A0A077Z9Q5_TRITR Loading...

Rho GTPase activating protein syd 1

AlphaFold DB , UniProt , Accession A0A077Z9Q5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,059 aa.

						>A0A077Z9Q5_TRITR|A0A077Z9Q5
MPWDSFRRKKRPSRSKDDIAPVVGCFSKTSSSLEGRQRDLPKEVYQKIKEIDQQTSTLSASNPVGLCARILDRYEYVQQLPNGQEKMYICQTVEMIKKPGQTLGIYLREGNGIDRASGVFVSRLMEGCDVEKSCVLSAGDEIVSVNDVDVTRTSIDDVVVMISIPRRLLLRIRSEKRDPRTVVTFPPPIKPMEKPVVVLKQMPREDSKDSVMTDESKPLASSQPLTTAQTSLGTRARLQAMKTSTATEQTEEAPSGSRQNIFRKSYPTTGNAAANVGASAQQHLGIDQQPPTRSMSDRWSYSRQLAMHTPRILDGEGRPVGSDGLRKQEQSSPQRLQSGKMPTAAAAAAAAAAAADGSTLSHTAYILPPKLKNASLPSAERMATSRSDRLSSSRVDSRSYGHYKVPSSLPDSINTANPALYSPRTVVSDSEACTSYEFSQRCLSARMPTGRLPDEGKTVRYPRPNVREPVVGSMKSNSLPRLHNRRTIRWSSELVTKTDEGFPPQTVADVSDSDGVVSAPELSLSPVKYAMDKSSYQPSAKTIDEVFSRAEYQAWVNSANRQTAMRLKSQMRPHKETEPQEPGPSRASAKSRSSSMPPHGLLFAEVPRRATEALTLERSPQISRYPIDVSPLPRRRYPLQIASSNVNSFFAGVSPTSTHGQTSGSPFTGLLIIQIFEGRFLRASNDTDELYCVIEVDTEHRARTEVKNRAAKFQWRESFEIDVWESRVVELYIYSWHPQFRHKLRHRGSLQLLDPLLMPSLLENRSQSFALNLEPRGQLILRLGFLSMLLMYRRQLALRPSTYWAWIPIVFEQNIEGIPLATLVEREASGYEVPILVIRLIQEIERRGLDSIGLYVLCGSVEKKLCLVSEIESNPLTADLSPEAVPDINVLTSVFKDWLCAMPEPLISSCTYQTLVDAWRVCIPEDREGNFRLIFGVLDCLPNVNKCTLIAVMDHLKNVLSQAPHSGLTVGKLCRIFAPLLFCTSVATCLKDKSTTINLLDNKLATRLMGTVLNLWPSRMNNSDSNGSDNGASAGALTKDSVSLINMYWKGGKLPESSC
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.5	Very low	27.3	Very low	237 Å²	237	194.1 Å²	194.1	100%	1.167	86%	0.861	S	S	*	*				0	151.7	0	-56.5	170.6	89.3	0	0	107.6
2	P	41.4	Very low	27.4	Very low	118 Å²	118	188.5 Å²	188.5	77%	0.766	86%	0.858	S	S	*	*			cis	-84.8	-176.4	-27.8	0.9	22.7	0	0	0	109.3
3	W	21.7	Very low	27.4	Very low	237 Å²	237	183.2 Å²	183.2	90%	0.898	86%	0.856	S	S	*	*				61.1	137.9	50.1	-60.8	38	0	0	0	111.6
4	D	28.3	Very low	27.4	Very low	120 Å²	120	188.1 Å²	188.1	64%	0.642	86%	0.863	S	S	*	*			cis	-157	166.8	20.9	-150.3	-48.4	0	0	0	113
5	S	29.1	Very low	27.5	Very low	83 Å²	83	181.9 Å²	181.9	58%	0.58	85%	0.849	S	S	*	*			trans	69.1	153.6	147.8	-76.9	0	0	0	0	121.6
6	F	28.1	Very low	27.5	Very low	195 Å²	195	183.6 Å²	183.6	86%	0.855	85%	0.853	S	S	*	*			cis	-143.5	159.4	-0.8	-126.9	-64.5	0	0	0	112.3
7	R	23.8	Very low	27.6	Very low	232 Å²	232	180.3 Å²	180.3	88%	0.875	84%	0.843	S	S	*	*			trans	-68.2	149.5	-176.1	-59.6	171.8	172.5	177	-3.9	116.2
8	R	26.8	Very low	27.7	Very low	252 Å²	252	179.8 Å²	179.8	95%	0.951	85%	0.847	S	S	*	*			trans	-142.1	145.4	137.5	-103.8	-176.4	-174.1	-164.3	2	113.5
9	K	23.9	Very low	27.7	Very low	206 Å²	206	179.1 Å²	179.1	90%	0.896	85%	0.847	S	S	*	*			trans	-55.7	146.1	-164.1	-57.2	169.8	178.5	178.4	0	116.3
10	K	27.6	Very low	27.6	Very low	213 Å²	213	174.8 Å²	174.8	93%	0.926	84%	0.844	S	S	*	*			trans	-116.5	161.4	148.5	-91.5	-173.2	175.9	179.7	0	110.4
11	R	22.6	Very low	27.7	Very low	242 Å²	242	171.7 Å²	171.7	91%	0.913	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-79.5	146.3	-171.1	-58.8	172.4	178.6	164.7	-3	112.3
12	P	28.5	Very low	27.6	Very low	127 Å²	127	167.5 Å²	167.5	83%	0.825	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-79.9	149.2	158.5	34	-32.3	0	0	0	111.1
13	S	27.7	Very low	26.9	Very low	119 Å²	119	168 Å²	168	83%	0.832	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-83.3	157.4	168.1	39.2	0	0	0	0	111.3
14	R	27.3	Very low	27.1	Very low	252 Å²	252	159.7 Å²	159.7	95%	0.951	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-77.5	120.5	171.6	-78	175.9	164.3	168.4	-7.4	110.3
15	S	27.9	Very low	26.9	Very low	95 Å²	95	159.5 Å²	159.5	66%	0.664	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-81.9	171	141.3	65.7	0	0	0	0	109	D17	S15-D17 PolarHBondContact OG-OD2 3.15Å
16	K	28.6	Very low	26.9	Very low	210 Å²	210	163 Å²	163	91%	0.913	83%	0.825	S	S	*	*			trans	-137.2	79.9	-177.7	-169.7	-168.7	177.9	-167.9	0	109.7
17	D	28	Very low	26.7	Very low	127 Å²	127	157.4 Å²	157.4	68%	0.679	81%	0.81	S	S	*	*			trans	-103.4	131.4	175.2	-51.9	-75.4	0	0	0	108.9	S15	S15-D17 PolarHBondContact OG-OD2 3.15Å
18	D	30.6	Very low	26.9	Very low	171 Å²	171	156.1 Å²	156.1	91%	0.914	81%	0.811	S	S	*	*			trans	-155.9	100.1	160.9	-102.9	-40.2	0	0	0	108.6
19	I	27.7	Very low	26.9	Very low	166 Å²	166	149.2 Å²	149.2	85%	0.851	80%	0.797	S	S	*	*			trans	-104.4	116.3	171.4	-63.3	173.6	0	0	0	106.8	P21	I19-P21 WeakPolarHBondContact O-CD 3.35Å
20	A	25.3	Very low	27.1	Very low	94 Å²	94	144 Å²	144	78%	0.777	79%	0.787	S	S	*	*			trans	-85.5	118.2	-178.3	0	0	0	0	0	111.7
21	P	28.8	Very low	27.1	Very low	109 Å²	109	139.7 Å²	139.7	71%	0.708	78%	0.783	S	S	*	*			trans	-82.2	137.6	171	33	-33	0	0	0	111.1	I19 V23	I19-P21 WeakPolarHBondContact O-CD 3.35Å; P21-V23 PolarHBondContact O-N 3.15Å
22	V	25.3	Very low	27.4	Very low	149 Å²	149	132.7 Å²	132.7	90%	0.903	77%	0.771	S	S	*	*			trans	-71.2	112.3	179.9	178.6	0	0	0	0	110.9
23	V	26.7	Very low	27.7	Very low	130 Å²	130	133 Å²	133	79%	0.788	77%	0.766	S	S	*	*			trans	-132.5	109.2	171.2	-178.7	0	0	0	0	108.9	P21	P21-V23 PolarHBondContact O-N 3.15Å
24	G	25.9	Very low	27.7	Very low	61 Å²	61	137.1 Å²	137.1	63%	0.629	77%	0.771	S	S	*	*			trans	-142.9	45.2	-159.5	0	0	0	0	0	116.7
25	C	25.3	Very low	27.7	Very low	117 Å²	117	128.5 Å²	128.5	79%	0.791	76%	0.761	S	S	*	*	S	Bend	trans	-143.8	24.9	168.2	-146.9	0	0	0	0	116.2
26	F	28.2	Very low	28	Very low	156 Å²	156	132.7 Å²	132.7	68%	0.684	76%	0.763	S	S	*	*	S	Bend	trans	-156.1	56.3	161.6	-102.8	-66.5	0	0	0	111.1	Y106 M125	F26-Y106 HydrophobicContact CE2-CE1 4.34Å; F26-Y106 HydrophobicContact CZ-CE1 4.48Å; F26-M125 HydrophobicContact CD2-CE 4.36Å
27	S	25.5	Very low	28.5	Very low	78 Å²	78	132.1 Å²	132.1	55%	0.545	76%	0.763	S	S	.	*			trans	-124.7	48.3	-172.8	47.7	0	0	0	0	113.5
28	K	26.4	Very low	29.4	Very low	205 Å²	205	131.9 Å²	131.9	89%	0.891	75%	0.753	S	S	*	*	S	Bend	trans	-129.1	27.4	169.5	-76.4	-164.9	174.1	-177.5	0	114.4
29	T	28.3	Very low	31	Very low	106 Å²	106	130.9 Å²	130.9	65%	0.65	75%	0.747	S	S	*	*	S	Bend	trans	-141.6	42.3	176.1	52.9	0	0	0	0	112.6
30	S	26.5	Very low	33.2	Very low	98 Å²	98	124 Å²	124	69%	0.685	71%	0.712	S	S	*	*	S	Bend	trans	-114.8	-19.2	175.1	49.7	0	0	0	0	114.3
31	S	28.2	Very low	36	Very low	122 Å²	122	122.8 Å²	122.8	85%	0.853	70%	0.696	S	S	*	*	S	Bend	trans	-101.2	23	-179.8	56.3	0	0	0	0	114.4
32	S	29.3	Very low	38.5	Very low	95 Å²	95	125.9 Å²	125.9	66%	0.664	70%	0.699	S	S	*	*	S	Bend	trans	-136.9	4.3	-178.3	-164.6	0	0	0	0	113.5
33	L	33.9	Very low	41.4	Very low	134 Å²	134	125.2 Å²	125.2	70%	0.702	69%	0.686	S	S	*	*	S	Bend	trans	-84	-19.2	-174.1	-92.9	160.4	0	0	0	114.3	G35	L33-G35 VanDerWaalsContact C-N 3.29Å
34	E	28.1	Very low	44.3	Very low	204 Å²	204	120.2 Å²	120.2	95%	0.953	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-14.5	175.5	-63.8	-178.8	123.7	0	0	112.9
35	G	28.4	Very low	47.2	Very low	72 Å²	72	122.2 Å²	122.2	74%	0.742	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	2.6	-176.1	0	0	0	0	0	116	L33	L33-G35 VanDerWaalsContact C-N 3.29Å
36	R	32.9	Very low	50.2	Low	183 Å²	183	123.1 Å²	123.1	69%	0.691	64%	0.637	S	S	*	*			trans	-153.7	77.6	-174.7	-120.7	173.8	-175.5	171.1	2.8	113.8	R38	R36-R38 HydrophobicContact CG-CG 4.42Å; R36-R38 PolarHBondContact O-N 3.5Å
37	Q	38.9	Very low	53	Low	197 Å²	197	120.5 Å²	120.5	92%	0.921	63%	0.625	S	S	*	*			trans	-72.4	75.5	170.5	-168.9	174.4	27.1	0	0	110.9	D39	Q37-D39 PolarHBondContact O-N 3.13Å
38	R	47.2	Very low	55.9	Low	122 Å²	122	116.9 Å²	116.9	46%	0.46	60%	0.6	S	S	.	*			trans	-76.1	110.2	-180	-74.9	176	166.5	179.6	-9.1	112	R36 L40 D156	R36-R38 HydrophobicContact CG-CG 4.42Å; R36-R38 PolarHBondContact O-N 3.5Å; R38-L40 PolarHBondContact O-N 2.89Å; R38-D156 IonicContact CZ-OD2 3.82Å; R38-D156 IonicContact NH1-OD2 2.71Å; R38-D156 PolarHBondContact NH1-OD2 2.83Å; R38-D156 IonicContact NH2-OD2 2.71Å
39	D	64.3	Low	58.8	Low	151 Å²	151	113.5 Å²	113.5	81%	0.807	59%	0.585	S	S	*	*				46.7	3.9	125.8	-49	-37.8	0	0	0	122.4	Q37 P41	Q37-D39 PolarHBondContact O-N 3.13Å; D39-P41 WeakPolarHBondContact O-CD 3.3Å
40	L	73.8	Confident	61.6	Low	21 Å²	21	114.1 Å²	114.1	11%	0.11	58%	0.581	C	S	.	*			trans	-69.9	122.9	166.6	-100.5	163.2	0	0	0	109.7	R38 V44 Y45 D157 V160 M161	R38-L40 PolarHBondContact O-N 2.89Å; L40-V44 HydrophobicContact CD2-CB 4.39Å; L40-V44 HydrophobicContact CD2-CG1 3.76Å; L40-Y45 HydrophobicContact CB-CD2 4.02Å; L40-Y45 HydrophobicContact CB-CE2 3.59Å; L40-D157 HydrophobicContact CD1-CB 4.5Å; L40-D157 HydrophobicContact CD2-CB 4.36Å; L40-D157 HydrophobicContact CG-CB 4.39Å; L40-V160 HydrophobicContact CD1-CB 3.83Å; L40-V160 HydrophobicContact CD1-CG1 3.48Å; L40-V160 VanDerWaalsContact CD1-CG1 3.48Å; L40-M161 HydrophobicContact CD1-CG 4.07Å; L40-M161 HydrophobicContact CD2-CG 3.91Å; L40-M161 HydrophobicContact CD2-SD 4.01Å
41	P	83.7	Confident	64.4	Low	68 Å²	68	110 Å²	110	44%	0.442	55%	0.551	S	S	.	*			trans	-58.4	150.4	-174	-26.6	34.6	0	0	0	114	D39 E43 V44 Y45	D39-P41 WeakPolarHBondContact O-CD 3.3Å; P41-E43 VanDerWaalsContact C-N 3.26Å; P41-E43 VanDerWaalsContact CB-OE2 3.27Å; P41-E43 WeakPolarHBondContact CB-OE2 3.4Å; P41-E43 PolarHBondContact O-N 2.86Å; P41-V44 HydrophobicContact CB-CG2 4.18Å; P41-V44 HydrophobicContact CG-CG2 4.33Å; P41-V44 WeakPolarHBondContact O-CB 3.47Å; P41-V44 PolarHBondContact O-N 2.92Å; P41-Y45 PolarHBondContact O-N 3.49Å
42	K	82.9	Confident	67.2	Low	174 Å²	174	106.7 Å²	106.7	76%	0.757	52%	0.524	S	S	*	.	H	α-helix	trans	-62.2	-35.2	-175.7	-71.7	-178.5	179.4	174.8	0	111.9	V44 Y45 Q46	K42-V44 VanDerWaalsContact C-N 3.3Å; K42-V44 PolarHBondContact O-N 3.22Å; K42-Y45 PolarHBondContact O-N 3.31Å; K42-Q46 VanDerWaalsContact O-CB 3.31Å; K42-Q46 WeakPolarHBondContact O-CB 3.14Å; K42-Q46 PolarHBondContact O-N 3.27Å
43	E	86.1	Confident	69.9	Low	135 Å²	135	108.9 Å²	108.9	63%	0.631	52%	0.524	S	S	*	.	H	α-helix	trans	-64.5	-35.9	177.4	-52.1	72.6	-157.2	0	0	111.4	P41 Q46 K47	P41-E43 VanDerWaalsContact C-N 3.26Å; P41-E43 VanDerWaalsContact CB-OE2 3.27Å; P41-E43 WeakPolarHBondContact CB-OE2 3.4Å; P41-E43 PolarHBondContact O-N 2.86Å; E43-Q46 PolarHBondContact O-N 3.42Å; E43-K47 PolarHBondContact O-N 2.88Å
44	V	86.9	Confident	72.4	Confident	25 Å²	25	107.1 Å²	107.1	15%	0.152	51%	0.512	C	S	.	.	H	α-helix	trans	-68.4	-48.4	178.1	175.1	0	0	0	0	110.3	L40 P41 K42 Q46 K47 I48 V148 M161	L40-V44 HydrophobicContact CD2-CB 4.39Å; L40-V44 HydrophobicContact CD2-CG1 3.76Å; P41-V44 HydrophobicContact CB-CG2 4.18Å; P41-V44 HydrophobicContact CG-CG2 4.33Å; P41-V44 WeakPolarHBondContact O-CB 3.47Å; P41-V44 PolarHBondContact O-N 2.92Å; K42-V44 VanDerWaalsContact C-N 3.3Å; K42-V44 PolarHBondContact O-N 3.22Å; V44-Q46 VanDerWaalsContact C-N 3.25Å; V44-Q46 PolarHBondContact O-N 3.17Å; V44-K47 PolarHBondContact O-N 3.5Å; V44-I48 HydrophobicContact CG1-CD1 3.77Å; V44-I48 WeakPolarHBondContact O-CB 3.46Å; V44-I48 WeakPolarHBondContact O-CD1 3.45Å; V44-I48 VanDerWaalsContact O-CG1 3.25Å; V44-I48 WeakPolarHBondContact O-CG1 3.43Å; V44-I48 PolarHBondContact O-N 3.29Å; V44-V148 HydrophobicContact CG1-CG1 4.23Å; V44-V148 HydrophobicContact CG1-CG2 4.29Å; V44-V148 HydrophobicContact CG2-CG1 4.22Å; V44-M161 HydrophobicContact CG1-CE 3.89Å; V44-M161 HydrophobicContact CG1-CG 4.34Å; V44-M161 HydrophobicContact CG1-SD 4.22Å
45	Y	86.1	Confident	74.6	Confident	104 Å²	104	104 Å²	104	41%	0.408	51%	0.507	S	S	.	.	H	α-helix	trans	-56.1	-41.3	171.6	-95.3	-81.3	0	0	0	112.2	L40 P41 K42 K49 I164	L40-Y45 HydrophobicContact CB-CD2 4.02Å; L40-Y45 HydrophobicContact CB-CE2 3.59Å; P41-Y45 PolarHBondContact O-N 3.49Å; K42-Y45 PolarHBondContact O-N 3.31Å; Y45-K49 VanDerWaalsContact O-CB 3.26Å; Y45-K49 WeakPolarHBondContact O-CB 3.34Å; Y45-K49 PolarHBondContact O-N 3.08Å; Y45-K49 VanDerWaalsContact O-N 3.08Å; Y45-I164 HydrophobicContact CD1-CD1 4.23Å; Y45-I164 HydrophobicContact CE1-CD1 3.43Å; Y45-I164 VanDerWaalsContact CE1-CD1 3.43Å; Y45-I164 HydrophobicContact CE1-CG1 4.41Å
46	Q	88.5	Confident	77.1	Confident	136 Å²	136	101.1 Å²	101.1	64%	0.636	48%	0.475	S	S	*	.	H	α-helix	trans	-68.5	-47.5	-177.2	-165.2	157	-21.4	0	0	111.6	K42 E43 V44 I48 K49 E50	K42-Q46 VanDerWaalsContact O-CB 3.31Å; K42-Q46 WeakPolarHBondContact O-CB 3.14Å; K42-Q46 PolarHBondContact O-N 3.27Å; E43-Q46 PolarHBondContact O-N 3.42Å; V44-Q46 VanDerWaalsContact C-N 3.25Å; V44-Q46 PolarHBondContact O-N 3.17Å; Q46-I48 PolarHBondContact O-N 2.98Å; Q46-K49 PolarHBondContact O-N 2.7Å; Q46-E50 WeakPolarHBondContact O-CB 3.26Å; Q46-E50 PolarHBondContact O-N 2.73Å
47	K	86.8	Confident	79.1	Confident	100 Å²	100	97.1 Å²	97.1	44%	0.435	47%	0.471	S	S	.	.	H	α-helix	trans	-55.4	-50.6	172	-95.8	-169.9	163.3	-168.1	0	113	E43 V44 K49 E50 I51 D147 V148	E43-K47 PolarHBondContact O-N 2.88Å; V44-K47 PolarHBondContact O-N 3.5Å; K47-K49 VanDerWaalsContact C-N 3.26Å; K47-K49 PolarHBondContact O-N 2.88Å; K47-E50 WeakPolarHBondContact O-CB 3.43Å; K47-E50 PolarHBondContact O-N 2.91Å; K47-E50 VanDerWaalsContact O-N 3.12Å; K47-I51 PolarHBondContact O-N 3.03Å; K47-I51 VanDerWaalsContact O-N 3.14Å; K47-D147 PolarHBondContact NZ-O 2.96Å; K47-V148 HydrophobicContact CB-CG2 4.08Å; K47-V148 HydrophobicContact CD-CG2 3.78Å
48	I	87.2	Confident	80.6	Confident	3 Å²	3	89 Å²	89	2%	0.015	43%	0.434	C	S	.	.	H	α-helix	trans	-56.8	-45.4	-179	-71.6	167.6	0	0	0	110.1	V44 Q46 D52 N146 M161 P165	V44-I48 HydrophobicContact CG1-CD1 3.77Å; V44-I48 WeakPolarHBondContact O-CB 3.46Å; V44-I48 WeakPolarHBondContact O-CD1 3.45Å; V44-I48 VanDerWaalsContact O-CG1 3.25Å; V44-I48 WeakPolarHBondContact O-CG1 3.43Å; V44-I48 PolarHBondContact O-N 3.29Å; Q46-I48 PolarHBondContact O-N 2.98Å; I48-D52 WeakPolarHBondContact O-CB 3.38Å; I48-D52 PolarHBondContact O-N 2.82Å; I48-N146 HydrophobicContact CG1-CB 4.17Å; I48-N146 PolarHBondContact O-ND2 3.17Å; I48-M161 HydrophobicContact CD1-CB 3.89Å; I48-M161 HydrophobicContact CD1-CE 4.1Å; I48-M161 HydrophobicContact CD1-CG 3.76Å; I48-P165 HydrophobicContact CG2-CB 3.87Å; I48-P165 HydrophobicContact CG2-CG 3.78Å
49	K	86.5	Confident	81.5	Confident	133 Å²	133	86.4 Å²	86.4	58%	0.578	44%	0.435	S	S	*	.	H	α-helix	trans	-71.3	-27.2	179.7	-166.3	-176.2	178.4	-176.2	0	113.3	Y45 Q46 K47 Q53	Y45-K49 VanDerWaalsContact O-CB 3.26Å; Y45-K49 WeakPolarHBondContact O-CB 3.34Å; Y45-K49 PolarHBondContact O-N 3.08Å; Y45-K49 VanDerWaalsContact O-N 3.08Å; Q46-K49 PolarHBondContact O-N 2.7Å; K47-K49 VanDerWaalsContact C-N 3.26Å; K47-K49 PolarHBondContact O-N 2.88Å; K49-Q53 WeakPolarHBondContact O-CG 3.24Å; K49-Q53 PolarHBondContact O-N 2.81Å; K49-Q53 PolarHBondContact O-NE2 3.35Å
50	E	88.3	Confident	81.1	Confident	120 Å²	120	83.8 Å²	83.8	56%	0.561	43%	0.434	S	S	*	.	H	α-helix	trans	-68.1	-48.1	175.3	-142.4	164.7	-140.4	0	0	110.6	Q46 K47 D52 Q53 Q54	Q46-E50 WeakPolarHBondContact O-CB 3.26Å; Q46-E50 PolarHBondContact O-N 2.73Å; K47-E50 WeakPolarHBondContact O-CB 3.43Å; K47-E50 PolarHBondContact O-N 2.91Å; K47-E50 VanDerWaalsContact O-N 3.12Å; E50-D52 VanDerWaalsContact C-N 3.35Å; E50-D52 PolarHBondContact O-N 2.88Å; E50-Q53 PolarHBondContact O-N 3.43Å; E50-Q54 PolarHBondContact O-N 3.28Å
