobicContact CE1-CG2 3.68Å; Y421-T502 PolarHBondContact OH-OG1 3.02Å; Y421-E505 WeakPolarHBondContact OH-CB 3.5Å
422	S	94.8	Very high	94.2	Very high	54 Å²	54	40.7 Å²	40.7	38%	0.378	22%	0.223	S	C	.	.	H	α-helix	trans	-61	-43.3	176	-58.7	0	0	0	0	111.9	H418 T419 L420 K425 S426	H418-S422 WeakPolarHBondContact O-CB 3.42Å; H418-S422 PolarHBondContact O-N 3.16Å; H418-S422 PolarHBondContact O-OG 3.43Å; T419-S422 WeakPolarHBondContact O-CB 3.38Å; T419-S422 PolarHBondContact O-N 3.31Å; L420-S422 VanDerWaalsContact C-N 3.33Å; L420-S422 PolarHBondContact O-N 3.43Å; S422-K425 PolarHBondContact O-N 3.38Å; S422-S426 PolarHBondContact O-N 3.28Å; S422-S426 PolarHBondContact O-OG 3.17Å
423	R	95.9	Very high	94.1	Very high	74 Å²	74	38.8 Å²	38.8	28%	0.279	22%	0.215	S	C	.	.	H	α-helix	trans	-68.4	-30.4	176	-69.4	-164.8	171.9	143.3	14.1	114.2	T419 L420 Y421 S426 G427 E428 Y429 D438	T419-R423 WeakPolarHBondContact O-CG 3.23Å; T419-R423 PolarHBondContact O-N 2.99Å; L420-R423 PolarHBondContact O-N 2.69Å; Y421-R423 PolarHBondContact O-N 2.99Å; R423-S426 WeakPolarHBondContact CA-OG 3.45Å; R423-S426 PolarHBondContact O-OG 3.16Å; R423-G427 PolarHBondContact O-N 2.94Å; R423-E428 HydrophobicContact CB-CB 4.39Å; R423-E428 WeakPolarHBondContact CD-OE2 3.34Å; R423-E428 WeakPolarHBondContact CG-OE2 3.43Å; R423-E428 IonicContact NE-OE2 3.66Å; R423-E428 PolarHBondContact NE-OE2 2.87Å; R423-E428 PolarHBondContact O-N 2.96Å; R423-E428 VanDerWaalsContact O-N 3.08Å; R423-Y429 HydrophobicContact CB-CD2 4.25Å; R423-Y429 HydrophobicContact CB-CE2 3.37Å; R423-Y429 WeakPolarHBondContact CB-OH 3.39Å; R423-Y429 VanDerWaalsContact CD-OH 3.3Å; R423-Y429 WeakPolarHBondContact CD-OH 3.45Å; R423-D438 IonicContact CZ-OD2 3.91Å; R423-D438 IonicContact NH1-OD2 3.81Å; R423-D438 PolarHBondContact NH1-OD2 3.24Å
424	V	95.6	Very high	94	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.012	21%	0.21	C	C	.	.	H	α-helix	trans	-69	-41.1	169.5	176.9	0	0	0	0	110.2	K376 L379 F380 L383 L420 Y421 G427 Y429 F435	K376-V424 HydrophobicContact CB-CG1 4.25Å; K376-V424 WeakPolarHBondContact CD-O 3.46Å; K376-V424 WeakPolarHBondContact CE-O 3.35Å; K376-V424 HydrophobicContact CG-CG1 4.29Å; K376-V424 PolarHBondContact NZ-O 3.33Å; L379-V424 HydrophobicContact CB-CG1 3.88Å; L379-V424 HydrophobicContact CB-CG2 3.83Å; L379-V424 HydrophobicContact CD1-CG2 4.1Å; F380-V424 HydrophobicContact CD1-CB 4.18Å; F380-V424 HydrophobicContact CD1-CG1 3.69Å; F380-V424 HydrophobicContact CD2-CG1 4.1Å; F380-V424 HydrophobicContact CE1-CB 3.88Å; F380-V424 HydrophobicContact CE1-CG1 3.61Å; F380-V424 HydrophobicContact CE2-CG1 4.02Å; F380-V424 HydrophobicContact CG-CG1 3.95Å; F380-V424 HydrophobicContact CZ-CB 4.36Å; F380-V424 HydrophobicContact CZ-CG1 3.8Å; L383-V424 HydrophobicContact CD1-CG2 4.01Å; L420-V424 WeakPolarHBondContact O-CG2 3.48Å; L420-V424 PolarHBondContact O-N 3.24Å; Y421-V424 PolarHBondContact O-N 3.02Å; V424-G427 PolarHBondContact O-N 3.45Å; V424-Y429 HydrophobicContact CG2-CD2 3.82Å; V424-Y429 HydrophobicContact CG2-CE2 3.88Å; V424-F435 HydrophobicContact CG2-CD2 3.95Å; V424-F435 HydrophobicContact CG2-CE2 3.71Å
425	K	92.6	Very high	94	Very high	104 Å²	104	32.8 Å²	32.8	45%	0.452	19%	0.187	S	C	.	.	H	α-helix	trans	-65	-47.6	179.2	-170.5	159.8	176.6	166	0	112.4	K376 F380 Y421 S422 E505	K376-K425 PolarHBondContact NZ-O 2.85Å; F380-K425 HydrophobicContact CE1-CB 4.19Å; F380-K425 HydrophobicContact CZ-CB 3.86Å; F380-K425 HydrophobicContact CZ-CG 4.36Å; Y421-K425 PolarHBondContact O-N 2.99Å; S422-K425 PolarHBondContact O-N 3.38Å; K425-E505 IonicContact NZ-OE1 3.02Å; K425-E505 PolarHBondContact NZ-OE1 3.29Å
426	S	93.3	Very high	94	Very high	69 Å²	69	32.3 Å²	32.3	48%	0.483	18%	0.184	S	C	.	.	H	α-helix	trans	-58.9	-46.9	169.4	60.4	0	0	0	0	111	K376 S422 R423 E428	K376-S426 PolarHBondContact NZ-O 2.65Å; S422-S426 PolarHBondContact O-N 3.28Å; S422-S426 PolarHBondContact O-OG 3.17Å; R423-S426 WeakPolarHBondContact CA-OG 3.45Å; R423-S426 PolarHBondContact O-OG 3.16Å; S426-E428 WeakPolarHBondContact CB-OE1 3.33Å; S426-E428 PolarHBondContact OG-OE1 2.97Å
427	G	91.3	Very high	93.8	Very high	34 Å²	34	32.2 Å²	32.2	35%	0.351	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	97.2	34.2	-177.1	0	0	0	0	0	113.6	R423 V424 Y429	R423-G427 PolarHBondContact O-N 2.94Å; V424-G427 PolarHBondContact O-N 3.45Å; G427-Y429 PolarHBondContact O-N 2.98Å
428	E	93.3	Very high	93.8	Very high	92 Å²	92	33.8 Å²	33.8	43%	0.43	19%	0.193	S	C	.	.			trans	-63.8	-24.5	174.9	-75.7	156.4	-114.7	0	0	112.5	I296 R423 S426 A430	I296-E428 VanDerWaalsContact CD1-O 3.29Å; I296-E428 WeakPolarHBondContact CD1-O 3.48Å; R423-E428 HydrophobicContact CB-CB 4.39Å; R423-E428 WeakPolarHBondContact CD-OE2 3.34Å; R423-E428 WeakPolarHBondContact CG-OE2 3.43Å; R423-E428 IonicContact NE-OE2 3.66Å; R423-E428 PolarHBondContact NE-OE2 2.87Å; R423-E428 PolarHBondContact O-N 2.96Å; R423-E428 VanDerWaalsContact O-N 3.08Å; S426-E428 WeakPolarHBondContact CB-OE1 3.33Å; S426-E428 PolarHBondContact OG-OE1 2.97Å; E428-A430 PolarHBondContact O-N 3.46Å
429	Y	93.9	Very high	93.9	Very high	18 Å²	18	31.1 Å²	31.1	7%	0.071	18%	0.181	C	C	.	.			trans	-83.8	100.9	178.9	-55.5	-59.7	0	0	0	112.3	L420 R423 V424 G427 S431 A434 F435 D438	L420-Y429 WeakPolarHBondContact CD2-OH 3.47Å; R423-Y429 HydrophobicContact CB-CD2 4.25Å; R423-Y429 HydrophobicContact CB-CE2 3.37Å; R423-Y429 WeakPolarHBondContact CB-OH 3.39Å; R423-Y429 VanDerWaalsContact CD-OH 3.3Å; R423-Y429 WeakPolarHBondContact CD-OH 3.45Å; V424-Y429 HydrophobicContact CG2-CD2 3.82Å; V424-Y429 HydrophobicContact CG2-CE2 3.88Å; G427-Y429 PolarHBondContact O-N 2.98Å; Y429-S431 VanDerWaalsContact C-N 3.32Å; Y429-A434 HydrophobicContact CD1-CB 4.03Å; Y429-F435 HydrophobicContact CD1-CB 4.1Å; Y429-F435 HydrophobicContact CD2-CB 4.39Å; Y429-F435 AromaticContact CD2-CD2 3.69Å; Y429-F435 HydrophobicContact CD2-CD2 3.69Å; Y429-F435 HydrophobicContact CE1-CB 4.43Å; Y429-F435 AromaticContact CE2-CD2 3.54Å; Y429-F435 HydrophobicContact CE2-CD2 3.54Å; Y429-F435 HydrophobicContact CE2-CE2 4.13Å; Y429-F435 HydrophobicContact CG-CB 4.07Å; Y429-F435 HydrophobicContact CG-CD2 4.23Å; Y429-D438 HydrophobicContact CE1-CB 3.92Å; Y429-D438 WeakPolarHBondContact CE1-OD2 3.49Å; Y429-D438 PolarHBondContact OH-OD2 3.18Å
430	A	87.9	Confident	93.9	Very high	54 Å²	54	31.6 Å²	31.6	45%	0.446	18%	0.178	S	C	.	.	S	Bend	trans	-71.8	-25.7	171.3	0	0	0	0	0	112.9	E358 E428	E358-A430 HydrophobicContact CG-CB 4.3Å; E428-A430 PolarHBondContact O-N 3.46Å
431	S	89.6	Confident	93.9	Very high	9 Å²	9	32.1 Å²	32.1	6%	0.063	18%	0.18	C	C	.	.	S	Bend	trans	-136.1	160.9	175.9	64.4	0	0	0	0	113.8	E358 Y429 Q433 A434 F435	E358-S431 VanDerWaalsContact CG-CB 3.44Å; E358-S431 WeakPolarHBondContact CG-OG 3.02Å; E358-S431 VanDerWaalsContact OE1-CB 3.32Å; E358-S431 WeakPolarHBondContact OE1-CB 3.48Å; E358-S431 PolarHBondContact OE1-N 3.38Å; E358-S431 PolarHBondContact OE1-OG 3.26Å; Y429-S431 VanDerWaalsContact C-N 3.32Å; S431-Q433 PolarHBondContact O-N 3.19Å; S431-Q433 PolarHBondContact OG-N 2.88Å; S431-A434 PolarHBondContact O-N 3.12Å; S431-A434 PolarHBondContact OG-N 2.83Å; S431-A434 VanDerWaalsContact OG-N 3.08Å; S431-F435 PolarHBondContact O-N 3.41Å
432	L	91.4	Very high	94.1	Very high	12 Å²	12	31.4 Å²	31.4	6%	0.063	18%	0.178	C	C	.	.	H	α-helix	trans	-59.7	-28.5	168.5	178.9	59.9	0	0	0	112.4	W367 L375 L379 L436 F471 M474 R475	W367-L432 HydrophobicContact CH2-CB 4.17Å; W367-L432 HydrophobicContact CH2-CD2 3.64Å; W367-L432 HydrophobicContact CH2-CG 4.45Å; W367-L432 HydrophobicContact CZ2-CD2 3.61Å; W367-L432 HydrophobicContact CZ3-CB 4.45Å; L375-L432 HydrophobicContact CD1-CB 4.41Å; L379-L432 HydrophobicContact CD2-CD1 3.85Å; L432-L436 PolarHBondContact O-N 3.37Å; L432-L436 VanDerWaalsContact O-N 3.08Å; L432-F471 HydrophobicContact CD1-CD2 3.77Å; L432-F471 HydrophobicContact CD1-CE2 3.43Å; L432-F471 VanDerWaalsContact CD1-CE2 3.43Å; L432-F471 HydrophobicContact CD1-CZ 4.29Å; L432-F471 HydrophobicContact CD2-CD2 4.36Å; L432-F471 HydrophobicContact CD2-CE2 3.93Å; L432-F471 HydrophobicContact CD2-CZ 4.05Å; L432-F471 HydrophobicContact CG-CD2 4.1Å; L432-F471 HydrophobicContact CG-CE2 3.39Å; L432-F471 HydrophobicContact CG-CZ 3.75Å; L432-M474 HydrophobicContact CD1-CE 4.42Å; L432-M474 HydrophobicContact CD1-SD 3.6Å; L432-M474 HydrophobicContact CD2-CG 4.41Å; L432-M474 HydrophobicContact CD2-SD 3.92Å; L432-M474 HydrophobicContact CG-SD 4.38Å; L432-R475 HydrophobicContact CD2-CB 4.27Å
433	Q	91.1	Very high	94.2	Very high	15 Å²	15	30.2 Å²	30.2	7%	0.07	17%	0.167	C	C	.	.	H	α-helix	trans	-75.5	-34.5	178.4	-171.2	66.8	23.9	0	0	112.1	D353 V354 A357 S431 F435 L436 G437	D353-Q433 HydrophobicContact CB-CG 3.88Å; V354-Q433 HydrophobicContact CB-CG 4.38Å; V354-Q433 HydrophobicContact CG2-CB 4.19Å; V354-Q433 HydrophobicContact CG2-CG 3.71Å; A357-Q433 HydrophobicContact CB-CB 3.74Å; S431-Q433 PolarHBondContact O-N 3.19Å; S431-Q433 PolarHBondContact OG-N 2.88Å; Q433-F435 VanDerWaalsContact C-N 3.31Å; Q433-F435 PolarHBondContact O-N 2.74Å; Q433-L436 WeakPolarHBondContact O-CB 3.13Å; Q433-L436 PolarHBondContact O-N 2.97Å; Q433-G437 PolarHBondContact O-N 3.09Å
434	A	93.5	Very high	94.3	Very high	21 Å²	21	26.9 Å²	26.9	17%	0.174	16%	0.155	C	C	.	.	H	α-helix	trans	-60.7	-42.7	171.6	0	0	0	0	0	111	V354 Y429 S431 G437 D438	V354-A434 HydrophobicContact CG1-CB 4.48Å; Y429-A434 HydrophobicContact CD1-CB 4.03Å; S431-A434 PolarHBondContact O-N 3.12Å; S431-A434 PolarHBondContact OG-N 2.83Å; S431-A434 VanDerWaalsContact OG-N 3.08Å; A434-G437 PolarHBondContact O-N 2.87Å; A434-D438 PolarHBondContact O-N 3.09Å
435	F	96.4	Very high	94.4	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61	-43.4	172.9	-175.2	-82.7	0	0	0	112.5	L379 L382 L383 L420 V424 Y429 S431 Q433 G437 D438 F439 F467	L379-F435 HydrophobicContact CD1-CB 4.34Å; L379-F435 HydrophobicContact CD1-CD2 3.97Å; L379-F435 HydrophobicContact CD1-CG 4.3Å; L379-F435 HydrophobicContact CD2-CB 4.12Å; L379-F435 HydrophobicContact CD2-CD1 3.91Å; L379-F435 HydrophobicContact CD2-CD2 3.81Å; L379-F435 HydrophobicContact CD2-CE1 4.3Å; L379-F435 HydrophobicContact CD2-CE2 4.19Å; L379-F435 HydrophobicContact CD2-CG 3.66Å; L379-F435 HydrophobicContact CD2-CZ 4.43Å; L379-F435 HydrophobicContact CG-CD2 4.36Å; L382-F435 HydrophobicContact CD2-CE1 4.23Å; L383-F435 HydrophobicContact CD1-CE2 4.09Å; L383-F435 HydrophobicContact CD1-CZ 4.23Å; L383-F435 HydrophobicContact CD2-CE2 4.5Å; L383-F435 HydrophobicContact CD2-CZ 3.92Å; L383-F435 HydrophobicContact CG-CE2 4.33Å; L383-F435 HydrophobicContact CG-CZ 3.98Å; L420-F435 HydrophobicContact CB-CE2 4.23Å; L420-F435 HydrophobicContact CB-CZ 4.44Å; L420-F435 HydrophobicContact CD1-CZ 4.18Å; L420-F435 HydrophobicContact CD2-CE2 4.46Å; V424-F435 HydrophobicContact CG2-CD2 3.95Å; V424-F435 HydrophobicContact CG2-CE2 3.71Å; Y429-F435 HydrophobicContact CD1-CB 4.1Å; Y429-F435 HydrophobicContact CD2-CB 4.39Å; Y429-F435 AromaticContact CD2-CD2 3.69Å; Y429-F435 HydrophobicContact CD2-CD2 3.69Å; Y429-F435 HydrophobicContact CE1-CB 4.43Å; Y429-F435 AromaticContact CE2-CD2 3.54Å; Y429-F435 HydrophobicContact CE2-CD2 3.54Å; Y429-F435 HydrophobicContact CE2-CE2 4.13Å; Y429-F435 HydrophobicContact CG-CB 4.07Å; Y429-F435 HydrophobicContact CG-CD2 4.23Å; S431-F435 PolarHBondContact O-N 3.41Å; Q433-F435 VanDerWaalsContact C-N 3.31Å; Q433-F435 PolarHBondContact O-N 2.74Å; F435-G437 VanDerWaalsContact C-N 3.33Å; F435-G437 PolarHBondContact O-N 3.24Å; F435-D438 PolarHBondContact O-N 3.15Å; F435-F439 HydrophobicContact CD1-CB 4.41Å; F435-F439 HydrophobicContact CE1-CB 4.15Å; F435-F439 HydrophobicContact CE1-CD2 4.35Å; F435-F439 WeakPolarHBondContact O-CB 3.38Å; F435-F439 PolarHBondContact O-N 3.29Å; F435-F467 HydrophobicContact CD1-CE2 4.14Å; F435-F467 AromaticContact CE1-CE2 3.8Å; F435-F467 HydrophobicContact CE1-CE2 3.8Å
436	L	95.2	Very high	94.6	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-59.2	-43.9	176.3	174.6	60.1	0	0	0	112.1	L432 Q433 D438 F439 R440 F467 F471	L432-L436 PolarHBondContact O-N 3.37Å; L432-L436 VanDerWaalsContact O-N 3.08Å; Q433-L436 WeakPolarHBondContact O-CB 3.13Å; Q433-L436 PolarHBondContact O-N 2.97Å; L436-D438 VanDerWaalsContact C-N 3.27Å; L436-D438 PolarHBondContact O-N 3.23Å; L436-F439 PolarHBondContact O-N 3.12Å; L436-R440 HydrophobicContact CD1-CG 4.14Å; L436-R440 WeakPolarHBondContact O-CG 3Å; L436-R440 PolarHBondContact O-N 3.37Å; L436-R440 VanDerWaalsContact O-N 3.12Å; L436-F467 HydrophobicContact CD1-CE1 3.39Å; L436-F467 HydrophobicContact CD1-CZ 3.56Å; L436-F471 HydrophobicContact CB-CE2 3.72Å; L436-F471 HydrophobicContact CB-CZ 3.85Å; L436-F471 HydrophobicContact CD1-CE2 4.42Å; L436-F471 HydrophobicContact CD2-CE1 4.03Å; L436-F471 HydrophobicContact CD2-CE2 4.3Å; L436-F471 HydrophobicContact CD2-CZ 3.67Å; L436-F471 HydrophobicContact CG-CE2 4.38Å; L436-F471 HydrophobicContact CG-CZ 4.22Å
437	G	94	Very high	94.8	Very high	3 Å²	3	20.1 Å²	20.1	3%	0.031	12%	0.118	C	C	.	.	H	α-helix	trans	-59.2	-39.4	178.1	0	0	0	0	0	112.4	R330 Q433 A434 F435	R330-G437 PolarHBondContact NH2-O 3.4Å; Q433-G437 PolarHBondContact O-N 3.09Å; A434-G437 PolarHBondContact O-N 2.87Å; F435-G437 VanDerWaalsContact C-N 3.33Å; F435-G437 PolarHBondContact O-N 3.24Å
438	D	96.2	Very high	95.1	Very high	33 Å²	33	19.8 Å²	19.8	18%	0.176	11%	0.108	C	C	.	.	H	α-helix	trans	-76	-43.4	177.6	-88.1	12.1	0	0	0	112.8	L420 R423 Y429 A434 F435 L436 R440 W441	L420-D438 HydrophobicContact CD2-CB 3.88Å; R423-D438 IonicContact CZ-OD2 3.91Å; R423-D438 IonicContact NH1-OD2 3.81Å; R423-D438 PolarHBondContact NH1-OD2 3.24Å; Y429-D438 HydrophobicContact CE1-CB 3.92Å; Y429-D438 WeakPolarHBondContact CE1-OD2 3.49Å; Y429-D438 PolarHBondContact OH-OD2 3.18Å; A434-D438 PolarHBondContact O-N 3.09Å; F435-D438 PolarHBondContact O-N 3.15Å; L436-D438 VanDerWaalsContact C-N 3.27Å; L436-D438 PolarHBondContact O-N 3.23Å; D438-R440 VanDerWaalsContact C-N 3.26Å; D438-R440 PolarHBondContact O-N 2.98Å; D438-W441 WeakPolarHBondContact O-CB 3.33Å; D438-W441 PolarHBondContact O-N 3.37Å; D438-W441 VanDerWaalsContact O-N 3.14Å
439	F	97.7	Very high	95.3	Very high	2 Å²	2	18 Å²	18	1%	0.009	10%	0.099	C	C	.	.	H	α-helix	trans	-54.9	-41.1	176.7	177.2	-86.1	0	0	0	112.5	L386 L417 L420 F435 L436 W441 I442 L463 F467	L386-F439 HydrophobicContact CD1-CE2 4.13Å; L417-F439 HydrophobicContact CD2-CE2 4.43Å; L420-F439 HydrophobicContact CD1-CB 4.26Å; L420-F439 HydrophobicContact CD1-CD2 3.83Å; F435-F439 HydrophobicContact CD1-CB 4.41Å; F435-F439 HydrophobicContact CE1-CB 4.15Å; F435-F439 HydrophobicContact CE1-CD2 4.35Å; F435-F439 WeakPolarHBondContact O-CB 3.38Å; F435-F439 PolarHBondContact O-N 3.29Å; L436-F439 PolarHBondContact O-N 3.12Å; F439-W441 PolarHBondContact O-N 3.1Å; F439-W441 VanDerWaalsContact O-N 3.15Å; F439-I442 HydrophobicContact CD2-CD1 4.1Å; F439-I442 HydrophobicContact CE2-CD1 4.13Å; F439-I442 WeakPolarHBondContact O-CB 3.45Å; F439-I442 WeakPolarHBondContact O-CG1 3.17Å; F439-I442 PolarHBondContact O-N 3.17Å; F439-L463 HydrophobicContact CE2-CD1 3.96Å; F439-L463 HydrophobicContact CE2-CG 4.3Å; F439-L463 HydrophobicContact CZ-CD1 3.88Å; F439-L463 HydrophobicContact CZ-CG 3.87Å; F439-F467 HydrophobicContact CB-CE2 4.39Å; F439-F467 HydrophobicContact CB-CZ 4.24Å; F439-F467 AromaticContact CD1-CD1 3.46Å; F439-F467 HydrophobicContact CD1-CD1 3.46Å; F439-F467 VanDerWaalsContact CD1-CD1 3.46Å; F439-F467 HydrophobicContact CD1-CD2 4.15Å; F439-F467 AromaticContact CD1-CE1 3.49Å; F439-F467 HydrophobicContact CD1-CE1 3.49Å; F439-F467 VanDerWaalsContact CD1-CE1 3.49Å; F439-F467 HydrophobicContact CD1-CE2 4.18Å; F439-F467 AromaticContact CD1-CG 3.8Å; F439-F467 HydrophobicContact CD1-CG 3.8Å; F439-F467 AromaticContact CD1-CZ 3.86Å; F439-F467 HydrophobicContact CD1-CZ 3.86Å; F439-F467 AromaticContact CD2-CD2 3.86Å; F439-F467 HydrophobicContact CD2-CD2 3.86Å; F439-F467 HydrophobicContact CD2-CE2 4.1Å; F439-F467 HydrophobicContact CD2-CG 4.12Å; F439-F467 HydrophobicContact CE1-CB 3.74Å; F439-F467 AromaticContact CE1-CD1 3.2Å; F439-F467 HydrophobicContact CE1-CD1 3.2Å; F439-F467 HydrophobicContact CE1-CD2 4.1Å; F439-F467 AromaticContact CE1-CE1 3.76Å; F439-F467 HydrophobicContact CE1-CE1 3.76Å; F439-F467 AromaticContact CE1-CG 3.39Å; F439-F467 HydrophobicContact CE1-CG 3.39Å; F439-F467 HydrophobicContact CE1-CZ 4.41Å; F439-F467 HydrophobicContact CE2-CB 3.85Å; F439-F467 HydrophobicContact CE2-CD1 4.36Å; F439-F467 AromaticContact CE2-CD2 3.78Å; F439-F467 HydrophobicContact CE2-CD2 3.78Å; F439-F467 HydrophobicContact CE2-CE2 4.47Å; F439-F467 AromaticContact CE2-CG 3.72Å; F439-F467 HydrophobicContact CE2-CG 3.72Å; F439-F467 HydrophobicContact CG-CD1 4.17Å; F439-F467 HydrophobicContact CG-CD2 4.05Å; F439-F467 HydrophobicContact CG-CE1 4.07Å; F439-F467 AromaticContact CG-CE2 3.94Å; F439-F467 HydrophobicContact CG-CE2 3.94Å; F439-F467 HydrophobicContact CG-CG 4.16Å; F439-F467 AromaticContact CG-CZ 3.94Å; F439-F467 HydrophobicContact CG-CZ 3.94Å; F439-F467 HydrophobicContact CZ-CB 3.28Å; F439-F467 AromaticContact CZ-CD1 3.7Å; F439-F467 HydrophobicContact CZ-CD1 3.7Å; F439-F467 AromaticContact CZ-CD2 3.91Å; F439-F467 HydrophobicContact CZ-CD2 3.91Å; F439-F467 AromaticContact CZ-CG 3.34Å; F439-F467 HydrophobicContact CZ-CG 3.34Å
440	R	96.4	Very high	95.4	Very high	47 Å²	47	19.7 Å²	19.7	18%	0.177	11%	0.109	C	C	.	.	H	α-helix	trans	-60.7	-22.8	-179.2	-80.9	178.6	169.7	165.8	3	114.7	W314 E350 L436 D438 I442 L443 H444 H468	W314-R440 HydrophobicContact CH2-CB 3.91Å; W314-R440 HydrophobicContact CZ2-CB 3.54Å; E350-R440 VanDerWaalsContact CD-NH1 3.33Å; E350-R440 WeakPolarHBondContact OE1-CD 3.48Å; E350-R440 IonicContact OE1-CZ 2.76Å; E350-R440 IonicContact OE1-NE 3.4Å; E350-R440 IonicContact OE1-NH1 2.76Å; E350-R440 PolarHBondContact OE1-NH1 2.77Å; E350-R440 IonicContact OE2-NH1 2.69Å; E350-R440 PolarHBondContact OE2-NH1 3.23Å; E350-R440 VanDerWaalsContact OE2-NH1 3.11Å; L436-R440 HydrophobicContact CD1-CG 4.14Å; L436-R440 WeakPolarHBondContact O-CG 3Å; L436-R440 PolarHBondContact O-N 3.37Å; L436-R440 VanDerWaalsContact O-N 3.12Å; D438-R440 VanDerWaalsContact C-N 3.26Å; D438-R440 PolarHBondContact O-N 2.98Å; R440-I442 PolarHBondContact O-N 3.15Å; R440-L443 PolarHBondContact O-N 2.85Å; R440-H444 PolarHBondContact O-N 3.48Å; R440-H444 VanDerWaalsContact O-N 3.16Å; R440-H468 PolarHBondContact NH2-CE1 2.94Å; R440-H468 PolarHBondContact NH2-NE2 2.97Å
441	W	97.7	Very high	95.8	Very high	10 Å²	10	18.5 Å²	18.5	4%	0.038	10%	0.102	C	C	.	.	H	α-helix	trans	-61.1	-26.9	172.9	-75.6	102.8	0	0	0	112.1	D310 W314 P329 R330 Y413 I415 D438 F439 H444 N445	D310-W441 HydrophobicContact CB-CH2 4.03Å; D310-W441 HydrophobicContact CB-CZ3 4.46Å; D310-W441 WeakPolarHBondContact OD2-CZ3 3.33Å; W314-W441 HydrophobicContact CE3-CH2 4.32Å; W314-W441 HydrophobicContact CE3-CZ2 4.34Å; W314-W441 HydrophobicContact CE3-CZ3 4.49Å; W314-W441 AromaticContact CH2-CD1 3.8Å; W314-W441 AromaticContact CH2-CD2 3.8Å; W314-W441 HydrophobicContact CH2-CD2 3.8Å; W314-W441 AromaticContact CH2-CE2 3.74Å; W314-W441 HydrophobicContact CH2-CE3 4.46Å; W314-W441 AromaticContact CH2-CG 3.81Å; W314-W441 HydrophobicContact CH2-CG 3.81Å; W314-W441 HydrophobicContact CH2-CZ2 4.3Å; W314-W441 AromaticContact CH2-NE1 3.77Å; W314-W441 AromaticContact CZ3-CD2 3.46Å; W314-W441 HydrophobicContact CZ3-CD2 3.46Å; W314-W441 VanDerWaalsContact CZ3-CD2 3.46Å; W314-W441 AromaticContact CZ3-CE2 3.45Å; W314-W441 VanDerWaalsContact CZ3-CE2 3.45Å; W314-W441 AromaticContact CZ3-CE3 3.71Å; W314-W441 HydrophobicContact CZ3-CE3 3.71Å; W314-W441 AromaticContact CZ3-CG 3.97Å; W314-W441 HydrophobicContact CZ3-CG 3.97Å; W314-W441 AromaticContact CZ3-CH2 3.87Å; W314-W441 HydrophobicContact CZ3-CH2 3.87Å; W314-W441 AromaticContact CZ3-CZ2 3.67Å; W314-W441 HydrophobicContact CZ3-CZ2 3.67Å; W314-W441 AromaticContact CZ3-CZ3 3.9Å; W314-W441 HydrophobicContact CZ3-CZ3 3.9Å; W314-W441 AromaticContact CZ3-NE1 3.99Å; P329-W441 HydrophobicContact CG-CZ2 4.01Å; R330-W441 HydrophobicContact CG-CH2 4.33Å; R330-W441 HydrophobicContact CG-CZ2 3.7Å; Y413-W441 HydrophobicContact CD2-CH2 4Å; Y413-W441 HydrophobicContact CD2-CZ2 4.42Å; Y413-W441 HydrophobicContact CD2-CZ3 4.36Å; Y413-W441 HydrophobicContact CG-CH2 4.14Å; Y413-W441 HydrophobicContact CG-CZ2 4.24Å; Y413-W441 HydrophobicContact CG-CZ3 4.36Å; I415-W441 HydrophobicContact CB-CB 4.07Å; I415-W441 VanDerWaalsContact CG2-C 3.44Å; I415-W441 HydrophobicContact CG2-CB 3.32Å; D438-W441 WeakPolarHBondContact O-CB 3.33Å; D438-W441 PolarHBondContact O-N 3.37Å; D438-W441 VanDerWaalsContact O-N 3.14Å; F439-W441 PolarHBondContact O-N 3.1Å; F439-W441 VanDerWaalsContact O-N 3.15Å; W441-H444 AromaticContact CE3-CD2 3.6Å; W441-H444 AromaticContact CH2-NE2 3.99Å; W441-H444 AromaticContact CZ3-CD2 3.53Å; W441-H444 AromaticContact CZ3-NE2 3.35Å; W441-H444 VanDerWaalsContact CZ3-NE2 3.35Å; W441-H444 WeakPolarHBondContact CZ3-NE2 3.24Å; W441-N445 WeakPolarHBondContact O-CB 3.45Å; W441-N445 PolarHBondContact O-N 3.33Å; W441-N445 PolarHBondContact O-ND2 3.49Å; W441-N445 VanDerWaalsContact O-ND2 3.15Å
442	I	97.8	Very high	96	Very high	6 Å²	6	20.7 Å²	20.7	3%	0.031	12%	0.121	C	C	.	.	H	α-helix	trans	-59.7	-52	178	-60.8	172	0	0	0	110.2	F395 I415 L417 L420 F439 R440 C446 L463	F395-I442 HydrophobicContact CB-CG2 4.04Å; F395-I442 HydrophobicContact CD1-CG2 3.66Å; F395-I442 HydrophobicContact CE1-CG2 4.36Å; F395-I442 HydrophobicContact CG-CG2 3.87Å; I415-I442 HydrophobicContact CG2-CB 4.27Å; I415-I442 HydrophobicContact CG2-CG1 3.54Å; I415-I442 VanDerWaalsContact CG2-N 3.26Å; L417-I442 HydrophobicContact CD2-CD1 4.05Å; L417-I442 HydrophobicContact CG-CD1 4.43Å; L420-I442 HydrophobicContact CD1-CD1 3.9Å; F439-I442 HydrophobicContact CD2-CD1 4.1Å; F439-I442 HydrophobicContact CE2-CD1 4.13Å; F439-I442 WeakPolarHBondContact O-CB 3.45Å; F439-I442 WeakPolarHBondContact O-CG1 3.17Å; F439-I442 PolarHBondContact O-N 3.17Å; R440-I442 PolarHBondContact O-N 3.15Å; I442-C446 WeakPolarHBondContact O-CB 3.42Å; I442-C446 PolarHBondContact O-N 2.85Å; I442-L463 HydrophobicContact CD1-CD2 4.27Å; I442-L463 HydrophobicContact CG2-CD2 3.85Å
443	L	97.3	Very high	96.1	Very high	28 Å²	28	24.8 Å²	24.8	15%	0.147	15%	0.151	C	C	.	.	H	α-helix	trans	-71.4	-41.5	-178.3	-179.1	60.2	0	0	0	111.8	R440 C446 I447 A460 R461 D464	R440-L443 PolarHBondContact O-N 2.85Å; L443-C446 PolarHBondContact O-N 2.78Å; L443-I447 HydrophobicContact CD1-CD1 3.87Å; L443-I447 HydrophobicContact CD1-CG1 4.1Å; L443-I447 HydrophobicContact CG-CD1 3.83Å; L443-I447 HydrophobicContact CG-CG1 4.47Å; L443-I447 VanDerWaalsContact O-CG1 3.29Å; L443-I447 WeakPolarHBondContact O-CG1 3.45Å; L443-I447 PolarHBondContact O-N 2.79Å; L443-A460 HydrophobicContact CD1-CB 3.69Å; L443-R461 HydrophobicContact CD1-CG 4.07Å; L443-D464 HydrophobicContact CD2-CB 3.94Å
444	H	97.9	Very high	96.3	Very high	4 Å²	4	25.4 Å²	25.4	2%	0.019	16%	0.157	C	C	.	.	H	α-helix	trans	-58.2	-53.4	177.1	178.1	85.7	0	0	0	111.5	D310 Y312 C313 W314 H317 R440 W441 C446 I447 I448	D310-H444 IonicContact OD1-NE2 3.67Å; D310-H444 PolarHBondContact OD1-NE2 2.96Å; D310-H444 IonicContact OD2-CD2 3.74Å; D310-H444 IonicContact OD2-CE1 3.69Å; D310-H444 CovalentContact OD2-NE2 1.73Å; D310-H444 IonicContact OD2-NE2 3.32Å; D310-H444 PolarHBondContact OD2-NE2 2.85Å; Y312-H444 PolarHBondContact O-CE1 3.34Å; C313-H444 PolarHBondContact O-CE1 3.02Å; W314-H444 WeakPolarHBondContact CA-CE1 3.32Å; W314-H444 HydrophobicContact CE3-CB 4.49Å; W314-H444 AromaticContact CE3-CG 3.94Å; W314-H444 AromaticContact CE3-ND1 3.81Å; W314-H444 HydrophobicContact CZ3-CB 4.16Å; W314-H444 AromaticContact CZ3-CD2 3.99Å; W314-H444 AromaticContact CZ3-CG 3.94Å; W314-H444 PolarHBondContact N-CE1 3.34Å; H317-H444 AromaticContact CE1-ND1 3.61Å; H317-H444 AromaticContact ND1-CG 3.68Å; H317-H444 AromaticContact ND1-ND1 2.9Å; H317-H444 PolarHBondContact ND1-ND1 3.25Å; R440-H444 PolarHBondContact O-N 3.48Å; R440-H444 VanDerWaalsContact O-N 3.16Å; W441-H444 AromaticContact CE3-CD2 3.6Å; W441-H444 AromaticContact CH2-NE2 3.99Å; W441-H444 AromaticContact CZ3-CD2 3.53Å; W441-H444 AromaticContact CZ3-NE2 3.35Å; W441-H444 VanDerWaalsContact CZ3-NE2 3.35Å; W441-H444 WeakPolarHBondContact CZ3-NE2 3.24Å; H444-C446 VanDerWaalsContact C-N 3.33Å; H444-C446 PolarHBondContact O-N 2.77Å; H444-I447 PolarHBondContact O-N 3.17Å; H444-I448 WeakPolarHBondContact O-CG1 3.04Å; H444-I448 PolarHBondContact O-N 3.29Å; H444-I448 VanDerWaalsContact O-N 3.07Å
445	N	97.8	Very high	96.4	Very high	4 Å²	4	28.6 Å²	28.6	2%	0.021	18%	0.177	C	C	.	.	H	α-helix	trans	-61.3	-40.9	176.7	-65.8	-18.3	0	0	0	111.9	I411 Y413 W441 I447 I448 F449	I411-N445 HydrophobicContact CD1-CB 3.97Å; I411-N445 HydrophobicContact CG1-CB 4.45Å; I411-N445 HydrophobicContact CG2-CB 4.03Å; I411-N445 VanDerWaalsContact CG2-CG 3.45Å; Y413-N445 PolarHBondContact O-ND2 3Å; W441-N445 WeakPolarHBondContact O-CB 3.45Å; W441-N445 PolarHBondContact O-N 3.33Å; W441-N445 PolarHBondContact O-ND2 3.49Å; W441-N445 VanDerWaalsContact O-ND2 3.15Å; N445-I447 PolarHBondContact O-N 2.86Å; N445-I448 PolarHBondContact O-N 2.87Å; N445-F449 WeakPolarHBondContact O-CB 3.32Å; N445-F449 PolarHBondContact O-N 3.4Å
446	C	97.6	Very high	96.4	Very high	7 Å²	7	30.5 Å²	30.5	5%	0.047	19%	0.188	C	C	.	.	H	α-helix	trans	-62.5	-41.6	178.8	-173.2	0	0	0	0	111.9	F395 I442 L443 H444 N450 T457 A460	F395-C446 HydrophobicContact CE1-CB 4.3Å; I442-C446 WeakPolarHBondContact O-CB 3.42Å; I442-C446 PolarHBondContact O-N 2.85Å; L443-C446 PolarHBondContact O-N 2.78Å; H444-C446 VanDerWaalsContact C-N 3.33Å; H444-C446 PolarHBondContact O-N 2.77Å; C446-N450 VanDerWaalsContact O-CB 3.27Å; C446-N450 WeakPolarHBondContact O-CB 3.48Å; C446-N450 PolarHBondContact O-N 2.79Å; C446-N450 PolarHBondContact O-ND2 3.27Å; C446-T457 PolarHBondContact O-OG1 2.91Å; C446-T457 VanDerWaalsContact SG-CA 3.56Å; C446-A460 HydrophobicContact CB-CB 3.93Å
447	I	97.7	Very high	96.5	Very high	23 Å²	23	30.5 Å²	30.5	12%	0.118	19%	0.187	C	C	.	.	H	α-helix	trans	-67	-42.7	177.5	-67.8	165.1	0	0	0	111.1	H317 L443 H444 N445 G451 A452 T457	H317-I447 HydrophobicContact CB-CB 4.13Å; H317-I447 HydrophobicContact CB-CG2 3.55Å; H317-I447 VanDerWaalsContact CD2-CD1 3.44Å; H317-I447 WeakPolarHBondContact CD2-CD1 2.98Å; L443-I447 HydrophobicContact CD1-CD1 3.87Å; L443-I447 HydrophobicContact CD1-CG1 4.1Å; L443-I447 HydrophobicContact CG-CD1 3.83Å; L443-I447 HydrophobicContact CG-CG1 4.47Å; L443-I447 VanDerWaalsContact O-CG1 3.29Å; L443-I447 WeakPolarHBondContact O-CG1 3.45Å; L443-I447 PolarHBondContact O-N 2.79Å; H444-I447 PolarHBondContact O-N 3.17Å; N445-I447 PolarHBondContact O-N 2.86Å; I447-G451 CarbonylContact O-C 3.59Å; I447-G451 WeakPolarHBondContact O-CA 3.47Å; I447-G451 PolarHBondContact O-N 3.17Å; I447-A452 HydrophobicContact CG2-CB 4.31Å; I447-T457 HydrophobicContact CB-CG2 4.5Å; I447-T457 HydrophobicContact CG1-CG2 3.53Å
448	I	97.3	Very high	96.6	Very high	26 Å²	26	33.4 Å²	33.4	13%	0.133	21%	0.207	C	C	.	.	H	α-helix	trans	-62.7	-52.2	178.8	-67.6	161.3	0	0	0	110.6	Y312 H317 L410 I411 H444 N445	Y312-I448 VanDerWaalsContact CB-CD1 3.48Å; Y312-I448 HydrophobicContact CD1-CD1 4.17Å; Y312-I448 HydrophobicContact CD1-CG1 3.92Å; Y312-I448 HydrophobicContact CD1-CG2 4.01Å; Y312-I448 HydrophobicContact CD2-CD1 3.83Å; Y312-I448 HydrophobicContact CD2-CG1 4.36Å; Y312-I448 HydrophobicContact CD2-CG2 4.05Å; Y312-I448 HydrophobicContact CE1-CG2 3.81Å; Y312-I448 HydrophobicContact CE2-CG2 3.86Å; Y312-I448 HydrophobicContact CG-CD1 3.55Å; Y312-I448 HydrophobicContact CG-CG1 3.84Å; Y312-I448 HydrophobicContact CG-CG2 4.15Å; H317-I448 HydrophobicContact CB-CG1 4.15Å; L410-I448 HydrophobicContact CB-CG2 4.46Å; I411-I448 HydrophobicContact CD1-CB 3.89Å; I411-I448 HydrophobicContact CD1-CD1 4.46Å; I411-I448 HydrophobicContact CD1-CG2 3.71Å; H444-I448 WeakPolarHBondContact O-CG1 3.04Å; H444-I448 PolarHBondContact O-N 3.29Å; H444-I448 VanDerWaalsContact O-N 3.07Å; N445-I448 PolarHBondContact O-N 2.87Å
449	F	97.1	Very high	96.6	Very high	56 Å²	56	33 Å²	33	25%	0.246	21%	0.207	C	C	.	.	H	α-helix	trans	-77.1	-38.2	-172.8	-170.3	-95	0	0	0	113.7	V404 Y407 L410 I411 N445	V404-F449 HydrophobicContact CG1-CD1 4.39Å; V404-F449 HydrophobicContact CG1-CE1 3.38Å; V404-F449 HydrophobicContact CG1-CE2 4.22Å; V404-F449 HydrophobicContact CG1-CZ 3.29Å; Y407-F449 HydrophobicContact CD2-CB 4.3Å; Y407-F449 AromaticContact CD2-CD1 3.97Å; Y407-F449 HydrophobicContact CD2-CD1 3.97Å; Y407-F449 AromaticContact CD2-CD2 3.55Å; Y407-F449 HydrophobicContact CD2-CD2 3.55Å; Y407-F449 HydrophobicContact CD2-CE1 4.25Å; Y407-F449 AromaticContact CD2-CE2 3.87Å; Y407-F449 HydrophobicContact CD2-CE2 3.87Å; Y407-F449 AromaticContact CD2-CG 3.63Å; Y407-F449 HydrophobicContact CD2-CG 3.63Å; Y407-F449 HydrophobicContact CD2-CZ 4.21Å; Y407-F449 HydrophobicContact CE2-CB 4.15Å; Y407-F449 HydrophobicContact CE2-CD1 4.32Å; Y407-F449 HydrophobicContact CE2-CD2 4.25Å; Y407-F449 AromaticContact CE2-CG 3.95Å; Y407-F449 HydrophobicContact CE2-CG 3.95Å; Y407-F449 HydrophobicContact CG-CD2 4.37Å; Y407-F449 HydrophobicContact CG-CE2 4.43Å; L410-F449 HydrophobicContact CD1-CD2 3.95Å; L410-F449 HydrophobicContact CD1-CE2 4.24Å; I411-F449 HydrophobicContact CD1-CB 4.37Å; I411-F449 HydrophobicContact CG1-CB 4.35Å; N445-F449 WeakPolarHBondContact O-CB 3.32Å; N445-F449 PolarHBondContact O-N 3.4Å
450	N	96.2	Very high	96.5	Very high	52 Å²	52	32.9 Å²	32.9	28%	0.278	21%	0.207	S	C	.	.	H	α-helix	trans	-102.2	-10.7	-173.3	-54.7	-93.1	0	0	0	113.5	C446 S454	C446-N450 VanDerWaalsContact O-CB 3.27Å; C446-N450 WeakPolarHBondContact O-CB 3.48Å; C446-N450 PolarHBondContact O-N 2.79Å; C446-N450 PolarHBondContact O-ND2 3.27Å; N450-S454 WeakPolarHBondContact O-CB 3.42Å
451	G	95.4	Very high	96.5	Very high	29 Å²	29	34.1 Å²	34.1	30%	0.299	21%	0.211	S	C	.	.			trans	77.4	152.1	-172.1	0	0	0	0	0	113.6	I447 S453 S454 T457	I447-G451 CarbonylContact O-C 3.59Å; I447-G451 WeakPolarHBondContact O-CA 3.47Å; I447-G451 PolarHBondContact O-N 3.17Å; G451-S453 PolarHBondContact O-N 2.84Å; G451-S453 VanDerWaalsContact O-N 3.09Å; G451-S454 PolarHBondContact O-N 3.4Å; G451-T457 WeakPolarHBondContact O-CB 3.49Å; G451-T457 PolarHBondContact O-OG1 2.87Å
452	A	94.1	Very high	96.3	Very high	56 Å²	56	37.1 Å²	37.1	46%	0.463	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-16.7	-173.3	0	0	0	0	0	115	I447 R461	I447-A452 HydrophobicContact CG2-CB 4.31Å; A452-R461 VanDerWaalsContact O-CZ 3.29Å; A452-R461 PolarHBondContact O-NH1 3.12Å; A452-R461 PolarHBondContact O-NH2 2.84Å
453	S	93.4	Very high	96.1	Very high	98 Å²	98	36.9 Å²	36.9	69%	0.685	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-1.9	-178.7	49.7	0	0	0	0	114.8	G451	G451-S453 PolarHBondContact O-N 2.84Å; G451-S453 VanDerWaalsContact O-N 3.09Å
454	S	96.1	Very high	95.9	Very high	28 Å²	28	36.8 Å²	36.8	20%	0.196	23%	0.226	C	C	.	.			trans	-68.2	146.8	-179.1	170.1	0	0	0	0	113.2	N450 G451 I456 T457 S458	N450-S454 WeakPolarHBondContact O-CB 3.42Å; G451-S454 PolarHBondContact O-N 3.4Å; S454-I456 PolarHBondContact O-N 2.96Å; S454-I456 PolarHBondContact OG-N 3.38Å; S454-I456 VanDerWaalsContact OG-N 3.14Å; S454-T457 CarbonylContact O-C 3.58Å; S454-T457 WeakPolarHBondContact O-CA 3.26Å; S454-T457 WeakPolarHBondContact O-CB 3.25Å; S454-T457 PolarHBondContact O-N 3.38Å; S454-T457 VanDerWaalsContact O-N 3.07Å; S454-S458 PolarHBondContact O-N 3.33Å; S454-S458 PolarHBondContact O-OG 2.85Å
455	S	95.6	Very high	95.6	Very high	87 Å²	87	39.8 Å²	39.8	61%	0.608	24%	0.237	S	C	*	.	H	α-helix	trans	-62.1	-29.9	171.7	52.5	0	0	0	0	113.1	S458 S459	S455-S458 PolarHBondContact O-N 2.82Å; S455-S459 PolarHBondContact O-N 2.83Å; S455-S459 PolarHBondContact O-OG 3.1Å
456	I	95.8	Very high	95.2	Very high	41 Å²	41	41.3 Å²	41.3	21%	0.21	25%	0.247	C	C	.	.	H	α-helix	trans	-67.1	-44.7	171.6	-57.2	177.2	0	0	0	108.8	Y394 F395 S454 S458 S459 A460	Y394-I456 HydrophobicContact CD1-CD1 4.31Å; Y394-I456 HydrophobicContact CD1-CG1 4.31Å; Y394-I456 HydrophobicContact CD1-CG2 4.45Å; Y394-I456 HydrophobicContact CD2-CG2 4.31Å; Y394-I456 HydrophobicContact CE1-CD1 4.28Å; Y394-I456 HydrophobicContact CE1-CG1 4.18Å; Y394-I456 HydrophobicContact CE2-CG1 4.43Å; Y394-I456 HydrophobicContact CG-CG1 4.5Å; Y394-I456 HydrophobicContact CG-CG2 4.04Å; F395-I456 HydrophobicContact CE1-CG2 4.03Å; F395-I456 HydrophobicContact CZ-CG2 3.82Å; S454-I456 PolarHBondContact O-N 2.96Å; S454-I456 PolarHBondContact OG-N 3.38Å; S454-I456 VanDerWaalsContact OG-N 3.14Å; I456-S458 VanDerWaalsContact C-N 3.32Å; I456-S458 PolarHBondContact O-N 3.15Å; I456-S459 CarbonylContact O-C 3.54Å; I456-S459 WeakPolarHBondContact O-CA 3.48Å; I456-S459 VanDerWaalsContact O-CB 3.27Å; I456-S459 WeakPolarHBondContact O-CB 3.46Å; I456-S459 PolarHBondContact O-N 3.09Å; I456-A460 PolarHBondContact O-N 3.34Å
457	T	97.1	Very high	95	Very high	0 Å²	0	41 Å²	41	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.6	-34.2	174.8	-51	0	0	0	0	112.8	C446 I447 G451 S454 S459 A460 R461	C446-T457 PolarHBondContact O-OG1 2.91Å; C446-T457 VanDerWaalsContact SG-CA 3.56Å; I447-T457 HydrophobicContact CB-CG2 4.5Å; I447-T457 HydrophobicContact CG1-CG2 3.53Å; G451-T457 WeakPolarHBondContact O-CB 3.49Å; G451-T457 PolarHBondContact O-OG1 2.87Å; S454-T457 CarbonylContact O-C 3.58Å; S454-T457 WeakPolarHBondContact O-CA 3.26Å; S454-T457 WeakPolarHBondContact O-CB 3.25Å; S454-T457 PolarHBondContact O-N 3.38Å; S454-T457 VanDerWaalsContact O-N 3.07Å; T457-S459 VanDerWaalsContact C-N 3.32Å; T457-A460 PolarHBondContact O-N 2.84Å; T457-R461 WeakPolarHBondContact O-CG 3.24Å; T457-R461 PolarHBondContact O-N 3.17Å
458	S	96	Very high	94.7	Very high	65 Å²	65	40.1 Å²	40.1	46%	0.455	24%	0.24	S	C	.	.	H	α-helix	trans	-65.5	-35.2	170.2	-63.3	0	0	0	0	112.4	S454 S455 I456 R461 L462	S454-S458 PolarHBondContact O-N 3.33Å; S454-S458 PolarHBondContact O-OG 2.85Å; S455-S458 PolarHBondContact O-N 2.82Å; I456-S458 VanDerWaalsContact C-N 3.32Å; I456-S458 PolarHBondContact O-N 3.15Å; S458-R461 PolarHBondContact O-N 2.98Å; S458-L462 PolarHBondContact O-N 3.4Å; S458-L462 VanDerWaalsContact O-N 3.13Å
459	S	95.9	Very high	94.1	Very high	23 Å²	23	44.3 Å²	44.3	16%	0.161	25%	0.254	C	S	.	.	H	α-helix	trans	-67.6	-39.8	171.7	-53.3	0	0	0	0	111.7	S455 I456 T457 R461 L462 L463	S455-S459 PolarHBondContact O-N 2.83Å; S455-S459 PolarHBondContact O-OG 3.1Å; I456-S459 CarbonylContact O-C 3.54Å; I456-S459 WeakPolarHBondContact O-CA 3.48Å; I456-S459 VanDerWaalsContact O-CB 3.27Å; I456-S459 WeakPolarHBondContact O-CB 3.46Å; I456-S459 PolarHBondContact O-N 3.09Å; T457-S459 VanDerWaalsContact C-N 3.32Å; S459-R461 PolarHBondContact O-N 3.14Å; S459-L462 PolarHBondContact O-N 3Å; S459-L463 PolarHBondContact O-N 3.49Å
460	A	96.6	Very high	93.7	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.008	25%	0.246	C	C	.	.	H	α-helix	trans	-63.4	-38.8	174.3	0	0	0	0	0	112.4	F395 L443 C446 I456 T457 L462 L463 D464	F395-A460 HydrophobicContact CE1-CB 4.03Å; F395-A460 HydrophobicContact CE2-CB 4.11Å; F395-A460 HydrophobicContact CZ-CB 3.56Å; L443-A460 HydrophobicContact CD1-CB 3.69Å; C446-A460 HydrophobicContact CB-CB 3.93Å; I456-A460 PolarHBondContact O-N 3.34Å; T457-A460 PolarHBondContact O-N 2.84Å; A460-L462 VanDerWaalsContact C-N 3.32Å; A460-L462 PolarHBondContact O-N 3.34Å; A460-L463 WeakPolarHBondContact O-CB 3.48Å; A460-L463 PolarHBondContact O-N 3.36Å; A460-D464 WeakPolarHBondContact O-CB 3.26Å; A460-D464 PolarHBondContact O-N 3.02Å
461	R	95.4	Very high	93.5	Very high	72 Å²	72	40.2 Å²	40.2	27%	0.272	23%	0.234	S	C	.	.	H	α-helix	trans	-64.8	-34.8	172.7	-72.5	178	-175.3	115	1.6	112.5	L443 A452 T457 S458 S459 R465	L443-R461 HydrophobicContact CD1-CG 4.07Å; A452-R461 VanDerWaalsContact O-CZ 3.29Å; A452-R461 PolarHBondContact O-NH1 3.12Å; A452-R461 PolarHBondContact O-NH2 2.84Å; T457-R461 WeakPolarHBondContact O-CG 3.24Å; T457-R461 PolarHBondContact O-N 3.17Å; S458-R461 PolarHBondContact O-N 2.98Å; S459-R461 PolarHBondContact O-N 3.14Å; R461-R465 WeakPolarHBondContact O-CB 3.33Å; R461-R465 WeakPolarHBondContact O-CG 3.48Å; R461-R465 PolarHBondContact O-N 2.99Å
462	L	93.3	Very high	93.1	Very high	73 Å²	73	40 Å²	40	38%	0.382	23%	0.226	S	C	.	.	H	α-helix	trans	-71.9	-37.2	176.5	-172.7	52.2	0	0	0	111.3	W391 S458 S459 A460 T466	W391-L462 HydrophobicContact CB-CD2 4.34Å; W391-L462 HydrophobicContact CD2-CB 4.46Å; W391-L462 HydrophobicContact CD2-CD2 4.33Å; W391-L462 HydrophobicContact CD2-CG 4.06Å; W391-L462 HydrophobicContact CG-CB 4.42Å; W391-L462 HydrophobicContact CG-CD2 3.74Å; W391-L462 HydrophobicContact CG-CG 3.99Å; W391-L462 HydrophobicContact CZ2-CG 4.46Å; S458-L462 PolarHBondContact O-N 3.4Å; S458-L462 VanDerWaalsContact O-N 3.13Å; S459-L462 PolarHBondContact O-N 3Å; A460-L462 VanDerWaalsContact C-N 3.32Å; A460-L462 PolarHBondContact O-N 3.34Å; L462-T466 VanDerWaalsContact O-CB 3.31Å; L462-T466 WeakPolarHBondContact O-CB 3.39Å; L462-T466 PolarHBondContact O-N 3.41Å; L462-T466 PolarHBondContact O-OG1 2.9Å
463	L	94.8	Very high	92.9	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-58.6	-52.1	168.2	166.1	59.8	0	0	0	111.5	L386 W391 F395 L417 F439 I442 S459 A460 T466 F467	L386-L463 HydrophobicContact CB-CD1 4.09Å; L386-L463 HydrophobicContact CD1-CD1 4.32Å; L386-L463 HydrophobicContact CD2-CD1 4.2Å; L386-L463 HydrophobicContact CG-CD1 4.43Å; W391-L463 HydrophobicContact CE3-CB 3.79Å; W391-L463 HydrophobicContact CH2-CB 4.49Å; W391-L463 HydrophobicContact CH2-CD1 4.47Å; W391-L463 HydrophobicContact CZ3-CB 3.56Å; W391-L463 HydrophobicContact CZ3-CD1 3.74Å; W391-L463 HydrophobicContact CZ3-CG 4.22Å; F395-L463 HydrophobicContact CB-CD2 3.92Å; F395-L463 HydrophobicContact CD2-CD2 3.62Å; F395-L463 HydrophobicContact CE2-CD2 4.41Å; F395-L463 HydrophobicContact CG-CD2 3.86Å; L417-L463 HydrophobicContact CD2-CD1 4.36Å; F439-L463 HydrophobicContact CE2-CD1 3.96Å; F439-L463 HydrophobicContact CE2-CG 4.3Å; F439-L463 HydrophobicContact CZ-CD1 3.88Å; F439-L463 HydrophobicContact CZ-CG 3.87Å; I442-L463 HydrophobicContact CD1-CD2 4.27Å; I442-L463 HydrophobicContact CG2-CD2 3.85Å; S459-L463 PolarHBondContact O-N 3.49Å; A460-L463 WeakPolarHBondContact O-CB 3.48Å; A460-L463 PolarHBondContact O-N 3.36Å; L463-T466 PolarHBondContact O-N 2.88Å; L463-F467 VanDerWaalsContact O-CB 3.3Å; L463-F467 WeakPolarHBondContact O-CB 3.18Å; L463-F467 PolarHBondContact O-N 2.78Å
464	D	93.8	Very high	92.8	Very high	26 Å²	26	33.2 Å²	33.2	14%	0.139	17%	0.174	C	C	.	.	H	α-helix	trans	-60.6	-48.9	179.1	-179.8	81.3	0	0	0	112.8	L443 A460 T466 F467 H468	L443-D464 HydrophobicContact CD2-CB 3.94Å; A460-D464 WeakPolarHBondContact O-CB 3.26Å; A460-D464 PolarHBondContact O-N 3.02Å; D464-T466 VanDerWaalsContact C-N 3.32Å; D464-T466 PolarHBondContact O-N 3.49Å; D464-F467 PolarHBondContact O-N 3.38Å; D464-H468 WeakPolarHBondContact O-CB 3.3Å; D464-H468 PolarHBondContact O-N 3Å; D464-H468 IonicContact OD1-CD2 3.57Å; D464-H468 IonicContact OD2-CD2 3.94Å
465	R	89.9	Confident	92.4	Very high	68 Å²	68	35.6 Å²	35.6	26%	0.257	18%	0.179	S	C	.	.	H	α-helix	trans	-59.9	-40.6	176.1	-71.4	171.2	-171	170.6	6.4	112.1	D214 R461 R469	D214-R465 VanDerWaalsContact CB-CZ 3.47Å; D214-R465 VanDerWaalsContact CG-NH2 3.34Å; D214-R465 IonicContact OD2-CZ 3.18Å; D214-R465 IonicContact OD2-NE 2.76Å; D214-R465 IonicContact OD2-NH2 2.83Å; D214-R465 PolarHBondContact OD2-NH2 2.94Å; R461-R465 WeakPolarHBondContact O-CB 3.33Å; R461-R465 WeakPolarHBondContact O-CG 3.48Å; R461-R465 PolarHBondContact O-N 2.99Å; R465-R469 WeakPolarHBondContact O-CG 3.45Å; R465-R469 PolarHBondContact O-N 3.44Å
466	T	89.9	Confident	92	Very high	36 Å²	36	33.1 Å²	33.1	22%	0.221	16%	0.164	C	C	.	.	H	α-helix	trans	-68.6	-46	178.5	-54.9	0	0	0	0	111.2	L386 W391 L462 L463 D464 H468 R469 E470	L386-T466 HydrophobicContact CD2-CG2 3.74Å; W391-T466 HydrophobicContact CH2-CG2 3.93Å; W391-T466 HydrophobicContact CZ2-CG2 3.95Å; W391-T466 VanDerWaalsContact CZ2-OG1 3.32Å; W391-T466 WeakPolarHBondContact CZ2-OG1 3.5Å; L462-T466 VanDerWaalsContact O-CB 3.31Å; L462-T466 WeakPolarHBondContact O-CB 3.39Å; L462-T466 PolarHBondContact O-N 3.41Å; L462-T466 PolarHBondContact O-OG1 2.9Å; L463-T466 PolarHBondContact O-N 2.88Å; D464-T466 VanDerWaalsContact C-N 3.32Å; D464-T466 PolarHBondContact O-N 3.49Å; T466-H468 PolarHBondContact O-N 2.86Å; T466-R469 PolarHBondContact O-N 2.91Å; T466-E470 PolarHBondContact O-N 2.88Å
467	F	94.1	Very high	91.8	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-57	-48.4	173.9	159	-95.5	0	0	0	111.2	L382 L386 F435 L436 F439 L463 D464 R469 E470 F471	L382-F467 HydrophobicContact CD1-CD2 4.38Å; L382-F467 HydrophobicContact CD2-CD2 3.92Å; L382-F467 HydrophobicContact CD2-CE2 3.85Å; L382-F467 HydrophobicContact CG-CD2 4.41Å; L386-F467 HydrophobicContact CD1-CB 3.83Å; L386-F467 HydrophobicContact CD1-CD2 4Å; L386-F467 HydrophobicContact CD1-CG 4.39Å; L386-F467 HydrophobicContact CD2-CB 4.03Å; F435-F467 HydrophobicContact CD1-CE2 4.14Å; F435-F467 AromaticContact CE1-CE2 3.8Å; F435-F467 HydrophobicContact CE1-CE2 3.8Å; L436-F467 HydrophobicContact CD1-CE1 3.39Å; L436-F467 HydrophobicContact CD1-CZ 3.56Å; F439-F467 HydrophobicContact CB-CE2 4.39Å; F439-F467 HydrophobicContact CB-CZ 4.24Å; F439-F467 AromaticContact CD1-CD1 3.46Å; F439-F467 HydrophobicContact CD1-CD1 3.46Å; F439-F467 VanDerWaalsContact CD1-CD1 3.46Å; F439-F467 HydrophobicContact CD1-CD2 4.15Å; F439-F467 AromaticContact CD1-CE1 3.49Å; F439-F467 HydrophobicContact CD1-CE1 3.49Å; F439-F467 VanDerWaalsContact CD1-CE1 3.49Å; F439-F467 HydrophobicContact CD1-CE2 4.18Å; F439-F467 AromaticContact CD1-CG 3.8Å; F439-F467 HydrophobicContact CD1-CG 3.8Å; F439-F467 AromaticContact CD1-CZ 3.86Å; F439-F467 HydrophobicContact CD1-CZ 3.86Å; F439-F467 AromaticContact CD2-CD2 3.86Å; F439-F467 HydrophobicContact CD2-CD2 3.86Å; F439-F467 HydrophobicContact CD2-CE2 4.1Å; F439-F467 HydrophobicContact CD2-CG 4.12Å; F439-F467 HydrophobicContact CE1-CB 3.74Å; F439-F467 AromaticContact CE1-CD1 3.2Å; F439-F467 HydrophobicContact CE1-CD1 3.2Å; F439-F467 HydrophobicContact CE1-CD2 4.1Å; F439-F467 AromaticContact CE1-CE1 3.76Å; F439-F467 HydrophobicContact CE1-CE1 3.76Å; F439-F467 AromaticContact CE1-CG 3.39Å; F439-F467 HydrophobicContact CE1-CG 3.39Å; F439-F467 HydrophobicContact CE1-CZ 4.41Å; F439-F467 HydrophobicContact CE2-CB 3.85Å; F439-F467 HydrophobicContact CE2-CD1 4.36Å; F439-F467 AromaticContact CE2-CD2 3.78Å; F439-F467 HydrophobicContact CE2-CD2 3.78Å; F439-F467 HydrophobicContact CE2-CE2 4.47Å; F439-F467 AromaticContact CE2-CG 3.72Å; F439-F467 HydrophobicContact CE2-CG 3.72Å; F439-F467 HydrophobicContact CG-CD1 4.17Å; F439-F467 HydrophobicContact CG-CD2 4.05Å; F439-F467 HydrophobicContact CG-CE1 4.07Å; F439-F467 AromaticContact CG-CE2 3.94Å; F439-F467 HydrophobicContact CG-CE2 3.94Å; F439-F467 HydrophobicContact CG-CG 4.16Å; F439-F467 AromaticContact CG-CZ 3.94Å; F439-F467 HydrophobicContact CG-CZ 3.94Å; F439-F467 HydrophobicContact CZ-CB 3.28Å; F439-F467 AromaticContact CZ-CD1 3.7Å; F439-F467 HydrophobicContact CZ-CD1 3.7Å; F439-F467 AromaticContact CZ-CD2 3.91Å; F439-F467 HydrophobicContact CZ-CD2 3.91Å; F439-F467 AromaticContact CZ-CG 3.34Å; F439-F467 HydrophobicContact CZ-CG 3.34Å; L463-F467 VanDerWaalsContact O-CB 3.3Å; L463-F467 WeakPolarHBondContact O-CB 3.18Å; L463-F467 PolarHBondContact O-N 2.78Å; D464-F467 PolarHBondContact O-N 3.38Å; F467-R469 VanDerWaalsContact C-N 3.32Å; F467-R469 PolarHBondContact O-N 3.28Å; F467-E470 PolarHBondContact O-N 3.27Å; F467-E470 VanDerWaalsContact O-N 3.15Å; F467-F471 HydrophobicContact CE1-CB 4.34Å; F467-F471 HydrophobicContact CE1-CD2 4.25Å; F467-F471 HydrophobicContact CE1-CG 4.38Å; F467-F471 HydrophobicContact CE2-CB 4.21Å; F467-F471 AromaticContact CE2-CD2 3.78Å; F467-F471 HydrophobicContact CE2-CD2 3.78Å; F467-F471 HydrophobicContact CE2-CG 4.38Å; F467-F471 HydrophobicContact CZ-CB 4.09Å; F467-F471 AromaticContact CZ-CD2 3.42Å; F467-F471 HydrophobicContact CZ-CD2 3.42Å; F467-F471 VanDerWaalsContact CZ-CD2 3.42Å; F467-F471 HydrophobicContact CZ-CE2 4.04Å; F467-F471 AromaticContact CZ-CG 3.95Å; F467-F471 HydrophobicContact CZ-CG 3.95Å; F467-F471 WeakPolarHBondContact O-CB 3.25Å; F467-F471 PolarHBondContact O-N 3.03Å