51	I	85.2	Confident	80.1	Confident	12 Å²	12	83.8 Å²	83.8	6%	0.062	44%	0.435	C	S	.	.	H	α-helix	trans	-69.1	-30.9	177	-74.5	163.5	0	0	0	112.4	K47 Q53 Q54 N146 D147 R167 L169	K47-I51 PolarHBondContact O-N 3.03Å; K47-I51 VanDerWaalsContact O-N 3.14Å; I51-Q53 VanDerWaalsContact C-N 3.31Å; I51-Q53 PolarHBondContact O-N 2.91Å; I51-Q54 PolarHBondContact O-N 2.95Å; I51-N146 HydrophobicContact CB-CB 4.12Å; I51-N146 VanDerWaalsContact CD1-C 3.43Å; I51-N146 HydrophobicContact CD1-CB 3.95Å; I51-N146 VanDerWaalsContact CD1-O 3.3Å; I51-N146 WeakPolarHBondContact CD1-O 3.46Å; I51-N146 HydrophobicContact CG2-CB 3.98Å; I51-N146 WeakPolarHBondContact CG2-ND2 3.49Å; I51-D147 HydrophobicContact CD1-CB 3.93Å; I51-D147 WeakPolarHBondContact CD1-OD2 3.17Å; I51-R167 PolarHBondContact O-NH1 3.45Å; I51-L169 HydrophobicContact CG2-CD1 3.79Å; I51-L169 HydrophobicContact CG2-CG 4.23Å
52	D	86.2	Confident	78.6	Confident	51 Å²	51	88 Å²	88	27%	0.273	45%	0.454	S	S	.	.	H	α-helix	trans	-68.1	-28	174.8	-164.1	34.2	0	0	0	113.2	I48 E50 P165 R166 R167	I48-D52 WeakPolarHBondContact O-CB 3.38Å; I48-D52 PolarHBondContact O-N 2.82Å; E50-D52 VanDerWaalsContact C-N 3.35Å; E50-D52 PolarHBondContact O-N 2.88Å; D52-P165 HydrophobicContact CB-CB 3.77Å; D52-P165 VanDerWaalsContact CG-CB 3.48Å; D52-P165 WeakPolarHBondContact OD2-CA 3.22Å; D52-R166 VanDerWaalsContact CG-N 3.34Å; D52-R166 WeakPolarHBondContact OD1-CA 3.35Å; D52-R166 PolarHBondContact OD1-N 3.25Å; D52-R166 PolarHBondContact OD2-N 3.15Å; D52-R167 PolarHBondContact OD1-N 3.18Å
53	Q	86.2	Confident	77.2	Confident	142 Å²	142	80.6 Å²	80.6	66%	0.664	42%	0.424	S	S	*	.	H	α-helix	trans	-86.1	-12.5	178	-74.5	171.8	103.3	0	0	114	K49 E50 I51	K49-Q53 WeakPolarHBondContact O-CG 3.24Å; K49-Q53 PolarHBondContact O-N 2.81Å; K49-Q53 PolarHBondContact O-NE2 3.35Å; E50-Q53 PolarHBondContact O-N 3.43Å; I51-Q53 VanDerWaalsContact C-N 3.31Å; I51-Q53 PolarHBondContact O-N 2.91Å
54	Q	86.4	Confident	75.9	Confident	97 Å²	97	81.2 Å²	81.2	45%	0.453	44%	0.437	S	S	.	.	S	Bend	trans	-70	132	177.3	-70.8	171	4.9	0	0	111.5	E50 I51 S56	E50-Q54 PolarHBondContact O-N 3.28Å; I51-Q54 PolarHBondContact O-N 2.95Å; Q54-S56 PolarHBondContact O-N 2.9Å
55	T	75.2	Confident	75.2	Confident	138 Å²	138	80.6 Å²	80.6	85%	0.847	44%	0.435	S	S	*	.			trans	-62.4	131.5	172.5	44.4	0	0	0	0	111.9
56	S	80.1	Confident	75.1	Confident	11 Å²	11	76.5 Å²	76.5	8%	0.077	42%	0.42	C	S	.	.			trans	-118.3	147.1	174.5	179.2	0	0	0	0	111.6	Q54 L58 S59 E94	Q54-S56 PolarHBondContact O-N 2.9Å; S56-L58 PolarHBondContact O-N 3.09Å; S56-L58 PolarHBondContact OG-N 2.86Å; S56-S59 PolarHBondContact N-OG 2.93Å; S56-S59 PolarHBondContact O-N 3.35Å; S56-S59 PolarHBondContact O-OG 3.09Å; S56-E94 WeakPolarHBondContact CB-OE1 3.27Å; S56-E94 PolarHBondContact OG-OE1 3.49Å; S56-E94 PolarHBondContact OG-OE2 2.8Å
57	T	75.1	Confident	74.8	Confident	100 Å²	100	71.2 Å²	71.2	61%	0.613	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-62.3	-24	171.6	57.4	0	0	0	0	112.4	S59 A60 R69	T57-S59 PolarHBondContact O-N 3.28Å; T57-A60 WeakPolarHBondContact O-CB 3.49Å; T57-A60 PolarHBondContact O-N 2.82Å; T57-R69 VanDerWaalsContact OG1-CZ 3.3Å; T57-R69 PolarHBondContact OG1-NH1 3.45Å; T57-R69 PolarHBondContact OG1-NH2 2.79Å
58	L	70.1	Confident	74.8	Confident	27 Å²	27	67.7 Å²	67.7	14%	0.141	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-70.1	-11.2	170.8	-78.2	-179.8	0	0	0	113.9	S56 C67 R69 E94 I96	S56-L58 PolarHBondContact O-N 3.09Å; S56-L58 PolarHBondContact OG-N 2.86Å; L58-C67 HydrophobicContact CD2-CB 4.44Å; L58-R69 HydrophobicContact CD1-CB 4.4Å; L58-R69 HydrophobicContact CD1-CG 3.85Å; L58-R69 HydrophobicContact CG-CG 4.42Å; L58-E94 HydrophobicContact CD1-CB 4.42Å; L58-E94 HydrophobicContact CD1-CG 4.15Å; L58-I96 HydrophobicContact CB-CD1 3.6Å; L58-I96 HydrophobicContact CB-CG1 4.26Å
59	S	65.4	Low	74.6	Confident	67 Å²	67	71.7 Å²	71.7	47%	0.469	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-99.4	0.6	175.8	65.7	0	0	0	0	113.8	S56 T57 S61	S56-S59 PolarHBondContact N-OG 2.93Å; S56-S59 PolarHBondContact O-N 3.35Å; S56-S59 PolarHBondContact O-OG 3.09Å; T57-S59 PolarHBondContact O-N 3.28Å; S59-S61 VanDerWaalsContact C-N 3.33Å; S59-S61 CarbonylContact C-O 3.54Å
60	A	55.9	Low	74.6	Confident	95 Å²	95	68.9 Å²	68.9	79%	0.785	39%	0.393	S	S	*	.	S	Bend	trans	-75.2	-23.9	174.4	0	0	0	0	0	112.4	T57	T57-A60 WeakPolarHBondContact O-CB 3.49Å; T57-A60 PolarHBondContact O-N 2.82Å
61	S	52.7	Low	74.5	Confident	21 Å²	21	67.2 Å²	67.2	15%	0.147	39%	0.387	C	S	.	.	S	Bend	trans	-90.2	151.2	163.5	77.2	0	0	0	0	110.9	S59 P63 E925	S59-S61 VanDerWaalsContact C-N 3.33Å; S59-S61 CarbonylContact C-O 3.54Å; S61-P63 WeakPolarHBondContact O-CD 3.47Å; S61-E925 VanDerWaalsContact CB-CG 3.41Å; S61-E925 WeakPolarHBondContact CB-OE1 3.36Å; S61-E925 PolarHBondContact OG-OE1 3.25Å
62	N	52.8	Low	74.6	Confident	157 Å²	157	69.6 Å²	69.6	84%	0.84	40%	0.4	S	S	*	.			trans	-84.4	101	174.5	-109.9	-37.7	0	0	0	107.8	V64	N62-V64 PolarHBondContact O-N 2.8Å
63	P	53.8	Low	74.8	Confident	18 Å²	18	73.7 Å²	73.7	12%	0.117	41%	0.412	C	S	.	.			trans	-73.5	122	-160	29.6	-35.4	0	0	0	111	S61 G65 C67 K98	S61-P63 WeakPolarHBondContact O-CD 3.47Å; P63-G65 PolarHBondContact O-N 2.69Å; P63-C67 WeakPolarHBondContact CB-SG 3.35Å; P63-K98 WeakPolarHBondContact O-CE 3.41Å; P63-K98 PolarHBondContact O-NZ 3.24Å; P63-K98 VanDerWaalsContact O-NZ 3.17Å
64	V	59.1	Low	74.7	Confident	149 Å²	149	71 Å²	71	90%	0.903	40%	0.396	S	S	*	.	S	Bend	trans	-83.2	55.4	176.3	-167.1	0	0	0	0	110.3	N62	N62-V64 PolarHBondContact O-N 2.8Å
65	G	71	Confident	74.8	Confident	11 Å²	11	70.2 Å²	70.2	11%	0.113	39%	0.393	C	S	.	.	S	Bend	trans	137.1	-144	-175.9	0	0	0	0	0	111	P63	P63-G65 PolarHBondContact O-N 2.69Å
66	L	83.7	Confident	75.2	Confident	18 Å²	18	66.5 Å²	66.5	9%	0.094	36%	0.364	C	S	.	.			trans	-96.6	133.9	168.2	175.1	157.8	0	0	0	110.3	A68 M95 I96 K97 L103 D129 V130	L66-A68 HydrophobicContact CD2-CB 4.05Å; L66-M95 HydrophobicContact CD1-CE 3.96Å; L66-M95 HydrophobicContact CD2-CE 4.3Å; L66-I96 WeakPolarHBondContact CA-O 3.46Å; L66-K97 HydrophobicContact CD1-CB 3.99Å; L66-K97 HydrophobicContact CG-CB 4.4Å; L66-L103 HydrophobicContact CD1-CD2 3.36Å; L66-D129 HydrophobicContact CB-CB 3.81Å; L66-D129 HydrophobicContact CD2-CB 4.31Å; L66-D129 PolarHBondContact N-OD2 3.07Å; L66-D129 VanDerWaalsContact N-OD2 3.15Å; L66-V130 HydrophobicContact CD1-CG2 3.8Å; L66-V130 HydrophobicContact CD2-CG2 4.2Å
67	C	82.1	Confident	75.2	Confident	26 Å²	26	69.5 Å²	69.5	18%	0.176	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	143.5	173.3	-64.4	0	0	0	0	110.1	L58 P63 M95 I96	L58-C67 HydrophobicContact CD2-CB 4.44Å; P63-C67 WeakPolarHBondContact CB-SG 3.35Å; C67-M95 CarbonylContact O-C 3.54Å; C67-M95 WeakPolarHBondContact O-CA 3.49Å; C67-I96 PolarHBondContact N-O 3.27Å; C67-I96 PolarHBondContact O-N 3.31Å
68	A	88.2	Confident	75.5	Confident	26 Å²	26	68.4 Å²	68.4	22%	0.215	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	150.7	-178.5	0	0	0	0	0	112.7	L66 E94 M95 V135	L66-A68 HydrophobicContact CD2-CB 4.05Å; A68-E94 CarbonylContact C-O 3.53Å; A68-E94 VanDerWaalsContact CA-O 3.23Å; A68-E94 WeakPolarHBondContact CA-O 3.37Å; A68-M95 HydrophobicContact CB-CB 4.38Å; A68-M95 HydrophobicContact CB-CG 3.78Å; A68-V135 HydrophobicContact CB-CG1 3.97Å; A68-V135 HydrophobicContact CB-CG2 4.04Å
69	R	82.4	Confident	75.7	Confident	86 Å²	86	73.8 Å²	73.8	33%	0.325	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	160.4	171.7	72.4	-174.6	167.3	168.5	-6.6	112.1	T57 L58 L71 V93 E94	T57-R69 VanDerWaalsContact OG1-CZ 3.3Å; T57-R69 PolarHBondContact OG1-NH1 3.45Å; T57-R69 PolarHBondContact OG1-NH2 2.79Å; L58-R69 HydrophobicContact CD1-CB 4.4Å; L58-R69 HydrophobicContact CD1-CG 3.85Å; L58-R69 HydrophobicContact CG-CG 4.42Å; R69-L71 HydrophobicContact CG-CD2 4.29Å; R69-V93 CarbonylContact O-C 3.48Å; R69-V93 WeakPolarHBondContact O-CA 3.24Å; R69-E94 HydrophobicContact CG-CB 4.24Å; R69-E94 IonicContact CZ-OE2 2.77Å; R69-E94 PolarHBondContact N-O 3.27Å; R69-E94 IonicContact NE-OE2 2.85Å; R69-E94 PolarHBondContact NE-OE2 2.73Å; R69-E94 IonicContact NH2-OE2 3.75Å; R69-E94 PolarHBondContact NH2-OE2 2.84Å; R69-E94 PolarHBondContact O-N 3.05Å
70	I	87	Confident	76.1	Confident	75 Å²	75	72.9 Å²	72.9	39%	0.385	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	132.5	161.9	-59	170.5	0	0	0	107.5	D72 R73 Q91 V93 V135	I70-D72 VanDerWaalsContact CG2-O 3.22Å; I70-D72 WeakPolarHBondContact CG2-O 3.06Å; I70-R73 HydrophobicContact CG2-CB 4.15Å; I70-Q91 HydrophobicContact CG2-CB 4.4Å; I70-V93 HydrophobicContact CG1-CG2 4.06Å; I70-V135 HydrophobicContact CG1-CG1 4.45Å
71	L	85.9	Confident	76.9	Confident	84 Å²	84	75.2 Å²	75.2	44%	0.44	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-38.8	173.2	-72.4	179.1	0	0	0	112.2	R69 T92 E94 L169	R69-L71 HydrophobicContact CG-CD2 4.29Å; L71-T92 PolarHBondContact N-O 2.62Å; L71-E94 HydrophobicContact CD1-CB 3.88Å; L71-E94 HydrophobicContact CD2-CB 4.44Å; L71-E94 HydrophobicContact CG-CB 3.94Å; L71-L169 HydrophobicContact CD1-CD2 3.51Å
72	D	87.4	Confident	78	Confident	62 Å²	62	79 Å²	79	33%	0.332	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	145.1	-174.3	152	55.8	0	0	0	108.5	I70 Q91 T92	I70-D72 VanDerWaalsContact CG2-O 3.22Å; I70-D72 WeakPolarHBondContact CG2-O 3.06Å; D72-Q91 CarbonylContact O-C 3.59Å; D72-Q91 VanDerWaalsContact O-CA 3.23Å; D72-Q91 WeakPolarHBondContact O-CA 3.43Å; D72-T92 PolarHBondContact N-O 3.05Å; D72-T92 PolarHBondContact O-N 3.01Å; D72-T92 PolarHBondContact OD2-OG1 2.91Å
73	R	90.2	Very high	78.9	Confident	137 Å²	137	74.7 Å²	74.7	52%	0.517	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	121.9	173.5	176.3	172	170.1	139.2	-9.7	109.6	I70 I89 C90 Q91	I70-R73 HydrophobicContact CG2-CB 4.15Å; R73-I89 HydrophobicContact CG-CG2 4.03Å; R73-C90 WeakPolarHBondContact CA-O 3.42Å; R73-Q91 HydrophobicContact CB-CB 4.04Å; R73-Q91 HydrophobicContact CG-CB 4.14Å
74	Y	83.8	Confident	79.8	Confident	85 Å²	85	79.5 Å²	79.5	33%	0.333	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	157.8	176.9	65.9	-88.3	0	0	0	110.9	Y76 C90 R171	Y74-Y76 HydrophobicContact CD2-CD1 4.4Å; Y74-Y76 AromaticContact CE2-CD1 3.89Å; Y74-Y76 HydrophobicContact CE2-CD1 3.89Å; Y74-C90 HydrophobicContact CD1-CB 4.1Å; Y74-C90 HydrophobicContact CD2-CB 4.21Å; Y74-C90 HydrophobicContact CE1-CB 3.51Å; Y74-C90 HydrophobicContact CE2-CB 3.65Å; Y74-C90 HydrophobicContact CG-CB 4.42Å; Y74-C90 PolarHBondContact N-O 3.4Å; Y74-C90 PolarHBondContact O-N 2.76Å; Y74-C90 VanDerWaalsContact O-O 3.04Å; Y74-C90 WeakPolarHBondContact OH-CB 2.85Å; Y74-R171 PolarHBondContact OH-NH2 3.27Å
75	E	88.8	Confident	80.6	Confident	82 Å²	82	78.1 Å²	78.1	38%	0.383	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	143.6	175.6	-56.4	-168.6	160.3	0	0	109.6	M87 Y88 I89 K176	E75-M87 HydrophobicContact CB-CE 4.23Å; E75-M87 WeakPolarHBondContact OE2-CE 3.05Å; E75-Y88 CarbonylContact C-O 3.57Å; E75-Y88 WeakPolarHBondContact CA-O 3.47Å; E75-I89 HydrophobicContact CG-CG1 4.01Å; E75-K176 WeakPolarHBondContact OE1-CD 3.17Å; E75-K176 IonicContact OE1-NZ 2.71Å; E75-K176 PolarHBondContact OE1-NZ 3.24Å; E75-K176 IonicContact OE2-NZ 3.17Å; E75-K176 PolarHBondContact OE2-NZ 2.89Å
76	Y	83.1	Confident	81	Confident	59 Å²	59	79.6 Å²	79.6	23%	0.231	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	150.8	175.8	76.2	-84.8	0	0	0	110.8	Y74 Q78 Y88 C90 R173	Y74-Y76 HydrophobicContact CD2-CD1 4.4Å; Y74-Y76 AromaticContact CE2-CD1 3.89Å; Y74-Y76 HydrophobicContact CE2-CD1 3.89Å; Y76-Q78 HydrophobicContact CD2-CB 4.47Å; Y76-Q78 HydrophobicContact CE2-CB 3.97Å; Y76-Y88 HydrophobicContact CE1-CG 4.43Å; Y76-Y88 HydrophobicContact CE2-CD2 4.3Å; Y76-Y88 PolarHBondContact N-O 2.96Å; Y76-Y88 PolarHBondContact O-N 2.92Å; Y76-C90 HydrophobicContact CE1-CB 4.38Å; Y76-R173 WeakPolarHBondContact OH-CD 3.21Å; Y76-R173 PolarHBondContact OH-NH1 3.19Å; Y76-R173 VanDerWaalsContact OH-NH1 3.09Å
77	V	80.3	Confident	80.9	Confident	75 Å²	75	82.2 Å²	82.2	46%	0.455	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	135.4	171.8	179	0	0	0	0	108.6	E85 M87	V77-E85 HydrophobicContact CG1-CB 3.66Å; V77-E85 HydrophobicContact CG1-CG 3.72Å; V77-M87 HydrophobicContact CG2-CG 4.33Å
78	Q	80.9	Confident	81.2	Confident	76 Å²	76	82.3 Å²	82.3	36%	0.355	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	117	171.5	-171.9	167.4	0.9	0	0	109.1	Y76 L80 K86 Y88	Y76-Q78 HydrophobicContact CD2-CB 4.47Å; Y76-Q78 HydrophobicContact CE2-CB 3.97Å; Q78-L80 PolarHBondContact O-N 3.48Å; Q78-K86 PolarHBondContact N-O 2.92Å; Q78-K86 PolarHBondContact O-N 3.18Å; Q78-Y88 HydrophobicContact CB-CD2 3.85Å; Q78-Y88 HydrophobicContact CB-CE2 3.87Å
79	Q	75.2	Confident	81.2	Confident	141 Å²	141	82 Å²	82	66%	0.659	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	126	165	-75.1	176.4	-0.5	0	0	109	E85	Q79-E85 HydrophobicContact CG-CG 3.55Å; Q79-E85 WeakPolarHBondContact CG-OE1 3.38Å; Q79-E85 PolarHBondContact NE2-OE1 3.39Å
80	L	74.5	Confident	81.7	Confident	47 Å²	47	78.1 Å²	78.1	25%	0.246	40%	0.399	C	S	.	.			trans	-85	159.4	173.6	-69.1	170.7	0	0	0	110.6	Q78 N82 G83 Q84 K86	Q78-L80 PolarHBondContact O-N 3.48Å; L80-N82 WeakPolarHBondContact CB-OD1 3.49Å; L80-N82 PolarHBondContact O-N 2.86Å; L80-G83 PolarHBondContact O-N 3.5Å; L80-Q84 WeakPolarHBondContact CB-O 3.21Å; L80-Q84 HydrophobicContact CD1-CB 4.4Å; L80-Q84 PolarHBondContact N-O 3.38Å; L80-K86 HydrophobicContact CD1-CD 3.93Å; L80-K86 HydrophobicContact CD1-CG 3.87Å
81	P	71.3	Confident	82	Confident	144 Å²	144	75.1 Å²	75.1	94%	0.935	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-15	178.7	-24.8	35.1	0	0	0	115.3	G83	P81-G83 VanDerWaalsContact C-N 3.35Å
82	N	76.2	Confident	82.4	Confident	101 Å²	101	72.2 Å²	72.2	54%	0.54	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	8.5	174.9	70.6	-14.7	0	0	0	113.5	L80 Q84	L80-N82 WeakPolarHBondContact CB-OD1 3.49Å; L80-N82 PolarHBondContact O-N 2.86Å; N82-Q84 VanDerWaalsContact C-N 3.27Å; N82-Q84 PolarHBondContact ND2-OE1 3.04Å; N82-Q84 PolarHBondContact O-N 3.46Å; N82-Q84 WeakPolarHBondContact OD1-CB 3.37Å; N82-Q84 PolarHBondContact OD1-N 3.33Å; N82-Q84 VanDerWaalsContact OD1-N 3.11Å
83	G	72.4	Confident	82.7	Confident	66 Å²	66	69.2 Å²	69.2	68%	0.68	35%	0.354	S	S	*	.	S	Bend	trans	77.2	2.5	-178.4	0	0	0	0	0	115.2	L80 P81	L80-G83 PolarHBondContact O-N 3.5Å; P81-G83 VanDerWaalsContact C-N 3.35Å
84	Q	71.9	Confident	82.8	Confident	119 Å²	119	62.8 Å²	62.8	56%	0.556	33%	0.329	S	S	*	.			trans	-83.9	137.5	174.5	-65.8	-171.4	-52.4	0	0	111.5	L80 N82	L80-Q84 WeakPolarHBondContact CB-O 3.21Å; L80-Q84 HydrophobicContact CD1-CB 4.4Å; L80-Q84 PolarHBondContact N-O 3.38Å; N82-Q84 VanDerWaalsContact C-N 3.27Å; N82-Q84 PolarHBondContact ND2-OE1 3.04Å; N82-Q84 PolarHBondContact O-N 3.46Å; N82-Q84 WeakPolarHBondContact OD1-CB 3.37Å; N82-Q84 PolarHBondContact OD1-N 3.33Å; N82-Q84 VanDerWaalsContact OD1-N 3.11Å
85	E	77.2	Confident	83.2	Confident	121 Å²	121	58.8 Å²	58.8	57%	0.565	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	125.5	172.8	-76.6	-175.4	170.1	0	0	110.8	V77 Q79	V77-E85 HydrophobicContact CG1-CB 3.66Å; V77-E85 HydrophobicContact CG1-CG 3.72Å; Q79-E85 HydrophobicContact CG-CG 3.55Å; Q79-E85 WeakPolarHBondContact CG-OE1 3.38Å; Q79-E85 PolarHBondContact NE2-OE1 3.39Å
86	K	78.1	Confident	83.2	Confident	42 Å²	42	55.4 Å²	55.4	18%	0.183	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	130.9	167.4	-82.5	-166.4	174.3	-164.5	0	110	Q78 L80 Y88 E175	Q78-K86 PolarHBondContact N-O 2.92Å; Q78-K86 PolarHBondContact O-N 3.18Å; L80-K86 HydrophobicContact CD1-CD 3.93Å; L80-K86 HydrophobicContact CD1-CG 3.87Å; K86-Y88 HydrophobicContact CB-CD2 4.26Å; K86-Y88 HydrophobicContact CB-CE2 3.6Å; K86-Y88 HydrophobicContact CD-CE2 4.41Å; K86-Y88 WeakPolarHBondContact CD-OH 3.17Å; K86-E175 HydrophobicContact CD-CG 4.38Å; K86-E175 WeakPolarHBondContact CD-OE1 3.46Å; K86-E175 WeakPolarHBondContact CE-OE1 3.32Å; K86-E175 IonicContact NZ-OE1 2.74Å; K86-E175 PolarHBondContact NZ-OE1 3.32Å; K86-E175 IonicContact NZ-OE2 2.69Å; K86-E175 PolarHBondContact NZ-OE2 2.73Å
87	M	82.3	Confident	83.5	Confident	72 Å²	72	53.3 Å²	53.3	36%	0.355	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	133	172.8	-157.6	175.4	-157.5	0	0	109.6	E75 V77 K176	E75-M87 HydrophobicContact CB-CE 4.23Å; E75-M87 WeakPolarHBondContact OE2-CE 3.05Å; V77-M87 HydrophobicContact CG2-CG 4.33Å; M87-K176 HydrophobicContact CB-CB 4.2Å; M87-K176 HydrophobicContact CG-CB 4.35Å; M87-K176 HydrophobicContact CG-CD 4.22Å; M87-K176 PolarHBondContact O-N 3.2Å; M87-K176 HydrophobicContact SD-CD 3.71Å; M87-K176 HydrophobicContact SD-CG 4.31Å
88	Y	87.3	Confident	83.5	Confident	28 Å²	28	53.9 Å²	53.9	11%	0.11	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	141.4	178.2	-72.7	-81.8	0	0	0	110.3	E75 Y76 Q78 K86 R173 S174 E175	E75-Y88 CarbonylContact C-O 3.57Å; E75-Y88 WeakPolarHBondContact CA-O 3.47Å; Y76-Y88 HydrophobicContact CE1-CG 4.43Å; Y76-Y88 HydrophobicContact CE2-CD2 4.3Å; Y76-Y88 PolarHBondContact N-O 2.96Å; Y76-Y88 PolarHBondContact O-N 2.92Å; Q78-Y88 HydrophobicContact CB-CD2 3.85Å; Q78-Y88 HydrophobicContact CB-CE2 3.87Å; K86-Y88 HydrophobicContact CB-CD2 4.26Å; K86-Y88 HydrophobicContact CB-CE2 3.6Å; K86-Y88 HydrophobicContact CD-CE2 4.41Å; K86-Y88 WeakPolarHBondContact CD-OH 3.17Å; Y88-R173 HydrophobicContact CD1-CG 3.71Å; Y88-R173 HydrophobicContact CE1-CG 4.38Å; Y88-R173 HydrophobicContact CG-CG 4.35Å; Y88-S174 WeakPolarHBondContact CA-O 3.42Å; Y88-E175 HydrophobicContact CD1-CB 4.21Å; Y88-E175 HydrophobicContact CE1-CB 3.92Å; Y88-E175 HydrophobicContact CE1-CG 4.21Å
89	I	89.7	Confident	83.2	Confident	20 Å²	20	55.1 Å²	55.1	10%	0.103	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	128.9	163.6	-65.2	150.9	0	0	0	106.6	R73 E75 R173 S174 K176	R73-I89 HydrophobicContact CG-CG2 4.03Å; E75-I89 HydrophobicContact CG-CG1 4.01Å; I89-R173 WeakPolarHBondContact O-CA 3.21Å; I89-S174 PolarHBondContact N-O 2.88Å; I89-S174 PolarHBondContact O-N 3.16Å; I89-K176 HydrophobicContact CD1-CB 3.97Å; I89-K176 HydrophobicContact CD1-CD 4.15Å; I89-K176 HydrophobicContact CD1-CG 4.29Å; I89-K176 HydrophobicContact CG1-CB 4.13Å; I89-K176 HydrophobicContact CG1-CD 4.18Å
90	C	92	Very high	83.3	Confident	4 Å²	4	52.5 Å²	52.5	3%	0.027	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	140.8	161.2	-101.7	0	0	0	0	108.5	R73 Y74 Y76 I172	R73-C90 WeakPolarHBondContact CA-O 3.42Å; Y74-C90 HydrophobicContact CD1-CB 4.1Å; Y74-C90 HydrophobicContact CD2-CB 4.21Å; Y74-C90 HydrophobicContact CE1-CB 3.51Å; Y74-C90 HydrophobicContact CE2-CB 3.65Å; Y74-C90 HydrophobicContact CG-CB 4.42Å; Y74-C90 PolarHBondContact N-O 3.4Å; Y74-C90 PolarHBondContact O-N 2.76Å; Y74-C90 VanDerWaalsContact O-O 3.04Å; Y74-C90 WeakPolarHBondContact OH-CB 2.85Å; Y76-C90 HydrophobicContact CE1-CB 4.38Å; C90-I172 WeakPolarHBondContact CA-O 3.2Å
91	Q	94	Very high	83.7	Confident	12 Å²	12	52.5 Å²	52.5	6%	0.056	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	139.7	175.4	55.4	-168.4	7.4	0	0	110.7	I70 D72 R73 I172	I70-Q91 HydrophobicContact CG2-CB 4.4Å; D72-Q91 CarbonylContact O-C 3.59Å; D72-Q91 VanDerWaalsContact O-CA 3.23Å; D72-Q91 WeakPolarHBondContact O-CA 3.43Å; R73-Q91 HydrophobicContact CB-CB 4.04Å; R73-Q91 HydrophobicContact CG-CB 4.14Å; Q91-I172 HydrophobicContact CG-CB 4.48Å; Q91-I172 HydrophobicContact CG-CD1 4.31Å; Q91-I172 PolarHBondContact N-O 2.89Å; Q91-I172 PolarHBondContact O-N 3.44Å
92	T	93.8	Very high	84.4	Confident	23 Å²	23	50.9 Å²	50.9	14%	0.141	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	123.5	177.5	-52.1	0	0	0	0	108.3	L71 D72	L71-T92 PolarHBondContact N-O 2.62Å; D72-T92 PolarHBondContact N-O 3.05Å; D72-T92 PolarHBondContact O-N 3.01Å; D72-T92 PolarHBondContact OD2-OG1 2.91Å
93	V	93.1	Very high	85	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	128.8	-170.3	166.2	0	0	0	0	110	R69 I70 M95 V135 L169 L170 I172	R69-V93 CarbonylContact O-C 3.48Å; R69-V93 WeakPolarHBondContact O-CA 3.24Å; I70-V93 HydrophobicContact CG1-CG2 4.06Å; V93-M95 HydrophobicContact CG1-CG 3.78Å; V93-M95 HydrophobicContact CG1-SD 4.07Å; V93-V135 HydrophobicContact CB-CB 4.5Å; V93-V135 HydrophobicContact CG1-CB 3.63Å; V93-V135 HydrophobicContact CG1-CG1 4.3Å; V93-V135 HydrophobicContact CG1-CG2 3.48Å; V93-V135 VanDerWaalsContact CG1-CG2 3.48Å; V93-V135 HydrophobicContact CG2-CB 3.99Å; V93-L169 CarbonylContact O-C 3.58Å; V93-L169 WeakPolarHBondContact O-CA 3.24Å; V93-L170 PolarHBondContact N-O 2.97Å; V93-L170 PolarHBondContact O-N 3.08Å; V93-I172 HydrophobicContact CB-CD1 3.97Å; V93-I172 HydrophobicContact CB-CG1 4.5Å; V93-I172 HydrophobicContact CG2-CD1 3.51Å; V93-I172 HydrophobicContact CG2-CG1 4.29Å
94	E	93.3	Very high	85.8	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	130.8	173.6	-173.4	179.9	-148.5	0	0	109.7	S56 L58 A68 R69 L71 R167 L168 L169	S56-E94 WeakPolarHBondContact CB-OE1 3.27Å; S56-E94 PolarHBondContact OG-OE1 3.49Å; S56-E94 PolarHBondContact OG-OE2 2.8Å; L58-E94 HydrophobicContact CD1-CB 4.42Å; L58-E94 HydrophobicContact CD1-CG 4.15Å; A68-E94 CarbonylContact C-O 3.53Å; A68-E94 VanDerWaalsContact CA-O 3.23Å; A68-E94 WeakPolarHBondContact CA-O 3.37Å; R69-E94 HydrophobicContact CG-CB 4.24Å; R69-E94 IonicContact CZ-OE2 2.77Å; R69-E94 PolarHBondContact N-O 3.27Å; R69-E94 IonicContact NE-OE2 2.85Å; R69-E94 PolarHBondContact NE-OE2 2.73Å; R69-E94 IonicContact NH2-OE2 3.75Å; R69-E94 PolarHBondContact NH2-OE2 2.84Å; R69-E94 PolarHBondContact O-N 3.05Å; L71-E94 HydrophobicContact CD1-CB 3.88Å; L71-E94 HydrophobicContact CD2-CB 4.44Å; L71-E94 HydrophobicContact CG-CB 3.94Å; E94-R167 IonicContact OE1-CZ 3.65Å; E94-R167 VanDerWaalsContact OE1-CZ 3.24Å; E94-R167 IonicContact OE1-NE 3.41Å; E94-R167 PolarHBondContact OE1-NE 2.95Å; E94-R167 IonicContact OE1-NH2 3.77Å; E94-R167 PolarHBondContact OE1-NH2 2.84Å; E94-L168 CarbonylContact C-O 3.29Å; E94-L168 WeakPolarHBondContact CA-O 3.46Å; E94-L169 HydrophobicContact CB-CD2 3.83Å; E94-L169 HydrophobicContact CG-CD2 4Å
95	M	91.3	Very high	86.8	Confident	1 Å²	1	40 Å²	40	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	139.3	178.9	-58	166.4	57.8	0	0	110.1	L66 C67 A68 V93 L103 V130 V135 L136 R167 L168 L170	L66-M95 HydrophobicContact CD1-CE 3.96Å; L66-M95 HydrophobicContact CD2-CE 4.3Å; C67-M95 CarbonylContact O-C 3.54Å; C67-M95 WeakPolarHBondContact O-CA 3.49Å; A68-M95 HydrophobicContact CB-CB 4.38Å; A68-M95 HydrophobicContact CB-CG 3.78Å; V93-M95 HydrophobicContact CG1-CG 3.78Å; V93-M95 HydrophobicContact CG1-SD 4.07Å; M95-L103 HydrophobicContact CE-CD1 4.07Å; M95-L103 HydrophobicContact CE-CD2 3.71Å; M95-L103 HydrophobicContact CE-CG 4.46Å; M95-V130 HydrophobicContact CE-CB 4.43Å; M95-V130 HydrophobicContact CE-CG1 4.08Å; M95-V130 HydrophobicContact CE-CG2 3.48Å; M95-V130 VanDerWaalsContact CE-CG2 3.48Å; M95-V135 HydrophobicContact SD-CG2 4.41Å; M95-L136 HydrophobicContact CE-CD1 4.38Å; M95-L136 HydrophobicContact SD-CD1 3.8Å; M95-R167 WeakPolarHBondContact O-CA 3.39Å; M95-L168 HydrophobicContact CB-CB 4.29Å; M95-L168 PolarHBondContact N-O 3.38Å; M95-L168 PolarHBondContact O-N 2.88Å; M95-L170 HydrophobicContact SD-CD1 3.73Å
96	I	89.5	Confident	87.5	Confident	11 Å²	11	37.4 Å²	37.4	6%	0.056	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	115.5	173.6	-56.5	-174	0	0	0	108.6	L58 L66 C67 R166 R167	L58-I96 HydrophobicContact CB-CD1 3.6Å; L58-I96 HydrophobicContact CB-CG1 4.26Å; L66-I96 WeakPolarHBondContact CA-O 3.46Å; C67-I96 PolarHBondContact N-O 3.27Å; C67-I96 PolarHBondContact O-N 3.31Å; I96-R166 WeakPolarHBondContact CA-O 3.46Å; I96-R167 HydrophobicContact CG1-CB 4.42Å; I96-R167 HydrophobicContact CG1-CG 4.32Å
97	K	88.6	Confident	88.3	Confident	16 Å²	16	36.9 Å²	36.9	7%	0.07	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-103.8	164.1	177.1	62.1	175.6	175.9	177.9	0	111.8	L66 Q101 L103 I162 S163 P165 R166	L66-K97 HydrophobicContact CD1-CB 3.99Å; L66-K97 HydrophobicContact CG-CB 4.4Å; K97-Q101 HydrophobicContact CB-CB 4.37Å; K97-L103 HydrophobicContact CD-CD2 4.06Å; K97-I162 PolarHBondContact NZ-O 3.44Å; K97-S163 VanDerWaalsContact NZ-C 3.34Å; K97-S163 PolarHBondContact NZ-O 3.22Å; K97-P165 WeakPolarHBondContact CE-O 3.32Å; K97-P165 PolarHBondContact NZ-O 3.36Å; K97-R166 WeakPolarHBondContact CG-O 3.45Å; K97-R166 PolarHBondContact N-O 3.47Å; K97-R166 VanDerWaalsContact O-CZ 3.31Å; K97-R166 PolarHBondContact O-NE 3.11Å; K97-R166 PolarHBondContact O-NH2 2.9Å
98	K	81	Confident	88.7	Confident	87 Å²	87	37.1 Å²	37.1	38%	0.378	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-77.4	156.7	166	-69.9	-178.3	179.5	178	0	111	P63 G100 Q101	P63-K98 WeakPolarHBondContact O-CE 3.41Å; P63-K98 PolarHBondContact O-NZ 3.24Å; P63-K98 VanDerWaalsContact O-NZ 3.17Å; K98-G100 PolarHBondContact O-N 3Å; K98-Q101 HydrophobicContact CB-CB 4.07Å; K98-Q101 VanDerWaalsContact O-CB 3.29Å; K98-Q101 WeakPolarHBondContact O-CB 3.15Å; K98-Q101 PolarHBondContact O-N 3.48Å; K98-Q101 VanDerWaalsContact O-N 3.1Å
99	P	74.6	Confident	88.9	Confident	102 Å²	102	41 Å²	41	66%	0.662	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.3	135.3	171.8	-20.8	32.8	0	0	0	110.3	Q101	P99-Q101 PolarHBondContact O-N 2.9Å; P99-Q101 VanDerWaalsContact O-N 3.13Å
100	G	76.3	Confident	88.8	Confident	86 Å²	86	40.1 Å²	40.1	89%	0.887	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.9	-5.6	-177.4	0	0	0	0	0	116.2	K98 T102	K98-G100 PolarHBondContact O-N 3Å; G100-T102 PolarHBondContact O-N 3.42Å
101	Q	83.5	Confident	88.3	Confident	46 Å²	46	41 Å²	41	22%	0.215	23%	0.232	C	C	.	.			trans	-72.4	126.2	179.3	-172.4	-178.8	9.2	0	0	111	K97 K98 P99 D129	K97-Q101 HydrophobicContact CB-CB 4.37Å; K98-Q101 HydrophobicContact CB-CB 4.07Å; K98-Q101 VanDerWaalsContact O-CB 3.29Å; K98-Q101 WeakPolarHBondContact O-CB 3.15Å; K98-Q101 PolarHBondContact O-N 3.48Å; K98-Q101 VanDerWaalsContact O-N 3.1Å; P99-Q101 PolarHBondContact O-N 2.9Å; P99-Q101 VanDerWaalsContact O-N 3.13Å; Q101-D129 PolarHBondContact NE2-OD2 3.4Å
102	T	87	Confident	87.4	Confident	111 Å²	111	43.4 Å²	43.4	68%	0.681	26%	0.259	S	S	*	.			trans	-78	144.2	175.2	56.6	0	0	0	0	111.1	G100 G104	G100-T102 PolarHBondContact O-N 3.42Å; T102-G104 VanDerWaalsContact C-N 3.3Å
103	L	88.8	Confident	86.5	Confident	16 Å²	16	47.8 Å²	47.8	8%	0.084	28%	0.281	C	S	.	.			trans	-75	-18.2	176.3	-64.7	-169.2	0	0	0	113.5	L66 M95 K97 I105 V130 I162 L168	L66-L103 HydrophobicContact CD1-CD2 3.36Å; M95-L103 HydrophobicContact CE-CD1 4.07Å; M95-L103 HydrophobicContact CE-CD2 3.71Å; M95-L103 HydrophobicContact CE-CG 4.46Å; K97-L103 HydrophobicContact CD-CD2 4.06Å; L103-I105 VanDerWaalsContact C-N 3.27Å; L103-I105 HydrophobicContact CB-CD1 4.31Å; L103-I105 HydrophobicContact CB-CG1 4.01Å; L103-I105 HydrophobicContact CB-CG2 4.43Å; L103-I105 HydrophobicContact CD1-CD1 3.88Å; L103-I105 HydrophobicContact CD1-CG1 4.43Å; L103-I105 PolarHBondContact O-N 3.49Å; L103-V130 HydrophobicContact CB-CG2 4.07Å; L103-V130 HydrophobicContact CD2-CG2 4.2Å; L103-V130 WeakPolarHBondContact O-CG2 3.16Å; L103-I162 HydrophobicContact CD1-CG2 3.36Å; L103-I162 HydrophobicContact CG-CG2 4.43Å; L103-L168 HydrophobicContact CD1-CD1 3.91Å; L103-L168 HydrophobicContact CD2-CD1 4.35Å
104	G	89.3	Confident	85.6	Confident	10 Å²	10	53.3 Å²	53.3	10%	0.103	31%	0.31	C	S	.	.			trans	62.1	32.3	-174	0	0	0	0	0	113.4	T102 L124 M125	T102-G104 VanDerWaalsContact C-N 3.3Å; G104-L124 CarbonylContact O-C 3.56Å; G104-M125 WeakPolarHBondContact O-CB 3.44Å; G104-M125 PolarHBondContact O-N 3.49Å
105	I	91.9	Very high	85	Confident	30 Å²	30	57.7 Å²	57.7	15%	0.154	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	143.7	172.9	66.7	-179.2	0	0	0	110.1	L103 L107 L124 V130	L103-I105 VanDerWaalsContact C-N 3.27Å; L103-I105 HydrophobicContact CB-CD1 4.31Å; L103-I105 HydrophobicContact CB-CG1 4.01Å; L103-I105 HydrophobicContact CB-CG2 4.43Å; L103-I105 HydrophobicContact CD1-CD1 3.88Å; L103-I105 HydrophobicContact CD1-CG1 4.43Å; L103-I105 PolarHBondContact O-N 3.49Å; I105-L107 HydrophobicContact CD1-CD2 4.23Å; I105-L107 HydrophobicContact CG1-CD2 4.48Å; I105-L124 HydrophobicContact CG2-CD2 3.98Å; I105-L124 HydrophobicContact CG2-CG 4.13Å; I105-V130 HydrophobicContact CG2-CB 4.28Å; I105-V130 HydrophobicContact CG2-CG1 3.98Å
106	Y	93.3	Very high	84.3	Confident	67 Å²	67	62 Å²	62	26%	0.263	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	126.4	173.8	-62.8	-95.6	0	0	0	108.5	F26 V121 S122 R123 M125	F26-Y106 HydrophobicContact CE2-CE1 4.34Å; F26-Y106 HydrophobicContact CZ-CE1 4.48Å; Y106-V121 CarbonylContact O-C 3.49Å; Y106-S122 PolarHBondContact O-N 3.42Å; Y106-R123 HydrophobicContact CD2-CB 3.83Å; Y106-R123 HydrophobicContact CG-CB 4.25Å; Y106-R123 PolarHBondContact N-O 3.34Å; Y106-R123 PolarHBondContact O-N 2.77Å; Y106-M125 HydrophobicContact CE2-CB 4.14Å