468	H	90	Very high	91.6	Very high	5 Å²	5	31.8 Å²	31.8	2%	0.023	16%	0.158	C	C	.	.	H	α-helix	trans	-66.6	-30.6	-176.8	-97.4	-50.1	0	0	0	113	C211 R440 D464 T466 N472	C211-H468 HydrophobicContact CB-CB 4.28Å; C211-H468 VanDerWaalsContact SG-CB 3.59Å; R440-H468 PolarHBondContact NH2-CE1 2.94Å; R440-H468 PolarHBondContact NH2-NE2 2.97Å; D464-H468 WeakPolarHBondContact O-CB 3.3Å; D464-H468 PolarHBondContact O-N 3Å; D464-H468 IonicContact OD1-CD2 3.57Å; D464-H468 IonicContact OD2-CD2 3.94Å; T466-H468 PolarHBondContact O-N 2.86Å; H468-N472 VanDerWaalsContact O-CB 3.27Å; H468-N472 WeakPolarHBondContact O-CB 3.34Å; H468-N472 PolarHBondContact O-N 3.37Å; H468-N472 PolarHBondContact O-ND2 3.2Å; H468-N472 VanDerWaalsContact O-ND2 3.15Å
469	R	85	Confident	91.4	Very high	114 Å²	114	30.6 Å²	30.6	43%	0.43	15%	0.146	S	C	.	.	H	α-helix	trans	-61.8	-48.8	169.6	-71.1	171.2	-175.1	-162.4	-1.1	111.8	R465 T466 F467 N472 L473	R465-R469 WeakPolarHBondContact O-CG 3.45Å; R465-R469 PolarHBondContact O-N 3.44Å; T466-R469 PolarHBondContact O-N 2.91Å; F467-R469 VanDerWaalsContact C-N 3.32Å; F467-R469 PolarHBondContact O-N 3.28Å; R469-N472 PolarHBondContact O-N 3.37Å; R469-L473 PolarHBondContact O-N 3.5Å
470	E	90.1	Very high	91.2	Very high	16 Å²	16	30.7 Å²	30.7	8%	0.075	15%	0.146	C	C	.	.	H	α-helix	trans	-71.2	-39.8	-178.9	-68.2	-64.6	156.5	0	0	113	L382 R385 T466 F467 N472 L473 M474 Y481 R484	L382-E470 HydrophobicContact CD1-CB 3.52Å; L382-E470 HydrophobicContact CD1-CG 4.36Å; R385-E470 IonicContact CZ-OE1 3.47Å; R385-E470 IonicContact CZ-OE2 3.61Å; R385-E470 IonicContact NH1-OE1 2.61Å; R385-E470 PolarHBondContact NH1-OE1 2.86Å; R385-E470 IonicContact NH1-OE2 3.91Å; R385-E470 PolarHBondContact NH1-OE2 3.42Å; R385-E470 IonicContact NH2-OE1 3.93Å; R385-E470 PolarHBondContact NH2-OE1 3.41Å; R385-E470 IonicContact NH2-OE2 2.75Å; T466-E470 PolarHBondContact O-N 2.88Å; F467-E470 PolarHBondContact O-N 3.27Å; F467-E470 VanDerWaalsContact O-N 3.15Å; E470-N472 VanDerWaalsContact C-N 3.31Å; E470-N472 PolarHBondContact O-N 2.92Å; E470-L473 WeakPolarHBondContact O-CB 3.47Å; E470-L473 PolarHBondContact O-N 3.37Å; E470-M474 PolarHBondContact O-N 2.83Å; E470-Y481 WeakPolarHBondContact O-CE2 3.36Å; E470-R484 IonicContact OE1-CZ 2.67Å; E470-R484 IonicContact OE1-NH1 2.8Å; E470-R484 PolarHBondContact OE1-NH1 3.38Å; E470-R484 IonicContact OE1-NH2 3.69Å; E470-R484 IonicContact OE2-NH1 3.29Å; E470-R484 PolarHBondContact OE2-NH1 3.25Å
471	F	91.4	Very high	91	Very high	5 Å²	5	30.8 Å²	30.8	2%	0.022	15%	0.146	C	C	.	.	H	α-helix	trans	-58.9	-41.5	172.6	-176.2	-86.4	0	0	0	111.6	L432 L436 F467 M474 R475	L432-F471 HydrophobicContact CD1-CD2 3.77Å; L432-F471 HydrophobicContact CD1-CE2 3.43Å; L432-F471 VanDerWaalsContact CD1-CE2 3.43Å; L432-F471 HydrophobicContact CD1-CZ 4.29Å; L432-F471 HydrophobicContact CD2-CD2 4.36Å; L432-F471 HydrophobicContact CD2-CE2 3.93Å; L432-F471 HydrophobicContact CD2-CZ 4.05Å; L432-F471 HydrophobicContact CG-CD2 4.1Å; L432-F471 HydrophobicContact CG-CE2 3.39Å; L432-F471 HydrophobicContact CG-CZ 3.75Å; L436-F471 HydrophobicContact CB-CE2 3.72Å; L436-F471 HydrophobicContact CB-CZ 3.85Å; L436-F471 HydrophobicContact CD1-CE2 4.42Å; L436-F471 HydrophobicContact CD2-CE1 4.03Å; L436-F471 HydrophobicContact CD2-CE2 4.3Å; L436-F471 HydrophobicContact CD2-CZ 3.67Å; L436-F471 HydrophobicContact CG-CE2 4.38Å; L436-F471 HydrophobicContact CG-CZ 4.22Å; F467-F471 HydrophobicContact CE1-CB 4.34Å; F467-F471 HydrophobicContact CE1-CD2 4.25Å; F467-F471 HydrophobicContact CE1-CG 4.38Å; F467-F471 HydrophobicContact CE2-CB 4.21Å; F467-F471 AromaticContact CE2-CD2 3.78Å; F467-F471 HydrophobicContact CE2-CD2 3.78Å; F467-F471 HydrophobicContact CE2-CG 4.38Å; F467-F471 HydrophobicContact CZ-CB 4.09Å; F467-F471 AromaticContact CZ-CD2 3.42Å; F467-F471 HydrophobicContact CZ-CD2 3.42Å; F467-F471 VanDerWaalsContact CZ-CD2 3.42Å; F467-F471 HydrophobicContact CZ-CE2 4.04Å; F467-F471 AromaticContact CZ-CG 3.95Å; F467-F471 HydrophobicContact CZ-CG 3.95Å; F467-F471 WeakPolarHBondContact O-CB 3.25Å; F467-F471 PolarHBondContact O-N 3.03Å; F471-M474 PolarHBondContact O-N 2.89Å; F471-R475 VanDerWaalsContact O-CB 3.29Å; F471-R475 WeakPolarHBondContact O-CB 3.27Å; F471-R475 PolarHBondContact O-N 3.43Å
472	N	87.1	Confident	90.9	Very high	24 Å²	24	28.6 Å²	28.6	13%	0.128	14%	0.14	C	C	.	.	H	α-helix	trans	-68.7	-34.5	178.2	-74.1	-18.4	0	0	0	112.4	H468 R469 E470 A476 L609	H468-N472 VanDerWaalsContact O-CB 3.27Å; H468-N472 WeakPolarHBondContact O-CB 3.34Å; H468-N472 PolarHBondContact O-N 3.37Å; H468-N472 PolarHBondContact O-ND2 3.2Å; H468-N472 VanDerWaalsContact O-ND2 3.15Å; R469-N472 PolarHBondContact O-N 3.37Å; E470-N472 VanDerWaalsContact C-N 3.31Å; E470-N472 PolarHBondContact O-N 2.92Å; N472-A476 WeakPolarHBondContact O-CB 3.47Å; N472-A476 PolarHBondContact O-N 3.04Å; N472-L609 HydrophobicContact CB-CD2 4.29Å
473	L	89.5	Confident	90.8	Very high	13 Å²	13	26.6 Å²	26.6	7%	0.068	13%	0.13	C	C	.	.	H	α-helix	trans	-61.4	-50.6	169.3	-70.6	167.9	0	0	0	111.3	R469 E470 R475 A476 C477 Y481 R484 I601 L609 V618	R469-L473 PolarHBondContact O-N 3.5Å; E470-L473 WeakPolarHBondContact O-CB 3.47Å; E470-L473 PolarHBondContact O-N 3.37Å; L473-R475 PolarHBondContact O-N 3.45Å; L473-A476 PolarHBondContact O-N 3.17Å; L473-C477 PolarHBondContact O-N 2.9Å; L473-Y481 HydrophobicContact CB-CD2 3.91Å; L473-Y481 HydrophobicContact CB-CE2 4.33Å; L473-R484 VanDerWaalsContact CD1-NH1 3.29Å; L473-I601 HydrophobicContact CD2-CB 4.42Å; L473-I601 HydrophobicContact CD2-CG1 4.2Å; L473-I601 HydrophobicContact CD2-CG2 4.16Å; L473-L609 HydrophobicContact CD2-CD2 4.03Å; L473-L609 HydrophobicContact CD2-CG 4.33Å; L473-L609 HydrophobicContact CG-CD2 4.45Å; L473-V618 HydrophobicContact CD1-CB 4.29Å; L473-V618 HydrophobicContact CD1-CG1 3.98Å; L473-V618 HydrophobicContact CD1-CG2 3.86Å; L473-V618 HydrophobicContact CD2-CG1 3.75Å; L473-V618 HydrophobicContact CD2-CG2 4.12Å; L473-V618 HydrophobicContact CG-CG1 4.03Å
474	M	91.8	Very high	90.6	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-59.7	-47.4	-179.5	-166.4	-163.6	-59.2	0	0	111.3	W367 M378 L379 L382 L432 E470 F471 A476 C477 P478 Y481	W367-M474 HydrophobicContact CH2-CG 4.12Å; W367-M474 HydrophobicContact CH2-SD 4.19Å; W367-M474 HydrophobicContact CZ2-CG 4.31Å; W367-M474 WeakPolarHBondContact CZ2-O 3.25Å; M378-M474 HydrophobicContact CB-CE 4.02Å; M378-M474 HydrophobicContact CB-SD 4.02Å; M378-M474 HydrophobicContact CE-CG 4.47Å; M378-M474 HydrophobicContact SD-CG 3.82Å; M378-M474 HydrophobicContact SD-SD 4.35Å; L379-M474 HydrophobicContact CD2-CE 4.36Å; L382-M474 HydrophobicContact CB-CE 4.18Å; L382-M474 HydrophobicContact CD2-CE 3.84Å; L432-M474 HydrophobicContact CD1-CE 4.42Å; L432-M474 HydrophobicContact CD1-SD 3.6Å; L432-M474 HydrophobicContact CD2-CG 4.41Å; L432-M474 HydrophobicContact CD2-SD 3.92Å; L432-M474 HydrophobicContact CG-SD 4.38Å; E470-M474 PolarHBondContact O-N 2.83Å; F471-M474 PolarHBondContact O-N 2.89Å; M474-A476 VanDerWaalsContact C-N 3.34Å; M474-A476 PolarHBondContact O-N 3.46Å; M474-C477 CarbonylContact O-C 3.53Å; M474-P478 WeakPolarHBondContact O-CD 3.34Å; M474-Y481 HydrophobicContact CB-CD1 4.13Å; M474-Y481 HydrophobicContact CB-CD2 3.78Å; M474-Y481 HydrophobicContact CB-CE1 4.32Å; M474-Y481 HydrophobicContact CB-CE2 4Å; M474-Y481 HydrophobicContact CB-CG 3.84Å; M474-Y481 HydrophobicContact CE-CD1 4.2Å; M474-Y481 HydrophobicContact CE-CE1 3.54Å; M474-Y481 HydrophobicContact CG-CD1 3.82Å; M474-Y481 HydrophobicContact CG-CD2 4.39Å; M474-Y481 HydrophobicContact CG-CE1 4.14Å; M474-Y481 HydrophobicContact CG-CG 3.95Å
475	R	88.5	Confident	90.4	Very high	77 Å²	77	26.1 Å²	26.1	29%	0.291	13%	0.126	S	C	.	.	H	α-helix	trans	-62	-38.8	178.2	-176.1	171.6	175.6	82.4	-6.3	112.5	S204 W367 L432 F471 L473	S204-R475 PolarHBondContact OG-NE 3.26Å; S204-R475 PolarHBondContact OG-NH2 3.45Å; W367-R475 PolarHBondContact NE1-O 2.98Å; L432-R475 HydrophobicContact CD2-CB 4.27Å; F471-R475 VanDerWaalsContact O-CB 3.29Å; F471-R475 WeakPolarHBondContact O-CB 3.27Å; F471-R475 PolarHBondContact O-N 3.43Å; L473-R475 PolarHBondContact O-N 3.45Å
476	A	87.3	Confident	90.2	Very high	35 Å²	35	25.2 Å²	25.2	29%	0.289	13%	0.129	S	C	.	.	H	α-helix	trans	-75.1	-42.1	-177.4	0	0	0	0	0	113.6	N472 L473 M474 I601 A602	N472-A476 WeakPolarHBondContact O-CB 3.47Å; N472-A476 PolarHBondContact O-N 3.04Å; L473-A476 PolarHBondContact O-N 3.17Å; M474-A476 VanDerWaalsContact C-N 3.34Å; M474-A476 PolarHBondContact O-N 3.46Å; A476-I601 HydrophobicContact CB-CG2 3.85Å; A476-A602 HydrophobicContact CB-CB 3.87Å
477	C	91	Very high	90	Very high	13 Å²	13	23.6 Å²	23.6	9%	0.088	12%	0.119	C	C	.	.			trans	-150.1	97.8	172.2	-171.5	0	0	0	0	111.7	L473 M474 I479 C480 Y481 I601	L473-C477 PolarHBondContact O-N 2.9Å; M474-C477 CarbonylContact O-C 3.53Å; C477-I479 VanDerWaalsContact C-N 3.3Å; C477-I479 PolarHBondContact O-N 2.82Å; C477-C480 HydrophobicContact CB-CB 4Å; C477-C480 PolarHBondContact O-N 2.9Å; C477-C480 PolarHBondContact SG-N 3.43Å; C477-Y481 PolarHBondContact O-N 3.3Å; C477-I601 HydrophobicContact CB-CG2 4.41Å
478	P	91.9	Very high	89.4	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-66.2	-30.7	-179.3	24.9	-33.3	0	0	0	112.6	S366 W367 I370 M378 M474 Y481 L482	S366-P478 WeakPolarHBondContact O-CG 3.41Å; W367-P478 HydrophobicContact CD2-CG 4.3Å; W367-P478 HydrophobicContact CH2-CB 4.22Å; W367-P478 HydrophobicContact CZ2-CB 4.04Å; W367-P478 HydrophobicContact CZ2-CG 4.27Å; I370-P478 HydrophobicContact CD1-CB 3.73Å; I370-P478 HydrophobicContact CD1-CG 3.77Å; I370-P478 HydrophobicContact CG1-CB 3.89Å; I370-P478 HydrophobicContact CG1-CG 3.69Å; M378-P478 HydrophobicContact CE-CB 4Å; M378-P478 HydrophobicContact SD-CB 3.96Å; M474-P478 WeakPolarHBondContact O-CD 3.34Å; P478-Y481 PolarHBondContact O-N 3.29Å; P478-L482 WeakPolarHBondContact O-CB 3.48Å; P478-L482 WeakPolarHBondContact O-CG 3.32Å; P478-L482 PolarHBondContact O-N 3.31Å
479	I	91.7	Very high	88.9	Confident	41 Å²	41	28.6 Å²	28.6	21%	0.21	14%	0.143	C	C	.	.	H	α-helix	trans	-63.3	-48	174.7	-53.5	-58.5	0	0	0	111.2	I370 C477 Y481 L482 N483 C579	I370-I479 HydrophobicContact CD1-CD1 3.83Å; C477-I479 VanDerWaalsContact C-N 3.3Å; C477-I479 PolarHBondContact O-N 2.82Å; I479-Y481 PolarHBondContact O-N 2.9Å; I479-L482 HydrophobicContact CD1-CD1 4.46Å; I479-L482 WeakPolarHBondContact O-CB 3.49Å; I479-L482 PolarHBondContact O-N 2.84Å; I479-N483 PolarHBondContact O-N 3.08Å; I479-N483 PolarHBondContact O-ND2 3.01Å; I479-C579 HydrophobicContact CB-CB 4.23Å; I479-C579 HydrophobicContact CG2-CB 4.15Å
480	C	92.4	Very high	88.8	Confident	24 Å²	24	26.4 Å²	26.4	16%	0.162	14%	0.139	C	C	.	.	H	α-helix	trans	-71	-20.8	177.8	-84	0	0	0	0	112.4	C477 R484 C579 H583	C477-C480 HydrophobicContact CB-CB 4Å; C477-C480 PolarHBondContact O-N 2.9Å; C477-C480 PolarHBondContact SG-N 3.43Å; C480-R484 PolarHBondContact O-N 2.9Å; C480-C579 WeakPolarHBondContact CA-SG 3.28Å; C480-C579 HydrophobicContact CB-CB 4.43Å; C480-C579 WeakPolarHBondContact CB-SG 3.39Å; C480-C579 PolarHBondContact N-SG 3.2Å; C480-C579 WeakPolarHBondContact SG-CB 3.4Å; C480-C579 CovalentContact SG-SG 2.06Å; C480-C579 PolarHBondContact SG-SG 3.36Å; C480-H583 PolarHBondContact SG-NE2 2.91Å; C480-H583 VanDerWaalsContact SG-NE2 3.4Å
481	Y	92.8	Very high	88.5	Confident	3 Å²	3	26 Å²	26	1%	0.012	14%	0.137	C	C	.	.	H	α-helix	trans	-77.3	-40.7	169	-165.3	-88.9	0	0	0	112.5	M378 F381 E470 L473 M474 C477 P478 I479 N483 R484	M378-Y481 HydrophobicContact CB-CD1 4.07Å; M378-Y481 HydrophobicContact CB-CE1 4.06Å; M378-Y481 HydrophobicContact CG-CD1 3.81Å; M378-Y481 HydrophobicContact CG-CE1 4.28Å; M378-Y481 HydrophobicContact SD-CD1 3.88Å; F381-Y481 HydrophobicContact CD1-CD1 4.47Å; F381-Y481 AromaticContact CD1-CE1 3.54Å; F381-Y481 HydrophobicContact CD1-CE1 3.54Å; F381-Y481 AromaticContact CD1-CZ 3.67Å; F381-Y481 WeakPolarHBondContact CD1-OH 3.18Å; F381-Y481 AromaticContact CE1-CE1 3.82Å; F381-Y481 HydrophobicContact CE1-CE1 3.82Å; F381-Y481 HydrophobicContact CE1-CE2 4.26Å; F381-Y481 AromaticContact CE1-CZ 3.66Å; E470-Y481 WeakPolarHBondContact O-CE2 3.36Å; L473-Y481 HydrophobicContact CB-CD2 3.91Å; L473-Y481 HydrophobicContact CB-CE2 4.33Å; M474-Y481 HydrophobicContact CB-CD1 4.13Å; M474-Y481 HydrophobicContact CB-CD2 3.78Å; M474-Y481 HydrophobicContact CB-CE1 4.32Å; M474-Y481 HydrophobicContact CB-CE2 4Å; M474-Y481 HydrophobicContact CB-CG 3.84Å; M474-Y481 HydrophobicContact CE-CD1 4.2Å; M474-Y481 HydrophobicContact CE-CE1 3.54Å; M474-Y481 HydrophobicContact CG-CD1 3.82Å; M474-Y481 HydrophobicContact CG-CD2 4.39Å; M474-Y481 HydrophobicContact CG-CE1 4.14Å; M474-Y481 HydrophobicContact CG-CG 3.95Å; C477-Y481 PolarHBondContact O-N 3.3Å; P478-Y481 PolarHBondContact O-N 3.29Å; I479-Y481 PolarHBondContact O-N 2.9Å; Y481-N483 VanDerWaalsContact C-N 3.35Å; Y481-N483 PolarHBondContact O-N 2.97Å; Y481-R484 VanDerWaalsContact O-CB 3.27Å; Y481-R484 WeakPolarHBondContact O-CB 3.33Å; Y481-R484 PolarHBondContact O-N 3.09Å; Y481-R484 VanDerWaalsContact O-N 3.08Å
482	L	92.5	Very high	87.7	Confident	26 Å²	26	28.8 Å²	28.8	14%	0.136	16%	0.156	C	C	.	.	H	α-helix	trans	-58.3	-45.6	170.4	-75.4	164.9	0	0	0	111.1	I370 Q374 M378 P478 I479 R484 M485	I370-L482 HydrophobicContact CD1-CD1 4.19Å; Q374-L482 HydrophobicContact CB-CD1 4.23Å; Q374-L482 HydrophobicContact CB-CD2 4.14Å; Q374-L482 HydrophobicContact CG-CD1 4.08Å; Q374-L482 HydrophobicContact CG-CD2 4.23Å; M378-L482 HydrophobicContact CG-CD2 3.59Å; M378-L482 HydrophobicContact CG-CG 3.95Å; M378-L482 HydrophobicContact SD-CD2 4.13Å; M378-L482 HydrophobicContact SD-CG 3.84Å; P478-L482 WeakPolarHBondContact O-CB 3.48Å; P478-L482 WeakPolarHBondContact O-CG 3.32Å; P478-L482 PolarHBondContact O-N 3.31Å; I479-L482 HydrophobicContact CD1-CD1 4.46Å; I479-L482 WeakPolarHBondContact O-CB 3.49Å; I479-L482 PolarHBondContact O-N 2.84Å; L482-R484 PolarHBondContact O-N 3.01Å; L482-M485 HydrophobicContact CD2-SD 3.91Å; L482-M485 WeakPolarHBondContact O-CB 3.41Å; L482-M485 PolarHBondContact O-N 3.32Å; L482-M485 VanDerWaalsContact O-N 3.07Å
483	N	91.2	Very high	86.5	Confident	31 Å²	31	30 Å²	30	17%	0.166	17%	0.166	C	C	.	.	H	α-helix	trans	-59	-26.7	175.4	-73.2	-26.1	0	0	0	112.8	I479 Y481 M485 W574 K577	I479-N483 PolarHBondContact O-N 3.08Å; I479-N483 PolarHBondContact O-ND2 3.01Å; Y481-N483 VanDerWaalsContact C-N 3.35Å; Y481-N483 PolarHBondContact O-N 2.97Å; N483-M485 VanDerWaalsContact C-N 3.35Å; N483-W574 VanDerWaalsContact O-CE3 3.28Å; N483-K577 WeakPolarHBondContact ND2-CB 3.39Å; N483-K577 WeakPolarHBondContact OD1-CD 3.47Å
484	R	90.8	Very high	84.8	Confident	13 Å²	13	32.3 Å²	32.3	5%	0.049	18%	0.181	C	C	.	.	H	α-helix	trans	-75.8	-19.1	178	-164.6	176	-167	-150	4.6	113.8	F381 E470 L473 C480 Y481 L482 A487 L491 W574 Y616	F381-R484 HydrophobicContact CZ-CG 4.24Å; E470-R484 IonicContact OE1-CZ 2.67Å; E470-R484 IonicContact OE1-NH1 2.8Å; E470-R484 PolarHBondContact OE1-NH1 3.38Å; E470-R484 IonicContact OE1-NH2 3.69Å; E470-R484 IonicContact OE2-NH1 3.29Å; E470-R484 PolarHBondContact OE2-NH1 3.25Å; L473-R484 VanDerWaalsContact CD1-NH1 3.29Å; C480-R484 PolarHBondContact O-N 2.9Å; Y481-R484 VanDerWaalsContact O-CB 3.27Å; Y481-R484 WeakPolarHBondContact O-CB 3.33Å; Y481-R484 PolarHBondContact O-N 3.09Å; Y481-R484 VanDerWaalsContact O-N 3.08Å; L482-R484 PolarHBondContact O-N 3.01Å; R484-A487 PolarHBondContact O-N 3.31Å; R484-L491 HydrophobicContact CG-CD1 3.84Å; R484-L491 HydrophobicContact CG-CD2 3.87Å; R484-L491 HydrophobicContact CG-CG 4.49Å; R484-W574 VanDerWaalsContact CA-CZ3 3.49Å; R484-W574 HydrophobicContact CB-CE3 4.3Å; R484-W574 HydrophobicContact CB-CH2 4.34Å; R484-W574 HydrophobicContact CB-CZ3 3.68Å; R484-W574 HydrophobicContact CG-CH2 3.76Å; R484-W574 HydrophobicContact CG-CZ3 3.63Å; R484-Y616 PolarHBondContact NH2-O 2.8Å
485	M	89.5	Confident	83	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.02	22%	0.223	C	C	.	.	S	Bend	trans	-64.8	-48.2	-171.1	-63	177.2	49.3	0	0	114.2	R377 M378 F381 L482 N483 A487 I488 Y509 L510	R377-M485 HydrophobicContact CB-CE 3.94Å; R377-M485 VanDerWaalsContact O-CE 3.28Å; R377-M485 WeakPolarHBondContact O-CE 3.49Å; M378-M485 HydrophobicContact CG-SD 4.06Å; F381-M485 HydrophobicContact CB-CE 3.89Å; F381-M485 HydrophobicContact CB-CG 4.11Å; F381-M485 HydrophobicContact CB-SD 4.36Å; F381-M485 HydrophobicContact CD1-CG 3.9Å; F381-M485 HydrophobicContact CD2-CB 4.16Å; F381-M485 HydrophobicContact CD2-CG 4.05Å; F381-M485 HydrophobicContact CE1-CG 4.24Å; F381-M485 HydrophobicContact CE2-CB 4.36Å; F381-M485 HydrophobicContact CE2-CG 4.37Å; F381-M485 HydrophobicContact CG-CB 4.38Å; F381-M485 HydrophobicContact CG-CG 3.78Å; F381-M485 HydrophobicContact CZ-CG 4.45Å; L482-M485 HydrophobicContact CD2-SD 3.91Å; L482-M485 WeakPolarHBondContact O-CB 3.41Å; L482-M485 PolarHBondContact O-N 3.32Å; L482-M485 VanDerWaalsContact O-N 3.07Å; N483-M485 VanDerWaalsContact C-N 3.35Å; M485-A487 PolarHBondContact O-N 3.27Å; M485-A487 VanDerWaalsContact O-N 3.12Å; M485-I488 PolarHBondContact O-N 3.36Å; M485-Y509 HydrophobicContact CE-CD2 3.47Å; M485-Y509 VanDerWaalsContact CE-CD2 3.47Å; M485-Y509 HydrophobicContact CE-CE2 4.39Å; M485-Y509 HydrophobicContact CE-CG 3.98Å; M485-L510 HydrophobicContact CB-CD2 4.32Å; M485-L510 WeakPolarHBondContact O-CD2 3.49Å
486	P	85.9	Confident	81.5	Confident	50 Å²	50	44.7 Å²	44.7	33%	0.325	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-24.9	177.4	-23.2	35.3	0	0	0	113.5	I488 L570	P486-I488 VanDerWaalsContact C-N 3.3Å; P486-I488 PolarHBondContact O-N 3.25Å; P486-L570 WeakPolarHBondContact O-CD1 3.39Å
487	A	85.1	Confident	80.8	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.008	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	9.7	-174	0	0	0	0	0	114.8	R484 M485 H489 L490 L491 W574	R484-A487 PolarHBondContact O-N 3.31Å; M485-A487 PolarHBondContact O-N 3.27Å; M485-A487 VanDerWaalsContact O-N 3.12Å; A487-H489 PolarHBondContact O-N 3.01Å; A487-L490 HydrophobicContact CB-CD1 4.49Å; A487-L490 WeakPolarHBondContact O-CA 3.37Å; A487-L490 WeakPolarHBondContact O-CB 3.28Å; A487-L490 PolarHBondContact O-N 3.02Å; A487-L491 HydrophobicContact CB-CD2 4.47Å; A487-L491 PolarHBondContact O-N 2.82Å; A487-W574 HydrophobicContact CB-CD2 3.43Å; A487-W574 VanDerWaalsContact CB-CD2 3.43Å; A487-W574 HydrophobicContact CB-CE3 4.17Å; A487-W574 HydrophobicContact CB-CG 3.59Å; A487-W574 HydrophobicContact CB-CH2 4.48Å; A487-W574 HydrophobicContact CB-CZ2 3.79Å
488	I	82	Confident	80.1	Confident	11 Å²	11	49.9 Å²	49.9	6%	0.056	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-47.4	-39.1	-169.1	-174.8	165.2	0	0	0	114.6	F381 R385 M485 P486 L490 L491 Y509	F381-I488 HydrophobicContact CD2-CD1 4.29Å; F381-I488 HydrophobicContact CE2-CB 4.02Å; F381-I488 HydrophobicContact CE2-CD1 4.29Å; F381-I488 HydrophobicContact CE2-CG1 4.27Å; R385-I488 HydrophobicContact CG-CD1 3.57Å; R385-I488 HydrophobicContact CG-CG1 4.04Å; M485-I488 PolarHBondContact O-N 3.36Å; P486-I488 VanDerWaalsContact C-N 3.3Å; P486-I488 PolarHBondContact O-N 3.25Å; I488-L490 VanDerWaalsContact C-N 3.32Å; I488-L490 PolarHBondContact O-N 3.24Å; I488-L491 PolarHBondContact O-N 3.11Å; I488-Y509 WeakPolarHBondContact CD1-OH 3.37Å
489	H	79.9	Confident	79.5	Confident	100 Å²	100	53.9 Å²	53.9	46%	0.463	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-71.6	-23.8	-179.7	-46.9	-49.3	0	0	0	114.1	A487 E507	A487-H489 PolarHBondContact O-N 3.01Å; H489-E507 IonicContact CE1-OE1 3.39Å; H489-E507 IonicContact CE1-OE2 2.69Å; H489-E507 PolarHBondContact CE1-OE2 3.01Å; H489-E507 IonicContact NE2-OE2 2.64Å
490	L	82.6	Confident	78.8	Confident	68 Å²	68	54 Å²	54	36%	0.356	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-85	-14.9	177.6	-58.1	179	0	0	0	113.2	A487 I488 L570 Y616	A487-L490 HydrophobicContact CB-CD1 4.49Å; A487-L490 WeakPolarHBondContact O-CA 3.37Å; A487-L490 WeakPolarHBondContact O-CB 3.28Å; A487-L490 PolarHBondContact O-N 3.02Å; I488-L490 VanDerWaalsContact C-N 3.32Å; I488-L490 PolarHBondContact O-N 3.24Å; L490-L570 HydrophobicContact CD1-CD2 3.98Å; L490-L570 HydrophobicContact CD2-CD2 4.2Å; L490-L570 HydrophobicContact CG-CD2 4.07Å; L490-Y616 HydrophobicContact CB-CD2 4.22Å; L490-Y616 HydrophobicContact CB-CE2 3.91Å; L490-Y616 HydrophobicContact CD1-CE2 4.19Å
491	L	82.8	Confident	78.2	Confident	6 Å²	6	53.6 Å²	53.6	3%	0.031	29%	0.286	C	S	.	.	S	Bend	trans	-76	144.4	-175.6	-56.3	179.3	0	0	0	111.4	F381 R484 A487 I488 S493 W574	F381-L491 HydrophobicContact CE2-CD1 4.26Å; F381-L491 HydrophobicContact CZ-CD1 3.8Å; R484-L491 HydrophobicContact CG-CD1 3.84Å; R484-L491 HydrophobicContact CG-CD2 3.87Å; R484-L491 HydrophobicContact CG-CG 4.49Å; A487-L491 HydrophobicContact CB-CD2 4.47Å; A487-L491 PolarHBondContact O-N 2.82Å; I488-L491 PolarHBondContact O-N 3.11Å; L491-S493 PolarHBondContact O-N 2.99Å; L491-S493 PolarHBondContact O-OG 2.73Å; L491-S493 VanDerWaalsContact O-OG 3.06Å; L491-W574 HydrophobicContact CD2-CH2 3.92Å; L491-W574 HydrophobicContact CD2-CZ2 3.85Å
492	P	76	Confident	77.3	Confident	64 Å²	64	54.8 Å²	54.8	42%	0.416	29%	0.293	S	S	.	.			trans	-46.7	115.1	170.9	-31.2	37.4	0	0	0	111.8	D615 D617	P492-D615 WeakPolarHBondContact CD-O 3.24Å; P492-D615 WeakPolarHBondContact CG-O 3.39Å; P492-D617 HydrophobicContact CG-CB 4.24Å
493	S	61.8	Low	76	Confident	50 Å²	50	62.3 Å²	62.3	35%	0.35	33%	0.328	S	S	.	.			trans	-113	138.5	-177.4	-64	0	0	0	0	108.6	L491 K497	L491-S493 PolarHBondContact O-N 2.99Å; L491-S493 PolarHBondContact O-OG 2.73Å; L491-S493 VanDerWaalsContact O-OG 3.06Å; S493-K497 VanDerWaalsContact CB-CE 3.42Å; S493-K497 VanDerWaalsContact OG-CE 3.26Å; S493-K497 WeakPolarHBondContact OG-CE 3.46Å; S493-K497 PolarHBondContact OG-NZ 2.84Å; S493-K497 VanDerWaalsContact OG-NZ 3.14Å
494	T	53.1	Low	74.5	Confident	61 Å²	61	68 Å²	68	37%	0.374	36%	0.358	S	S	.	.			trans	-70	161.3	172.3	79.1	0	0	0	0	110.9	Q389 R496	Q389-T494 PolarHBondContact OE1-OG1 2.89Å; T494-R496 PolarHBondContact O-N 3.04Å
495	T	53.7	Low	72.9	Confident	145 Å²	145	70.4 Å²	70.4	89%	0.89	37%	0.37	S	S	*	.	S	Bend	trans	-73.5	6	-158.7	47.3	0	0	0	0	116
496	R	58.4	Low	71.5	Confident	192 Å²	192	73.7 Å²	73.7	73%	0.725	39%	0.392	S	S	*	.			trans	-144.1	127.9	166.8	-59.2	-176.1	-160.5	-154	2.4	110	T494	T494-R496 PolarHBondContact O-N 3.04Å
497	K	72.4	Confident	70.7	Confident	122 Å²	122	73.5 Å²	73.5	53%	0.53	39%	0.387	S	S	.	.	B	Isolated β-bridge	trans	-96.3	123.1	175.2	-64.4	-175.8	178.2	-174.9	0	110.1	R388 S493	R388-K497 CarbonylContact O-C 3.58Å; R388-K497 WeakPolarHBondContact O-CA 3.33Å; S493-K497 VanDerWaalsContact CB-CE 3.42Å; S493-K497 VanDerWaalsContact OG-CE 3.26Å; S493-K497 WeakPolarHBondContact OG-CE 3.46Å; S493-K497 PolarHBondContact OG-NZ 2.84Å; S493-K497 VanDerWaalsContact OG-NZ 3.14Å
498	L	76.4	Confident	69.9	Low	36 Å²	36	74.9 Å²	74.9	19%	0.188	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-74.7	159.1	163.8	-66.4	-178.9	0	0	0	110	R388 Q389 W393	R388-L498 PolarHBondContact O-N 3.09Å; Q389-L498 WeakPolarHBondContact O-CD1 3.48Å; W393-L498 HydrophobicContact CB-CD1 4.2Å; W393-L498 HydrophobicContact CE3-CD1 4.26Å; W393-L498 HydrophobicContact CE3-CD2 4.14Å
499	P	79.3	Confident	69.6	Low	83 Å²	83	74.7 Å²	74.7	54%	0.539	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-62.4	157.3	172.3	26.6	-35.5	0	0	0	112	R396	R396-P499 PolarHBondContact NH2-O 3.34Å
500	P	76.4	Confident	69.3	Low	44 Å²	44	71.6 Å²	71.6	29%	0.286	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-52.6	154.6	173.2	-24.6	34.6	0	0	0	112.9	R396 T502 P506	R396-P500 VanDerWaalsContact NH2-C 3.33Å; R396-P500 PolarHBondContact NH2-O 3.48Å; P500-T502 PolarHBondContact O-N 2.85Å; P500-P506 HydrophobicContact CG-CB 4.43Å
501	L	80.4	Confident	68.3	Low	16 Å²	16	73.9 Å²	73.9	8%	0.084	39%	0.394	C	S	.	.	S	Bend	trans	-58.2	-35.1	179	-82.6	164	0	0	0	113.3	L383 S387 R396 L417 Y421	L383-L501 HydrophobicContact CB-CD1 4.25Å; S387-L501 VanDerWaalsContact CB-CG 3.43Å; S387-L501 WeakPolarHBondContact OG-CD1 3.23Å; S387-L501 WeakPolarHBondContact OG-CG 3.4Å; R396-L501 HydrophobicContact CB-CD2 4.11Å; R396-L501 HydrophobicContact CG-CD2 4.26Å; L417-L501 HydrophobicContact CB-CD1 4.25Å; L417-L501 HydrophobicContact CB-CD2 4.09Å; Y421-L501 HydrophobicContact CD2-CD1 4.43Å
502	T	73.6	Confident	66.7	Low	27 Å²	27	79.4 Å²	79.4	17%	0.166	43%	0.428	C	S	.	.			trans	-136.3	132.8	-176.4	54.5	0	0	0	0	110.4	Y421 P500 N504	Y421-T502 HydrophobicContact CD1-CG2 4.04Å; Y421-T502 HydrophobicContact CE1-CG2 3.68Å; Y421-T502 PolarHBondContact OH-OG1 3.02Å; P500-T502 PolarHBondContact O-N 2.85Å; T502-N504 VanDerWaalsContact C-N 3.31Å; T502-N504 PolarHBondContact O-N 3.2Å
503	E	63.7	Low	64.7	Low	184 Å²	184	80.4 Å²	80.4	86%	0.86	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-26.8	-176.1	-59.3	-176.3	151.6	0	0	112.9	P506	E503-P506 WeakPolarHBondContact O-CD 3.06Å
504	N	59.6	Low	63	Low	150 Å²	150	83.2 Å²	83.2	80%	0.802	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-8.8	-172.7	-62.7	-37.8	0	0	0	114.4	T502	T502-N504 VanDerWaalsContact C-N 3.31Å; T502-N504 PolarHBondContact O-N 3.2Å
505	E	58.5	Low	61.9	Low	64 Å²	64	87 Å²	87	30%	0.299	48%	0.483	S	S	.	.			trans	-137.6	37.7	-171.7	-66.8	-91.8	-162.8	0	0	113.6	Y421 K425 E507 S508	Y421-E505 WeakPolarHBondContact OH-CB 3.5Å; K425-E505 IonicContact NZ-OE1 3.02Å; K425-E505 PolarHBondContact NZ-OE1 3.29Å; E505-E507 PolarHBondContact O-N 3.33Å; E505-S508 WeakPolarHBondContact OE2-CB 3.14Å; E505-S508 PolarHBondContact OE2-OG 3.22Å
506	P	59.2	Low	60.6	Low	74 Å²	74	88.7 Å²	88.7	48%	0.481	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	124.1	177.6	28.7	-34.5	0	0	0	109.8	P500 E503 S508	P500-P506 HydrophobicContact CG-CB 4.43Å; E503-P506 WeakPolarHBondContact O-CD 3.06Å; P506-S508 PolarHBondContact O-N 3.04Å; P506-S508 VanDerWaalsContact O-N 3.07Å
507	E	69	Low	59.1	Low	46 Å²	46	84.2 Å²	84.2	22%	0.215	48%	0.48	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.9	21.8	172.8	-68.9	158.4	-152.3	0	0	114.7	R388 H489 E505 Y509 L510	R388-E507 IonicContact CZ-OE1 2.99Å; R388-E507 IonicContact NH1-OE1 2.94Å; R388-E507 PolarHBondContact NH1-OE1 3.13Å; R388-E507 VanDerWaalsContact NH1-OE1 3.1Å; R388-E507 IonicContact NH2-OE1 2.8Å; R388-E507 PolarHBondContact NH2-OE1 2.91Å; H489-E507 IonicContact CE1-OE1 3.39Å; H489-E507 IonicContact CE1-OE2 2.69Å; H489-E507 PolarHBondContact CE1-OE2 3.01Å; H489-E507 IonicContact NE2-OE2 2.64Å; E505-E507 PolarHBondContact O-N 3.33Å; E507-Y509 HydrophobicContact CG-CE1 4.46Å; E507-Y509 PolarHBondContact O-N 3.25Å; E507-L510 HydrophobicContact CB-CD1 3.93Å; E507-L510 HydrophobicContact CB-CG 4.19Å; E507-L510 HydrophobicContact CG-CD1 4.42Å; E507-L510 VanDerWaalsContact O-CB 3.25Å; E507-L510 WeakPolarHBondContact O-CB 3.29Å; E507-L510 WeakPolarHBondContact O-CG 3.42Å; E507-L510 PolarHBondContact O-N 2.96Å
508	S	69.9	Low	56.9	Low	29 Å²	29	83.9 Å²	83.9	20%	0.203	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	-61.5	-19.3	-178.6	64	0	0	0	0	114.6	E505 P506 L510 N511	E505-S508 WeakPolarHBondContact OE2-CB 3.14Å; E505-S508 PolarHBondContact OE2-OG 3.22Å; P506-S508 PolarHBondContact O-N 3.04Å; P506-S508 VanDerWaalsContact O-N 3.07Å; S508-L510 PolarHBondContact O-N 3.49Å; S508-N511 WeakPolarHBondContact O-CB 3.24Å; S508-N511 PolarHBondContact O-N 3.26Å
509	Y	75.2	Confident	54.5	Low	8 Å²	8	89.1 Å²	89.1	3%	0.031	52%	0.521	C	S	.	.	G	3₁₀ helix	trans	-67.1	-10.8	169.8	58.2	-105	0	0	0	114.6	F380 F381 D384 M485 I488 E507	F380-Y509 HydrophobicContact CB-CD1 3.86Å; F380-Y509 HydrophobicContact CB-CG 4.32Å; F381-Y509 HydrophobicContact CB-CD1 4.42Å; F381-Y509 HydrophobicContact CB-CD2 3.95Å; F381-Y509 HydrophobicContact CB-CE1 4.35Å; F381-Y509 HydrophobicContact CB-CE2 3.89Å; F381-Y509 HydrophobicContact CB-CG 4.21Å; F381-Y509 HydrophobicContact CD2-CD2 4.48Å; F381-Y509 AromaticContact CD2-CE2 3.72Å; F381-Y509 HydrophobicContact CD2-CE2 3.72Å; F381-Y509 HydrophobicContact CG-CE2 4.29Å; D384-Y509 HydrophobicContact CB-CE1 3.89Å; D384-Y509 WeakPolarHBondContact OD2-CE1 3.43Å; D384-Y509 PolarHBondContact OD2-OH 3.32Å; M485-Y509 HydrophobicContact CE-CD2 3.47Å; M485-Y509 VanDerWaalsContact CE-CD2 3.47Å; M485-Y509 HydrophobicContact CE-CE2 4.39Å; M485-Y509 HydrophobicContact CE-CG 3.98Å; I488-Y509 WeakPolarHBondContact CD1-OH 3.37Å; E507-Y509 HydrophobicContact CG-CE1 4.46Å; E507-Y509 PolarHBondContact O-N 3.25Å
510	L	72.3	Confident	52.2	Low	34 Å²	34	94.8 Å²	94.8	18%	0.178	54%	0.54	C	S	.	.	G	3₁₀ helix	trans	-84.7	-12.2	172.8	-62	-173.2	0	0	0	113.6	M485 E507 S508 V512	M485-L510 HydrophobicContact CB-CD2 4.32Å; M485-L510 WeakPolarHBondContact O-CD2 3.49Å; E507-L510 HydrophobicContact CB-CD1 3.93Å; E507-L510 HydrophobicContact CB-CG 4.19Å; E507-L510 HydrophobicContact CG-CD1 4.42Å; E507-L510 VanDerWaalsContact O-CB 3.25Å; E507-L510 WeakPolarHBondContact O-CB 3.29Å; E507-L510 WeakPolarHBondContact O-CG 3.42Å; E507-L510 PolarHBondContact O-N 2.96Å; S508-L510 PolarHBondContact O-N 3.49Å; L510-V512 PolarHBondContact O-N 3.01Å
511	N	62.7	Low	49.9	Very low	117 Å²	117	96.9 Å²	96.9	63%	0.626	56%	0.556	S	S	*	*			trans	-66.1	100	179	-81.6	-31.6	0	0	0	110.5	S508 A513	S508-N511 WeakPolarHBondContact O-CB 3.24Å; S508-N511 PolarHBondContact O-N 3.26Å; N511-A513 VanDerWaalsContact C-N 3.35Å; N511-A513 PolarHBondContact O-N 2.95Å
512	V	48.5	Very low	47.7	Very low	122 Å²	122	102.1 Å²	102.1	74%	0.739	58%	0.584	S	S	*	*			trans	-71.5	94.2	166.4	-178.2	0	0	0	0	107.2	L510 S514	L510-V512 PolarHBondContact O-N 3.01Å; V512-S514 PolarHBondContact O-N 3.49Å; V512-S514 VanDerWaalsContact O-N 3.13Å
513	A	33.6	Very low	45.7	Very low	85 Å²	85	108.8 Å²	108.8	70%	0.702	61%	0.613	S	S	*	*			trans	-59.1	115.3	159.4	0	0	0	0	0	107.3	N511 V515	N511-A513 VanDerWaalsContact C-N 3.35Å; N511-A513 PolarHBondContact O-N 2.95Å; A513-V515 PolarHBondContact O-N 3.48Å
514	S	27.7	Very low	44.1	Very low	108 Å²	108	106.5 Å²	106.5	76%	0.755	61%	0.605	S	S	*	*			trans	-60.2	100.2	-178.7	-55.5	0	0	0	0	109.9	V512 Q516	V512-S514 PolarHBondContact O-N 3.49Å; V512-S514 VanDerWaalsContact O-N 3.13Å; S514-Q516 PolarHBondContact O-N 2.88Å; S514-Q516 VanDerWaalsContact O-N 3.08Å
515	V	30	Very low	42.8	Very low	141 Å²	141	106.4 Å²	106.4	86%	0.855	60%	0.603	S	S	*	*			trans	-59	116.5	167	177.8	0	0	0	0	106	A513 S517	A513-V515 PolarHBondContact O-N 3.48Å; V515-S517 PolarHBondContact O-N 3.36Å
516	Q	26.6	Very low	41.4	Very low	181 Å²	181	111 Å²	111	85%	0.846	63%	0.625	S	S	*	*			trans	-57.3	126.5	179.5	-69	172	-46.6	0	0	108.2	S514 S518	S514-Q516 PolarHBondContact O-N 2.88Å; S514-Q516 VanDerWaalsContact O-N 3.08Å; Q516-S518 PolarHBondContact O-N 2.93Å; Q516-S518 VanDerWaalsContact O-N 3.09Å
517	S	25.8	Very low	40	Very low	98 Å²	98	113 Å²	113	69%	0.685	64%	0.64	S	S	*	*			trans	-59	114.5	174	48.2	0	0	0	0	108.9	V515 N519	V515-S517 PolarHBondContact O-N 3.36Å; S517-N519 PolarHBondContact O-N 2.72Å; S517-N519 PolarHBondContact O-OD1 3.28Å
518	S	27.2	Very low	38.3	Very low	114 Å²	114	117.4 Å²	117.4	80%	0.797	67%	0.665	S	S	*	*			trans	-56.6	122.3	158	46.9	0	0	0	0	107.5	Q516 E520	Q516-S518 PolarHBondContact O-N 2.93Å; Q516-S518 VanDerWaalsContact O-N 3.09Å; S518-E520 PolarHBondContact O-N 3.42Å; S518-E520 VanDerWaalsContact O-N 3.11Å
519	N	25.2	Very low	36.3	Very low	147 Å²	147	122.8 Å²	122.8	79%	0.786	69%	0.692	S	S	*	*			trans	-65.3	111.5	-166	-60.6	-32.8	0	0	0	112.2	S517	S517-N519 PolarHBondContact O-N 2.72Å; S517-N519 PolarHBondContact O-OD1 3.28Å
520	E	30.4	Very low	34.2	Very low	202 Å²	202	130.9 Å²	130.9	94%	0.944	73%	0.734	S	S	*	*			trans	-122.4	98.2	148.2	-72.6	-169.6	147.9	0	0	107.3	S518	S518-E520 PolarHBondContact O-N 3.42Å; S518-E520 VanDerWaalsContact O-N 3.11Å
521	S	29.4	Very low	32	Very low	88 Å²	88	134.4 Å²	134.4	62%	0.615	76%	0.761	S	S	*	*			trans	-122.7	161.6	170.9	64.4	0	0	0	0	108.5
522	N	32.9	Very low	30.5	Very low	126 Å²	126	135.3 Å²	135.3	67%	0.674	77%	0.771	S	S	*	*			trans	83.4	137.1	-178.1	-51.8	37.3	0	0	0	113.6
523	E	32.6	Very low	29.6	Very low	167 Å²	167	135.4 Å²	135.4	78%	0.78	77%	0.771	S	S	*	*			cis	-150.4	172.4	-12.3	-128	158.6	152.7	0	0	113.2
524	I	29	Very low	29.2	Very low	135 Å²	135	139.8 Å²	139.8	69%	0.692	78%	0.783	S	S	*	*			trans	-82.6	141.2	-164.7	-62.8	150.3	0	0	0	112.3	E526	I524-E526 HydrophobicContact CG2-CG 3.81Å
525	I	32.2	Very low	29.1	Very low	149 Å²	149	137.5 Å²	137.5	76%	0.764	78%	0.777	S	S	*	*			trans	-131.3	134.9	140.8	-61.1	-175.1	0	0	0	108.2
526	E	30	Very low	29.1	Very low	160 Å²	160	137.7 Å²	137.7	75%	0.748	78%	0.778	S	S	*	*			trans	-93.6	172.7	-179.6	-62.1	-174.8	109	0	0	112.6	I524	I524-E526 HydrophobicContact CG2-CG 3.81Å
527	S	28.9	Very low	29	Very low	115 Å²	115	136.3 Å²	136.3	80%	0.804	78%	0.776	S	S	*	*			trans	64.2	135.4	178.5	58.1	0	0	0	0	115.6
528	D	34	Very low	29.1	Very low	140 Å²	140	139.1 Å²	139.1	75%	0.749	78%	0.783	S	S	*	*			cis	-148.1	162.1	29.5	-133.3	-27.2	0	0	0	115.7
529	N	28	Very low	29.1	Very low	142 Å²	142	143.1 Å²	143.1	76%	0.759	79%	0.79	S	S	*	*			trans	-35	131	178.9	-70.6	-87.4	0	0	0	119.3
530	I	31.5	Very low	29.3	Very low	177 Å²	177	142.5 Å²	142.5	91%	0.908	80%	0.795	S	S	*	*			trans	-151.1	137.7	138	-101.8	154.1	0	0	0	109.2
531	S	26.2	Very low	29.1	Very low	108 Å²	108	140.3 Å²	140.3	76%	0.755	79%	0.79	S	S	*	*			trans	-122.5	123.3	-163.6	49	0	0	0	0	114.5
532	V	30.6	Very low	29.1	Very low	137 Å²	137	141 Å²	141	83%	0.83	80%	0.795	S	S	*	*			trans	-143.5	102.1	159.2	-175.2	0	0	0	0	110.8
533	V	30.2	Very low	29.2	Very low	123 Å²	123	141 Å²	141	75%	0.745	81%	0.805	S	S	*	*			trans	42.1	88.1	154.2	-165.5	0	0	0	0	117.8
534	N	24.7	Very low	29.1	Very low	177 Å²	177	140.1 Å²	140.1	95%	0.947	81%	0.805	S	S	*	*			trans	-79.8	132.6	138.4	-96.5	-29.6	0	0	0	108.2
535	G	26.5	Very low	29.3	Very low	61 Å²	61	140.3 Å²	140.3	63%	0.629	81%	0.813	S	S	*	*			trans	158.8	83.1	171.1	0	0	0	0	0	117
536	V	28.8	Very low	29.4	Very low	144 Å²	144	140.9 Å²	140.9	87%	0.873	81%	0.812	S	S	*	*				-150.3	110.2	120.5	179	0	0	0	0	107.2
537	N	26	Very low	29.5	Very low	153 Å²	153	139.6 Å²	139.6	82%	0.818	82%	0.816	S	S	*	*	S	Bend	trans	-152.1	124.5	160.7	-108.6	-22.1	0	0	0	107.5
538	N	26.8	Very low	29.6	Very low	156 Å²	156	140.7 Å²	140.7	83%	0.834	81%	0.812	S	S	*	*			trans	54	94.1	175	-58.9	-23.7	0	0	0	117.7
539	E	28.1	Very low	29.6	Very low	199 Å²	199	140 Å²	140	93%	0.93	81%	0.813	S	S	*	*			trans	-158.8	116.2	134	-128.6	174.8	-143.6	0	0	113.4
540	C	28.3	Very low	29.9	Very low	133 Å²	133	139.1 Å²	139.1	90%	0.899	81%	0.813	S	S	*	*			trans	-164.8	94.9	140.3	-167.5	0	0	0	0	108.8
541	N	26	Very low	30.1	Very low	157 Å²	157	135 Å²	135	84%	0.84	80%	0.8	S	S	*	*			trans	-145.7	90.8	176.9	-154.5	13.7	0	0	0	108.9
542	S	30.7	Very low	30.6	Very low	102 Å²	102	136.3 Å²	136.3	71%	0.713	80%	0.799	S	S	*	*			trans	169.9	126.9	154.2	-84.4	0	0	0	0	113.4
543	S	34.9	Very low	30.8	Very low	127 Å²	127	136.7 Å²	136.7	89%	0.888	80%	0.796	S	S	*	*			trans	-157	105.5	139.4	-80.7	0	0	0	0	107.3
544	N	29.7	Very low	31	Very low	147 Å²	147	135.2 Å²	135.2	79%	0.786	79%	0.791	S	S	*	*			trans	-73.8	147.9	-176.2	-76.8	-45.2	0	0	0	111.9
545	T	34.1	Very low	31.5	Very low	140 Å²	140	134.9 Å²	134.9	86%	0.859	78%	0.784	S	S	*	*				-156.2	150.2	128.9	0.2	0	0	0	0	111.3
546	H	32.9	Very low	31.9	Very low	161 Å²	161	136.3 Å²	136.3	75%	0.745	78%	0.784	S	S	*	*			trans	-63.5	163.6	-175.4	-59.1	-83.6	0	0	0	112.2
547	T	32.9	Very low	32.2	Very low	133 Å²	133	139.1 Å²	139.1	82%	0.816	79%	0.785	S	S	*	*			cis	-153.8	156.5	44.9	50.5	0	0	0	0	116.5
548	N	30.7	Very low	32.6	Very low	138 Å²	138	136.7 Å²	136.7	74%	0.738	78%	0.78	S	S	*	*			trans	-34.4	155.7	162.6	-47.5	-14.6	0	0	0	114.5
549	T	33.5	Very low	33	Very low	124 Å²	124	134.7 Å²	134.7	76%	0.761	78%	0.778	S	S	*	*				-163.5	153.1	59	34.2	0	0	0	0	116
550	T	34.6	Very low	33.4	Very low	125 Å²	125	131 Å²	131	77%	0.767	78%	0.775	S	S	*	*			trans	6.5	148.6	145.2	45.8	0	0	0	0	121.3
551	S	37	Very low	33.6	Very low	91 Å²	91	130.2 Å²	130.2	64%	0.636	77%	0.77	S	S	*	*			cis	-174.9	152.5	7.6	40.2	0	0	0	0	115.2
552	N	36.2	Very low	33.8	Very low	135 Å²	135	128.1 Å²	128.1	72%	0.722	77%	0.768	S	S	*	*			trans	66.9	128	139.2	-62.3	4.9	0	0	0	123.7
553	N	34.1	Very low	33.9	Very low	145 Å²	145	129.3 Å²	129.3	78%	0.775	78%	0.776	S	S	*	*			trans	72.2	146.3	135.4	-63	7	0	0	0	120.3
554	S	35.2	Very low	33.8	Very low	92 Å²	92	129 Å²	129	64%	0.643	77%	0.774	S	S	*	*			cis	-163.9	171.7	-11.6	45.1	0	0	0	0	112.9
555	E	34.5	Very low	33.8	Very low	170 Å²	170	127.7 Å²	127.7	79%	0.794	78%	0.776	S	S	*	*			trans	76.7	82	149.2	-77.6	163.9	167.3	0	0	123.3
556	S	34.1	Very low	33.7	Very low	90 Å²	90	126.1 Å²	126.1	63%	0.629	77%	0.771	S	S	*	*				77.8	130.2	105.7	75.6	0	0	0	0	124.3
557	K	35.2	Very low	34	Very low	203 Å²	203	126.2 Å²	126.2	88%	0.883	78%	0.776	S	S	*	*			trans	69.5	145.9	145.3	-66	163.7	-175.6	173.8	0	116.7
558	S	35.2	Very low	34.6	Very low	102 Å²	102	123.7 Å²	123.7	71%	0.713	76%	0.763	S	S	*	*			cis	-152.7	123.5	10.8	55.1	0	0	0	0	110.4
559	S	35	Very low	35.6	Very low	114 Å²	114	123.9 Å²	123.9	80%	0.797	77%	0.769	S	S	*	*				88.9	97.9	93.9	76.4	0	0	0	0	117.9
560	S	37	Very low	37.1	Very low	123 Å²	123	121.6 Å²	121.6	86%	0.86	75%	0.752	S	S	*	*			trans	-159.1	141.7	140.2	56.7	0	0	0	0	108.7
561	S	31.4	Very low	39	Very low	115 Å²	115	117.5 Å²	117.5	80%	0.804	73%	0.725	S	S	*	*			trans	-164.7	156.1	-164.1	56.2	0	0	0	0	114.7
562	S	30.9	Very low	40.8	Very low	114 Å²	114	116.9 Å²	116.9	80%	0.797	72%	0.719	S	S	*	*			trans	113.4	115.2	160.6	73	0	0	0	0	116.4
563	S	32.1	Very low	43.2	Very low	127 Å²	127	115 Å²	115	89%	0.888	70%	0.702	S	S	*	*			trans	166.1	60	155.7	38.6	0	0	0	0	112.1
564	S	33.6	Very low	45.9	Very low	120 Å²	120	108.3 Å²	108.3	84%	0.839	67%	0.666	S	S	*	*			trans	-154.5	52	-178	68.1	0	0	0	0	114.5
565	S	29.8	Very low	48.7	Very low	119 Å²	119	104.7 Å²	104.7	83%	0.832	64%	0.639	S	S	*	*			trans	-156.8	53.6	-174.7	61.9	0	0	0	0	114.4
566	S	32.6	Very low	51.5	Low	107 Å²	107	96.7 Å²	96.7	75%	0.748	60%	0.601	S	S	*	*			trans	-155	29.2	176.3	65.4	0	0	0	0	115.3	S568	S566-S568 PolarHBondContact O-N 2.93Å; S566-S568 VanDerWaalsContact O-N 3.09Å
567	I	39.1	Very low	54.3	Low	164 Å²	164	96.6 Å²	96.6	84%	0.841	59%	0.59	S	S	*	*			trans	-71.9	102.9	161.4	-67.8	178.2	0	0	0	106.4
568	S	44.5	Very low	57	Low	80 Å²	80	89 Å²	89	56%	0.559	56%	0.559	S	S	*	*			trans	-62.6	148.4	174.2	47	0	0	0	0	110.2	S566 L570	S566-S568 PolarHBondContact O-N 2.93Å; S566-S568 VanDerWaalsContact O-N 3.09Å; S568-L570 PolarHBondContact O-N 3.38Å
569	T	52.8	Low	59.6	Low	141 Å²	141	84.6 Å²	84.6	87%	0.865	53%	0.528	S	S	*	.			trans	-59.7	111.2	-173.9	48.5	0	0	0	0	110.9	D571	T569-D571 PolarHBondContact O-N 3.07Å
570	L	64.4	Low	61.9	Low	76 Å²	76	82.8 Å²	82.8	40%	0.398	51%	0.509	S	S	.	.			trans	-55.9	109.6	177.1	-170	85.3	0	0	0	109.6	P486 L490 S568 P572	P486-L570 WeakPolarHBondContact O-CD1 3.39Å; L490-L570 HydrophobicContact CD1-CD2 3.98Å; L490-L570 HydrophobicContact CD2-CD2 4.2Å; L490-L570 HydrophobicContact CG-CD2 4.07Å; S568-L570 PolarHBondContact O-N 3.38Å; L570-P572 WeakPolarHBondContact O-CD 3.49Å
571	D	73.6	Confident	64.1	Low	39 Å²	39	81.2 Å²	81.2	21%	0.209	49%	0.494	C	S	.	.			trans	-67.1	109.6	179.1	173.5	10.9	0	0	0	110.1	T569 W573 W574 K577	T569-D571 PolarHBondContact O-N 3.07Å; D571-W573 PolarHBondContact O-N 3.09Å; D571-W573 WeakPolarHBondContact OD1-CA 3.33Å; D571-W573 PolarHBondContact OD1-N 2.84Å; D571-W574 HydrophobicContact CB-CB 4.42Å; D571-W574 WeakPolarHBondContact O-CB 3.27Å; D571-W574 PolarHBondContact O-N 3.28Å; D571-W574 PolarHBondContact OD1-N 2.85Å; D571-W574 WeakPolarHBondContact OD2-CA 3.3Å; D571-W574 PolarHBondContact OD2-N 3.41Å; D571-K577 WeakPolarHBondContact OD2-CE 3.29Å; D571-K577 IonicContact OD2-NZ 3.68Å; D571-K577 PolarHBondContact OD2-NZ 3.33Å
572	P	75.6	Confident	67	Low	78 Å²	78	76.5 Å²	76.5	51%	0.506	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-17.7	-177.7	31.3	-34.2	0	0	0	112	L570	L570-P572 WeakPolarHBondContact O-CD 3.49Å
573	W	87.2	Confident	70	Confident	96 Å²	96	71.8 Å²	71.8	36%	0.364	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	15	-179	-55.3	108.9	0	0	0	112.9	D571 F575 C576 K577 T715 E716 Y719	D571-W573 PolarHBondContact O-N 3.09Å; D571-W573 WeakPolarHBondContact OD1-CA 3.33Å; D571-W573 PolarHBondContact OD1-N 2.84Å; W573-F575 PolarHBondContact O-N 3.5Å; W573-C576 HydrophobicContact CB-CB 4.33Å; W573-C576 WeakPolarHBondContact O-CA 3.39Å; W573-C576 WeakPolarHBondContact O-CB 3.35Å; W573-C576 PolarHBondContact O-N 2.97Å; W573-K577 PolarHBondContact O-N 3.46Å; W573-T715 HydrophobicContact CH2-CG2 3.92Å; W573-T715 HydrophobicContact CZ3-CG2 4.27Å; W573-E716 HydrophobicContact CZ3-CG 4.43Å; W573-Y719 HydrophobicContact CB-CD1 4.3Å; W573-Y719 HydrophobicContact CB-CE1 3.78Å; W573-Y719 AromaticContact CD2-CD1 3.74Å; W573-Y719 HydrophobicContact CD2-CD1 3.74Å; W573-Y719 AromaticContact CD2-CE1 3.81Å; W573-Y719 HydrophobicContact CD2-CE1 3.81Å; W573-Y719 HydrophobicContact CD2-CG 4.4Å; W573-Y719 AromaticContact CE3-CD1 3.38Å; W573-Y719 HydrophobicContact CE3-CD1 3.38Å; W573-Y719 AromaticContact CE3-CE1 3.96Å; W573-Y719 HydrophobicContact CE3-CE1 3.96Å; W573-Y719 AromaticContact CE3-CG 3.94Å; W573-Y719 HydrophobicContact CE3-CG 3.94Å; W573-Y719 HydrophobicContact CG-CD1 4.15Å; W573-Y719 AromaticContact CG-CE1 3.75Å; W573-Y719 HydrophobicContact CG-CE1 3.75Å; W573-Y719 AromaticContact CZ3-CD1 3.93Å; W573-Y719 HydrophobicContact CZ3-CD1 3.93Å; W573-Y719 HydrophobicContact CZ3-CG 4.01Å
574	W	90.6	Very high	73	Confident	5 Å²	5	66.6 Å²	66.6	2%	0.019	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-48.4	-40.1	-179.4	73	-88.1	0	0	0	113.2	N483 R484 A487 L491 D571 C576 K577 Y616	N483-W574 VanDerWaalsContact O-CE3 3.28Å; R484-W574 VanDerWaalsContact CA-CZ3 3.49Å; R484-W574 HydrophobicContact CB-CE3 4.3Å; R484-W574 HydrophobicContact CB-CH2 4.34Å; R484-W574 HydrophobicContact CB-CZ3 3.68Å; R484-W574 HydrophobicContact CG-CH2 3.76Å; R484-W574 HydrophobicContact CG-CZ3 3.63Å; A487-W574 HydrophobicContact CB-CD2 3.43Å; A487-W574 VanDerWaalsContact CB-CD2 3.43Å; A487-W574 HydrophobicContact CB-CE3 4.17Å; A487-W574 HydrophobicContact CB-CG 3.59Å; A487-W574 HydrophobicContact CB-CH2 4.48Å; A487-W574 HydrophobicContact CB-CZ2 3.79Å; L491-W574 HydrophobicContact CD2-CH2 3.92Å; L491-W574 HydrophobicContact CD2-CZ2 3.85Å; D571-W574 HydrophobicContact CB-CB 4.42Å; D571-W574 WeakPolarHBondContact O-CB 3.27Å; D571-W574 PolarHBondContact O-N 3.28Å; D571-W574 PolarHBondContact OD1-N 2.85Å; D571-W574 WeakPolarHBondContact OD2-CA 3.3Å; D571-W574 PolarHBondContact OD2-N 3.41Å; W574-C576 VanDerWaalsContact C-N 3.3Å; W574-C576 PolarHBondContact O-N 3.01Å; W574-K577 WeakPolarHBondContact O-CB 3.36Å; W574-K577 PolarHBondContact O-N 3.49Å; W574-Y616 HydrophobicContact CH2-CD1 4.13Å; W574-Y616 HydrophobicContact CH2-CG 4.14Å; W574-Y616 AromaticContact CZ2-CD1 3.5Å; W574-Y616 HydrophobicContact CZ2-CD1 3.5Å; W574-Y616 AromaticContact CZ2-CD2 3.72Å; W574-Y616 HydrophobicContact CZ2-CD2 3.72Å; W574-Y616 AromaticContact CZ2-CE1 3.81Å; W574-Y616 HydrophobicContact CZ2-CE1 3.81Å; W574-Y616 AromaticContact CZ2-CE2 3.99Å; W574-Y616 HydrophobicContact CZ2-CE2 3.99Å; W574-Y616 AromaticContact CZ2-CG 3.44Å; W574-Y616 HydrophobicContact CZ2-CG 3.44Å; W574-Y616 VanDerWaalsContact CZ2-CG 3.44Å; W574-Y616 AromaticContact NE1-CE1 3.99Å; W574-Y616 AromaticContact NE1-CE2 3.79Å; W574-Y616 AromaticContact NE1-CZ 3.56Å
575	F	93.1	Very high	76	Confident	16 Å²	16	60.9 Å²	60.9	7%	0.07	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-75	-21.5	-179.5	-169.5	-111.8	0	0	0	112.4	W573 K599 S611 F613 Y616	W573-F575 PolarHBondContact O-N 3.5Å; F575-K599 HydrophobicContact CE1-CD 4.19Å; F575-K599 HydrophobicContact CE1-CG 4.14Å; F575-K599 HydrophobicContact CE2-CD 4.39Å; F575-K599 HydrophobicContact CZ-CB 4.44Å; F575-K599 HydrophobicContact CZ-CD 3.9Å; F575-K599 HydrophobicContact CZ-CG 3.91Å; F575-K599 VanDerWaalsContact O-CE 3.24Å; F575-K599 WeakPolarHBondContact O-CE 3.46Å; F575-K599 PolarHBondContact O-NZ 3.34Å; F575-S611 WeakPolarHBondContact CE2-OG 3.46Å; F575-F613 AromaticContact CD1-CD1 3.55Å; F575-F613 HydrophobicContact CD1-CD1 3.55Å; F575-F613 AromaticContact CD1-CE1 3.9Å; F575-F613 HydrophobicContact CD1-CE1 3.9Å; F575-F613 HydrophobicContact CD1-CG 4.06Å; F575-F613 HydrophobicContact CE1-CB 4.22Å; F575-F613 AromaticContact CE1-CD1 3.48Å; F575-F613 HydrophobicContact CE1-CD1 3.48Å; F575-F613 VanDerWaalsContact CE1-CD1 3.48Å; F575-F613 AromaticContact CE1-CD2 3.96Å; F575-F613 HydrophobicContact CE1-CD2 3.96Å; F575-F613 AromaticContact CE1-CE1 3.74Å; F575-F613 HydrophobicContact CE1-CE1 3.74Å; F575-F613 HydrophobicContact CE1-CE2 4.19Å; F575-F613 AromaticContact CE1-CG 3.6Å; F575-F613 HydrophobicContact CE1-CG 3.6Å; F575-F613 HydrophobicContact CE1-CZ 4.09Å; F575-Y616 HydrophobicContact CB-CD1 4.15Å; F575-Y616 HydrophobicContact CB-CE1 3.84Å; F575-Y616 HydrophobicContact CD1-CD1 4.36Å; F575-Y616 HydrophobicContact CD1-CE1 4.4Å; F575-Y616 HydrophobicContact CD2-CD1 4.35Å; F575-Y616 HydrophobicContact CG-CD1 4.03Å; F575-Y616 HydrophobicContact CG-CE1 4.13Å
576	C	93.6	Very high	79.1	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.007	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-85.4	-11.6	178.3	-60	0	0	0	0	113.1	W573 W574 E716 Y719 H720 L723	W573-C576 HydrophobicContact CB-CB 4.33Å; W573-C576 WeakPolarHBondContact O-CA 3.39Å; W573-C576 WeakPolarHBondContact O-CB 3.35Å; W573-C576 PolarHBondContact O-N 2.97Å; W574-C576 VanDerWaalsContact C-N 3.3Å; W574-C576 PolarHBondContact O-N 3.01Å; C576-E716 PolarHBondContact SG-O 3.02Å; C576-E716 VanDerWaalsContact SG-O 3.34Å; C576-Y719 HydrophobicContact CB-CD1 3.52Å; C576-Y719 HydrophobicContact CB-CE1 3.89Å; C576-H720 HydrophobicContact CB-CB 4.07Å; C576-H720 PolarHBondContact O-ND1 3.48Å; C576-L723 HydrophobicContact CB-CD1 4.33Å; C576-L723 WeakPolarHBondContact O-CD1 3.47Å
577	K	92.4	Very high	82.1	Confident	88 Å²	88	50.8 Å²	50.8	38%	0.383	28%	0.275	S	S	.	.			trans	-52.8	142.6	171.5	-75.9	175.6	164.1	153.3	0	111.1	N483 D571 W573 W574	N483-K577 WeakPolarHBondContact ND2-CB 3.39Å; N483-K577 WeakPolarHBondContact OD1-CD 3.47Å; D571-K577 WeakPolarHBondContact OD2-CE 3.29Å; D571-K577 IonicContact OD2-NZ 3.68Å; D571-K577 PolarHBondContact OD2-NZ 3.33Å; W573-K577 PolarHBondContact O-N 3.46Å; W574-K577 WeakPolarHBondContact O-CB 3.36Å; W574-K577 PolarHBondContact O-N 3.49Å
578	L	92.1	Very high	84.7	Confident	45 Å²	45	43 Å²	43	24%	0.236	24%	0.236	C	C	.	.			trans	-77.6	157.1	176.6	-55.1	-174.7	0	0	0	110	L723 I724 R727	L578-L723 HydrophobicContact CD1-CB 4.39Å; L578-L723 HydrophobicContact CD2-CB 3.95Å; L578-L723 HydrophobicContact CG-CB 4.29Å; L578-I724 HydrophobicContact CD2-CG1 3.74Å; L578-R727 HydrophobicContact CD1-CB 3.64Å; L578-R727 HydrophobicContact CD1-CG 4.24Å
579	C	89.7	Confident	86.9	Confident	9 Å²	9	46.2 Å²	46.2	6%	0.061	24%	0.235	C	C	.	.			trans	-131.4	148.8	171.7	-62.4	0	0	0	0	105.3	I479 C480 V581	I479-C579 HydrophobicContact CB-CB 4.23Å; I479-C579 HydrophobicContact CG2-CB 4.15Å; C480-C579 WeakPolarHBondContact CA-SG 3.28Å; C480-C579 HydrophobicContact CB-CB 4.43Å; C480-C579 WeakPolarHBondContact CB-SG 3.39Å; C480-C579 PolarHBondContact N-SG 3.2Å; C480-C579 WeakPolarHBondContact SG-CB 3.4Å; C480-C579 CovalentContact SG-SG 2.06Å; C480-C579 PolarHBondContact SG-SG 3.36Å; C579-V581 CarbonylContact O-C 3.59Å; C579-V581 PolarHBondContact O-N 3.47Å
580	D	82.9	Confident	88.3	Confident	75 Å²	75	42 Å²	42	40%	0.401	21%	0.207	S	C	.	.	S	Bend	trans	-49.9	-28.2	-167.8	-57.9	30.3	0	0	0	114.8	K369	K369-D580 WeakPolarHBondContact CD-OD2 3.34Å; K369-D580 IonicContact NZ-OD2 1.73Å; K369-D580 PolarHBondContact NZ-OD2 2.78Å
581	V	84.2	Confident	88.9	Confident	91 Å²	91	45.3 Å²	45.3	55%	0.552	22%	0.221	S	C	*	.	S	Bend	trans	-107	126.4	172.1	-179.2	0	0	0	0	109.3	C579 H583	C579-V581 CarbonylContact O-C 3.59Å; C579-V581 PolarHBondContact O-N 3.47Å; V581-H583 PolarHBondContact O-N 3.42Å
582	I	91.9	Very high	89	Confident	15 Å²	15	49.4 Å²	49.4	8%	0.077	24%	0.243	C	C	.	.			trans	-65.8	106	177.6	-49.7	174.4	0	0	0	109.7	I724 Y728 F731 Y749 F752	I582-I724 HydrophobicContact CD1-CG2 3.97Å; I582-I724 HydrophobicContact CG2-CD1 3.84Å; I582-I724 HydrophobicContact CG2-CG1 4.21Å; I582-I724 HydrophobicContact CG2-CG2 4.04Å; I582-Y728 HydrophobicContact CD1-CD2 3.64Å; I582-Y728 HydrophobicContact CD1-CE2 4.1Å; I582-Y728 HydrophobicContact CD1-CG 3.89Å; I582-Y728 HydrophobicContact CG1-CD2 3.97Å; I582-Y728 HydrophobicContact CG1-CE2 3.91Å; I582-F731 HydrophobicContact CD1-CB 4.49Å; I582-F731 HydrophobicContact CD1-CD2 3.67Å; I582-F731 HydrophobicContact CD1-CE2 4.18Å; I582-F731 HydrophobicContact CD1-CG 4.25Å; I582-F731 HydrophobicContact CG2-CE2 4.05Å; I582-F731 HydrophobicContact CG2-CZ 4.38Å; I582-Y749 HydrophobicContact CB-CD1 4.37Å; I582-Y749 HydrophobicContact CG2-CD1 3.84Å; I582-Y749 HydrophobicContact CG2-CE1 4.04Å; I582-F752 HydrophobicContact CD1-CB 4.49Å; I582-F752 HydrophobicContact CD1-CD2 3.6Å; I582-F752 HydrophobicContact CD1-CE2 4.11Å; I582-F752 HydrophobicContact CD1-CG 4.19Å
583	H	93.4	Very high	88.9	Confident	16 Å²	16	52.1 Å²	52.1	7%	0.074	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-60.9	129.4	177.7	-72.8	-75.6	0	0	0	111.9	C480 V581 I585 K599 V600	C480-H583 PolarHBondContact SG-NE2 2.91Å; C480-H583 VanDerWaalsContact SG-NE2 3.4Å; V581-H583 PolarHBondContact O-N 3.42Å; H583-I585 PolarHBondContact O-N 3.43Å; H583-I585 VanDerWaalsContact O-N 3.13Å; H583-K599 HydrophobicContact CB-CB 4.16Å; H583-K599 HydrophobicContact CB-CD 4.37Å; H583-V600 PolarHBondContact ND1-O 2.58Å; H583-V600 VanDerWaalsContact ND1-O 3.08Å
584	P	95.1	Very high	88.6	Confident	17 Å²	17	49.3 Å²	49.3	11%	0.11	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-59	118.5	176.7	-25.8	34.9	0	0	0	111.9	V600 L628 F740 V745 Y749	P584-V600 HydrophobicContact CB-CB 4.16Å; P584-V600 HydrophobicContact CB-CG2 4.34Å; P584-V600 HydrophobicContact CG-CB 4.48Å; P584-V600 WeakPolarHBondContact O-CG2 3.13Å; P584-V600 PolarHBondContact O-N 2.79Å; P584-L628 HydrophobicContact CB-CD2 4.35Å; P584-F740 HydrophobicContact CB-CE2 3.96Å; P584-V745 HydrophobicContact CB-CG2 4.47Å; P584-V745 HydrophobicContact CG-CG1 3.83Å; P584-V745 HydrophobicContact CG-CG2 4.4Å; P584-Y749 HydrophobicContact CB-CD1 4.39Å; P584-Y749 HydrophobicContact CB-CD2 4.24Å; P584-Y749 HydrophobicContact CB-CE2 4.48Å; P584-Y749 HydrophobicContact CB-CG 4.19Å; P584-Y749 HydrophobicContact CG-CD1 4.48Å; P584-Y749 HydrophobicContact CG-CG 4.2Å
585	I	96.6	Very high	88.6	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	127.2	178.9	-51.9	178.7	0	0	0	108.8	H583 F613 L628 H629 L717 V721 I724 Y749	H583-I585 PolarHBondContact O-N 3.43Å; H583-I585 VanDerWaalsContact O-N 3.13Å; I585-F613 HydrophobicContact CG2-CE2 4.29Å; I585-L628 WeakPolarHBondContact O-CA 3.16Å; I585-H629 HydrophobicContact CB-CB 3.97Å; I585-H629 HydrophobicContact CG2-CB 3.71Å; I585-H629 PolarHBondContact O-N 2.89Å; I585-L717 HydrophobicContact CD1-CD1 4.45Å; I585-L717 HydrophobicContact CG2-CD1 3.56Å; I585-V721 HydrophobicContact CD1-CG2 3.65Å; I585-I724 HydrophobicContact CD1-CD1 3.95Å; I585-Y749 HydrophobicContact CG1-CE1 4.41Å; I585-Y749 PolarHBondContact N-OH 3.31Å
586	V	95.8	Very high	88.6	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	158.4	-174.7	-68.7	0	0	0	0	112.5	I588 P597 A598 V600 V610 K627 L628 F740	V586-I588 HydrophobicContact CB-CD1 4.21Å; V586-I588 HydrophobicContact CG2-CD1 3.66Å; V586-I588 HydrophobicContact CG2-CG1 4.02Å; V586-P597 CarbonylContact O-C 3.57Å; V586-P597 WeakPolarHBondContact O-CA 3.26Å; V586-A598 HydrophobicContact CG2-CB 4.08Å; V586-A598 PolarHBondContact N-O 2.77Å; V586-A598 PolarHBondContact O-N 3.22Å; V586-V600 HydrophobicContact CB-CG2 4.27Å; V586-V600 HydrophobicContact CG1-CG2 3.64Å; V586-V600 HydrophobicContact CG2-CG2 3.58Å; V586-V610 HydrophobicContact CG2-CG1 4.36Å; V586-K627 CarbonylContact C-O 3.39Å; V586-K627 VanDerWaalsContact CA-O 3.24Å; V586-K627 WeakPolarHBondContact CA-O 2.96Å; V586-L628 HydrophobicContact CG1-CD2 4.05Å; V586-F740 HydrophobicContact CG1-CD2 3.59Å; V586-F740 HydrophobicContact CG1-CE2 4.14Å
587	W	95.6	Very high	88.7	Confident	14 Å²	14	54.1 Å²	54.1	5%	0.053	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	118.8	162.5	-61.7	86.1	0	0	0	108.4	R595 W596 P597 K627 H629 L637 F710 I714 L717	W587-R595 HydrophobicContact CB-CB 4.47Å; W587-R595 HydrophobicContact CE3-CB 4.26Å; W587-W596 WeakPolarHBondContact CA-O 3.5Å; W587-P597 HydrophobicContact CE3-CB 4.27Å; W587-P597 HydrophobicContact CH2-CB 4.4Å; W587-P597 HydrophobicContact CZ3-CB 4.19Å; W587-P597 HydrophobicContact CZ3-CG 4.25Å; W587-K627 PolarHBondContact N-O 3.22Å; W587-K627 PolarHBondContact O-N 3.19Å; W587-H629 AromaticContact CE2-ND1 3.73Å; W587-H629 AromaticContact CZ2-ND1 3.73Å; W587-H629 AromaticContact NE1-CG 3.93Å; W587-H629 AromaticContact NE1-ND1 3.27Å; W587-H629 PolarHBondContact NE1-ND1 3.45Å; W587-L637 HydrophobicContact CH2-CD1 3.97Å; W587-L637 HydrophobicContact CZ2-CD1 3.84Å; W587-F710 HydrophobicContact CZ3-CE2 4.31Å; W587-F710 HydrophobicContact CZ3-CZ 4.34Å; W587-I714 HydrophobicContact CH2-CD1 3.64Å; W587-I714 HydrophobicContact CZ3-CD1 4.19Å; W587-L717 HydrophobicContact CH2-CD2 4.21Å; W587-L717 HydrophobicContact CZ2-CD2 4.01Å
588	I	93.8	Very high	88.9	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	141.2	176.6	-56.1	-54.6	0	0	0	109.2	V586 L590 R595 W596 A598 V610 F612 A621 A626	V586-I588 HydrophobicContact CB-CD1 4.21Å; V586-I588 HydrophobicContact CG2-CD1 3.66Å; V586-I588 HydrophobicContact CG2-CG1 4.02Å; I588-L590 HydrophobicContact CG2-CD2 3.77Å; I588-L590 HydrophobicContact CG2-CG 4.05Å; I588-R595 VanDerWaalsContact O-CA 3.26Å; I588-R595 WeakPolarHBondContact O-CA 3.5Å; I588-W596 PolarHBondContact N-O 2.87Å; I588-W596 PolarHBondContact O-N 3.37Å; I588-W596 VanDerWaalsContact O-N 3.08Å; I588-A598 HydrophobicContact CG1-CB 4.3Å; I588-V610 HydrophobicContact CD1-CG1 4.12Å; I588-V610 HydrophobicContact CG1-CG1 4.19Å; I588-V610 HydrophobicContact CG1-CG2 4.32Å; I588-F612 HydrophobicContact CB-CE1 3.97Å; I588-F612 HydrophobicContact CB-CZ 4.26Å; I588-F612 HydrophobicContact CG1-CE1 4.17Å; I588-F612 HydrophobicContact CG2-CZ 4.34Å; I588-A621 HydrophobicContact CD1-CB 3.92Å; I588-A621 HydrophobicContact CG1-CB 4.21Å; I588-A621 HydrophobicContact CG2-CB 3.67Å; I588-A626 HydrophobicContact CD1-CB 3.44Å; I588-A626 VanDerWaalsContact CD1-CB 3.44Å
589	R	91	Very high	89.1	Confident	146 Å²	146	47.9 Å²	47.9	55%	0.551	23%	0.227	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	103.2	166.1	-179.5	165.8	175.6	71.5	-11.4	110	Y593 R595 S625	R589-Y593 PolarHBondContact NH1-O 2.89Å; R589-R595 HydrophobicContact CB-CG 3.93Å; R589-S625 PolarHBondContact N-O 2.75Å
590	L	82.2	Confident	89.3	Confident	52 Å²	52	47.7 Å²	47.7	27%	0.272	23%	0.225	S	C	.	.			trans	-81.9	164.2	166.2	-57.1	-179.5	0	0	0	110.3	I588 Y593 F612 T619	I588-L590 HydrophobicContact CG2-CD2 3.77Å; I588-L590 HydrophobicContact CG2-CG 4.05Å; L590-Y593 HydrophobicContact CB-CD2 4.23Å; L590-F612 HydrophobicContact CD1-CE2 4.23Å; L590-F612 HydrophobicContact CD1-CZ 4.01Å; L590-F612 HydrophobicContact CG-CZ 4.47Å; L590-T619 HydrophobicContact CD1-CG2 4.34Å
591	Q	76.7	Confident	89.7	Confident	147 Å²	147	45.1 Å²	45.1	69%	0.687	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	141.5	173.7	-174.3	167.1	-14.3	0	0	110	Y593	Q591-Y593 VanDerWaalsContact O-CD2 3.24Å; Q591-Y593 WeakPolarHBondContact O-CD2 3.35Å; Q591-Y593 PolarHBondContact O-N 2.87Å
592	N	75.6	Confident	89.8	Confident	125 Å²	125	42.1 Å²	42.1	67%	0.668	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.3	2.6	-179.4	-55.2	-23	0	0	0	117.2
593	Y	72.9	Confident	89.5	Confident	135 Å²	135	45.6 Å²	45.6	53%	0.529	21%	0.212	S	C	.	.	S	Bend	trans	-112.4	158.6	176.3	-72.9	-79.3	0	0	0	112.6	R589 L590 Q591	R589-Y593 PolarHBondContact NH1-O 2.89Å; L590-Y593 HydrophobicContact CB-CD2 4.23Å; Q591-Y593 VanDerWaalsContact O-CD2 3.24Å; Q591-Y593 WeakPolarHBondContact O-CD2 3.35Å; Q591-Y593 PolarHBondContact O-N 2.87Å
594	P	82.1	Confident	88.6	Confident	36 Å²	36	46.5 Å²	46.5	23%	0.234	22%	0.217	C	C	.	.			trans	-66.8	-177.9	167.4	32.1	-37.9	0	0	0	111.3	W596 M702	P594-W596 HydrophobicContact CG-CE3 3.91Å; P594-W596 HydrophobicContact CG-CZ3 4.08Å; P594-W596 PolarHBondContact O-N 2.89Å; P594-M702 HydrophobicContact CB-CE 3.56Å; P594-M702 HydrophobicContact CG-CE 3.65Å
595	R	89.5	Confident	87.9	Confident	106 Å²	106	47.3 Å²	47.3	40%	0.4	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	118	166.4	-86	-172.8	-175.8	131	10.8	109.7	W587 I588 R589	W587-R595 HydrophobicContact CB-CB 4.47Å; W587-R595 HydrophobicContact CE3-CB 4.26Å; I588-R595 VanDerWaalsContact O-CA 3.26Å; I588-R595 WeakPolarHBondContact O-CA 3.5Å; R589-R595 HydrophobicContact CB-CG 3.93Å
596	W	93.6	Very high	87.3	Confident	17 Å²	17	52.9 Å²	52.9	6%	0.064	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	141.3	178.6	-146.8	-89.7	0	0	0	111.1	W587 I588 P594 F612 F613 V706 N709 F710 A713	W587-W596 WeakPolarHBondContact CA-O 3.5Å; I588-W596 PolarHBondContact N-O 2.87Å; I588-W596 PolarHBondContact O-N 3.37Å; I588-W596 VanDerWaalsContact O-N 3.08Å; P594-W596 HydrophobicContact CG-CE3 3.91Å; P594-W596 HydrophobicContact CG-CZ3 4.08Å; P594-W596 PolarHBondContact O-N 2.89Å; W596-F612 HydrophobicContact CB-CD1 3.8Å; W596-F612 HydrophobicContact CB-CE1 3.83Å; W596-F612 AromaticContact CD1-CD1 3.57Å; W596-F612 AromaticContact CD1-CG 3.99Å; W596-F612 AromaticContact CG-CD1 3.97Å; W596-F612 HydrophobicContact CG-CD1 3.97Å; W596-F612 HydrophobicContact CG-CE1 4.46Å; W596-F613 PolarHBondContact NE1-O 3.34Å; W596-V706 HydrophobicContact CH2-CG1 3.59Å; W596-V706 WeakPolarHBondContact CH2-O 3.47Å; W596-V706 HydrophobicContact CZ3-CG1 3.42Å; W596-V706 VanDerWaalsContact CZ3-CG1 3.42Å; W596-N709 HydrophobicContact CH2-CB 4.16Å; W596-N709 HydrophobicContact CZ2-CB 4.06Å; W596-F710 HydrophobicContact CD2-CD2 4.2Å; W596-F710 AromaticContact CE3-CD2 3.84Å; W596-F710 HydrophobicContact CE3-CD2 3.84Å; W596-F710 HydrophobicContact CH2-CB 3.58Å; W596-F710 HydrophobicContact CH2-CD2 4.09Å; W596-F710 HydrophobicContact CH2-CG 4.36Å; W596-F710 HydrophobicContact CZ2-CB 4.16Å; W596-F710 HydrophobicContact CZ2-CD2 4.43Å; W596-F710 HydrophobicContact CZ3-CB 3.93Å; W596-F710 AromaticContact CZ3-CD2 3.77Å; W596-F710 HydrophobicContact CZ3-CD2 3.77Å; W596-F710 HydrophobicContact CZ3-CG 4.32Å; W596-A713 HydrophobicContact CZ2-CB 4.19Å
597	P	96.4	Very high	86.9	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	140.8	173.2	31.4	-34.8	0	0	0	111.5	V586 W587 F613 A713 I714 L717	V586-P597 CarbonylContact O-C 3.57Å; V586-P597 WeakPolarHBondContact O-CA 3.26Å; W587-P597 HydrophobicContact CE3-CB 4.27Å; W587-P597 HydrophobicContact CH2-CB 4.4Å; W587-P597 HydrophobicContact CZ3-CB 4.19Å; W587-P597 HydrophobicContact CZ3-CG 4.25Å; P597-F613 HydrophobicContact CB-CD2 4.05Å; P597-F613 HydrophobicContact CG-CB 4.31Å; P597-F613 HydrophobicContact CG-CD2 4.41Å; P597-F613 PolarHBondContact O-N 3.12Å; P597-F613 VanDerWaalsContact O-N 3.14Å; P597-A713 HydrophobicContact CG-CB 4.04Å; P597-I714 HydrophobicContact CG-CD1 4.41Å; P597-L717 HydrophobicContact CB-CD2 3.79Å; P597-L717 HydrophobicContact CG-CD2 4.22Å
598	A	96.1	Very high	86.7	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	158.9	179.8	0	0	0	0	0	112.3	V586 I588 V610 S611 F612	V586-A598 HydrophobicContact CG2-CB 4.08Å; V586-A598 PolarHBondContact N-O 2.77Å; V586-A598 PolarHBondContact O-N 3.22Å; I588-A598 HydrophobicContact CG1-CB 4.3Å; A598-V610 HydrophobicContact CB-CB 4.04Å; A598-S611 CarbonylContact C-O 3.52Å; A598-S611 VanDerWaalsContact CA-O 3.27Å; A598-S611 WeakPolarHBondContact CA-O 3.39Å; A598-S611 WeakPolarHBondContact CB-O 3.29Å; A598-F612 HydrophobicContact CB-CD1 3.62Å; A598-F612 HydrophobicContact CB-CE1 3.93Å; A598-F612 HydrophobicContact CB-CG 4.36Å
599	K	96	Very high	86.5	Confident	3 Å²	3	56.4 Å²	56.4	1%	0.013	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	132.8	163.4	-59.5	-170.1	-171.3	-164.4	0	109.4	F575 H583 I601 V610 S611 F613 H720	F575-K599 HydrophobicContact CE1-CD 4.19Å; F575-K599 HydrophobicContact CE1-CG 4.14Å; F575-K599 HydrophobicContact CE2-CD 4.39Å; F575-K599 HydrophobicContact CZ-CB 4.44Å; F575-K599 HydrophobicContact CZ-CD 3.9Å; F575-K599 HydrophobicContact CZ-CG 3.91Å; F575-K599 VanDerWaalsContact O-CE 3.24Å; F575-K599 WeakPolarHBondContact O-CE 3.46Å; F575-K599 PolarHBondContact O-NZ 3.34Å; H583-K599 HydrophobicContact CB-CB 4.16Å; H583-K599 HydrophobicContact CB-CD 4.37Å; K599-I601 HydrophobicContact CB-CD1 3.81Å; K599-I601 PolarHBondContact O-N 2.85Å; K599-V610 WeakPolarHBondContact O-CA 3.37Å; K599-S611 PolarHBondContact N-O 3.11Å; K599-S611 PolarHBondContact O-N 2.68Å; K599-F613 HydrophobicContact CD-CZ 4.39Å; K599-F613 HydrophobicContact CG-CE2 3.81Å; K599-F613 HydrophobicContact CG-CZ 3.74Å; K599-H720 VanDerWaalsContact CE-NE2 3.33Å; K599-H720 WeakPolarHBondContact CE-NE2 3.47Å; K599-H720 PolarHBondContact NZ-CE1 3.21Å; K599-H720 PolarHBondContact NZ-NE2 3.44Å; K599-H720 VanDerWaalsContact NZ-NE2 3.11Å
600	V	94.6	Very high	86.6	Confident	4 Å²	4	49.4 Å²	49.4	2%	0.024	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	113.1	165.5	-177.8	0	0	0	0	108.4	H583 P584 V586 A602 L608 V610 F740	H583-V600 PolarHBondContact ND1-O 2.58Å; H583-V600 VanDerWaalsContact ND1-O 3.08Å; P584-V600 HydrophobicContact CB-CB 4.16Å; P584-V600 HydrophobicContact CB-CG2 4.34Å; P584-V600 HydrophobicContact CG-CB 4.48Å; P584-V600 WeakPolarHBondContact O-CG2 3.13Å; P584-V600 PolarHBondContact O-N 2.79Å; V586-V600 HydrophobicContact CB-CG2 4.27Å; V586-V600 HydrophobicContact CG1-CG2 3.64Å; V586-V600 HydrophobicContact CG2-CG2 3.58Å; V600-A602 WeakPolarHBondContact CG1-O 3.36Å; V600-L608 HydrophobicContact CG1-CB 4.41Å; V600-L608 HydrophobicContact CG1-CD2 4.49Å; V600-L608 HydrophobicContact CG2-CD1 4.34Å; V600-V610 HydrophobicContact CG2-CG1 4.19Å; V600-F740 HydrophobicContact CB-CE2 4.35Å; V600-F740 HydrophobicContact CG1-CE2 4.34Å; V600-F740 HydrophobicContact CG1-CZ 4.2Å; V600-F740 HydrophobicContact CG2-CD2 4.35Å; V600-F740 HydrophobicContact CG2-CE2 3.75Å; V600-F740 HydrophobicContact CG2-CZ 4.37Å
601	I	91.1	Very high	87.1	Confident	21 Å²	21	47.2 Å²	47.2	11%	0.108	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-37	-179.7	-49.2	-56.1	0	0	0	110.3	L473 A476 C477 K599 L609	L473-I601 HydrophobicContact CD2-CB 4.42Å; L473-I601 HydrophobicContact CD2-CG1 4.2Å; L473-I601 HydrophobicContact CD2-CG2 4.16Å; A476-I601 HydrophobicContact CB-CG2 3.85Å; C477-I601 HydrophobicContact CB-CG2 4.41Å; K599-I601 HydrophobicContact CB-CD1 3.81Å; K599-I601 PolarHBondContact O-N 2.85Å; I601-L609 HydrophobicContact CB-CD2 4.37Å; I601-L609 HydrophobicContact CB-CG 4.38Å; I601-L609 PolarHBondContact N-O 2.99Å
602	A	86.5	Confident	88	Confident	29 Å²	29	40.6 Å²	40.6	24%	0.24	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	166.3	172.4	0	0	0	0	0	111.5	A476 V600 L609	A476-A602 HydrophobicContact CB-CB 3.87Å; V600-A602 WeakPolarHBondContact CG1-O 3.36Å; A602-L609 HydrophobicContact CB-CB 4.02Å; A602-L609 HydrophobicContact CB-CD2 4.34Å; A602-L609 PolarHBondContact N-O 3.01Å; A602-L609 PolarHBondContact O-N 3.18Å
603	H	85.5	Confident	88.8	Confident	88 Å²	88	34.7 Å²	34.7	41%	0.407	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	146.7	168	63.9	37.1	0	0	0	111	F607 L608	H603-F607 WeakPolarHBondContact CA-O 3.44Å; H603-L608 HydrophobicContact CB-CD2 3.54Å
604	D	74.8	Confident	89.7	Confident	35 Å²	35	28.3 Å²	28.3	19%	0.187	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	137.9	166.7	-170.7	20.6	0	0	0	110.9	S205 F208 N606 F607	S205-D604 WeakPolarHBondContact CA-OD2 3.43Å; S205-D604 WeakPolarHBondContact CB-OD2 3.49Å; F208-D604 HydrophobicContact CD1-CB 3.7Å; F208-D604 HydrophobicContact CE1-CB 3.97Å; F208-D604 HydrophobicContact CG-CB 4.35Å; D604-N606 PolarHBondContact O-N 3.32Å; D604-F607 PolarHBondContact N-O 3.16Å; D604-F607 WeakPolarHBondContact O-CA 3.42Å; D604-F607 PolarHBondContact O-N 2.8Å; D604-F607 VanDerWaalsContact O-O 3.08Å
605	G	79.5	Confident	89.7	Confident	34 Å²	34	29.1 Å²	29.1	35%	0.351	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.5	-111	-173.8	0	0	0	0	0	113.3
606	N	84.2	Confident	89.7	Confident	117 Å²	117	24.2 Å²	24.2	63%	0.626	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.3	16.5	-179.3	-69	-20.7	0	0	0	113.7	D604 I623	D604-N606 PolarHBondContact O-N 3.32Å; N606-I623 HydrophobicContact CB-CG2 4.12Å; N606-I623 WeakPolarHBondContact O-CB 3.22Å; N606-I623 WeakPolarHBondContact O-CG2 3.18Å; N606-I623 PolarHBondContact O-N 3.07Å
607	F	88.3	Confident	89.4	Confident	82 Å²	82	26.7 Å²	26.7	36%	0.36	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	145.4	-169.8	-66.6	-70.2	0	0	0	112.3	F208 I209 H603 D604 I620	F208-F607 HydrophobicContact CE1-CB 3.85Å; I209-F607 HydrophobicContact CD1-CD2 4.43Å; I209-F607 HydrophobicContact CD1-CE2 4.49Å; I209-F607 HydrophobicContact CG1-CD2 4.28Å; I209-F607 HydrophobicContact CG1-CE2 4.47Å; H603-F607 WeakPolarHBondContact CA-O 3.44Å; D604-F607 PolarHBondContact N-O 3.16Å; D604-F607 WeakPolarHBondContact O-CA 3.42Å; D604-F607 PolarHBondContact O-N 2.8Å; D604-F607 VanDerWaalsContact O-O 3.08Å; F607-I620 HydrophobicContact CB-CG2 3.63Å; F607-I620 HydrophobicContact CD1-CG2 3.94Å; F607-I620 HydrophobicContact CG-CG2 4.11Å
608	L	90.9	Very high	89	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	124.8	-177.7	-51.3	-179.5	0	0	0	109.9	V600 H603 V610 I620 A621 I623 A626 F740	V600-L608 HydrophobicContact CG1-CB 4.41Å; V600-L608 HydrophobicContact CG1-CD2 4.49Å; V600-L608 HydrophobicContact CG2-CD1 4.34Å; H603-L608 HydrophobicContact CB-CD2 3.54Å; L608-V610 HydrophobicContact CB-CG1 3.96Å; L608-V610 PolarHBondContact O-N 3.26Å; L608-I620 CarbonylContact O-C 3.59Å; L608-I620 VanDerWaalsContact O-CA 3.25Å; L608-I620 WeakPolarHBondContact O-CA 3.29Å; L608-A621 PolarHBondContact N-O 2.83Å; L608-A621 PolarHBondContact O-N 3.42Å; L608-I623 HydrophobicContact CD2-CD1 4.49Å; L608-I623 HydrophobicContact CD2-CG1 4.25Å; L608-I623 HydrophobicContact CG-CB 4.48Å; L608-I623 HydrophobicContact CG-CG1 4.5Å; L608-A626 HydrophobicContact CD1-CB 3.44Å; L608-A626 VanDerWaalsContact CD1-CB 3.44Å; L608-F740 HydrophobicContact CD1-CB 4.49Å; L608-F740 HydrophobicContact CD1-CD1 3.97Å; L608-F740 HydrophobicContact CD1-CD2 4.23Å; L608-F740 HydrophobicContact CD1-CE1 4.18Å; L608-F740 HydrophobicContact CD1-CE2 4.41Å; L608-F740 HydrophobicContact CD1-CG 3.98Å; L608-F740 HydrophobicContact CD1-CZ 4.37Å; L608-F740 HydrophobicContact CD2-CD1 3.85Å; L608-F740 HydrophobicContact CD2-CE1 3.37Å; L608-F740 HydrophobicContact CD2-CZ 3.76Å; L608-F740 HydrophobicContact CG-CE1 4.44Å
609	L	90.1	Very high	88.7	Confident	6 Å²	6	29.3 Å²	29.3	3%	0.031	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	115.9	166.7	-175.1	63.1	0	0	0	107.9	F208 N472 L473 I601 A602 V618 I620	F208-L609 HydrophobicContact CE2-CB 3.86Å; F208-L609 HydrophobicContact CE2-CD2 4.46Å; F208-L609 HydrophobicContact CZ-CB 3.86Å; N472-L609 HydrophobicContact CB-CD2 4.29Å; L473-L609 HydrophobicContact CD2-CD2 4.03Å; L473-L609 HydrophobicContact CD2-CG 4.33Å; L473-L609 HydrophobicContact CG-CD2 4.45Å; I601-L609 HydrophobicContact CB-CD2 4.37Å; I601-L609 HydrophobicContact CB-CG 4.38Å; I601-L609 PolarHBondContact N-O 2.99Å; A602-L609 HydrophobicContact CB-CB 4.02Å; A602-L609 HydrophobicContact CB-CD2 4.34Å; A602-L609 PolarHBondContact N-O 3.01Å; A602-L609 PolarHBondContact O-N 3.18Å; L609-V618 HydrophobicContact CD1-CG1 3.76Å; L609-I620 HydrophobicContact CD1-CD1 4.47Å; L609-I620 HydrophobicContact CD1-CG1 3.89Å
610	V	92.4	Very high	88.2	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	142	-175.1	-64.7	0	0	0	0	110.8	V586 I588 A598 K599 V600 L608 F612 V618 T619 A621	V586-V610 HydrophobicContact CG2-CG1 4.36Å; I588-V610 HydrophobicContact CD1-CG1 4.12Å; I588-V610 HydrophobicContact CG1-CG1 4.19Å; I588-V610 HydrophobicContact CG1-CG2 4.32Å; A598-V610 HydrophobicContact CB-CB 4.04Å; K599-V610 WeakPolarHBondContact O-CA 3.37Å; V600-V610 HydrophobicContact CG2-CG1 4.19Å; L608-V610 HydrophobicContact CB-CG1 3.96Å; L608-V610 PolarHBondContact O-N 3.26Å; V610-F612 HydrophobicContact CG2-CE2 4.43Å; V610-F612 HydrophobicContact CG2-CZ 4.23Å; V610-V618 WeakPolarHBondContact O-CA 3.37Å; V610-T619 HydrophobicContact CG2-CG2 3.68Å; V610-T619 WeakPolarHBondContact CG2-O 3.33Å; V610-T619 PolarHBondContact N-O 2.96Å; V610-T619 PolarHBondContact O-N 3.24Å; V610-A621 HydrophobicContact CG1-CB 4.38Å; V610-A621 HydrophobicContact CG2-CB 4Å
611	S	92.8	Very high	87.9	Confident	6 Å²	6	30.5 Å²	30.5	4%	0.042	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	125	170.4	-173	0	0	0	0	108.9	F575 A598 K599 D617	F575-S611 WeakPolarHBondContact CE2-OG 3.46Å; A598-S611 CarbonylContact C-O 3.52Å; A598-S611 VanDerWaalsContact CA-O 3.27Å; A598-S611 WeakPolarHBondContact CA-O 3.39Å; A598-S611 WeakPolarHBondContact CB-O 3.29Å; K599-S611 PolarHBondContact N-O 3.11Å; K599-S611 PolarHBondContact O-N 2.68Å; S611-D617 WeakPolarHBondContact CA-O 3.17Å
612	F	94.4	Very high	87.9	Confident	8 Å²	8	32.6 Å²	32.6	4%	0.035	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	147.6	-173.2	-70.6	-68	0	0	0	112.5	I588 L590 W596 A598 V610 D615 Y616 D617 T619	I588-F612 HydrophobicContact CB-CE1 3.97Å; I588-F612 HydrophobicContact CB-CZ 4.26Å; I588-F612 HydrophobicContact CG1-CE1 4.17Å; I588-F612 HydrophobicContact CG2-CZ 4.34Å; L590-F612 HydrophobicContact CD1-CE2 4.23Å; L590-F612 HydrophobicContact CD1-CZ 4.01Å; L590-F612 HydrophobicContact CG-CZ 4.47Å; W596-F612 HydrophobicContact CB-CD1 3.8Å; W596-F612 HydrophobicContact CB-CE1 3.83Å; W596-F612 AromaticContact CD1-CD1 3.57Å; W596-F612 AromaticContact CD1-CG 3.99Å; W596-F612 AromaticContact CG-CD1 3.97Å; W596-F612 HydrophobicContact CG-CD1 3.97Å; W596-F612 HydrophobicContact CG-CE1 4.46Å; A598-F612 HydrophobicContact CB-CD1 3.62Å; A598-F612 HydrophobicContact CB-CE1 3.93Å; A598-F612 HydrophobicContact CB-CG 4.36Å; V610-F612 HydrophobicContact CG2-CE2 4.43Å; V610-F612 HydrophobicContact CG2-CZ 4.23Å; F612-D615 WeakPolarHBondContact CB-OD1 3.37Å; F612-Y616 WeakPolarHBondContact O-CA 3.33Å; F612-Y616 PolarHBondContact O-N 2.67Å; F612-D617 HydrophobicContact CD2-CB 4.23Å; F612-D617 PolarHBondContact N-O 3.3Å; F612-T619 HydrophobicContact CE2-CG2 3.64Å; F612-T619 HydrophobicContact CZ-CG2 4.06Å
613	F	94.3	Very high	88	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	152	168.1	-68.1	-97.2	0	0	0	110	F575 I585 W596 P597 K599 D615 A713 E716 L717 H720	F575-F613 AromaticContact CD1-CD1 3.55Å; F575-F613 HydrophobicContact CD1-CD1 3.55Å; F575-F613 AromaticContact CD1-CE1 3.9Å; F575-F613 HydrophobicContact CD1-CE1 3.9Å; F575-F613 HydrophobicContact CD1-CG 4.06Å; F575-F613 HydrophobicContact CE1-CB 4.22Å; F575-F613 AromaticContact CE1-CD1 3.48Å; F575-F613 HydrophobicContact CE1-CD1 3.48Å; F575-F613 VanDerWaalsContact CE1-CD1 3.48Å; F575-F613 AromaticContact CE1-CD2 3.96Å; F575-F613 HydrophobicContact CE1-CD2 3.96Å; F575-F613 AromaticContact CE1-CE1 3.74Å; F575-F613 HydrophobicContact CE1-CE1 3.74Å; F575-F613 HydrophobicContact CE1-CE2 4.19Å; F575-F613 AromaticContact CE1-CG 3.6Å; F575-F613 HydrophobicContact CE1-CG 3.6Å; F575-F613 HydrophobicContact CE1-CZ 4.09Å; I585-F613 HydrophobicContact CG2-CE2 4.29Å; W596-F613 PolarHBondContact NE1-O 3.34Å; P597-F613 HydrophobicContact CB-CD2 4.05Å; P597-F613 HydrophobicContact CG-CB 4.31Å; P597-F613 HydrophobicContact CG-CD2 4.41Å; P597-F613 PolarHBondContact O-N 3.12Å; P597-F613 VanDerWaalsContact O-N 3.14Å; K599-F613 HydrophobicContact CD-CZ 4.39Å; K599-F613 HydrophobicContact CG-CE2 3.81Å; K599-F613 HydrophobicContact CG-CZ 3.74Å; F613-D615 PolarHBondContact O-N 3.47Å; F613-D615 VanDerWaalsContact O-N 3.09Å; F613-A713 HydrophobicContact CB-CB 3.85Å; F613-A713 VanDerWaalsContact O-CB 3.25Å; F613-A713 WeakPolarHBondContact O-CB 3.4Å; F613-E716 HydrophobicContact CB-CB 4.48Å; F613-E716 HydrophobicContact CD1-CB 3.73Å; F613-L717 HydrophobicContact CD1-CB 4.4Å; F613-L717 HydrophobicContact CE2-CD1 4.25Å; F613-L717 HydrophobicContact CG-CB 4.48Å; F613-L717 HydrophobicContact CZ-CD1 4.29Å; F613-H720 HydrophobicContact CE1-CB 3.99Å; F613-H720 HydrophobicContact CZ-CB 4.48Å; F613-H720 AromaticContact CZ-CD2 3.81Å
614	G	89.9	Confident	88.2	Confident	2 Å²	2	32.7 Å²	32.7	2%	0.021	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	-58.4	174.8	0	0	0	0	0	115.5	K712 E716	G614-K712 WeakPolarHBondContact O-CE 3.42Å; G614-K712 PolarHBondContact O-NZ 3.47Å; G614-E716 PolarHBondContact N-OE2 3.44Å
615	D	82.4	Confident	89	Confident	53 Å²	53	32.1 Å²	32.1	28%	0.283	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-15.9	-180	64.6	8	0	0	0	114.2	P492 F612 F613 D617	P492-D615 WeakPolarHBondContact CD-O 3.24Å; P492-D615 WeakPolarHBondContact CG-O 3.39Å; F612-D615 WeakPolarHBondContact CB-OD1 3.37Å; F613-D615 PolarHBondContact O-N 3.47Å; F613-D615 VanDerWaalsContact O-N 3.09Å; D615-D617 PolarHBondContact O-N 3.29Å; D615-D617 PolarHBondContact OD1-N 2.67Å
616	Y	89.9	Confident	89.7	Confident	3 Å²	3	30.6 Å²	30.6	1%	0.012	19%	0.185	C	C	.	.			trans	60.1	23.1	175.7	-37.2	-59.4	0	0	0	115	R484 L490 W574 F575 F612 K712 E716	R484-Y616 PolarHBondContact NH2-O 2.8Å; L490-Y616 HydrophobicContact CB-CD2 4.22Å; L490-Y616 HydrophobicContact CB-CE2 3.91Å; L490-Y616 HydrophobicContact CD1-CE2 4.19Å; W574-Y616 HydrophobicContact CH2-CD1 4.13Å; W574-Y616 HydrophobicContact CH2-CG 4.14Å; W574-Y616 AromaticContact CZ2-CD1 3.5Å; W574-Y616 HydrophobicContact CZ2-CD1 3.5Å; W574-Y616 AromaticContact CZ2-CD2 3.72Å; W574-Y616 HydrophobicContact CZ2-CD2 3.72Å; W574-Y616 AromaticContact CZ2-CE1 3.81Å; W574-Y616 HydrophobicContact CZ2-CE1 3.81Å; W574-Y616 AromaticContact CZ2-CE2 3.99Å; W574-Y616 HydrophobicContact CZ2-CE2 3.99Å; W574-Y616 AromaticContact CZ2-CG 3.44Å; W574-Y616 HydrophobicContact CZ2-CG 3.44Å; W574-Y616 VanDerWaalsContact CZ2-CG 3.44Å; W574-Y616 AromaticContact NE1-CE1 3.99Å; W574-Y616 AromaticContact NE1-CE2 3.79Å; W574-Y616 AromaticContact NE1-CZ 3.56Å; F575-Y616 HydrophobicContact CB-CD1 4.15Å; F575-Y616 HydrophobicContact CB-CE1 3.84Å; F575-Y616 HydrophobicContact CD1-CD1 4.36Å; F575-Y616 HydrophobicContact CD1-CE1 4.4Å; F575-Y616 HydrophobicContact CD2-CD1 4.35Å; F575-Y616 HydrophobicContact CG-CD1 4.03Å; F575-Y616 HydrophobicContact CG-CE1 4.13Å; F612-Y616 WeakPolarHBondContact O-CA 3.33Å; F612-Y616 PolarHBondContact O-N 2.67Å; Y616-K712 VanDerWaalsContact CZ-NZ 3.32Å; Y616-K712 WeakPolarHBondContact OH-CE 3.49Å; Y616-K712 PolarHBondContact OH-NZ 3.31Å; Y616-E716 VanDerWaalsContact CE1-OE1 3.29Å; Y616-E716 WeakPolarHBondContact CE1-OE1 3.33Å; Y616-E716 WeakPolarHBondContact CE1-OE2 3.34Å; Y616-E716 VanDerWaalsContact CZ-OE1 3.29Å; Y616-E716 PolarHBondContact OH-OE1 3.49Å
617	D	88	Confident	90.2	Very high	69 Å²	69	27.8 Å²	27.8	37%	0.369	17%	0.168	S	C	.	.			trans	-69.9	152.2	172.9	-172.8	41.1	0	0	0	111.4	P492 S611 F612 D615	P492-D617 HydrophobicContact CG-CB 4.24Å; S611-D617 WeakPolarHBondContact CA-O 3.17Å; F612-D617 HydrophobicContact CD2-CB 4.23Å; F612-D617 PolarHBondContact N-O 3.3Å; D615-D617 PolarHBondContact O-N 3.29Å; D615-D617 PolarHBondContact OD1-N 2.67Å
618	V	88.2	Confident	90.5	Very high	14 Å²	14	23.9 Å²	23.9	9%	0.085	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	116.6	-177	175.9	0	0	0	0	110	L473 L609 V610	L473-V618 HydrophobicContact CD1-CB 4.29Å; L473-V618 HydrophobicContact CD1-CG1 3.98Å; L473-V618 HydrophobicContact CD1-CG2 3.86Å; L473-V618 HydrophobicContact CD2-CG1 3.75Å; L473-V618 HydrophobicContact CD2-CG2 4.12Å; L473-V618 HydrophobicContact CG-CG1 4.03Å; L609-V618 HydrophobicContact CD1-CG1 3.76Å; V610-V618 WeakPolarHBondContact O-CA 3.37Å
619	T	88.5	Confident	90.7	Very high	41 Å²	41	23.9 Å²	23.9	25%	0.252	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	172.5	178.8	-164.1	0	0	0	0	111.2	L590 V610 F612	L590-T619 HydrophobicContact CD1-CG2 4.34Å; V610-T619 HydrophobicContact CG2-CG2 3.68Å; V610-T619 WeakPolarHBondContact CG2-O 3.33Å; V610-T619 PolarHBondContact N-O 2.96Å; V610-T619 PolarHBondContact O-N 3.24Å; F612-T619 HydrophobicContact CE2-CG2 3.64Å; F612-T619 HydrophobicContact CZ-CG2 4.06Å
620	I	86.3	Confident	90.8	Very high	31 Å²	31	23.7 Å²	23.7	16%	0.159	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	115.9	167.8	-65.9	-177.6	0	0	0	108.5	F208 L212 F607 L608 L609	F208-I620 HydrophobicContact CD1-CD1 4.17Å; F208-I620 HydrophobicContact CD2-CD1 3.98Å; F208-I620 HydrophobicContact CE1-CD1 3.78Å; F208-I620 HydrophobicContact CE1-CG2 4.2Å; F208-I620 HydrophobicContact CE2-CD1 3.55Å; F208-I620 HydrophobicContact CE2-CG1 4.32Å; F208-I620 HydrophobicContact CG-CD1 4.28Å; F208-I620 HydrophobicContact CZ-CD1 3.44Å; F208-I620 VanDerWaalsContact CZ-CD1 3.44Å; F208-I620 HydrophobicContact CZ-CG1 3.97Å; F208-I620 HydrophobicContact CZ-CG2 4.33Å; L212-I620 HydrophobicContact CD1-CB 3.51Å; L212-I620 HydrophobicContact CD1-CD1 3.57Å; L212-I620 HydrophobicContact CD1-CG1 3.59Å; L212-I620 HydrophobicContact CG-CD1 4.35Å; F607-I620 HydrophobicContact CB-CG2 3.63Å; F607-I620 HydrophobicContact CD1-CG2 3.94Å; F607-I620 HydrophobicContact CG-CG2 4.11Å; L608-I620 CarbonylContact O-C 3.59Å; L608-I620 VanDerWaalsContact O-CA 3.25Å; L608-I620 WeakPolarHBondContact O-CA 3.29Å; L609-I620 HydrophobicContact CD1-CD1 4.47Å; L609-I620 HydrophobicContact CD1-CG1 3.89Å
621	A	88.5	Confident	90.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	137.4	178.5	0	0	0	0	0	110.6	I588 L608 V610	I588-A621 HydrophobicContact CD1-CB 3.92Å; I588-A621 HydrophobicContact CG1-CB 4.21Å; I588-A621 HydrophobicContact CG2-CB 3.67Å; L608-A621 PolarHBondContact N-O 2.83Å; L608-A621 PolarHBondContact O-N 3.42Å; V610-A621 HydrophobicContact CG1-CB 4.38Å; V610-A621 HydrophobicContact CG2-CB 4Å
622	P	89.6	Confident	90.2	Very high	65 Å²	65	27.8 Å²	27.8	42%	0.422	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	138.9	171.6	28.2	-33.1	0	0	0	109.8	G624 S625	P622-G624 PolarHBondContact O-N 2.06Å; P622-S625 WeakPolarHBondContact O-CB 3.43Å; P622-S625 PolarHBondContact O-N 3.29Å; P622-S625 PolarHBondContact O-OG 3.24Å
623	I	89.7	Confident	89.5	Confident	42 Å²	42	29.4 Å²	29.4	22%	0.215	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-55	-33.6	-171.2	-165.8	168.3	0	0	0	113.5	N606 L608 S625 A626 F740	N606-I623 HydrophobicContact CB-CG2 4.12Å; N606-I623 WeakPolarHBondContact O-CB 3.22Å; N606-I623 WeakPolarHBondContact O-CG2 3.18Å; N606-I623 PolarHBondContact O-N 3.07Å; L608-I623 HydrophobicContact CD2-CD1 4.49Å; L608-I623 HydrophobicContact CD2-CG1 4.25Å; L608-I623 HydrophobicContact CG-CB 4.48Å; L608-I623 HydrophobicContact CG-CG1 4.5Å; I623-S625 VanDerWaalsContact C-N 3.28Å; I623-S625 PolarHBondContact O-N 3.4Å; I623-A626 WeakPolarHBondContact O-CB 3.19Å; I623-A626 PolarHBondContact O-N 3.15Å; I623-F740 HydrophobicContact CD1-CD1 3.84Å; I623-F740 HydrophobicContact CD1-CE1 4.25Å; I623-F740 HydrophobicContact CG1-CD1 3.7Å; I623-F740 HydrophobicContact CG1-CE1 4.44Å
624	G	89.3	Confident	88.8	Confident	78 Å²	78	30.5 Å²	30.5	80%	0.804	19%	0.188	S	C	*	.	G	3₁₀ helix	trans	-68.5	-19.5	176.7	0	0	0	0	0	115.1	P622 A626	P622-G624 PolarHBondContact O-N 2.06Å; G624-A626 VanDerWaalsContact C-N 3.29Å
625	S	91.5	Very high	87.9	Confident	23 Å²	23	36.6 Å²	36.6	16%	0.161	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-77.6	-15.5	174	72.1	0	0	0	0	113.2	R589 P622 I623	R589-S625 PolarHBondContact N-O 2.75Å; P622-S625 WeakPolarHBondContact O-CB 3.43Å; P622-S625 PolarHBondContact O-N 3.29Å; P622-S625 PolarHBondContact O-OG 3.24Å; I623-S625 VanDerWaalsContact C-N 3.28Å; I623-S625 PolarHBondContact O-N 3.4Å
626	A	94.2	Very high	87.3	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.008	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	135.7	-167.9	0	0	0	0	0	113.3	I588 L608 I623 G624 F740	I588-A626 HydrophobicContact CD1-CB 3.44Å; I588-A626 VanDerWaalsContact CD1-CB 3.44Å; L608-A626 HydrophobicContact CD1-CB 3.44Å; L608-A626 VanDerWaalsContact CD1-CB 3.44Å; I623-A626 WeakPolarHBondContact O-CB 3.19Å; I623-A626 PolarHBondContact O-N 3.15Å; G624-A626 VanDerWaalsContact C-N 3.29Å; A626-F740 HydrophobicContact CB-CB 3.81Å; A626-F740 HydrophobicContact CB-CG 4.46Å; A626-F740 PolarHBondContact O-N 3.49Å
627	K	94.4	Very high	86.4	Confident	59 Å²	59	38 Å²	38	26%	0.257	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	135.2	171.7	-67.9	-168.8	171.3	-158.5	0	111	V586 W587 Q737 L738	V586-K627 CarbonylContact C-O 3.39Å; V586-K627 VanDerWaalsContact CA-O 3.24Å; V586-K627 WeakPolarHBondContact CA-O 2.96Å; W587-K627 PolarHBondContact N-O 3.22Å; W587-K627 PolarHBondContact O-N 3.19Å; K627-Q737 HydrophobicContact CB-CG 3.9Å; K627-Q737 HydrophobicContact CD-CG 3.98Å; K627-L738 CarbonylContact C-O 3.59Å; K627-L738 VanDerWaalsContact CA-O 3.22Å; K627-L738 WeakPolarHBondContact CA-O 3.27Å; K627-L738 WeakPolarHBondContact CB-O 3.19Å
628	L	95.5	Very high	85.2	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	143.8	178.3	-65.6	171.7	0	0	0	111.1	P584 I585 V586 P734 Q737 L738 F740 H744 V745 Y749	P584-L628 HydrophobicContact CB-CD2 4.35Å; I585-L628 WeakPolarHBondContact O-CA 3.16Å; V586-L628 HydrophobicContact CG1-CD2 4.05Å; L628-P734 HydrophobicContact CB-CG 4.32Å; L628-Q737 WeakPolarHBondContact O-CG 3.31Å; L628-L738 HydrophobicContact CD1-CB 4.5Å; L628-L738 PolarHBondContact N-O 3.06Å; L628-F740 HydrophobicContact CD2-CD2 3.78Å; L628-F740 HydrophobicContact CD2-CE2 4.31Å; L628-H744 HydrophobicContact CD1-CB 3.64Å; L628-V745 HydrophobicContact CD2-CG2 4.48Å; L628-Y749 HydrophobicContact CD2-CD2 4.42Å; L628-Y749 HydrophobicContact CD2-CE2 4Å
629	H	95	Very high	83.8	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.253	C	S	.	.			trans	-63.6	148.9	168.1	-172	92.5	0	0	0	110.2	I585 W587 S634 P734	I585-H629 HydrophobicContact CB-CB 3.97Å; I585-H629 HydrophobicContact CG2-CB 3.71Å; I585-H629 PolarHBondContact O-N 2.89Å; W587-H629 AromaticContact CE2-ND1 3.73Å; W587-H629 AromaticContact CZ2-ND1 3.73Å; W587-H629 AromaticContact NE1-CG 3.93Å; W587-H629 AromaticContact NE1-ND1 3.27Å; W587-H629 PolarHBondContact NE1-ND1 3.45Å; H629-S634 PolarHBondContact NE2-OG 3.05Å; H629-P734 WeakPolarHBondContact O-CD 3.1Å; H629-P734 VanDerWaalsContact O-CG 3.29Å; H629-P734 WeakPolarHBondContact O-CG 3.49Å
630	S	92.8	Very high	82.2	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.014	26%	0.255	C	S	.	.			trans	-140.9	147.4	-169.6	53.3	0	0	0	0	112.5	N632 Q633 S634 P734 N736	S630-N632 VanDerWaalsContact C-N 3.25Å; S630-N632 PolarHBondContact O-N 2.76Å; S630-Q633 WeakPolarHBondContact O-CA 3.4Å; S630-Q633 VanDerWaalsContact O-CB 3.31Å; S630-Q633 WeakPolarHBondContact O-CB 3.34Å; S630-Q633 PolarHBondContact O-N 3.35Å; S630-Q633 VanDerWaalsContact OG-CD 3.28Å; S630-Q633 WeakPolarHBondContact OG-CG 3.5Å; S630-Q633 PolarHBondContact OG-OE1 2.75Å; S630-S634 PolarHBondContact O-N 3.34Å; S630-S634 VanDerWaalsContact O-N 3.15Å; S630-S634 PolarHBondContact O-OG 3.38Å; S630-P734 CarbonylContact C-O 3.54Å; S630-P734 WeakPolarHBondContact CA-O 3.15Å; S630-P734 WeakPolarHBondContact CB-O 3.42Å; S630-N736 VanDerWaalsContact CB-C 3.49Å; S630-N736 WeakPolarHBondContact CB-O 3.33Å
631	S	87.8	Confident	80.4	Confident	24 Å²	24	45 Å²	45	17%	0.168	26%	0.264	C	S	.	.	H	α-helix	trans	-65.5	-26.4	-172.5	59.2	0	0	0	0	113.5	Q633 S634 K635 P734	S631-Q633 VanDerWaalsContact C-N 3.3Å; S631-Q633 PolarHBondContact O-N 3.36Å; S631-S634 PolarHBondContact O-N 2.9Å; S631-K635 VanDerWaalsContact O-CG 3.31Å; S631-K635 WeakPolarHBondContact O-CG 3.41Å; S631-K635 PolarHBondContact O-N 2.99Å; S631-P734 PolarHBondContact N-O 2.83Å
632	N	83.5	Confident	78.6	Confident	69 Å²	69	49.8 Å²	49.8	37%	0.369	29%	0.288	S	S	.	.	H	α-helix	trans	-68.1	-27.2	169.6	-75.3	-19.5	0	0	0	113	S630 S636 V735 N736	S630-N632 VanDerWaalsContact C-N 3.25Å; S630-N632 PolarHBondContact O-N 2.76Å; N632-S636 PolarHBondContact O-N 3.43Å; N632-V735 VanDerWaalsContact CB-O 3.28Å; N632-V735 WeakPolarHBondContact CB-O 3.32Å; N632-V735 VanDerWaalsContact CG-O 3.25Å; N632-V735 PolarHBondContact N-O 3.18Å; N632-V735 WeakPolarHBondContact ND2-CG1 3.33Å; N632-V735 PolarHBondContact ND2-O 3.46Å; N632-V735 VanDerWaalsContact ND2-O 3.14Å; N632-N736 PolarHBondContact ND2-OD1 3.19Å; N632-N736 VanDerWaalsContact ND2-OD1 3.09Å