107	L	94.2	Very high	84.1	Confident	31 Å²	31	65 Å²	65	16%	0.162	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	163.8	177.4	-56.1	-177.4	0	0	0	111.3	I105 V119 F120 V121 I142 I155 V158 V159 I162	I105-L107 HydrophobicContact CD1-CD2 4.23Å; I105-L107 HydrophobicContact CG1-CD2 4.48Å; L107-V119 HydrophobicContact CB-CG1 4.07Å; L107-V119 HydrophobicContact CD1-CG1 3.93Å; L107-V119 HydrophobicContact CG-CG1 4.4Å; L107-F120 CarbonylContact C-O 3.55Å; L107-F120 VanDerWaalsContact CA-O 3.32Å; L107-F120 WeakPolarHBondContact CA-O 3.35Å; L107-V121 HydrophobicContact CD2-CG2 4.24Å; L107-I142 HydrophobicContact CD1-CD1 4.32Å; L107-I142 HydrophobicContact CD2-CD1 3.73Å; L107-I155 HydrophobicContact CB-CD1 3.89Å; L107-I155 HydrophobicContact CB-CG1 4.08Å; L107-V158 HydrophobicContact CD1-CG1 4.15Å; L107-V159 HydrophobicContact CD1-CG2 4.03Å; L107-I162 HydrophobicContact CD1-CD1 4.29Å
108	R	91.4	Very high	84.2	Confident	78 Å²	78	64.5 Å²	64.5	29%	0.294	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	156.5	168.6	61.1	179.6	172	155.9	9.2	109.9	N111 F120	R108-N111 PolarHBondContact NH1-O 3.24Å; R108-N111 PolarHBondContact NH2-O 2.98Å; R108-F120 HydrophobicContact CG-CB 4.12Å; R108-F120 PolarHBondContact N-O 2.81Å; R108-F120 PolarHBondContact O-N 3.18Å
109	E	91	Very high	84.8	Confident	109 Å²	109	60.4 Å²	60.4	51%	0.509	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	139	163.4	-87.1	162.2	-164.9	0	0	110.3	I155	E109-I155 HydrophobicContact CG-CB 4.11Å; E109-I155 WeakPolarHBondContact OE1-CB 3.42Å; E109-I155 WeakPolarHBondContact OE1-CG2 3.36Å; E109-I155 PolarHBondContact OE1-N 2.96Å
110	G	86.3	Confident	85.7	Confident	2 Å²	2	56 Å²	56	2%	0.021	34%	0.337	C	S	.	.	S	Bend	trans	72.1	161	-177.7	0	0	0	0	0	115.1	G112 R115 A116 G118 F120	G110-G112 PolarHBondContact O-N 3.24Å; G110-R115 CarbonylContact C-O 3.48Å; G110-R115 WeakPolarHBondContact CA-O 3.32Å; G110-A116 PolarHBondContact N-O 2.91Å; G110-G118 PolarHBondContact N-O 3.38Å; G110-F120 VanDerWaalsContact C-CE2 3.46Å; G110-F120 WeakPolarHBondContact O-CD2 3.43Å
111	N	82.3	Confident	86.5	Confident	22 Å²	22	51.9 Å²	51.9	12%	0.118	30%	0.295	C	S	.	.			trans	-77.5	-4.7	176.8	72.6	1.1	0	0	0	113	R108 I113 D114 R115 F120	R108-N111 PolarHBondContact NH1-O 3.24Å; R108-N111 PolarHBondContact NH2-O 2.98Å; N111-I113 VanDerWaalsContact C-N 3.28Å; N111-I113 PolarHBondContact O-N 3.46Å; N111-I113 PolarHBondContact OD1-N 2.75Å; N111-D114 PolarHBondContact ND2-OD1 3.17Å; N111-D114 PolarHBondContact OD1-N 2.88Å; N111-D114 VanDerWaalsContact OD1-N 3.11Å; N111-D114 PolarHBondContact OD1-OD1 3.32Å; N111-R115 PolarHBondContact N-O 2.87Å; N111-R115 PolarHBondContact OD1-N 3.21Å; N111-R115 PolarHBondContact OD1-O 3.47Å; N111-F120 HydrophobicContact CB-CD1 4.01Å; N111-F120 HydrophobicContact CB-CE1 3.6Å; N111-F120 HydrophobicContact CB-CE2 4.17Å; N111-F120 HydrophobicContact CB-CG 4.44Å; N111-F120 HydrophobicContact CB-CZ 3.72Å
112	G	75.4	Confident	86.7	Confident	62 Å²	62	52 Å²	52	64%	0.639	30%	0.301	S	S	*	.	S	Bend	trans	65.7	25.4	-179.5	0	0	0	0	0	114.5	G110	G110-G112 PolarHBondContact O-N 3.24Å
113	I	74.5	Confident	86.7	Confident	116 Å²	116	53.4 Å²	53.4	60%	0.595	29%	0.293	S	S	*	.	S	Bend	trans	-129.1	-68.6	177.7	-58.5	166.9	0	0	0	109.3	N111	N111-I113 VanDerWaalsContact C-N 3.28Å; N111-I113 PolarHBondContact O-N 3.46Å; N111-I113 PolarHBondContact OD1-N 2.75Å
114	D	75.4	Confident	86.7	Confident	115 Å²	115	54.1 Å²	54.1	62%	0.615	30%	0.297	S	S	*	.	S	Bend	trans	-134.7	-25.2	-172	60.4	-20.4	0	0	0	113	N111	N111-D114 PolarHBondContact ND2-OD1 3.17Å; N111-D114 PolarHBondContact OD1-N 2.88Å; N111-D114 VanDerWaalsContact OD1-N 3.11Å; N111-D114 PolarHBondContact OD1-OD1 3.32Å
115	R	78.7	Confident	86.4	Confident	93 Å²	93	57.2 Å²	57.2	35%	0.351	31%	0.31	S	S	.	.			trans	-105.6	109.3	-177.5	-161.6	179	-173.6	-155.5	-6.9	110.7	G110 N111 E141	G110-R115 CarbonylContact C-O 3.48Å; G110-R115 WeakPolarHBondContact CA-O 3.32Å; N111-R115 PolarHBondContact N-O 2.87Å; N111-R115 PolarHBondContact OD1-N 3.21Å; N111-R115 PolarHBondContact OD1-O 3.47Å; R115-E141 IonicContact CZ-OE1 3.82Å; R115-E141 VanDerWaalsContact NH1-CD 3.29Å; R115-E141 IonicContact NH1-OE1 2.88Å; R115-E141 PolarHBondContact NH1-OE1 2.95Å; R115-E141 IonicContact NH1-OE2 3.95Å; R115-E141 PolarHBondContact NH1-OE2 3.04Å; R115-E141 IonicContact NH2-OE1 2.79Å
116	A	78.5	Confident	85.7	Confident	92 Å²	92	63.4 Å²	63.4	76%	0.76	34%	0.338	S	S	*	.			trans	-78.9	-17.3	-179.7	0	0	0	0	0	114.6	G110	G110-A116 PolarHBondContact N-O 2.91Å
117	S	84.3	Confident	84.8	Confident	73 Å²	73	62.3 Å²	62.3	51%	0.51	35%	0.347	S	S	.	.	S	Bend	trans	-108.5	157.7	-177.5	57.3	0	0	0	0	113.4
118	G	90.3	Very high	84.3	Confident	7 Å²	7	61.5 Å²	61.5	7%	0.072	34%	0.344	C	S	.	.	S	Bend	trans	93.8	155.5	-171	0	0	0	0	0	112	G110 F120	G110-G118 PolarHBondContact N-O 3.38Å; G118-F120 WeakPolarHBondContact O-CD2 3.28Å
119	V	94.2	Very high	83.8	Confident	0 Å²	0	60 Å²	60	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	124.9	-179.5	179.6	0	0	0	0	109.9	L107 I142 I155 V158	L107-V119 HydrophobicContact CB-CG1 4.07Å; L107-V119 HydrophobicContact CD1-CG1 3.93Å; L107-V119 HydrophobicContact CG-CG1 4.4Å; V119-I142 PolarHBondContact O-N 3.28Å; V119-I155 HydrophobicContact CG1-CG1 4.42Å; V119-V158 HydrophobicContact CG1-CG1 4.15Å; V119-V158 HydrophobicContact CG2-CB 4.47Å; V119-V158 HydrophobicContact CG2-CG2 4.05Å
120	F	93.8	Very high	83.5	Confident	10 Å²	10	54.8 Å²	54.8	4%	0.044	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	146.7	-173.4	-66.1	-103.7	0	0	0	111.5	L107 R108 G110 N111 G118 S122 D140 E141	L107-F120 CarbonylContact C-O 3.55Å; L107-F120 VanDerWaalsContact CA-O 3.32Å; L107-F120 WeakPolarHBondContact CA-O 3.35Å; R108-F120 HydrophobicContact CG-CB 4.12Å; R108-F120 PolarHBondContact N-O 2.81Å; R108-F120 PolarHBondContact O-N 3.18Å; G110-F120 VanDerWaalsContact C-CE2 3.46Å; G110-F120 WeakPolarHBondContact O-CD2 3.43Å; N111-F120 HydrophobicContact CB-CD1 4.01Å; N111-F120 HydrophobicContact CB-CE1 3.6Å; N111-F120 HydrophobicContact CB-CE2 4.17Å; N111-F120 HydrophobicContact CB-CG 4.44Å; N111-F120 HydrophobicContact CB-CZ 3.72Å; G118-F120 WeakPolarHBondContact O-CD2 3.28Å; F120-S122 PolarHBondContact O-N 3.46Å; F120-D140 CarbonylContact C-O 3.56Å; F120-D140 VanDerWaalsContact CA-O 3.27Å; F120-D140 WeakPolarHBondContact CA-O 3.36Å; F120-E141 HydrophobicContact CD1-CB 3.69Å; F120-E141 HydrophobicContact CD1-CG 4.11Å; F120-E141 HydrophobicContact CD2-CG 4.43Å; F120-E141 HydrophobicContact CE1-CB 3.42Å; F120-E141 VanDerWaalsContact CE1-CB 3.42Å; F120-E141 HydrophobicContact CE1-CG 3.64Å; F120-E141 HydrophobicContact CE2-CG 3.98Å; F120-E141 HydrophobicContact CG-CB 4.41Å; F120-E141 HydrophobicContact CG-CG 4.48Å; F120-E141 HydrophobicContact CZ-CB 3.92Å; F120-E141 HydrophobicContact CZ-CG 3.55Å
121	V	93.3	Very high	83.2	Confident	0 Å²	0	58 Å²	58	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	113.2	167.5	-175.6	0	0	0	0	108.3	Y106 L107 L124 L136 S137 G139 D140	Y106-V121 CarbonylContact O-C 3.49Å; L107-V121 HydrophobicContact CD2-CG2 4.24Å; V121-L124 HydrophobicContact CG1-CD1 4.17Å; V121-L136 HydrophobicContact CG2-CD2 3.87Å; V121-S137 WeakPolarHBondContact CB-O 3.28Å; V121-G139 PolarHBondContact O-N 3.04Å; V121-D140 HydrophobicContact CG2-CB 4.42Å; V121-D140 PolarHBondContact N-O 2.76Å
122	S	88	Confident	82.9	Confident	48 Å²	48	62.6 Å²	62.6	34%	0.336	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	-41	175.2	-173	0	0	0	0	112.4	Y106 F120	Y106-S122 PolarHBondContact O-N 3.42Å; F120-S122 PolarHBondContact O-N 3.46Å
123	R	87	Confident	82.9	Confident	140 Å²	140	61 Å²	61	53%	0.528	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	159.8	-176.1	-49.1	-172.4	-60.8	-173.7	3.7	109.8	Y106	Y106-R123 HydrophobicContact CD2-CB 3.83Å; Y106-R123 HydrophobicContact CG-CB 4.25Å; Y106-R123 PolarHBondContact N-O 3.34Å; Y106-R123 PolarHBondContact O-N 2.77Å
124	L	87	Confident	83.1	Confident	32 Å²	32	58.2 Å²	58.2	17%	0.168	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	162.1	156.5	-64.7	94.9	0	0	0	109.2	G104 I105 V121 V130 E131	G104-L124 CarbonylContact O-C 3.56Å; I105-L124 HydrophobicContact CG2-CD2 3.98Å; I105-L124 HydrophobicContact CG2-CG 4.13Å; V121-L124 HydrophobicContact CG1-CD1 4.17Å; L124-V130 HydrophobicContact CD2-CB 4.3Å; L124-V130 HydrophobicContact CD2-CG1 3.99Å; L124-E131 HydrophobicContact CB-CB 4.31Å; L124-E131 HydrophobicContact CD2-CB 4Å
125	M	84.2	Confident	83.6	Confident	74 Å²	74	53 Å²	53	37%	0.365	29%	0.293	S	S	.	.			trans	-86.1	123	170	176.6	-179.8	-74.9	0	0	108.2	F26 G104 Y106 G127 C128	F26-M125 HydrophobicContact CD2-CE 4.36Å; G104-M125 WeakPolarHBondContact O-CB 3.44Å; G104-M125 PolarHBondContact O-N 3.49Å; Y106-M125 HydrophobicContact CE2-CB 4.14Å; M125-G127 PolarHBondContact O-N 3.22Å; M125-C128 HydrophobicContact CB-CB 4.2Å; M125-C128 VanDerWaalsContact O-CB 3.25Å; M125-C128 WeakPolarHBondContact O-CB 3.48Å; M125-C128 PolarHBondContact O-N 3.27Å; M125-C128 PolarHBondContact O-SG 2.88Å; M125-C128 VanDerWaalsContact O-SG 3.34Å
126	E	76.4	Confident	84.1	Confident	160 Å²	160	48.8 Å²	48.8	75%	0.748	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	127.1	-177	-167.3	167.8	-158.4	0	0	110.8	E131	E126-E131 WeakPolarHBondContact CA-OE2 3.35Å
127	G	74.7	Confident	84.5	Confident	44 Å²	44	47.3 Å²	47.3	45%	0.454	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	9.1	-175.7	0	0	0	0	0	115.7	M125 E131 K132	M125-G127 PolarHBondContact O-N 3.22Å; G127-E131 PolarHBondContact N-OE2 3.14Å; G127-K132 WeakPolarHBondContact O-CE 3.38Å; G127-K132 PolarHBondContact O-NZ 3.45Å
128	C	83.1	Confident	84.7	Confident	15 Å²	15	46 Å²	46	10%	0.101	25%	0.254	C	S	.	.			trans	-74.1	155.9	172.6	85.1	0	0	0	0	112.3	M125 V130 E131 K132	M125-C128 HydrophobicContact CB-CB 4.2Å; M125-C128 VanDerWaalsContact O-CB 3.25Å; M125-C128 WeakPolarHBondContact O-CB 3.48Å; M125-C128 PolarHBondContact O-N 3.27Å; M125-C128 PolarHBondContact O-SG 2.88Å; M125-C128 VanDerWaalsContact O-SG 3.34Å; C128-V130 VanDerWaalsContact C-N 3.26Å; C128-V130 PolarHBondContact O-N 3.48Å; C128-E131 PolarHBondContact O-N 3.28Å; C128-E131 PolarHBondContact SG-N 3.39Å; C128-K132 WeakPolarHBondContact O-CG 3.4Å; C128-K132 PolarHBondContact O-N 3.11Å
129	D	82.2	Confident	84.6	Confident	45 Å²	45	47.2 Å²	47.2	24%	0.241	27%	0.268	C	S	.	.	H	α-helix	trans	-64.8	-31.2	-176.3	-67.2	-9.1	0	0	0	112.9	L66 Q101 K132 S133	L66-D129 HydrophobicContact CB-CB 3.81Å; L66-D129 HydrophobicContact CD2-CB 4.31Å; L66-D129 PolarHBondContact N-OD2 3.07Å; L66-D129 VanDerWaalsContact N-OD2 3.15Å; Q101-D129 PolarHBondContact NE2-OD2 3.4Å; D129-K132 PolarHBondContact O-N 3.45Å; D129-K132 IonicContact OD1-NZ 3.95Å; D129-K132 PolarHBondContact OD1-NZ 3.49Å; D129-S133 PolarHBondContact O-N 2.91Å
130	V	84.6	Confident	84.4	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66.9	-42.2	175.9	-175.7	0	0	0	0	110.7	L66 M95 L103 I105 L124 C128 S133 C134 L136	L66-V130 HydrophobicContact CD1-CG2 3.8Å; L66-V130 HydrophobicContact CD2-CG2 4.2Å; M95-V130 HydrophobicContact CE-CB 4.43Å; M95-V130 HydrophobicContact CE-CG1 4.08Å; M95-V130 HydrophobicContact CE-CG2 3.48Å; M95-V130 VanDerWaalsContact CE-CG2 3.48Å; L103-V130 HydrophobicContact CB-CG2 4.07Å; L103-V130 HydrophobicContact CD2-CG2 4.2Å; L103-V130 WeakPolarHBondContact O-CG2 3.16Å; I105-V130 HydrophobicContact CG2-CB 4.28Å; I105-V130 HydrophobicContact CG2-CG1 3.98Å; L124-V130 HydrophobicContact CD2-CB 4.3Å; L124-V130 HydrophobicContact CD2-CG1 3.99Å; C128-V130 VanDerWaalsContact C-N 3.26Å; C128-V130 PolarHBondContact O-N 3.48Å; V130-S133 PolarHBondContact O-N 3.43Å; V130-S133 PolarHBondContact O-OG 2.84Å; V130-C134 PolarHBondContact O-N 3.17Å; V130-C134 VanDerWaalsContact O-N 3.13Å; V130-L136 HydrophobicContact CG1-CB 3.97Å; V130-L136 HydrophobicContact CG1-CD1 3.7Å; V130-L136 HydrophobicContact CG1-CG 4.47Å
131	E	79.9	Confident	84.4	Confident	69 Å²	69	47.4 Å²	47.4	32%	0.322	27%	0.269	S	S	.	.	H	α-helix	trans	-62.7	-46.3	173.5	-173.4	-175.9	-115.8	0	0	111.4	L124 E126 G127 C128 S133 C134	L124-E131 HydrophobicContact CB-CB 4.31Å; L124-E131 HydrophobicContact CD2-CB 4Å; E126-E131 WeakPolarHBondContact CA-OE2 3.35Å; G127-E131 PolarHBondContact N-OE2 3.14Å; C128-E131 PolarHBondContact O-N 3.28Å; C128-E131 PolarHBondContact SG-N 3.39Å; E131-S133 PolarHBondContact O-N 3.47Å; E131-C134 PolarHBondContact O-N 2.85Å; E131-C134 PolarHBondContact O-SG 3.21Å
132	K	74.9	Confident	84.5	Confident	119 Å²	119	47.4 Å²	47.4	52%	0.517	27%	0.269	S	S	.	.	H	α-helix	trans	-54.9	-37.2	175.8	-65.9	168.3	-156.2	152.4	0	112.4	G127 C128 D129 R1007	G127-K132 WeakPolarHBondContact O-CE 3.38Å; G127-K132 PolarHBondContact O-NZ 3.45Å; C128-K132 WeakPolarHBondContact O-CG 3.4Å; C128-K132 PolarHBondContact O-N 3.11Å; D129-K132 PolarHBondContact O-N 3.45Å; D129-K132 IonicContact OD1-NZ 3.95Å; D129-K132 PolarHBondContact OD1-NZ 3.49Å; K132-R1007 PolarHBondContact O-NE 2.85Å; K132-R1007 VanDerWaalsContact O-NE 3.14Å; K132-R1007 PolarHBondContact O-NH2 2.99Å
133	S	76.5	Confident	84.8	Confident	30 Å²	30	46.3 Å²	46.3	21%	0.21	26%	0.26	C	S	.	.	H	α-helix	trans	-74.8	-25.8	178	78.5	0	0	0	0	114.1	D129 V130 E131 V135 R1007	D129-S133 PolarHBondContact O-N 2.91Å; V130-S133 PolarHBondContact O-N 3.43Å; V130-S133 PolarHBondContact O-OG 2.84Å; E131-S133 PolarHBondContact O-N 3.47Å; S133-V135 PolarHBondContact O-N 2.99Å; S133-V135 VanDerWaalsContact O-N 3.17Å; S133-V135 WeakPolarHBondContact OG-CG2 3.18Å; S133-R1007 PolarHBondContact O-NH2 3.37Å
134	C	78.8	Confident	85.2	Confident	56 Å²	56	40.3 Å²	40.3	38%	0.378	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	49	29	-174	-62.7	0	0	0	0	115	V130 E131 L136 R1007	V130-C134 PolarHBondContact O-N 3.17Å; V130-C134 VanDerWaalsContact O-N 3.13Å; E131-C134 PolarHBondContact O-N 2.85Å; E131-C134 PolarHBondContact O-SG 3.21Å; C134-L136 PolarHBondContact O-N 3.22Å; C134-R1007 WeakPolarHBondContact SG-CD 3.45Å; C134-R1007 PolarHBondContact SG-NE 3.47Å; C134-R1007 VanDerWaalsContact SG-NE 3.38Å
135	V	85.5	Confident	85.6	Confident	7 Å²	7	38.8 Å²	38.8	4%	0.042	23%	0.231	C	C	.	.	S	Bend	trans	-74.6	-14.8	170.5	-57.7	0	0	0	0	112.7	A68 I70 V93 M95 S133 I172	A68-V135 HydrophobicContact CB-CG1 3.97Å; A68-V135 HydrophobicContact CB-CG2 4.04Å; I70-V135 HydrophobicContact CG1-CG1 4.45Å; V93-V135 HydrophobicContact CB-CB 4.5Å; V93-V135 HydrophobicContact CG1-CB 3.63Å; V93-V135 HydrophobicContact CG1-CG1 4.3Å; V93-V135 HydrophobicContact CG1-CG2 3.48Å; V93-V135 VanDerWaalsContact CG1-CG2 3.48Å; V93-V135 HydrophobicContact CG2-CB 3.99Å; M95-V135 HydrophobicContact SD-CG2 4.41Å; S133-V135 PolarHBondContact O-N 2.99Å; S133-V135 VanDerWaalsContact O-N 3.17Å; S133-V135 WeakPolarHBondContact OG-CG2 3.18Å; V135-I172 WeakPolarHBondContact O-CD1 3.42Å