633	Q	81.3	Confident	76.2	Confident	42 Å²	42	50.5 Å²	50.5	20%	0.196	29%	0.287	C	S	.	.	H	α-helix	trans	-74.9	-41.9	170.9	-68.1	173.5	-51.2	0	0	111.3	S630 S631 K635 S636 L637 Q737	S630-Q633 WeakPolarHBondContact O-CA 3.4Å; S630-Q633 VanDerWaalsContact O-CB 3.31Å; S630-Q633 WeakPolarHBondContact O-CB 3.34Å; S630-Q633 PolarHBondContact O-N 3.35Å; S630-Q633 VanDerWaalsContact OG-CD 3.28Å; S630-Q633 WeakPolarHBondContact OG-CG 3.5Å; S630-Q633 PolarHBondContact OG-OE1 2.75Å; S631-Q633 VanDerWaalsContact C-N 3.3Å; S631-Q633 PolarHBondContact O-N 3.36Å; Q633-K635 VanDerWaalsContact C-N 3.3Å; Q633-K635 PolarHBondContact O-N 3.29Å; Q633-S636 CarbonylContact O-C 3.59Å; Q633-S636 WeakPolarHBondContact O-CA 3.26Å; Q633-S636 WeakPolarHBondContact O-CB 3.2Å; Q633-S636 PolarHBondContact O-N 3.09Å; Q633-L637 WeakPolarHBondContact O-CG 3.44Å; Q633-L637 PolarHBondContact O-N 3.44Å; Q633-Q737 VanDerWaalsContact NE2-CD 3.29Å
634	S	77.7	Confident	74	Confident	23 Å²	23	50 Å²	50	16%	0.161	29%	0.286	C	S	.	.	H	α-helix	trans	-56.4	-45.9	174.8	-29.5	0	0	0	0	110.9	H629 S630 S631 S636 L637 S638	H629-S634 PolarHBondContact NE2-OG 3.05Å; S630-S634 PolarHBondContact O-N 3.34Å; S630-S634 VanDerWaalsContact O-N 3.15Å; S630-S634 PolarHBondContact O-OG 3.38Å; S631-S634 PolarHBondContact O-N 2.9Å; S634-S636 PolarHBondContact O-N 3.28Å; S634-L637 PolarHBondContact O-N 3.05Å; S634-S638 PolarHBondContact O-N 3.11Å; S634-S638 PolarHBondContact O-OG 3.25Å
635	K	71.6	Confident	71.4	Confident	130 Å²	130	52.7 Å²	52.7	57%	0.565	28%	0.279	S	S	*	.	H	α-helix	trans	-63.3	-20.9	172.9	-70.8	172.4	-177.5	176.9	0	115	S631 Q633 S638	S631-K635 VanDerWaalsContact O-CG 3.31Å; S631-K635 WeakPolarHBondContact O-CG 3.41Å; S631-K635 PolarHBondContact O-N 2.99Å; Q633-K635 VanDerWaalsContact C-N 3.3Å; Q633-K635 PolarHBondContact O-N 3.29Å; K635-S638 PolarHBondContact O-OG 2.91Å
636	S	70	Confident	68.7	Low	66 Å²	66	55.6 Å²	55.6	46%	0.462	29%	0.293	S	S	.	.	H	α-helix	trans	-88.3	-38.2	175.4	-168.5	0	0	0	0	111.4	N632 Q633 S634 K639 L640	N632-S636 PolarHBondContact O-N 3.43Å; Q633-S636 CarbonylContact O-C 3.59Å; Q633-S636 WeakPolarHBondContact O-CA 3.26Å; Q633-S636 WeakPolarHBondContact O-CB 3.2Å; Q633-S636 PolarHBondContact O-N 3.09Å; S634-S636 PolarHBondContact O-N 3.28Å; S636-K639 PolarHBondContact O-N 2.82Å; S636-L640 VanDerWaalsContact O-CD1 3.25Å; S636-L640 WeakPolarHBondContact O-CD1 3.46Å; S636-L640 PolarHBondContact O-N 2.86Å
637	L	71.9	Confident	66	Low	20 Å²	20	59.7 Å²	59.7	11%	0.105	31%	0.314	C	S	.	.	H	α-helix	trans	-73.5	-36.8	-178.7	-68.2	167.8	0	0	0	112	W587 Q633 S634 K639 L640 S641 I714 L717	W587-L637 HydrophobicContact CH2-CD1 3.97Å; W587-L637 HydrophobicContact CZ2-CD1 3.84Å; Q633-L637 WeakPolarHBondContact O-CG 3.44Å; Q633-L637 PolarHBondContact O-N 3.44Å; S634-L637 PolarHBondContact O-N 3.05Å; L637-K639 PolarHBondContact O-N 3.15Å; L637-L640 PolarHBondContact O-N 3.07Å; L637-S641 PolarHBondContact O-N 3Å; L637-I714 HydrophobicContact CB-CG2 4.11Å; L637-I714 HydrophobicContact CD1-CD1 4.1Å; L637-I714 HydrophobicContact CD1-CG2 4.37Å; L637-I714 HydrophobicContact CD2-CD1 3.87Å; L637-I714 HydrophobicContact CD2-CG1 4.21Å; L637-I714 HydrophobicContact CD2-CG2 3.99Å; L637-I714 HydrophobicContact CG-CG2 4.38Å; L637-L717 HydrophobicContact CD1-CD2 4.16Å
638	S	61.6	Low	63.2	Low	52 Å²	52	61.9 Å²	61.9	36%	0.364	33%	0.329	S	S	.	.	H	α-helix	trans	-61.3	-31	172.6	61	0	0	0	0	112.9	S634 K635 S641 I642	S634-S638 PolarHBondContact O-N 3.11Å; S634-S638 PolarHBondContact O-OG 3.25Å; K635-S638 PolarHBondContact O-OG 2.91Å; S638-S641 WeakPolarHBondContact CA-OG 3.48Å; S638-S641 PolarHBondContact O-OG 3.09Å; S638-I642 WeakPolarHBondContact O-CD1 3.44Å; S638-I642 WeakPolarHBondContact O-CG1 3.23Å; S638-I642 PolarHBondContact O-N 2.97Å
639	K	59.5	Low	60.4	Low	144 Å²	144	66.3 Å²	66.3	63%	0.626	36%	0.356	S	S	*	.	H	α-helix	trans	-70.2	-35.2	171.5	-67.7	-179	-179.9	-173.6	0	112.4	S636 L637 I643	S636-K639 PolarHBondContact O-N 2.82Å; L637-K639 PolarHBondContact O-N 3.15Å; K639-I643 WeakPolarHBondContact O-CD1 3.4Å; K639-I643 VanDerWaalsContact O-CG1 3.24Å; K639-I643 WeakPolarHBondContact O-CG1 3.49Å; K639-I643 PolarHBondContact O-N 3.2Å
640	L	54.2	Low	57.7	Low	59 Å²	59	70.3 Å²	70.3	31%	0.309	38%	0.38	S	S	.	.	H	α-helix	trans	-70.1	-38.3	173.9	-88.8	94	0	0	0	112.5	S636 L637 I643 T644	S636-L640 VanDerWaalsContact O-CD1 3.25Å; S636-L640 WeakPolarHBondContact O-CD1 3.46Å; S636-L640 PolarHBondContact O-N 2.86Å; L637-L640 PolarHBondContact O-N 3.07Å; L640-I643 PolarHBondContact O-N 2.82Å; L640-T644 WeakPolarHBondContact O-CB 3.24Å; L640-T644 PolarHBondContact O-N 2.98Å; L640-T644 PolarHBondContact O-OG1 3.12Å
641	S	49	Very low	55.1	Low	47 Å²	47	74.5 Å²	74.5	33%	0.329	41%	0.406	S	S	.	.	H	α-helix	trans	-64.7	-39.9	178.7	55.2	0	0	0	0	112.3	L637 S638 T644 M645	L637-S641 PolarHBondContact O-N 3Å; S638-S641 WeakPolarHBondContact CA-OG 3.48Å; S638-S641 PolarHBondContact O-OG 3.09Å; S641-T644 PolarHBondContact O-N 3.39Å; S641-M645 PolarHBondContact O-N 3.31Å; S641-M645 VanDerWaalsContact O-N 3.15Å
642	I	50.5	Low	52.6	Low	99 Å²	99	79.8 Å²	79.8	51%	0.508	43%	0.432	S	S	.	.	H	α-helix	trans	-59.2	-54.5	172.7	-65.8	164.1	0	0	0	110.2	S638 T644 M645 D646	S638-I642 WeakPolarHBondContact O-CD1 3.44Å; S638-I642 WeakPolarHBondContact O-CG1 3.23Å; S638-I642 PolarHBondContact O-N 2.97Å; I642-T644 PolarHBondContact O-N 2.69Å; I642-T644 VanDerWaalsContact O-N 3.12Å; I642-M645 PolarHBondContact O-N 3.01Å; I642-D646 PolarHBondContact O-N 2.86Å
643	I	40.2	Very low	50.4	Low	80 Å²	80	82.9 Å²	82.9	41%	0.41	45%	0.449	S	S	.	.	H	α-helix	trans	-57.2	-33.2	179.5	-67.9	165.7	0	0	0	112.3	K639 L640 I647	K639-I643 WeakPolarHBondContact O-CD1 3.4Å; K639-I643 VanDerWaalsContact O-CG1 3.24Å; K639-I643 WeakPolarHBondContact O-CG1 3.49Å; K639-I643 PolarHBondContact O-N 3.2Å; L640-I643 PolarHBondContact O-N 2.82Å; I643-I647 HydrophobicContact CG2-CD1 3.87Å; I643-I647 WeakPolarHBondContact O-CD1 3.45Å; I643-I647 VanDerWaalsContact O-CG1 3.26Å; I643-I647 WeakPolarHBondContact O-CG1 3.31Å; I643-I647 PolarHBondContact O-N 3Å; I643-I647 VanDerWaalsContact O-N 3.1Å
644	T	42.1	Very low	48.2	Very low	32 Å²	32	87.8 Å²	87.8	20%	0.196	48%	0.476	C	S	.	.	H	α-helix	trans	-73.1	-33.7	179.1	-49	0	0	0	0	111.8	L640 S641 I642 N648 H711	L640-T644 WeakPolarHBondContact O-CB 3.24Å; L640-T644 PolarHBondContact O-N 2.98Å; L640-T644 PolarHBondContact O-OG1 3.12Å; S641-T644 PolarHBondContact O-N 3.39Å; I642-T644 PolarHBondContact O-N 2.69Å; I642-T644 VanDerWaalsContact O-N 3.12Å; T644-N648 PolarHBondContact O-N 3.39Å; T644-H711 PolarHBondContact OG1-CE1 2.94Å; T644-H711 VanDerWaalsContact OG1-CE1 3.23Å
645	M	35.5	Very low	45.9	Very low	134 Å²	134	92.4 Å²	92.4	66%	0.66	51%	0.509	S	S	*	.	H	α-helix	trans	-70.8	-40	172.3	-71.5	178.5	160.6	0	0	112.1	S641 I642 I647 N648 T649	S641-M645 PolarHBondContact O-N 3.31Å; S641-M645 VanDerWaalsContact O-N 3.15Å; I642-M645 PolarHBondContact O-N 3.01Å; M645-I647 VanDerWaalsContact C-N 3.33Å; M645-I647 PolarHBondContact O-N 3.46Å; M645-N648 PolarHBondContact O-N 3.15Å; M645-T649 PolarHBondContact O-N 2.82Å; M645-T649 VanDerWaalsContact O-N 3.15Å; M645-T649 PolarHBondContact O-OG1 3.03Å
646	D	34.1	Very low	44.1	Very low	85 Å²	85	90.9 Å²	90.9	46%	0.455	51%	0.514	S	S	.	.	H	α-helix	trans	-63	-38	176.6	-61.4	-28.7	0	0	0	112.2	I642 T649 T650	I642-D646 PolarHBondContact O-N 2.86Å; D646-T649 PolarHBondContact O-OG1 3.25Å; D646-T649 VanDerWaalsContact O-OG1 3.13Å; D646-T650 WeakPolarHBondContact O-CB 3.49Å; D646-T650 WeakPolarHBondContact O-CG2 3.3Å; D646-T650 PolarHBondContact O-N 3.43Å; D646-T650 PolarHBondContact O-OG1 2.62Å
647	I	38.1	Very low	42.5	Very low	87 Å²	87	95 Å²	95	45%	0.446	53%	0.532	S	S	.	.	H	α-helix	trans	-68.1	-51.4	176.7	-70.7	166.3	0	0	0	110.5	I643 M645 T649 T650 T651	I643-I647 HydrophobicContact CG2-CD1 3.87Å; I643-I647 WeakPolarHBondContact O-CD1 3.45Å; I643-I647 VanDerWaalsContact O-CG1 3.26Å; I643-I647 WeakPolarHBondContact O-CG1 3.31Å; I643-I647 PolarHBondContact O-N 3Å; I643-I647 VanDerWaalsContact O-N 3.1Å; M645-I647 VanDerWaalsContact C-N 3.33Å; M645-I647 PolarHBondContact O-N 3.46Å; I647-T649 PolarHBondContact O-N 3.08Å; I647-T649 VanDerWaalsContact O-N 3.17Å; I647-T650 PolarHBondContact O-N 3.13Å; I647-T650 PolarHBondContact O-OG1 2.73Å; I647-T651 HydrophobicContact CG2-CG2 4.07Å; I647-T651 WeakPolarHBondContact O-CG2 3.35Å; I647-T651 PolarHBondContact O-N 3.17Å; I647-T651 PolarHBondContact O-OG1 3.31Å
648	N	35.5	Very low	40.5	Very low	105 Å²	105	103.6 Å²	103.6	56%	0.561	57%	0.568	S	S	*	*	H	α-helix	trans	-63.7	-24.4	-176.6	-71.7	-4.5	0	0	0	113.4	T644 M645	T644-N648 PolarHBondContact O-N 3.39Å; M645-N648 PolarHBondContact O-N 3.15Å
649	T	36.9	Very low	39.2	Very low	92 Å²	92	109.2 Å²	109.2	56%	0.564	59%	0.588	S	S	*	*	H	α-helix	trans	-85.4	-23.6	174.5	48.4	0	0	0	0	113.6	M645 D646 I647	M645-T649 PolarHBondContact O-N 2.82Å; M645-T649 VanDerWaalsContact O-N 3.15Å; M645-T649 PolarHBondContact O-OG1 3.03Å; D646-T649 PolarHBondContact O-OG1 3.25Å; D646-T649 VanDerWaalsContact O-OG1 3.13Å; I647-T649 PolarHBondContact O-N 3.08Å; I647-T649 VanDerWaalsContact O-N 3.17Å
650	T	37.7	Very low	38	Very low	85 Å²	85	108 Å²	108	52%	0.521	59%	0.589	S	S	.	*	H	α-helix	trans	-93	-21.9	179	49	0	0	0	0	114.3	D646 I647 N652	D646-T650 WeakPolarHBondContact O-CB 3.49Å; D646-T650 WeakPolarHBondContact O-CG2 3.3Å; D646-T650 PolarHBondContact O-N 3.43Å; D646-T650 PolarHBondContact O-OG1 2.62Å; I647-T650 PolarHBondContact O-N 3.13Å; I647-T650 PolarHBondContact O-OG1 2.73Å; T650-N652 VanDerWaalsContact C-N 3.35Å; T650-N652 PolarHBondContact O-N 3.37Å
651	T	37.6	Very low	37	Very low	90 Å²	90	115.4 Å²	115.4	55%	0.552	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-18.3	179.9	48.4	0	0	0	0	115.1	I647	I647-T651 HydrophobicContact CG2-CG2 4.07Å; I647-T651 WeakPolarHBondContact O-CG2 3.35Å; I647-T651 PolarHBondContact O-N 3.17Å; I647-T651 PolarHBondContact O-OG1 3.31Å
652	N	36.2	Very low	36.4	Very low	135 Å²	135	117.6 Å²	117.6	72%	0.722	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-7.4	-176.7	-80.5	-2.1	0	0	0	115.1	T650	T650-N652 VanDerWaalsContact C-N 3.35Å; T650-N652 PolarHBondContact O-N 3.37Å
653	N	38.3	Very low	35.7	Very low	134 Å²	134	119.6 Å²	119.6	72%	0.717	64%	0.64	S	S	*	*	S	Bend	trans	-112	6	-169.6	-74.6	-28.1	0	0	0	115.5
654	N	33.2	Very low	35.3	Very low	144 Å²	144	126.2 Å²	126.2	77%	0.77	66%	0.661	S	S	*	*			trans	-128.4	81.3	-175.7	-72.1	-66.9	0	0	0	112.2
655	S	29.9	Very low	34.9	Very low	121 Å²	121	131 Å²	131	85%	0.846	69%	0.686	S	S	*	*			trans	-142.9	32.8	177.7	59.3	0	0	0	0	114.4
656	S	34.8	Very low	34.9	Very low	97 Å²	97	128.1 Å²	128.1	68%	0.678	69%	0.69	S	S	*	*			trans	-125.7	152.5	168.5	62.8	0	0	0	0	112.3
657	D	35.1	Very low	34.8	Very low	154 Å²	154	129 Å²	129	82%	0.824	70%	0.699	S	S	*	*			trans	63.7	95.6	161.1	-48.2	-37.3	0	0	0	118.8
658	K	31.7	Very low	34.7	Very low	200 Å²	200	134.3 Å²	134.3	87%	0.87	72%	0.718	S	S	*	*			trans	-74.3	150.8	155.6	-53	161.8	-176.6	167.5	0	108.7
659	E	33.7	Very low	34.4	Very low	169 Å²	169	133.9 Å²	133.9	79%	0.79	72%	0.724	S	S	*	*				178.6	144.7	116.4	-102.7	-170.4	-163.4	0	0	113.6
660	N	33.7	Very low	33.9	Very low	120 Å²	120	137 Å²	137	64%	0.642	73%	0.733	S	S	*	*			trans	55	149	142.3	-69.1	-41.8	0	0	0	121.9
661	R	34.1	Very low	33.5	Very low	214 Å²	214	138.8 Å²	138.8	81%	0.808	75%	0.745	S	S	*	*			cis	-178.6	153.4	-17.5	-170.9	179.8	180	175.5	-0.6	108.5
662	S	35.4	Very low	33.3	Very low	93 Å²	93	139.6 Å²	139.6	65%	0.65	75%	0.754	S	S	*	*			trans	66.9	156.9	162.5	18	0	0	0	0	116.7
663	D	35.6	Very low	33	Very low	141 Å²	141	140.4 Å²	140.4	75%	0.754	76%	0.755	S	S	*	*			cis	-160.1	174.5	-1.8	-128.6	-23.5	0	0	0	114.8
664	Y	33.2	Very low	32.6	Very low	219 Å²	219	139.7 Å²	139.7	86%	0.859	75%	0.752	S	S	*	*			trans	82.9	151.8	156.8	-100.1	-92.6	0	0	0	123.7
665	D	32.3	Very low	32.7	Very low	133 Å²	133	139.2 Å²	139.2	71%	0.711	75%	0.749	S	S	*	*			trans	-106.5	167	-154	176.4	37.9	0	0	0	115	T667	D665-T667 WeakPolarHBondContact OD1-CG2 3.4Å
666	G	35.2	Very low	32.9	Very low	73 Å²	73	139.6 Å²	139.6	75%	0.753	74%	0.742	S	S	*	*			trans	179	94.1	174	0	0	0	0	0	113.9
667	T	33.2	Very low	32.8	Very low	103 Å²	103	141.6 Å²	141.6	63%	0.632	74%	0.744	S	S	*	*			trans	-98.6	163.7	-168.5	54.7	0	0	0	0	116.5	D665	D665-T667 WeakPolarHBondContact OD1-CG2 3.4Å
668	K	34.8	Very low	32.8	Very low	198 Å²	198	141.1 Å²	141.1	86%	0.861	74%	0.741	S	S	*	*			trans	89.6	157.8	162.7	-55.4	165.6	-172.4	171.2	0	117.9
669	S	29.5	Very low	32.9	Very low	96 Å²	96	136 Å²	136	67%	0.671	73%	0.73	S	S	*	*			cis	-171.8	143	-38	-160.6	0	0	0	0	111.2
670	M	26.5	Very low	33	Very low	157 Å²	157	135.4 Å²	135.4	77%	0.773	73%	0.732	S	S	*	*			trans	60.8	128.5	149.9	-76.8	175.1	69.9	0	0	123.6
671	T	29.6	Very low	33	Very low	124 Å²	124	137.1 Å²	137.1	76%	0.761	74%	0.741	S	S	*	*			trans	73.9	143.1	136.5	54.6	0	0	0	0	123.7
672	S	32.6	Very low	33.1	Very low	106 Å²	106	131.6 Å²	131.6	74%	0.741	73%	0.733	S	S	*	*			trans	112.9	99.2	138.9	-157.4	0	0	0	0	119.4
673	M	30.2	Very low	32.8	Very low	153 Å²	153	132.4 Å²	132.4	75%	0.754	74%	0.739	S	S	*	*				44.2	113.7	128.9	-61.5	177.9	81.6	0	0	121.7
674	D	30.2	Very low	32.5	Very low	119 Å²	119	131.5 Å²	131.5	64%	0.636	74%	0.738	S	S	*	*				75.9	147.8	118.2	-50.2	-16.5	0	0	0	123.7
675	N	35	Very low	32.4	Very low	133 Å²	133	126.9 Å²	126.9	71%	0.711	73%	0.733	S	S	*	*			trans	88.3	107.9	151.2	-60.5	-36.3	0	0	0	121.9
676	N	35.3	Very low	32.3	Very low	130 Å²	130	126.1 Å²	126.1	70%	0.695	73%	0.733	S	S	*	*				80.6	97.1	116.8	-63.3	11.5	0	0	0	121.7
677	D	32.3	Very low	31.9	Very low	138 Å²	138	127.1 Å²	127.1	74%	0.738	73%	0.728	S	S	*	*				91	149.3	103.1	-93.5	-35.6	0	0	0	124.7
678	I	33.8	Very low	31.9	Very low	145 Å²	145	130.6 Å²	130.6	74%	0.744	74%	0.737	S	S	*	*			trans	84.4	136.2	148	-75	159.1	0	0	0	121.2
679	S	34.5	Very low	31.6	Very low	93 Å²	93	129 Å²	129	65%	0.65	74%	0.737	S	S	*	*			trans	95.7	96.1	155.5	66.3	0	0	0	0	121.5
680	N	35.2	Very low	31.7	Very low	155 Å²	155	130.2 Å²	130.2	83%	0.829	75%	0.746	S	S	*	*				73.4	101.2	116.6	-60.4	5.7	0	0	0	122.3
681	D	34	Very low	31.7	Very low	156 Å²	156	128.3 Å²	128.3	83%	0.834	75%	0.748	S	S	*	*				75	164.3	116.6	-118	26.7	0	0	0	119.1
682	P	36.5	Very low	31.8	Very low	98 Å²	98	132 Å²	132	64%	0.636	75%	0.754	S	S	*	*				-134.3	-167	-102.1	41.6	-23.5	0	0	0	115
683	S	28.7	Very low	31.6	Very low	110 Å²	110	138 Å²	138	77%	0.769	76%	0.76	S	S	*	*			trans	99	160.7	160.4	83.6	0	0	0	0	118.8
684	V	30.8	Very low	31.8	Very low	122 Å²	122	136.9 Å²	136.9	74%	0.739	76%	0.762	S	S	*	*			trans	71.5	89.5	163.9	-174.7	0	0	0	0	119.2
685	V	29.7	Very low	31.9	Very low	123 Å²	123	134.9 Å²	134.9	75%	0.745	76%	0.757	S	S	*	*				75	151.3	126	177.8	0	0	0	0	120.7
686	T	30.2	Very low	31.8	Very low	117 Å²	117	132.4 Å²	132.4	72%	0.718	75%	0.75	S	S	*	*			trans	70.5	101.1	166.4	29	0	0	0	0	120.7
687	S	28.2	Very low	31.9	Very low	94 Å²	94	132.9 Å²	132.9	66%	0.657	75%	0.752	S	S	*	*				50.8	124.4	125.5	66.8	0	0	0	0	121.2
688	Q	33.2	Very low	32.4	Very low	176 Å²	176	133.3 Å²	133.3	82%	0.822	75%	0.754	S	S	*	*				167.9	147.9	110.3	-87.7	-173.3	26.7	0	0	112.4
689	L	27.9	Very low	33	Very low	163 Å²	163	128.4 Å²	128.4	85%	0.853	73%	0.731	S	S	*	*			trans	-8	119.8	169.9	-69	61.5	0	0	0	119.5
690	S	30.9	Very low	33.6	Very low	122 Å²	122	128.8 Å²	128.8	85%	0.853	73%	0.733	S	S	*	*				-156.9	119.9	124.5	55.3	0	0	0	0	112.2
691	S	27.4	Very low	34.9	Very low	118 Å²	118	127.1 Å²	127.1	83%	0.825	73%	0.733	S	S	*	*			trans	-113.1	169.5	172.9	-77.1	0	0	0	0	110.5
692	K	31.3	Very low	36.5	Very low	202 Å²	202	122 Å²	122	88%	0.878	71%	0.705	S	S	*	*			trans	83.6	96.1	176	-49.3	170	-179.1	179.6	0	115.7
693	R	28.9	Very low	38.5	Very low	231 Å²	231	120.8 Å²	120.8	87%	0.872	69%	0.694	S	S	*	*	S	Bend	trans	-164.4	-9.1	149.5	-117	170.9	-168	-167.8	2.6	117.7
694	T	34.2	Very low	41	Very low	130 Å²	130	117.6 Å²	117.6	80%	0.798	67%	0.67	S	S	*	*	S	Bend	trans	-96	-10.8	-171.6	45.1	0	0	0	0	116.1
695	S	32	Very low	43.4	Very low	77 Å²	77	114.1 Å²	114.1	54%	0.538	65%	0.647	S	S	.	*	S	Bend	trans	-85.4	-20	-167.8	-40.6	0	0	0	0	116
696	S	33.2	Very low	45.9	Very low	80 Å²	80	109.7 Å²	109.7	56%	0.559	62%	0.62	S	S	*	*	S	Bend	trans	-104.2	-3.3	-160.5	51.7	0	0	0	0	116.2
697	L	36.1	Very low	48.3	Very low	141 Å²	141	106.5 Å²	106.5	74%	0.738	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	5.3	-170.5	-74.3	167	0	0	0	115
698	L	43	Very low	51	Low	147 Å²	147	107.8 Å²	107.8	77%	0.77	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	-11.1	-175.3	-75.8	168.2	0	0	0	114.9
699	T	47.5	Very low	53.5	Low	42 Å²	42	101.7 Å²	101.7	26%	0.258	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-115.9	-25.8	-175.3	49.1	0	0	0	0	114.1	S701 M702	T699-S701 PolarHBondContact O-N 3.26Å; T699-M702 WeakPolarHBondContact O-CB 3.19Å; T699-M702 PolarHBondContact O-N 2.93Å
700	S	46.7	Very low	56.4	Low	101 Å²	101	95.9 Å²	95.9	71%	0.706	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-0.6	-168.5	65.6	0	0	0	0	116.5
701	S	63.5	Low	59.1	Low	119 Å²	119	93.6 Å²	93.6	83%	0.832	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.6	14.1	169	85.2	0	0	0	0	112.7	T699	T699-S701 PolarHBondContact O-N 3.26Å
702	M	66.2	Low	62.1	Low	49 Å²	49	91.5 Å²	91.5	24%	0.241	49%	0.485	C	S	.	.	S	Bend	trans	-86.1	128.5	161.6	-63	-169	-177	0	0	107.7	P594 T699 Q707	P594-M702 HydrophobicContact CB-CE 3.56Å; P594-M702 HydrophobicContact CG-CE 3.65Å; T699-M702 WeakPolarHBondContact O-CB 3.19Å; T699-M702 PolarHBondContact O-N 2.93Å; M702-Q707 HydrophobicContact CB-CB 4.49Å
703	D	78.9	Confident	65	Low	73 Å²	73	81.9 Å²	81.9	39%	0.39	44%	0.443	S	S	.	.			trans	-69.7	156.2	158.7	166.8	-143	0	0	0	106.5	L1324 L1325	D703-L1324 VanDerWaalsContact C-CD2 3.48Å; D703-L1324 HydrophobicContact CB-CB 4.1Å; D703-L1324 HydrophobicContact CB-CD1 3.31Å; D703-L1324 HydrophobicContact CB-CG 4.12Å; D703-L1324 VanDerWaalsContact CG-CD1 3.41Å; D703-L1324 WeakPolarHBondContact O-CD2 3.45Å; D703-L1324 WeakPolarHBondContact OD1-CA 3.43Å; D703-L1324 WeakPolarHBondContact OD1-CB 3.36Å; D703-L1324 WeakPolarHBondContact OD1-CD1 3.49Å; D703-L1324 PolarHBondContact OD1-N 3.48Å; D703-L1324 WeakPolarHBondContact OD2-CB 3.44Å; D703-L1325 PolarHBondContact OD2-N 3.4Å
704	P	80.4	Confident	68	Low	42 Å²	42	71.5 Å²	71.5	27%	0.273	41%	0.405	S	S	.	.	H	α-helix	trans	-80	-41.7	-149.1	-28.3	41.8	0	0	0	123.6	V706 Q707 E708 L1325 L1326	P704-V706 PolarHBondContact O-N 3.44Å; P704-Q707 CarbonylContact O-C 3.44Å; P704-Q707 WeakPolarHBondContact O-CA 3.48Å; P704-Q707 VanDerWaalsContact O-CB 3.24Å; P704-Q707 WeakPolarHBondContact O-CB 3.07Å; P704-Q707 PolarHBondContact O-N 3.47Å; P704-E708 PolarHBondContact O-N 3.38Å; P704-L1325 WeakPolarHBondContact CD-O 3.27Å; P704-L1325 WeakPolarHBondContact CG-O 3.46Å; P704-L1326 HydrophobicContact CG-CD1 4.31Å
705	I	81.1	Confident	70.7	Confident	49 Å²	49	68.8 Å²	68.8	25%	0.251	39%	0.388	S	S	.	.	H	α-helix	trans	-49.2	-30.1	-179.8	-58.9	177.4	0	0	0	114.6	E708 N709 L1324 L1325	I705-E708 WeakPolarHBondContact O-CB 3.44Å; I705-N709 WeakPolarHBondContact O-CB 3.48Å; I705-N709 PolarHBondContact O-N 3.35Å; I705-L1324 HydrophobicContact CB-CB 4.01Å; I705-L1324 HydrophobicContact CB-CD2 3.78Å; I705-L1324 HydrophobicContact CB-CG 4.34Å; I705-L1324 HydrophobicContact CG1-CB 4.11Å; I705-L1325 HydrophobicContact CD1-CD1 4.03Å; I705-L1325 HydrophobicContact CD1-CG 3.85Å; I705-L1325 HydrophobicContact CG1-CB 4.32Å; I705-L1325 HydrophobicContact CG1-CD1 3.67Å; I705-L1325 HydrophobicContact CG1-CG 3.78Å
706	V	82.3	Confident	73.6	Confident	30 Å²	30	65.4 Å²	65.4	18%	0.182	36%	0.364	C	S	.	.	H	α-helix	trans	-87.2	-29.4	179.9	172.7	0	0	0	0	108.4	W596 P704 E708 F710 L1324	W596-V706 HydrophobicContact CH2-CG1 3.59Å; W596-V706 WeakPolarHBondContact CH2-O 3.47Å; W596-V706 HydrophobicContact CZ3-CG1 3.42Å; W596-V706 VanDerWaalsContact CZ3-CG1 3.42Å; P704-V706 PolarHBondContact O-N 3.44Å; V706-E708 VanDerWaalsContact C-N 3.33Å; V706-F710 WeakPolarHBondContact O-CA 3.34Å; V706-F710 WeakPolarHBondContact O-CB 3.43Å; V706-F710 PolarHBondContact O-N 2.9Å; V706-L1324 HydrophobicContact CB-CD2 3.38Å; V706-L1324 HydrophobicContact CG2-CD2 3.32Å; V706-L1324 HydrophobicContact CG2-CG 4.26Å
707	Q	81.1	Confident	76.5	Confident	50 Å²	50	61.6 Å²	61.6	23%	0.234	34%	0.337	C	S	.	.	H	α-helix	trans	-64.2	-41.4	164.2	-167.6	-174.2	-19.9	0	0	110.4	M702 P704 F710 H711	M702-Q707 HydrophobicContact CB-CB 4.49Å; P704-Q707 CarbonylContact O-C 3.44Å; P704-Q707 WeakPolarHBondContact O-CA 3.48Å; P704-Q707 VanDerWaalsContact O-CB 3.24Å; P704-Q707 WeakPolarHBondContact O-CB 3.07Å; P704-Q707 PolarHBondContact O-N 3.47Å; Q707-F710 PolarHBondContact O-N 3.27Å; Q707-H711 PolarHBondContact NE2-NE2 3.26Å; Q707-H711 WeakPolarHBondContact O-CB 3.13Å; Q707-H711 PolarHBondContact O-CD2 3.36Å; Q707-H711 PolarHBondContact O-N 3.44Å
708	E	85	Confident	79.2	Confident	122 Å²	122	56.3 Å²	56.3	57%	0.57	31%	0.31	S	S	*	.	H	α-helix	trans	-63.6	-52.8	173.9	-176.1	-177.3	-179.1	0	0	112	P704 I705 V706 F710 H711 K712	P704-E708 PolarHBondContact O-N 3.38Å; I705-E708 WeakPolarHBondContact O-CB 3.44Å; V706-E708 VanDerWaalsContact C-N 3.33Å; E708-F710 PolarHBondContact O-N 2.64Å; E708-H711 PolarHBondContact O-N 3.25Å; E708-K712 WeakPolarHBondContact O-CB 3.49Å; E708-K712 PolarHBondContact O-N 3.47Å
709	N	86.1	Confident	81.6	Confident	48 Å²	48	53.6 Å²	53.6	26%	0.257	29%	0.29	S	S	.	.	H	α-helix	trans	-60.6	-32.6	174.5	-73.3	-14.3	0	0	0	112.2	W596 I705 A713	W596-N709 HydrophobicContact CH2-CB 4.16Å; W596-N709 HydrophobicContact CZ2-CB 4.06Å; I705-N709 WeakPolarHBondContact O-CB 3.48Å; I705-N709 PolarHBondContact O-N 3.35Å; N709-A713 VanDerWaalsContact O-CB 3.26Å; N709-A713 WeakPolarHBondContact O-CB 3.4Å; N709-A713 PolarHBondContact O-N 2.93Å
710	F	88.7	Confident	83.9	Confident	41 Å²	41	51.9 Å²	51.9	18%	0.18	28%	0.279	C	S	.	.	H	α-helix	trans	-70.9	-44.9	174.9	-174.7	-101.3	0	0	0	110.9	W587 W596 V706 Q707 E708 K712 A713 I714	W587-F710 HydrophobicContact CZ3-CE2 4.31Å; W587-F710 HydrophobicContact CZ3-CZ 4.34Å; W596-F710 HydrophobicContact CD2-CD2 4.2Å; W596-F710 AromaticContact CE3-CD2 3.84Å; W596-F710 HydrophobicContact CE3-CD2 3.84Å; W596-F710 HydrophobicContact CH2-CB 3.58Å; W596-F710 HydrophobicContact CH2-CD2 4.09Å; W596-F710 HydrophobicContact CH2-CG 4.36Å; W596-F710 HydrophobicContact CZ2-CB 4.16Å; W596-F710 HydrophobicContact CZ2-CD2 4.43Å; W596-F710 HydrophobicContact CZ3-CB 3.93Å; W596-F710 AromaticContact CZ3-CD2 3.77Å; W596-F710 HydrophobicContact CZ3-CD2 3.77Å; W596-F710 HydrophobicContact CZ3-CG 4.32Å; V706-F710 WeakPolarHBondContact O-CA 3.34Å; V706-F710 WeakPolarHBondContact O-CB 3.43Å; V706-F710 PolarHBondContact O-N 2.9Å; Q707-F710 PolarHBondContact O-N 3.27Å; E708-F710 PolarHBondContact O-N 2.64Å; F710-K712 VanDerWaalsContact C-N 3.3Å; F710-K712 PolarHBondContact O-N 2.76Å; F710-A713 CarbonylContact O-C 3.56Å; F710-A713 WeakPolarHBondContact O-CB 3.13Å; F710-A713 PolarHBondContact O-N 3.26Å; F710-A713 VanDerWaalsContact O-N 3.12Å; F710-I714 HydrophobicContact CD1-CG1 4.11Å; F710-I714 HydrophobicContact CE1-CD1 4.13Å; F710-I714 HydrophobicContact CE1-CG1 3.84Å; F710-I714 HydrophobicContact CE2-CD1 4.31Å; F710-I714 HydrophobicContact CZ-CD1 3.91Å; F710-I714 HydrophobicContact CZ-CG1 4.14Å; F710-I714 WeakPolarHBondContact O-CG1 3.33Å; F710-I714 PolarHBondContact O-N 2.76Å
711	H	87.8	Confident	86.1	Confident	74 Å²	74	47.3 Å²	47.3	34%	0.343	25%	0.247	S	C	.	.	H	α-helix	trans	-57.9	-42.8	172.6	-78	-59.1	0	0	0	111.7	T644 Q707 E708 I714 T715	T644-H711 PolarHBondContact OG1-CE1 2.94Å; T644-H711 VanDerWaalsContact OG1-CE1 3.23Å; Q707-H711 PolarHBondContact NE2-NE2 3.26Å; Q707-H711 WeakPolarHBondContact O-CB 3.13Å; Q707-H711 PolarHBondContact O-CD2 3.36Å; Q707-H711 PolarHBondContact O-N 3.44Å; E708-H711 PolarHBondContact O-N 3.25Å; H711-I714 PolarHBondContact O-N 3.39Å; H711-T715 WeakPolarHBondContact O-CB 3.47Å; H711-T715 PolarHBondContact O-N 3.15Å; H711-T715 PolarHBondContact O-OG1 3.37Å
712	K	89.6	Confident	87.5	Confident	73 Å²	73	46.1 Å²	46.1	32%	0.317	23%	0.231	S	C	.	.	H	α-helix	trans	-58.8	-48.7	171.3	-175.5	-171.2	173.9	-158.3	0	111.4	G614 Y616 E708 F710 I714 T715 E716	G614-K712 WeakPolarHBondContact O-CE 3.42Å; G614-K712 PolarHBondContact O-NZ 3.47Å; Y616-K712 VanDerWaalsContact CZ-NZ 3.32Å; Y616-K712 WeakPolarHBondContact OH-CE 3.49Å; Y616-K712 PolarHBondContact OH-NZ 3.31Å; E708-K712 WeakPolarHBondContact O-CB 3.49Å; E708-K712 PolarHBondContact O-N 3.47Å; F710-K712 VanDerWaalsContact C-N 3.3Å; F710-K712 PolarHBondContact O-N 2.76Å; K712-I714 VanDerWaalsContact C-N 3.34Å; K712-I714 PolarHBondContact O-N 3.01Å; K712-T715 WeakPolarHBondContact O-CB 3.48Å; K712-T715 PolarHBondContact O-N 3.04Å; K712-T715 VanDerWaalsContact O-N 3.1Å; K712-E716 VanDerWaalsContact CE-OE1 3.22Å; K712-E716 WeakPolarHBondContact CE-OE1 3.27Å; K712-E716 IonicContact NZ-OE1 2.73Å; K712-E716 WeakPolarHBondContact O-CG 3.27Å; K712-E716 PolarHBondContact O-N 3.02Å
713	A	92.4	Very high	88.8	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.6	-38.1	178.1	0	0	0	0	0	113.1	W596 P597 F613 N709 F710 L717	W596-A713 HydrophobicContact CZ2-CB 4.19Å; P597-A713 HydrophobicContact CG-CB 4.04Å; F613-A713 HydrophobicContact CB-CB 3.85Å; F613-A713 VanDerWaalsContact O-CB 3.25Å; F613-A713 WeakPolarHBondContact O-CB 3.4Å; N709-A713 VanDerWaalsContact O-CB 3.26Å; N709-A713 WeakPolarHBondContact O-CB 3.4Å; N709-A713 PolarHBondContact O-N 2.93Å; F710-A713 CarbonylContact O-C 3.56Å; F710-A713 WeakPolarHBondContact O-CB 3.13Å; F710-A713 PolarHBondContact O-N 3.26Å; F710-A713 VanDerWaalsContact O-N 3.12Å; A713-L717 WeakPolarHBondContact O-CB 3.36Å; A713-L717 PolarHBondContact O-N 3.06Å
714	I	92.3	Very high	89.4	Confident	13 Å²	13	42 Å²	42	7%	0.067	21%	0.21	C	C	.	.	H	α-helix	trans	-68.1	-38.8	173.5	-63.9	-49.3	0	0	0	111.4	W587 P597 L637 F710 H711 K712 L717 N718	W587-I714 HydrophobicContact CH2-CD1 3.64Å; W587-I714 HydrophobicContact CZ3-CD1 4.19Å; P597-I714 HydrophobicContact CG-CD1 4.41Å; L637-I714 HydrophobicContact CB-CG2 4.11Å; L637-I714 HydrophobicContact CD1-CD1 4.1Å; L637-I714 HydrophobicContact CD1-CG2 4.37Å; L637-I714 HydrophobicContact CD2-CD1 3.87Å; L637-I714 HydrophobicContact CD2-CG1 4.21Å; L637-I714 HydrophobicContact CD2-CG2 3.99Å; L637-I714 HydrophobicContact CG-CG2 4.38Å; F710-I714 HydrophobicContact CD1-CG1 4.11Å; F710-I714 HydrophobicContact CE1-CD1 4.13Å; F710-I714 HydrophobicContact CE1-CG1 3.84Å; F710-I714 HydrophobicContact CE2-CD1 4.31Å; F710-I714 HydrophobicContact CZ-CD1 3.91Å; F710-I714 HydrophobicContact CZ-CG1 4.14Å; F710-I714 WeakPolarHBondContact O-CG1 3.33Å; F710-I714 PolarHBondContact O-N 2.76Å; H711-I714 PolarHBondContact O-N 3.39Å; K712-I714 VanDerWaalsContact C-N 3.34Å; K712-I714 PolarHBondContact O-N 3.01Å; I714-L717 HydrophobicContact CD1-CD2 4.25Å; I714-L717 PolarHBondContact O-N 3.34Å; I714-N718 WeakPolarHBondContact O-CB 3.38Å; I714-N718 VanDerWaalsContact O-CG 3.23Å; I714-N718 PolarHBondContact O-N 3.13Å; I714-N718 PolarHBondContact O-ND2 3.34Å
715	T	90	Very high	90	Very high	73 Å²	73	43.9 Å²	43.9	45%	0.448	21%	0.212	S	C	.	.	H	α-helix	trans	-66.5	-48.6	179.4	-57.5	0	0	0	0	111.2	W573 H711 K712 L717 N718 Y719	W573-T715 HydrophobicContact CH2-CG2 3.92Å; W573-T715 HydrophobicContact CZ3-CG2 4.27Å; H711-T715 WeakPolarHBondContact O-CB 3.47Å; H711-T715 PolarHBondContact O-N 3.15Å; H711-T715 PolarHBondContact O-OG1 3.37Å; K712-T715 WeakPolarHBondContact O-CB 3.48Å; K712-T715 PolarHBondContact O-N 3.04Å; K712-T715 VanDerWaalsContact O-N 3.1Å; T715-L717 PolarHBondContact O-N 3.05Å; T715-N718 PolarHBondContact O-N 2.94Å; T715-Y719 PolarHBondContact O-N 3.17Å
716	E	94	Very high	90.5	Very high	6 Å²	6	48.6 Å²	48.6	3%	0.028	23%	0.233	C	C	.	.	H	α-helix	trans	-60.3	-43.3	173.5	-69.3	179.5	179.8	0	0	112.3	W573 C576 F613 G614 Y616 K712 N718 Y719 H720	W573-E716 HydrophobicContact CZ3-CG 4.43Å; C576-E716 PolarHBondContact SG-O 3.02Å; C576-E716 VanDerWaalsContact SG-O 3.34Å; F613-E716 HydrophobicContact CB-CB 4.48Å; F613-E716 HydrophobicContact CD1-CB 3.73Å; G614-E716 PolarHBondContact N-OE2 3.44Å; Y616-E716 VanDerWaalsContact CE1-OE1 3.29Å; Y616-E716 WeakPolarHBondContact CE1-OE1 3.33Å; Y616-E716 WeakPolarHBondContact CE1-OE2 3.34Å; Y616-E716 VanDerWaalsContact CZ-OE1 3.29Å; Y616-E716 PolarHBondContact OH-OE1 3.49Å; K712-E716 VanDerWaalsContact CE-OE1 3.22Å; K712-E716 WeakPolarHBondContact CE-OE1 3.27Å; K712-E716 IonicContact NZ-OE1 2.73Å; K712-E716 WeakPolarHBondContact O-CG 3.27Å; K712-E716 PolarHBondContact O-N 3.02Å; E716-N718 PolarHBondContact O-N 3.38Å; E716-Y719 PolarHBondContact O-N 3.29Å; E716-H720 VanDerWaalsContact O-CB 3.3Å; E716-H720 WeakPolarHBondContact O-CB 3.41Å; E716-H720 PolarHBondContact O-N 3.44Å
717	L	94.8	Very high	90.9	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-57.5	-48.4	176.1	168.5	65.2	0	0	0	111.8	I585 W587 P597 F613 L637 A713 I714 T715 V721	I585-L717 HydrophobicContact CD1-CD1 4.45Å; I585-L717 HydrophobicContact CG2-CD1 3.56Å; W587-L717 HydrophobicContact CH2-CD2 4.21Å; W587-L717 HydrophobicContact CZ2-CD2 4.01Å; P597-L717 HydrophobicContact CB-CD2 3.79Å; P597-L717 HydrophobicContact CG-CD2 4.22Å; F613-L717 HydrophobicContact CD1-CB 4.4Å; F613-L717 HydrophobicContact CE2-CD1 4.25Å; F613-L717 HydrophobicContact CG-CB 4.48Å; F613-L717 HydrophobicContact CZ-CD1 4.29Å; L637-L717 HydrophobicContact CD1-CD2 4.16Å; A713-L717 WeakPolarHBondContact O-CB 3.36Å; A713-L717 PolarHBondContact O-N 3.06Å; I714-L717 HydrophobicContact CD1-CD2 4.25Å; I714-L717 PolarHBondContact O-N 3.34Å; T715-L717 PolarHBondContact O-N 3.05Å; L717-V721 HydrophobicContact CD1-CG2 4.14Å; L717-V721 WeakPolarHBondContact O-CB 3.37Å; L717-V721 VanDerWaalsContact O-CG2 3.27Å; L717-V721 WeakPolarHBondContact O-CG2 3.49Å; L717-V721 PolarHBondContact O-N 3.32Å
718	N	92.7	Very high	91.4	Very high	31 Å²	31	51.2 Å²	51.2	17%	0.166	24%	0.238	C	C	.	.	H	α-helix	trans	-63.9	-43.9	179.2	-71.8	-21.4	0	0	0	111.3	I714 T715 E716 V721 N722	I714-N718 WeakPolarHBondContact O-CB 3.38Å; I714-N718 VanDerWaalsContact O-CG 3.23Å; I714-N718 PolarHBondContact O-N 3.13Å; I714-N718 PolarHBondContact O-ND2 3.34Å; T715-N718 PolarHBondContact O-N 2.94Å; E716-N718 PolarHBondContact O-N 3.38Å; N718-V721 PolarHBondContact O-N 3.27Å; N718-N722 VanDerWaalsContact O-CG 3.26Å; N718-N722 PolarHBondContact O-N 3.14Å
719	Y	92.9	Very high	91.5	Very high	90 Å²	90	49.5 Å²	49.5	35%	0.353	24%	0.237	S	C	.	.	H	α-helix	trans	-64.2	-45.4	177.7	-179.8	-112.1	0	0	0	112.1	W573 C576 T715 E716 V721 N722 L723	W573-Y719 HydrophobicContact CB-CD1 4.3Å; W573-Y719 HydrophobicContact CB-CE1 3.78Å; W573-Y719 AromaticContact CD2-CD1 3.74Å; W573-Y719 HydrophobicContact CD2-CD1 3.74Å; W573-Y719 AromaticContact CD2-CE1 3.81Å; W573-Y719 HydrophobicContact CD2-CE1 3.81Å; W573-Y719 HydrophobicContact CD2-CG 4.4Å; W573-Y719 AromaticContact CE3-CD1 3.38Å; W573-Y719 HydrophobicContact CE3-CD1 3.38Å; W573-Y719 AromaticContact CE3-CE1 3.96Å; W573-Y719 HydrophobicContact CE3-CE1 3.96Å; W573-Y719 AromaticContact CE3-CG 3.94Å; W573-Y719 HydrophobicContact CE3-CG 3.94Å; W573-Y719 HydrophobicContact CG-CD1 4.15Å; W573-Y719 AromaticContact CG-CE1 3.75Å; W573-Y719 HydrophobicContact CG-CE1 3.75Å; W573-Y719 AromaticContact CZ3-CD1 3.93Å; W573-Y719 HydrophobicContact CZ3-CD1 3.93Å; W573-Y719 HydrophobicContact CZ3-CG 4.01Å; C576-Y719 HydrophobicContact CB-CD1 3.52Å; C576-Y719 HydrophobicContact CB-CE1 3.89Å; T715-Y719 PolarHBondContact O-N 3.17Å; E716-Y719 PolarHBondContact O-N 3.29Å; Y719-V721 PolarHBondContact O-N 3.09Å; Y719-N722 PolarHBondContact O-N 3.43Å; Y719-L723 HydrophobicContact CD1-CD1 4.03Å; Y719-L723 HydrophobicContact CE1-CD1 3.52Å; Y719-L723 HydrophobicContact CE1-CG 4.2Å; Y719-L723 HydrophobicContact CE2-CG 4.41Å; Y719-L723 PolarHBondContact O-N 2.79Å
720	H	94.6	Very high	91.5	Very high	5 Å²	5	52.8 Å²	52.8	2%	0.023	26%	0.255	C	S	.	.	H	α-helix	trans	-62.9	-39.9	176.4	-175.6	54.1	0	0	0	112.7	C576 K599 F613 E716 L723 I724	C576-H720 HydrophobicContact CB-CB 4.07Å; C576-H720 PolarHBondContact O-ND1 3.48Å; K599-H720 VanDerWaalsContact CE-NE2 3.33Å; K599-H720 WeakPolarHBondContact CE-NE2 3.47Å; K599-H720 PolarHBondContact NZ-CE1 3.21Å; K599-H720 PolarHBondContact NZ-NE2 3.44Å; K599-H720 VanDerWaalsContact NZ-NE2 3.11Å; F613-H720 HydrophobicContact CE1-CB 3.99Å; F613-H720 HydrophobicContact CZ-CB 4.48Å; F613-H720 AromaticContact CZ-CD2 3.81Å; E716-H720 VanDerWaalsContact O-CB 3.3Å; E716-H720 WeakPolarHBondContact O-CB 3.41Å; E716-H720 PolarHBondContact O-N 3.44Å; H720-L723 PolarHBondContact O-N 3.13Å; H720-I724 WeakPolarHBondContact O-CG1 3.08Å; H720-I724 PolarHBondContact O-N 2.69Å
721	V	93.5	Very high	91.6	Very high	5 Å²	5	50.9 Å²	50.9	3%	0.03	25%	0.247	C	C	.	.	H	α-helix	trans	-63.6	-40.4	174.4	166.7	0	0	0	0	111.3	I585 L717 N718 Y719 I724 Y725 L733	I585-V721 HydrophobicContact CD1-CG2 3.65Å; L717-V721 HydrophobicContact CD1-CG2 4.14Å; L717-V721 WeakPolarHBondContact O-CB 3.37Å; L717-V721 VanDerWaalsContact O-CG2 3.27Å; L717-V721 WeakPolarHBondContact O-CG2 3.49Å; L717-V721 PolarHBondContact O-N 3.32Å; N718-V721 PolarHBondContact O-N 3.27Å; Y719-V721 PolarHBondContact O-N 3.09Å; V721-I724 PolarHBondContact O-N 2.86Å; V721-Y725 HydrophobicContact CG1-CD2 3.75Å; V721-Y725 HydrophobicContact CG1-CE2 3.5Å; V721-Y725 WeakPolarHBondContact O-CD2 3.44Å; V721-Y725 PolarHBondContact O-N 2.95Å; V721-L733 HydrophobicContact CG1-CD1 4.05Å
722	N	92.4	Very high	91.7	Very high	94 Å²	94	54.3 Å²	54.3	50%	0.503	26%	0.261	S	S	.	.	H	α-helix	trans	-64.4	-42.1	175.5	-69.9	-10.9	0	0	0	112.1	N718 Y719 I724 Y725 Q726	N718-N722 VanDerWaalsContact O-CG 3.26Å; N718-N722 PolarHBondContact O-N 3.14Å; Y719-N722 PolarHBondContact O-N 3.43Å; N722-I724 VanDerWaalsContact C-N 3.33Å; N722-I724 PolarHBondContact O-N 3.18Å; N722-Y725 PolarHBondContact O-N 3.25Å; N722-Q726 WeakPolarHBondContact O-CG 3.35Å; N722-Q726 PolarHBondContact O-N 3.42Å
723	L	93.2	Very high	91.9	Very high	34 Å²	34	51.3 Å²	51.3	18%	0.178	25%	0.248	C	C	.	.	H	α-helix	trans	-60	-40.5	173.9	-72.2	174.6	0	0	0	112.2	C576 L578 Y719 H720 Q726 R727	C576-L723 HydrophobicContact CB-CD1 4.33Å; C576-L723 WeakPolarHBondContact O-CD1 3.47Å; L578-L723 HydrophobicContact CD1-CB 4.39Å; L578-L723 HydrophobicContact CD2-CB 3.95Å; L578-L723 HydrophobicContact CG-CB 4.29Å; Y719-L723 HydrophobicContact CD1-CD1 4.03Å; Y719-L723 HydrophobicContact CE1-CD1 3.52Å; Y719-L723 HydrophobicContact CE1-CG 4.2Å; Y719-L723 HydrophobicContact CE2-CG 4.41Å; Y719-L723 PolarHBondContact O-N 2.79Å; H720-L723 PolarHBondContact O-N 3.13Å; L723-Q726 PolarHBondContact O-N 3.1Å; L723-R727 PolarHBondContact O-N 3.2Å
724	I	93.3	Very high	91.9	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-61.6	-45.7	175.1	-67.2	163	0	0	0	110.5	L578 I582 I585 H720 V721 N722 Q726 R727 Y728 F731	L578-I724 HydrophobicContact CD2-CG1 3.74Å; I582-I724 HydrophobicContact CD1-CG2 3.97Å; I582-I724 HydrophobicContact CG2-CD1 3.84Å; I582-I724 HydrophobicContact CG2-CG1 4.21Å; I582-I724 HydrophobicContact CG2-CG2 4.04Å; I585-I724 HydrophobicContact CD1-CD1 3.95Å; H720-I724 WeakPolarHBondContact O-CG1 3.08Å; H720-I724 PolarHBondContact O-N 2.69Å; V721-I724 PolarHBondContact O-N 2.86Å; N722-I724 VanDerWaalsContact C-N 3.33Å; N722-I724 PolarHBondContact O-N 3.18Å; I724-Q726 VanDerWaalsContact C-N 3.29Å; I724-Q726 PolarHBondContact O-N 2.95Å; I724-R727 PolarHBondContact O-N 2.93Å; I724-Y728 HydrophobicContact CG2-CD2 4.36Å; I724-Y728 PolarHBondContact O-N 3.39Å; I724-F731 HydrophobicContact CG2-CB 4.19Å; I724-F731 HydrophobicContact CG2-CD1 3.41Å; I724-F731 VanDerWaalsContact CG2-CD1 3.41Å; I724-F731 HydrophobicContact CG2-CD2 4.18Å; I724-F731 HydrophobicContact CG2-CE1 3.69Å; I724-F731 HydrophobicContact CG2-CE2 4.44Å; I724-F731 HydrophobicContact CG2-CG 3.67Å; I724-F731 HydrophobicContact CG2-CZ 4.21Å
725	Y	93.2	Very high	91.7	Very high	82 Å²	82	54.9 Å²	54.9	32%	0.322	27%	0.27	S	S	.	.	H	α-helix	trans	-64	-31.3	177.4	-79.5	-62.5	0	0	0	113.4	V721 N722 F731 L733	V721-Y725 HydrophobicContact CG1-CD2 3.75Å; V721-Y725 HydrophobicContact CG1-CE2 3.5Å; V721-Y725 WeakPolarHBondContact O-CD2 3.44Å; V721-Y725 PolarHBondContact O-N 2.95Å; N722-Y725 PolarHBondContact O-N 3.25Å; Y725-F731 HydrophobicContact CD1-CD1 4.34Å; Y725-F731 HydrophobicContact CE1-CD1 4.09Å; Y725-F731 WeakPolarHBondContact CE1-O 3.39Å; Y725-L733 HydrophobicContact CE2-CD1 4.29Å
726	Q	91.3	Very high	91.6	Very high	148 Å²	148	56.3 Å²	56.3	69%	0.692	28%	0.275	S	S	*	.	H	α-helix	trans	-71	-44.6	175.2	-74.2	172.7	-23.7	0	0	112.5	N722 L723 I724	N722-Q726 WeakPolarHBondContact O-CG 3.35Å; N722-Q726 PolarHBondContact O-N 3.42Å; L723-Q726 PolarHBondContact O-N 3.1Å; I724-Q726 VanDerWaalsContact C-N 3.29Å; I724-Q726 PolarHBondContact O-N 2.95Å
727	R	90.7	Very high	91.2	Very high	125 Å²	125	58.2 Å²	58.2	47%	0.472	28%	0.284	S	S	.	.	H	α-helix	trans	-78.5	-30.4	179.2	-169.9	172.2	-173	88.1	-1.6	113.3	L578 L723 I724 E754	L578-R727 HydrophobicContact CD1-CB 3.64Å; L578-R727 HydrophobicContact CD1-CG 4.24Å; L723-R727 PolarHBondContact O-N 3.2Å; I724-R727 PolarHBondContact O-N 2.93Å; R727-E754 IonicContact CZ-OE1 2.78Å; R727-E754 IonicContact CZ-OE2 3.33Å; R727-E754 IonicContact NE-OE1 3.75Å; R727-E754 PolarHBondContact NE-OE1 3Å; R727-E754 IonicContact NE-OE2 3.09Å; R727-E754 IonicContact NH2-OE1 3.26Å; R727-E754 PolarHBondContact NH2-OE1 3.41Å; R727-E754 IonicContact NH2-OE2 2.72Å; R727-E754 PolarHBondContact NH2-OE2 3.44Å
728	Y	90.6	Very high	91	Very high	10 Å²	10	60.5 Å²	60.5	4%	0.039	30%	0.296	C	S	.	.			trans	-130	77.4	-177.3	-52.3	-80.7	0	0	0	110.8	I582 I724 N730 F731 F752 E754	I582-Y728 HydrophobicContact CD1-CD2 3.64Å; I582-Y728 HydrophobicContact CD1-CE2 4.1Å; I582-Y728 HydrophobicContact CD1-CG 3.89Å; I582-Y728 HydrophobicContact CG1-CD2 3.97Å; I582-Y728 HydrophobicContact CG1-CE2 3.91Å; I724-Y728 HydrophobicContact CG2-CD2 4.36Å; I724-Y728 PolarHBondContact O-N 3.39Å; Y728-N730 PolarHBondContact O-N 3.3Å; Y728-F731 WeakPolarHBondContact O-CB 3.47Å; Y728-F731 PolarHBondContact O-N 3.05Å; Y728-F752 HydrophobicContact CD1-CB 3.88Å; Y728-F752 HydrophobicContact CE1-CB 4.4Å; Y728-E754 HydrophobicContact CE1-CG 3.7Å; Y728-E754 PolarHBondContact OH-OE1 2.98Å
729	P	87.9	Confident	91	Very high	87 Å²	87	68.3 Å²	68.3	57%	0.565	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-24.8	-178.5	-27.3	36.1	0	0	0	114.6
730	N	86.5	Confident	91	Very high	117 Å²	117	64.4 Å²	64.4	63%	0.626	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-11.6	176.2	-71.2	-37.5	0	0	0	114.1	Y728	Y728-N730 PolarHBondContact O-N 3.3Å
731	F	90.5	Very high	90.8	Very high	1 Å²	1	66.4 Å²	66.4	0%	0.004	32%	0.321	C	S	.	.			trans	-63.3	133.5	176.2	176.6	-103.4	0	0	0	111	I582 I724 Y725 Y728 L733 Y748 Y749 F752	I582-F731 HydrophobicContact CD1-CB 4.49Å; I582-F731 HydrophobicContact CD1-CD2 3.67Å; I582-F731 HydrophobicContact CD1-CE2 4.18Å; I582-F731 HydrophobicContact CD1-CG 4.25Å; I582-F731 HydrophobicContact CG2-CE2 4.05Å; I582-F731 HydrophobicContact CG2-CZ 4.38Å; I724-F731 HydrophobicContact CG2-CB 4.19Å; I724-F731 HydrophobicContact CG2-CD1 3.41Å; I724-F731 VanDerWaalsContact CG2-CD1 3.41Å; I724-F731 HydrophobicContact CG2-CD2 4.18Å; I724-F731 HydrophobicContact CG2-CE1 3.69Å; I724-F731 HydrophobicContact CG2-CE2 4.44Å; I724-F731 HydrophobicContact CG2-CG 3.67Å; I724-F731 HydrophobicContact CG2-CZ 4.21Å; Y725-F731 HydrophobicContact CD1-CD1 4.34Å; Y725-F731 HydrophobicContact CE1-CD1 4.09Å; Y725-F731 WeakPolarHBondContact CE1-O 3.39Å; Y728-F731 WeakPolarHBondContact O-CB 3.47Å; Y728-F731 PolarHBondContact O-N 3.05Å; F731-L733 HydrophobicContact CE1-CD2 3.8Å; F731-L733 HydrophobicContact CE1-CG 3.75Å; F731-L733 HydrophobicContact CZ-CD2 3.75Å; F731-L733 HydrophobicContact CZ-CG 4.17Å; F731-Y748 VanDerWaalsContact CE2-O 3.26Å; F731-Y748 WeakPolarHBondContact CE2-O 3.35Å; F731-Y749 AromaticContact CE2-CD1 3.79Å; F731-Y749 HydrophobicContact CE2-CD1 3.79Å; F731-Y749 AromaticContact CE2-CE1 3.76Å; F731-Y749 HydrophobicContact CE2-CE1 3.76Å; F731-Y749 HydrophobicContact CE2-CG 4.41Å; F731-Y749 HydrophobicContact CZ-CD1 4.14Å; F731-Y749 AromaticContact CZ-CE1 3.6Å; F731-Y749 HydrophobicContact CZ-CE1 3.6Å; F731-Y749 AromaticContact CZ-CZ 3.96Å; F731-F752 HydrophobicContact CB-CE1 4.37Å; F731-F752 HydrophobicContact CB-CZ 4.42Å; F731-F752 HydrophobicContact CD2-CD2 4.4Å; F731-F752 HydrophobicContact CD2-CE1 4.5Å; F731-F752 AromaticContact CD2-CE2 3.7Å; F731-F752 HydrophobicContact CD2-CE2 3.7Å; F731-F752 AromaticContact CD2-CZ 3.76Å; F731-F752 HydrophobicContact CD2-CZ 3.76Å; F731-F752 HydrophobicContact CE2-CE2 4.36Å
732	K	90	Very high	90.4	Very high	146 Å²	146	70.3 Å²	70.3	64%	0.635	34%	0.337	S	S	*	.			trans	-138.7	108.5	-178.8	-70.5	175.7	-174.9	168.4	0	110.8	Y748	K732-Y748 WeakPolarHBondContact O-CD1 3.5Å
733	L	92.7	Very high	90.2	Very high	10 Å²	10	75.8 Å²	75.8	5%	0.052	35%	0.351	C	S	.	.			trans	-56.1	147	169.3	-70.3	169	0	0	0	111.5	V721 Y725 F731 Y749	V721-L733 HydrophobicContact CG1-CD1 4.05Å; Y725-L733 HydrophobicContact CE2-CD1 4.29Å; F731-L733 HydrophobicContact CE1-CD2 3.8Å; F731-L733 HydrophobicContact CE1-CG 3.75Å; F731-L733 HydrophobicContact CZ-CD2 3.75Å; F731-L733 HydrophobicContact CZ-CG 4.17Å; L733-Y749 WeakPolarHBondContact CD2-OH 3.26Å
734	P	92.4	Very high	90.1	Very high	1 Å²	1	76.8 Å²	76.8	1%	0.006	35%	0.354	C	S	.	.			trans	-60.3	143	171.9	27.2	-34.6	0	0	0	110.6	L628 H629 S630 S631 N736 L738 Y748	L628-P734 HydrophobicContact CB-CG 4.32Å; H629-P734 WeakPolarHBondContact O-CD 3.1Å; H629-P734 VanDerWaalsContact O-CG 3.29Å; H629-P734 WeakPolarHBondContact O-CG 3.49Å; S630-P734 CarbonylContact C-O 3.54Å; S630-P734 WeakPolarHBondContact CA-O 3.15Å; S630-P734 WeakPolarHBondContact CB-O 3.42Å; S631-P734 PolarHBondContact N-O 2.83Å; P734-N736 PolarHBondContact O-N 2.73Å; P734-L738 HydrophobicContact CB-CD1 3.85Å; P734-L738 HydrophobicContact CB-CG 4.16Å; P734-Y748 HydrophobicContact CB-CD1 4.15Å; P734-Y748 HydrophobicContact CB-CD2 4.12Å; P734-Y748 HydrophobicContact CB-CE1 3.94Å; P734-Y748 HydrophobicContact CB-CE2 3.95Å; P734-Y748 HydrophobicContact CB-CG 4.24Å; P734-Y748 HydrophobicContact CG-CD2 4.45Å; P734-Y748 HydrophobicContact CG-CG 4.43Å
735	V	88	Confident	90	Very high	86 Å²	86	77.1 Å²	77.1	52%	0.521	36%	0.357	S	S	.	.	S	Bend	trans	-64	-43.6	-178.1	178.5	0	0	0	0	111.3	N632	N632-V735 VanDerWaalsContact CB-O 3.28Å; N632-V735 WeakPolarHBondContact CB-O 3.32Å; N632-V735 VanDerWaalsContact CG-O 3.25Å; N632-V735 PolarHBondContact N-O 3.18Å; N632-V735 WeakPolarHBondContact ND2-CG1 3.33Å; N632-V735 PolarHBondContact ND2-O 3.46Å; N632-V735 VanDerWaalsContact ND2-O 3.14Å