136	L	88.7	Confident	86	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.016	21%	0.214	C	C	.	.	S	Bend	trans	-136.1	141.1	-176.2	-87.5	152.6	0	0	0	109.6	M95 V121 V130 C134 L170 I172	M95-L136 HydrophobicContact CE-CD1 4.38Å; M95-L136 HydrophobicContact SD-CD1 3.8Å; V121-L136 HydrophobicContact CG2-CD2 3.87Å; V130-L136 HydrophobicContact CG1-CB 3.97Å; V130-L136 HydrophobicContact CG1-CD1 3.7Å; V130-L136 HydrophobicContact CG1-CG 4.47Å; C134-L136 PolarHBondContact O-N 3.22Å; L136-L170 HydrophobicContact CD1-CD1 4Å; L136-I172 HydrophobicContact CD2-CD1 3.6Å; L136-I172 HydrophobicContact CD2-CG1 4.37Å; L136-I172 HydrophobicContact CD2-CG2 4Å; L136-I172 HydrophobicContact CG-CD1 3.77Å
137	S	87.7	Confident	86.7	Confident	61 Å²	61	32 Å²	32	43%	0.427	20%	0.202	S	C	.	.			trans	-129.4	155.4	178.8	-69.4	0	0	0	0	112.1	V121 G139 D140	V121-S137 WeakPolarHBondContact CB-O 3.28Å; S137-G139 PolarHBondContact O-N 3.1Å; S137-D140 WeakPolarHBondContact CA-OD2 3.32Å; S137-D140 WeakPolarHBondContact CB-OD2 3.4Å; S137-D140 PolarHBondContact N-OD2 2.93Å; S137-D140 WeakPolarHBondContact O-CB 3.26Å; S137-D140 PolarHBondContact O-N 3.28Å
138	A	87.5	Confident	87.6	Confident	45 Å²	45	30.9 Å²	30.9	37%	0.372	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	124.8	171.3	0	0	0	0	0	110.4
139	G	87.7	Confident	88	Confident	34 Å²	34	34.7 Å²	34.7	35%	0.351	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	109.4	-14.6	-172.4	0	0	0	0	0	114.5	V121 S137	V121-G139 PolarHBondContact O-N 3.04Å; S137-G139 PolarHBondContact O-N 3.1Å
140	D	91.5	Very high	88.6	Confident	10 Å²	10	32.5 Å²	32.5	5%	0.053	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-71.2	140.1	179.1	-66.1	-19.1	0	0	0	112.1	F120 V121 S137 I172 S174	F120-D140 CarbonylContact C-O 3.56Å; F120-D140 VanDerWaalsContact CA-O 3.27Å; F120-D140 WeakPolarHBondContact CA-O 3.36Å; V121-D140 HydrophobicContact CG2-CB 4.42Å; V121-D140 PolarHBondContact N-O 2.76Å; S137-D140 WeakPolarHBondContact CA-OD2 3.32Å; S137-D140 WeakPolarHBondContact CB-OD2 3.4Å; S137-D140 PolarHBondContact N-OD2 2.93Å; S137-D140 WeakPolarHBondContact O-CB 3.26Å; S137-D140 PolarHBondContact O-N 3.28Å; D140-I172 HydrophobicContact CB-CG2 3.7Å; D140-S174 WeakPolarHBondContact OD1-CB 3.47Å; D140-S174 PolarHBondContact OD1-OG 3.38Å
141	E	94.2	Very high	88.7	Confident	4 Å²	4	33.7 Å²	33.7	2%	0.019	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	121.9	176.5	-169.4	-179.2	167.3	0	0	110.2	R115 F120 V143 I172 R173	R115-E141 IonicContact CZ-OE1 3.82Å; R115-E141 VanDerWaalsContact NH1-CD 3.29Å; R115-E141 IonicContact NH1-OE1 2.88Å; R115-E141 PolarHBondContact NH1-OE1 2.95Å; R115-E141 IonicContact NH1-OE2 3.95Å; R115-E141 PolarHBondContact NH1-OE2 3.04Å; R115-E141 IonicContact NH2-OE1 2.79Å; F120-E141 HydrophobicContact CD1-CB 3.69Å; F120-E141 HydrophobicContact CD1-CG 4.11Å; F120-E141 HydrophobicContact CD2-CG 4.43Å; F120-E141 HydrophobicContact CE1-CB 3.42Å; F120-E141 VanDerWaalsContact CE1-CB 3.42Å; F120-E141 HydrophobicContact CE1-CG 3.64Å; F120-E141 HydrophobicContact CE2-CG 3.98Å; F120-E141 HydrophobicContact CG-CB 4.41Å; F120-E141 HydrophobicContact CG-CG 4.48Å; F120-E141 HydrophobicContact CZ-CB 3.92Å; F120-E141 HydrophobicContact CZ-CG 3.55Å; E141-V143 PolarHBondContact O-N 3.44Å; E141-I172 CarbonylContact O-C 3.55Å; E141-I172 WeakPolarHBondContact O-CA 3.43Å; E141-I172 VanDerWaalsContact O-CG2 3.24Å; E141-I172 WeakPolarHBondContact O-CG2 3.3Å; E141-R173 HydrophobicContact CB-CB 4.26Å; E141-R173 PolarHBondContact N-O 3.11Å; E141-R173 PolarHBondContact O-N 2.73Å; E141-R173 IonicContact OE1-CZ 2.67Å; E141-R173 IonicContact OE1-NE 3.53Å; E141-R173 IonicContact OE1-NH2 3.64Å; E141-R173 PolarHBondContact OE1-NH2 3.37Å; E141-R173 IonicContact OE2-CZ 3.43Å; E141-R173 VanDerWaalsContact OE2-CZ 3.3Å; E141-R173 IonicContact OE2-NE 2.82Å; E141-R173 PolarHBondContact OE2-NE 3.3Å; E141-R173 IonicContact OE2-NH2 3.9Å; E141-R173 PolarHBondContact OE2-NH2 3.26Å
142	I	95.2	Very high	89	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	118	172.1	-53	-176.6	0	0	0	107.8	L107 V119 V145 V150 I162 L170	L107-I142 HydrophobicContact CD1-CD1 4.32Å; L107-I142 HydrophobicContact CD2-CD1 3.73Å; V119-I142 PolarHBondContact O-N 3.28Å; I142-V145 HydrophobicContact CG2-CG2 3.88Å; I142-V150 HydrophobicContact CB-CG2 4.32Å; I142-V150 HydrophobicContact CG2-CG2 3.75Å; I142-V150 WeakPolarHBondContact O-CG2 3.18Å; I142-I162 HydrophobicContact CD1-CD1 3.77Å; I142-L170 HydrophobicContact CG2-CD2 4.37Å
143	V	94.5	Very high	89.6	Confident	24 Å²	24	38 Å²	38	15%	0.145	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	-40.9	-176.3	-177	0	0	0	0	111	E141 V150 T151 R171 R173	E141-V143 PolarHBondContact O-N 3.44Å; V143-V150 PolarHBondContact O-N 3.13Å; V143-T151 HydrophobicContact CB-CG2 4.34Å; V143-T151 HydrophobicContact CG1-CG2 3.83Å; V143-R171 WeakPolarHBondContact CA-O 3.31Å; V143-R171 WeakPolarHBondContact CB-O 3.49Å; V143-R171 PolarHBondContact N-O 3.37Å; V143-R173 HydrophobicContact CG2-CB 3.73Å
144	S	94.5	Very high	90.2	Very high	14 Å²	14	38.7 Å²	38.7	10%	0.098	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	155.5	171.2	68.6	0	0	0	0	113	V148 L170 R171	S144-V148 CarbonylContact C-O 3.6Å; S144-V148 WeakPolarHBondContact CA-O 3.3Å; S144-V148 WeakPolarHBondContact CB-O 3.29Å; S144-L170 WeakPolarHBondContact O-CA 3.33Å; S144-R171 PolarHBondContact N-O 3.03Å; S144-R171 PolarHBondContact O-N 3.33Å; S144-R171 WeakPolarHBondContact OG-CB 3.5Å
145	V	94.9	Very high	90.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	118.3	174.2	-175.9	0	0	0	0	107.7	I142 D147 V148 V150 V158 M161 I162 L168 L169 L170	I142-V145 HydrophobicContact CG2-CG2 3.88Å; V145-D147 VanDerWaalsContact C-N 3.32Å; V145-D147 PolarHBondContact O-N 3.43Å; V145-V148 PolarHBondContact N-O 3.09Å; V145-V148 WeakPolarHBondContact O-CB 3.28Å; V145-V148 PolarHBondContact O-N 3.44Å; V145-V150 HydrophobicContact CB-CG1 4.33Å; V145-V150 HydrophobicContact CG2-CG1 3.92Å; V145-V150 HydrophobicContact CG2-CG2 4.12Å; V145-V158 HydrophobicContact CG2-CG1 4.45Å; V145-M161 HydrophobicContact CB-CE 4.22Å; V145-M161 HydrophobicContact CG1-CB 4.28Å; V145-I162 HydrophobicContact CG1-CG1 3.85Å; V145-I162 HydrophobicContact CG2-CD1 4.07Å; V145-I162 HydrophobicContact CG2-CG1 3.84Å; V145-L168 HydrophobicContact CG1-CD2 4.02Å; V145-L169 CarbonylContact C-O 3.57Å; V145-L169 WeakPolarHBondContact CA-O 3.35Å; V145-L170 HydrophobicContact CB-CD2 4.18Å; V145-L170 HydrophobicContact CG1-CD2 3.98Å; V145-L170 HydrophobicContact CG2-CD2 3.75Å
146	N	93.8	Very high	91.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	44.6	55	-176.2	-67.4	21.6	0	0	0	112.1	I48 I51 V148 R167 L168 L169	I48-N146 HydrophobicContact CG1-CB 4.17Å; I48-N146 PolarHBondContact O-ND2 3.17Å; I51-N146 HydrophobicContact CB-CB 4.12Å; I51-N146 VanDerWaalsContact CD1-C 3.43Å; I51-N146 HydrophobicContact CD1-CB 3.95Å; I51-N146 VanDerWaalsContact CD1-O 3.3Å; I51-N146 WeakPolarHBondContact CD1-O 3.46Å; I51-N146 HydrophobicContact CG2-CB 3.98Å; I51-N146 WeakPolarHBondContact CG2-ND2 3.49Å; N146-V148 PolarHBondContact O-N 3.37Å; N146-V148 VanDerWaalsContact O-N 3.1Å; N146-R167 PolarHBondContact ND2-O 3.14Å; N146-L168 WeakPolarHBondContact OD1-CA 3.3Å; N146-L169 PolarHBondContact N-O 3.39Å; N146-L169 PolarHBondContact OD1-N 3.21Å
147	D	91.2	Very high	91.2	Very high	92 Å²	92	43.5 Å²	43.5	49%	0.492	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	29.8	-179.8	-59.2	-40.9	0	0	0	115.7	K47 I51 V145	K47-D147 PolarHBondContact NZ-O 2.96Å; I51-D147 HydrophobicContact CD1-CB 3.93Å; I51-D147 WeakPolarHBondContact CD1-OD2 3.17Å; V145-D147 VanDerWaalsContact C-N 3.32Å; V145-D147 PolarHBondContact O-N 3.43Å
148	V	92.6	Very high	91.5	Very high	20 Å²	20	40.6 Å²	40.6	12%	0.121	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	121.3	162.8	-175.4	0	0	0	0	108.1	V44 K47 S144 V145 N146 M161	V44-V148 HydrophobicContact CG1-CG1 4.23Å; V44-V148 HydrophobicContact CG1-CG2 4.29Å; V44-V148 HydrophobicContact CG2-CG1 4.22Å; K47-V148 HydrophobicContact CB-CG2 4.08Å; K47-V148 HydrophobicContact CD-CG2 3.78Å; S144-V148 CarbonylContact C-O 3.6Å; S144-V148 WeakPolarHBondContact CA-O 3.3Å; S144-V148 WeakPolarHBondContact CB-O 3.29Å; V145-V148 PolarHBondContact N-O 3.09Å; V145-V148 WeakPolarHBondContact O-CB 3.28Å; V145-V148 PolarHBondContact O-N 3.44Å; N146-V148 PolarHBondContact O-N 3.37Å; N146-V148 VanDerWaalsContact O-N 3.1Å; V148-M161 HydrophobicContact CB-CE 3.65Å; V148-M161 HydrophobicContact CG1-CE 3.58Å; V148-M161 HydrophobicContact CG2-CE 4.33Å
149	D	92.5	Very high	91.7	Very high	95 Å²	95	41.7 Å²	41.7	51%	0.508	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	131.5	172.8	179.8	-2.8	0	0	0	109.7	T151	D149-T151 VanDerWaalsContact OD1-CB 3.31Å; D149-T151 WeakPolarHBondContact OD1-CB 3.42Å; D149-T151 WeakPolarHBondContact OD1-CG2 3.33Å; D149-T151 PolarHBondContact OD1-N 3.43Å; D149-T151 PolarHBondContact OD1-OG1 3.37Å; D149-T151 PolarHBondContact OD2-OG1 2.96Å
150	V	93.3	Very high	91.8	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.223	C	C	.	.			trans	-119.4	8.4	179	-61.1	0	0	0	0	113.9	I142 V143 V145 R152 T153 V158 M161	I142-V150 HydrophobicContact CB-CG2 4.32Å; I142-V150 HydrophobicContact CG2-CG2 3.75Å; I142-V150 WeakPolarHBondContact O-CG2 3.18Å; V143-V150 PolarHBondContact O-N 3.13Å; V145-V150 HydrophobicContact CB-CG1 4.33Å; V145-V150 HydrophobicContact CG2-CG1 3.92Å; V145-V150 HydrophobicContact CG2-CG2 4.12Å; V150-R152 PolarHBondContact O-N 3.13Å; V150-T153 WeakPolarHBondContact CA-OG1 3.45Å; V150-T153 PolarHBondContact O-N 3.17Å; V150-V158 HydrophobicContact CB-CG2 3.67Å; V150-V158 HydrophobicContact CG1-CG2 3.9Å; V150-V158 HydrophobicContact CG2-CG2 4.28Å; V150-M161 HydrophobicContact CG1-CE 3.64Å; V150-M161 HydrophobicContact CG1-SD 4.02Å
151	T	87.7	Confident	91.8	Very high	24 Å²	24	42.4 Å²	42.4	15%	0.147	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-11.4	-177.5	59	0	0	0	0	114.9	V143 D149	V143-T151 HydrophobicContact CB-CG2 4.34Å; V143-T151 HydrophobicContact CG1-CG2 3.83Å; D149-T151 VanDerWaalsContact OD1-CB 3.31Å; D149-T151 WeakPolarHBondContact OD1-CB 3.42Å; D149-T151 WeakPolarHBondContact OD1-CG2 3.33Å; D149-T151 PolarHBondContact OD1-N 3.43Å; D149-T151 PolarHBondContact OD1-OG1 3.37Å; D149-T151 PolarHBondContact OD2-OG1 2.96Å
152	R	85.5	Confident	91.7	Very high	235 Å²	235	42.7 Å²	42.7	89%	0.887	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-128.5	3.8	179.4	-54.5	-178.1	-169.7	-115.9	3.5	113.9	V150	V150-R152 PolarHBondContact O-N 3.13Å
153	T	87.2	Confident	91.4	Very high	45 Å²	45	46.2 Å²	46.2	28%	0.276	25%	0.247	S	C	.	.	S	Bend	trans	-92.1	152.3	-174.3	-37.6	0	0	0	0	110.1	V150 D157	V150-T153 WeakPolarHBondContact CA-OG1 3.45Å; V150-T153 PolarHBondContact O-N 3.17Å; T153-D157 HydrophobicContact CG2-CB 3.71Å
154	S	89.6	Confident	91	Very high	44 Å²	44	48.8 Å²	48.8	31%	0.308	26%	0.26	S	S	.	.			trans	-68	153.1	-178.6	84.8	0	0	0	0	111.9	D156 D157 V158	S154-D156 PolarHBondContact O-N 3.47Å; S154-D157 WeakPolarHBondContact CB-OD2 3.35Å; S154-D157 PolarHBondContact O-N 3.25Å; S154-D157 PolarHBondContact OG-N 2.68Å; S154-D157 PolarHBondContact OG-OD2 3.33Å; S154-V158 WeakPolarHBondContact O-CG2 3.33Å; S154-V158 PolarHBondContact O-N 2.92Å; S154-V158 VanDerWaalsContact O-N 3.07Å
155	I	92.3	Very high	90.7	Very high	43 Å²	43	48.1 Å²	48.1	22%	0.221	26%	0.255	C	S	.	.	H	α-helix	trans	-58	-36.1	176.4	-166.7	171.8	0	0	0	113.1	L107 E109 V119 V158 V159	L107-I155 HydrophobicContact CB-CD1 3.89Å; L107-I155 HydrophobicContact CB-CG1 4.08Å; E109-I155 HydrophobicContact CG-CB 4.11Å; E109-I155 WeakPolarHBondContact OE1-CB 3.42Å; E109-I155 WeakPolarHBondContact OE1-CG2 3.36Å; E109-I155 PolarHBondContact OE1-N 2.96Å; V119-I155 HydrophobicContact CG1-CG1 4.42Å; I155-V158 PolarHBondContact O-N 2.65Å; I155-V159 WeakPolarHBondContact O-CB 3.38Å; I155-V159 VanDerWaalsContact O-CG2 3.28Å; I155-V159 WeakPolarHBondContact O-CG2 3.45Å; I155-V159 PolarHBondContact O-N 3.21Å
156	D	90.8	Very high	90.5	Very high	82 Å²	82	52.9 Å²	52.9	44%	0.439	27%	0.273	S	S	.	.	H	α-helix	trans	-61.5	-46.9	177.5	-92.2	11.8	0	0	0	110.5	R38 S154 V159 V160	R38-D156 IonicContact CZ-OD2 3.82Å; R38-D156 IonicContact NH1-OD2 2.71Å; R38-D156 PolarHBondContact NH1-OD2 2.83Å; R38-D156 IonicContact NH2-OD2 2.71Å; S154-D156 PolarHBondContact O-N 3.47Å; D156-V159 PolarHBondContact O-N 3.49Å; D156-V160 WeakPolarHBondContact O-CG2 3.38Å; D156-V160 PolarHBondContact O-N 2.96Å
157	D	91.6	Very high	90.3	Very high	42 Å²	42	54 Å²	54	23%	0.225	28%	0.277	C	S	.	.	H	α-helix	trans	-65.6	-42.7	179.8	-57.6	-49.1	0	0	0	111.2	L40 T153 S154 V159 V160 M161	L40-D157 HydrophobicContact CD1-CB 4.5Å; L40-D157 HydrophobicContact CD2-CB 4.36Å; L40-D157 HydrophobicContact CG-CB 4.39Å; T153-D157 HydrophobicContact CG2-CB 3.71Å; S154-D157 WeakPolarHBondContact CB-OD2 3.35Å; S154-D157 PolarHBondContact O-N 3.25Å; S154-D157 PolarHBondContact OG-N 2.68Å; S154-D157 PolarHBondContact OG-OD2 3.33Å; D157-V159 VanDerWaalsContact C-N 3.33Å; D157-V159 PolarHBondContact O-N 3.35Å; D157-V160 PolarHBondContact O-N 3.06Å; D157-V160 VanDerWaalsContact O-N 3.11Å; D157-M161 VanDerWaalsContact O-CG 3.24Å; D157-M161 WeakPolarHBondContact O-CG 3.14Å; D157-M161 PolarHBondContact O-N 3.39Å
158	V	93.1	Very high	90.4	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.5	-38.4	177.8	177.2	0	0	0	0	111.2	L107 V119 V145 V150 S154 I155 V160 M161 I162	L107-V158 HydrophobicContact CD1-CG1 4.15Å; V119-V158 HydrophobicContact CG1-CG1 4.15Å; V119-V158 HydrophobicContact CG2-CB 4.47Å; V119-V158 HydrophobicContact CG2-CG2 4.05Å; V145-V158 HydrophobicContact CG2-CG1 4.45Å; V150-V158 HydrophobicContact CB-CG2 3.67Å; V150-V158 HydrophobicContact CG1-CG2 3.9Å; V150-V158 HydrophobicContact CG2-CG2 4.28Å; S154-V158 WeakPolarHBondContact O-CG2 3.33Å; S154-V158 PolarHBondContact O-N 2.92Å; S154-V158 VanDerWaalsContact O-N 3.07Å; I155-V158 PolarHBondContact O-N 2.65Å; V158-V160 VanDerWaalsContact C-N 3.33Å; V158-V160 PolarHBondContact O-N 3.22Å; V158-M161 PolarHBondContact O-N 3.31Å; V158-I162 HydrophobicContact CG1-CD1 3.69Å; V158-I162 HydrophobicContact CG1-CG1 4.36Å; V158-I162 WeakPolarHBondContact O-CB 3.33Å; V158-I162 VanDerWaalsContact O-CG1 3.25Å; V158-I162 WeakPolarHBondContact O-CG1 3.5Å; V158-I162 PolarHBondContact O-N 3.24Å
159	V	91.6	Very high	90.4	Very high	68 Å²	68	49.6 Å²	49.6	41%	0.412	25%	0.253	S	S	.	.	H	α-helix	trans	-60.7	-42.4	171.4	166.9	0	0	0	0	111	L107 I155 D156 D157 S163	L107-V159 HydrophobicContact CD1-CG2 4.03Å; I155-V159 WeakPolarHBondContact O-CB 3.38Å; I155-V159 VanDerWaalsContact O-CG2 3.28Å; I155-V159 WeakPolarHBondContact O-CG2 3.45Å; I155-V159 PolarHBondContact O-N 3.21Å; D156-V159 PolarHBondContact O-N 3.49Å; D157-V159 VanDerWaalsContact C-N 3.33Å; D157-V159 PolarHBondContact O-N 3.35Å; V159-S163 VanDerWaalsContact O-CB 3.23Å; V159-S163 WeakPolarHBondContact O-CB 3.34Å; V159-S163 PolarHBondContact O-N 3.37Å; V159-S163 PolarHBondContact O-OG 2.88Å