736	N	87.9	Confident	89.7	Confident	103 Å²	103	79.8 Å²	79.8	55%	0.551	37%	0.37	S	S	*	.	S	Bend	trans	-113.6	159.6	-178.2	-68.5	-28.8	0	0	0	111.7	S630 N632 P734 L738	S630-N736 VanDerWaalsContact CB-C 3.49Å; S630-N736 WeakPolarHBondContact CB-O 3.33Å; N632-N736 PolarHBondContact ND2-OD1 3.19Å; N632-N736 VanDerWaalsContact ND2-OD1 3.09Å; P734-N736 PolarHBondContact O-N 2.73Å; N736-L738 PolarHBondContact O-N 3.38Å
737	Q	85.7	Confident	89.6	Confident	46 Å²	46	79.9 Å²	79.9	22%	0.215	37%	0.368	C	S	.	.			trans	-75.7	89.5	-173.6	-159.3	-162.6	30.4	0	0	112.9	K627 L628 Q633	K627-Q737 HydrophobicContact CB-CG 3.9Å; K627-Q737 HydrophobicContact CD-CG 3.98Å; L628-Q737 WeakPolarHBondContact O-CG 3.31Å; Q633-Q737 VanDerWaalsContact NE2-CD 3.29Å
738	L	91.6	Very high	89.7	Confident	49 Å²	49	76.3 Å²	76.3	26%	0.257	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-74.1	151.5	179.7	-58.3	-179.6	0	0	0	113	K627 L628 P734 N736 H744 Y748	K627-L738 CarbonylContact C-O 3.59Å; K627-L738 VanDerWaalsContact CA-O 3.22Å; K627-L738 WeakPolarHBondContact CA-O 3.27Å; K627-L738 WeakPolarHBondContact CB-O 3.19Å; L628-L738 HydrophobicContact CD1-CB 4.5Å; L628-L738 PolarHBondContact N-O 3.06Å; P734-L738 HydrophobicContact CB-CD1 3.85Å; P734-L738 HydrophobicContact CB-CG 4.16Å; N736-L738 PolarHBondContact O-N 3.38Å; L738-H744 HydrophobicContact CD1-CB 4.5Å; L738-Y748 HydrophobicContact CD1-CD2 4.18Å; L738-Y748 HydrophobicContact CD1-CE2 3.48Å; L738-Y748 VanDerWaalsContact CD1-CE2 3.48Å
739	R	92.3	Very high	89.7	Confident	195 Å²	195	76 Å²	76	74%	0.736	35%	0.354	S	S	*	.	B	Isolated β-bridge	trans	-64.3	146.1	165	-63.9	-173.6	-173.7	-171.5	2.7	109.8	T741 H744	R739-T741 PolarHBondContact O-N 2.86Å; R739-H744 PolarHBondContact O-ND1 3.3Å
740	F	92.1	Very high	89.1	Confident	7 Å²	7	72.5 Å²	72.5	3%	0.031	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-66.8	123.4	172.3	-171.2	-82.1	0	0	0	110.4	P584 V586 V600 L608 I623 A626 L628 V745	P584-F740 HydrophobicContact CB-CE2 3.96Å; V586-F740 HydrophobicContact CG1-CD2 3.59Å; V586-F740 HydrophobicContact CG1-CE2 4.14Å; V600-F740 HydrophobicContact CB-CE2 4.35Å; V600-F740 HydrophobicContact CG1-CE2 4.34Å; V600-F740 HydrophobicContact CG1-CZ 4.2Å; V600-F740 HydrophobicContact CG2-CD2 4.35Å; V600-F740 HydrophobicContact CG2-CE2 3.75Å; V600-F740 HydrophobicContact CG2-CZ 4.37Å; L608-F740 HydrophobicContact CD1-CB 4.49Å; L608-F740 HydrophobicContact CD1-CD1 3.97Å; L608-F740 HydrophobicContact CD1-CD2 4.23Å; L608-F740 HydrophobicContact CD1-CE1 4.18Å; L608-F740 HydrophobicContact CD1-CE2 4.41Å; L608-F740 HydrophobicContact CD1-CG 3.98Å; L608-F740 HydrophobicContact CD1-CZ 4.37Å; L608-F740 HydrophobicContact CD2-CD1 3.85Å; L608-F740 HydrophobicContact CD2-CE1 3.37Å; L608-F740 HydrophobicContact CD2-CZ 3.76Å; L608-F740 HydrophobicContact CG-CE1 4.44Å; I623-F740 HydrophobicContact CD1-CD1 3.84Å; I623-F740 HydrophobicContact CD1-CE1 4.25Å; I623-F740 HydrophobicContact CG1-CD1 3.7Å; I623-F740 HydrophobicContact CG1-CE1 4.44Å; A626-F740 HydrophobicContact CB-CB 3.81Å; A626-F740 HydrophobicContact CB-CG 4.46Å; A626-F740 PolarHBondContact O-N 3.49Å; L628-F740 HydrophobicContact CD2-CD2 3.78Å; L628-F740 HydrophobicContact CD2-CE2 4.31Å; F740-V745 HydrophobicContact CD1-CG2 4.5Å; F740-V745 HydrophobicContact CD2-CG2 3.96Å; F740-V745 HydrophobicContact CE1-CG2 4.02Å; F740-V745 HydrophobicContact CE2-CG2 3.42Å; F740-V745 VanDerWaalsContact CE2-CG2 3.42Å; F740-V745 HydrophobicContact CG-CG2 4.49Å; F740-V745 HydrophobicContact CZ-CG2 3.48Å; F740-V745 VanDerWaalsContact CZ-CG2 3.48Å
741	T	90.1	Very high	88.1	Confident	48 Å²	48	71 Å²	71	29%	0.294	33%	0.33	S	S	.	.			trans	-146	153.4	172.6	74.5	0	0	0	0	109	R739 R743 H744 V745	R739-T741 PolarHBondContact O-N 2.86Å; T741-R743 PolarHBondContact O-N 3.2Å; T741-H744 PolarHBondContact O-N 2.8Å; T741-H744 VanDerWaalsContact O-N 3.1Å; T741-H744 PolarHBondContact OG1-N 3.42Å; T741-H744 PolarHBondContact OG1-ND1 3.48Å; T741-V745 WeakPolarHBondContact O-CG2 3.19Å; T741-V745 PolarHBondContact O-N 2.93Å
742	K	85.6	Confident	86.9	Confident	86 Å²	86	73.8 Å²	73.8	37%	0.374	34%	0.342	S	S	.	.	H	α-helix	trans	-56.2	-35.6	176.2	-65.2	-176.2	178.6	-178.7	0	112.4	K746	K742-K746 PolarHBondContact O-N 3.01Å
743	R	88.3	Confident	85.1	Confident	210 Å²	210	71.8 Å²	71.8	79%	0.792	34%	0.342	S	S	*	.	H	α-helix	trans	-68.4	-39.6	176.8	-165.1	175.2	-171.6	170.6	2.8	112.6	T741 K747	T741-R743 PolarHBondContact O-N 3.2Å; R743-K747 WeakPolarHBondContact O-CB 3.34Å; R743-K747 PolarHBondContact O-N 3.18Å
744	H	91.9	Very high	83.2	Confident	54 Å²	54	75.9 Å²	75.9	25%	0.25	36%	0.361	C	S	.	.	H	α-helix	trans	-71.4	-39.3	174.7	-61.8	154.9	0	0	0	112	L628 L738 R739 T741 K747 Y748	L628-H744 HydrophobicContact CD1-CB 3.64Å; L738-H744 HydrophobicContact CD1-CB 4.5Å; R739-H744 PolarHBondContact O-ND1 3.3Å; T741-H744 PolarHBondContact O-N 2.8Å; T741-H744 VanDerWaalsContact O-N 3.1Å; T741-H744 PolarHBondContact OG1-N 3.42Å; T741-H744 PolarHBondContact OG1-ND1 3.48Å; H744-K747 PolarHBondContact O-N 3.39Å; H744-Y748 VanDerWaalsContact O-CD2 3.3Å; H744-Y748 WeakPolarHBondContact O-CD2 3.44Å; H744-Y748 PolarHBondContact O-N 2.85Å
745	V	89.8	Confident	80.7	Confident	9 Å²	9	80.5 Å²	80.5	6%	0.055	39%	0.389	C	S	.	.	H	α-helix	trans	-61.3	-52.7	175.7	173.6	0	0	0	0	110.4	P584 L628 F740 T741 K747 Y748 Y749 G750	P584-V745 HydrophobicContact CB-CG2 4.47Å; P584-V745 HydrophobicContact CG-CG1 3.83Å; P584-V745 HydrophobicContact CG-CG2 4.4Å; L628-V745 HydrophobicContact CD2-CG2 4.48Å; F740-V745 HydrophobicContact CD1-CG2 4.5Å; F740-V745 HydrophobicContact CD2-CG2 3.96Å; F740-V745 HydrophobicContact CE1-CG2 4.02Å; F740-V745 HydrophobicContact CE2-CG2 3.42Å; F740-V745 VanDerWaalsContact CE2-CG2 3.42Å; F740-V745 HydrophobicContact CG-CG2 4.49Å; F740-V745 HydrophobicContact CZ-CG2 3.48Å; F740-V745 VanDerWaalsContact CZ-CG2 3.48Å; T741-V745 WeakPolarHBondContact O-CG2 3.19Å; T741-V745 PolarHBondContact O-N 2.93Å; V745-K747 PolarHBondContact O-N 3.45Å; V745-K747 VanDerWaalsContact O-N 3.12Å; V745-Y748 PolarHBondContact O-N 3.14Å; V745-Y749 CarbonylContact O-C 3.01Å; V745-Y749 VanDerWaalsContact O-CA 3.29Å; V745-Y749 WeakPolarHBondContact O-CA 3.29Å; V745-Y749 PolarHBondContact O-N 3.06Å; V745-G750 PolarHBondContact O-N 2.82Å
746	K	87.9	Confident	78.2	Confident	138 Å²	138	82 Å²	82	60%	0.6	40%	0.401	S	S	*	.	H	α-helix	trans	-58.1	-29.6	177	-172.2	175.2	179.1	-178	0	113	K742 G750	K742-K746 PolarHBondContact O-N 3.01Å; K746-G750 WeakPolarHBondContact O-CA 3.44Å
747	K	89.6	Confident	75.5	Confident	150 Å²	150	83 Å²	83	65%	0.652	42%	0.416	S	S	*	.	H	α-helix	trans	-78.1	-37.1	179.6	-178	171.7	-179.5	175.8	0	114.5	R743 H744 V745	R743-K747 WeakPolarHBondContact O-CB 3.34Å; R743-K747 PolarHBondContact O-N 3.18Å; H744-K747 PolarHBondContact O-N 3.39Å; V745-K747 PolarHBondContact O-N 3.45Å; V745-K747 VanDerWaalsContact O-N 3.12Å
748	Y	91.2	Very high	73	Confident	50 Å²	50	85.9 Å²	85.9	20%	0.196	44%	0.441	C	S	.	.	H	α-helix	trans	-112.4	-18.2	-172.2	-64.5	-70.6	0	0	0	114	F731 K732 P734 L738 H744 V745	F731-Y748 VanDerWaalsContact CE2-O 3.26Å; F731-Y748 WeakPolarHBondContact CE2-O 3.35Å; K732-Y748 WeakPolarHBondContact O-CD1 3.5Å; P734-Y748 HydrophobicContact CB-CD1 4.15Å; P734-Y748 HydrophobicContact CB-CD2 4.12Å; P734-Y748 HydrophobicContact CB-CE1 3.94Å; P734-Y748 HydrophobicContact CB-CE2 3.95Å; P734-Y748 HydrophobicContact CB-CG 4.24Å; P734-Y748 HydrophobicContact CG-CD2 4.45Å; P734-Y748 HydrophobicContact CG-CG 4.43Å; L738-Y748 HydrophobicContact CD1-CD2 4.18Å; L738-Y748 HydrophobicContact CD1-CE2 3.48Å; L738-Y748 VanDerWaalsContact CD1-CE2 3.48Å; H744-Y748 VanDerWaalsContact O-CD2 3.3Å; H744-Y748 WeakPolarHBondContact O-CD2 3.44Å; H744-Y748 PolarHBondContact O-N 2.85Å; V745-Y748 PolarHBondContact O-N 3.14Å
749	Y	90.6	Very high	70	Confident	3 Å²	3	88.9 Å²	88.9	1%	0.012	47%	0.466	C	S	.	.	S	Bend	trans	-133.5	39.3	178.6	-62.6	-94.1	0	0	0	109.5	Y245 I582 P584 I585 L628 F731 L733 V745	Y245-Y749 PolarHBondContact OH-O 3.46Å; I582-Y749 HydrophobicContact CB-CD1 4.37Å; I582-Y749 HydrophobicContact CG2-CD1 3.84Å; I582-Y749 HydrophobicContact CG2-CE1 4.04Å; P584-Y749 HydrophobicContact CB-CD1 4.39Å; P584-Y749 HydrophobicContact CB-CD2 4.24Å; P584-Y749 HydrophobicContact CB-CE2 4.48Å; P584-Y749 HydrophobicContact CB-CG 4.19Å; P584-Y749 HydrophobicContact CG-CD1 4.48Å; P584-Y749 HydrophobicContact CG-CG 4.2Å; I585-Y749 HydrophobicContact CG1-CE1 4.41Å; I585-Y749 PolarHBondContact N-OH 3.31Å; L628-Y749 HydrophobicContact CD2-CD2 4.42Å; L628-Y749 HydrophobicContact CD2-CE2 4Å; F731-Y749 AromaticContact CE2-CD1 3.79Å; F731-Y749 HydrophobicContact CE2-CD1 3.79Å; F731-Y749 AromaticContact CE2-CE1 3.76Å; F731-Y749 HydrophobicContact CE2-CE1 3.76Å; F731-Y749 HydrophobicContact CE2-CG 4.41Å; F731-Y749 HydrophobicContact CZ-CD1 4.14Å; F731-Y749 AromaticContact CZ-CE1 3.6Å; F731-Y749 HydrophobicContact CZ-CE1 3.6Å; F731-Y749 AromaticContact CZ-CZ 3.96Å; L733-Y749 WeakPolarHBondContact CD2-OH 3.26Å; V745-Y749 CarbonylContact O-C 3.01Å; V745-Y749 VanDerWaalsContact O-CA 3.29Å; V745-Y749 WeakPolarHBondContact O-CA 3.29Å; V745-Y749 PolarHBondContact O-N 3.06Å
750	G	75.3	Confident	67.2	Low	13 Å²	13	87.8 Å²	87.8	13%	0.134	47%	0.474	C	S	.	.	S	Bend	trans	-69.9	-177.8	171.3	0	0	0	0	0	111.9	V745 K746 F752	V745-G750 PolarHBondContact O-N 2.82Å; K746-G750 WeakPolarHBondContact O-CA 3.44Å; G750-F752 WeakPolarHBondContact O-CD2 3.34Å; G750-F752 WeakPolarHBondContact O-CE2 3.19Å; G750-F752 PolarHBondContact O-N 3Å
751	P	66.7	Low	64.2	Low	86 Å²	86	92.6 Å²	92.6	56%	0.558	51%	0.509	S	S	*	.			trans	-62.6	121.7	171.6	26.2	-31.6	0	0	0	109.9	Y245	Y245-P751 HydrophobicContact CD1-CB 4.11Å; Y245-P751 HydrophobicContact CD1-CG 4.31Å; Y245-P751 HydrophobicContact CE1-CB 4.4Å
752	F	64.7	Low	61.4	Low	60 Å²	60	97.3 Å²	97.3	26%	0.263	53%	0.527	S	S	.	.			trans	-108.4	112.3	166.2	-65.6	-88.9	0	0	0	106.7	I582 Y728 F731 G750	I582-F752 HydrophobicContact CD1-CB 4.49Å; I582-F752 HydrophobicContact CD1-CD2 3.6Å; I582-F752 HydrophobicContact CD1-CE2 4.11Å; I582-F752 HydrophobicContact CD1-CG 4.19Å; Y728-F752 HydrophobicContact CD1-CB 3.88Å; Y728-F752 HydrophobicContact CE1-CB 4.4Å; F731-F752 HydrophobicContact CB-CE1 4.37Å; F731-F752 HydrophobicContact CB-CZ 4.42Å; F731-F752 HydrophobicContact CD2-CD2 4.4Å; F731-F752 HydrophobicContact CD2-CE1 4.5Å; F731-F752 AromaticContact CD2-CE2 3.7Å; F731-F752 HydrophobicContact CD2-CE2 3.7Å; F731-F752 AromaticContact CD2-CZ 3.76Å; F731-F752 HydrophobicContact CD2-CZ 3.76Å; F731-F752 HydrophobicContact CE2-CE2 4.36Å; G750-F752 WeakPolarHBondContact O-CD2 3.34Å; G750-F752 WeakPolarHBondContact O-CE2 3.19Å; G750-F752 PolarHBondContact O-N 3Å
753	T	53.5	Low	58.8	Low	104 Å²	104	98.7 Å²	98.7	64%	0.638	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-69.3	146	168.9	43.2	0	0	0	0	109.6
754	E	51.5	Low	55.9	Low	96 Å²	96	94 Å²	94	45%	0.449	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-75.3	132.3	173	-64	-175.9	171.5	0	0	108.7	R727 Y728	R727-E754 IonicContact CZ-OE1 2.78Å; R727-E754 IonicContact CZ-OE2 3.33Å; R727-E754 IonicContact NE-OE1 3.75Å; R727-E754 PolarHBondContact NE-OE1 3Å; R727-E754 IonicContact NE-OE2 3.09Å; R727-E754 IonicContact NH2-OE1 3.26Å; R727-E754 PolarHBondContact NH2-OE1 3.41Å; R727-E754 IonicContact NH2-OE2 2.72Å; R727-E754 PolarHBondContact NH2-OE2 3.44Å; Y728-E754 HydrophobicContact CE1-CG 3.7Å; Y728-E754 PolarHBondContact OH-OE1 2.98Å
755	T	39.6	Very low	52.9	Low	97 Å²	97	98.9 Å²	98.9	60%	0.595	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-66.7	123.8	170.8	43.6	0	0	0	0	108.3	S757	T755-S757 PolarHBondContact O-N 2.98Å
756	P	35.5	Very low	49.9	Very low	117 Å²	117	105.4 Å²	105.4	76%	0.76	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-60.9	129.3	178.7	25.6	-33.6	0	0	0	109.5	S758	P756-S758 PolarHBondContact O-N 3.36Å
757	S	31.8	Very low	47	Very low	125 Å²	125	104 Å²	104	87%	0.874	60%	0.602	S	S	*	*			trans	-77.6	72.4	-179.8	52.3	0	0	0	0	110.8	T755 S759	T755-S757 PolarHBondContact O-N 2.98Å; S757-S759 PolarHBondContact O-N 3.12Å
758	S	33.8	Very low	44.1	Very low	106 Å²	106	105.7 Å²	105.7	74%	0.741	61%	0.61	S	S	*	*			trans	-71	112.6	170.4	56.7	0	0	0	0	110.1	P756 L760	P756-S758 PolarHBondContact O-N 3.36Å; S758-L760 PolarHBondContact O-N 3.33Å
759	S	28.5	Very low	41.3	Very low	113 Å²	113	112.7 Å²	112.7	79%	0.79	65%	0.645	S	S	*	*			trans	-63.8	123.2	167.3	39.7	0	0	0	0	110.2	S757	S757-S759 PolarHBondContact O-N 3.12Å
760	L	33.5	Very low	38.4	Very low	171 Å²	171	117.9 Å²	117.9	90%	0.895	68%	0.677	S	S	*	*			trans	-170.4	94.5	159.5	-109.9	159.2	0	0	0	112.4	S758	S758-L760 PolarHBondContact O-N 3.33Å
761	S	28.8	Very low	36.4	Very low	108 Å²	108	124.8 Å²	124.8	76%	0.755	71%	0.71	S	S	*	*			trans	-119.3	145.5	146.7	55	0	0	0	0	105.8
762	E	32.2	Very low	34.5	Very low	148 Å²	148	125.2 Å²	125.2	69%	0.692	72%	0.716	S	S	*	*			cis	-139.3	164.3	26.4	-64.1	178.2	112.6	0	0	114.9
763	T	29.7	Very low	32.8	Very low	114 Å²	114	128.1 Å²	128.1	70%	0.699	74%	0.738	S	S	*	*			trans	29.4	104.4	148.9	55.8	0	0	0	0	121.3
764	T	27.2	Very low	31.7	Very low	113 Å²	113	130.4 Å²	130.4	69%	0.693	75%	0.745	S	S	*	*				33.3	115.9	119	58.5	0	0	0	0	119.5
765	N	29.5	Very low	30.6	Very low	155 Å²	155	131.9 Å²	131.9	83%	0.829	76%	0.756	S	S	*	*				-163.8	162.1	95.2	-102	-48.3	0	0	0	115.2
766	L	27.2	Very low	30.2	Very low	147 Å²	147	134.6 Å²	134.6	77%	0.77	76%	0.764	S	S	*	*			trans	-72.1	163.5	178.7	-86.6	64.5	0	0	0	111.5
767	T	27.1	Very low	30	Very low	107 Å²	107	134.8 Å²	134.8	66%	0.656	76%	0.763	S	S	*	*			cis	-162.4	165.3	13.9	-4.9	0	0	0	0	112.4
768	K	28.8	Very low	29.9	Very low	187 Å²	187	139.9 Å²	139.9	81%	0.813	76%	0.763	S	S	*	*			trans	57.1	118.9	148.1	-71.2	166.7	-177.9	177.3	0	119.3
769	E	31.8	Very low	29.7	Very low	197 Å²	197	140.2 Å²	140.2	92%	0.921	76%	0.76	S	S	*	*				-145.1	178.1	108.8	-130.4	168.4	-144.6	0	0	110.5
770	T	30.2	Very low	29.7	Very low	112 Å²	112	139.8 Å²	139.8	69%	0.687	75%	0.753	S	S	*	*			trans	-122.9	145.4	-159.3	50.9	0	0	0	0	114
771	N	32	Very low	29.4	Very low	157 Å²	157	138.2 Å²	138.2	84%	0.84	75%	0.745	S	S	*	*				-176.3	162.5	124.7	-90.3	-29.1	0	0	0	113.8
772	S	27.2	Very low	29.4	Very low	96 Å²	96	136.5 Å²	136.5	67%	0.671	74%	0.737	S	S	*	*			trans	-23.8	147.7	168.7	54.7	0	0	0	0	117.3
773	V	29.9	Very low	29.2	Very low	120 Å²	120	135.2 Å²	135.2	73%	0.727	74%	0.74	S	S	*	*				-149.7	121.8	51.5	166	0	0	0	0	111.8
774	I	29.9	Very low	29	Very low	153 Å²	153	138.5 Å²	138.5	79%	0.785	75%	0.747	S	S	*	*				33.4	126	125	-53.7	162.8	0	0	0	117
775	D	28.7	Very low	29	Very low	127 Å²	127	139.4 Å²	139.4	68%	0.679	75%	0.753	S	S	*	*			cis	-162.8	-159.7	-15.5	-152.5	21.7	0	0	0	105.7
776	M	30.5	Very low	28.7	Very low	154 Å²	154	137.9 Å²	137.9	76%	0.759	75%	0.749	S	S	*	*			cis	-148	154.2	3.6	-172.3	172.3	-70.2	0	0	109.6
777	T	31.2	Very low	28.6	Very low	120 Å²	120	136.8 Å²	136.8	74%	0.736	75%	0.752	S	S	*	*			trans	-147.1	172.7	-179.9	47.4	0	0	0	0	112.2
778	R	29.8	Very low	28.4	Very low	233 Å²	233	138.7 Å²	138.7	88%	0.879	76%	0.758	S	S	*	*			trans	102.2	153.1	179.9	-59.8	165.9	159.7	168.7	-5.9	113.2
779	T	30.3	Very low	28.3	Very low	113 Å²	113	136 Å²	136	69%	0.693	76%	0.758	S	S	*	*			cis	-153.7	125.7	17.8	-19.5	0	0	0	0	113.4
780	V	27.9	Very low	28	Very low	104 Å²	104	132.2 Å²	132.2	63%	0.63	75%	0.748	S	S	*	*				58.6	131.9	127.3	-178.8	0	0	0	0	124.1
781	N	27.4	Very low	27.8	Very low	137 Å²	137	132.3 Å²	132.3	73%	0.733	75%	0.754	S	S	*	*			trans	-5	143.1	151.9	-43.3	-20.2	0	0	0	121.5
782	A	29.3	Very low	27.6	Very low	72 Å²	72	129.6 Å²	129.6	60%	0.595	75%	0.747	S	S	*	*				163.2	121.6	102.9	0	0	0	0	0	117.2
783	T	27.3	Very low	27.4	Very low	121 Å²	121	130.6 Å²	130.6	74%	0.742	75%	0.754	S	S	*	*			trans	31.6	132.7	144.5	42.6	0	0	0	0	125.9
784	Q	26.3	Very low	27.4	Very low	183 Å²	183	131.2 Å²	131.2	86%	0.855	75%	0.752	S	S	*	*			trans	71.1	153.2	150.5	-61.1	174.7	8.3	0	0	116.2
785	V	26	Very low	27.1	Very low	133 Å²	133	131.6 Å²	131.6	81%	0.806	76%	0.755	S	S	*	*			cis	-136.1	163.4	25.3	172.1	0	0	0	0	112.4
786	T	24.6	Very low	27.1	Very low	123 Å²	123	131 Å²	131	76%	0.755	76%	0.756	S	S	*	*			trans	-74.9	151.4	177.1	50.1	0	0	0	0	116.3
787	C	23.8	Very low	26.8	Very low	123 Å²	123	130 Å²	130	83%	0.831	76%	0.759	S	S	*	*			trans	-158.2	158.2	130	54.4	0	0	0	0	114
788	N	24.1	Very low	26.6	Very low	147 Å²	147	129.9 Å²	129.9	79%	0.786	76%	0.759	S	S	*	*			trans	-75.1	170.2	-175.7	-46.2	-52.6	0	0	0	111.2
789	T	26.2	Very low	26.4	Very low	130 Å²	130	124.8 Å²	124.8	80%	0.798	75%	0.753	S	S	*	*				-159.3	133.5	62.3	41.5	0	0	0	0	116.7
790	T	24.5	Very low	26.4	Very low	118 Å²	118	125.6 Å²	125.6	72%	0.724	76%	0.758	S	S	*	*			trans	2.8	124.8	136.2	44.9	0	0	0	0	121.4
791	S	26.8	Very low	26.3	Very low	115 Å²	115	128.7 Å²	128.7	80%	0.804	77%	0.771	S	S	*	*				39.6	112.4	115.8	-50.1	0	0	0	0	121.4
792	S	27.1	Very low	26.4	Very low	100 Å²	100	126.6 Å²	126.6	70%	0.699	77%	0.773	S	S	*	*			trans	-149.2	127.1	139.1	51	0	0	0	0	107.5
793	S	24.5	Very low	26.1	Very low	116 Å²	116	128.9 Å²	128.9	81%	0.811	79%	0.785	S	S	*	*			cis	57.1	71.1	37.7	83.2	0	0	0	0	113.7
794	I	28.2	Very low	26.2	Very low	133 Å²	133	129.7 Å²	129.7	68%	0.682	79%	0.789	S	S	*	*			trans	-103.3	101.5	165.8	-60.8	179.7	0	0	0	108.6	T796	I794-T796 HydrophobicContact CG2-CG2 3.83Å
795	N	24.5	Very low	26.1	Very low	161 Å²	161	126.5 Å²	126.5	86%	0.861	78%	0.783	S	S	*	*			trans	-86.4	111.4	157	-82.1	-20.7	0	0	0	107.8
796	T	27.8	Very low	26.2	Very low	114 Å²	114	127.7 Å²	127.7	70%	0.699	78%	0.784	S	S	*	*			trans	-115.1	73.2	169.6	28.4	0	0	0	0	110.9	I794 T798	I794-T796 HydrophobicContact CG2-CG2 3.83Å; T796-T798 PolarHBondContact O-N 3.27Å
797	T	24.4	Very low	26.2	Very low	135 Å²	135	126.6 Å²	126.6	83%	0.828	78%	0.782	S	S	*	*			trans	-65.5	96.8	157.7	44.1	0	0	0	0	109.5
798	T	28.6	Very low	26.4	Very low	117 Å²	117	129.8 Å²	129.8	72%	0.718	79%	0.785	S	S	*	*			trans	-110.5	101.6	169.7	-49.6	0	0	0	0	109.5	T796	T796-T798 PolarHBondContact O-N 3.27Å
799	T	25.6	Very low	26.5	Very low	125 Å²	125	131.8 Å²	131.8	77%	0.767	79%	0.786	S	S	*	*			trans	-72.1	124.7	177.5	48.8	0	0	0	0	112
800	T	29	Very low	26.6	Very low	130 Å²	130	134.9 Å²	134.9	80%	0.798	79%	0.794	S	S	*	*			trans	-131.8	116.8	157.4	41.6	0	0	0	0	110.3
801	N	25.4	Very low	26.6	Very low	169 Å²	169	136 Å²	136	90%	0.904	80%	0.795	S	S	*	*			trans	-79.3	125.1	175.2	-68.2	-54.7	0	0	0	109.9
802	A	29.9	Very low	26.7	Very low	94 Å²	94	138.5 Å²	138.5	78%	0.777	80%	0.8	S	S	*	*			trans	-143.6	80	171	0	0	0	0	0	111.1	V804	A802-V804 PolarHBondContact O-N 3.05Å
803	S	23.8	Very low	26.7	Very low	120 Å²	120	138.2 Å²	138.2	84%	0.839	80%	0.798	S	S	*	*			trans	-78.3	111.5	173.8	55.7	0	0	0	0	111.1
804	V	28.8	Very low	26.9	Very low	138 Å²	138	139.5 Å²	139.5	84%	0.836	80%	0.8	S	S	*	*			trans	-129.3	122	165.6	-177.6	0	0	0	0	109.6	A802	A802-V804 PolarHBondContact O-N 3.05Å
805	T	24.1	Very low	26.9	Very low	116 Å²	116	141.4 Å²	141.4	71%	0.712	80%	0.804	S	S	*	*			trans	-96.4	129.8	174.9	51.6	0	0	0	0	110.6
806	N	28.5	Very low	27.1	Very low	157 Å²	157	141.7 Å²	141.7	84%	0.84	80%	0.804	S	S	*	*			trans	-169.8	131.2	139.5	-87.3	-28.4	0	0	0	107.7
807	S	23.8	Very low	27.2	Very low	101 Å²	101	142.7 Å²	142.7	71%	0.706	81%	0.806	S	S	*	*			cis	94.8	59	33.1	-62.1	0	0	0	0	115.1
808	E	28.6	Very low	27.2	Very low	190 Å²	190	148.4 Å²	148.4	89%	0.888	81%	0.812	S	S	*	*			trans	-157.5	110.9	153.6	-109.5	157.1	-144.9	0	0	107.6
809	K	26.2	Very low	27.2	Very low	189 Å²	189	150.3 Å²	150.3	82%	0.822	82%	0.816	S	S	*	*				58.5	92	66.2	-82.4	-166.3	169.4	-173.7	0	115.7
810	M	28	Very low	27.3	Very low	195 Å²	195	149.4 Å²	149.4	96%	0.961	81%	0.812	S	S	*	*				-137.8	133.2	123	-83.2	-149	171.3	0	0	110.9
811	D	25.6	Very low	27.2	Very low	140 Å²	140	148.8 Å²	148.8	75%	0.749	81%	0.814	S	S	*	*			trans	-79.5	144.5	165.6	-77.1	-77.4	0	0	0	109.8
812	N	28.6	Very low	27.3	Very low	168 Å²	168	145.4 Å²	145.4	90%	0.898	80%	0.803	S	S	*	*				-158.9	130.3	127.7	-106.6	-43.4	0	0	0	111.6
813	S	26.3	Very low	27.3	Very low	95 Å²	95	148.5 Å²	148.5	66%	0.664	81%	0.807	S	S	*	*			trans	-120.2	117.3	-177.1	-172.5	0	0	0	0	110.3
814	V	29.4	Very low	27.3	Very low	142 Å²	142	151.1 Å²	151.1	86%	0.861	81%	0.811	S	S	*	*			trans	-106.3	99.5	168.6	-177.9	0	0	0	0	108.9
815	K	27.5	Very low	27.3	Very low	173 Å²	173	149.1 Å²	149.1	75%	0.752	81%	0.809	S	S	*	*			trans	-86.3	133.7	162.5	-66.4	172.9	-180	170.8	0	108.3
816	L	29.1	Very low	27.5	Very low	167 Å²	167	154.3 Å²	154.3	87%	0.874	82%	0.817	S	S	*	*			trans	-132.2	128.4	158.6	-144.4	72	0	0	0	112
817	N	29.3	Very low	27.5	Very low	136 Å²	136	155.6 Å²	155.6	73%	0.727	81%	0.811	S	S	*	*			trans	-72.7	153.9	-158.4	-57.3	-51.4	0	0	0	115
818	R	24.9	Very low	27.8	Very low	254 Å²	254	154.7 Å²	154.7	96%	0.958	80%	0.795	S	S	*	*			trans	-68.9	136.4	153.4	-73.6	175.7	168.4	173.6	-5.1	110.2
819	I	28.3	Very low	28.1	Very low	157 Å²	157	149.9 Å²	149.9	81%	0.805	78%	0.78	S	S	*	*			trans	-137.9	144.5	155.2	-62.4	-173.7	0	0	0	107.5
820	P	28.1	Very low	28.5	Very low	106 Å²	106	144.9 Å²	144.9	69%	0.688	77%	0.765	S	S	*	*			trans	-115.3	168.7	-162.4	41.6	-32.7	0	0	0	116.2
821	S	27.2	Very low	29	Very low	118 Å²	118	139.2 Å²	139.2	83%	0.825	74%	0.738	S	S	*	*			trans	65.3	157.5	165.6	67.9	0	0	0	0	116.5
822	S	27.2	Very low	29.6	Very low	98 Å²	98	135 Å²	135	69%	0.685	72%	0.718	S	S	*	*			cis	-152.2	146.7	-5.9	42.1	0	0	0	0	110.2
823	N	29.1	Very low	29.7	Very low	159 Å²	159	132 Å²	132	85%	0.85	69%	0.694	S	S	*	*			trans	170.5	145.9	137.3	-88.3	-5.2	0	0	0	110.3
824	D	25.4	Very low	30	Very low	175 Å²	175	129 Å²	129	94%	0.936	67%	0.672	S	S	*	*			trans	-87.2	127.1	-172.1	-68.9	-71.1	0	0	0	113.6
825	A	29.2	Very low	30.1	Very low	96 Å²	96	123.3 Å²	123.3	79%	0.793	64%	0.639	S	S	*	*			trans	-150.3	144.8	162.5	0	0	0	0	0	109.2	R827	A825-R827 PolarHBondContact O-N 2.69Å; A825-R827 VanDerWaalsContact O-N 3.14Å
826	Y	26.9	Very low	30.3	Very low	224 Å²	224	116.5 Å²	116.5	88%	0.878	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-51.5	117.6	-174.7	-100.3	-104.2	0	0	0	112.4	E828	Y826-E828 PolarHBondContact O-N 2.73Å
827	R	29.3	Very low	30.5	Very low	185 Å²	185	112 Å²	112	70%	0.698	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-80.1	123.2	-179.9	-156.9	-178.5	-164	-157	7.4	110.6	A825	A825-R827 PolarHBondContact O-N 2.69Å; A825-R827 VanDerWaalsContact O-N 3.14Å
828	E	30.4	Very low	30.6	Very low	82 Å²	82	107.3 Å²	107.3	38%	0.383	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-57.1	145.4	-177.6	-161.3	168.2	-113.4	0	0	113.5	K318 Y826 T832	K318-E828 IonicContact NZ-OE1 3.25Å; K318-E828 PolarHBondContact NZ-OE1 3.2Å; Y826-E828 PolarHBondContact O-N 2.73Å; E828-T832 HydrophobicContact CG-CG2 4.29Å; E828-T832 WeakPolarHBondContact OE2-CG2 3.3Å
829	P	35.1	Very low	31.1	Very low	88 Å²	88	99 Å²	99	57%	0.571	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-54	144.3	179	-27.8	35.9	0	0	0	113.5	L831 T832	P829-L831 PolarHBondContact O-N 2.73Å; P829-T832 PolarHBondContact O-N 3.07Å
830	V	34.5	Very low	31.2	Very low	85 Å²	85	97 Å²	97	52%	0.515	53%	0.532	S	S	.	.	H	α-helix	trans	-54.4	-33	-175.4	177.7	0	0	0	0	112.3	T832 R833 V834	V830-T832 PolarHBondContact O-N 3.18Å; V830-R833 PolarHBondContact O-N 3.41Å; V830-R833 VanDerWaalsContact O-N 3.09Å; V830-V834 HydrophobicContact CG1-CG2 4.03Å; V830-V834 PolarHBondContact O-N 3.37Å
831	L	37.7	Very low	31.2	Very low	75 Å²	75	96 Å²	96	39%	0.393	53%	0.528	S	S	.	.	H	α-helix	trans	-69.1	-24.6	-179.1	-80.2	123.3	0	0	0	115.1	P829 R833 A835	P829-L831 PolarHBondContact O-N 2.73Å; L831-R833 VanDerWaalsContact C-N 3.28Å; L831-R833 PolarHBondContact O-N 2.71Å; L831-A835 WeakPolarHBondContact O-CB 3.39Å; L831-A835 PolarHBondContact O-N 3.31Å
832	T	37.8	Very low	31.5	Very low	52 Å²	52	95.2 Å²	95.2	32%	0.319	52%	0.519	S	S	.	.	H	α-helix	trans	-66.4	-36.3	169.5	-48.1	0	0	0	0	110.4	E828 P829 V830 A836	E828-T832 HydrophobicContact CG-CG2 4.29Å; E828-T832 WeakPolarHBondContact OE2-CG2 3.3Å; P829-T832 PolarHBondContact O-N 3.07Å; V830-T832 PolarHBondContact O-N 3.18Å; T832-A836 WeakPolarHBondContact O-CB 3.41Å; T832-A836 PolarHBondContact O-N 3.08Å
833	R	30.7	Very low	31.4	Very low	106 Å²	106	96.7 Å²	96.7	40%	0.4	52%	0.524	S	S	.	.	H	α-helix	trans	-76.3	-39.9	177.3	-161.3	175.7	-59.7	122.2	15.2	112.8	V830 L831 A835 A836 S837	V830-R833 PolarHBondContact O-N 3.41Å; V830-R833 VanDerWaalsContact O-N 3.09Å; L831-R833 VanDerWaalsContact C-N 3.28Å; L831-R833 PolarHBondContact O-N 2.71Å; R833-A835 VanDerWaalsContact C-N 3.35Å; R833-A836 WeakPolarHBondContact O-CB 3.46Å; R833-A836 PolarHBondContact O-N 2.91Å; R833-S837 PolarHBondContact O-N 2.81Å; R833-S837 PolarHBondContact O-OG 3.34Å
834	V	33.5	Very low	31.3	Very low	32 Å²	32	95.8 Å²	95.8	19%	0.194	52%	0.518	C	S	.	.	H	α-helix	trans	-63.3	-42.5	172.6	171.9	0	0	0	0	110.5	V830 A836 S837 L838 I1147	V830-V834 HydrophobicContact CG1-CG2 4.03Å; V830-V834 PolarHBondContact O-N 3.37Å; V834-A836 VanDerWaalsContact C-N 3.3Å; V834-A836 PolarHBondContact O-N 3Å; V834-S837 PolarHBondContact O-N 3.32Å; V834-L838 HydrophobicContact CG1-CD1 4.27Å; V834-L838 WeakPolarHBondContact O-CB 3.37Å; V834-L838 PolarHBondContact O-N 3.36Å; V834-I1147 HydrophobicContact CG1-CD1 3.84Å; V834-I1147 HydrophobicContact CG2-CD1 3.98Å; V834-I1147 HydrophobicContact CG2-CG1 4.19Å
835	A	31	Very low	31.4	Very low	21 Å²	21	92.2 Å²	92.2	17%	0.174	51%	0.506	C	S	.	.	H	α-helix	trans	-64.7	-32.9	173.6	0	0	0	0	0	112.2	L831 R833 R839	L831-A835 WeakPolarHBondContact O-CB 3.39Å; L831-A835 PolarHBondContact O-N 3.31Å; R833-A835 VanDerWaalsContact C-N 3.35Å; A835-R839 WeakPolarHBondContact O-CG 3.45Å; A835-R839 PolarHBondContact O-NE 3.43Å
836	A	31.7	Very low	31.4	Very low	30 Å²	30	92.1 Å²	92.1	25%	0.248	50%	0.5	C	S	.	.	H	α-helix	trans	-68	-40.7	172.4	0	0	0	0	0	113.2	T832 R833 V834 N840	T832-A836 WeakPolarHBondContact O-CB 3.41Å; T832-A836 PolarHBondContact O-N 3.08Å; R833-A836 WeakPolarHBondContact O-CB 3.46Å; R833-A836 PolarHBondContact O-N 2.91Å; V834-A836 VanDerWaalsContact C-N 3.3Å; V834-A836 PolarHBondContact O-N 3Å; A836-N840 WeakPolarHBondContact O-CB 3.34Å; A836-N840 PolarHBondContact O-N 3.17Å
837	S	32.8	Very low	31.5	Very low	72 Å²	72	90.6 Å²	90.6	50%	0.503	50%	0.501	S	S	.	.	H	α-helix	trans	-65.1	-46.6	175.8	-67.8	0	0	0	0	112.5	R833 V834 R839 N840	R833-S837 PolarHBondContact O-N 2.81Å; R833-S837 PolarHBondContact O-OG 3.34Å; V834-S837 PolarHBondContact O-N 3.32Å; S837-R839 PolarHBondContact O-N 3.15Å; S837-N840 PolarHBondContact O-N 3.23Å
838	L	32.5	Very low	31.6	Very low	39 Å²	39	87.2 Å²	87.2	20%	0.204	51%	0.506	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	9.2	-177.6	-105.6	167.3	0	0	0	116	R201 V834 E1143	R201-L838 PolarHBondContact NH1-O 2.77Å; V834-L838 HydrophobicContact CG1-CD1 4.27Å; V834-L838 WeakPolarHBondContact O-CB 3.37Å; V834-L838 PolarHBondContact O-N 3.36Å; L838-E1143 WeakPolarHBondContact CD2-OE2 3.49Å; L838-E1143 WeakPolarHBondContact CG-OE1 3.42Å; L838-E1143 WeakPolarHBondContact CG-OE2 3.4Å
839	R	34	Very low	31.4	Very low	80 Å²	80	89.2 Å²	89.2	30%	0.302	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.1	-16.8	-171.3	-61.9	-170.9	-74.5	-169	7.2	113.8	C336 L337 C338 A835 S837	C336-R839 VanDerWaalsContact O-CZ 3.28Å; C336-R839 PolarHBondContact O-NH1 3Å; C336-R839 PolarHBondContact O-NH2 3.03Å; L337-R839 VanDerWaalsContact CA-NH1 3.31Å; L337-R839 WeakPolarHBondContact O-CD 3.25Å; L337-R839 VanDerWaalsContact O-CZ 3.28Å; L337-R839 PolarHBondContact O-NE 2.86Å; L337-R839 PolarHBondContact O-NH1 3.25Å; C338-R839 HydrophobicContact CB-CB 3.51Å; C338-R839 HydrophobicContact CB-CG 4.42Å; C338-R839 WeakPolarHBondContact O-CB 3.19Å; C338-R839 PolarHBondContact SG-NE 3.48Å; C338-R839 PolarHBondContact SG-NH2 3.49Å; A835-R839 WeakPolarHBondContact O-CG 3.45Å; A835-R839 PolarHBondContact O-NE 3.43Å; S837-R839 PolarHBondContact O-N 3.15Å
840	N	31.3	Very low	31.2	Very low	115 Å²	115	90.7 Å²	90.7	62%	0.615	54%	0.541	S	S	*	.			trans	-107.8	32	169.7	-67.7	7	0	0	0	112.1	C338 A836 S837	C338-N840 WeakPolarHBondContact CB-OD1 3.12Å; A836-N840 WeakPolarHBondContact O-CB 3.34Å; A836-N840 PolarHBondContact O-N 3.17Å; S837-N840 PolarHBondContact O-N 3.23Å
841	S	29.1	Very low	30.8	Very low	85 Å²	85	92.9 Å²	92.9	59%	0.594	56%	0.555	S	S	*	*			trans	-70.9	138.6	170.5	-163.2	0	0	0	0	109.4
842	P	31.6	Very low	30.4	Very low	100 Å²	100	97.5 Å²	97.5	65%	0.649	58%	0.579	S	S	*	*			trans	-72.9	135.6	-152.9	-21.1	34.2	0	0	0	114.6	I844	P842-I844 HydrophobicContact CB-CG1 4.34Å; P842-I844 PolarHBondContact O-N 2.81Å; P842-I844 VanDerWaalsContact O-N 3.15Å
843	V	26.7	Very low	29.8	Very low	130 Å²	130	103.2 Å²	103.2	79%	0.788	60%	0.602	S	S	*	*			trans	-64.6	107.9	147.2	178	0	0	0	0	106.3	S845	V843-S845 PolarHBondContact O-N 3.14Å
844	I	26.7	Very low	29.7	Very low	139 Å²	139	104.7 Å²	104.7	71%	0.713	62%	0.623	S	S	*	*			trans	-78	84	174	-59.3	-179.5	0	0	0	107.4	P842 S846	P842-I844 HydrophobicContact CB-CG1 4.34Å; P842-I844 PolarHBondContact O-N 2.81Å; P842-I844 VanDerWaalsContact O-N 3.15Å; I844-S846 PolarHBondContact O-N 3.23Å
845	S	26.8	Very low	29.4	Very low	100 Å²	100	107.7 Å²	107.7	70%	0.699	65%	0.645	S	S	*	*			trans	-72	70	166.4	-57.5	0	0	0	0	109.5	V843 E847	V843-S845 PolarHBondContact O-N 3.14Å; S845-E847 PolarHBondContact O-N 3.04Å
846	S	28.6	Very low	29.1	Very low	95 Å²	95	112.6 Å²	112.6	66%	0.664	68%	0.677	S	S	*	*			trans	-77.9	74.1	174.3	55.8	0	0	0	0	110.4	I844 S848	I844-S846 PolarHBondContact O-N 3.23Å; S846-S848 PolarHBondContact O-N 2.84Å; S846-S848 VanDerWaalsContact O-N 3.13Å
847	E	29.2	Very low	29.1	Very low	192 Å²	192	116.2 Å²	116.2	90%	0.897	70%	0.698	S	S	*	*			trans	-61.1	111.2	159.2	-69.9	-172.6	148.5	0	0	107.8	S845	S845-E847 PolarHBondContact O-N 3.04Å
848	S	31.6	Very low	29	Very low	114 Å²	114	118.7 Å²	118.7	80%	0.797	71%	0.712	S	S	*	*			trans	-76.8	134.4	-175.8	45.2	0	0	0	0	111.2	S846 S850	S846-S848 PolarHBondContact O-N 2.84Å; S846-S848 VanDerWaalsContact O-N 3.13Å; S848-S850 PolarHBondContact O-N 3.33Å
849	S	27.4	Very low	28.8	Very low	124 Å²	124	122.7 Å²	122.7	87%	0.867	74%	0.738	S	S	*	*			trans	-56.7	126.5	179.8	-54.9	0	0	0	0	112.4
850	S	30.9	Very low	28.4	Very low	119 Å²	119	126 Å²	126	83%	0.832	76%	0.76	S	S	*	*			trans	-123.3	135.3	152.4	58.3	0	0	0	0	109.5	S848	S848-S850 PolarHBondContact O-N 3.33Å
851	V	26.4	Very low	28.2	Very low	131 Å²	131	125.7 Å²	125.7	79%	0.794	77%	0.767	S	S	*	*			trans	-94.5	119	-172.3	174.4	0	0	0	0	109.9
852	L	28.7	Very low	28.1	Very low	171 Å²	171	126.8 Å²	126.8	90%	0.895	77%	0.77	S	S	*	*			trans	-140.5	144.2	149	-92.5	-178.7	0	0	0	111.1
853	Q	25	Very low	28	Very low	172 Å²	172	128.5 Å²	128.5	80%	0.804	77%	0.773	S	S	*	*			trans	-93.1	131.8	-173.5	-55.7	158.8	-63.3	0	0	110.5
854	T	28	Very low	28	Very low	137 Å²	137	128 Å²	128	84%	0.84	77%	0.771	S	S	*	*			trans	-168.4	116.3	137.2	21.6	0	0	0	0	113.3
855	S	27.9	Very low	28.1	Very low	96 Å²	96	130.1 Å²	130.1	67%	0.671	78%	0.78	S	S	*	*			trans	15.6	118.8	144.8	57.2	0	0	0	0	122.4
856	C	25.1	Very low	28.1	Very low	123 Å²	123	134.5 Å²	134.5	83%	0.831	79%	0.786	S	S	*	*				55.7	167.6	122	-58.4	0	0	0	0	122
857	P	30.9	Very low	28.2	Very low	107 Å²	107	141.8 Å²	141.8	70%	0.695	80%	0.799	S	S	*	*			cis	-127.6	176.5	-30.7	34.5	-16.7	0	0	0	112.9
858	P	30.7	Very low	28.1	Very low	123 Å²	123	140.5 Å²	140.5	80%	0.799	79%	0.791	S	S	*	*			trans	-84.7	137.3	178.8	32.7	-35.2	0	0	0	115.2
859	V	29	Very low	28.1	Very low	124 Å²	124	141.9 Å²	141.9	75%	0.752	78%	0.784	S	S	*	*			trans	-146.9	108.9	177	-177.6	0	0	0	0	107.6
860	I	25.5	Very low	28.1	Very low	149 Å²	149	141.3 Å²	141.3	76%	0.764	77%	0.772	S	S	*	*				70.8	103.3	79.8	-60.8	169.8	0	0	0	115
861	S	26.1	Very low	28	Very low	108 Å²	108	141.7 Å²	141.7	76%	0.755	76%	0.764	S	S	*	*			trans	61.7	172.5	149.3	-132.9	0	0	0	0	117.9
862	V	26.4	Very low	28.2	Very low	108 Å²	108	141.8 Å²	141.8	66%	0.655	77%	0.765	S	S	*	*			cis	-139.6	162	-3.6	-144.7	0	0	0	0	106.7
863	N	29.9	Very low	28.1	Very low	136 Å²	136	138.2 Å²	138.2	73%	0.727	75%	0.754	S	S	*	*				-178.1	136.2	84.2	-102.9	-48.6	0	0	0	112.7
864	T	27.5	Very low	28.5	Very low	119 Å²	119	137.9 Å²	137.9	73%	0.73	76%	0.758	S	S	*	*			trans	-97.9	148.8	159	55.9	0	0	0	0	110.2
865	M	29.2	Very low	28.4	Very low	185 Å²	185	136.5 Å²	136.5	91%	0.911	75%	0.753	S	S	*	*			trans	-130.7	133.2	158.2	-76.8	-155.9	175.4	0	0	112.5
866	K	26.6	Very low	28.6	Very low	191 Å²	191	135.6 Å²	135.6	83%	0.83	75%	0.752	S	S	*	*			trans	-109.6	132.5	176.4	-67.7	175.7	177.1	174.8	0	110.7
867	R	30.8	Very low	28.8	Very low	248 Å²	248	135.2 Å²	135.2	94%	0.936	75%	0.75	S	S	*	*			trans	-147.4	113.6	150.3	-67.8	-174.8	176.1	171.5	-2.4	105
868	K	25.8	Very low	28.9	Very low	166 Å²	166	134.7 Å²	134.7	72%	0.722	75%	0.749	S	S	*	*			cis	79	125.9	24.7	-149.2	-160.2	179.9	-140.8	0	113.9
869	H	31.3	Very low	28.9	Very low	142 Å²	142	134.3 Å²	134.3	66%	0.657	75%	0.749	S	S	*	*			trans	73.7	139.5	-175.6	-60.7	-78.9	0	0	0	114.1
870	N	29.1	Very low	29.2	Very low	113 Å²	113	134.6 Å²	134.6	60%	0.604	75%	0.754	S	S	*	*			cis	-148.1	154.3	5.5	-136	39.9	0	0	0	114.1
871	D	27.6	Very low	29.4	Very low	126 Å²	126	131.5 Å²	131.5	67%	0.674	75%	0.751	S	S	*	*			trans	12.1	137	150.9	-41.4	-26.8	0	0	0	118.8
872	T	31.5	Very low	29.5	Very low	134 Å²	134	132.8 Å²	132.8	82%	0.822	75%	0.754	S	S	*	*				-161	154.2	60.9	-58.8	0	0	0	0	112.7
873	S	27	Very low	29.5	Very low	95 Å²	95	132.6 Å²	132.6	66%	0.664	75%	0.753	S	S	*	*			trans	-71.2	156.1	178.7	56.1	0	0	0	0	115.7
874	L	31.6	Very low	29.4	Very low	166 Å²	166	133.3 Å²	133.3	87%	0.869	76%	0.756	S	S	*	*				-163.8	156.7	112.8	-103.6	163.1	0	0	0	113.2
875	S	26.6	Very low	29.5	Very low	107 Å²	107	135.8 Å²	135.8	75%	0.748	76%	0.759	S	S	*	*			trans	-94.6	-178.6	-174.3	56	0	0	0	0	112.1
876	A	32.8	Very low	29.3	Very low	77 Å²	77	135 Å²	135	64%	0.636	76%	0.758	S	S	*	*			cis	-163.3	172.5	19.4	0	0	0	0	0	113.3
877	S	29.7	Very low	29.4	Very low	115 Å²	115	134.3 Å²	134.3	80%	0.804	76%	0.758	S	S	*	*			trans	61.8	146.7	153.9	44.3	0	0	0	0	119.5
878	S	32.7	Very low	29.2	Very low	97 Å²	97	128 Å²	128	68%	0.678	75%	0.752	S	S	*	*			cis	-164.4	124.3	-5.2	44	0	0	0	0	108.9
879	S	30.5	Very low	29.4	Very low	114 Å²	114	127.3 Å²	127.3	80%	0.797	76%	0.761	S	S	*	*				81.4	152.8	94.2	-53.2	0	0	0	0	115.8
880	P	35.9	Very low	29.2	Very low	131 Å²	131	125.1 Å²	125.1	85%	0.851	76%	0.761	S	S	*	*			cis	-138.4	-169.5	-41	40.4	-23	0	0	0	113.9
881	A	29.1	Very low	29.3	Very low	84 Å²	84	125.4 Å²	125.4	69%	0.694	77%	0.772	S	S	*	*			trans	-107.6	176.8	-175.5	0	0	0	0	0	115.1
882	V	28.4	Very low	29.5	Very low	134 Å²	134	127.1 Å²	127.1	81%	0.812	78%	0.776	S	S	*	*			trans	179.7	127.2	152	136.3	0	0	0	0	107.7
883	T	26.3	Very low	29.7	Very low	105 Å²	105	128.2 Å²	128.2	64%	0.644	78%	0.777	S	S	*	*			cis	95.2	144.7	-6.4	-33.5	0	0	0	0	117.9
884	L	28.1	Very low	29.9	Very low	151 Å²	151	129.3 Å²	129.3	79%	0.791	77%	0.774	S	S	*	*			trans	86.8	158.4	173.6	-46.4	176.4	0	0	0	116.4
885	E	28.1	Very low	30	Very low	170 Å²	170	131.9 Å²	131.9	79%	0.794	77%	0.772	S	S	*	*			cis	-131.2	167.6	5.9	-80.4	-173.4	139.9	0	0	113.6
886	L	25	Very low	30.4	Very low	169 Å²	169	129.5 Å²	129.5	89%	0.885	76%	0.759	S	S	*	*			trans	-150.4	110	172.1	-151.4	168.1	0	0	0	108.9
887	E	28.8	Very low	30.3	Very low	177 Å²	177	131 Å²	131	83%	0.827	76%	0.76	S	S	*	*			trans	-88	161.9	-174.1	-71.7	-165.2	120.9	0	0	114.4
888	S	27.9	Very low	30.4	Very low	116 Å²	116	129.5 Å²	129.5	81%	0.811	75%	0.746	S	S	*	*			trans	-146.1	155.6	-178.1	62.2	0	0	0	0	112.2
889	V	30.4	Very low	30.4	Very low	150 Å²	150	131.9 Å²	131.9	91%	0.909	75%	0.751	S	S	*	*			trans	-139.6	139.4	179.5	-175.6	0	0	0	0	109.3
890	S	27	Very low	30.6	Very low	96 Å²	96	133.8 Å²	133.8	67%	0.671	75%	0.747	S	S	*	*			trans	-99.6	176.4	-171.6	71.6	0	0	0	0	114.7
891	S	31.3	Very low	30.2	Very low	119 Å²	119	131.9 Å²	131.9	83%	0.832	74%	0.737	S	S	*	*			trans	-162.3	136	165.8	-70.8	0	0	0	0	110
892	E	31.8	Very low	30.5	Very low	163 Å²	163	137.3 Å²	137.3	76%	0.762	75%	0.745	S	S	*	*			trans	-126.9	166.8	-169.9	-125.7	74.9	-148.6	0	0	113.8
893	D	35.5	Very low	30.7	Very low	156 Å²	156	140.1 Å²	140.1	83%	0.834	75%	0.747	S	S	*	*			trans	80.6	154.9	162.2	-72.7	-36.9	0	0	0	123.2
894	I	31.4	Very low	31	Very low	118 Å²	118	144.7 Å²	144.7	61%	0.605	76%	0.757	S	S	*	*			trans	-148.9	163.9	-148.5	-48.7	174	0	0	0	111.7
895	R	32.7	Very low	31.1	Very low	221 Å²	221	147.8 Å²	147.8	83%	0.834	76%	0.759	S	S	*	*			trans	114.3	157.1	157	-65.6	171.1	-171.4	179.5	5.3	115.9
896	A	34.8	Very low	31.3	Very low	57 Å²	57	147.9 Å²	147.9	47%	0.471	76%	0.756	S	S	.	*			cis	-152.4	-166.3	-12.2	0	0	0	0	0	112.5	H1273 H1274 Y1275	A896-H1273 CarbonylContact C-O 3.49Å; A896-H1273 WeakPolarHBondContact CA-O 3.23Å; A896-H1274 CarbonylContact O-C 3.53Å; A896-Y1275 WeakPolarHBondContact O-CB 3.43Å; A896-Y1275 PolarHBondContact O-N 2.66Å
897	T	31.7	Very low	31.6	Very low	108 Å²	108	149 Å²	149	66%	0.663	75%	0.754	S	S	*	*			trans	-74.4	173.7	-141.2	24	0	0	0	0	123.6	H1273	T897-H1273 WeakPolarHBondContact CA-O 3.37Å; T897-H1273 HydrophobicContact CG2-CB 3.9Å; T897-H1273 WeakPolarHBondContact CG2-O 3.44Å; T897-H1273 PolarHBondContact N-O 3.11Å; T897-H1273 VanDerWaalsContact N-O 3.09Å
898	V	31.8	Very low	31.5	Very low	83 Å²	83	145.8 Å²	145.8	50%	0.503	75%	0.751	S	S	.	*			trans	-89.5	154.5	179.6	172.2	0	0	0	0	114.3	Y1275	V898-Y1275 HydrophobicContact CG2-CD2 3.63Å; V898-Y1275 HydrophobicContact CG2-CE2 3.87Å; V898-Y1275 HydrophobicContact CG2-CG 4.14Å
899	D	33	Very low	31.7	Very low	147 Å²	147	150.1 Å²	150.1	79%	0.786	76%	0.755	S	S	*	*			trans	-152.1	-178	149	-148.5	-15.7	0	0	0	114.1
900	H	33.1	Very low	31.6	Very low	154 Å²	154	150.4 Å²	150.4	71%	0.713	75%	0.746	S	S	*	*			trans	-114.8	148.4	-144.3	-90.8	-85.1	0	0	0	120
901	S	29.1	Very low	31.8	Very low	92 Å²	92	154.8 Å²	154.8	64%	0.643	76%	0.756	S	S	*	*			trans	66.1	125.4	137.9	-63.5	0	0	0	0	122.7
902	K	34	Very low	31.6	Very low	198 Å²	198	155.3 Å²	155.3	86%	0.861	75%	0.749	S	S	*	*				175	124.1	115.7	-91.1	147.3	-166.6	160.3	0	116.6
903	K	32.4	Very low	31.5	Very low	193 Å²	193	156 Å²	156	84%	0.839	76%	0.757	S	S	*	*			trans	22.3	119.8	141.5	-58	173.6	177.1	176	0	120.9
904	K	32.6	Very low	31	Very low	200 Å²	200	158.7 Å²	158.7	87%	0.87	76%	0.761	S	S	*	*				170.1	126.2	111.4	-94.4	166.8	-177.4	174.4	0	117.5
905	R	31.3	Very low	30.9	Very low	216 Å²	216	162.6 Å²	162.6	82%	0.815	77%	0.774	S	S	*	*			trans	41.6	125.3	134.6	-78.2	-178.4	164.2	178.3	-3.6	124
906	K	31.5	Very low	30.6	Very low	172 Å²	172	159.1 Å²	159.1	75%	0.748	77%	0.771	S	S	*	*				88.9	132.4	128.4	-78.5	-174.5	173.4	-174.9	0	122.4
907	K	31.4	Very low	30.1	Very low	194 Å²	194	162 Å²	162	84%	0.843	78%	0.782	S	S	*	*			trans	61.2	115.2	157.3	-67.2	-176.8	173.4	-171.5	0	116.5
908	S	27	Very low	29.8	Very low	108 Å²	108	165.5 Å²	165.5	76%	0.755	79%	0.789	S	S	*	*				87.9	109.8	50.8	-178.8	0	0	0	0	114.6
909	K	32.1	Very low	29.5	Very low	207 Å²	207	169.7 Å²	169.7	90%	0.9	80%	0.8	S	S	*	*			trans	-164.9	156.2	131.5	-106.4	174.4	-179.1	-175	0	110.6
910	H	28.4	Very low	29.1	Very low	156 Å²	156	168.7 Å²	168.7	72%	0.722	80%	0.802	S	S	*	*			trans	-79.3	157.5	-177.2	-72.8	-122.6	0	0	0	112.7
911	H	31.6	Very low	28.7	Very low	189 Å²	189	169.1 Å²	169.1	88%	0.875	81%	0.808	S	S	*	*				-151.5	155.5	114.9	-123.5	-94.3	0	0	0	111.9
912	N	26.7	Very low	28.7	Very low	130 Å²	130	168.7 Å²	168.7	70%	0.695	81%	0.806	S	S	*	*			trans	-90.3	144.3	-165.6	-60.6	-46	0	0	0	113.9
913	L	28.8	Very low	28.3	Very low	176 Å²	176	167.2 Å²	167.2	92%	0.921	80%	0.802	S	S	*	*			trans	-145.7	136.8	149.6	-106.1	155.1	0	0	0	108.8
914	K	25.9	Very low	28.1	Very low	213 Å²	213	165 Å²	165	93%	0.926	80%	0.799	S	S	*	*			trans	-76.6	129.4	-162.2	-62.3	175.9	-179.5	177.9	0	112
915	K	29.7	Very low	27.8	Very low	200 Å²	200	164.1 Å²	164.1	87%	0.87	80%	0.798	S	S	*	*			trans	-124.5	129.6	159.6	-153	173.8	-173.7	-177.6	0	107.3	T917	K915-T917 PolarHBondContact O-N 3.48Å
916	I	25.5	Very low	27.6	Very low	149 Å²	149	159 Å²	159	76%	0.764	79%	0.791	S	S	*	*			trans	-76.2	121.7	-165.3	-62.6	172.8	0	0	0	110.1	F918	I916-F918 HydrophobicContact CG2-CD2 4.37Å; I916-F918 HydrophobicContact CG2-CE2 4.18Å
917	T	24.1	Very low	27.4	Very low	117 Å²	117	157.2 Å²	157.2	72%	0.718	79%	0.794	S	S	*	*			trans	-102.9	118.6	169.4	-56.5	0	0	0	0	108.5	K915 K919	K915-T917 PolarHBondContact O-N 3.48Å; T917-K919 PolarHBondContact O-N 3.43Å
918	F	25.7	Very low	27	Very low	181 Å²	181	153.8 Å²	153.8	79%	0.794	79%	0.79	S	S	*	*			trans	-78.4	111.9	158.9	-76	-84.1	0	0	0	107.7	I916	I916-F918 HydrophobicContact CG2-CD2 4.37Å; I916-F918 HydrophobicContact CG2-CE2 4.18Å
919	K	25.8	Very low	27	Very low	172 Å²	172	155.5 Å²	155.5	75%	0.748	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-79.6	138.6	164.9	-80.4	-171.7	171.1	-169.3	0	108.7	T917	T917-K919 PolarHBondContact O-N 3.43Å
920	P	25.4	Very low	26.7	Very low	125 Å²	125	152.6 Å²	152.6	81%	0.812	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-62.3	132	144.9	-6.9	24.1	0	0	0	107.7
921	L	24.8	Very low	26.5	Very low	163 Å²	163	151.2 Å²	151.2	85%	0.853	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-97	137.9	161.8	-101.8	145.2	0	0	0	107.2
922	S	27.8	Very low	26.2	Very low	84 Å²	84	147.7 Å²	147.7	59%	0.587	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-93.8	143.8	179.7	54.9	0	0	0	0	110.8
923	E	25.4	Very low	26.2	Very low	166 Å²	166	147.4 Å²	147.4	78%	0.776	79%	0.79	S	S	*	*			trans	68.2	146.6	149.6	-69.5	134.9	-171.9	0	0	120.5
924	D	27.7	Very low	26.2	Very low	147 Å²	147	143.9 Å²	143.9	79%	0.786	79%	0.786	S	S	*	*			trans	53	111.5	155.6	-54	-16	0	0	0	121.8
925	E	27.2	Very low	26.2	Very low	181 Å²	181	138.6 Å²	138.6	85%	0.846	78%	0.776	S	S	*	*				-168.8	109.7	108.5	-101.8	174.7	-173.2	0	0	108.1
926	T	27.3	Very low	26	Very low	110 Å²	110	135.5 Å²	135.5	68%	0.675	77%	0.769	S	S	*	*				26.6	109.8	95.1	49.8	0	0	0	0	114.2
927	T	28	Very low	26.2	Very low	133 Å²	133	135.2 Å²	135.2	82%	0.816	77%	0.769	S	S	*	*				65.1	123.2	88.1	-48.4	0	0	0	0	113
928	T	23.2	Very low	26.4	Very low	123 Å²	123	137.8 Å²	137.8	76%	0.755	77%	0.772	S	S	*	*	S	Bend	trans	-59.8	156.4	179.5	-21.9	0	0	0	0	113.6
929	I	26	Very low	26.6	Very low	143 Å²	143	134.8 Å²	134.8	73%	0.733	77%	0.769	S	S	*	*			trans	97.1	109.2	157.8	-59.1	152.7	0	0	0	117
930	I	24.8	Very low	26.7	Very low	146 Å²	146	133.6 Å²	133.6	75%	0.749	77%	0.771	S	S	*	*			trans	24.1	124.4	131.7	-23.3	173.5	0	0	0	115.5
931	T	25.3	Very low	27	Very low	128 Å²	128	132.3 Å²	132.3	79%	0.785	77%	0.765	S	S	*	*				-164.8	153.1	53.7	-42	0	0	0	0	112.7
932	S	25.4	Very low	27.2	Very low	114 Å²	114	130.9 Å²	130.9	80%	0.797	76%	0.758	S	S	*	*			trans	-73.7	147.7	170.6	-44.2	0	0	0	0	113.3
933	S	26.3	Very low	27.3	Very low	125 Å²	125	132.7 Å²	132.7	87%	0.874	76%	0.762	S	S	*	*			trans	-134.2	119.1	160.8	-66.8	0	0	0	0	109.8
934	A	28.1	Very low	27.6	Very low	101 Å²	101	130.6 Å²	130.6	84%	0.835	76%	0.756	S	S	*	*			trans	-103.1	166.5	172.3	0	0	0	0	0	110.5