160	V	90.1	Very high	90.6	Very high	56 Å²	56	45 Å²	45	34%	0.339	23%	0.228	S	C	.	.	H	α-helix	trans	-65.7	-48.5	176.6	172.8	0	0	0	0	111.5	L40 D156 D157 V158 I162 S163 I164	L40-V160 HydrophobicContact CD1-CB 3.83Å; L40-V160 HydrophobicContact CD1-CG1 3.48Å; L40-V160 VanDerWaalsContact CD1-CG1 3.48Å; D156-V160 WeakPolarHBondContact O-CG2 3.38Å; D156-V160 PolarHBondContact O-N 2.96Å; D157-V160 PolarHBondContact O-N 3.06Å; D157-V160 VanDerWaalsContact O-N 3.11Å; V158-V160 VanDerWaalsContact C-N 3.33Å; V158-V160 PolarHBondContact O-N 3.22Å; V160-I162 VanDerWaalsContact C-N 3.28Å; V160-I162 PolarHBondContact O-N 2.95Å; V160-S163 WeakPolarHBondContact O-CA 3.38Å; V160-S163 WeakPolarHBondContact O-CB 2.87Å; V160-S163 PolarHBondContact O-N 3.03Å; V160-I164 HydrophobicContact CG1-CD1 3.58Å; V160-I164 HydrophobicContact CG1-CG1 4.29Å; V160-I164 WeakPolarHBondContact O-CD1 3.47Å; V160-I164 WeakPolarHBondContact O-CG1 3.22Å; V160-I164 PolarHBondContact O-N 3.49Å; V160-I164 VanDerWaalsContact O-N 3.1Å
161	M	91.1	Very high	90.7	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-57.5	-38.7	178	-68	169.3	68.5	0	0	112.5	L40 V44 I48 V145 V148 V150 D157 V158 P165	L40-M161 HydrophobicContact CD1-CG 4.07Å; L40-M161 HydrophobicContact CD2-CG 3.91Å; L40-M161 HydrophobicContact CD2-SD 4.01Å; V44-M161 HydrophobicContact CG1-CE 3.89Å; V44-M161 HydrophobicContact CG1-CG 4.34Å; V44-M161 HydrophobicContact CG1-SD 4.22Å; I48-M161 HydrophobicContact CD1-CB 3.89Å; I48-M161 HydrophobicContact CD1-CE 4.1Å; I48-M161 HydrophobicContact CD1-CG 3.76Å; V145-M161 HydrophobicContact CB-CE 4.22Å; V145-M161 HydrophobicContact CG1-CB 4.28Å; V148-M161 HydrophobicContact CB-CE 3.65Å; V148-M161 HydrophobicContact CG1-CE 3.58Å; V148-M161 HydrophobicContact CG2-CE 4.33Å; V150-M161 HydrophobicContact CG1-CE 3.64Å; V150-M161 HydrophobicContact CG1-SD 4.02Å; D157-M161 VanDerWaalsContact O-CG 3.24Å; D157-M161 WeakPolarHBondContact O-CG 3.14Å; D157-M161 PolarHBondContact O-N 3.39Å; V158-M161 PolarHBondContact O-N 3.31Å; M161-P165 WeakPolarHBondContact O-CD 3.3Å
162	I	92.1	Very high	91	Very high	10 Å²	10	48.2 Å²	48.2	5%	0.051	24%	0.238	C	C	.	.	H	α-helix	trans	-77.9	-24.2	176.5	-66.3	174	0	0	0	111.9	K97 L103 L107 I142 V145 V158 V160 L168 L170	K97-I162 PolarHBondContact NZ-O 3.44Å; L103-I162 HydrophobicContact CD1-CG2 3.36Å; L103-I162 HydrophobicContact CG-CG2 4.43Å; L107-I162 HydrophobicContact CD1-CD1 4.29Å; I142-I162 HydrophobicContact CD1-CD1 3.77Å; V145-I162 HydrophobicContact CG1-CG1 3.85Å; V145-I162 HydrophobicContact CG2-CD1 4.07Å; V145-I162 HydrophobicContact CG2-CG1 3.84Å; V158-I162 HydrophobicContact CG1-CD1 3.69Å; V158-I162 HydrophobicContact CG1-CG1 4.36Å; V158-I162 WeakPolarHBondContact O-CB 3.33Å; V158-I162 VanDerWaalsContact O-CG1 3.25Å; V158-I162 WeakPolarHBondContact O-CG1 3.5Å; V158-I162 PolarHBondContact O-N 3.24Å; V160-I162 VanDerWaalsContact C-N 3.28Å; V160-I162 PolarHBondContact O-N 2.95Å; I162-L168 HydrophobicContact CG2-CD1 4.06Å; I162-L168 HydrophobicContact CG2-CD2 4.43Å; I162-L170 HydrophobicContact CD1-CD2 4.22Å; I162-L170 HydrophobicContact CG1-CD2 4.2Å
163	S	89.1	Confident	91.4	Very high	74 Å²	74	38.6 Å²	38.6	52%	0.517	20%	0.201	S	C	.	.	H	α-helix	trans	-76.7	-36.5	179.6	-66.6	0	0	0	0	113.4	K97 V159 V160	K97-S163 VanDerWaalsContact NZ-C 3.34Å; K97-S163 PolarHBondContact NZ-O 3.22Å; V159-S163 VanDerWaalsContact O-CB 3.23Å; V159-S163 WeakPolarHBondContact O-CB 3.34Å; V159-S163 PolarHBondContact O-N 3.37Å; V159-S163 PolarHBondContact O-OG 2.88Å; V160-S163 WeakPolarHBondContact O-CA 3.38Å; V160-S163 WeakPolarHBondContact O-CB 2.87Å; V160-S163 PolarHBondContact O-N 3.03Å
164	I	86.5	Confident	91.5	Very high	78 Å²	78	37.4 Å²	37.4	40%	0.4	20%	0.195	S	C	.	.	S	Bend	trans	-67.8	-61.6	-170.6	-67	154.1	0	0	0	115.2	Y45 V160	Y45-I164 HydrophobicContact CD1-CD1 4.23Å; Y45-I164 HydrophobicContact CE1-CD1 3.43Å; Y45-I164 VanDerWaalsContact CE1-CD1 3.43Å; Y45-I164 HydrophobicContact CE1-CG1 4.41Å; V160-I164 HydrophobicContact CG1-CD1 3.58Å; V160-I164 HydrophobicContact CG1-CG1 4.29Å; V160-I164 WeakPolarHBondContact O-CD1 3.47Å; V160-I164 WeakPolarHBondContact O-CG1 3.22Å; V160-I164 PolarHBondContact O-N 3.49Å; V160-I164 VanDerWaalsContact O-N 3.1Å
165	P	88.8	Confident	91.3	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.193	C	C	.	.			trans	-77.6	156.6	-167	33.7	-38.3	0	0	0	111.9	I48 D52 K97 M161 L168	I48-P165 HydrophobicContact CG2-CB 3.87Å; I48-P165 HydrophobicContact CG2-CG 3.78Å; D52-P165 HydrophobicContact CB-CB 3.77Å; D52-P165 VanDerWaalsContact CG-CB 3.48Å; D52-P165 WeakPolarHBondContact OD2-CA 3.22Å; K97-P165 WeakPolarHBondContact CE-O 3.32Å; K97-P165 PolarHBondContact NZ-O 3.36Å; M161-P165 WeakPolarHBondContact O-CD 3.3Å; P165-L168 HydrophobicContact CG-CD2 3.54Å; P165-L168 HydrophobicContact CG-CG 4.1Å
166	R	89.4	Confident	90.2	Very high	100 Å²	100	39.6 Å²	39.6	38%	0.377	20%	0.198	S	C	.	.	S	Bend	trans	-75.1	-38.3	167	-76.7	-160	68.6	-178.5	-7.3	112.4	D52 I96 K97	D52-R166 VanDerWaalsContact CG-N 3.34Å; D52-R166 WeakPolarHBondContact OD1-CA 3.35Å; D52-R166 PolarHBondContact OD1-N 3.25Å; D52-R166 PolarHBondContact OD2-N 3.15Å; I96-R166 WeakPolarHBondContact CA-O 3.46Å; K97-R166 WeakPolarHBondContact CG-O 3.45Å; K97-R166 PolarHBondContact N-O 3.47Å; K97-R166 VanDerWaalsContact O-CZ 3.31Å; K97-R166 PolarHBondContact O-NE 3.11Å; K97-R166 PolarHBondContact O-NH2 2.9Å
167	R	91.3	Very high	88.5	Confident	25 Å²	25	41 Å²	41	9%	0.094	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	120.4	179.8	178.9	178.4	179.7	-114	4.7	110	I51 D52 E94 M95 I96 N146	I51-R167 PolarHBondContact O-NH1 3.45Å; D52-R167 PolarHBondContact OD1-N 3.18Å; E94-R167 IonicContact OE1-CZ 3.65Å; E94-R167 VanDerWaalsContact OE1-CZ 3.24Å; E94-R167 IonicContact OE1-NE 3.41Å; E94-R167 PolarHBondContact OE1-NE 2.95Å; E94-R167 IonicContact OE1-NH2 3.77Å; E94-R167 PolarHBondContact OE1-NH2 2.84Å; M95-R167 WeakPolarHBondContact O-CA 3.39Å; I96-R167 HydrophobicContact CG1-CB 4.42Å; I96-R167 HydrophobicContact CG1-CG 4.32Å; N146-R167 PolarHBondContact ND2-O 3.14Å
168	L	92.1	Very high	86.1	Confident	1 Å²	1	44 Å²	44	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	131.8	178.8	-72.3	161.3	0	0	0	109.8	E94 M95 L103 V145 N146 I162 P165 L170	E94-L168 CarbonylContact C-O 3.29Å; E94-L168 WeakPolarHBondContact CA-O 3.46Å; M95-L168 HydrophobicContact CB-CB 4.29Å; M95-L168 PolarHBondContact N-O 3.38Å; M95-L168 PolarHBondContact O-N 2.88Å; L103-L168 HydrophobicContact CD1-CD1 3.91Å; L103-L168 HydrophobicContact CD2-CD1 4.35Å; V145-L168 HydrophobicContact CG1-CD2 4.02Å; N146-L168 WeakPolarHBondContact OD1-CA 3.3Å; I162-L168 HydrophobicContact CG2-CD1 4.06Å; I162-L168 HydrophobicContact CG2-CD2 4.43Å; P165-L168 HydrophobicContact CG-CD2 3.54Å; P165-L168 HydrophobicContact CG-CG 4.1Å; L168-L170 HydrophobicContact CB-CG 4.43Å
169	L	93.8	Very high	83.3	Confident	17 Å²	17	50 Å²	50	9%	0.089	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	107.5	161.2	-73.7	173.4	0	0	0	107.6	I51 L71 V93 E94 V145 N146	I51-L169 HydrophobicContact CG2-CD1 3.79Å; I51-L169 HydrophobicContact CG2-CG 4.23Å; L71-L169 HydrophobicContact CD1-CD2 3.51Å; V93-L169 CarbonylContact O-C 3.58Å; V93-L169 WeakPolarHBondContact O-CA 3.24Å; E94-L169 HydrophobicContact CB-CD2 3.83Å; E94-L169 HydrophobicContact CG-CD2 4Å; V145-L169 CarbonylContact C-O 3.57Å; V145-L169 WeakPolarHBondContact CA-O 3.35Å; N146-L169 PolarHBondContact N-O 3.39Å; N146-L169 PolarHBondContact OD1-N 3.21Å
170	L	95.1	Very high	80.2	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	117.6	178	-62.6	179.6	0	0	0	109.2	V93 M95 L136 I142 S144 V145 I162 L168 I172	V93-L170 PolarHBondContact N-O 2.97Å; V93-L170 PolarHBondContact O-N 3.08Å; M95-L170 HydrophobicContact SD-CD1 3.73Å; L136-L170 HydrophobicContact CD1-CD1 4Å; I142-L170 HydrophobicContact CG2-CD2 4.37Å; S144-L170 WeakPolarHBondContact O-CA 3.33Å; V145-L170 HydrophobicContact CB-CD2 4.18Å; V145-L170 HydrophobicContact CG1-CD2 3.98Å; V145-L170 HydrophobicContact CG2-CD2 3.75Å; I162-L170 HydrophobicContact CD1-CD2 4.22Å; I162-L170 HydrophobicContact CG1-CD2 4.2Å; L168-L170 HydrophobicContact CB-CG 4.43Å; L170-I172 HydrophobicContact CB-CG1 4.36Å
171	R	95.4	Very high	77.3	Confident	91 Å²	91	58.7 Å²	58.7	34%	0.343	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	123.8	168	-163.1	172	-177.2	148.7	-0.7	108.1	Y74 V143 S144	Y74-R171 PolarHBondContact OH-NH2 3.27Å; V143-R171 WeakPolarHBondContact CA-O 3.31Å; V143-R171 WeakPolarHBondContact CB-O 3.49Å; V143-R171 PolarHBondContact N-O 3.37Å; S144-R171 PolarHBondContact N-O 3.03Å; S144-R171 PolarHBondContact O-N 3.33Å; S144-R171 WeakPolarHBondContact OG-CB 3.5Å
172	I	95.2	Very high	74.3	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	143.4	-168.2	-11.9	164	0	0	0	110.5	C90 Q91 V93 V135 L136 D140 E141 L170	C90-I172 WeakPolarHBondContact CA-O 3.2Å; Q91-I172 HydrophobicContact CG-CB 4.48Å; Q91-I172 HydrophobicContact CG-CD1 4.31Å; Q91-I172 PolarHBondContact N-O 2.89Å; Q91-I172 PolarHBondContact O-N 3.44Å; V93-I172 HydrophobicContact CB-CD1 3.97Å; V93-I172 HydrophobicContact CB-CG1 4.5Å; V93-I172 HydrophobicContact CG2-CD1 3.51Å; V93-I172 HydrophobicContact CG2-CG1 4.29Å; V135-I172 WeakPolarHBondContact O-CD1 3.42Å; L136-I172 HydrophobicContact CD2-CD1 3.6Å; L136-I172 HydrophobicContact CD2-CG1 4.37Å; L136-I172 HydrophobicContact CD2-CG2 4Å; L136-I172 HydrophobicContact CG-CD1 3.77Å; D140-I172 HydrophobicContact CB-CG2 3.7Å; E141-I172 CarbonylContact O-C 3.55Å; E141-I172 WeakPolarHBondContact O-CA 3.43Å; E141-I172 VanDerWaalsContact O-CG2 3.24Å; E141-I172 WeakPolarHBondContact O-CG2 3.3Å; L170-I172 HydrophobicContact CB-CG1 4.36Å
173	R	93.2	Very high	71.3	Confident	33 Å²	33	70.9 Å²	70.9	13%	0.125	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	135.7	178.2	166.7	166.1	62.3	-145.9	-5.8	111.7	Y76 Y88 I89 E141 V143	Y76-R173 WeakPolarHBondContact OH-CD 3.21Å; Y76-R173 PolarHBondContact OH-NH1 3.19Å; Y76-R173 VanDerWaalsContact OH-NH1 3.09Å; Y88-R173 HydrophobicContact CD1-CG 3.71Å; Y88-R173 HydrophobicContact CE1-CG 4.38Å; Y88-R173 HydrophobicContact CG-CG 4.35Å; I89-R173 WeakPolarHBondContact O-CA 3.21Å; E141-R173 HydrophobicContact CB-CB 4.26Å; E141-R173 PolarHBondContact N-O 3.11Å; E141-R173 PolarHBondContact O-N 2.73Å; E141-R173 IonicContact OE1-CZ 2.67Å; E141-R173 IonicContact OE1-NE 3.53Å; E141-R173 IonicContact OE1-NH2 3.64Å; E141-R173 PolarHBondContact OE1-NH2 3.37Å; E141-R173 IonicContact OE2-CZ 3.43Å; E141-R173 VanDerWaalsContact OE2-CZ 3.3Å; E141-R173 IonicContact OE2-NE 2.82Å; E141-R173 PolarHBondContact OE2-NE 3.3Å; E141-R173 IonicContact OE2-NH2 3.9Å; E141-R173 PolarHBondContact OE2-NH2 3.26Å; V143-R173 HydrophobicContact CG2-CB 3.73Å
174	S	90.1	Very high	68.2	Low	20 Å²	20	72.9 Å²	72.9	14%	0.14	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	138.4	178.8	-42.6	0	0	0	0	110.4	Y88 I89 D140 K176	Y88-S174 WeakPolarHBondContact CA-O 3.42Å; I89-S174 PolarHBondContact N-O 2.88Å; I89-S174 PolarHBondContact O-N 3.16Å; D140-S174 WeakPolarHBondContact OD1-CB 3.47Å; D140-S174 PolarHBondContact OD1-OG 3.38Å; S174-K176 PolarHBondContact O-N 3.44Å
175	E	83.8	Confident	65.6	Low	55 Å²	55	78.3 Å²	78.3	26%	0.257	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	120.9	176.1	-173.8	173.9	154.5	0	0	110.7	K86 Y88	K86-E175 HydrophobicContact CD-CG 4.38Å; K86-E175 WeakPolarHBondContact CD-OE1 3.46Å; K86-E175 WeakPolarHBondContact CE-OE1 3.32Å; K86-E175 IonicContact NZ-OE1 2.74Å; K86-E175 PolarHBondContact NZ-OE1 3.32Å; K86-E175 IonicContact NZ-OE2 2.69Å; K86-E175 PolarHBondContact NZ-OE2 2.73Å; Y88-E175 HydrophobicContact CD1-CB 4.21Å; Y88-E175 HydrophobicContact CE1-CB 3.92Å; Y88-E175 HydrophobicContact CE1-CG 4.21Å
176	K	69.4	Low	62.7	Low	77 Å²	77	82.9 Å²	82.9	34%	0.335	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	121.3	178	178	171	171.6	175.7	0	109.6	E75 M87 I89 S174	E75-K176 WeakPolarHBondContact OE1-CD 3.17Å; E75-K176 IonicContact OE1-NZ 2.71Å; E75-K176 PolarHBondContact OE1-NZ 3.24Å; E75-K176 IonicContact OE2-NZ 3.17Å; E75-K176 PolarHBondContact OE2-NZ 2.89Å; M87-K176 HydrophobicContact CB-CB 4.2Å; M87-K176 HydrophobicContact CG-CB 4.35Å; M87-K176 HydrophobicContact CG-CD 4.22Å; M87-K176 PolarHBondContact O-N 3.2Å; M87-K176 HydrophobicContact SD-CD 3.71Å; M87-K176 HydrophobicContact SD-CG 4.31Å; I89-K176 HydrophobicContact CD1-CB 3.97Å; I89-K176 HydrophobicContact CD1-CD 4.15Å; I89-K176 HydrophobicContact CD1-CG 4.29Å; I89-K176 HydrophobicContact CG1-CB 4.13Å; I89-K176 HydrophobicContact CG1-CD 4.18Å; S174-K176 PolarHBondContact O-N 3.44Å
177	R	56.5	Low	59.7	Low	112 Å²	112	83 Å²	83	42%	0.423	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-98	133.8	-175.6	-58.8	173.9	-168.8	112.9	6	111.1	G660 T662	R177-G660 PolarHBondContact NE-O 2.86Å; R177-G660 PolarHBondContact NH2-O 2.94Å; R177-T662 PolarHBondContact NH1-OG1 2.86Å; R177-T662 VanDerWaalsContact NH2-N 3.14Å
178	D	40.7	Very low	56.6	Low	104 Å²	104	87.7 Å²	87.7	56%	0.556	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-86.2	129.4	172.2	-168	6.1	0	0	0	110	R180	D178-R180 PolarHBondContact O-N 3.29Å
179	P	32.8	Very low	53.5	Low	127 Å²	127	95.5 Å²	95.5	83%	0.825	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	12.1	-173	-24.2	36	0	0	0	117.7
180	R	27.8	Very low	50.2	Low	208 Å²	208	103.7 Å²	103.7	79%	0.785	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.8	-13.1	-161	-68	-168.6	174	108.8	-4.1	117.6	D178 V182	D178-R180 PolarHBondContact O-N 3.29Å; R180-V182 PolarHBondContact O-N 2.88Å
181	T	29.9	Very low	47	Very low	98 Å²	98	109.4 Å²	109.4	60%	0.601	58%	0.577	S	S	*	*			trans	-87.4	100.7	-172.9	10.1	0	0	0	0	113.1
182	V	26.3	Very low	43.8	Very low	147 Å²	147	113.8 Å²	113.8	89%	0.891	60%	0.603	S	S	*	*			trans	-100.3	111.8	166.4	178.8	0	0	0	0	108.5	R180	R180-V182 PolarHBondContact O-N 2.88Å
183	V	29.9	Very low	40.4	Very low	121 Å²	121	122.2 Å²	122.2	73%	0.733	64%	0.642	S	S	*	*			trans	-134.9	136.7	177.5	-174.4	0	0	0	0	112.2
184	T	24.1	Very low	37.1	Very low	116 Å²	116	129.2 Å²	129.2	71%	0.712	67%	0.674	S	S	*	*			trans	-59.2	154.6	-174.1	-43.9	0	0	0	0	116
185	F	31.3	Very low	34	Very low	192 Å²	192	134.1 Å²	134.1	84%	0.842	71%	0.705	S	S	*	*			trans	-33.5	142.3	175.5	-53.3	-89.2	0	0	0	117.8
186	P	29	Very low	31.2	Very low	97 Å²	97	137 Å²	137	63%	0.63	73%	0.726	S	S	*	*				-137.5	-150.1	129.2	45.4	-31.7	0	0	0	112.4
187	P	26.7	Very low	29	Very low	103 Å²	103	139.1 Å²	139.1	67%	0.669	75%	0.746	S	S	*	*				-112.4	175.1	-127	12.2	15.4	0	0	0	115.4