935	S	25.9	Very low	27.8	Very low	103 Å²	103	130 Å²	130	72%	0.72	75%	0.752	S	S	*	*			trans	-131.4	145.6	162	60.5	0	0	0	0	108.5
936	N	26.5	Very low	28.1	Very low	135 Å²	135	127.7 Å²	127.7	72%	0.722	75%	0.746	S	S	*	*			trans	76.6	118.1	-174.3	-50.1	20.3	0	0	0	111.2
937	D	29.7	Very low	28.4	Very low	142 Å²	142	127 Å²	127	76%	0.759	75%	0.745	S	S	*	*			cis	-145.5	160.4	10.2	-82	-46.4	0	0	0	114.5
938	E	28.9	Very low	28.6	Very low	171 Å²	171	125.2 Å²	125.2	80%	0.799	74%	0.739	S	S	*	*			trans	66.2	104.7	155.3	-72.3	-178.9	167.7	0	0	123.2
939	T	28.6	Very low	28.6	Very low	119 Å²	119	127 Å²	127	73%	0.73	74%	0.743	S	S	*	*				89.3	135	128.2	57.9	0	0	0	0	123.5
940	D	29.5	Very low	28.8	Very low	147 Å²	147	125.6 Å²	125.6	79%	0.786	74%	0.742	S	S	*	*			trans	52.8	116.4	147.3	-59.2	0.6	0	0	0	120.4
941	S	29.8	Very low	28.8	Very low	98 Å²	98	124.3 Å²	124.3	69%	0.685	74%	0.741	S	S	*	*			cis	175.6	162.2	20.7	52.3	0	0	0	0	111.6
942	N	30.1	Very low	28.7	Very low	133 Å²	133	124.6 Å²	124.6	71%	0.711	74%	0.742	S	S	*	*			trans	67.1	102.6	152.7	-69.4	-35.1	0	0	0	122.9
943	N	29.4	Very low	28.8	Very low	122 Å²	122	124.9 Å²	124.9	65%	0.652	74%	0.739	S	S	*	*				90.3	117.7	117.1	-72.1	-21.1	0	0	0	122.6
944	N	31.3	Very low	28.7	Very low	122 Å²	122	125.4 Å²	125.4	65%	0.652	73%	0.73	S	S	*	*			trans	71.2	149.6	131.6	-57.9	-14.7	0	0	0	118.7
945	N	33.2	Very low	28.8	Very low	134 Å²	134	130.2 Å²	130.2	72%	0.717	73%	0.732	S	S	*	*			cis	-169.1	166.5	-13.8	-99.9	-14	0	0	0	108.4
946	N	33.6	Very low	28.9	Very low	133 Å²	133	131.8 Å²	131.8	71%	0.711	73%	0.733	S	S	*	*			cis	-177	162.8	-31.5	-174.2	25.5	0	0	0	109.3
947	S	32.7	Very low	29	Very low	94 Å²	94	133.1 Å²	133.1	66%	0.657	74%	0.74	S	S	*	*			trans	79.1	150.4	152	95.4	0	0	0	0	118.8
948	S	31.8	Very low	28.9	Very low	97 Å²	97	130 Å²	130	68%	0.678	73%	0.734	S	S	*	*			cis	-173.9	144.9	-20.6	44.5	0	0	0	0	112.4
949	D	23.9	Very low	28.6	Very low	159 Å²	159	129.8 Å²	129.8	85%	0.85	74%	0.737	S	S	*	*			trans	-82.4	143.5	154.4	-81.4	-56.5	0	0	0	111.8
950	T	29	Very low	28.4	Very low	115 Å²	115	130.4 Å²	130.4	71%	0.706	74%	0.741	S	S	*	*			trans	-165.3	109.8	161.2	29	0	0	0	0	107.7
951	T	24.8	Very low	28.1	Very low	118 Å²	118	130.3 Å²	130.3	72%	0.724	74%	0.739	S	S	*	*				97.2	135.1	51.6	56	0	0	0	0	114.5
952	V	24.6	Very low	27.9	Very low	134 Å²	134	134.4 Å²	134.4	81%	0.812	75%	0.748	S	S	*	*			trans	74.8	143.7	152.2	162.2	0	0	0	0	115.2
953	V	26.2	Very low	27.7	Very low	121 Å²	121	134.1 Å²	134.1	73%	0.733	75%	0.75	S	S	*	*			cis	-139.9	136.5	30.2	-166.2	0	0	0	0	115.6
954	I	25.5	Very low	27.4	Very low	136 Å²	136	131.9 Å²	131.9	70%	0.697	76%	0.757	S	S	*	*			trans	-9.5	137.6	144.5	-39.1	158.1	0	0	0	119.9
955	K	29.3	Very low	27.3	Very low	202 Å²	202	132 Å²	132	88%	0.878	76%	0.764	S	S	*	*				179.3	146.3	119.4	-101.2	178.1	-178.3	-179.9	0	117.3
956	D	28.8	Very low	26.8	Very low	136 Å²	136	132.3 Å²	132.3	73%	0.727	77%	0.771	S	S	*	*			trans	-102.1	158.9	-176.9	-38.4	-98.8	0	0	0	114
957	N	29.3	Very low	26.2	Very low	162 Å²	162	132.4 Å²	132.4	87%	0.866	78%	0.776	S	S	*	*			trans	164.4	139.3	142.8	-84.5	-22.9	0	0	0	108.5
958	A	25.8	Very low	25.7	Very low	77 Å²	77	133.4 Å²	133.4	64%	0.636	78%	0.778	S	S	*	*			cis	117.5	131.8	10.3	0	0	0	0	0	112.4
959	L	23.2	Very low	25.2	Very low	166 Å²	166	135.6 Å²	135.6	87%	0.869	78%	0.781	S	S	*	*			trans	71.7	157.4	171.9	-54.9	161.5	0	0	0	115.1
960	T	24.9	Very low	25.3	Very low	132 Å²	132	133.4 Å²	133.4	81%	0.81	77%	0.774	S	S	*	*			cis	-147.4	178.1	13.1	-26.4	0	0	0	0	112.2
961	I	23.6	Very low	25.1	Very low	146 Å²	146	135 Å²	135	75%	0.749	78%	0.784	S	S	*	*			trans	-106.8	143.1	-179.4	-60.3	159.9	0	0	0	110.7
962	E	25.3	Very low	25.3	Very low	184 Å²	184	133.9 Å²	133.9	86%	0.86	78%	0.78	S	S	*	*			trans	-170.1	108.1	152.6	-104.8	167.2	-146.2	0	0	107.4
963	T	24.6	Very low	25.4	Very low	126 Å²	126	136.3 Å²	136.3	77%	0.773	78%	0.783	S	S	*	*				61.5	113.3	78.8	65.2	0	0	0	0	117
964	G	25	Very low	25.5	Very low	76 Å²	76	138.2 Å²	138.2	78%	0.784	79%	0.785	S	S	*	*			trans	155.4	114.6	165.8	0	0	0	0	0	113.8
965	P	27.6	Very low	25.6	Very low	124 Å²	124	140.2 Å²	140.2	81%	0.805	79%	0.792	S	S	*	*			trans	-95.4	148	-176.1	35.9	-34	0	0	0	113.8
966	T	23.5	Very low	25.7	Very low	140 Å²	140	135.6 Å²	135.6	86%	0.859	78%	0.783	S	S	*	*			trans	-151.2	139.9	157.9	-67.3	0	0	0	0	108.6
967	V	21.5	Very low	25.9	Very low	135 Å²	135	137.6 Å²	137.6	82%	0.818	79%	0.785	S	S	*	*			trans	-102.5	121	-164.2	175.2	0	0	0	0	112.1
968	T	20.7	Very low	26.1	Very low	116 Å²	116	133.6 Å²	133.6	71%	0.712	77%	0.77	S	S	*	*			trans	-161.6	139.2	161.9	8.3	0	0	0	0	114.4
969	I	22.7	Very low	26.4	Very low	143 Å²	143	136.1 Å²	136.1	73%	0.733	77%	0.773	S	S	*	*			trans	85.8	137.3	145.9	-63.1	161	0	0	0	120.2
970	T	25.2	Very low	27	Very low	113 Å²	113	133.4 Å²	133.4	69%	0.693	76%	0.758	S	S	*	*			trans	63.1	132.2	165.5	42	0	0	0	0	122.8	S972	T970-S972 PolarHBondContact O-N 3.47Å
971	T	26.2	Very low	27.2	Very low	149 Å²	149	134.4 Å²	134.4	91%	0.914	76%	0.757	S	S	*	*			trans	-79.9	89.6	161.1	47.2	0	0	0	0	110.8
972	S	27.6	Very low	27.6	Very low	94 Å²	94	132.1 Å²	132.1	66%	0.657	75%	0.745	S	S	*	*			trans	-144.2	33	178.6	62.6	0	0	0	0	114.1	T970	T970-S972 PolarHBondContact O-N 3.47Å
973	E	26.3	Very low	27.8	Very low	185 Å²	185	127.8 Å²	127.8	86%	0.864	73%	0.733	S	S	*	*			trans	-124.5	87.2	179.6	-68	-170.6	134.9	0	0	111.7
974	M	28.4	Very low	27.9	Very low	160 Å²	160	128.1 Å²	128.1	79%	0.788	74%	0.74	S	S	*	*			trans	-167.3	89.6	152.6	-88.9	-122.7	157.7	0	0	108.4
975	Q	29.3	Very low	28.2	Very low	178 Å²	178	129.3 Å²	129.3	83%	0.832	73%	0.732	S	S	*	*			trans	-77.5	156	174.4	-97	-171.5	-54.1	0	0	112.1	F977	Q975-F977 PolarHBondContact O-N 3.2Å
976	P	30.8	Very low	28.3	Very low	106 Å²	106	128.4 Å²	128.4	69%	0.688	73%	0.729	S	S	*	*			trans	-71.3	125.6	177.8	-14	29.8	0	0	0	112	S978	P976-S978 PolarHBondContact O-N 3.43Å
977	F	33.1	Very low	28.8	Very low	177 Å²	177	128.8 Å²	128.8	78%	0.776	73%	0.726	S	S	*	*			trans	-82.3	50.1	175.6	-91.3	-86	0	0	0	112.8	Q975 I980	Q975-F977 PolarHBondContact O-N 3.2Å; F977-I980 HydrophobicContact CD1-CD1 4.04Å
978	S	33.4	Very low	29.5	Very low	78 Å²	78	125 Å²	125	55%	0.545	70%	0.704	S	S	.	*			trans	-77.6	-22.3	-174	37.8	0	0	0	0	115.6	P976	P976-S978 PolarHBondContact O-N 3.43Å
979	D	31.6	Very low	30.5	Very low	130 Å²	130	123.3 Å²	123.3	70%	0.695	70%	0.696	S	S	*	*			trans	-117.5	26.6	-156.6	-66.6	-81.1	0	0	0	116.1	I981	D979-I981 PolarHBondContact O-N 3.32Å
980	I	35	Very low	31.3	Very low	110 Å²	110	122 Å²	122	56%	0.564	69%	0.69	S	S	*	*			trans	-76.3	85.7	173.5	-54.6	-174.7	0	0	0	110.8	F977 I982	F977-I980 HydrophobicContact CD1-CD1 4.04Å; I980-I982 HydrophobicContact CG2-CG1 3.93Å; I980-I982 PolarHBondContact O-N 3.04Å
981	I	30.3	Very low	32.3	Very low	153 Å²	153	121.2 Å²	121.2	79%	0.785	68%	0.682	S	S	*	*			trans	-76	96.9	170.4	-56.8	175.5	0	0	0	109.4	D979 P983	D979-I981 PolarHBondContact O-N 3.32Å; I981-P983 WeakPolarHBondContact O-CD 3.5Å
982	I	32.7	Very low	33.1	Very low	98 Å²	98	116.8 Å²	116.8	50%	0.503	66%	0.655	S	S	.	*			trans	-77.6	121.5	173.4	-55.7	-177.9	0	0	0	109.9	I980 T988 V992	I980-I982 HydrophobicContact CG2-CG1 3.93Å; I980-I982 PolarHBondContact O-N 3.04Å; I982-T988 HydrophobicContact CG2-CG2 4.37Å; I982-V992 HydrophobicContact CD1-CG2 4.39Å
983	P	28.2	Very low	34.1	Very low	92 Å²	92	117.7 Å²	117.7	60%	0.597	65%	0.649	S	S	*	*			trans	-64.6	138.6	176.8	-22.2	34.7	0	0	0	112.6	I981 T985	I981-P983 WeakPolarHBondContact O-CD 3.5Å; P983-T985 VanDerWaalsContact C-N 3.25Å; P983-T985 PolarHBondContact O-N 2.89Å
984	S	27.9	Very low	35.6	Very low	133 Å²	133	114.5 Å²	114.5	93%	0.93	64%	0.635	S	S	*	*	S	Bend	trans	-80.9	63.1	-177.7	42.9	0	0	0	0	113.4
985	T	31.3	Very low	36.9	Very low	101 Å²	101	111 Å²	111	62%	0.62	62%	0.622	S	S	*	*			trans	-118.4	153.7	168.8	49.6	0	0	0	0	111	P983	P983-T985 VanDerWaalsContact C-N 3.25Å; P983-T985 PolarHBondContact O-N 2.89Å
986	S	28.6	Very low	38	Very low	106 Å²	106	106 Å²	106	74%	0.741	60%	0.601	S	S	*	*	S	Bend	trans	-58.2	152.7	-172.4	46	0	0	0	0	115.1
987	N	33.9	Very low	39.6	Very low	148 Å²	148	103.4 Å²	103.4	79%	0.791	58%	0.581	S	S	*	*			trans	79.9	42.6	173.9	-53.7	4.4	0	0	0	116.6
988	T	36.9	Very low	41.2	Very low	56 Å²	56	99.8 Å²	99.8	34%	0.344	57%	0.57	S	S	.	*			trans	-111.4	6.1	-176.3	49.6	0	0	0	0	116.4	I982 D990	I982-T988 HydrophobicContact CG2-CG2 4.37Å; T988-D990 VanDerWaalsContact C-N 3.32Å; T988-D990 PolarHBondContact O-N 3.22Å
989	S	40.6	Very low	42.5	Very low	79 Å²	79	101 Å²	101	55%	0.552	57%	0.565	S	S	*	*	H	α-helix	trans	-59.4	-41.6	177.3	39.5	0	0	0	0	113.1	V992	S989-V992 PolarHBondContact O-N 2.98Å
990	D	40.2	Very low	44	Very low	115 Å²	115	96 Å²	96	62%	0.615	54%	0.537	S	S	*	.	H	α-helix	trans	-80.8	-31.2	-162.2	-47.8	-9.4	0	0	0	110.8	T988 V992 H993 M994	T988-D990 VanDerWaalsContact C-N 3.32Å; T988-D990 PolarHBondContact O-N 3.22Å; D990-V992 VanDerWaalsContact C-N 3.27Å; D990-V992 PolarHBondContact O-N 3.49Å; D990-H993 PolarHBondContact O-N 3.2Å; D990-M994 PolarHBondContact O-N 2.92Å
991	N	45.5	Very low	45.7	Very low	97 Å²	97	95.1 Å²	95.1	52%	0.519	53%	0.534	S	S	.	.	H	α-helix	trans	-64	-28.9	173.1	-68.7	-25.5	0	0	0	112.9	V995	N991-V995 WeakPolarHBondContact O-CG2 3.48Å; N991-V995 PolarHBondContact O-N 2.85Å
992	V	43.3	Very low	47.3	Very low	57 Å²	57	90.3 Å²	90.3	35%	0.345	51%	0.514	S	S	.	.	H	α-helix	trans	-71.5	-35.3	179.7	179.6	0	0	0	0	110.9	I982 S989 D990 L996	I982-V992 HydrophobicContact CD1-CG2 4.39Å; S989-V992 PolarHBondContact O-N 2.98Å; D990-V992 VanDerWaalsContact C-N 3.27Å; D990-V992 PolarHBondContact O-N 3.49Å; V992-L996 HydrophobicContact CG1-CD1 4.09Å; V992-L996 VanDerWaalsContact O-CG 3.31Å; V992-L996 WeakPolarHBondContact O-CG 3.39Å; V992-L996 PolarHBondContact O-N 3.06Å
993	H	48.9	Very low	48.6	Very low	113 Å²	113	87 Å²	87	52%	0.523	50%	0.496	S	S	.	.	H	α-helix	trans	-65.1	-48.8	173.1	-88.9	-89.3	0	0	0	111.4	D990 V995 L996 D997	D990-H993 PolarHBondContact O-N 3.2Å; H993-V995 VanDerWaalsContact C-N 3.35Å; H993-V995 PolarHBondContact O-N 3.47Å; H993-L996 PolarHBondContact O-N 3.19Å; H993-L996 VanDerWaalsContact O-N 3.1Å; H993-D997 PolarHBondContact O-N 2.99Å
994	M	57.7	Low	50.3	Low	118 Å²	118	84.8 Å²	84.8	58%	0.581	48%	0.479	S	S	*	.	H	α-helix	trans	-54	-48	177.1	-73.1	-174.8	67.9	0	0	112.7	D990 L996 D997 D998	D990-M994 PolarHBondContact O-N 2.92Å; M994-L996 VanDerWaalsContact C-N 3.31Å; M994-L996 PolarHBondContact O-N 2.84Å; M994-D997 PolarHBondContact O-N 3.37Å; M994-D998 WeakPolarHBondContact O-CB 3.44Å; M994-D998 PolarHBondContact O-N 2.88Å
995	V	56.5	Low	52.3	Low	86 Å²	86	83.3 Å²	83.3	52%	0.521	46%	0.458	S	S	.	.	H	α-helix	trans	-64.2	-34.5	179.9	172.6	0	0	0	0	112.4	N991 H993 F999	N991-V995 WeakPolarHBondContact O-CG2 3.48Å; N991-V995 PolarHBondContact O-N 2.85Å; H993-V995 VanDerWaalsContact C-N 3.35Å; H993-V995 PolarHBondContact O-N 3.47Å; V995-F999 VanDerWaalsContact O-CB 3.3Å; V995-F999 WeakPolarHBondContact O-CB 3.47Å; V995-F999 PolarHBondContact O-N 2.92Å; V995-F999 VanDerWaalsContact O-N 3.11Å
996	L	51.7	Low	53.9	Low	72 Å²	72	80.4 Å²	80.4	38%	0.377	45%	0.445	S	S	.	.	H	α-helix	trans	-74	-35.3	175.9	-71.6	171.3	0	0	0	112.5	V992 H993 M994 R1000 L1127	V992-L996 HydrophobicContact CG1-CD1 4.09Å; V992-L996 VanDerWaalsContact O-CG 3.31Å; V992-L996 WeakPolarHBondContact O-CG 3.39Å; V992-L996 PolarHBondContact O-N 3.06Å; H993-L996 PolarHBondContact O-N 3.19Å; H993-L996 VanDerWaalsContact O-N 3.1Å; M994-L996 VanDerWaalsContact C-N 3.31Å; M994-L996 PolarHBondContact O-N 2.84Å; L996-R1000 VanDerWaalsContact O-CB 3.31Å; L996-R1000 WeakPolarHBondContact O-CB 3.43Å; L996-R1000 PolarHBondContact O-N 3.1Å; L996-L1127 HydrophobicContact CD1-CD1 4.08Å
997	D	63.6	Low	55.4	Low	53 Å²	53	77.8 Å²	77.8	28%	0.283	42%	0.422	S	S	.	.	H	α-helix	trans	-73	-40	175.8	-73.7	-37.5	0	0	0	111.8	H993 M994 F999 R1000 N1001	H993-D997 PolarHBondContact O-N 2.99Å; M994-D997 PolarHBondContact O-N 3.37Å; D997-F999 VanDerWaalsContact C-N 3.33Å; D997-F999 PolarHBondContact O-N 3.38Å; D997-R1000 WeakPolarHBondContact O-CB 3.4Å; D997-R1000 PolarHBondContact O-N 3.45Å; D997-N1001 WeakPolarHBondContact O-CB 3.08Å; D997-N1001 PolarHBondContact O-N 2.96Å; D997-N1001 PolarHBondContact O-ND2 2.89Å; D997-N1001 VanDerWaalsContact O-ND2 3.08Å
998	D	67.9	Low	57.1	Low	101 Å²	101	76 Å²	76	54%	0.54	41%	0.408	S	S	.	.	H	α-helix	trans	-60.6	-42.5	171.6	-73.8	-26.1	0	0	0	111.4	M994 N1001 S1002	M994-D998 WeakPolarHBondContact O-CB 3.44Å; M994-D998 PolarHBondContact O-N 2.88Å; D998-N1001 PolarHBondContact O-N 3.48Å; D998-S1002 WeakPolarHBondContact O-CB 3.38Å; D998-S1002 PolarHBondContact O-N 2.95Å
999	F	60.9	Low	58.7	Low	102 Å²	102	78.4 Å²	78.4	45%	0.447	41%	0.414	S	S	.	.	H	α-helix	trans	-65.8	-40	174.6	-175.6	-113.4	0	0	0	112.4	V995 D997 S1002 I1003	V995-F999 VanDerWaalsContact O-CB 3.3Å; V995-F999 WeakPolarHBondContact O-CB 3.47Å; V995-F999 PolarHBondContact O-N 2.92Å; V995-F999 VanDerWaalsContact O-N 3.11Å; D997-F999 VanDerWaalsContact C-N 3.33Å; D997-F999 PolarHBondContact O-N 3.38Å; F999-S1002 PolarHBondContact O-N 2.92Å; F999-I1003 HydrophobicContact CD1-CD1 3.97Å; F999-I1003 HydrophobicContact CE1-CD1 3.49Å; F999-I1003 VanDerWaalsContact CE1-CD1 3.49Å; F999-I1003 HydrophobicContact CE2-CD1 4.31Å; F999-I1003 HydrophobicContact CZ-CD1 3.69Å; F999-I1003 HydrophobicContact CZ-CG1 4.43Å; F999-I1003 WeakPolarHBondContact O-CG1 3.42Å; F999-I1003 PolarHBondContact O-N 3.33Å
1000	R	63.2	Low	59.5	Low	26 Å²	26	80 Å²	80	10%	0.098	42%	0.416	C	S	.	.	H	α-helix	trans	-59.8	-45	173.2	-170.8	-170.1	-147.5	84.9	8.9	111.3	L996 D997 I1003 N1004 L1037 H1038 Y1120	L996-R1000 VanDerWaalsContact O-CB 3.31Å; L996-R1000 WeakPolarHBondContact O-CB 3.43Å; L996-R1000 PolarHBondContact O-N 3.1Å; D997-R1000 WeakPolarHBondContact O-CB 3.4Å; D997-R1000 PolarHBondContact O-N 3.45Å; R1000-I1003 PolarHBondContact O-N 2.8Å; R1000-N1004 VanDerWaalsContact O-CG 3.24Å; R1000-N1004 PolarHBondContact O-N 2.9Å; R1000-N1004 PolarHBondContact O-ND2 3.18Å; R1000-L1037 VanDerWaalsContact CZ-O 3.28Å; R1000-L1037 PolarHBondContact NE-O 3.5Å; R1000-L1037 PolarHBondContact NH2-O 2.98Å; R1000-H1038 PolarHBondContact NH2-O 3.45Å; R1000-Y1120 PolarHBondContact NH1-OH 3.35Å
1001	N	69.5	Low	60.4	Low	92 Å²	92	79.5 Å²	79.5	49%	0.492	41%	0.41	S	S	.	.	H	α-helix	trans	-63.7	-44.1	177.5	-68.9	-30	0	0	0	111.3	D997 D998 I1003 N1004 E1005	D997-N1001 WeakPolarHBondContact O-CB 3.08Å; D997-N1001 PolarHBondContact O-N 2.96Å; D997-N1001 PolarHBondContact O-ND2 2.89Å; D997-N1001 VanDerWaalsContact O-ND2 3.08Å; D998-N1001 PolarHBondContact O-N 3.48Å; N1001-I1003 PolarHBondContact O-N 3.38Å; N1001-N1004 PolarHBondContact O-N 3.45Å; N1001-E1005 WeakPolarHBondContact O-CB 3.42Å; N1001-E1005 PolarHBondContact O-N 3.4Å
1002	S	65	Low	61.5	Low	52 Å²	52	80.3 Å²	80.3	36%	0.364	41%	0.411	S	S	.	.	H	α-helix	trans	-60.9	-40.9	175.6	-171.6	0	0	0	0	112.8	D998 F999 E1005 A1006	D998-S1002 WeakPolarHBondContact O-CB 3.38Å; D998-S1002 PolarHBondContact O-N 2.95Å; F999-S1002 PolarHBondContact O-N 2.92Å; S1002-E1005 PolarHBondContact O-N 3.49Å; S1002-A1006 WeakPolarHBondContact O-CB 3.46Å; S1002-A1006 PolarHBondContact O-N 2.97Å
1003	I	58.6	Low	62.5	Low	27 Å²	27	85.4 Å²	85.4	14%	0.138	43%	0.428	C	S	.	.	H	α-helix	trans	-65	-44.9	173.9	-73	174.6	0	0	0	111.5	F999 R1000 N1001 E1005 A1006 L1007 L1037 I1116	F999-I1003 HydrophobicContact CD1-CD1 3.97Å; F999-I1003 HydrophobicContact CE1-CD1 3.49Å; F999-I1003 VanDerWaalsContact CE1-CD1 3.49Å; F999-I1003 HydrophobicContact CE2-CD1 4.31Å; F999-I1003 HydrophobicContact CZ-CD1 3.69Å; F999-I1003 HydrophobicContact CZ-CG1 4.43Å; F999-I1003 WeakPolarHBondContact O-CG1 3.42Å; F999-I1003 PolarHBondContact O-N 3.33Å; R1000-I1003 PolarHBondContact O-N 2.8Å; N1001-I1003 PolarHBondContact O-N 3.38Å; I1003-E1005 VanDerWaalsContact C-N 3.34Å; I1003-E1005 PolarHBondContact O-N 3.09Å; I1003-A1006 PolarHBondContact O-N 2.62Å; I1003-L1007 HydrophobicContact CG2-CD1 3.87Å; I1003-L1007 HydrophobicContact CG2-CG 4.41Å; I1003-L1007 WeakPolarHBondContact O-CB 3.45Å; I1003-L1007 WeakPolarHBondContact O-CG 3.43Å; I1003-L1007 PolarHBondContact O-N 2.79Å; I1003-L1037 HydrophobicContact CG2-CD1 4.18Å; I1003-I1116 HydrophobicContact CD1-CG2 4.41Å; I1003-I1116 HydrophobicContact CG2-CG2 4.39Å
1004	N	64.9	Low	62.6	Low	46 Å²	46	83 Å²	83	25%	0.246	42%	0.419	C	S	.	.	H	α-helix	trans	-60.1	-44.2	177.3	-70.6	-27.5	0	0	0	111.3	R1000 N1001 L1007 Q1008	R1000-N1004 VanDerWaalsContact O-CG 3.24Å; R1000-N1004 PolarHBondContact O-N 2.9Å; R1000-N1004 PolarHBondContact O-ND2 3.18Å; N1001-N1004 PolarHBondContact O-N 3.45Å; N1004-L1007 PolarHBondContact O-N 3.4Å; N1004-Q1008 WeakPolarHBondContact O-CB 3.25Å; N1004-Q1008 PolarHBondContact O-N 3.18Å
1005	E	70.3	Confident	62.2	Low	102 Å²	102	80.1 Å²	80.1	48%	0.477	41%	0.414	S	S	.	.	H	α-helix	trans	-65.8	-38.7	177.6	-163.1	-168.2	167.6	0	0	112.1	N1001 S1002 I1003 Q1008 K1009	N1001-E1005 WeakPolarHBondContact O-CB 3.42Å; N1001-E1005 PolarHBondContact O-N 3.4Å; S1002-E1005 PolarHBondContact O-N 3.49Å; I1003-E1005 VanDerWaalsContact C-N 3.34Å; I1003-E1005 PolarHBondContact O-N 3.09Å; E1005-Q1008 PolarHBondContact O-N 3.13Å; E1005-K1009 VanDerWaalsContact CD-NZ 3.28Å; E1005-K1009 HydrophobicContact CG-CD 4.35Å; E1005-K1009 WeakPolarHBondContact O-CB 3.48Å; E1005-K1009 VanDerWaalsContact O-CG 3.29Å; E1005-K1009 WeakPolarHBondContact O-CG 3.46Å; E1005-K1009 PolarHBondContact O-N 3.5Å; E1005-K1009 WeakPolarHBondContact OE1-CE 3.41Å; E1005-K1009 IonicContact OE1-NZ 3.41Å; E1005-K1009 PolarHBondContact OE1-NZ 2.96Å; E1005-K1009 IonicContact OE2-NZ 2.74Å
1006	A	63.7	Low	61.9	Low	41 Å²	41	80.4 Å²	80.4	34%	0.339	42%	0.417	S	S	.	.	H	α-helix	trans	-65.8	-42	175.1	0	0	0	0	0	112.4	S1002 I1003 K1009 L1010	S1002-A1006 WeakPolarHBondContact O-CB 3.46Å; S1002-A1006 PolarHBondContact O-N 2.97Å; I1003-A1006 PolarHBondContact O-N 2.62Å; A1006-K1009 PolarHBondContact O-N 3Å; A1006-L1010 WeakPolarHBondContact O-CG 3.44Å; A1006-L1010 PolarHBondContact O-N 3.03Å
1007	L	60.7	Low	61.3	Low	50 Å²	50	81.7 Å²	81.7	26%	0.262	43%	0.428	S	S	.	.	H	α-helix	trans	-63.4	-43.2	174.4	-72.4	168.5	0	0	0	111.4	I1003 N1004 L1010 Q1011	I1003-L1007 HydrophobicContact CG2-CD1 3.87Å; I1003-L1007 HydrophobicContact CG2-CG 4.41Å; I1003-L1007 WeakPolarHBondContact O-CB 3.45Å; I1003-L1007 WeakPolarHBondContact O-CG 3.43Å; I1003-L1007 PolarHBondContact O-N 2.79Å; N1004-L1007 PolarHBondContact O-N 3.4Å; L1007-L1010 PolarHBondContact O-N 3.32Å; L1007-Q1011 WeakPolarHBondContact O-CB 3.45Å; L1007-Q1011 PolarHBondContact O-N 3.02Å
1008	Q	68.7	Low	60.2	Low	110 Å²	110	85.1 Å²	85.1	51%	0.514	45%	0.445	S	S	.	.	H	α-helix	trans	-62.4	-45.7	175.3	-176.7	175.3	-18	0	0	111.7	N1004 E1005 L1010 Q1011 E1012	N1004-Q1008 WeakPolarHBondContact O-CB 3.25Å; N1004-Q1008 PolarHBondContact O-N 3.18Å; E1005-Q1008 PolarHBondContact O-N 3.13Å; Q1008-L1010 VanDerWaalsContact C-N 3.28Å; Q1008-L1010 PolarHBondContact O-N 3.05Å; Q1008-Q1011 PolarHBondContact O-N 3.46Å; Q1008-Q1011 VanDerWaalsContact O-N 3.11Å; Q1008-E1012 HydrophobicContact CG-CG 4.39Å; Q1008-E1012 WeakPolarHBondContact CG-OE1 3.27Å; Q1008-E1012 PolarHBondContact NE2-OE1 3.37Å; Q1008-E1012 WeakPolarHBondContact O-CG 3.3Å; Q1008-E1012 PolarHBondContact O-N 3.42Å
1009	K	70.7	Confident	58.7	Low	107 Å²	107	87.2 Å²	87.2	47%	0.465	46%	0.457	S	S	.	.	H	α-helix	trans	-62.2	-31.3	176.3	-75.5	169.2	-179.7	169.6	0	113.3	E1005 A1006 K1013	E1005-K1009 VanDerWaalsContact CD-NZ 3.28Å; E1005-K1009 HydrophobicContact CG-CD 4.35Å; E1005-K1009 WeakPolarHBondContact O-CB 3.48Å; E1005-K1009 VanDerWaalsContact O-CG 3.29Å; E1005-K1009 WeakPolarHBondContact O-CG 3.46Å; E1005-K1009 PolarHBondContact O-N 3.5Å; E1005-K1009 WeakPolarHBondContact OE1-CE 3.41Å; E1005-K1009 IonicContact OE1-NZ 3.41Å; E1005-K1009 PolarHBondContact OE1-NZ 2.96Å; E1005-K1009 IonicContact OE2-NZ 2.74Å; A1006-K1009 PolarHBondContact O-N 3Å; K1009-K1013 WeakPolarHBondContact O-CB 3.28Å; K1009-K1013 WeakPolarHBondContact O-CG 3.32Å; K1009-K1013 PolarHBondContact O-N 3.09Å
1010	L	57.2	Low	57.6	Low	112 Å²	112	86 Å²	86	59%	0.586	47%	0.465	S	S	*	.	H	α-helix	trans	-70.3	-44.4	171.5	-76.3	166.3	0	0	0	111.3	A1006 L1007 Q1008 K1013 L1014	A1006-L1010 WeakPolarHBondContact O-CG 3.44Å; A1006-L1010 PolarHBondContact O-N 3.03Å; L1007-L1010 PolarHBondContact O-N 3.32Å; Q1008-L1010 VanDerWaalsContact C-N 3.28Å; Q1008-L1010 PolarHBondContact O-N 3.05Å; L1010-K1013 PolarHBondContact O-N 2.79Å; L1010-L1014 PolarHBondContact O-N 2.6Å; L1010-L1014 VanDerWaalsContact O-N 3.07Å
1011	Q	60	Low	56.3	Low	106 Å²	106	91.3 Å²	91.3	50%	0.495	50%	0.501	S	S	.	.	H	α-helix	trans	-64.9	-41.1	179.3	-167.2	173.2	-0.9	0	0	112.2	L1007 Q1008 L1014 A1015	L1007-Q1011 WeakPolarHBondContact O-CB 3.45Å; L1007-Q1011 PolarHBondContact O-N 3.02Å; Q1008-Q1011 PolarHBondContact O-N 3.46Å; Q1008-Q1011 VanDerWaalsContact O-N 3.11Å; Q1011-L1014 PolarHBondContact O-N 2.85Å; Q1011-A1015 PolarHBondContact O-N 2.89Å; Q1011-A1015 VanDerWaalsContact O-N 3.12Å
1012	E	69.1	Low	54.5	Low	113 Å²	113	94.5 Å²	94.5	53%	0.528	52%	0.518	S	S	.	.	H	α-helix	trans	-65	-36	173.8	-73.1	174.8	-171.4	0	0	112.4	Q1008 L1014	Q1008-E1012 HydrophobicContact CG-CG 4.39Å; Q1008-E1012 WeakPolarHBondContact CG-OE1 3.27Å; Q1008-E1012 PolarHBondContact NE2-OE1 3.37Å; Q1008-E1012 WeakPolarHBondContact O-CG 3.3Å; Q1008-E1012 PolarHBondContact O-N 3.42Å; E1012-L1014 VanDerWaalsContact C-N 3.33Å
1013	K	62.8	Low	53	Low	164 Å²	164	99.5 Å²	99.5	71%	0.713	54%	0.541	S	S	*	.	H	α-helix	trans	-69.4	-25.8	173.1	-82.8	-179.6	176.1	-178.8	0	114	K1009 L1010 P1016	K1009-K1013 WeakPolarHBondContact O-CB 3.28Å; K1009-K1013 WeakPolarHBondContact O-CG 3.32Å; K1009-K1013 PolarHBondContact O-N 3.09Å; L1010-K1013 PolarHBondContact O-N 2.79Å; K1013-P1016 WeakPolarHBondContact O-CD 3.44Å
1014	L	51.6	Low	51.5	Low	64 Å²	64	102.7 Å²	102.7	34%	0.335	57%	0.571	S	S	.	*	H	α-helix	trans	-89.3	-23.4	-178.3	-156.5	71.5	0	0	0	113	L1010 Q1011 E1012 T1017	L1010-L1014 PolarHBondContact O-N 2.6Å; L1010-L1014 VanDerWaalsContact O-N 3.07Å; Q1011-L1014 PolarHBondContact O-N 2.85Å; E1012-L1014 VanDerWaalsContact C-N 3.33Å; L1014-T1017 PolarHBondContact O-N 2.9Å; L1014-T1017 VanDerWaalsContact O-N 3.09Å
1015	A	49.5	Very low	49.9	Very low	56 Å²	56	106.7 Å²	106.7	46%	0.463	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-53.8	-35.9	179.8	0	0	0	0	0	115.7	Q1011	Q1011-A1015 PolarHBondContact O-N 2.89Å; Q1011-A1015 VanDerWaalsContact O-N 3.12Å
1016	P	49.5	Very low	47.9	Very low	93 Å²	93	108 Å²	108	60%	0.604	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-29	176.8	-19	33.5	0	0	0	113.6	K1013 I1018	K1013-P1016 WeakPolarHBondContact O-CD 3.44Å; P1016-I1018 VanDerWaalsContact C-N 3.29Å; P1016-I1018 PolarHBondContact O-N 3.38Å
1017	T	41	Very low	46.2	Very low	99 Å²	99	115.8 Å²	115.8	61%	0.607	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-16.8	-168.9	-41.8	0	0	0	0	113.2	L1014	L1014-T1017 PolarHBondContact O-N 2.9Å; L1014-T1017 VanDerWaalsContact O-N 3.09Å
1018	I	40.3	Very low	44.7	Very low	125 Å²	125	119 Å²	119	64%	0.641	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-17.8	-174.3	-64.6	171.3	0	0	0	112.2	P1016 A1020	P1016-I1018 VanDerWaalsContact C-N 3.29Å; P1016-I1018 PolarHBondContact O-N 3.38Å; I1018-A1020 PolarHBondContact O-N 3.49Å
1019	N	35.6	Very low	42.6	Very low	145 Å²	145	120.1 Å²	120.1	78%	0.775	67%	0.672	S	S	*	*	S	Bend	trans	-97.1	30.1	-173.3	-66.4	-28.7	0	0	0	114
1020	A	37.8	Very low	40.6	Very low	76 Å²	76	121.3 Å²	121.3	63%	0.628	69%	0.688	S	S	*	*	S	Bend	trans	-123	8.1	-163.6	0	0	0	0	0	117	I1018	I1018-A1020 PolarHBondContact O-N 3.49Å
1021	T	36.7	Very low	39.1	Very low	137 Å²	137	122.5 Å²	122.5	84%	0.84	70%	0.701	S	S	*	*			trans	-146.2	84.9	168.8	50.5	0	0	0	0	112.8	N1023	T1021-N1023 PolarHBondContact O-N 2.93Å
1022	D	30.9	Very low	37.7	Very low	160 Å²	160	122.8 Å²	122.8	86%	0.856	71%	0.714	S	S	*	*			trans	-70.6	119.9	163.6	-90.5	-46.9	0	0	0	110.6
1023	N	32.8	Very low	35.9	Very low	157 Å²	157	126.2 Å²	126.2	84%	0.84	73%	0.73	S	S	*	*				176.4	112.2	128.6	-96	-64.5	0	0	0	112.6	T1021	T1021-N1023 PolarHBondContact O-N 2.93Å
1024	A	27.8	Very low	34.4	Very low	94 Å²	94	123 Å²	123	78%	0.777	72%	0.72	S	S	*	*			trans	49.6	92.6	151.9	0	0	0	0	0	120.4
1025	V	31.4	Very low	33.5	Very low	129 Å²	129	125 Å²	125	78%	0.782	74%	0.737	S	S	*	*				-157.4	141.8	115.5	139.5	0	0	0	0	108.2	Y1027	V1025-Y1027 HydrophobicContact CG1-CD2 4.2Å; V1025-Y1027 HydrophobicContact CG1-CE2 4.28Å
1026	V	27.9	Very low	32.9	Very low	131 Å²	131	129 Å²	129	79%	0.794	75%	0.751	S	S	*	*			trans	-108.1	120.8	-169.7	178.5	0	0	0	0	111.8
1027	Y	27.5	Very low	32.3	Very low	203 Å²	203	127.1 Å²	127.1	80%	0.796	74%	0.735	S	S	*	*			trans	-135.2	150.6	158	-79.1	-73.1	0	0	0	109.8	V1025	V1025-Y1027 HydrophobicContact CG1-CD2 4.2Å; V1025-Y1027 HydrophobicContact CG1-CE2 4.28Å
1028	P	28.9	Very low	32	Very low	117 Å²	117	129.7 Å²	129.7	76%	0.76	74%	0.74	S	S	*	*			trans	-81.1	125.7	-156.7	29.8	-35.5	0	0	0	114.2	T1030	P1028-T1030 PolarHBondContact O-N 2.87Å
1029	T	25.8	Very low	31.6	Very low	135 Å²	135	126 Å²	126	83%	0.828	72%	0.724	S	S	*	*			trans	-69.7	120.7	170.4	-3.2	0	0	0	0	111.3
1030	T	28.4	Very low	31.3	Very low	131 Å²	131	125.9 Å²	125.9	80%	0.804	72%	0.722	S	S	*	*			trans	-102.5	100.8	159.1	51.1	0	0	0	0	109	P1028 S1032	P1028-T1030 PolarHBondContact O-N 2.87Å; T1030-S1032 PolarHBondContact O-N 3.36Å
1031	T	26.9	Very low	30.8	Very low	138 Å²	138	128.3 Å²	128.3	85%	0.847	72%	0.716	S	S	*	*			trans	-68.1	119.2	169.6	47.8	0	0	0	0	110
1032	S	28.9	Very low	30.4	Very low	111 Å²	111	127.4 Å²	127.4	78%	0.776	71%	0.714	S	S	*	*			trans	-133.5	140.5	163.7	59.2	0	0	0	0	109	T1030	T1030-S1032 PolarHBondContact O-N 3.36Å
1033	E	31	Very low	30.1	Very low	186 Å²	186	124.7 Å²	124.7	87%	0.869	70%	0.699	S	S	*	*			trans	-66.1	158.1	-166.6	-64.6	149.4	124.1	0	0	113.6
1034	L	31.3	Very low	29.9	Very low	97 Å²	97	124.2 Å²	124.2	51%	0.508	70%	0.695	S	S	.	*			trans	-58.9	132.9	173.6	-158.5	84.4	0	0	0	109.2	N1036	L1034-N1036 PolarHBondContact O-N 3.3Å
1035	P	34.3	Very low	29.8	Very low	106 Å²	106	121.9 Å²	121.9	69%	0.688	68%	0.676	S	S	*	*			trans	-66	97.6	178.1	-21.4	33.5	0	0	0	111.1	L1037	P1035-L1037 PolarHBondContact O-N 2.84Å
1036	N	35.9	Very low	29.6	Very low	140 Å²	140	123.6 Å²	123.6	75%	0.749	68%	0.679	S	S	*	*			trans	-51.4	133.4	168.6	-97	-57.8	0	0	0	109.5	L1034 H1038	L1034-N1036 PolarHBondContact O-N 3.3Å; N1036-H1038 PolarHBondContact O-N 3.04Å
1037	L	37.2	Very low	29.6	Very low	53 Å²	53	125.3 Å²	125.3	28%	0.277	68%	0.678	S	S	.	*			trans	-70.7	68.5	175.5	-83.8	167.9	0	0	0	110.5	R1000 I1003 P1035 L1117	R1000-L1037 VanDerWaalsContact CZ-O 3.28Å; R1000-L1037 PolarHBondContact NE-O 3.5Å; R1000-L1037 PolarHBondContact NH2-O 2.98Å; I1003-L1037 HydrophobicContact CG2-CD1 4.18Å; P1035-L1037 PolarHBondContact O-N 2.84Å; L1037-L1117 HydrophobicContact CD2-CD1 4.43Å
1038	H	34.1	Very low	29.6	Very low	153 Å²	153	121.7 Å²	121.7	71%	0.708	68%	0.677	S	S	*	*			trans	-58.9	132.5	177.9	-157.1	-72	0	0	0	109.6	R1000 N1036 I1040	R1000-H1038 PolarHBondContact NH2-O 3.45Å; N1036-H1038 PolarHBondContact O-N 3.04Å; H1038-I1040 PolarHBondContact O-N 3.39Å
1039	P	32.5	Very low	29.6	Very low	48 Å²	48	122.9 Å²	122.9	31%	0.312	68%	0.677	S	S	.	*			trans	-65	130.1	175.5	27	-34.6	0	0	0	109.8	Y1041	P1039-Y1041 VanDerWaalsContact C-N 3.27Å; P1039-Y1041 HydrophobicContact CB-CD2 3.58Å; P1039-Y1041 HydrophobicContact CB-CE2 3.72Å; P1039-Y1041 HydrophobicContact CG-CD2 3.7Å; P1039-Y1041 HydrophobicContact CG-CE2 3.72Å; P1039-Y1041 PolarHBondContact O-N 3.39Å
1040	I	29.7	Very low	30	Very low	141 Å²	141	123.3 Å²	123.3	72%	0.723	67%	0.674	S	S	*	*			trans	-86.8	79.6	162.5	-57.3	-180	0	0	0	105.8	H1038 C1042	H1038-I1040 PolarHBondContact O-N 3.39Å; I1040-C1042 PolarHBondContact O-N 2.92Å
1041	Y	27.4	Very low	30.4	Very low	128 Å²	128	123.7 Å²	123.7	50%	0.502	67%	0.672	S	S	.	*			trans	-61.7	104.6	173.7	-94.9	-84.7	0	0	0	109.5	P1039 D1043	P1039-Y1041 VanDerWaalsContact C-N 3.27Å; P1039-Y1041 HydrophobicContact CB-CD2 3.58Å; P1039-Y1041 HydrophobicContact CB-CE2 3.72Å; P1039-Y1041 HydrophobicContact CG-CD2 3.7Å; P1039-Y1041 HydrophobicContact CG-CE2 3.72Å; P1039-Y1041 PolarHBondContact O-N 3.39Å; Y1041-D1043 WeakPolarHBondContact CB-OD2 3.49Å; Y1041-D1043 WeakPolarHBondContact CD1-OD1 3.43Å; Y1041-D1043 PolarHBondContact O-N 3.36Å
1042	C	26.9	Very low	30.5	Very low	118 Å²	118	124.4 Å²	124.4	80%	0.797	67%	0.669	S	S	*	*			trans	-75.8	63.9	157.2	-78.8	0	0	0	0	109	I1040 I1044	I1040-C1042 PolarHBondContact O-N 2.92Å; C1042-I1044 PolarHBondContact O-N 3.09Å
1043	D	26.2	Very low	30.6	Very low	103 Å²	103	123.7 Å²	123.7	55%	0.551	66%	0.662	S	S	*	*			trans	-65.1	96.6	178.3	-93.7	-36.6	0	0	0	110.6	Y1041 A1045	Y1041-D1043 WeakPolarHBondContact CB-OD2 3.49Å; Y1041-D1043 WeakPolarHBondContact CD1-OD1 3.43Å; Y1041-D1043 PolarHBondContact O-N 3.36Å; D1043-A1045 HydrophobicContact CB-CB 3.95Å; D1043-A1045 PolarHBondContact O-N 3.43Å
1044	I	28	Very low	30.4	Very low	147 Å²	147	121.9 Å²	121.9	75%	0.754	66%	0.657	S	S	*	*			trans	-84.9	58.8	144.7	-49	-179	0	0	0	106.4	C1042 I1046	C1042-I1044 PolarHBondContact O-N 3.09Å; I1044-I1046 PolarHBondContact O-N 3.08Å
1045	A	26.4	Very low	30.2	Very low	44 Å²	44	124.9 Å²	124.9	36%	0.364	67%	0.673	S	S	.	*			trans	-67.1	122.8	-179.3	0	0	0	0	0	109	D1043 Q1047	D1043-A1045 HydrophobicContact CB-CB 3.95Å; D1043-A1045 PolarHBondContact O-N 3.43Å; A1045-Q1047 HydrophobicContact CB-CG 3.96Å; A1045-Q1047 PolarHBondContact O-N 2.79Å
1046	I	26.9	Very low	29.8	Very low	166 Å²	166	125.8 Å²	125.8	85%	0.851	67%	0.672	S	S	*	*			trans	-78.5	69.3	175.1	-53	177.3	0	0	0	107.7	I1044 T1048	I1044-I1046 PolarHBondContact O-N 3.08Å; I1046-T1048 PolarHBondContact O-N 3.24Å; I1046-T1048 VanDerWaalsContact O-N 3.13Å
1047	Q	27.4	Very low	29.6	Very low	167 Å²	167	127.1 Å²	127.1	78%	0.78	67%	0.673	S	S	*	*			trans	-76.9	100.2	178.4	-72.9	-175.6	-5.6	0	0	109.8	A1045	A1045-Q1047 HydrophobicContact CB-CG 3.96Å; A1045-Q1047 PolarHBondContact O-N 2.79Å
1048	T	28.2	Very low	29.2	Very low	127 Å²	127	129.8 Å²	129.8	78%	0.779	69%	0.691	S	S	*	*			trans	-57.9	140.9	153.5	49.2	0	0	0	0	109.4	I1046	I1046-T1048 PolarHBondContact O-N 3.24Å; I1046-T1048 VanDerWaalsContact O-N 3.13Å
1049	N	28.5	Very low	28.9	Very low	141 Å²	141	131 Å²	131	75%	0.754	70%	0.697	S	S	*	*			trans	-49.3	148.2	-179.4	-48.6	-18.2	0	0	0	113.5
1050	D	34.7	Very low	28.6	Very low	144 Å²	144	133.2 Å²	133.2	77%	0.77	71%	0.714	S	S	*	*				-177.1	136.8	98.6	-83.8	-24.9	0	0	0	113.1
1051	D	36	Very low	28.4	Very low	139 Å²	139	134.6 Å²	134.6	74%	0.743	72%	0.722	S	S	*	*			trans	54.2	108.3	148.4	-72.3	-9.2	0	0	0	125.7
1052	L	29.6	Very low	28.5	Very low	153 Å²	153	137.9 Å²	137.9	80%	0.801	74%	0.739	S	S	*	*				85.9	164.4	123.4	-101.9	72.5	0	0	0	121
1053	P	31.5	Very low	29	Very low	97 Å²	97	138 Å²	138	63%	0.63	74%	0.738	S	S	*	*				-139.6	167.9	-112.1	44.9	-26.2	0	0	0	119.3
1054	I	25.7	Very low	29	Very low	147 Å²	147	141.6 Å²	141.6	75%	0.754	76%	0.756	S	S	*	*			trans	39.1	119.6	140.3	-57	161.7	0	0	0	119.5
1055	L	27.7	Very low	29	Very low	161 Å²	161	140.5 Å²	140.5	84%	0.843	75%	0.752	S	S	*	*				-157.9	155.6	123.7	-153.7	55.7	0	0	0	114.2
1056	D	24.7	Very low	29	Very low	124 Å²	124	145 Å²	145	66%	0.663	77%	0.774	S	S	*	*			trans	-87.9	174.7	-177	-75.2	-74.1	0	0	0	116
1057	H	32.7	Very low	29	Very low	168 Å²	168	143.8 Å²	143.8	78%	0.778	77%	0.767	S	S	*	*			trans	108.1	141.1	155.1	-58.4	-58.3	0	0	0	117.2
1058	V	28.3	Very low	29.1	Very low	109 Å²	109	141.4 Å²	141.4	66%	0.661	76%	0.76	S	S	*	*			cis	149.5	141.7	-20.1	149.5	0	0	0	0	107.8
1059	H	27.7	Very low	29.1	Very low	178 Å²	178	142.5 Å²	142.5	82%	0.824	76%	0.756	S	S	*	*			trans	76.7	105.1	167.8	-76.8	-44.8	0	0	0	121.6
1060	S	25.5	Very low	29.2	Very low	95 Å²	95	140.1 Å²	140.1	66%	0.664	75%	0.75	S	S	*	*				74.2	121.7	108.8	-167.9	0	0	0	0	120.9
1061	L	27.2	Very low	29	Very low	170 Å²	170	142.4 Å²	142.4	89%	0.89	75%	0.753	S	S	*	*				-174.6	178.4	110.9	-96.6	163.5	0	0	0	112.7
1062	K	27.9	Very low	28.6	Very low	198 Å²	198	140.1 Å²	140.1	86%	0.861	75%	0.748	S	S	*	*			trans	-99.1	159.6	-171.1	-88.3	-175.5	174.7	-177.2	0	114
1063	P	38.1	Very low	28.6	Very low	121 Å²	121	139.2 Å²	139.2	79%	0.786	74%	0.743	S	S	*	*			trans	-86.1	164.3	-172.2	35.9	-38.1	0	0	0	114.4
1064	L	25.5	Very low	28.5	Very low	177 Å²	177	142.4 Å²	142.4	93%	0.927	75%	0.749	S	S	*	*			trans	-154.1	148.3	164.2	-115.9	159.9	0	0	0	113.7
1065	N	28.4	Very low	28.7	Very low	125 Å²	125	140.1 Å²	140.1	67%	0.668	74%	0.743	S	S	*	*			trans	-66.3	159.2	-176	-178.9	29.1	0	0	0	115.5
1066	V	27.6	Very low	28.8	Very low	137 Å²	137	139.7 Å²	139.7	83%	0.83	74%	0.741	S	S	*	*			trans	-166.6	152.7	140.8	134.6	0	0	0	0	111.8
1067	M	26.8	Very low	29.1	Very low	141 Å²	141	137.6 Å²	137.6	70%	0.695	75%	0.749	S	S	*	*			trans	-97.4	161.2	-172.4	-55.2	133.3	53.2	0	0	113.7
1068	N	28	Very low	29	Very low	118 Å²	118	138.7 Å²	138.7	63%	0.631	76%	0.756	S	S	*	*				172.2	136.3	106.3	-102.2	19.6	0	0	0	117.7
1069	E	28.2	Very low	29.2	Very low	149 Å²	149	141.7 Å²	141.7	70%	0.696	76%	0.763	S	S	*	*			trans	62.1	106.3	131	-65.1	-172	114.3	0	0	125.8
1070	S	31.2	Very low	29.4	Very low	92 Å²	92	141.4 Å²	141.4	64%	0.643	77%	0.767	S	S	*	*				82.3	137.8	103.4	-60.4	0	0	0	0	124.7
1071	K	31.3	Very low	29.7	Very low	192 Å²	192	141.6 Å²	141.6	84%	0.835	77%	0.768	S	S	*	*			trans	79.2	144.9	151.2	-69.2	155.2	-176.7	168.6	0	118.9
1072	S	27.5	Very low	30.1	Very low	91 Å²	91	139.5 Å²	139.5	64%	0.636	76%	0.763	S	S	*	*			cis	179.2	177	-11.6	54	0	0	0	0	111.4
1073	I	28.7	Very low	30.6	Very low	134 Å²	134	136.5 Å²	136.5	69%	0.687	76%	0.756	S	S	*	*			trans	80.2	105.1	157.1	-69.4	165.7	0	0	0	115.3
1074	Q	29.9	Very low	30.4	Very low	163 Å²	163	137.6 Å²	137.6	76%	0.762	76%	0.755	S	S	*	*				82.6	148	80.2	-75.4	179.7	-29.9	0	0	114
1075	T	30.3	Very low	30.9	Very low	100 Å²	100	135.3 Å²	135.3	61%	0.613	75%	0.753	S	S	*	*			cis	-166.3	178.5	-11.9	30	0	0	0	0	110.6
1076	D	29.8	Very low	31.2	Very low	151 Å²	151	135.1 Å²	135.1	81%	0.807	75%	0.751	S	S	*	*			trans	90.8	129.9	144.3	-59.4	-49	0	0	0	122.8
1077	G	30.5	Very low	31.6	Very low	80 Å²	80	133.9 Å²	133.9	83%	0.825	75%	0.748	S	S	*	*			trans	92.5	139.5	150.9	0	0	0	0	0	117.5
1078	M	31.3	Very low	32	Very low	191 Å²	191	133.9 Å²	133.9	94%	0.941	75%	0.751	S	S	*	*			cis	-157.8	158.4	-9.6	-161.5	165.1	-173.2	0	0	110.2
1079	E	32.8	Very low	32.4	Very low	172 Å²	172	136 Å²	136	80%	0.804	76%	0.763	S	S	*	*			trans	-75.6	157	-176.8	-50	169.4	118.5	0	0	113.6
1080	L	31.8	Very low	33	Very low	172 Å²	172	137 Å²	137	90%	0.901	77%	0.773	S	S	*	*				-158.9	151.2	113.9	-149	61.7	0	0	0	112.6
1081	S	31.6	Very low	34.1	Very low	99 Å²	99	142 Å²	142	69%	0.692	78%	0.778	S	S	*	*			trans	-120.7	157.3	-173.9	50.5	0	0	0	0	112.6
1082	T	34.1	Very low	35.1	Very low	126 Å²	126	138.2 Å²	138.2	77%	0.773	77%	0.772	S	S	*	*			trans	-153.8	108.9	158.7	-53.1	0	0	0	0	112.1
1083	N	38.3	Very low	36.5	Very low	136 Å²	136	136 Å²	136	73%	0.727	76%	0.757	S	S	*	*			trans	27.1	115.5	149.2	-47.4	-26.5	0	0	0	119.6
1084	L	34.1	Very low	38.7	Very low	144 Å²	144	132.3 Å²	132.3	75%	0.754	74%	0.741	S	S	*	*				65.4	113.3	73.4	-90.1	75.2	0	0	0	116.6	I1086	L1084-I1086 HydrophobicContact CD2-CD1 3.77Å; L1084-I1086 HydrophobicContact CD2-CG1 4.43Å; L1084-I1086 HydrophobicContact CG-CD1 4.15Å; L1084-I1086 HydrophobicContact CG-CG1 4.34Å
1085	S	37.4	Very low	40.9	Very low	129 Å²	129	130.6 Å²	130.6	90%	0.902	74%	0.736	S	S	*	*			trans	-144.2	137	132.9	47.9	0	0	0	0	108.1
1086	I	34.9	Very low	43.1	Very low	120 Å²	120	132.8 Å²	132.8	62%	0.615	74%	0.739	S	S	*	*			trans	-120.5	131.1	-161.4	-65.4	172.1	0	0	0	112.4	L1084 N1088	L1084-I1086 HydrophobicContact CD2-CD1 3.77Å; L1084-I1086 HydrophobicContact CD2-CG1 4.43Å; L1084-I1086 HydrophobicContact CG-CD1 4.15Å; L1084-I1086 HydrophobicContact CG-CG1 4.34Å; I1086-N1088 WeakPolarHBondContact CG2-OD1 3.27Å
1087	S	35.3	Very low	45.1	Very low	111 Å²	111	129.3 Å²	129.3	78%	0.776	72%	0.718	S	S	*	*			trans	-163.8	80.3	153.9	56.4	0	0	0	0	108.9
1088	N	34.8	Very low	47.2	Very low	142 Å²	142	131.8 Å²	131.8	76%	0.759	70%	0.703	S	S	*	*				73.1	89.9	92.8	-69.7	-13.3	0	0	0	114.1	I1086	I1086-N1088 WeakPolarHBondContact CG2-OD1 3.27Å
1089	D	37.5	Very low	49.1	Very low	163 Å²	163	128.6 Å²	128.6	87%	0.872	69%	0.687	S	S	*	*				-162.2	30.5	122.3	-139.8	1.7	0	0	0	115.1	R1091	D1089-R1091 PolarHBondContact O-N 2.87Å
1090	D	40.5	Very low	51.2	Low	168 Å²	168	125.3 Å²	125.3	90%	0.898	67%	0.673	S	S	*	*			trans	-82	104.4	-178.7	-76.9	-57.7	0	0	0	113
1091	R	54.5	Low	53.3	Low	199 Å²	199	121.6 Å²	121.6	75%	0.751	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-78.7	121.6	164.2	178.9	179.8	171.8	-156.4	-8.1	109.2	D1089 S1093	D1089-R1091 PolarHBondContact O-N 2.87Å; R1091-S1093 PolarHBondContact O-N 3.25Å
1092	P	51.3	Low	55.4	Low	111 Å²	111	119.7 Å²	119.7	72%	0.721	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-65.4	129.8	-178.2	26.1	-34.2	0	0	0	111.3	T1094	P1092-T1094 PolarHBondContact O-N 2.98Å
1093	S	56.5	Low	57.4	Low	44 Å²	44	120.3 Å²	120.3	31%	0.308	64%	0.635	S	S	.	*	P	Polyproline II helix	trans	-62.4	135.3	-177.6	64.5	0	0	0	0	111.7	R1091 R1098	R1091-S1093 PolarHBondContact O-N 3.25Å; S1093-R1098 PolarHBondContact O-NE 3.21Å; S1093-R1098 PolarHBondContact O-NH2 3.47Å; S1093-R1098 PolarHBondContact OG-NE 3.44Å
1094	T	76.3	Confident	59.2	Low	58 Å²	58	118 Å²	118	36%	0.356	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-65.6	161.1	177.5	63.9	0	0	0	0	111	P1092 Q1096 E1097 R1098	P1092-T1094 PolarHBondContact O-N 2.98Å; T1094-Q1096 PolarHBondContact O-N 3.25Å; T1094-E1097 VanDerWaalsContact CB-OE2 3.24Å; T1094-E1097 WeakPolarHBondContact CB-OE2 3.41Å; T1094-E1097 VanDerWaalsContact CG2-OE2 3.31Å; T1094-E1097 WeakPolarHBondContact CG2-OE2 3.48Å; T1094-E1097 PolarHBondContact N-OE2 3.43Å; T1094-E1097 PolarHBondContact O-N 3.42Å; T1094-E1097 VanDerWaalsContact OG1-CD 3.29Å; T1094-E1097 WeakPolarHBondContact OG1-CG 3.44Å; T1094-E1097 PolarHBondContact OG1-N 3.3Å; T1094-E1097 PolarHBondContact OG1-OE2 3.11Å; T1094-R1098 PolarHBondContact O-N 3.16Å; T1094-R1098 VanDerWaalsContact O-N 3.13Å
1095	L	75.8	Confident	61.4	Low	126 Å²	126	115.6 Å²	115.6	66%	0.66	61%	0.61	S	S	*	*	H	α-helix	trans	-57.5	-34.8	173.5	-176.9	63.7	0	0	0	111.6	R1098 M1099	L1095-R1098 PolarHBondContact O-N 3.09Å; L1095-M1099 HydrophobicContact CG-SD 4.28Å; L1095-M1099 VanDerWaalsContact O-CG 3.3Å; L1095-M1099 WeakPolarHBondContact O-CG 3.3Å; L1095-M1099 PolarHBondContact O-N 2.79Å
1096	Q	75.9	Confident	63.4	Low	147 Å²	147	115.7 Å²	115.7	69%	0.687	60%	0.595	S	S	*	*	H	α-helix	trans	-75.5	-33.8	-178.2	-169.7	165.4	-1.3	0	0	112.9	T1094 M1100	T1094-Q1096 PolarHBondContact O-N 3.25Å; Q1096-M1100 WeakPolarHBondContact O-CB 3.45Å; Q1096-M1100 PolarHBondContact O-N 3.11Å
1097	E	72	Confident	65.3	Low	78 Å²	78	115.7 Å²	115.7	36%	0.364	59%	0.594	S	S	.	*	H	α-helix	trans	-62.4	-47.2	168.4	-75.7	151.7	150.6	0	0	110.2	T1094 M1099 M1100 E1101	T1094-E1097 VanDerWaalsContact CB-OE2 3.24Å; T1094-E1097 WeakPolarHBondContact CB-OE2 3.41Å; T1094-E1097 VanDerWaalsContact CG2-OE2 3.31Å; T1094-E1097 WeakPolarHBondContact CG2-OE2 3.48Å; T1094-E1097 PolarHBondContact N-OE2 3.43Å; T1094-E1097 PolarHBondContact O-N 3.42Å; T1094-E1097 VanDerWaalsContact OG1-CD 3.29Å; T1094-E1097 WeakPolarHBondContact OG1-CG 3.44Å; T1094-E1097 PolarHBondContact OG1-N 3.3Å; T1094-E1097 PolarHBondContact OG1-OE2 3.11Å; E1097-M1099 PolarHBondContact O-N 2.95Å; E1097-M1100 CarbonylContact O-C 3.43Å; E1097-M1100 WeakPolarHBondContact O-CB 3.4Å; E1097-M1100 PolarHBondContact O-N 3.45Å; E1097-M1100 VanDerWaalsContact O-N 3.08Å; E1097-E1101 VanDerWaalsContact O-CG 3.29Å; E1097-E1101 WeakPolarHBondContact O-CG 3.32Å; E1097-E1101 PolarHBondContact O-N 3.32Å
1098	R	73.6	Confident	67.3	Low	132 Å²	132	114.9 Å²	114.9	50%	0.498	58%	0.578	S	S	.	*	H	α-helix	trans	-64.9	-31.5	176.8	-87.2	178.1	-81.5	156.5	-6.4	115.1	S1093 T1094 L1095 E1101 A1102	S1093-R1098 PolarHBondContact O-NE 3.21Å; S1093-R1098 PolarHBondContact O-NH2 3.47Å; S1093-R1098 PolarHBondContact OG-NE 3.44Å; T1094-R1098 PolarHBondContact O-N 3.16Å; T1094-R1098 VanDerWaalsContact O-N 3.13Å; L1095-R1098 PolarHBondContact O-N 3.09Å; R1098-E1101 WeakPolarHBondContact CA-OE2 3.36Å; R1098-E1101 VanDerWaalsContact CG-OE2 3.26Å; R1098-E1101 WeakPolarHBondContact CG-OE2 3.42Å; R1098-A1102 WeakPolarHBondContact O-CB 3.33Å; R1098-A1102 PolarHBondContact O-N 3.41Å; R1098-A1102 VanDerWaalsContact O-N 3.15Å
1099	M	72.9	Confident	69.2	Low	124 Å²	124	112.1 Å²	112.1	61%	0.611	56%	0.561	S	S	*	*	H	α-helix	trans	-68.6	-39.4	170.6	-73.3	175.7	70.6	0	0	111.6	L1095 E1097 A1102 E1103	L1095-M1099 HydrophobicContact CG-SD 4.28Å; L1095-M1099 VanDerWaalsContact O-CG 3.3Å; L1095-M1099 WeakPolarHBondContact O-CG 3.3Å; L1095-M1099 PolarHBondContact O-N 2.79Å; E1097-M1099 PolarHBondContact O-N 2.95Å; M1099-A1102 PolarHBondContact O-N 3.38Å; M1099-E1103 PolarHBondContact O-N 3.08Å
1100	M	76.4	Confident	70.9	Confident	103 Å²	103	107.8 Å²	107.8	51%	0.507	54%	0.535	S	S	.	.	H	α-helix	trans	-68.2	-41	176.8	-164.2	-171.8	-45.8	0	0	111.8	Q1096 E1097 A1102 E1103 I1104	Q1096-M1100 WeakPolarHBondContact O-CB 3.45Å; Q1096-M1100 PolarHBondContact O-N 3.11Å; E1097-M1100 CarbonylContact O-C 3.43Å; E1097-M1100 WeakPolarHBondContact O-CB 3.4Å; E1097-M1100 PolarHBondContact O-N 3.45Å; E1097-M1100 VanDerWaalsContact O-N 3.08Å; M1100-A1102 VanDerWaalsContact C-N 3.33Å; M1100-A1102 PolarHBondContact O-N 3.12Å; M1100-E1103 PolarHBondContact O-N 3.23Å; M1100-I1104 HydrophobicContact CG-CD1 4.16Å; M1100-I1104 WeakPolarHBondContact O-CB 3.34Å; M1100-I1104 WeakPolarHBondContact O-CD1 3.29Å; M1100-I1104 VanDerWaalsContact O-CG1 3.23Å; M1100-I1104 WeakPolarHBondContact O-CG1 3.31Å; M1100-I1104 PolarHBondContact O-N 3.47Å
1101	E	75.2	Confident	72.6	Confident	94 Å²	94	104.2 Å²	104.2	44%	0.439	52%	0.515	S	S	.	.	H	α-helix	trans	-57.6	-43.5	172.2	-71.6	160.6	-169.4	0	0	111.5	E1097 R1098 I1104 L1105	E1097-E1101 VanDerWaalsContact O-CG 3.29Å; E1097-E1101 WeakPolarHBondContact O-CG 3.32Å; E1097-E1101 PolarHBondContact O-N 3.32Å; R1098-E1101 WeakPolarHBondContact CA-OE2 3.36Å; R1098-E1101 VanDerWaalsContact CG-OE2 3.26Å; R1098-E1101 WeakPolarHBondContact CG-OE2 3.42Å; E1101-I1104 PolarHBondContact O-N 2.98Å; E1101-L1105 WeakPolarHBondContact O-CB 3.23Å; E1101-L1105 WeakPolarHBondContact O-CG 3.32Å; E1101-L1105 PolarHBondContact O-N 3.37Å
1102	A	75.8	Confident	73.8	Confident	59 Å²	59	100.5 Å²	100.5	49%	0.488	51%	0.506	S	S	.	.	H	α-helix	trans	-67.4	-38.2	176	0	0	0	0	0	113.1	R1098 M1099 M1100 L1105 H1106	R1098-A1102 WeakPolarHBondContact O-CB 3.33Å; R1098-A1102 PolarHBondContact O-N 3.41Å; R1098-A1102 VanDerWaalsContact O-N 3.15Å; M1099-A1102 PolarHBondContact O-N 3.38Å; M1100-A1102 VanDerWaalsContact C-N 3.33Å; M1100-A1102 PolarHBondContact O-N 3.12Å; A1102-L1105 PolarHBondContact O-N 3.27Å; A1102-H1106 WeakPolarHBondContact O-CB 3.47Å; A1102-H1106 PolarHBondContact O-N 2.79Å