188	P	25.1	Very low	27.5	Very low	123 Å²	123	139.3 Å²	139.3	80%	0.799	76%	0.759	S	S	*	*			trans	-78.9	138.5	-172.3	31.4	-36.1	0	0	0	114.7
189	I	28.2	Very low	26.7	Very low	164 Å²	164	141.8 Å²	141.8	84%	0.841	77%	0.771	S	S	*	*			trans	-126.8	150.6	172.4	-62.7	179.8	0	0	0	109.3
190	K	23.9	Very low	26.4	Very low	190 Å²	190	143.3 Å²	143.3	83%	0.826	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-64.3	146.7	-167.4	-61.5	175.2	-177.3	176.1	0	113.1
191	P	27.6	Very low	26.3	Very low	120 Å²	120	142 Å²	142	78%	0.779	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-69.8	137.1	179.2	29.5	-34.9	0	0	0	111.8
192	M	27.6	Very low	26	Very low	182 Å²	182	145.5 Å²	145.5	90%	0.897	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-95.7	141.1	171.2	-142.4	176.8	86.3	0	0	110.1
193	E	24.1	Very low	26.2	Very low	177 Å²	177	144 Å²	144	83%	0.827	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-76.6	140.3	-171.6	-165.5	165.2	-153.4	0	0	112.2
194	K	25.1	Very low	26	Very low	181 Å²	181	149 Å²	149	79%	0.787	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-89.8	141.5	175.1	-69.4	179.9	-179.5	175.5	0	109.6	V196	K194-V196 PolarHBondContact O-N 3.21Å; K194-V196 VanDerWaalsContact O-N 3.12Å
195	P	24.6	Very low	26.2	Very low	123 Å²	123	151.9 Å²	151.9	80%	0.799	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-63.1	117.4	179.1	26.1	-34.1	0	0	0	110.7	V197	P195-V197 PolarHBondContact O-N 2.71Å
196	V	24.8	Very low	26.1	Very low	114 Å²	114	150 Å²	150	69%	0.691	78%	0.783	S	S	*	*			trans	-74.3	107.1	178.6	-179.2	0	0	0	0	109.2	K194 V198	K194-V196 PolarHBondContact O-N 3.21Å; K194-V196 VanDerWaalsContact O-N 3.12Å; V196-V198 VanDerWaalsContact C-N 3.33Å; V196-V198 HydrophobicContact CG1-CG2 3.88Å; V196-V198 PolarHBondContact O-N 2.74Å
197	V	23.8	Very low	26.2	Very low	123 Å²	123	150.2 Å²	150.2	75%	0.745	79%	0.786	S	S	*	*			trans	-72.4	93.1	166	-179.6	0	0	0	0	107.8	P195 L199	P195-V197 PolarHBondContact O-N 2.71Å; V197-L199 VanDerWaalsContact C-N 3.32Å; V197-L199 PolarHBondContact O-N 3.25Å
198	V	24	Very low	26.3	Very low	116 Å²	116	154.4 Å²	154.4	70%	0.703	79%	0.794	S	S	*	*			trans	-68.7	92.7	174.4	-178.3	0	0	0	0	108.7	V196 K200	V196-V198 VanDerWaalsContact C-N 3.33Å; V196-V198 HydrophobicContact CG1-CG2 3.88Å; V196-V198 PolarHBondContact O-N 2.74Å; V198-K200 VanDerWaalsContact C-N 3.31Å; V198-K200 PolarHBondContact O-N 2.9Å
199	L	24.8	Very low	26.7	Very low	155 Å²	155	156.2 Å²	156.2	81%	0.812	80%	0.797	S	S	*	*			trans	-61.1	98	160.8	-74.5	171.3	0	0	0	107.5	V197 Q201	V197-L199 VanDerWaalsContact C-N 3.32Å; V197-L199 PolarHBondContact O-N 3.25Å; L199-Q201 VanDerWaalsContact C-N 3.35Å; L199-Q201 PolarHBondContact O-N 3.28Å
200	K	26.6	Very low	26.7	Very low	159 Å²	159	153.6 Å²	153.6	69%	0.691	79%	0.793	S	S	*	*			trans	-63.6	95.4	178.3	-176.1	179.6	179.8	-177.8	0	108.8	V198 M202	V198-K200 VanDerWaalsContact C-N 3.31Å; V198-K200 PolarHBondContact O-N 2.9Å; K200-M202 PolarHBondContact O-N 2.99Å
201	Q	25.5	Very low	27	Very low	181 Å²	181	151.2 Å²	151.2	85%	0.846	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-52.3	124.3	167.4	-76	179.5	-60.1	0	0	108.2	L199	L199-Q201 VanDerWaalsContact C-N 3.35Å; L199-Q201 PolarHBondContact O-N 3.28Å
202	M	23.7	Very low	27.1	Very low	172 Å²	172	153.4 Å²	153.4	85%	0.847	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-63.3	131.6	162.2	-62.3	-178.5	-175.8	0	0	106.8	K200 R204	K200-M202 PolarHBondContact O-N 2.99Å; M202-R204 PolarHBondContact O-N 3.36Å
203	P	29.7	Very low	27.4	Very low	115 Å²	115	151.1 Å²	151.1	75%	0.747	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-54.8	137.2	169.3	-22.6	33.7	0	0	0	109.2
204	R	25.9	Very low	27.7	Very low	226 Å²	226	149.7 Å²	149.7	85%	0.853	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-75	123.6	161.7	-73.3	178.4	172.5	151.2	-3.3	106.7	M202 D206	M202-R204 PolarHBondContact O-N 3.36Å; R204-D206 PolarHBondContact O-N 3.41Å
205	E	28.3	Very low	28.1	Very low	176 Å²	176	148.9 Å²	148.9	82%	0.822	79%	0.789	S	S	*	*			trans	-80.8	93.5	170.3	-67.2	-171.6	154.6	0	0	108.5	S207	E205-S207 PolarHBondContact O-N 3.04Å
206	D	29.2	Very low	28.4	Very low	154 Å²	154	146.7 Å²	146.7	82%	0.824	78%	0.777	S	S	*	*			trans	-66.8	112.9	167.8	-69.9	-47.6	0	0	0	108.6	R204	R204-D206 PolarHBondContact O-N 3.41Å
207	S	30.4	Very low	28.6	Very low	101 Å²	101	150.7 Å²	150.7	71%	0.706	79%	0.785	S	S	*	*			trans	-121.5	92.4	-174.8	-71	0	0	0	0	112.4	E205	E205-S207 PolarHBondContact O-N 3.04Å
208	K	29.3	Very low	29	Very low	190 Å²	190	150.4 Å²	150.4	83%	0.826	79%	0.786	S	S	*	*			trans	-175.3	132	158.9	-96.5	150.8	-171.5	178.8	0	104.6
209	D	33.3	Very low	29.2	Very low	162 Å²	162	153.6 Å²	153.6	87%	0.866	80%	0.798	S	S	*	*			cis	-121.7	-179.7	30.5	-70.4	-53	0	0	0	115.8
210	S	28	Very low	29.2	Very low	108 Å²	108	150.5 Å²	150.5	76%	0.755	80%	0.795	S	S	*	*			trans	-89.6	144	-175.7	175.9	0	0	0	0	113.3
211	V	31.8	Very low	29.2	Very low	140 Å²	140	148.2 Å²	148.2	85%	0.848	80%	0.799	S	S	*	*			trans	-152.8	152.8	131.6	143.1	0	0	0	0	108.2
212	M	28.3	Very low	29.3	Very low	166 Å²	166	144.4 Å²	144.4	82%	0.818	79%	0.792	S	S	*	*			trans	-63.4	159.6	-177.5	-65.4	175.4	174.9	0	0	112.6
213	T	34.5	Very low	29.6	Very low	134 Å²	134	144.4 Å²	144.4	82%	0.822	79%	0.79	S	S	*	*				-152.4	164.7	51.9	49.9	0	0	0	0	116.6
214	D	29.8	Very low	29.4	Very low	148 Å²	148	145.1 Å²	145.1	79%	0.791	80%	0.795	S	S	*	*			trans	-28.7	162.8	153.9	-86	-54.2	0	0	0	117.9
215	E	33.1	Very low	29.5	Very low	163 Å²	163	141 Å²	141	76%	0.762	79%	0.789	S	S	*	*			cis	-146.7	-157.3	25.4	-126.4	-96.5	-175.2	0	0	113.1
216	S	31.1	Very low	29.6	Very low	78 Å²	78	137.4 Å²	137.4	55%	0.545	78%	0.779	S	S	.	*			trans	-99.6	151.7	-141.9	68.1	0	0	0	0	121.9
217	K	30.2	Very low	29.9	Very low	198 Å²	198	136 Å²	136	86%	0.861	78%	0.777	S	S	*	*			trans	79.8	152.6	143	-80.4	167.4	-178.2	170.5	0	122.7
218	P	32.5	Very low	29.8	Very low	117 Å²	117	135.3 Å²	135.3	76%	0.76	78%	0.777	S	S	*	*			trans	-124.6	172.7	-167.2	43.5	-28.8	0	0	0	115.8
219	L	27.7	Very low	30.1	Very low	182 Å²	182	133.3 Å²	133.3	95%	0.953	77%	0.771	S	S	*	*			trans	-153.3	164	159.2	-110.5	156	0	0	0	110.3
220	A	25.3	Very low	30.6	Very low	90 Å²	90	129.3 Å²	129.3	74%	0.744	75%	0.752	S	S	*	*			trans	-123.9	144.3	-162.5	0	0	0	0	0	114.6
221	S	25.8	Very low	31	Very low	111 Å²	111	129.4 Å²	129.4	78%	0.776	75%	0.753	S	S	*	*			trans	-173.7	133.1	142.9	57.6	0	0	0	0	113.7
222	S	26.5	Very low	31.2	Very low	102 Å²	102	128.7 Å²	128.7	71%	0.713	74%	0.743	S	S	*	*			trans	25.7	119.1	147.8	61	0	0	0	0	121.5
223	Q	31	Very low	31.5	Very low	171 Å²	171	123 Å²	123	80%	0.799	73%	0.727	S	S	*	*				178.1	146.7	106.6	-94.9	175.7	32.5	0	0	111.8	L225	Q223-L225 PolarHBondContact O-N 3.06Å
224	P	26.3	Very low	31.9	Very low	131 Å²	131	121.2 Å²	121.2	85%	0.851	72%	0.716	S	S	*	*			trans	-81.3	105.4	174	31.9	-31.6	0	0	0	111
225	L	28	Very low	32.4	Very low	140 Å²	140	123.1 Å²	123.1	73%	0.733	71%	0.712	S	S	*	*			trans	-67	142	179.8	-78.6	167	0	0	0	112.9	Q223	Q223-L225 PolarHBondContact O-N 3.06Å
226	T	30.4	Very low	32.5	Very low	100 Å²	100	118.6 Å²	118.6	61%	0.613	70%	0.703	S	S	*	*			trans	-70.1	148.2	-178	167.1	0	0	0	0	112.8	A228 Q229	T226-A228 PolarHBondContact O-N 3.48Å; T226-Q229 PolarHBondContact O-N 2.81Å
227	T	34	Very low	32.8	Very low	125 Å²	125	124.7 Å²	124.7	77%	0.767	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-53.1	-16.4	-174.4	-43.2	0	0	0	0	115.2	Q229	T227-Q229 PolarHBondContact O-N 3.32Å
228	A	28.6	Very low	33.3	Very low	86 Å²	86	121.4 Å²	121.4	71%	0.711	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-65.1	-14	-177.6	0	0	0	0	0	115.8	T226	T226-A228 PolarHBondContact O-N 3.48Å
229	Q	36.1	Very low	33.6	Very low	148 Å²	148	123.3 Å²	123.3	69%	0.692	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-109.6	13.8	-171.4	-70.9	-172.4	-33.9	0	0	116	T226 T227	T226-Q229 PolarHBondContact O-N 2.81Å; T227-Q229 PolarHBondContact O-N 3.32Å
230	T	43.5	Very low	34	Very low	78 Å²	78	118.5 Å²	118.5	48%	0.479	69%	0.69	S	S	.	*	S	Bend	trans	-87.9	145.6	175.9	62.2	0	0	0	0	113.1	L232 G233	T230-L232 PolarHBondContact O-N 3.28Å; T230-G233 PolarHBondContact O-N 3.36Å
231	S	36.6	Very low	34.3	Very low	110 Å²	110	122.2 Å²	122.2	77%	0.769	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	-3.3	-171.2	51.2	0	0	0	0	116.7
232	L	36.1	Very low	34.5	Very low	125 Å²	125	125.2 Å²	125.2	65%	0.654	69%	0.693	S	S	*	*	H	α-helix	trans	-77.8	-33.1	169.1	-96.6	151	0	0	0	112.7	T230 T234 R235 A236	T230-L232 PolarHBondContact O-N 3.28Å; L232-T234 PolarHBondContact O-N 2.75Å; L232-R235 PolarHBondContact O-N 3.13Å; L232-A236 PolarHBondContact O-N 3.18Å
233	G	35	Very low	34.6	Very low	46 Å²	46	127.3 Å²	127.3	47%	0.474	70%	0.702	S	S	.	*	H	α-helix	trans	-64.2	-38.4	-177.3	0	0	0	0	0	113.4	T230 R235 R237	T230-G233 PolarHBondContact O-N 3.36Å; G233-R235 VanDerWaalsContact C-N 3.34Å; G233-R235 PolarHBondContact O-N 2.63Å; G233-R237 PolarHBondContact O-N 3.01Å
234	T	42.1	Very low	34.4	Very low	96 Å²	96	124.8 Å²	124.8	59%	0.589	70%	0.703	S	S	*	*	H	α-helix	trans	-66.6	-34.4	179.6	-37.1	0	0	0	0	112.4	L232 L238	L232-T234 PolarHBondContact O-N 2.75Å; T234-L238 PolarHBondContact O-N 2.93Å
235	R	41.3	Very low	34.6	Very low	188 Å²	188	125.2 Å²	125.2	71%	0.709	70%	0.703	S	S	*	*	H	α-helix	trans	-76.8	-38.6	-175.5	-159.1	168	-173.3	152	1.1	112.4	L232 G233 R237 L238 Q239	L232-R235 PolarHBondContact O-N 3.13Å; G233-R235 VanDerWaalsContact C-N 3.34Å; G233-R235 PolarHBondContact O-N 2.63Å; R235-R237 VanDerWaalsContact C-N 3.28Å; R235-R237 PolarHBondContact O-N 3.05Å; R235-L238 PolarHBondContact O-N 3.24Å; R235-Q239 PolarHBondContact O-N 3.17Å
236	A	34.9	Very low	34.7	Very low	68 Å²	68	123.1 Å²	123.1	56%	0.562	71%	0.706	S	S	*	*	H	α-helix	trans	-60.7	-36.7	173.2	0	0	0	0	0	112.3	L232 L238	L232-A236 PolarHBondContact O-N 3.18Å; A236-L238 VanDerWaalsContact C-N 3.35Å; A236-L238 PolarHBondContact O-N 2.95Å
237	R	37.7	Very low	34.5	Very low	206 Å²	206	124.4 Å²	124.4	78%	0.777	71%	0.714	S	S	*	*	H	α-helix	trans	-73.4	-23.3	-179.4	-139.8	171.2	-168.1	161.3	2.7	113.9	G233 R235	G233-R237 PolarHBondContact O-N 3.01Å; R235-R237 VanDerWaalsContact C-N 3.28Å; R235-R237 PolarHBondContact O-N 3.05Å
238	L	39.2	Very low	34.3	Very low	129 Å²	129	126.4 Å²	126.4	68%	0.675	72%	0.715	S	S	*	*	H	α-helix	trans	-89.2	-15.7	178.7	-72.9	170.4	0	0	0	114.2	T234 R235 A236	T234-L238 PolarHBondContact O-N 2.93Å; R235-L238 PolarHBondContact O-N 3.24Å; A236-L238 VanDerWaalsContact C-N 3.35Å; A236-L238 PolarHBondContact O-N 2.95Å
239	Q	39.6	Very low	34.3	Very low	158 Å²	158	129.6 Å²	129.6	74%	0.738	72%	0.715	S	S	*	*	H	α-helix	trans	-89.1	-8	172.4	-67.4	-174.3	-83	0	0	113.3	R235	R235-Q239 PolarHBondContact O-N 3.17Å
240	A	34.9	Very low	34	Very low	80 Å²	80	127.5 Å²	127.5	66%	0.661	71%	0.713	S	S	*	*	S	Bend	trans	-98.2	10.2	178	0	0	0	0	0	114.4
241	M	32.5	Very low	33.2	Very low	169 Å²	169	132 Å²	132	83%	0.833	73%	0.728	S	S	*	*	S	Bend	trans	-134.3	28.1	-177.6	-76.5	-167.7	156.1	0	0	114.1
242	K	30	Very low	32.9	Very low	174 Å²	174	135.8 Å²	135.8	76%	0.757	73%	0.734	S	S	*	*	S	Bend	trans	-136	152.1	162.9	-69.7	-169.9	175.8	-176.7	0	109.4
243	T	29.2	Very low	32.4	Very low	146 Å²	146	134.4 Å²	134.4	90%	0.896	74%	0.74	S	S	*	*	S	Bend	trans	61	60.8	180	65.4	0	0	0	0	117
244	S	25.9	Very low	32.5	Very low	117 Å²	117	138.7 Å²	138.7	82%	0.818	76%	0.76	S	S	*	*			trans	-152.2	43.1	157	71	0	0	0	0	113.8
245	T	30.7	Very low	31.9	Very low	140 Å²	140	140.3 Å²	140.3	86%	0.859	78%	0.775	S	S	*	*			trans	-145.2	134.9	163.8	47.6	0	0	0	0	107.1
246	A	30.3	Very low	31.4	Very low	97 Å²	97	134.5 Å²	134.5	80%	0.802	77%	0.774	S	S	*	*			cis	-138.5	178.6	-1.3	0	0	0	0	0	110.9
247	T	26.7	Very low	31.4	Very low	126 Å²	126	136.6 Å²	136.6	77%	0.773	78%	0.784	S	S	*	*			trans	-132.3	157.7	172.7	40.6	0	0	0	0	109.8
248	E	29.8	Very low	31.1	Very low	167 Å²	167	137.9 Å²	137.9	78%	0.78	79%	0.789	S	S	*	*			trans	72.6	142.2	-179.4	-48.7	-164.4	90.7	0	0	113.9
249	Q	28.3	Very low	30.8	Very low	153 Å²	153	139.8 Å²	139.8	72%	0.715	80%	0.795	S	S	*	*			cis	-166.1	168	-5.2	-118.7	-167.6	72.6	0	0	108.8
250	T	29.1	Very low	30.2	Very low	105 Å²	105	138.6 Å²	138.6	64%	0.644	79%	0.793	S	S	*	*			cis	-147	-73.7	-1.3	-147.4	0	0	0	0	115.4
251	E	27.1	Very low	30	Very low	171 Å²	171	141.4 Å²	141.4	80%	0.799	80%	0.796	S	S	*	*			trans	-120.7	168.6	-170.6	-69	155.6	151.9	0	0	111.3
252	E	29.4	Very low	29.8	Very low	191 Å²	191	142.5 Å²	142.5	89%	0.893	80%	0.796	S	S	*	*			cis	-143.4	175.2	29.3	-75	-169.2	118.4	0	0	113.8
253	A	27.2	Very low	29.7	Very low	96 Å²	96	145.1 Å²	145.1	79%	0.793	80%	0.801	S	S	*	*			trans	-152.8	140	161.4	0	0	0	0	0	113.1
254	P	37.4	Very low	29.9	Very low	136 Å²	136	147.6 Å²	147.6	88%	0.883	80%	0.8	S	S	*	*			trans	-114.4	163.8	159.4	31.3	-18.3	0	0	0	113.4
255	S	29	Very low	29.8	Very low	129 Å²	129	146.4 Å²	146.4	90%	0.902	79%	0.791	S	S	*	*			trans	-108.3	155.1	-163.6	65	0	0	0	0	115.2
256	G	31.1	Very low	30.2	Very low	67 Å²	67	150.2 Å²	150.2	69%	0.691	79%	0.792	S	S	*	*			trans	-150.8	123.2	169.8	0	0	0	0	0	113.3
257	S	34.4	Very low	30.3	Very low	112 Å²	112	151.1 Å²	151.1	78%	0.783	79%	0.789	S	S	*	*			trans	27.1	103.7	163.1	53.3	0	0	0	0	119.2
258	R	32.5	Very low	30.3	Very low	232 Å²	232	151.1 Å²	151.1	88%	0.875	79%	0.789	S	S	*	*				85.8	110.3	75.2	-85.4	-174.2	171	-178.1	-1.8	115.8
259	Q	32.3	Very low	30.2	Very low	170 Å²	170	149.8 Å²	149.8	79%	0.794	79%	0.793	S	S	*	*				40.3	137.9	126.7	-71.4	-174.1	-5.3	0	0	120.1
260	N	26.6	Very low	30.3	Very low	133 Å²	133	145.9 Å²	145.9	71%	0.711	79%	0.794	S	S	*	*			cis	-171.3	-173.8	9.1	-129.6	-21.4	0	0	0	113.3
261	I	29.6	Very low	30.2	Very low	138 Å²	138	148.6 Å²	148.6	71%	0.708	80%	0.804	S	S	*	*			trans	80.9	133.8	158.5	-15.7	178	0	0	0	121.6
262	F	29.9	Very low	30.4	Very low	193 Å²	193	144.7 Å²	144.7	85%	0.846	80%	0.801	S	S	*	*			trans	101.6	108.7	151.1	-87.3	-62.9	0	0	0	122.1
263	R	27.1	Very low	30.4	Very low	228 Å²	228	140.4 Å²	140.4	86%	0.86	80%	0.799	S	S	*	*			trans	-71.5	162.5	158.4	-65.8	171.8	167.5	162.5	-6.3	111.2
264	K	32.7	Very low	30.6	Very low	199 Å²	199	139.7 Å²	139.7	87%	0.865	79%	0.792	S	S	*	*			trans	-149.5	140.1	135.8	-125	169.7	-173.7	174.2	0	113.2
265	S	25.4	Very low	30.1	Very low	92 Å²	92	140.6 Å²	140.6	64%	0.643	79%	0.79	S	S	*	*			trans	-150.5	104.4	174.2	55.6	0	0	0	0	108.4
266	Y	37.9	Very low	30.3	Very low	220 Å²	220	141.6 Å²	141.6	86%	0.863	79%	0.79	S	S	*	*			trans	60.7	153.2	-177.5	-49.2	-74.2	0	0	0	116.1
267	P	33.6	Very low	30.2	Very low	115 Å²	115	142 Å²	142	75%	0.747	79%	0.794	S	S	*	*			trans	-145.3	166.1	134.1	38	-23.9	0	0	0	113.9
268	T	26.4	Very low	29.9	Very low	126 Å²	126	141.8 Å²	141.8	77%	0.773	80%	0.799	S	S	*	*			trans	-150	161.4	165.1	-47.9	0	0	0	0	108.7