1103	E	76.5	Confident	75.1	Confident	138 Å²	138	99.8 Å²	99.8	65%	0.645	49%	0.489	S	S	*	.	H	α-helix	trans	-69.6	-37	176.3	-170.2	167.7	-154.3	0	0	112	M1099 M1100 H1106 M1107	M1099-E1103 PolarHBondContact O-N 3.08Å; M1100-E1103 PolarHBondContact O-N 3.23Å; E1103-H1106 PolarHBondContact O-N 3.38Å; E1103-M1107 WeakPolarHBondContact O-CB 3.25Å; E1103-M1107 WeakPolarHBondContact O-CG 3.27Å; E1103-M1107 PolarHBondContact O-N 3.43Å
1104	I	75.8	Confident	76	Confident	87 Å²	87	101.2 Å²	101.2	45%	0.446	49%	0.493	S	S	.	.	H	α-helix	trans	-61.5	-50.1	170.7	-70.8	163.3	0	0	0	110.4	M1100 E1101 H1106 M1107 E1108	M1100-I1104 HydrophobicContact CG-CD1 4.16Å; M1100-I1104 WeakPolarHBondContact O-CB 3.34Å; M1100-I1104 WeakPolarHBondContact O-CD1 3.29Å; M1100-I1104 VanDerWaalsContact O-CG1 3.23Å; M1100-I1104 WeakPolarHBondContact O-CG1 3.31Å; M1100-I1104 PolarHBondContact O-N 3.47Å; E1101-I1104 PolarHBondContact O-N 2.98Å; I1104-H1106 VanDerWaalsContact C-N 3.28Å; I1104-H1106 PolarHBondContact O-N 3.3Å; I1104-M1107 WeakPolarHBondContact O-CB 3.28Å; I1104-M1107 PolarHBondContact O-N 3.21Å; I1104-M1107 VanDerWaalsContact O-N 3.12Å; I1104-E1108 HydrophobicContact CG2-CG 4.39Å; I1104-E1108 WeakPolarHBondContact O-CG 3.25Å; I1104-E1108 PolarHBondContact O-N 2.99Å
1105	L	79.7	Confident	76.1	Confident	95 Å²	95	102.4 Å²	102.4	50%	0.497	50%	0.497	S	S	.	.	H	α-helix	trans	-60	-36.5	177.8	-76.2	167.2	0	0	0	112.8	E1101 A1102 Q1109	E1101-L1105 WeakPolarHBondContact O-CB 3.23Å; E1101-L1105 WeakPolarHBondContact O-CG 3.32Å; E1101-L1105 PolarHBondContact O-N 3.37Å; A1102-L1105 PolarHBondContact O-N 3.27Å; L1105-Q1109 WeakPolarHBondContact O-CG 3.33Å; L1105-Q1109 PolarHBondContact O-N 2.81Å; L1105-Q1109 VanDerWaalsContact O-N 3.09Å
1106	H	79.1	Confident	76	Confident	130 Å²	130	100 Å²	100	60%	0.602	48%	0.484	S	S	*	.	H	α-helix	trans	-67.4	-43.3	173.9	179.3	-91.8	0	0	0	112.1	A1102 E1103 I1104 E1108 Q1109 E1110	A1102-H1106 WeakPolarHBondContact O-CB 3.47Å; A1102-H1106 PolarHBondContact O-N 2.79Å; E1103-H1106 PolarHBondContact O-N 3.38Å; I1104-H1106 VanDerWaalsContact C-N 3.28Å; I1104-H1106 PolarHBondContact O-N 3.3Å; H1106-E1108 PolarHBondContact O-N 3.46Å; H1106-Q1109 PolarHBondContact O-N 3.08Å; H1106-E1110 PolarHBondContact O-N 2.64Å
1107	M	75.5	Confident	76.1	Confident	120 Å²	120	96.4 Å²	96.4	59%	0.591	47%	0.469	S	S	*	.	H	α-helix	trans	-61.4	-41.4	174.4	-72.3	-95.4	-76.4	0	0	112	E1103 I1104 E1110 I1111	E1103-M1107 WeakPolarHBondContact O-CB 3.25Å; E1103-M1107 WeakPolarHBondContact O-CG 3.27Å; E1103-M1107 PolarHBondContact O-N 3.43Å; I1104-M1107 WeakPolarHBondContact O-CB 3.28Å; I1104-M1107 PolarHBondContact O-N 3.21Å; I1104-M1107 VanDerWaalsContact O-N 3.12Å; M1107-E1110 PolarHBondContact O-N 3.43Å; M1107-I1111 WeakPolarHBondContact O-CB 3.47Å; M1107-I1111 VanDerWaalsContact O-CG1 3.26Å; M1107-I1111 WeakPolarHBondContact O-CG1 3.37Å; M1107-I1111 PolarHBondContact O-N 3.2Å
1108	E	77.2	Confident	76.2	Confident	94 Å²	94	95.3 Å²	95.3	44%	0.439	47%	0.468	S	S	.	.	H	α-helix	trans	-63.5	-40.2	176	-73.5	179.1	166.2	0	0	112.4	I1104 H1106 I1111 Q1112	I1104-E1108 HydrophobicContact CG2-CG 4.39Å; I1104-E1108 WeakPolarHBondContact O-CG 3.25Å; I1104-E1108 PolarHBondContact O-N 2.99Å; H1106-E1108 PolarHBondContact O-N 3.46Å; E1108-I1111 PolarHBondContact O-N 3.41Å; E1108-Q1112 WeakPolarHBondContact O-CG 3.46Å; E1108-Q1112 PolarHBondContact O-N 3.46Å
1109	Q	75.6	Confident	76	Confident	84 Å²	84	96.5 Å²	96.5	39%	0.393	47%	0.473	S	S	.	.	H	α-helix	trans	-64.8	-42.7	175.1	-73.7	176.6	30.2	0	0	112.2	L1105 H1106 Q1112 R1113	L1105-Q1109 WeakPolarHBondContact O-CG 3.33Å; L1105-Q1109 PolarHBondContact O-N 2.81Å; L1105-Q1109 VanDerWaalsContact O-N 3.09Å; H1106-Q1109 PolarHBondContact O-N 3.08Å; Q1109-Q1112 PolarHBondContact O-N 2.86Å; Q1109-R1113 PolarHBondContact O-N 3.01Å
1110	E	73.6	Confident	75.9	Confident	72 Å²	72	93.1 Å²	93.1	34%	0.336	45%	0.453	S	S	.	.	H	α-helix	trans	-67.4	-36.8	176.3	179.8	59.2	-170.7	0	0	111.8	H1106 M1107 Q1112 R1113 L1114	H1106-E1110 PolarHBondContact O-N 2.64Å; M1107-E1110 PolarHBondContact O-N 3.43Å; E1110-Q1112 PolarHBondContact O-N 3.3Å; E1110-R1113 PolarHBondContact O-N 2.99Å; E1110-R1113 IonicContact OE1-CZ 3.11Å; E1110-R1113 IonicContact OE1-NE 3.86Å; E1110-R1113 IonicContact OE1-NH2 3.68Å; E1110-R1113 PolarHBondContact OE1-NH2 3.5Å; E1110-R1113 IonicContact OE2-CZ 3.86Å; E1110-R1113 IonicContact OE2-NE 3.79Å; E1110-R1113 PolarHBondContact OE2-NE 3.29Å; E1110-R1113 IonicContact OE2-NH2 3.39Å; E1110-R1113 PolarHBondContact OE2-NH2 2.98Å; E1110-L1114 HydrophobicContact CG-CD1 4.05Å; E1110-L1114 HydrophobicContact CG-CG 4.41Å; E1110-L1114 WeakPolarHBondContact O-CB 3.3Å; E1110-L1114 VanDerWaalsContact O-CG 3.28Å; E1110-L1114 WeakPolarHBondContact O-CG 3.28Å; E1110-L1114 PolarHBondContact O-N 3.32Å
1111	I	75.7	Confident	75.7	Confident	94 Å²	94	91.3 Å²	91.3	48%	0.482	45%	0.448	S	S	.	.	H	α-helix	trans	-60.8	-43.5	171.5	-72.6	165.5	0	0	0	110.9	M1107 E1108 L1114 N1115	M1107-I1111 WeakPolarHBondContact O-CB 3.47Å; M1107-I1111 VanDerWaalsContact O-CG1 3.26Å; M1107-I1111 WeakPolarHBondContact O-CG1 3.37Å; M1107-I1111 PolarHBondContact O-N 3.2Å; E1108-I1111 PolarHBondContact O-N 3.41Å; I1111-L1114 PolarHBondContact O-N 3.17Å; I1111-N1115 WeakPolarHBondContact O-CB 3.47Å; I1111-N1115 VanDerWaalsContact O-CG 3.28Å; I1111-N1115 PolarHBondContact O-N 2.95Å; I1111-N1115 PolarHBondContact O-ND2 3.46Å
1112	Q	78.7	Confident	75.5	Confident	121 Å²	121	88.3 Å²	88.3	57%	0.565	43%	0.433	S	S	*	.	H	α-helix	trans	-62	-44.8	174.6	-71.8	175.3	41.1	0	0	111.8	E1108 Q1109 E1110 L1114 N1115 I1116	E1108-Q1112 WeakPolarHBondContact O-CG 3.46Å; E1108-Q1112 PolarHBondContact O-N 3.46Å; Q1109-Q1112 PolarHBondContact O-N 2.86Å; E1110-Q1112 PolarHBondContact O-N 3.3Å; Q1112-L1114 PolarHBondContact O-N 2.96Å; Q1112-N1115 PolarHBondContact O-N 2.96Å; Q1112-I1116 WeakPolarHBondContact O-CG1 3.19Å; Q1112-I1116 PolarHBondContact O-N 3.25Å; Q1112-I1116 VanDerWaalsContact O-N 3.12Å
1113	R	79.1	Confident	75.3	Confident	95 Å²	95	88.4 Å²	88.4	36%	0.358	43%	0.433	S	S	.	.	H	α-helix	trans	-61.5	-44	178	-163.8	-169.8	69.7	78.9	5.1	112.2	Q1109 E1110 I1116 L1117	Q1109-R1113 PolarHBondContact O-N 3.01Å; E1110-R1113 PolarHBondContact O-N 2.99Å; E1110-R1113 IonicContact OE1-CZ 3.11Å; E1110-R1113 IonicContact OE1-NE 3.86Å; E1110-R1113 IonicContact OE1-NH2 3.68Å; E1110-R1113 PolarHBondContact OE1-NH2 3.5Å; E1110-R1113 IonicContact OE2-CZ 3.86Å; E1110-R1113 IonicContact OE2-NE 3.79Å; E1110-R1113 PolarHBondContact OE2-NE 3.29Å; E1110-R1113 IonicContact OE2-NH2 3.39Å; E1110-R1113 PolarHBondContact OE2-NH2 2.98Å; R1113-I1116 PolarHBondContact O-N 3.45Å; R1113-L1117 PolarHBondContact O-N 3.44Å
1114	L	75.3	Confident	75	Confident	74 Å²	74	85.6 Å²	85.6	39%	0.387	42%	0.42	S	S	.	.	H	α-helix	trans	-65.5	-41.7	176.7	-71.1	170.5	0	0	0	111.8	E1110 I1111 Q1112 I1116 L1117 V1118	E1110-L1114 HydrophobicContact CG-CD1 4.05Å; E1110-L1114 HydrophobicContact CG-CG 4.41Å; E1110-L1114 WeakPolarHBondContact O-CB 3.3Å; E1110-L1114 VanDerWaalsContact O-CG 3.28Å; E1110-L1114 WeakPolarHBondContact O-CG 3.28Å; E1110-L1114 PolarHBondContact O-N 3.32Å; I1111-L1114 PolarHBondContact O-N 3.17Å; Q1112-L1114 PolarHBondContact O-N 2.96Å; L1114-I1116 VanDerWaalsContact C-N 3.32Å; L1114-I1116 PolarHBondContact O-N 3.39Å; L1114-L1117 PolarHBondContact O-N 3.41Å; L1114-V1118 WeakPolarHBondContact O-CB 3.5Å; L1114-V1118 VanDerWaalsContact O-CG2 3.27Å; L1114-V1118 WeakPolarHBondContact O-CG2 3.37Å; L1114-V1118 PolarHBondContact O-N 3.3Å
1115	N	77.5	Confident	74.7	Confident	83 Å²	83	85.9 Å²	85.9	44%	0.444	42%	0.421	S	S	.	.	H	α-helix	trans	-60	-38.5	176	-79.4	-40.8	0	0	0	112.7	I1111 Q1112 R1119	I1111-N1115 WeakPolarHBondContact O-CB 3.47Å; I1111-N1115 VanDerWaalsContact O-CG 3.28Å; I1111-N1115 PolarHBondContact O-N 2.95Å; I1111-N1115 PolarHBondContact O-ND2 3.46Å; Q1112-N1115 PolarHBondContact O-N 2.96Å; N1115-R1119 WeakPolarHBondContact O-CG 3.45Å; N1115-R1119 PolarHBondContact O-N 2.86Å
1116	I	75.6	Confident	74.3	Confident	76 Å²	76	82.7 Å²	82.7	39%	0.39	41%	0.411	S	S	.	.	H	α-helix	trans	-65.1	-46.5	175.7	-67	165.8	0	0	0	110.9	I1003 Q1112 R1113 L1114 V1118 R1119 Y1120	I1003-I1116 HydrophobicContact CD1-CG2 4.41Å; I1003-I1116 HydrophobicContact CG2-CG2 4.39Å; Q1112-I1116 WeakPolarHBondContact O-CG1 3.19Å; Q1112-I1116 PolarHBondContact O-N 3.25Å; Q1112-I1116 VanDerWaalsContact O-N 3.12Å; R1113-I1116 PolarHBondContact O-N 3.45Å; L1114-I1116 VanDerWaalsContact C-N 3.32Å; L1114-I1116 PolarHBondContact O-N 3.39Å; I1116-V1118 VanDerWaalsContact C-N 3.35Å; I1116-V1118 PolarHBondContact O-N 2.95Å; I1116-R1119 PolarHBondContact O-N 3.32Å; I1116-Y1120 PolarHBondContact O-N 3.13Å
1117	L	77.9	Confident	74.1	Confident	71 Å²	71	80.6 Å²	80.6	37%	0.372	40%	0.404	S	S	.	.	H	α-helix	trans	-63.8	-39.3	178.8	-178.3	62.4	0	0	0	112.5	L1037 R1113 L1114 Y1120 T1121	L1037-L1117 HydrophobicContact CD2-CD1 4.43Å; R1113-L1117 PolarHBondContact O-N 3.44Å; L1114-L1117 PolarHBondContact O-N 3.41Å; L1117-Y1120 PolarHBondContact O-N 3.41Å; L1117-T1121 HydrophobicContact CD1-CG2 4.39Å; L1117-T1121 WeakPolarHBondContact O-CG2 3.49Å; L1117-T1121 PolarHBondContact O-N 3.22Å; L1117-T1121 PolarHBondContact O-OG1 3.38Å
1118	V	74	Confident	74.1	Confident	56 Å²	56	78.7 Å²	78.7	34%	0.339	39%	0.394	S	S	.	.	H	α-helix	trans	-65	-40	176.3	165.2	0	0	0	0	111.3	L1114 I1116 T1121 R1122	L1114-V1118 WeakPolarHBondContact O-CB 3.5Å; L1114-V1118 VanDerWaalsContact O-CG2 3.27Å; L1114-V1118 WeakPolarHBondContact O-CG2 3.37Å; L1114-V1118 PolarHBondContact O-N 3.3Å; I1116-V1118 VanDerWaalsContact C-N 3.35Å; I1116-V1118 PolarHBondContact O-N 2.95Å; V1118-T1121 PolarHBondContact O-OG1 3.18Å; V1118-R1122 VanDerWaalsContact O-CB 3.3Å; V1118-R1122 WeakPolarHBondContact O-CB 3.45Å; V1118-R1122 PolarHBondContact O-N 2.74Å; V1118-R1122 VanDerWaalsContact O-N 3.09Å
1119	R	69.4	Low	74	Confident	157 Å²	157	79.1 Å²	79.1	59%	0.592	40%	0.397	S	S	*	.	H	α-helix	trans	-65.8	-45.5	173.4	-74.3	173.4	178.6	-177.2	1.2	112.8	N1115 I1116 R1122 A1123	N1115-R1119 WeakPolarHBondContact O-CG 3.45Å; N1115-R1119 PolarHBondContact O-N 2.86Å; I1116-R1119 PolarHBondContact O-N 3.32Å; R1119-R1122 PolarHBondContact O-N 2.82Å; R1119-A1123 PolarHBondContact O-N 3.1Å
1120	Y	69.6	Low	73.8	Confident	53 Å²	53	81.4 Å²	81.4	21%	0.208	41%	0.408	C	S	.	.	H	α-helix	trans	-57.5	-52.6	176.8	173	-82.7	0	0	0	111.3	R1000 I1116 L1117 R1122 A1123 E1124	R1000-Y1120 PolarHBondContact NH1-OH 3.35Å; I1116-Y1120 PolarHBondContact O-N 3.13Å; L1117-Y1120 PolarHBondContact O-N 3.41Å; Y1120-R1122 VanDerWaalsContact C-N 3.29Å; Y1120-R1122 PolarHBondContact O-N 2.91Å; Y1120-A1123 PolarHBondContact O-N 2.72Å; Y1120-A1123 VanDerWaalsContact O-N 3.16Å; Y1120-E1124 HydrophobicContact CE1-CB 4.43Å; Y1120-E1124 WeakPolarHBondContact CE1-OE1 3.22Å; Y1120-E1124 WeakPolarHBondContact CE1-OE2 3.28Å; Y1120-E1124 PolarHBondContact O-N 3.09Å; Y1120-E1124 PolarHBondContact OH-OE1 3.19Å
1121	T	72.4	Confident	73.8	Confident	65 Å²	65	85.9 Å²	85.9	40%	0.399	42%	0.421	S	S	.	.	H	α-helix	trans	-65.9	-31	-177.4	49.4	0	0	0	0	112.7	L1117 V1118 M1125	L1117-T1121 HydrophobicContact CD1-CG2 4.39Å; L1117-T1121 WeakPolarHBondContact O-CG2 3.49Å; L1117-T1121 PolarHBondContact O-N 3.22Å; L1117-T1121 PolarHBondContact O-OG1 3.38Å; V1118-T1121 PolarHBondContact O-OG1 3.18Å; T1121-M1125 WeakPolarHBondContact O-CB 3.18Å; T1121-M1125 PolarHBondContact O-N 3.14Å
1122	R	72.3	Confident	73.7	Confident	31 Å²	31	88.6 Å²	88.6	12%	0.117	43%	0.425	C	S	.	.	H	α-helix	trans	-69.7	-39.3	173	-167.1	175.5	-65.3	108.7	-0.1	112.6	E65 M66 E69 V1118 R1119 Y1120 G1126	E65-R1122 IonicContact OE2-CZ 2.79Å; E65-R1122 IonicContact OE2-NH2 3.6Å; E65-R1122 PolarHBondContact OE2-NH2 2.72Å; M66-R1122 HydrophobicContact CG-CG 3.86Å; E69-R1122 IonicContact OE1-CZ 3.49Å; E69-R1122 IonicContact OE1-NH1 2.69Å; E69-R1122 PolarHBondContact OE1-NH1 3.41Å; E69-R1122 WeakPolarHBondContact OE2-CD 3.44Å; E69-R1122 IonicContact OE2-CZ 2.72Å; E69-R1122 IonicContact OE2-NE 3.45Å; E69-R1122 IonicContact OE2-NH1 3.1Å; E69-R1122 PolarHBondContact OE2-NH1 3.25Å; V1118-R1122 VanDerWaalsContact O-CB 3.3Å; V1118-R1122 WeakPolarHBondContact O-CB 3.45Å; V1118-R1122 PolarHBondContact O-N 2.74Å; V1118-R1122 VanDerWaalsContact O-N 3.09Å; R1119-R1122 PolarHBondContact O-N 2.82Å; Y1120-R1122 VanDerWaalsContact C-N 3.29Å; Y1120-R1122 PolarHBondContact O-N 2.91Å; R1122-G1126 PolarHBondContact O-N 3.39Å
1123	A	70.1	Confident	73.5	Confident	60 Å²	60	85.6 Å²	85.6	50%	0.496	41%	0.413	S	S	.	.	H	α-helix	trans	-65	-45.6	174.6	0	0	0	0	0	111.9	R1119 Y1120 G1126 L1127	R1119-A1123 PolarHBondContact O-N 3.1Å; Y1120-A1123 PolarHBondContact O-N 2.72Å; Y1120-A1123 VanDerWaalsContact O-N 3.16Å; A1123-G1126 PolarHBondContact O-N 3.42Å; A1123-L1127 PolarHBondContact O-N 3.24Å
1124	E	70.4	Confident	73.1	Confident	79 Å²	79	84.2 Å²	84.2	37%	0.369	42%	0.417	S	S	.	.	H	α-helix	trans	-58.6	-47.5	176.2	-172.8	172.3	-118.4	0	0	111.9	Y1120 G1126 L1127 E1128	Y1120-E1124 HydrophobicContact CE1-CB 4.43Å; Y1120-E1124 WeakPolarHBondContact CE1-OE1 3.22Å; Y1120-E1124 WeakPolarHBondContact CE1-OE2 3.28Å; Y1120-E1124 PolarHBondContact O-N 3.09Å; Y1120-E1124 PolarHBondContact OH-OE1 3.19Å; E1124-G1126 VanDerWaalsContact C-N 3.33Å; E1124-G1126 PolarHBondContact O-N 2.94Å; E1124-L1127 PolarHBondContact O-N 2.89Å; E1124-E1128 PolarHBondContact O-N 2.92Å
1125	M	70.1	Confident	73.2	Confident	93 Å²	93	84.5 Å²	84.5	46%	0.458	42%	0.417	S	S	.	.	H	α-helix	trans	-64	-35.9	175.1	-171.9	179.1	67.8	0	0	112.6	M66 T1121 M1129	M66-M1125 HydrophobicContact CE-CE 4.38Å; M66-M1125 HydrophobicContact CG-CE 4.36Å; M66-M1125 HydrophobicContact SD-CE 3.72Å; T1121-M1125 WeakPolarHBondContact O-CB 3.18Å; T1121-M1125 PolarHBondContact O-N 3.14Å; M1125-M1129 VanDerWaalsContact O-CB 3.29Å; M1125-M1129 WeakPolarHBondContact O-CB 3.29Å; M1125-M1129 PolarHBondContact O-N 3.14Å
1126	G	71.3	Confident	73.3	Confident	29 Å²	29	84.7 Å²	84.7	30%	0.299	42%	0.417	S	S	.	.	H	α-helix	trans	-62.2	-43.4	175	0	0	0	0	0	112.9	R1122 A1123 E1124 M1129 Q1130	R1122-G1126 PolarHBondContact O-N 3.39Å; A1123-G1126 PolarHBondContact O-N 3.42Å; E1124-G1126 VanDerWaalsContact C-N 3.33Å; E1124-G1126 PolarHBondContact O-N 2.94Å; G1126-M1129 PolarHBondContact O-N 3.44Å; G1126-Q1130 WeakPolarHBondContact O-CB 3.16Å; G1126-Q1130 PolarHBondContact O-N 2.75Å
1127	L	74.6	Confident	73.3	Confident	85 Å²	85	84.2 Å²	84.2	45%	0.445	41%	0.411	S	S	.	.	H	α-helix	trans	-65.6	-46.7	178.3	-70.6	173.7	0	0	0	112.5	L996 A1123 E1124 M1129 Q1130 R1131	L996-L1127 HydrophobicContact CD1-CD1 4.08Å; A1123-L1127 PolarHBondContact O-N 3.24Å; E1124-L1127 PolarHBondContact O-N 2.89Å; L1127-M1129 PolarHBondContact O-N 3.16Å; L1127-Q1130 PolarHBondContact O-N 3.45Å; L1127-R1131 PolarHBondContact O-N 2.85Å
1128	E	75.9	Confident	73.4	Confident	81 Å²	81	87 Å²	87	38%	0.379	42%	0.416	S	S	.	.	H	α-helix	trans	-65.7	-37.9	175.7	173.1	54.4	-161.1	0	0	111.5	E1124 Q1130 R1131 R1132	E1124-E1128 PolarHBondContact O-N 2.92Å; E1128-Q1130 VanDerWaalsContact C-N 3.31Å; E1128-Q1130 PolarHBondContact O-N 2.9Å; E1128-R1131 WeakPolarHBondContact O-CB 3.42Å; E1128-R1131 PolarHBondContact O-N 3.27Å; E1128-R1131 WeakPolarHBondContact OE2-CD 3.43Å; E1128-R1132 WeakPolarHBondContact O-CB 3.16Å; E1128-R1132 PolarHBondContact O-N 3.02Å; E1128-R1132 WeakPolarHBondContact OE1-CD 3.41Å; E1128-R1132 IonicContact OE1-NH1 2.69Å; E1128-R1132 PolarHBondContact OE1-NH1 3.13Å; E1128-R1132 VanDerWaalsContact OE1-NH1 3.11Å
1129	M	74.2	Confident	73.6	Confident	102 Å²	102	87.1 Å²	87.1	50%	0.502	41%	0.414	S	S	.	.	H	α-helix	trans	-60.4	-40.9	173.1	-180	165.3	168	0	0	111.8	M1125 G1126 L1127 R1132 I1133	M1125-M1129 VanDerWaalsContact O-CB 3.29Å; M1125-M1129 WeakPolarHBondContact O-CB 3.29Å; M1125-M1129 PolarHBondContact O-N 3.14Å; G1126-M1129 PolarHBondContact O-N 3.44Å; L1127-M1129 PolarHBondContact O-N 3.16Å; M1129-R1132 PolarHBondContact O-N 3.21Å; M1129-I1133 HydrophobicContact CE-CD1 3.89Å; M1129-I1133 HydrophobicContact CG-CD1 3.85Å; M1129-I1133 WeakPolarHBondContact O-CB 3.39Å; M1129-I1133 WeakPolarHBondContact O-CD1 3.46Å; M1129-I1133 VanDerWaalsContact O-CG1 3.24Å; M1129-I1133 WeakPolarHBondContact O-CG1 3.36Å; M1129-I1133 PolarHBondContact O-N 3.25Å
1130	Q	73	Confident	74	Confident	133 Å²	133	87.3 Å²	87.3	62%	0.621	42%	0.415	S	S	*	.	H	α-helix	trans	-67.3	-38.3	175.7	-176.1	165	-42.9	0	0	112.5	G1126 L1127 E1128 S1134	G1126-Q1130 WeakPolarHBondContact O-CB 3.16Å; G1126-Q1130 PolarHBondContact O-N 2.75Å; L1127-Q1130 PolarHBondContact O-N 3.45Å; E1128-Q1130 VanDerWaalsContact C-N 3.31Å; E1128-Q1130 PolarHBondContact O-N 2.9Å; Q1130-S1134 WeakPolarHBondContact O-CB 3.47Å; Q1130-S1134 PolarHBondContact O-N 2.83Å; Q1130-S1134 PolarHBondContact O-OG 3.27Å
1131	R	73.4	Confident	74.5	Confident	166 Å²	166	89 Å²	89	63%	0.626	43%	0.428	S	S	*	.	H	α-helix	trans	-60.8	-49	171.6	-168.4	-178.9	-171.4	166.5	2	110.9	L1127 E1128 I1133 S1134 E1135	L1127-R1131 PolarHBondContact O-N 2.85Å; E1128-R1131 WeakPolarHBondContact O-CB 3.42Å; E1128-R1131 PolarHBondContact O-N 3.27Å; E1128-R1131 WeakPolarHBondContact OE2-CD 3.43Å; R1131-I1133 PolarHBondContact O-N 3.03Å; R1131-S1134 PolarHBondContact O-N 3.49Å; R1131-E1135 PolarHBondContact O-N 2.99Å
1132	R	72.5	Confident	74.8	Confident	150 Å²	150	89.9 Å²	89.9	57%	0.566	43%	0.43	S	S	*	.	H	α-helix	trans	-59.9	-44.3	178.4	-144.9	79.7	-177.6	-170.8	1.9	112.8	E1128 M1129 S1134 L1136	E1128-R1132 WeakPolarHBondContact O-CB 3.16Å; E1128-R1132 PolarHBondContact O-N 3.02Å; E1128-R1132 WeakPolarHBondContact OE1-CD 3.41Å; E1128-R1132 IonicContact OE1-NH1 2.69Å; E1128-R1132 PolarHBondContact OE1-NH1 3.13Å; E1128-R1132 VanDerWaalsContact OE1-NH1 3.11Å; M1129-R1132 PolarHBondContact O-N 3.21Å; R1132-S1134 VanDerWaalsContact C-N 3.32Å; R1132-S1134 PolarHBondContact O-N 3.07Å; R1132-L1136 WeakPolarHBondContact O-CB 3.31Å; R1132-L1136 VanDerWaalsContact O-CG 3.29Å; R1132-L1136 WeakPolarHBondContact O-CG 3.35Å; R1132-L1136 PolarHBondContact O-N 2.78Å
1133	I	75.1	Confident	75	Confident	59 Å²	59	90.2 Å²	90.2	30%	0.303	43%	0.433	S	S	.	.	H	α-helix	trans	-64.3	-38.1	177	-73	166.6	0	0	0	111.1	M1129 R1131 R1137	M1129-I1133 HydrophobicContact CE-CD1 3.89Å; M1129-I1133 HydrophobicContact CG-CD1 3.85Å; M1129-I1133 WeakPolarHBondContact O-CB 3.39Å; M1129-I1133 WeakPolarHBondContact O-CD1 3.46Å; M1129-I1133 VanDerWaalsContact O-CG1 3.24Å; M1129-I1133 WeakPolarHBondContact O-CG1 3.36Å; M1129-I1133 PolarHBondContact O-N 3.25Å; R1131-I1133 PolarHBondContact O-N 3.03Å; I1133-R1137 WeakPolarHBondContact O-CD 3.36Å; I1133-R1137 VanDerWaalsContact O-CG 3.24Å; I1133-R1137 WeakPolarHBondContact O-CG 3.2Å; I1133-R1137 PolarHBondContact O-N 3.26Å; I1133-R1137 VanDerWaalsContact O-N 3.13Å
1134	S	71.1	Confident	75.5	Confident	65 Å²	65	91.1 Å²	91.1	46%	0.455	43%	0.429	S	S	.	.	H	α-helix	trans	-67.5	-44.9	-180	-58.8	0	0	0	0	111.8	Q1130 R1131 R1132 R1137 R1138	Q1130-S1134 WeakPolarHBondContact O-CB 3.47Å; Q1130-S1134 PolarHBondContact O-N 2.83Å; Q1130-S1134 PolarHBondContact O-OG 3.27Å; R1131-S1134 PolarHBondContact O-N 3.49Å; R1132-S1134 VanDerWaalsContact C-N 3.32Å; R1132-S1134 PolarHBondContact O-N 3.07Å; S1134-R1137 WeakPolarHBondContact O-CB 3.26Å; S1134-R1137 PolarHBondContact O-N 2.97Å; S1134-R1138 PolarHBondContact O-N 3.37Å; S1134-R1138 VanDerWaalsContact O-N 3.09Å
1135	E	76.7	Confident	76.1	Confident	80 Å²	80	92 Å²	92	37%	0.374	44%	0.436	S	S	.	.	H	α-helix	trans	-67.1	-41.3	177	179.9	60.4	-176.4	0	0	112.4	R1131 R1137 R1138 I1139	R1131-E1135 PolarHBondContact O-N 2.99Å; E1135-R1137 PolarHBondContact O-N 2.89Å; E1135-R1138 WeakPolarHBondContact O-CB 3.17Å; E1135-R1138 PolarHBondContact O-N 3.07Å; E1135-R1138 VanDerWaalsContact O-N 3.11Å; E1135-R1138 IonicContact OE1-CZ 3.81Å; E1135-R1138 IonicContact OE1-NE 3.51Å; E1135-R1138 PolarHBondContact OE1-NE 3.47Å; E1135-R1138 IonicContact OE1-NH2 3.58Å; E1135-R1138 PolarHBondContact OE1-NH2 2.94Å; E1135-R1138 IonicContact OE2-CZ 2.63Å; E1135-R1138 IonicContact OE2-NE 3.47Å; E1135-R1138 PolarHBondContact OE2-NE 3.26Å; E1135-R1138 IonicContact OE2-NH2 3.28Å; E1135-I1139 HydrophobicContact CG-CD1 4.11Å; E1135-I1139 WeakPolarHBondContact O-CG1 3.12Å; E1135-I1139 PolarHBondContact O-N 2.98Å
1136	L	79.8	Confident	76.6	Confident	87 Å²	87	90.5 Å²	90.5	46%	0.455	44%	0.438	S	S	.	.	H	α-helix	trans	-60.3	-31.2	174	-75.9	170.6	0	0	0	113	R1132 W1140	R1132-L1136 WeakPolarHBondContact O-CB 3.31Å; R1132-L1136 VanDerWaalsContact O-CG 3.29Å; R1132-L1136 WeakPolarHBondContact O-CG 3.35Å; R1132-L1136 PolarHBondContact O-N 2.78Å; L1136-W1140 WeakPolarHBondContact O-CB 3.36Å; L1136-W1140 PolarHBondContact O-N 3.31Å; L1136-W1140 VanDerWaalsContact O-N 3.15Å
1137	R	76.1	Confident	77	Confident	67 Å²	67	92.3 Å²	92.3	25%	0.253	44%	0.44	S	S	.	.	H	α-helix	trans	-74.5	-36.4	174.5	-73.9	165.3	173.5	-173.8	-1.9	112.4	S239 I240 I1133 S1134 E1135 W1140 N1141	S239-R1137 PolarHBondContact OG-NH1 3Å; I240-R1137 PolarHBondContact O-NH2 3Å; I1133-R1137 WeakPolarHBondContact O-CD 3.36Å; I1133-R1137 VanDerWaalsContact O-CG 3.24Å; I1133-R1137 WeakPolarHBondContact O-CG 3.2Å; I1133-R1137 PolarHBondContact O-N 3.26Å; I1133-R1137 VanDerWaalsContact O-N 3.13Å; S1134-R1137 WeakPolarHBondContact O-CB 3.26Å; S1134-R1137 PolarHBondContact O-N 2.97Å; E1135-R1137 PolarHBondContact O-N 2.89Å; R1137-W1140 PolarHBondContact O-N 3.01Å; R1137-N1141 VanDerWaalsContact O-CG 3.27Å; R1137-N1141 PolarHBondContact O-N 3.16Å; R1137-N1141 PolarHBondContact O-ND2 2.99Å
1138	R	78.9	Confident	77.2	Confident	128 Å²	128	94.1 Å²	94.1	48%	0.483	45%	0.448	S	S	.	.	H	α-helix	trans	-59.4	-53.9	173.3	-168.5	-178.2	69.5	81.2	-8.6	110.4	S1134 E1135 W1140 N1141 D1142	S1134-R1138 PolarHBondContact O-N 3.37Å; S1134-R1138 VanDerWaalsContact O-N 3.09Å; E1135-R1138 WeakPolarHBondContact O-CB 3.17Å; E1135-R1138 PolarHBondContact O-N 3.07Å; E1135-R1138 VanDerWaalsContact O-N 3.11Å; E1135-R1138 IonicContact OE1-CZ 3.81Å; E1135-R1138 IonicContact OE1-NE 3.51Å; E1135-R1138 PolarHBondContact OE1-NE 3.47Å; E1135-R1138 IonicContact OE1-NH2 3.58Å; E1135-R1138 PolarHBondContact OE1-NH2 2.94Å; E1135-R1138 IonicContact OE2-CZ 2.63Å; E1135-R1138 IonicContact OE2-NE 3.47Å; E1135-R1138 PolarHBondContact OE2-NE 3.26Å; E1135-R1138 IonicContact OE2-NH2 3.28Å; R1138-W1140 VanDerWaalsContact C-N 3.33Å; R1138-W1140 PolarHBondContact O-N 3.4Å; R1138-N1141 PolarHBondContact O-N 3.36Å; R1138-N1141 VanDerWaalsContact O-N 3.14Å; R1138-D1142 IonicContact NH1-OD2 3.37Å; R1138-D1142 PolarHBondContact NH1-OD2 3.15Å; R1138-D1142 PolarHBondContact O-N 3.26Å
1139	I	78.4	Confident	77.5	Confident	59 Å²	59	94.9 Å²	94.9	30%	0.303	45%	0.451	S	S	.	.	H	α-helix	trans	-57.5	-43.6	178.8	-63.5	166.3	0	0	0	111.6	E1135 D1142 E1143	E1135-I1139 HydrophobicContact CG-CD1 4.11Å; E1135-I1139 WeakPolarHBondContact O-CG1 3.12Å; E1135-I1139 PolarHBondContact O-N 2.98Å; I1139-D1142 PolarHBondContact O-N 3.15Å; I1139-E1143 PolarHBondContact O-N 2.86Å
1140	W	78.4	Confident	77.8	Confident	161 Å²	161	92.4 Å²	92.4	61%	0.61	45%	0.447	S	S	*	.	H	α-helix	trans	-64.3	-42.7	177.4	-172.8	-1.2	0	0	0	111.9	L1136 R1137 R1138 D1142 E1143 L1144	L1136-W1140 WeakPolarHBondContact O-CB 3.36Å; L1136-W1140 PolarHBondContact O-N 3.31Å; L1136-W1140 VanDerWaalsContact O-N 3.15Å; R1137-W1140 PolarHBondContact O-N 3.01Å; R1138-W1140 VanDerWaalsContact C-N 3.33Å; R1138-W1140 PolarHBondContact O-N 3.4Å; W1140-D1142 PolarHBondContact O-N 2.89Å; W1140-E1143 PolarHBondContact O-N 3.08Å; W1140-L1144 VanDerWaalsContact O-CB 3.26Å; W1140-L1144 WeakPolarHBondContact O-CB 3.43Å; W1140-L1144 PolarHBondContact O-N 3.04Å
1141	N	80.3	Confident	78.1	Confident	89 Å²	89	88.7 Å²	88.7	48%	0.476	44%	0.439	S	S	.	.	H	α-helix	trans	-61.5	-44.1	176.9	-71.5	-26.2	0	0	0	111.7	R1137 R1138 L1144 I1145	R1137-N1141 VanDerWaalsContact O-CG 3.27Å; R1137-N1141 PolarHBondContact O-N 3.16Å; R1137-N1141 PolarHBondContact O-ND2 2.99Å; R1138-N1141 PolarHBondContact O-N 3.36Å; R1138-N1141 VanDerWaalsContact O-N 3.14Å; N1141-L1144 PolarHBondContact O-N 3.29Å; N1141-I1145 WeakPolarHBondContact O-CG1 3.32Å; N1141-I1145 PolarHBondContact O-N 3.14Å; N1141-I1145 VanDerWaalsContact O-N 3.15Å
1142	D	77.9	Confident	78.5	Confident	83 Å²	83	83.7 Å²	83.7	44%	0.444	43%	0.429	S	S	.	.	H	α-helix	trans	-62.3	-45.7	178.6	-64.1	-22.7	0	0	0	111.4	R1138 I1139 W1140 A1146	R1138-D1142 IonicContact NH1-OD2 3.37Å; R1138-D1142 PolarHBondContact NH1-OD2 3.15Å; R1138-D1142 PolarHBondContact O-N 3.26Å; I1139-D1142 PolarHBondContact O-N 3.15Å; W1140-D1142 PolarHBondContact O-N 2.89Å; D1142-A1146 PolarHBondContact O-N 3.21Å
1143	E	76.9	Confident	79.1	Confident	39 Å²	39	84.1 Å²	84.1	18%	0.182	43%	0.431	C	S	.	.	H	α-helix	trans	-64.9	-38.8	175	-76.3	-172.8	157.6	0	0	113.2	L838 I1139 W1140 I1145 A1146 I1147	L838-E1143 WeakPolarHBondContact CD2-OE2 3.49Å; L838-E1143 WeakPolarHBondContact CG-OE1 3.42Å; L838-E1143 WeakPolarHBondContact CG-OE2 3.4Å; I1139-E1143 PolarHBondContact O-N 2.86Å; W1140-E1143 PolarHBondContact O-N 3.08Å; E1143-I1145 VanDerWaalsContact C-N 3.34Å; E1143-I1145 PolarHBondContact O-N 3.26Å; E1143-A1146 PolarHBondContact O-N 2.74Å; E1143-I1147 VanDerWaalsContact O-CG1 3.28Å; E1143-I1147 WeakPolarHBondContact O-CG1 3.3Å; E1143-I1147 PolarHBondContact O-N 3.48Å
1144	L	80.9	Confident	79.5	Confident	79 Å²	79	84.6 Å²	84.6	41%	0.414	43%	0.433	S	S	.	.	H	α-helix	trans	-62.3	-43.2	-179.5	-179.7	63	0	0	0	110.9	W1140 N1141 I1147 M1148	W1140-L1144 VanDerWaalsContact O-CB 3.26Å; W1140-L1144 WeakPolarHBondContact O-CB 3.43Å; W1140-L1144 PolarHBondContact O-N 3.04Å; N1141-L1144 PolarHBondContact O-N 3.29Å; L1144-I1147 PolarHBondContact O-N 2.9Å; L1144-M1148 HydrophobicContact CD1-SD 4.45Å; L1144-M1148 HydrophobicContact CG-SD 4.27Å; L1144-M1148 WeakPolarHBondContact O-CB 3.48Å; L1144-M1148 VanDerWaalsContact O-CG 3.32Å; L1144-M1148 WeakPolarHBondContact O-CG 3.45Å; L1144-M1148 PolarHBondContact O-N 2.93Å
1145	I	82.2	Confident	80	Confident	98 Å²	98	90 Å²	90	50%	0.503	44%	0.444	S	S	.	.	H	α-helix	trans	-61.7	-47.7	174.9	-66.4	165.1	0	0	0	110.2	N1141 E1143 I1147 M1148 E1149	N1141-I1145 WeakPolarHBondContact O-CG1 3.32Å; N1141-I1145 PolarHBondContact O-N 3.14Å; N1141-I1145 VanDerWaalsContact O-N 3.15Å; E1143-I1145 VanDerWaalsContact C-N 3.34Å; E1143-I1145 PolarHBondContact O-N 3.26Å; I1145-I1147 VanDerWaalsContact C-N 3.33Å; I1145-I1147 PolarHBondContact O-N 2.88Å; I1145-M1148 PolarHBondContact O-N 3.26Å; I1145-E1149 PolarHBondContact O-N 3Å
1146	A	81.9	Confident	80.3	Confident	60 Å²	60	91.6 Å²	91.6	50%	0.496	45%	0.451	S	S	.	.	H	α-helix	trans	-61	-38.4	179.1	0	0	0	0	0	113	D1142 E1143 A1150	D1142-A1146 PolarHBondContact O-N 3.21Å; E1143-A1146 PolarHBondContact O-N 2.74Å; A1146-A1150 WeakPolarHBondContact O-CB 3.16Å; A1146-A1150 PolarHBondContact O-N 3.27Å
1147	I	79.7	Confident	80.6	Confident	68 Å²	68	94.9 Å²	94.9	35%	0.349	46%	0.459	S	S	.	.	H	α-helix	trans	-68.1	-42.6	175.3	-69.2	166.2	0	0	0	111	V834 E1143 L1144 I1145 A1150 A1151	V834-I1147 HydrophobicContact CG1-CD1 3.84Å; V834-I1147 HydrophobicContact CG2-CD1 3.98Å; V834-I1147 HydrophobicContact CG2-CG1 4.19Å; E1143-I1147 VanDerWaalsContact O-CG1 3.28Å; E1143-I1147 WeakPolarHBondContact O-CG1 3.3Å; E1143-I1147 PolarHBondContact O-N 3.48Å; L1144-I1147 PolarHBondContact O-N 2.9Å; I1145-I1147 VanDerWaalsContact C-N 3.33Å; I1145-I1147 PolarHBondContact O-N 2.88Å; I1147-A1150 PolarHBondContact O-N 2.97Å; I1147-A1151 WeakPolarHBondContact O-CB 3.27Å; I1147-A1151 PolarHBondContact O-N 3.08Å
1148	M	78.2	Confident	80.9	Confident	123 Å²	123	94.2 Å²	94.2	61%	0.606	46%	0.46	S	S	*	.	H	α-helix	trans	-63.5	-42.6	177.5	-74.6	177.6	62.8	0	0	112.1	L1144 I1145 A1151 S1152	L1144-M1148 HydrophobicContact CD1-SD 4.45Å; L1144-M1148 HydrophobicContact CG-SD 4.27Å; L1144-M1148 WeakPolarHBondContact O-CB 3.48Å; L1144-M1148 VanDerWaalsContact O-CG 3.32Å; L1144-M1148 WeakPolarHBondContact O-CG 3.45Å; L1144-M1148 PolarHBondContact O-N 2.93Å; I1145-M1148 PolarHBondContact O-N 3.26Å; M1148-A1151 PolarHBondContact O-N 3.24Å; M1148-S1152 WeakPolarHBondContact O-CB 3.37Å; M1148-S1152 PolarHBondContact O-N 3.41Å
1149	E	82.7	Confident	81.1	Confident	96 Å²	96	90.8 Å²	90.8	45%	0.449	45%	0.454	S	S	.	.	H	α-helix	trans	-61.6	-44.6	172.7	-79.7	-158.5	-148.5	0	0	112.4	I1145 A1151 S1152 R1153	I1145-E1149 PolarHBondContact O-N 3Å; E1149-A1151 PolarHBondContact O-N 2.65Å; E1149-S1152 PolarHBondContact O-N 3.29Å; E1149-R1153 VanDerWaalsContact O-CG 3.28Å; E1149-R1153 WeakPolarHBondContact O-CG 3.45Å; E1149-R1153 PolarHBondContact O-N 2.91Å; E1149-R1153 VanDerWaalsContact O-N 3.09Å; E1149-R1153 IonicContact OE2-CZ 2.6Å; E1149-R1153 IonicContact OE2-NE 3.55Å; E1149-R1153 IonicContact OE2-NH2 2.89Å; E1149-R1153 PolarHBondContact OE2-NH2 3.33Å
1150	A	80.2	Confident	81.6	Confident	50 Å²	50	92.1 Å²	92.1	41%	0.413	46%	0.464	S	S	.	.	H	α-helix	trans	-63.6	-40.6	179.3	0	0	0	0	0	112.2	A1146 I1147 I1154	A1146-A1150 WeakPolarHBondContact O-CB 3.16Å; A1146-A1150 PolarHBondContact O-N 3.27Å; I1147-A1150 PolarHBondContact O-N 2.97Å; A1150-I1154 WeakPolarHBondContact O-CD1 3.07Å; A1150-I1154 WeakPolarHBondContact O-CG1 3.21Å; A1150-I1154 PolarHBondContact O-N 3.47Å
1151	A	78.2	Confident	82	Confident	56 Å²	56	89.6 Å²	89.6	46%	0.463	46%	0.455	S	S	.	.	H	α-helix	trans	-65.1	-44.5	175.6	0	0	0	0	0	112	I1147 M1148 E1149 R1153 I1154 W1155	I1147-A1151 WeakPolarHBondContact O-CB 3.27Å; I1147-A1151 PolarHBondContact O-N 3.08Å; M1148-A1151 PolarHBondContact O-N 3.24Å; E1149-A1151 PolarHBondContact O-N 2.65Å; A1151-R1153 PolarHBondContact O-N 2.89Å; A1151-I1154 PolarHBondContact O-N 2.74Å; A1151-I1154 VanDerWaalsContact O-N 3.17Å; A1151-W1155 PolarHBondContact O-N 2.94Å
1152	S	81.8	Confident	82.1	Confident	60 Å²	60	90 Å²	90	42%	0.42	46%	0.456	S	S	.	.	H	α-helix	trans	-57.8	-48.6	177.5	-171.3	0	0	0	0	111.9	M1148 E1149 I1154 W1155 E1156	M1148-S1152 WeakPolarHBondContact O-CB 3.37Å; M1148-S1152 PolarHBondContact O-N 3.41Å; E1149-S1152 PolarHBondContact O-N 3.29Å; S1152-I1154 VanDerWaalsContact C-N 3.25Å; S1152-I1154 PolarHBondContact O-N 3.3Å; S1152-W1155 PolarHBondContact O-N 3.26Å; S1152-W1155 VanDerWaalsContact O-N 3.11Å; S1152-E1156 WeakPolarHBondContact O-CG 3.31Å; S1152-E1156 PolarHBondContact O-N 3.26Å
1153	R	86.9	Confident	82.3	Confident	160 Å²	160	89 Å²	89	60%	0.604	45%	0.453	S	S	*	.	H	α-helix	trans	-62.8	-28.2	178.1	-64.7	170.3	-165.9	-168.1	5.8	113.5	E1149 A1151 Y1157	E1149-R1153 VanDerWaalsContact O-CG 3.28Å; E1149-R1153 WeakPolarHBondContact O-CG 3.45Å; E1149-R1153 PolarHBondContact O-N 2.91Å; E1149-R1153 VanDerWaalsContact O-N 3.09Å; E1149-R1153 IonicContact OE2-CZ 2.6Å; E1149-R1153 IonicContact OE2-NE 3.55Å; E1149-R1153 IonicContact OE2-NH2 2.89Å; E1149-R1153 PolarHBondContact OE2-NH2 3.33Å; A1151-R1153 PolarHBondContact O-N 2.89Å; R1153-Y1157 PolarHBondContact O-N 3Å
1154	I	81.6	Confident	82.8	Confident	69 Å²	69	90.4 Å²	90.4	35%	0.354	46%	0.461	S	S	.	.	H	α-helix	trans	-74.2	-45.8	173.3	-69	165.5	0	0	0	110	A1150 A1151 S1152 E1156 Y1157 D1158	A1150-I1154 WeakPolarHBondContact O-CD1 3.07Å; A1150-I1154 WeakPolarHBondContact O-CG1 3.21Å; A1150-I1154 PolarHBondContact O-N 3.47Å; A1151-I1154 PolarHBondContact O-N 2.74Å; A1151-I1154 VanDerWaalsContact O-N 3.17Å; S1152-I1154 VanDerWaalsContact C-N 3.25Å; S1152-I1154 PolarHBondContact O-N 3.3Å; I1154-E1156 PolarHBondContact O-N 3.38Å; I1154-Y1157 PolarHBondContact O-N 2.94Å; I1154-D1158 WeakPolarHBondContact O-CB 3.48Å; I1154-D1158 PolarHBondContact O-N 3.11Å
1155	W	81.9	Confident	82.8	Confident	178 Å²	178	90.2 Å²	90.2	67%	0.674	46%	0.463	S	S	*	.	H	α-helix	trans	-61.2	-43.5	178.3	-177.6	81	0	0	0	112.3	A1151 S1152 Y1157 D1158 V1159	A1151-W1155 PolarHBondContact O-N 2.94Å; S1152-W1155 PolarHBondContact O-N 3.26Å; S1152-W1155 VanDerWaalsContact O-N 3.11Å; W1155-Y1157 VanDerWaalsContact C-N 3.32Å; W1155-Y1157 PolarHBondContact O-N 3.28Å; W1155-D1158 PolarHBondContact O-N 2.95Å; W1155-V1159 HydrophobicContact CD2-CG2 3.95Å; W1155-V1159 HydrophobicContact CE3-CG2 4.4Å; W1155-V1159 HydrophobicContact CG-CG2 4.41Å; W1155-V1159 HydrophobicContact CH2-CG2 4.3Å; W1155-V1159 HydrophobicContact CZ2-CG2 3.82Å; W1155-V1159 WeakPolarHBondContact O-CB 3.45Å; W1155-V1159 VanDerWaalsContact O-CG2 3.3Å; W1155-V1159 WeakPolarHBondContact O-CG2 3.46Å; W1155-V1159 PolarHBondContact O-N 3.32Å
1156	E	84.4	Confident	82.9	Confident	113 Å²	113	88.7 Å²	88.7	53%	0.528	46%	0.458	S	S	.	.	H	α-helix	trans	-56.2	-43.9	173.5	-72.4	-177.3	156.1	0	0	112.4	S1152 I1154 V1160	S1152-E1156 WeakPolarHBondContact O-CG 3.31Å; S1152-E1156 PolarHBondContact O-N 3.26Å; I1154-E1156 PolarHBondContact O-N 3.38Å; E1156-V1160 WeakPolarHBondContact O-CG2 3.21Å; E1156-V1160 PolarHBondContact O-N 3.47Å; E1156-V1160 VanDerWaalsContact O-N 3.15Å
1157	Y	85.5	Confident	83.1	Confident	157 Å²	157	92.7 Å²	92.7	62%	0.616	46%	0.464	S	S	*	.	H	α-helix	trans	-67.8	-41.9	178.5	179.4	-102.9	0	0	0	112.3	R1153 I1154 W1155 V1160 R1161	R1153-Y1157 PolarHBondContact O-N 3Å; I1154-Y1157 PolarHBondContact O-N 2.94Å; W1155-Y1157 VanDerWaalsContact C-N 3.32Å; W1155-Y1157 PolarHBondContact O-N 3.28Å; Y1157-V1160 PolarHBondContact O-N 3.06Å; Y1157-R1161 WeakPolarHBondContact O-CB 3.36Å; Y1157-R1161 PolarHBondContact O-N 3.33Å
1158	D	82.6	Confident	83.4	Confident	52 Å²	52	99.6 Å²	99.6	28%	0.278	49%	0.486	S	S	.	.	H	α-helix	trans	-68.7	-41.1	-179.5	-82.5	28.3	0	0	0	111.7	I1154 W1155 V1160 R1161 I1162	I1154-D1158 WeakPolarHBondContact O-CB 3.48Å; I1154-D1158 PolarHBondContact O-N 3.11Å; W1155-D1158 PolarHBondContact O-N 2.95Å; D1158-V1160 PolarHBondContact O-N 3.43Å; D1158-R1161 VanDerWaalsContact CG-NH1 3.32Å; D1158-R1161 PolarHBondContact O-N 3.47Å; D1158-R1161 IonicContact OD1-CZ 2.84Å; D1158-R1161 IonicContact OD1-NH1 3.54Å; D1158-R1161 PolarHBondContact OD1-NH1 2.88Å; D1158-R1161 IonicContact OD1-NH2 3.88Å; D1158-R1161 PolarHBondContact OD1-NH2 2.85Å; D1158-R1161 IonicContact OD2-CZ 3.48Å; D1158-R1161 IonicContact OD2-NH1 2.72Å; D1158-R1161 IonicContact OD2-NH2 3.57Å; D1158-R1161 PolarHBondContact OD2-NH2 2.8Å; D1158-I1162 WeakPolarHBondContact O-CB 3.47Å; D1158-I1162 WeakPolarHBondContact O-CD1 3.1Å; D1158-I1162 VanDerWaalsContact O-CG1 3.25Å; D1158-I1162 WeakPolarHBondContact O-CG1 3.48Å; D1158-I1162 PolarHBondContact O-N 2.83Å
1159	V	83.6	Confident	83.8	Confident	57 Å²	57	99.8 Å²	99.8	35%	0.345	48%	0.48	S	S	.	.	H	α-helix	trans	-58.8	-46.9	171.7	168.9	0	0	0	0	110.9	W1155 R1161 I1162 V1163	W1155-V1159 HydrophobicContact CD2-CG2 3.95Å; W1155-V1159 HydrophobicContact CE3-CG2 4.4Å; W1155-V1159 HydrophobicContact CG-CG2 4.41Å; W1155-V1159 HydrophobicContact CH2-CG2 4.3Å; W1155-V1159 HydrophobicContact CZ2-CG2 3.82Å; W1155-V1159 WeakPolarHBondContact O-CB 3.45Å; W1155-V1159 VanDerWaalsContact O-CG2 3.3Å; W1155-V1159 WeakPolarHBondContact O-CG2 3.46Å; W1155-V1159 PolarHBondContact O-N 3.32Å; V1159-R1161 PolarHBondContact O-N 3.43Å; V1159-I1162 PolarHBondContact O-N 3.29Å; V1159-V1163 HydrophobicContact CG1-CG2 4.38Å; V1159-V1163 VanDerWaalsContact O-CB 3.3Å; V1159-V1163 WeakPolarHBondContact O-CB 3.34Å; V1159-V1163 VanDerWaalsContact O-CG2 3.23Å; V1159-V1163 WeakPolarHBondContact O-CG2 3.46Å; V1159-V1163 PolarHBondContact O-N 3.44Å
1160	V	87	Confident	84	Confident	86 Å²	86	100.6 Å²	100.6	52%	0.521	48%	0.484	S	S	.	.	H	α-helix	trans	-61.9	-44	176.8	170	0	0	0	0	111.4	E1156 Y1157 D1158 V1163 D1164	E1156-V1160 WeakPolarHBondContact O-CG2 3.21Å; E1156-V1160 PolarHBondContact O-N 3.47Å; E1156-V1160 VanDerWaalsContact O-N 3.15Å; Y1157-V1160 PolarHBondContact O-N 3.06Å; D1158-V1160 PolarHBondContact O-N 3.43Å; V1160-V1163 PolarHBondContact O-N 3.07Å; V1160-D1164 PolarHBondContact O-N 3.48Å
1161	R	87.2	Confident	84.5	Confident	109 Å²	109	102.2 Å²	102.2	41%	0.411	48%	0.479	S	S	.	.	H	α-helix	trans	-60.4	-47.4	177.1	-176.7	-179.9	67.5	-111.4	1.1	111.8	Y1157 D1158 V1159 D1164 V1165	Y1157-R1161 WeakPolarHBondContact O-CB 3.36Å; Y1157-R1161 PolarHBondContact O-N 3.33Å; D1158-R1161 VanDerWaalsContact CG-NH1 3.32Å; D1158-R1161 PolarHBondContact O-N 3.47Å; D1158-R1161 IonicContact OD1-CZ 2.84Å; D1158-R1161 IonicContact OD1-NH1 3.54Å; D1158-R1161 PolarHBondContact OD1-NH1 2.88Å; D1158-R1161 IonicContact OD1-NH2 3.88Å; D1158-R1161 PolarHBondContact OD1-NH2 2.85Å; D1158-R1161 IonicContact OD2-CZ 3.48Å; D1158-R1161 IonicContact OD2-NH1 2.72Å; D1158-R1161 IonicContact OD2-NH2 3.57Å; D1158-R1161 PolarHBondContact OD2-NH2 2.8Å; V1159-R1161 PolarHBondContact O-N 3.43Å; R1161-D1164 PolarHBondContact O-N 3.11Å; R1161-V1165 WeakPolarHBondContact O-CG2 3.38Å; R1161-V1165 PolarHBondContact O-N 2.75Å
1162	I	82	Confident	85.2	Confident	98 Å²	98	99.8 Å²	99.8	50%	0.503	46%	0.459	S	S	.	.	H	α-helix	trans	-63.2	-47.5	179.9	-69.6	164.2	0	0	0	110	D1158 V1159 D1164 V1165 V1166	D1158-I1162 WeakPolarHBondContact O-CB 3.47Å; D1158-I1162 WeakPolarHBondContact O-CD1 3.1Å; D1158-I1162 VanDerWaalsContact O-CG1 3.25Å; D1158-I1162 WeakPolarHBondContact O-CG1 3.48Å; D1158-I1162 PolarHBondContact O-N 2.83Å; V1159-I1162 PolarHBondContact O-N 3.29Å; I1162-D1164 VanDerWaalsContact C-N 3.3Å; I1162-D1164 PolarHBondContact O-N 3.24Å; I1162-V1165 PolarHBondContact O-N 2.96Å; I1162-V1166 HydrophobicContact CG2-CG2 4.33Å; I1162-V1166 WeakPolarHBondContact O-CB 3.3Å; I1162-V1166 WeakPolarHBondContact O-CG2 3.47Å; I1162-V1166 PolarHBondContact O-N 2.84Å
1163	V	83.5	Confident	85.6	Confident	62 Å²	62	99.2 Å²	99.2	38%	0.376	46%	0.458	S	S	.	.	H	α-helix	trans	-58.6	-40.2	178.1	164.9	0	0	0	0	111.9	V1159 V1160 V1166 K1167	V1159-V1163 HydrophobicContact CG1-CG2 4.38Å; V1159-V1163 VanDerWaalsContact O-CB 3.3Å; V1159-V1163 WeakPolarHBondContact O-CB 3.34Å; V1159-V1163 VanDerWaalsContact O-CG2 3.23Å; V1159-V1163 WeakPolarHBondContact O-CG2 3.46Å; V1159-V1163 PolarHBondContact O-N 3.44Å; V1160-V1163 PolarHBondContact O-N 3.07Å; V1163-V1166 PolarHBondContact O-N 2.9Å; V1163-K1167 HydrophobicContact CG1-CD 4.23Å; V1163-K1167 VanDerWaalsContact CG1-NZ 3.31Å; V1163-K1167 VanDerWaalsContact O-CG 3.27Å; V1163-K1167 WeakPolarHBondContact O-CG 3.33Å; V1163-K1167 PolarHBondContact O-N 3.05Å
1164	D	86.4	Confident	85.9	Confident	68 Å²	68	96.8 Å²	96.8	36%	0.364	45%	0.449	S	S	.	.	H	α-helix	trans	-77	-26.1	178.1	-81.5	1.7	0	0	0	113.9	V1160 R1161 I1162 K1167 R1168	V1160-D1164 PolarHBondContact O-N 3.48Å; R1161-D1164 PolarHBondContact O-N 3.11Å; I1162-D1164 VanDerWaalsContact C-N 3.3Å; I1162-D1164 PolarHBondContact O-N 3.24Å; D1164-K1167 IonicContact OD1-NZ 3.97Å; D1164-K1167 PolarHBondContact OD1-NZ 3.44Å; D1164-R1168 WeakPolarHBondContact O-CD 3.39Å; D1164-R1168 VanDerWaalsContact O-CG 3.26Å; D1164-R1168 WeakPolarHBondContact O-CG 3.33Å
1165	V	81.9	Confident	86.4	Confident	75 Å²	75	95.6 Å²	95.6	46%	0.455	45%	0.447	S	S	.	.	H	α-helix	trans	-69.6	-40.7	167	170.2	0	0	0	0	110.7	R1161 I1162 R1168	R1161-V1165 WeakPolarHBondContact O-CG2 3.38Å; R1161-V1165 PolarHBondContact O-N 2.75Å; I1162-V1165 PolarHBondContact O-N 2.96Å; V1165-R1168 PolarHBondContact O-N 2.91Å
1166	V	83.4	Confident	86.9	Confident	65 Å²	65	88.9 Å²	88.9	39%	0.394	43%	0.433	S	S	.	.	H	α-helix	trans	-65	-46	179.3	166.1	0	0	0	0	111.4	I1162 V1163 R1168 R1169 W1171	I1162-V1166 HydrophobicContact CG2-CG2 4.33Å; I1162-V1166 WeakPolarHBondContact O-CB 3.3Å; I1162-V1166 WeakPolarHBondContact O-CG2 3.47Å; I1162-V1166 PolarHBondContact O-N 2.84Å; V1163-V1166 PolarHBondContact O-N 2.9Å; V1166-R1168 PolarHBondContact O-N 3.35Å; V1166-R1168 VanDerWaalsContact O-N 3.15Å; V1166-R1169 PolarHBondContact O-N 3.46Å; V1166-R1169 VanDerWaalsContact O-N 3.17Å; V1166-W1171 HydrophobicContact CB-CZ2 4.24Å; V1166-W1171 HydrophobicContact CG1-CZ2 3.87Å; V1166-W1171 HydrophobicContact CG2-CZ2 4.27Å; V1166-W1171 PolarHBondContact O-NE1 2.94Å
1167	K	86.8	Confident	87.1	Confident	144 Å²	144	89.9 Å²	89.9	63%	0.626	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-20.7	177.1	-72.8	168.9	-168.1	156.1	0	114.7	V1163 D1164	V1163-K1167 HydrophobicContact CG1-CD 4.23Å; V1163-K1167 VanDerWaalsContact CG1-NZ 3.31Å; V1163-K1167 VanDerWaalsContact O-CG 3.27Å; V1163-K1167 WeakPolarHBondContact O-CG 3.33Å; V1163-K1167 PolarHBondContact O-N 3.05Å; D1164-K1167 IonicContact OD1-NZ 3.97Å; D1164-K1167 PolarHBondContact OD1-NZ 3.44Å
1168	R	86.8	Confident	87.3	Confident	213 Å²	213	84.4 Å²	84.4	80%	0.804	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-12.2	179.5	-72.4	171.7	-169.2	-143.2	4.1	113.5	D1164 V1165 V1166	D1164-R1168 WeakPolarHBondContact O-CD 3.39Å; D1164-R1168 VanDerWaalsContact O-CG 3.26Å; D1164-R1168 WeakPolarHBondContact O-CG 3.33Å; V1165-R1168 PolarHBondContact O-N 2.91Å; V1166-R1168 PolarHBondContact O-N 3.35Å; V1166-R1168 VanDerWaalsContact O-N 3.15Å
1169	R	85.6	Confident	87.7	Confident	128 Å²	128	82.5 Å²	82.5	48%	0.483	40%	0.404	S	S	.	.	S	Bend	trans	-99.5	153	179.2	-63.1	-173.1	-175.7	-124.9	1	111.2	V1166 W1171 I1178	V1166-R1169 PolarHBondContact O-N 3.46Å; V1166-R1169 VanDerWaalsContact O-N 3.17Å; R1169-W1171 HydrophobicContact CB-CD2 4.43Å; R1169-W1171 HydrophobicContact CB-CH2 4.35Å; R1169-W1171 HydrophobicContact CB-CZ2 3.71Å; R1169-W1171 HydrophobicContact CG-CZ2 4.37Å; R1169-W1171 VanDerWaalsContact O-CD1 3.3Å; R1169-W1171 PolarHBondContact O-NE1 2.94Å; R1169-I1178 VanDerWaalsContact NH1-CD1 3.3Å
1170	Q	86.6	Confident	88	Confident	113 Å²	113	88.2 Å²	88.2	53%	0.528	42%	0.421	S	S	.	.			trans	-89.7	138.8	167.9	-72.2	-69.9	-41.8	0	0	108.9	A1179 S1188	Q1170-A1179 HydrophobicContact CB-CB 4.32Å; Q1170-A1179 PolarHBondContact O-N 3.45Å; Q1170-S1188 PolarHBondContact OE1-OG 2.97Å
1171	W	90.6	Very high	88.1	Confident	83 Å²	83	90.1 Å²	90.1	31%	0.314	42%	0.42	S	S	.	.	B	Isolated β-bridge	trans	-122.4	148.6	-170.1	-59.6	106.3	0	0	0	112	V1166 R1169 A1173 I1178	V1166-W1171 HydrophobicContact CB-CZ2 4.24Å; V1166-W1171 HydrophobicContact CG1-CZ2 3.87Å; V1166-W1171 HydrophobicContact CG2-CZ2 4.27Å; V1166-W1171 PolarHBondContact O-NE1 2.94Å; R1169-W1171 HydrophobicContact CB-CD2 4.43Å; R1169-W1171 HydrophobicContact CB-CH2 4.35Å; R1169-W1171 HydrophobicContact CB-CZ2 3.71Å; R1169-W1171 HydrophobicContact CG-CZ2 4.37Å; R1169-W1171 VanDerWaalsContact O-CD1 3.3Å; R1169-W1171 PolarHBondContact O-NE1 2.94Å; W1171-A1173 PolarHBondContact O-N 2.94Å; W1171-I1178 HydrophobicContact CE3-CG1 4.15Å; W1171-I1178 HydrophobicContact CH2-CG1 4.29Å; W1171-I1178 HydrophobicContact CZ3-CG1 3.66Å
1172	C	93.9	Very high	88.2	Confident	6 Å²	6	91.2 Å²	91.2	4%	0.041	43%	0.425	C	S	.	.	B	Isolated β-bridge	trans	-78.7	113	-177	-178	0	0	0	0	110.3	Y1174 C1175 G1176 R1177 S1188 C1190	C1172-Y1174 PolarHBondContact O-N 2.99Å; C1172-C1175 PolarHBondContact O-N 3.48Å; C1172-C1175 VanDerWaalsContact O-N 3.15Å; C1172-C1175 PolarHBondContact SG-SG 3.26Å; C1172-G1176 PolarHBondContact O-N 3.45Å; C1172-R1177 WeakPolarHBondContact CA-O 3.35Å; C1172-R1177 WeakPolarHBondContact CB-O 3.34Å; C1172-R1177 PolarHBondContact N-O 3.23Å; C1172-S1188 WeakPolarHBondContact CA-O 3.5Å; C1172-C1190 HydrophobicContact CB-CB 3.95Å; C1172-C1190 PolarHBondContact SG-N 2.96Å
1173	A	90.4	Very high	88.6	Confident	48 Å²	48	86.9 Å²	86.9	40%	0.397	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	3.2	-178.8	0	0	0	0	0	115.2	W1171 T1187 S1188 Y1189	W1171-A1173 PolarHBondContact O-N 2.94Å; A1173-T1187 HydrophobicContact CB-CG2 3.9Å; A1173-S1188 PolarHBondContact N-O 2.97Å; A1173-Y1189 HydrophobicContact CB-CE1 4.37Å
1174	Y	91.4	Very high	88.8	Confident	108 Å²	108	84.3 Å²	84.3	42%	0.424	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-26	175.6	-174.9	-106.4	0	0	0	114.2	C1172 C1194 K1197 H1198	C1172-Y1174 PolarHBondContact O-N 2.99Å; Y1174-C1194 HydrophobicContact CD1-CB 3.94Å; Y1174-C1194 HydrophobicContact CG-CB 4.33Å; Y1174-K1197 HydrophobicContact CD1-CB 4.26Å; Y1174-K1197 HydrophobicContact CD2-CB 4.15Å; Y1174-K1197 HydrophobicContact CE1-CB 3.84Å; Y1174-K1197 HydrophobicContact CE1-CD 3.62Å; Y1174-K1197 HydrophobicContact CE1-CG 4.38Å; Y1174-K1197 HydrophobicContact CE2-CB 3.73Å; Y1174-K1197 HydrophobicContact CG-CB 4.42Å; Y1174-K1197 WeakPolarHBondContact OH-CD 3.25Å; Y1174-H1198 HydrophobicContact CD2-CB 3.9Å; Y1174-H1198 HydrophobicContact CG-CB 4.28Å
1175	C	93.3	Very high	88.7	Confident	44 Å²	44	90.1 Å²	90.1	30%	0.297	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.4	20.8	-166	77.7	0	0	0	0	115.6	C1172 R1177 C1190 C1194	C1172-C1175 PolarHBondContact O-N 3.48Å; C1172-C1175 VanDerWaalsContact O-N 3.15Å; C1172-C1175 PolarHBondContact SG-SG 3.26Å; C1175-R1177 PolarHBondContact O-N 3.27Å; C1175-C1190 PolarHBondContact SG-SG 3.18Å; C1175-C1194 VanDerWaalsContact SG-SG 3.63Å
1176	G	91.5	Very high	88.9	Confident	37 Å²	37	92.1 Å²	92.1	38%	0.381	41%	0.412	S	S	.	.	S	Bend	trans	73.8	-42.9	175	0	0	0	0	0	115.5	C1172	C1172-G1176 PolarHBondContact O-N 3.45Å
1177	R	89.6	Confident	89.2	Confident	134 Å²	134	89.6 Å²	89.6	51%	0.506	40%	0.397	S	S	.	.	S	Bend	trans	-52.7	154.6	-176	-61.1	-178.5	-174.4	-167.2	-0.2	114	C1172 C1175 A1179 C1190	C1172-R1177 WeakPolarHBondContact CA-O 3.35Å; C1172-R1177 WeakPolarHBondContact CB-O 3.34Å; C1172-R1177 PolarHBondContact N-O 3.23Å; C1175-R1177 PolarHBondContact O-N 3.27Å; R1177-A1179 PolarHBondContact O-N 3.27Å; R1177-C1190 HydrophobicContact CB-CB 4.34Å
1178	I	89.3	Confident	89.5	Confident	43 Å²	43	83.1 Å²	83.1	22%	0.221	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-50	132.1	175.9	-60.6	161.9	0	0	0	110.9	R1169 W1171 Y1180 C1190	R1169-I1178 VanDerWaalsContact NH1-CD1 3.3Å; W1171-I1178 HydrophobicContact CE3-CG1 4.15Å; W1171-I1178 HydrophobicContact CH2-CG1 4.29Å; W1171-I1178 HydrophobicContact CZ3-CG1 3.66Å; I1178-Y1180 HydrophobicContact CB-CE2 4.5Å; I1178-Y1180 HydrophobicContact CG2-CE1 4.1Å; I1178-Y1180 HydrophobicContact CG2-CE2 4.3Å; I1178-C1190 WeakPolarHBondContact O-CB 3.46Å
1179	A	91.4	Very high	89.8	Confident	12 Å²	12	73 Å²	73	10%	0.099	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-93.5	143.2	179.1	0	0	0	0	0	113	Q1170 R1177 S1188 Y1189	Q1170-A1179 HydrophobicContact CB-CB 4.32Å; Q1170-A1179 PolarHBondContact O-N 3.45Å; R1177-A1179 PolarHBondContact O-N 3.27Å; A1179-S1188 VanDerWaalsContact CB-CB 3.44Å; A1179-Y1189 CarbonylContact C-O 3.46Å; A1179-Y1189 WeakPolarHBondContact CA-O 3.31Å; A1179-Y1189 WeakPolarHBondContact CB-O 3.31Å
1180	Y	90	Very high	90.2	Very high	176 Å²	176	67.8 Å²	67.8	69%	0.69	32%	0.315	S	S	*	.			trans	-123.7	-18.4	177.6	-56.8	-76	0	0	0	112.5	I1178 Y1189	I1178-Y1180 HydrophobicContact CB-CE2 4.5Å; I1178-Y1180 HydrophobicContact CG2-CE1 4.1Å; I1178-Y1180 HydrophobicContact CG2-CE2 4.3Å; Y1180-Y1189 PolarHBondContact N-O 2.78Å
1181	Y	88.1	Confident	90.5	Very high	127 Å²	127	65.1 Å²	65.1	50%	0.498	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	109.5	-178.2	-61.1	-96	0	0	0	109.5	S1188 Y1189 C1190	Y1181-S1188 CarbonylContact O-C 3.04Å; Y1181-S1188 WeakPolarHBondContact O-CA 3.25Å; Y1181-Y1189 PolarHBondContact N-O 3.02Å; Y1181-Y1189 PolarHBondContact O-N 3.41Å; Y1181-C1190 WeakPolarHBondContact CD2-O 3.39Å; Y1181-C1190 WeakPolarHBondContact CE2-O 3.29Å
1182	Y	89.8	Confident	90.6	Very high	132 Å²	132	64.8 Å²	64.8	52%	0.518	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	138.6	177.8	173.6	-96	0	0	0	111.4	C1184 W1185	Y1182-C1184 WeakPolarHBondContact CE2-O 3.46Å; Y1182-W1185 PolarHBondContact OH-N 3.36Å; Y1182-W1185 VanDerWaalsContact OH-N 3.13Å
1183	C	89.7	Confident	90.6	Very high	6 Å²	6	69.3 Å²	69.3	4%	0.041	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	-49	175.2	178.4	0	0	0	0	111.9	T1187 Y1189 H1202 Q1208	C1183-T1187 WeakPolarHBondContact CA-O 3.12Å; C1183-T1187 WeakPolarHBondContact CB-O 3.22Å; C1183-T1187 PolarHBondContact N-O 2.8Å; C1183-Y1189 HydrophobicContact CB-CD2 4.1Å; C1183-Y1189 HydrophobicContact CB-CE2 3.67Å; C1183-H1202 PolarHBondContact SG-NE2 3.3Å; C1183-H1202 VanDerWaalsContact SG-NE2 3.44Å; C1183-Q1208 WeakPolarHBondContact O-CG 3.38Å; C1183-Q1208 PolarHBondContact O-NE2 2.94Å; C1183-Q1208 PolarHBondContact O-OE1 2.86Å
1184	C	88.3	Confident	90.8	Very high	9 Å²	9	67.6 Å²	67.6	6%	0.061	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	178.7	166.8	73.2	0	0	0	0	111.3	Y1182 N1186 T1187 H1202	Y1182-C1184 WeakPolarHBondContact CE2-O 3.46Å; C1184-N1186 PolarHBondContact O-N 3.08Å; C1184-T1187 PolarHBondContact N-O 2.68Å; C1184-T1187 CarbonylContact O-C 3.49Å; C1184-T1187 PolarHBondContact O-N 3.17Å; C1184-T1187 VanDerWaalsContact O-O 3.06Å; C1184-H1202 VanDerWaalsContact SG-CE1 3.56Å
1185	W	84.8	Confident	90.9	Very high	190 Å²	190	65.7 Å²	65.7	72%	0.72	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-26.3	-168.3	78	-89.4	0	0	0	115.5	Y1182	Y1182-W1185 PolarHBondContact OH-N 3.36Å; Y1182-W1185 VanDerWaalsContact OH-N 3.13Å
1186	N	85.7	Confident	90.8	Very high	116 Å²	116	67.2 Å²	67.2	62%	0.62	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120	21.3	177.3	-163	56.9	0	0	0	113	C1184	C1184-N1186 PolarHBondContact O-N 3.08Å
1187	T	89.9	Confident	90.8	Very high	13 Å²	13	71 Å²	71	8%	0.08	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	114.9	-178.5	-53.2	0	0	0	0	112	A1173 C1183 C1184 Y1189 H1202	A1173-T1187 HydrophobicContact CB-CG2 3.9Å; C1183-T1187 WeakPolarHBondContact CA-O 3.12Å; C1183-T1187 WeakPolarHBondContact CB-O 3.22Å; C1183-T1187 PolarHBondContact N-O 2.8Å; C1184-T1187 PolarHBondContact N-O 2.68Å; C1184-T1187 CarbonylContact O-C 3.49Å; C1184-T1187 PolarHBondContact O-N 3.17Å; C1184-T1187 VanDerWaalsContact O-O 3.06Å; T1187-Y1189 HydrophobicContact CG2-CE1 4.21Å; T1187-Y1189 HydrophobicContact CG2-CE2 3.89Å; T1187-Y1189 WeakPolarHBondContact CG2-OH 3.48Å; T1187-H1202 PolarHBondContact OG1-CE1 3.36Å
1188	S	92.5	Very high	90.9	Very high	7 Å²	7	66.5 Å²	66.5	5%	0.049	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	161.5	176.5	-57	0	0	0	0	109.5	Q1170 C1172 A1173 A1179 Y1181	Q1170-S1188 PolarHBondContact OE1-OG 2.97Å; C1172-S1188 WeakPolarHBondContact CA-O 3.5Å; A1173-S1188 PolarHBondContact N-O 2.97Å; A1179-S1188 VanDerWaalsContact CB-CB 3.44Å; Y1181-S1188 CarbonylContact O-C 3.04Å; Y1181-S1188 WeakPolarHBondContact O-CA 3.25Å
1189	Y	94.2	Very high	90.8	Very high	1 Å²	1	68.5 Å²	68.5	0%	0.004	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	150	-174.5	-58.5	-72.3	0	0	0	112.3	A1173 A1179 Y1180 Y1181 C1183 T1187 C1194 Q1195 H1198	A1173-Y1189 HydrophobicContact CB-CE1 4.37Å; A1179-Y1189 CarbonylContact C-O 3.46Å; A1179-Y1189 WeakPolarHBondContact CA-O 3.31Å; A1179-Y1189 WeakPolarHBondContact CB-O 3.31Å; Y1180-Y1189 PolarHBondContact N-O 2.78Å; Y1181-Y1189 PolarHBondContact N-O 3.02Å; Y1181-Y1189 PolarHBondContact O-N 3.41Å; C1183-Y1189 HydrophobicContact CB-CD2 4.1Å; C1183-Y1189 HydrophobicContact CB-CE2 3.67Å; T1187-Y1189 HydrophobicContact CG2-CE1 4.21Å; T1187-Y1189 HydrophobicContact CG2-CE2 3.89Å; T1187-Y1189 WeakPolarHBondContact CG2-OH 3.48Å; Y1189-C1194 HydrophobicContact CD1-CB 4.49Å; Y1189-Q1195 HydrophobicContact CD1-CB 4.26Å; Y1189-Q1195 HydrophobicContact CD2-CB 3.67Å; Y1189-Q1195 HydrophobicContact CD2-CG 3.74Å; Y1189-Q1195 HydrophobicContact CE2-CB 3.99Å; Y1189-Q1195 HydrophobicContact CE2-CG 3.68Å; Y1189-Q1195 HydrophobicContact CG-CB 3.8Å; Y1189-Q1195 HydrophobicContact CG-CG 4.38Å; Y1189-H1198 HydrophobicContact CE1-CB 3.66Å; Y1189-H1198 AromaticContact CE1-CG 3.96Å; Y1189-H1198 AromaticContact CE1-ND1 3.47Å; Y1189-H1198 WeakPolarHBondContact CE1-ND1 3.26Å; Y1189-H1198 AromaticContact CZ-ND1 3.79Å; Y1189-H1198 PolarHBondContact OH-ND1 3.29Å
1190	C	94	Very high	90.7	Very high	18 Å²	18	72 Å²	72	12%	0.122	35%	0.346	C	S	.	.	S	Bend	trans	-80.7	-27.9	176	68.1	0	0	0	0	113.1	C1172 C1175 R1177 I1178 Y1181 C1194	C1172-C1190 HydrophobicContact CB-CB 3.95Å; C1172-C1190 PolarHBondContact SG-N 2.96Å; C1175-C1190 PolarHBondContact SG-SG 3.18Å; R1177-C1190 HydrophobicContact CB-CB 4.34Å; I1178-C1190 WeakPolarHBondContact O-CB 3.46Å; Y1181-C1190 WeakPolarHBondContact CD2-O 3.39Å; Y1181-C1190 WeakPolarHBondContact CE2-O 3.29Å; C1190-C1194 PolarHBondContact SG-SG 3.12Å
1191	N	93.1	Very high	90.6	Very high	57 Å²	57	71.3 Å²	71.3	31%	0.305	35%	0.346	S	S	.	.	S	Bend	trans	-158	170.6	174.2	61.7	32.8	0	0	0	111.5	I1193 C1194 Q1195	N1191-I1193 VanDerWaalsContact C-N 3.26Å; N1191-I1193 PolarHBondContact O-N 3.42Å; N1191-I1193 WeakPolarHBondContact OD1-CB 3.43Å; N1191-I1193 PolarHBondContact OD1-N 2.89Å; N1191-C1194 PolarHBondContact O-N 1.73Å; N1191-C1194 PolarHBondContact OD1-N 3.07Å; N1191-C1194 PolarHBondContact OD1-SG 2.89Å; N1191-Q1195 PolarHBondContact O-N 2.97Å; N1191-Q1195 VanDerWaalsContact O-N 3.1Å
1192	S	92	Very high	90.7	Very high	77 Å²	77	65.5 Å²	65.5	54%	0.538	32%	0.324	S	S	.	.	H	α-helix	trans	-62.8	-25.9	178.8	52.5	0	0	0	0	114.2	Q1195 S1196	S1192-Q1195 PolarHBondContact O-N 3.47Å; S1192-S1196 WeakPolarHBondContact O-CB 3.34Å; S1192-S1196 PolarHBondContact O-N 3.35Å; S1192-S1196 PolarHBondContact O-OG 3.18Å
1193	I	93	Very high	90.7	Very high	100 Å²	100	63.7 Å²	63.7	51%	0.513	32%	0.321	S	S	.	.	H	α-helix	trans	-69.4	-40.3	176.2	-56.4	170.1	0	0	0	110.3	N1191 S1196 K1197	N1191-I1193 VanDerWaalsContact C-N 3.26Å; N1191-I1193 PolarHBondContact O-N 3.42Å; N1191-I1193 WeakPolarHBondContact OD1-CB 3.43Å; N1191-I1193 PolarHBondContact OD1-N 2.89Å; I1193-S1196 PolarHBondContact O-OG 3.04Å; I1193-K1197 HydrophobicContact CG2-CD 4.44Å; I1193-K1197 WeakPolarHBondContact O-CB 3.43Å; I1193-K1197 WeakPolarHBondContact O-CG 3.34Å; I1193-K1197 PolarHBondContact O-N 3.42Å; I1193-K1197 VanDerWaalsContact O-N 3.09Å
1194	C	96	Very high	90.5	Very high	12 Å²	12	67.1 Å²	67.1	8%	0.081	35%	0.35	C	S	.	.	H	α-helix	trans	-71.5	-35.2	175	-65.5	0	0	0	0	111.7	Y1174 C1175 Y1189 C1190 N1191 H1198	Y1174-C1194 HydrophobicContact CD1-CB 3.94Å; Y1174-C1194 HydrophobicContact CG-CB 4.33Å; C1175-C1194 VanDerWaalsContact SG-SG 3.63Å; Y1189-C1194 HydrophobicContact CD1-CB 4.49Å; C1190-C1194 PolarHBondContact SG-SG 3.12Å; N1191-C1194 PolarHBondContact O-N 1.73Å; N1191-C1194 PolarHBondContact OD1-N 3.07Å; N1191-C1194 PolarHBondContact OD1-SG 2.89Å; C1194-H1198 WeakPolarHBondContact O-CB 3.45Å; C1194-H1198 PolarHBondContact O-N 3.41Å; C1194-H1198 VanDerWaalsContact O-N 3.16Å
1195	Q	93	Very high	90.4	Very high	68 Å²	68	70.3 Å²	70.3	32%	0.318	37%	0.372	S	S	.	.	H	α-helix	trans	-60.5	-53.6	170.4	-178.3	175.3	10.7	0	0	111.2	Y1189 N1191 S1192 K1197 H1198 W1199	Y1189-Q1195 HydrophobicContact CD1-CB 4.26Å; Y1189-Q1195 HydrophobicContact CD2-CB 3.67Å; Y1189-Q1195 HydrophobicContact CD2-CG 3.74Å; Y1189-Q1195 HydrophobicContact CE2-CB 3.99Å; Y1189-Q1195 HydrophobicContact CE2-CG 3.68Å; Y1189-Q1195 HydrophobicContact CG-CB 3.8Å; Y1189-Q1195 HydrophobicContact CG-CG 4.38Å; N1191-Q1195 PolarHBondContact O-N 2.97Å; N1191-Q1195 VanDerWaalsContact O-N 3.1Å; S1192-Q1195 PolarHBondContact O-N 3.47Å; Q1195-K1197 PolarHBondContact O-N 3.01Å; Q1195-H1198 PolarHBondContact O-N 3.02Å; Q1195-W1199 VanDerWaalsContact O-CB 3.28Å; Q1195-W1199 WeakPolarHBondContact O-CB 3.42Å; Q1195-W1199 PolarHBondContact O-N 3.21Å
1196	S	90.5	Very high	90.6	Very high	76 Å²	76	61.2 Å²	61.2	53%	0.531	34%	0.338	S	S	.	.	H	α-helix	trans	-65.6	-35	-176	64.3	0	0	0	0	113.2	S1192 I1193 P1200	S1192-S1196 WeakPolarHBondContact O-CB 3.34Å; S1192-S1196 PolarHBondContact O-N 3.35Å; S1192-S1196 PolarHBondContact O-OG 3.18Å; I1193-S1196 PolarHBondContact O-OG 3.04Å; S1196-P1200 WeakPolarHBondContact O-CD 2.94Å
1197	K	92.6	Very high	90.5	Very high	117 Å²	117	59.9 Å²	59.9	51%	0.509	33%	0.334	S	S	.	.	H	α-helix	trans	-69.1	-34.8	174.2	-72.1	-175.5	177.6	-168.4	0	113.6	Y1174 I1193 Q1195	Y1174-K1197 HydrophobicContact CD1-CB 4.26Å; Y1174-K1197 HydrophobicContact CD2-CB 4.15Å; Y1174-K1197 HydrophobicContact CE1-CB 3.84Å; Y1174-K1197 HydrophobicContact CE1-CD 3.62Å; Y1174-K1197 HydrophobicContact CE1-CG 4.38Å; Y1174-K1197 HydrophobicContact CE2-CB 3.73Å; Y1174-K1197 HydrophobicContact CG-CB 4.42Å; Y1174-K1197 WeakPolarHBondContact OH-CD 3.25Å; I1193-K1197 HydrophobicContact CG2-CD 4.44Å; I1193-K1197 WeakPolarHBondContact O-CB 3.43Å; I1193-K1197 WeakPolarHBondContact O-CG 3.34Å; I1193-K1197 PolarHBondContact O-N 3.42Å; I1193-K1197 VanDerWaalsContact O-N 3.09Å; Q1195-K1197 PolarHBondContact O-N 3.01Å
1198	H	91.6	Very high	90	Very high	39 Å²	39	63.7 Å²	63.7	18%	0.181	35%	0.351	C	S	.	.	H	α-helix	trans	-86.1	-22.5	176.5	-170.7	-154	0	0	0	113.4	Y1174 Y1189 C1194 Q1195 P1200 F1201 H1202	Y1174-H1198 HydrophobicContact CD2-CB 3.9Å; Y1174-H1198 HydrophobicContact CG-CB 4.28Å; Y1189-H1198 HydrophobicContact CE1-CB 3.66Å; Y1189-H1198 AromaticContact CE1-CG 3.96Å; Y1189-H1198 AromaticContact CE1-ND1 3.47Å; Y1189-H1198 WeakPolarHBondContact CE1-ND1 3.26Å; Y1189-H1198 AromaticContact CZ-ND1 3.79Å; Y1189-H1198 PolarHBondContact OH-ND1 3.29Å; C1194-H1198 WeakPolarHBondContact O-CB 3.45Å; C1194-H1198 PolarHBondContact O-N 3.41Å; C1194-H1198 VanDerWaalsContact O-N 3.16Å; Q1195-H1198 PolarHBondContact O-N 3.02Å; H1198-P1200 VanDerWaalsContact C-CD 3.44Å; H1198-F1201 PolarHBondContact O-N 2.61Å; H1198-H1202 PolarHBondContact O-N 2.76Å
1199	W	87.7	Confident	89.1	Confident	86 Å²	86	64.1 Å²	64.1	33%	0.326	35%	0.354	S	S	.	.	H	α-helix	trans	-52	-42.4	-172.5	-174.9	-108.5	0	0	0	114.9	Q1195 F1201 H1202 M1203 C1206 A1209	Q1195-W1199 VanDerWaalsContact O-CB 3.28Å; Q1195-W1199 WeakPolarHBondContact O-CB 3.42Å; Q1195-W1199 PolarHBondContact O-N 3.21Å; W1199-F1201 PolarHBondContact O-N 3.2Å; W1199-H1202 AromaticContact CZ3-CD2 3.95Å; W1199-H1202 PolarHBondContact O-N 2.94Å; W1199-M1203 HydrophobicContact CD2-CB 4.23Å; W1199-M1203 HydrophobicContact CH2-CG 4.5Å; W1199-M1203 HydrophobicContact CZ2-CB 4.05Å; W1199-M1203 HydrophobicContact CZ2-CG 3.75Å; W1199-M1203 HydrophobicContact CZ2-SD 4.07Å; W1199-M1203 PolarHBondContact NE1-SD 2.86Å; W1199-M1203 VanDerWaalsContact NE1-SD 3.44Å; W1199-M1203 WeakPolarHBondContact O-CB 3.17Å; W1199-M1203 PolarHBondContact O-N 2.81Å; W1199-C1206 HydrophobicContact CH2-CB 4.35Å; W1199-C1206 HydrophobicContact CZ3-CB 4.35Å; W1199-A1209 HydrophobicContact CH2-CB 4.15Å; W1199-A1209 HydrophobicContact CZ2-CB 4.41Å
1200	P	88.3	Confident	88.1	Confident	86 Å²	86	70.1 Å²	70.1	56%	0.558	38%	0.38	S	S	*	.	H	α-helix	trans	-56.3	-35.9	177.4	-26.7	36	0	0	0	113.7	S1196 H1198	S1196-P1200 WeakPolarHBondContact O-CD 2.94Å; H1198-P1200 VanDerWaalsContact C-CD 3.44Å
1201	F	87.9	Confident	86.9	Confident	160 Å²	160	72.3 Å²	72.3	70%	0.702	40%	0.396	S	S	*	.	H	α-helix	trans	-83.1	-41.6	178.4	-50.1	-83.1	0	0	0	111.5	H1198 W1199	H1198-F1201 PolarHBondContact O-N 2.61Å; W1199-F1201 PolarHBondContact O-N 3.2Å
1202	H	90.7	Very high	85.5	Confident	6 Å²	6	75.8 Å²	75.8	3%	0.028	41%	0.41	C	S	.	.	H	α-helix	trans	-70.8	-37	-177.7	-177.9	50	0	0	0	113.4	C1183 C1184 T1187 H1198 W1199 A1204 S1205 C1206	C1183-H1202 PolarHBondContact SG-NE2 3.3Å; C1183-H1202 VanDerWaalsContact SG-NE2 3.44Å; C1184-H1202 VanDerWaalsContact SG-CE1 3.56Å; T1187-H1202 PolarHBondContact OG1-CE1 3.36Å; H1198-H1202 PolarHBondContact O-N 2.76Å; W1199-H1202 AromaticContact CZ3-CD2 3.95Å; W1199-H1202 PolarHBondContact O-N 2.94Å; H1202-A1204 VanDerWaalsContact C-N 3.3Å; H1202-A1204 PolarHBondContact O-N 3.34Å; H1202-A1204 VanDerWaalsContact O-N 3.12Å; H1202-S1205 PolarHBondContact ND1-OG 3.35Å; H1202-S1205 CarbonylContact O-C 3.52Å; H1202-S1205 WeakPolarHBondContact O-CA 3.32Å; H1202-S1205 PolarHBondContact O-N 2.62Å; H1202-S1205 PolarHBondContact O-OG 2.95Å; H1202-C1206 WeakPolarHBondContact NE2-CB 3.38Å; H1202-C1206 PolarHBondContact NE2-SG 3.03Å; H1202-C1206 PolarHBondContact O-N 3.25Å
1203	M	89.5	Confident	84	Confident	94 Å²	94	77.9 Å²	77.9	46%	0.463	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-39.5	-168.4	-177.9	174.1	66	0	0	114.1	W1199 S1205 C1206 A1209	W1199-M1203 HydrophobicContact CD2-CB 4.23Å; W1199-M1203 HydrophobicContact CH2-CG 4.5Å; W1199-M1203 HydrophobicContact CZ2-CB 4.05Å; W1199-M1203 HydrophobicContact CZ2-CG 3.75Å; W1199-M1203 HydrophobicContact CZ2-SD 4.07Å; W1199-M1203 PolarHBondContact NE1-SD 2.86Å; W1199-M1203 VanDerWaalsContact NE1-SD 3.44Å; W1199-M1203 WeakPolarHBondContact O-CB 3.17Å; W1199-M1203 PolarHBondContact O-N 2.81Å; M1203-S1205 VanDerWaalsContact C-N 3.26Å; M1203-S1205 PolarHBondContact O-N 2.87Å; M1203-C1206 PolarHBondContact O-N 3.36Å; M1203-A1209 HydrophobicContact CG-CB 4.35Å
1204	A	84.7	Confident	82.3	Confident	78 Å²	78	79.3 Å²	79.3	65%	0.645	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-28.2	178.2	0	0	0	0	0	113.7	H1202 K1210	H1202-A1204 VanDerWaalsContact C-N 3.3Å; H1202-A1204 PolarHBondContact O-N 3.34Å; H1202-A1204 VanDerWaalsContact O-N 3.12Å; A1204-K1210 WeakPolarHBondContact O-CE 3.39Å; A1204-K1210 PolarHBondContact O-NZ 2.98Å
1205	S	87.5	Confident	80.2	Confident	75 Å²	75	84.2 Å²	84.2	52%	0.524	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-19.7	178	72.4	0	0	0	0	113.7	H1202 M1203 V1207	H1202-S1205 PolarHBondContact ND1-OG 3.35Å; H1202-S1205 CarbonylContact O-C 3.52Å; H1202-S1205 WeakPolarHBondContact O-CA 3.32Å; H1202-S1205 PolarHBondContact O-N 2.62Å; H1202-S1205 PolarHBondContact O-OG 2.95Å; M1203-S1205 VanDerWaalsContact C-N 3.26Å; M1203-S1205 PolarHBondContact O-N 2.87Å; S1205-V1207 PolarHBondContact O-N 2.8Å
1206	C	88.9	Confident	78.1	Confident	0 Å²	0	86.5 Å²	86.5	0%	0	46%	0.463	C	S	.	.			trans	-64.3	119.2	-172.1	-175.6	0	0	0	0	112.3	W1199 H1202 M1203 Q1208 A1209 K1210	W1199-C1206 HydrophobicContact CH2-CB 4.35Å; W1199-C1206 HydrophobicContact CZ3-CB 4.35Å; H1202-C1206 WeakPolarHBondContact NE2-CB 3.38Å; H1202-C1206 PolarHBondContact NE2-SG 3.03Å; H1202-C1206 PolarHBondContact O-N 3.25Å; M1203-C1206 PolarHBondContact O-N 3.36Å; C1206-Q1208 VanDerWaalsContact C-N 3.31Å; C1206-Q1208 PolarHBondContact O-N 2.56Å; C1206-A1209 HydrophobicContact CB-CB 3.86Å; C1206-A1209 PolarHBondContact O-N 2.99Å; C1206-K1210 PolarHBondContact O-N 3.03Å
1207	V	82.9	Confident	75.8	Confident	88 Å²	88	89.6 Å²	89.6	53%	0.533	47%	0.474	S	S	.	.	H	α-helix	trans	-64	-37	178.7	-176.7	0	0	0	0	111.3	S1205 K1210 S1211	S1205-V1207 PolarHBondContact O-N 2.8Å; V1207-K1210 PolarHBondContact O-N 3.37Å; V1207-S1211 PolarHBondContact O-N 3.45Å
1208	Q	79.9	Confident	73.1	Confident	93 Å²	93	91.3 Å²	91.3	44%	0.435	49%	0.489	S	S	.	.	H	α-helix	trans	-67.6	-41	178.1	-67.2	-166.6	-6.9	0	0	112.3	C1183 C1206 K1210 S1211 Q1212	C1183-Q1208 WeakPolarHBondContact O-CG 3.38Å; C1183-Q1208 PolarHBondContact O-NE2 2.94Å; C1183-Q1208 PolarHBondContact O-OE1 2.86Å; C1206-Q1208 VanDerWaalsContact C-N 3.31Å; C1206-Q1208 PolarHBondContact O-N 2.56Å; Q1208-K1210 VanDerWaalsContact C-N 3.3Å; Q1208-K1210 PolarHBondContact O-N 3.36Å; Q1208-S1211 PolarHBondContact O-N 2.84Å; Q1208-S1211 VanDerWaalsContact O-N 3.08Å; Q1208-S1211 PolarHBondContact O-OG 3.09Å; Q1208-Q1212 PolarHBondContact O-N 2.8Å
1209	A	73.6	Confident	70.3	Confident	15 Å²	15	94.1 Å²	94.1	12%	0.124	51%	0.513	C	S	.	.	H	α-helix	trans	-58	-41.9	176.6	0	0	0	0	0	112	W1199 M1203 C1206 S1211 Q1212 L1213	W1199-A1209 HydrophobicContact CH2-CB 4.15Å; W1199-A1209 HydrophobicContact CZ2-CB 4.41Å; M1203-A1209 HydrophobicContact CG-CB 4.35Å; C1206-A1209 HydrophobicContact CB-CB 3.86Å; C1206-A1209 PolarHBondContact O-N 2.99Å; A1209-S1211 VanDerWaalsContact C-N 3.34Å; A1209-S1211 PolarHBondContact O-N 3.19Å; A1209-Q1212 PolarHBondContact O-N 3.31Å; A1209-L1213 PolarHBondContact O-N 2.8Å; A1209-L1213 VanDerWaalsContact O-N 3.08Å
1210	K	73	Confident	67.6	Low	127 Å²	127	95.3 Å²	95.3	55%	0.552	53%	0.534	S	S	*	.	H	α-helix	trans	-64.7	-35.1	176	-67.3	-178.1	-178.8	176.7	0	112.7	A1204 C1206 V1207 Q1208 N1214	A1204-K1210 WeakPolarHBondContact O-CE 3.39Å; A1204-K1210 PolarHBondContact O-NZ 2.98Å; C1206-K1210 PolarHBondContact O-N 3.03Å; V1207-K1210 PolarHBondContact O-N 3.37Å; Q1208-K1210 VanDerWaalsContact C-N 3.3Å; Q1208-K1210 PolarHBondContact O-N 3.36Å; K1210-N1214 PolarHBondContact O-N 3.16Å
1211	S	68.7	Low	65	Low	64 Å²	64	97.2 Å²	97.2	45%	0.448	54%	0.544	S	S	.	.	H	α-helix	trans	-69.3	-38	174.3	68.7	0	0	0	0	113.6	V1207 Q1208 A1209 N1214 N1215	V1207-S1211 PolarHBondContact O-N 3.45Å; Q1208-S1211 PolarHBondContact O-N 2.84Å; Q1208-S1211 VanDerWaalsContact O-N 3.08Å; Q1208-S1211 PolarHBondContact O-OG 3.09Å; A1209-S1211 VanDerWaalsContact C-N 3.34Å; A1209-S1211 PolarHBondContact O-N 3.19Å; S1211-N1214 PolarHBondContact O-N 2.79Å; S1211-N1215 PolarHBondContact O-N 3.31Å
1212	Q	62.8	Low	62.4	Low	130 Å²	130	101 Å²	101	61%	0.607	55%	0.554	S	S	*	*	H	α-helix	trans	-69.9	-37.7	176.9	-71.3	-168.1	-7.2	0	0	112.7	Q1208 A1209 N1214 N1215 N1216	Q1208-Q1212 PolarHBondContact O-N 2.8Å; A1209-Q1212 PolarHBondContact O-N 3.31Å; Q1212-N1214 VanDerWaalsContact C-N 3.27Å; Q1212-N1214 PolarHBondContact O-N 3.02Å; Q1212-N1215 PolarHBondContact O-N 3.02Å; Q1212-N1215 VanDerWaalsContact O-N 3.15Å; Q1212-N1216 PolarHBondContact O-N 3.03Å; Q1212-N1216 VanDerWaalsContact O-N 3.15Å
1213	L	61.7	Low	59.6	Low	122 Å²	122	110.8 Å²	110.8	64%	0.639	59%	0.59	S	S	*	*	H	α-helix	trans	-60.1	-35.7	174	-77.3	166.7	0	0	0	112.6	A1209	A1209-L1213 PolarHBondContact O-N 2.8Å; A1209-L1213 VanDerWaalsContact O-N 3.08Å
1214	N	56.3	Low	57.1	Low	129 Å²	129	113.9 Å²	113.9	69%	0.69	60%	0.603	S	S	*	*	H	α-helix	trans	-68.8	-35.3	174.2	-100.7	12.4	0	0	0	113.2	K1210 S1211 Q1212	K1210-N1214 PolarHBondContact O-N 3.16Å; S1211-N1214 PolarHBondContact O-N 2.79Å; Q1212-N1214 VanDerWaalsContact C-N 3.27Å; Q1212-N1214 PolarHBondContact O-N 3.02Å
1215	N	53.2	Low	54.5	Low	115 Å²	115	114.3 Å²	114.3	62%	0.615	60%	0.601	S	S	*	*	H	α-helix	trans	-75.2	-31.8	-178.6	-77.1	-1.5	0	0	0	113.1	S1211 Q1212 N1217 N1218	S1211-N1215 PolarHBondContact O-N 3.31Å; Q1212-N1215 PolarHBondContact O-N 3.02Å; Q1212-N1215 VanDerWaalsContact O-N 3.15Å; N1215-N1217 PolarHBondContact O-N 3.32Å; N1215-N1217 VanDerWaalsContact O-N 3.15Å; N1215-N1218 PolarHBondContact O-N 2.81Å
1216	N	48.7	Very low	52	Low	116 Å²	116	120.1 Å²	120.1	62%	0.62	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-67.3	-14.8	-175.3	-76.5	-4.4	0	0	0	114.5	Q1212 N1218	Q1212-N1216 PolarHBondContact O-N 3.03Å; Q1212-N1216 VanDerWaalsContact O-N 3.15Å; N1216-N1218 PolarHBondContact O-N 3.08Å
1217	N	42.6	Very low	49.1	Very low	141 Å²	141	125.5 Å²	125.5	75%	0.754	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-70.6	-11.4	170.6	-77.9	-18.7	0	0	0	113.6	N1215	N1215-N1217 PolarHBondContact O-N 3.32Å; N1215-N1217 VanDerWaalsContact O-N 3.15Å
1218	N	35.9	Very low	46.8	Very low	154 Å²	154	126.3 Å²	126.3	82%	0.824	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-110.3	30.5	179.3	-88.8	-20	0	0	0	114.2	N1215 N1216	N1215-N1218 PolarHBondContact O-N 2.81Å; N1216-N1218 PolarHBondContact O-N 3.08Å
1219	S	31.4	Very low	44.4	Very low	98 Å²	98	128.6 Å²	128.6	69%	0.685	68%	0.68	S	S	*	*			trans	-139.8	45.5	174.7	-56.6	0	0	0	0	114.4
1220	S	31.2	Very low	42.2	Very low	111 Å²	111	135 Å²	135	78%	0.776	71%	0.712	S	S	*	*			trans	-71.9	151.8	160.4	-80.4	0	0	0	0	111.2
1221	V	34.5	Very low	39.9	Very low	125 Å²	125	134.5 Å²	134.5	76%	0.758	72%	0.719	S	S	*	*			trans	75.4	81.1	171.5	-163.9	0	0	0	0	117.3
1222	R	32.6	Very low	37.9	Very low	241 Å²	241	138 Å²	138	91%	0.909	73%	0.733	S	S	*	*			trans	169	80.9	135.6	-92.2	166.4	-155.7	-124.2	6.2	106.8
1223	R	32.3	Very low	36.1	Very low	211 Å²	211	136.6 Å²	136.6	80%	0.796	74%	0.738	S	S	*	*				49.1	128.4	66.4	-74.5	-157.5	-173.9	-167.8	5.7	114.1
1224	H	35.7	Very low	34.5	Very low	159 Å²	159	134.9 Å²	134.9	74%	0.736	74%	0.736	S	S	*	*			trans	69.9	139.4	169	-59	-65.4	0	0	0	118
1225	S	31.9	Very low	33.1	Very low	86 Å²	86	135.6 Å²	135.6	60%	0.601	74%	0.739	S	S	*	*			cis	170.1	116.5	-42.3	42.5	0	0	0	0	108
1226	Q	33.1	Very low	31.9	Very low	198 Å²	198	136.8 Å²	136.8	93%	0.925	74%	0.744	S	S	*	*			trans	-169.7	112.6	158.1	-107.4	150.3	43	0	0	111.2
1227	S	28.9	Very low	30.9	Very low	112 Å²	112	138.3 Å²	138.3	78%	0.783	75%	0.751	S	S	*	*			trans	-81.4	163.4	143.2	-40.4	0	0	0	0	107.1
1228	P	34.8	Very low	30.1	Very low	105 Å²	105	137.4 Å²	137.4	68%	0.682	75%	0.746	S	S	*	*				-152	-157.9	63.6	39.7	-16.7	0	0	0	114
1229	N	29.8	Very low	29.7	Very low	142 Å²	142	138.6 Å²	138.6	76%	0.759	75%	0.747	S	S	*	*			trans	68.9	129.6	160.8	-61.3	-4.2	0	0	0	116.3
1230	L	26.3	Very low	29.4	Very low	150 Å²	150	138 Å²	138	79%	0.785	74%	0.742	S	S	*	*			cis	69.8	123.3	9.6	-117.7	175.7	0	0	0	116.2
1231	T	26.3	Very low	29.2	Very low	116 Å²	116	140.3 Å²	140.3	71%	0.712	74%	0.741	S	S	*	*			trans	78.4	143.9	177	74.6	0	0	0	0	118.6
1232	N	25.3	Very low	28.7	Very low	137 Å²	137	142.9 Å²	142.9	73%	0.733	74%	0.742	S	S	*	*			trans	59.6	124.8	164.9	-65.3	-20.2	0	0	0	119.7
1233	S	26	Very low	28.5	Very low	101 Å²	101	135.3 Å²	135.3	71%	0.706	73%	0.726	S	S	*	*			cis	85.2	153.7	41.5	-62	0	0	0	0	113.6
1234	S	27.1	Very low	28.2	Very low	86 Å²	86	133.3 Å²	133.3	60%	0.601	73%	0.73	S	S	*	*			trans	52.4	90.6	159	55.2	0	0	0	0	116.7
1235	N	28.2	Very low	27.8	Very low	143 Å²	143	132 Å²	132	77%	0.765	73%	0.734	S	S	*	*				174.9	124.6	104.5	-82.1	-15.9	0	0	0	108.3
1236	I	27.5	Very low	27.6	Very low	140 Å²	140	135.3 Å²	135.3	72%	0.718	74%	0.74	S	S	*	*			cis	57.4	97.3	42.2	-43.5	174.6	0	0	0	111.2
1237	I	26.8	Very low	27.8	Very low	149 Å²	149	132 Å²	132	76%	0.764	74%	0.735	S	S	*	*				-172.2	151.6	126.7	-96.5	157	0	0	0	109.3
1238	D	26	Very low	27.7	Very low	122 Å²	122	130.5 Å²	130.5	65%	0.652	73%	0.725	S	S	*	*			trans	-50.4	138.3	-174.6	-45.6	-80.2	0	0	0	116.2
1239	Q	28.7	Very low	27.5	Very low	178 Å²	178	129.4 Å²	129.4	83%	0.832	73%	0.725	S	S	*	*				-164.7	119.9	100.4	-93.2	143.3	75.9	0	0	107.9
1240	S	25.4	Very low	27.5	Very low	85 Å²	85	129.6 Å²	129.6	59%	0.594	72%	0.724	S	S	*	*			cis	71.9	124.7	48.7	89	0	0	0	0	113.4
1241	H	26.6	Very low	27.9	Very low	160 Å²	160	130 Å²	130	74%	0.741	72%	0.722	S	S	*	*			trans	72.5	135.1	163.3	-75.7	-126.4	0	0	0	119.3
1242	F	24.5	Very low	28.3	Very low	180 Å²	180	131.9 Å²	131.9	79%	0.789	72%	0.722	S	S	*	*			trans	60.4	138.9	141.7	-77.2	-118.8	0	0	0	118.3
1243	S	26.6	Very low	28.4	Very low	82 Å²	82	131.9 Å²	131.9	57%	0.573	72%	0.722	S	S	*	*			cis	-141.1	163.9	5.1	-65.4	0	0	0	0	107.9
1244	L	27	Very low	28.6	Very low	169 Å²	169	130.8 Å²	130.8	89%	0.885	71%	0.714	S	S	*	*			cis	59.3	46	44	-129.7	178	0	0	0	114.4
1245	T	28	Very low	28.8	Very low	132 Å²	132	134.2 Å²	134.2	81%	0.81	72%	0.721	S	S	*	*			trans	-146	136.9	160.4	11.8	0	0	0	0	112.8
1246	Q	26.1	Very low	29	Very low	155 Å²	155	134 Å²	134	72%	0.724	72%	0.72	S	S	*	*			trans	-81.3	172.5	176.7	-60.5	166.5	-44.4	0	0	110.9	S1248	Q1246-S1248 PolarHBondContact NE2-OG 2.91Å; Q1246-S1248 PolarHBondContact OE1-OG 3.34Å
1247	P	38.3	Very low	29.5	Very low	127 Å²	127	134.6 Å²	134.6	83%	0.825	72%	0.719	S	S	*	*				-115.9	140	91.7	33.5	-34.3	0	0	0	111.4
1248	S	27.7	Very low	30.1	Very low	81 Å²	81	133.3 Å²	133.3	57%	0.566	72%	0.72	S	S	*	*			cis	56.7	68.2	12.8	-73.2	0	0	0	0	116.3	Q1246	Q1246-S1248 PolarHBondContact NE2-OG 2.91Å; Q1246-S1248 PolarHBondContact OE1-OG 3.34Å
1249	A	30.5	Very low	30.4	Very low	83 Å²	83	136.5 Å²	136.5	69%	0.686	73%	0.725	S	S	*	*				-129.2	121.3	126	0	0	0	0	0	105.4
1250	I	29.8	Very low	31.1	Very low	145 Å²	145	133 Å²	133	74%	0.744	72%	0.718	S	S	*	*				64.7	117.9	78	-63.9	166	0	0	0	108.8
1251	Q	33.4	Very low	32	Very low	158 Å²	158	134 Å²	134	74%	0.738	72%	0.722	S	S	*	*			cis	-154	149.9	24.9	-142.3	150.3	15.7	0	0	113.4
1252	H	35.2	Very low	32.4	Very low	156 Å²	156	132.4 Å²	132.4	72%	0.722	73%	0.728	S	S	*	*			trans	41.7	128.8	144.7	-76.5	-131.8	0	0	0	121.7
1253	L	27.4	Very low	32.9	Very low	137 Å²	137	127.7 Å²	127.7	72%	0.717	73%	0.731	S	S	*	*				98.3	133.7	53.5	-143.1	85.3	0	0	0	111.2
1254	S	29.8	Very low	33.3	Very low	79 Å²	79	129 Å²	129	55%	0.552	75%	0.747	S	S	*	*			trans	70.4	148	147.6	-76.2	0	0	0	0	119.6
1255	Q	31.7	Very low	33.9	Very low	157 Å²	157	125.8 Å²	125.8	73%	0.734	75%	0.745	S	S	*	*			cis	-171.5	178.4	-13.3	-120.1	159.9	-15.5	0	0	109.8
1256	N	33	Very low	34.4	Very low	140 Å²	140	125.8 Å²	125.8	75%	0.749	75%	0.746	S	S	*	*			trans	80	98.6	153.4	-58.9	-24.5	0	0	0	121.2
1257	H	36.3	Very low	35	Very low	151 Å²	151	122.8 Å²	122.8	70%	0.699	75%	0.748	S	S	*	*				-13.8	154	117.1	-72.7	-62	0	0	0	116.9	Y1259	H1257-Y1259 HydrophobicContact CB-CD2 4.31Å; H1257-Y1259 AromaticContact CE1-CE2 3.99Å; H1257-Y1259 AromaticContact ND1-CD2 3.85Å; H1257-Y1259 AromaticContact ND1-CE2 3.75Å
1258	P	39.8	Very low	35.3	Very low	122 Å²	122	122.4 Å²	122.4	79%	0.792	75%	0.746	S	S	*	*				-132.1	146.8	52.5	12.6	14	0	0	0	116.3
1259	Y	33.7	Very low	35.9	Very low	190 Å²	190	123.9 Å²	123.9	75%	0.745	75%	0.753	S	S	*	*				79.5	155.8	80.6	-88.1	-99.2	0	0	0	114.7	H1257	H1257-Y1259 HydrophobicContact CB-CD2 4.31Å; H1257-Y1259 AromaticContact CE1-CE2 3.99Å; H1257-Y1259 AromaticContact ND1-CD2 3.85Å; H1257-Y1259 AromaticContact ND1-CE2 3.75Å
1260	P	43.4	Very low	36.6	Very low	105 Å²	105	125.2 Å²	125.2	68%	0.682	76%	0.755	S	S	*	*			trans	-126.6	-132.4	-130.3	29.7	-1.5	0	0	0	110.7
1261	P	43.6	Very low	37.1	Very low	105 Å²	105	123.4 Å²	123.4	68%	0.682	75%	0.753	S	S	*	*			cis	-144.6	179.1	-10.8	44.6	-25.1	0	0	0	118.9
1262	S	35.7	Very low	37.4	Very low	126 Å²	126	119.9 Å²	119.9	88%	0.881	74%	0.744	S	S	*	*			trans	67	123.5	146.4	-65.5	0	0	0	0	123.1
1263	G	33.9	Very low	37.5	Very low	81 Å²	81	118.7 Å²	118.7	84%	0.835	74%	0.738	S	S	*	*			trans	-176.6	146.5	160.4	0	0	0	0	0	111
1264	A	35.3	Very low	38	Very low	111 Å²	111	117.5 Å²	117.5	92%	0.917	73%	0.729	S	S	*	*			trans	-141.1	143.1	-169.9	0	0	0	0	0	114.8
1265	A	40.3	Very low	38.3	Very low	101 Å²	101	119.7 Å²	119.7	84%	0.835	73%	0.726	S	S	*	*			trans	-164.2	168.4	172.1	0	0	0	0	0	111.9
1266	P	38.3	Very low	38.7	Very low	131 Å²	131	118 Å²	118	85%	0.851	72%	0.718	S	S	*	*			trans	-117.9	-178.4	-160.1	38.8	-24.9	0	0	0	117.3
1267	A	38.5	Very low	39	Very low	92 Å²	92	118.6 Å²	118.6	76%	0.76	72%	0.716	S	S	*	*			trans	-81.3	177.3	-179.3	0	0	0	0	0	114.5
1268	P	43.9	Very low	39.1	Very low	119 Å²	119	120.2 Å²	120.2	77%	0.773	72%	0.723	S	S	*	*			cis	-123.7	-142.3	-0.5	42.9	-23.9	0	0	0	111.2
1269	P	40	Very low	39.1	Very low	112 Å²	112	122 Å²	122	73%	0.727	72%	0.721	S	S	*	*			cis	-135.3	174	-15.5	38	-17.5	0	0	0	117.8
1270	P	45.3	Very low	39.4	Very low	112 Å²	112	121.9 Å²	121.9	73%	0.727	73%	0.726	S	S	*	*			trans	-89.4	173.9	168.7	42	-40.1	0	0	0	112.5
1271	P	41.5	Very low	38.9	Very low	106 Å²	106	123.5 Å²	123.5	69%	0.688	73%	0.729	S	S	*	*				-142.7	-108.9	73.5	28.3	0.2	0	0	0	120.1
1272	P	38.6	Very low	38.8	Very low	85 Å²	85	127.7 Å²	127.7	55%	0.552	74%	0.74	S	S	*	*				-137.5	-166	-119.6	45.6	-26.3	0	0	0	120.2
1273	H	37.7	Very low	39	Very low	131 Å²	131	128.6 Å²	128.6	61%	0.606	73%	0.73	S	S	*	*			trans	85.6	56.7	154.8	-80.9	-56.3	0	0	0	124.2	A896 T897	A896-H1273 CarbonylContact C-O 3.49Å; A896-H1273 WeakPolarHBondContact CA-O 3.23Å; T897-H1273 WeakPolarHBondContact CA-O 3.37Å; T897-H1273 HydrophobicContact CG2-CB 3.9Å; T897-H1273 WeakPolarHBondContact CG2-O 3.44Å; T897-H1273 PolarHBondContact N-O 3.11Å; T897-H1273 VanDerWaalsContact N-O 3.09Å
1274	H	38.9	Very low	39.1	Very low	111 Å²	111	131.7 Å²	131.7	51%	0.514	72%	0.722	S	S	.	*				28.3	138.4	120.6	162.4	89.8	0	0	0	124.3	A896	A896-H1274 CarbonylContact O-C 3.53Å
1275	Y	36.1	Very low	39.2	Very low	125 Å²	125	134.6 Å²	134.6	49%	0.49	72%	0.717	S	S	.	*			trans	-154.9	-117.9	144.3	-152.6	-136.2	0	0	0	119.4	A896 V898	A896-Y1275 WeakPolarHBondContact O-CB 3.43Å; A896-Y1275 PolarHBondContact O-N 2.66Å; V898-Y1275 HydrophobicContact CG2-CD2 3.63Å; V898-Y1275 HydrophobicContact CG2-CE2 3.87Å; V898-Y1275 HydrophobicContact CG2-CG 4.14Å
1276	H	39	Very low	39	Very low	122 Å²	122	139.3 Å²	139.3	57%	0.565	72%	0.721	S	S	*	*			trans	-148.3	-179.8	-156.8	-88.3	24.2	0	0	0	113.8
1277	H	38.8	Very low	38.8	Very low	152 Å²	152	140.9 Å²	140.9	70%	0.704	72%	0.718	S	S	*	*			cis	-169.1	144.3	9.3	-135.1	5.9	0	0	0	113.6
1278	H	39.9	Very low	38.7	Very low	186 Å²	186	145 Å²	145	86%	0.861	72%	0.721	S	S	*	*			trans	175.7	169.1	134.4	-116.5	-93.2	0	0	0	116.4
1279	H	38.9	Very low	38.1	Very low	159 Å²	159	150.7 Å²	150.7	74%	0.736	73%	0.727	S	S	*	*			trans	-114.6	151.7	-172.4	-94.6	-91.3	0	0	0	115.4
1280	H	39.5	Very low	37.5	Very low	187 Å²	187	153.2 Å²	153.2	87%	0.866	73%	0.731	S	S	*	*				-170	161.9	119.7	-119.1	-88.3	0	0	0	115.1
1281	N	34.1	Very low	36.8	Very low	139 Å²	139	155.8 Å²	155.8	74%	0.743	74%	0.737	S	S	*	*			trans	-111.1	145.9	175.9	-80.6	-54	0	0	0	112
1282	H	39.8	Very low	36.2	Very low	194 Å²	194	156.3 Å²	156.3	90%	0.898	73%	0.733	S	S	*	*			trans	-160.8	-171.4	137.1	-129.4	-108.6	0	0	0	115
1283	H	40.2	Very low	35.8	Very low	145 Å²	145	158.2 Å²	158.2	67%	0.671	75%	0.746	S	S	*	*			trans	-116.6	163.6	-138.1	-156	41.6	0	0	0	115.7
1284	Q	36.7	Very low	35.3	Very low	145 Å²	145	158.8 Å²	158.8	68%	0.678	75%	0.754	S	S	*	*			trans	82.2	119.6	151.3	-81.4	169.4	14.3	0	0	124.9
1285	Q	36.3	Very low	35	Very low	173 Å²	173	160.2 Å²	160.2	81%	0.808	77%	0.77	S	S	*	*			trans	48.8	118.2	133.8	-62.5	-176.8	17.4	0	0	122.5
1286	Q	37.9	Very low	34.8	Very low	199 Å²	199	159.2 Å²	159.2	93%	0.93	78%	0.782	S	S	*	*			trans	-156.4	157.2	130.5	-111.6	167.6	44.5	0	0	111.2
1287	Q	32.6	Very low	34.3	Very low	165 Å²	165	160.8 Å²	160.8	77%	0.771	79%	0.794	S	S	*	*			trans	-118.6	131.4	175.6	-66.7	178.4	-8.5	0	0	110
1288	Q	36.3	Very low	34	Very low	179 Å²	179	158.8 Å²	158.8	84%	0.836	80%	0.797	S	S	*	*			trans	-170.6	137	149.7	-111.1	151.2	99.8	0	0	114.7
1289	R	32.7	Very low	33.6	Very low	237 Å²	237	154.9 Å²	154.9	89%	0.894	79%	0.791	S	S	*	*			trans	44.3	133.3	154.1	-65.5	-176.6	177.1	-126.7	-2.1	120.9
1290	M	26.2	Very low	33.3	Very low	166 Å²	166	155.4 Å²	155.4	82%	0.818	80%	0.797	S	S	*	*			trans	-80.5	155.2	166.9	-52.1	-166.1	-52.8	0	0	112.1	L1292	M1290-L1292 HydrophobicContact CE-CD1 4.14Å
1291	I	31.6	Very low	32.8	Very low	165 Å²	165	150 Å²	150	85%	0.846	79%	0.792	S	S	*	*			trans	-131.2	130.1	155.3	-61.6	179.3	0	0	0	106.6
1292	L	28.3	Very low	32.7	Very low	117 Å²	117	146.3 Å²	146.3	61%	0.613	79%	0.786	S	S	*	*			trans	-89.2	141.4	169.6	-83.8	75.3	0	0	0	109.5	M1290 N1294	M1290-L1292 HydrophobicContact CE-CD1 4.14Å; L1292-N1294 PolarHBondContact O-N 3.36Å
1293	P	30.8	Very low	32.2	Very low	125 Å²	125	143.6 Å²	143.6	81%	0.812	78%	0.777	S	S	*	*			trans	-77.4	101.5	154.8	31.6	-28.4	0	0	0	109.1
1294	N	26.8	Very low	31.7	Very low	144 Å²	144	147.5 Å²	147.5	77%	0.77	79%	0.788	S	S	*	*			trans	-90	119.4	157.5	-89.2	2.9	0	0	0	108	L1292	L1292-N1294 PolarHBondContact O-N 3.36Å
1295	T	32.5	Very low	31.6	Very low	141 Å²	141	145.7 Å²	145.7	87%	0.865	79%	0.788	S	S	*	*			trans	-120.7	148	161.7	48.4	0	0	0	0	108.9
1296	S	32	Very low	31.4	Very low	104 Å²	104	145.3 Å²	145.3	73%	0.727	79%	0.791	S	S	*	*			trans	-137	141	-148.7	57.6	0	0	0	0	115.6
1297	N	29	Very low	31	Very low	155 Å²	155	142.2 Å²	142.2	83%	0.829	78%	0.781	S	S	*	*			trans	44	114.5	144.3	-64.4	-3.2	0	0	0	121.3
1298	S	32	Very low	31	Very low	110 Å²	110	139.7 Å²	139.7	77%	0.769	77%	0.773	S	S	*	*				-154.7	118.6	126.6	48.1	0	0	0	0	107.9
1299	S	31.5	Very low	30.8	Very low	104 Å²	104	138 Å²	138	73%	0.727	77%	0.769	S	S	*	*				68.6	125.6	67.3	-60.7	0	0	0	0	111.4
1300	I	31.9	Very low	30.7	Very low	170 Å²	170	129.8 Å²	129.8	87%	0.872	76%	0.758	S	S	*	*			cis	-136.9	162	11.9	-69.1	102.6	0	0	0	107
1301	G	30.5	Very low	31	Very low	73 Å²	73	129.4 Å²	129.4	75%	0.753	76%	0.76	S	S	*	*			cis	114.1	154.6	20.6	0	0	0	0	0	110.2
1302	G	30.9	Very low	30.7	Very low	61 Å²	61	126.7 Å²	126.7	63%	0.629	76%	0.755	S	S	*	*			cis	-143.3	-177.4	6.5	0	0	0	0	0	113.3
1303	I	30.2	Very low	30.7	Very low	138 Å²	138	129.1 Å²	129.1	71%	0.708	77%	0.767	S	S	*	*				72.6	120.5	84.8	-59.4	167.1	0	0	0	110.4
1304	Y	29.7	Very low	30.6	Very low	227 Å²	227	128.8 Å²	128.8	89%	0.89	76%	0.763	S	S	*	*				-136.6	148.2	54.2	-74	-90.7	0	0	0	116.5
1305	P	34.3	Very low	30.6	Very low	106 Å²	106	128.1 Å²	128.1	69%	0.688	76%	0.764	S	S	*	*			trans	-120.9	164.2	172	41.3	-31.2	0	0	0	115.2
1306	L	30.9	Very low	30.5	Very low	166 Å²	166	128.8 Å²	128.8	87%	0.869	76%	0.762	S	S	*	*			trans	-137.5	122.6	150.3	-73.8	173.8	0	0	0	107.9
1307	N	29.8	Very low	30.3	Very low	134 Å²	134	130 Å²	130	72%	0.717	76%	0.761	S	S	*	*				66.4	134.7	64.1	-100.6	6.3	0	0	0	114.5
1308	N	32.1	Very low	30.3	Very low	111 Å²	111	129.5 Å²	129.5	59%	0.594	76%	0.757	S	S	*	*			cis	-162.2	165.3	0.8	-153.3	-2.6	0	0	0	113.7
1309	N	32.4	Very low	30.3	Very low	144 Å²	144	128.6 Å²	128.6	77%	0.77	75%	0.748	S	S	*	*			trans	64.4	141.6	160.1	-59	-40.6	0	0	0	119.4
1310	G	31.7	Very low	30.1	Very low	64 Å²	64	132.5 Å²	132.5	66%	0.66	75%	0.752	S	S	*	*			cis	175.8	177.4	-4.5	0	0	0	0	0	114
1311	N	31.7	Very low	29.9	Very low	159 Å²	159	131.3 Å²	131.3	85%	0.85	74%	0.743	S	S	*	*			trans	65.4	107.5	-179.4	-61.7	-24.2	0	0	0	115.8
1312	S	26.1	Very low	29.8	Very low	107 Å²	107	135.8 Å²	135.8	75%	0.748	74%	0.737	S	S	*	*				89.8	109	59.9	-73.3	0	0	0	0	113.2
1313	I	28.2	Very low	29.6	Very low	169 Å²	169	135.5 Å²	135.5	87%	0.867	73%	0.725	S	S	*	*			trans	-179.2	149.5	133.1	-93.7	155.9	0	0	0	111.1
1314	T	29.3	Very low	29.6	Very low	117 Å²	117	130.9 Å²	130.9	72%	0.718	70%	0.702	S	S	*	*			trans	-47	147.4	-168	53.1	0	0	0	0	120.6
1315	T	25.7	Very low	29.5	Very low	130 Å²	130	124.9 Å²	124.9	80%	0.798	69%	0.685	S	S	*	*			trans	-33.4	129.5	157.9	52.2	0	0	0	0	118.2
1316	N	30	Very low	29.3	Very low	155 Å²	155	127.2 Å²	127.2	83%	0.829	69%	0.691	S	S	*	*			trans	-157.3	128.9	143.7	-82	-49.1	0	0	0	105.1
1317	N	29.2	Very low	29.2	Very low	129 Å²	129	124.2 Å²	124.2	69%	0.69	68%	0.683	S	S	*	*			cis	72	124.8	37.9	-136.2	-14.3	0	0	0	113
1318	I	27.2	Very low	29.2	Very low	146 Å²	146	123 Å²	123	75%	0.749	69%	0.686	S	S	*	*			trans	92.8	139.5	-179	-59.3	175	0	0	0	115.5
1319	P	32	Very low	29.1	Very low	90 Å²	90	122.7 Å²	122.7	58%	0.584	69%	0.692	S	S	*	*			trans	-122.1	157.1	-155.7	41.4	-26.8	0	0	0	116.3
1320	F	28	Very low	29	Very low	186 Å²	186	121.7 Å²	121.7	82%	0.816	70%	0.696	S	S	*	*			trans	-142.4	124.5	166.3	-81.8	-86.4	0	0	0	106.3
1321	Q	28.8	Very low	29	Very low	145 Å²	145	122.4 Å²	122.4	68%	0.678	70%	0.704	S	S	*	*			cis	59.2	117.9	36.7	-151.3	-155.7	50.2	0	0	112.3
1322	R	28	Very low	29	Very low	168 Å²	168	121 Å²	121	63%	0.634	70%	0.701	S	S	*	*			trans	65.8	130.3	154.2	-111.1	178.5	-164.3	173	3.2	115.7
1323	S	26.4	Very low	29.4	Very low	54 Å²	54	124.6 Å²	124.6	38%	0.378	71%	0.706	S	S	.	*			trans	-47.7	153	132.6	40	0	0	0	0	107
1324	L	31	Very low	29.5	Very low	41 Å²	41	121.6 Å²	121.6	22%	0.215	70%	0.7	C	S	.	*				-152	-152.3	51.2	-35.3	97	0	0	0	114.3	D703 I705 V706	D703-L1324 VanDerWaalsContact C-CD2 3.48Å; D703-L1324 HydrophobicContact CB-CB 4.1Å; D703-L1324 HydrophobicContact CB-CD1 3.31Å; D703-L1324 HydrophobicContact CB-CG 4.12Å; D703-L1324 VanDerWaalsContact CG-CD1 3.41Å; D703-L1324 WeakPolarHBondContact O-CD2 3.45Å; D703-L1324 WeakPolarHBondContact OD1-CA 3.43Å; D703-L1324 WeakPolarHBondContact OD1-CB 3.36Å; D703-L1324 WeakPolarHBondContact OD1-CD1 3.49Å; D703-L1324 PolarHBondContact OD1-N 3.48Å; D703-L1324 WeakPolarHBondContact OD2-CB 3.44Å; I705-L1324 HydrophobicContact CB-CB 4.01Å; I705-L1324 HydrophobicContact CB-CD2 3.78Å; I705-L1324 HydrophobicContact CB-CG 4.34Å; I705-L1324 HydrophobicContact CG1-CB 4.11Å; V706-L1324 HydrophobicContact CB-CD2 3.38Å; V706-L1324 HydrophobicContact CG2-CD2 3.32Å; V706-L1324 HydrophobicContact CG2-CG 4.26Å
1325	L	27.2	Very low	29.7	Very low	102 Å²	102	126.9 Å²	126.9	53%	0.534	71%	0.707	S	S	.	*			trans	-115.5	119.3	-167.2	-77.9	166	0	0	0	112.7	D703 P704 I705	D703-L1325 PolarHBondContact OD2-N 3.4Å; P704-L1325 WeakPolarHBondContact CD-O 3.27Å; P704-L1325 WeakPolarHBondContact CG-O 3.46Å; I705-L1325 HydrophobicContact CD1-CD1 4.03Å; I705-L1325 HydrophobicContact CD1-CG 3.85Å; I705-L1325 HydrophobicContact CG1-CB 4.32Å; I705-L1325 HydrophobicContact CG1-CD1 3.67Å; I705-L1325 HydrophobicContact CG1-CG 3.78Å
1326	L	29.8	Very low	30.1	Very low	154 Å²	154	126 Å²	126	81%	0.806	70%	0.702	S	S	*	*			trans	-155.7	156.7	132.1	-136	67.1	0	0	0	114.5	P704	P704-L1326 HydrophobicContact CG-CD1 4.31Å
1327	S	27.8	Very low	30.1	Very low	103 Å²	103	127.5 Å²	127.5	72%	0.72	70%	0.701	S	S	*	*			trans	-68.8	154.3	-170.1	49.3	0	0	0	0	116.3
1328	S	30.4	Very low	30.1	Very low	110 Å²	110	130 Å²	130	77%	0.769	71%	0.706	S	S	*	*				-168.4	145.7	118.8	39	0	0	0	0	114.9
1329	S	30.9	Very low	30.3	Very low	103 Å²	103	134.6 Å²	134.6	72%	0.72	73%	0.732	S	S	*	*			trans	61.2	107.9	153.8	51.3	0	0	0	0	122.3
1330	S	29.4	Very low	30.2	Very low	123 Å²	123	136.8 Å²	136.8	86%	0.86	74%	0.739	S	S	*	*			trans	61	115.9	131.6	63	0	0	0	0	121.7
1331	G	32.9	Very low	30.3	Very low	80 Å²	80	134.2 Å²	134.2	83%	0.825	74%	0.735	S	S	*	*			trans	-176.4	96.1	162.4	0	0	0	0	0	111.5
1332	T	30.1	Very low	30.4	Very low	129 Å²	129	133.6 Å²	133.6	79%	0.791	74%	0.739	S	S	*	*			trans	-81.4	160.4	-174.5	50.4	0	0	0	0	114.1
1333	Q	34.8	Very low	30.5	Very low	182 Å²	182	131.6 Å²	131.6	85%	0.85	75%	0.745	S	S	*	*			trans	95.7	143.5	170.6	-56	174.1	27.4	0	0	115.6
1334	S	31.8	Very low	30.8	Very low	106 Å²	106	136.4 Å²	136.4	74%	0.741	77%	0.768	S	S	*	*			cis	178.2	145.2	-35.1	-104	0	0	0	0	108.4
1335	R	32.9	Very low	30.8	Very low	228 Å²	228	142.8 Å²	142.8	86%	0.86	81%	0.805	S	S	*	*			trans	65.9	104.8	167.2	-69.3	179.7	172.4	174.3	-3	116.1
1336	T	33.9	Very low	31	Very low	113 Å²	113	145.7 Å²	145.7	69%	0.693	82%	0.824	S	S	*	*				60.8	119.8	80.6	67.2	0	0	0	0	113.1
1337	F	29.3	Very low	31.1	Very low	186 Å²	186	145.1 Å²	145.1	82%	0.816	83%	0.825	S	S	*	*				-158.7	172.5	61.9	-118.2	-87.3	0	0	0	114.1
1338	K	30.7	Very low	31.4	Very low	182 Å²	182	148.6 Å²	148.6	79%	0.791	83%	0.834	S	S	*	*			trans	-51	139.6	-177.3	-55.1	171.6	179.7	-178.1	0	115.4
1339	N	30	Very low	31.5	Very low	241 Å²	241	152.1 Å²	152.1	100%	1.289	84%	0.84	S	S	*	*				-137.1	0	100.2	-113.8	5.2	0	0	0	108.8

Retrieved 1,339 of 1,339 residues in 1367 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).