269	T	28.3	Very low	29.6	Very low	139 Å²	139	136.5 Å²	136.5	85%	0.853	80%	0.798	S	S	*	*			trans	81.9	145.6	170.7	75.3	0	0	0	0	118.7
270	G	29.2	Very low	29.6	Very low	72 Å²	72	132.2 Å²	132.2	74%	0.742	79%	0.791	S	S	*	*			trans	178.5	108.1	174.4	0	0	0	0	0	108.9
271	N	28.1	Very low	29.6	Very low	161 Å²	161	133.7 Å²	133.7	86%	0.861	79%	0.794	S	S	*	*			trans	-96.8	-175.8	177.8	-57	-26.3	0	0	0	109.1
272	A	30.9	Very low	29.6	Very low	89 Å²	89	135.1 Å²	135.1	74%	0.736	80%	0.798	S	S	*	*			cis	-164.4	167.6	13.5	0	0	0	0	0	112.9
273	A	29.9	Very low	29.5	Very low	102 Å²	102	133.3 Å²	133.3	84%	0.843	79%	0.792	S	S	*	*			trans	69.7	155.8	146.8	0	0	0	0	0	119
274	A	30.8	Very low	29.5	Very low	80 Å²	80	130 Å²	130	66%	0.661	79%	0.79	S	S	*	*			cis	-152.2	163.6	1	0	0	0	0	0	113.7
275	N	26.4	Very low	29.3	Very low	156 Å²	156	123.8 Å²	123.8	83%	0.834	78%	0.783	S	S	*	*			trans	52.5	119.3	154.5	-62.2	-5	0	0	0	121.2
276	V	34.3	Very low	29.7	Very low	150 Å²	150	127.8 Å²	127.8	91%	0.909	80%	0.795	S	S	*	*				-148.1	153	90	154	0	0	0	0	107.3
277	G	27.9	Very low	29.5	Very low	74 Å²	74	124.6 Å²	124.6	76%	0.763	79%	0.793	S	S	*	*			trans	-102.2	163.5	-167.5	0	0	0	0	0	116.2
278	A	29	Very low	29.1	Very low	109 Å²	109	127.6 Å²	127.6	90%	0.901	80%	0.797	S	S	*	*			trans	-144.6	148	159.2	0	0	0	0	0	108.6
279	S	26	Very low	29.3	Very low	120 Å²	120	130.4 Å²	130.4	84%	0.839	80%	0.802	S	S	*	*			trans	-146.1	169	-174.8	55.4	0	0	0	0	111.9
280	A	31	Very low	29.4	Very low	80 Å²	80	129.4 Å²	129.4	66%	0.661	80%	0.797	S	S	*	*			trans	74.6	104.7	175.1	0	0	0	0	0	118.7
281	Q	27.7	Very low	29.5	Very low	164 Å²	164	131.7 Å²	131.7	77%	0.766	80%	0.799	S	S	*	*				55.6	141.7	119	-66.2	173.6	-56.6	0	0	122.8
282	Q	29.6	Very low	29.6	Very low	169 Å²	169	130.9 Å²	130.9	79%	0.79	80%	0.8	S	S	*	*			trans	73.5	145	147.2	-78.2	171.7	24.2	0	0	117.6
283	H	27.2	Very low	29.3	Very low	155 Å²	155	138.3 Å²	138.3	72%	0.718	81%	0.809	S	S	*	*			cis	-159.3	163	-9	-158.5	-152.4	0	0	0	111.3
284	L	26.5	Very low	29.2	Very low	157 Å²	157	138.4 Å²	138.4	82%	0.822	80%	0.804	S	S	*	*			trans	63.7	145.4	161.4	-72.8	159.2	0	0	0	120.5
285	G	29.3	Very low	28.9	Very low	69 Å²	69	143.7 Å²	143.7	71%	0.711	82%	0.817	S	S	*	*			trans	139.6	60.9	158.7	0	0	0	0	0	118.2
286	I	34.5	Very low	28.9	Very low	177 Å²	177	140.7 Å²	140.7	91%	0.908	81%	0.808	S	S	*	*			trans	-170.2	146.7	147.6	-103.7	154.8	0	0	0	110
287	D	32.1	Very low	28.3	Very low	153 Å²	153	141.8 Å²	141.8	82%	0.818	81%	0.809	S	S	*	*			trans	-89.6	170.9	-165.3	-106.5	-57.9	0	0	0	116.6
288	Q	25.6	Very low	28.1	Very low	177 Å²	177	149.3 Å²	149.3	83%	0.827	81%	0.814	S	S	*	*			trans	-89.5	132.2	-172.1	-55.8	172.7	45.8	0	0	113.3
289	Q	30.7	Very low	27.9	Very low	186 Å²	186	155.7 Å²	155.7	87%	0.869	82%	0.815	S	S	*	*			trans	-136.6	125.9	149.4	-82.3	-163.3	-13.1	0	0	110.9
290	P	29.6	Very low	27.9	Very low	118 Å²	118	155.1 Å²	155.1	77%	0.766	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-92.7	131.3	-177	33.8	-32.4	0	0	0	112.8
291	P	33.1	Very low	27.5	Very low	120 Å²	120	161.5 Å²	161.5	78%	0.779	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-71.7	136.1	165.7	29.4	-32.5	0	0	0	110.8	R293	P291-R293 PolarHBondContact O-N 2.74Å
292	T	28.8	Very low	27.2	Very low	144 Å²	144	158.1 Å²	158.1	88%	0.883	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-48.2	121.6	-177	51.3	0	0	0	0	114.2	S294	T292-S294 PolarHBondContact O-N 3.26Å
293	R	24.9	Very low	27	Very low	244 Å²	244	161 Å²	161	92%	0.921	82%	0.818	S	S	*	*			trans	-80.5	110.5	167.7	-75.2	-174.5	174	-174.5	-1.4	110.8	P291	P291-R293 PolarHBondContact O-N 2.74Å
294	S	29.1	Very low	26.9	Very low	105 Å²	105	162.3 Å²	162.3	73%	0.734	82%	0.824	S	S	*	*			trans	-73.5	138.9	161.8	-173.3	0	0	0	0	110.1	T292 S296	T292-S294 PolarHBondContact O-N 3.26Å; S294-S296 PolarHBondContact O-N 3.16Å
295	M	24	Very low	26.8	Very low	191 Å²	191	163.6 Å²	163.6	94%	0.941	83%	0.831	S	S	*	*	S	Bend	trans	-85.1	92.3	177.4	-73.5	-166.5	-74.6	0	0	111.5
296	S	25.3	Very low	26.5	Very low	92 Å²	92	164.4 Å²	164.4	64%	0.643	83%	0.831	S	S	*	*			trans	-161.5	72.8	169.2	62.8	0	0	0	0	112.9	S294	S294-S296 PolarHBondContact O-N 3.16Å
297	D	23.4	Very low	26	Very low	173 Å²	173	163.3 Å²	163.3	93%	0.925	82%	0.824	S	S	*	*			trans	-163.3	85.7	161.4	-110	-30.2	0	0	0	111.6
298	R	23.5	Very low	25.7	Very low	233 Å²	233	165.4 Å²	165.4	88%	0.879	83%	0.829	S	S	*	*			trans	-157.9	78.7	165.8	-137.9	-177	-166.7	-159.9	3.4	113
299	W	24.8	Very low	25.8	Very low	242 Å²	242	162.5 Å²	162.5	92%	0.917	82%	0.823	S	S	*	*			trans	171.9	140.8	132.6	-87.5	12.3	0	0	0	109.5
300	S	24.4	Very low	25.6	Very low	109 Å²	109	159.6 Å²	159.6	76%	0.762	82%	0.821	S	S	*	*			trans	-145.6	107	-168.7	59.2	0	0	0	0	112.2
301	Y	23.3	Very low	25.7	Very low	214 Å²	214	163.4 Å²	163.4	84%	0.839	82%	0.82	S	S	*	*			trans	-115.6	88.9	173.9	-94.8	-91.8	0	0	0	111.9
302	S	22.3	Very low	25.5	Very low	93 Å²	93	165.7 Å²	165.7	65%	0.65	82%	0.824	S	S	*	*			trans	-100.1	70.9	167.2	-76.7	0	0	0	0	110.6	R635	S302-R635 PolarHBondContact OG-NH1 3.48Å
303	R	24.5	Very low	25.8	Very low	229 Å²	229	164 Å²	164	86%	0.864	81%	0.808	S	S	*	*			trans	-169.1	74.2	174	-115.2	-179	-165.6	-171.2	4.7	113.7
304	Q	25	Very low	26.6	Very low	182 Å²	182	156.3 Å²	156.3	85%	0.85	79%	0.786	S	S	*	*			trans	-163.3	33	164.5	-117.7	155.2	-3.6	0	0	116.2
305	L	24.3	Very low	26.9	Very low	184 Å²	184	155.5 Å²	155.5	96%	0.963	79%	0.794	S	S	*	*	S	Bend	trans	-129	69.4	164.7	-79	178.7	0	0	0	110.9
306	A	24.2	Very low	27.6	Very low	87 Å²	87	154.2 Å²	154.2	72%	0.719	79%	0.786	S	S	*	*			trans	-153	161.2	161.9	0	0	0	0	0	106.6
307	M	23.7	Very low	27.9	Very low	153 Å²	153	152 Å²	152	75%	0.754	78%	0.778	S	S	*	*			trans	72.4	81.3	-174.8	-45	-60.8	-80	0	0	114.8
308	H	26.3	Very low	28.8	Very low	197 Å²	197	152.1 Å²	152.1	91%	0.912	77%	0.765	S	S	*	*				-164	66.8	126.5	-104.6	-66.9	0	0	0	110.9
309	T	27.3	Very low	29.4	Very low	117 Å²	117	145.9 Å²	145.9	72%	0.718	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-71	141.1	155.3	36.9	0	0	0	0	108.9	R311	T309-R311 PolarHBondContact O-N 2.99Å
310	P	27	Very low	30.1	Very low	125 Å²	125	140.9 Å²	140.9	81%	0.812	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-66.4	119.2	173.7	27.4	-32.8	0	0	0	108.9
311	R	30	Very low	30.7	Very low	197 Å²	197	139 Å²	139	74%	0.743	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-73.3	127	169.8	-77.7	-179.4	169.2	153.9	-5.2	108.5	T309 L313	T309-R311 PolarHBondContact O-N 2.99Å; R311-L313 PolarHBondContact O-N 3.26Å
312	I	30	Very low	31.3	Very low	169 Å²	169	134.8 Å²	134.8	87%	0.867	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-66.2	121	165.7	-60.9	173.8	0	0	0	106.6
313	L	33.9	Very low	32	Very low	107 Å²	107	138.6 Å²	138.6	56%	0.56	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-92.7	145.5	167.2	-67.8	171.4	0	0	0	108.4	R311	R311-L313 PolarHBondContact O-N 3.26Å
314	D	43.2	Very low	32.5	Very low	83 Å²	83	131.2 Å²	131.2	44%	0.444	76%	0.758	S	S	.	*			trans	-77.1	174	166.4	54.5	12.1	0	0	0	111.1	E316 G317 R318	D314-E316 PolarHBondContact O-N 3.34Å; D314-G317 PolarHBondContact O-N 3.43Å; D314-G317 PolarHBondContact OD1-N 3.33Å; D314-G317 VanDerWaalsContact OD1-N 3.12Å; D314-R318 PolarHBondContact OD1-N 2.81Å
315	G	34.2	Very low	32.7	Very low	89 Å²	89	130.3 Å²	130.3	92%	0.918	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	-11.7	-173.5	0	0	0	0	0	115.7
316	E	38.6	Very low	33	Very low	163 Å²	163	132.3 Å²	132.3	76%	0.762	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.6	13.1	175.1	-60.5	-157.9	159.4	0	0	113.5	D314	D314-E316 PolarHBondContact O-N 3.34Å
317	G	32	Very low	33.4	Very low	46 Å²	46	136.2 Å²	136.2	47%	0.474	75%	0.754	S	S	.	*			trans	72.7	32.9	163.2	0	0	0	0	0	116.2	D314	D314-G317 PolarHBondContact O-N 3.43Å; D314-G317 PolarHBondContact OD1-N 3.33Å; D314-G317 VanDerWaalsContact OD1-N 3.12Å
318	R	41.7	Very low	33.7	Very low	175 Å²	175	135.7 Å²	135.7	66%	0.66	75%	0.75	S	S	*	*			trans	-105.2	142	179.6	-59.2	-168	-169.6	-155.6	6.1	112.4	D314 V320	D314-R318 PolarHBondContact OD1-N 2.81Å; R318-V320 PolarHBondContact O-N 2.83Å
319	P	37.6	Very low	33.6	Very low	103 Å²	103	133 Å²	133	67%	0.669	74%	0.738	S	S	*	*			trans	-82.6	115.6	178.1	31.4	-32.5	0	0	0	111.6
320	V	38.4	Very low	33.7	Very low	136 Å²	136	135 Å²	135	82%	0.824	74%	0.739	S	S	*	*			trans	-71.1	130.6	169.3	-177.6	0	0	0	0	109.9	R318	R318-V320 PolarHBondContact O-N 2.83Å
321	G	36.5	Very low	33.8	Very low	70 Å²	70	134.7 Å²	134.7	72%	0.722	74%	0.74	S	S	*	*			trans	-113	150.6	175.7	0	0	0	0	0	112.5
322	S	37.5	Very low	33.5	Very low	125 Å²	125	130.8 Å²	130.8	87%	0.874	74%	0.743	S	S	*	*			trans	-150	142.8	170.7	53.1	0	0	0	0	110.8
323	D	35.9	Very low	34	Very low	174 Å²	174	128.1 Å²	128.1	93%	0.93	74%	0.736	S	S	*	*			trans	-111.9	158	-170.4	-101.2	-50.7	0	0	0	113.2
324	G	34.9	Very low	33.9	Very low	73 Å²	73	131 Å²	131	75%	0.753	75%	0.747	S	S	*	*			trans	81.9	130.6	150.6	0	0	0	0	0	118
325	L	29.4	Very low	33.2	Very low	164 Å²	164	136.6 Å²	136.6	86%	0.859	76%	0.762	S	S	*	*			trans	-144.6	156.3	173.4	-155.1	91.2	0	0	0	111.2
326	R	30.9	Very low	32.8	Very low	226 Å²	226	138.9 Å²	138.9	85%	0.853	75%	0.752	S	S	*	*			trans	88.8	149.5	176.4	-59.1	176.8	153.9	175.9	-7.9	114.3
327	K	32.6	Very low	32.6	Very low	168 Å²	168	139.8 Å²	139.8	73%	0.73	76%	0.756	S	S	*	*			cis	-152.3	160.8	22	-144.4	179.3	-178.7	-171.9	0	112.4
328	Q	29.9	Very low	32.4	Very low	142 Å²	142	142.9 Å²	142.9	66%	0.664	77%	0.771	S	S	*	*			trans	11.8	145.9	145.7	-75.6	178.8	-80.8	0	0	120.9
329	E	25.2	Very low	31.8	Very low	140 Å²	140	138.1 Å²	138.1	65%	0.654	78%	0.777	S	S	*	*			cis	-174.2	174	-6	-152.3	176.7	125.6	0	0	110.7
330	Q	28.8	Very low	31.6	Very low	161 Å²	161	143.6 Å²	143.6	75%	0.752	79%	0.79	S	S	*	*			trans	78	138.5	158.4	-62.2	-178.7	12.7	0	0	122.5
331	S	28.5	Very low	31	Very low	117 Å²	117	145.5 Å²	145.5	82%	0.818	79%	0.792	S	S	*	*			trans	84	149.1	156	79.8	0	0	0	0	121.1
332	S	24.1	Very low	31.4	Very low	116 Å²	116	147.2 Å²	147.2	81%	0.811	79%	0.79	S	S	*	*			trans	-166.6	176.7	-179	-54.3	0	0	0	0	106.3
333	P	39.9	Very low	31.1	Very low	112 Å²	112	148.4 Å²	148.4	73%	0.727	79%	0.793	S	S	*	*			cis	-134.2	-149.9	0.3	38.9	-17	0	0	0	112.7
334	Q	31.4	Very low	30.7	Very low	169 Å²	169	145.2 Å²	145.2	79%	0.79	79%	0.79	S	S	*	*			trans	86.8	151.2	168.6	-58.5	-158.8	30	0	0	118.2
335	R	29	Very low	30.5	Very low	200 Å²	200	146.1 Å²	146.1	76%	0.755	79%	0.791	S	S	*	*			cis	-172.6	131.5	-24.3	175.6	177.1	-173.9	-154.4	1.1	112.4
336	L	27.3	Very low	30.4	Very low	137 Å²	137	143.2 Å²	143.2	72%	0.717	79%	0.79	S	S	*	*			trans	67.5	163.4	157.9	-76.3	171	0	0	0	121.8
337	Q	32.8	Very low	30.4	Very low	181 Å²	181	137.2 Å²	137.2	85%	0.846	79%	0.789	S	S	*	*			trans	76.5	148.8	169.4	-52.9	-168.9	36.6	0	0	117.7
338	S	27.7	Very low	30.2	Very low	111 Å²	111	133.6 Å²	133.6	78%	0.776	79%	0.79	S	S	*	*				171.4	126.4	-55.2	48.2	0	0	0	0	109.3
339	G	30.6	Very low	30.1	Very low	76 Å²	76	131.6 Å²	131.6	78%	0.784	80%	0.798	S	S	*	*			trans	176.6	102.5	175.5	0	0	0	0	0	119.2
340	K	31.8	Very low	30.4	Very low	218 Å²	218	129.8 Å²	129.8	95%	0.948	81%	0.807	S	S	*	*			trans	48.3	139.2	144.1	-64.2	-176.5	176.9	-179.7	0	122.9
341	M	25.9	Very low	30.4	Very low	175 Å²	175	126.9 Å²	126.9	86%	0.862	81%	0.811	S	S	*	*			trans	-98.1	-162.1	159.4	-61.2	-157	-51.8	0	0	110.3
342	P	44.6	Very low	30.3	Very low	106 Å²	106	126.2 Å²	126.2	69%	0.688	81%	0.812	S	S	*	*				-129	176.7	-66.2	35.6	-20.1	0	0	0	113.3
343	T	32.2	Very low	30.6	Very low	151 Å²	151	125.4 Å²	125.4	93%	0.926	81%	0.812	S	S	*	*			trans	-150.3	166.6	154.5	34.1	0	0	0	0	111
344	A	27.9	Very low	30.1	Very low	107 Å²	107	125 Å²	125	88%	0.884	82%	0.819	S	S	*	*			trans	-147.4	163.3	-169	0	0	0	0	0	114.8
345	A	30	Very low	30.1	Very low	92 Å²	92	121.1 Å²	121.1	76%	0.76	82%	0.815	S	S	*	*			trans	-154.1	139.1	164	0	0	0	0	0	106.9
346	A	27.7	Very low	30.2	Very low	102 Å²	102	119.7 Å²	119.7	84%	0.843	82%	0.823	S	S	*	*			cis	69.8	125.4	27.5	0	0	0	0	0	113.8
347	A	30	Very low	30.4	Very low	101 Å²	101	117 Å²	117	84%	0.835	83%	0.829	S	S	*	*			cis	-148.1	-170.4	-9.6	0	0	0	0	0	107.5
348	A	29.5	Very low	30.1	Very low	91 Å²	91	113.9 Å²	113.9	75%	0.752	83%	0.826	S	S	*	*			cis	-154.3	156	11.4	0	0	0	0	0	107.1
349	A	27.9	Very low	30.5	Very low	101 Å²	101	115.1 Å²	115.1	84%	0.835	83%	0.829	S	S	*	*				85.2	136.7	56.1	0	0	0	0	0	117.4
350	A	30.3	Very low	30.5	Very low	102 Å²	102	119.2 Å²	119.2	84%	0.843	83%	0.833	S	S	*	*			trans	77.4	93.2	161.4	0	0	0	0	0	122.8
351	A	28.8	Very low	30.6	Very low	100 Å²	100	114.1 Å²	114.1	83%	0.826	82%	0.824	S	S	*	*				45.5	119	119.6	0	0	0	0	0	124.8
352	A	27.7	Very low	30.9	Very low	102 Å²	102	114 Å²	114	84%	0.843	82%	0.821	S	S	*	*				87	144.3	123.7	0	0	0	0	0	124
353	A	29.8	Very low	30.3	Very low	99 Å²	99	113.4 Å²	113.4	82%	0.818	82%	0.816	S	S	*	*			trans	91.1	101.8	153.6	0	0	0	0	0	122.3
354	A	28.8	Very low	30	Very low	105 Å²	105	110.9 Å²	110.9	87%	0.868	81%	0.811	S	S	*	*			trans	81.6	157.5	131.9	0	0	0	0	0	123
355	A	31.4	Very low	30	Very low	86 Å²	86	115.1 Å²	115.1	71%	0.711	81%	0.805	S	S	*	*			trans	76.5	111.9	167.6	0	0	0	0	0	120.5
356	D	31.4	Very low	29.9	Very low	170 Å²	170	118.9 Å²	118.9	91%	0.909	81%	0.81	S	S	*	*			trans	53.8	144.3	135.7	-52.2	-22.5	0	0	0	123.4
357	G	31.1	Very low	29.9	Very low	82 Å²	82	121.1 Å²	121.1	85%	0.845	81%	0.807	S	S	*	*			trans	141.1	103.7	167.5	0	0	0	0	0	114.6
358	S	27.8	Very low	30.1	Very low	114 Å²	114	121.6 Å²	121.6	80%	0.797	80%	0.802	S	S	*	*			trans	-98.8	134.4	-179.5	59.5	0	0	0	0	113.8
359	T	35.8	Very low	30.2	Very low	137 Å²	137	122.6 Å²	122.6	84%	0.84	80%	0.801	S	S	*	*			trans	-161.1	108.2	148.9	8.4	0	0	0	0	115.3
360	L	31.1	Very low	30.2	Very low	163 Å²	163	127.9 Å²	127.9	85%	0.853	81%	0.805	S	S	*	*			trans	29.4	147.1	137.4	-63.8	168.2	0	0	0	124.1
361	S	33.3	Very low	30.3	Very low	110 Å²	110	131.3 Å²	131.3	77%	0.769	81%	0.808	S	S	*	*			trans	79.9	142.5	162.1	82.3	0	0	0	0	117.7
362	H	32.8	Very low	30.5	Very low	172 Å²	172	135.3 Å²	135.3	80%	0.796	81%	0.807	S	S	*	*			cis	-144.6	115.7	-12.9	-135.7	-40.9	0	0	0	113
363	T	31.4	Very low	30.7	Very low	95 Å²	95	137.7 Å²	137.7	58%	0.583	81%	0.806	S	S	*	*			trans	25.1	122.4	148.2	-40.2	0	0	0	0	121.7	Y365	T363-Y365 HydrophobicContact CG2-CD2 3.28Å; T363-Y365 HydrophobicContact CG2-CE2 3.66Å; T363-Y365 HydrophobicContact CG2-CG 4.1Å
364	A	24.7	Very low	30.8	Very low	98 Å²	98	137.1 Å²	137.1	81%	0.81	80%	0.801	S	S	*	*			trans	-124.8	141.5	140.2	0	0	0	0	0	109.1
365	Y	27.8	Very low	31	Very low	195 Å²	195	137 Å²	137	77%	0.765	79%	0.793	S	S	*	*			trans	-144	121.2	179.9	-85.8	-53.2	0	0	0	113	T363	T363-Y365 HydrophobicContact CG2-CD2 3.28Å; T363-Y365 HydrophobicContact CG2-CE2 3.66Å; T363-Y365 HydrophobicContact CG2-CG 4.1Å
366	I	29.2	Very low	31	Very low	171 Å²	171	141 Å²	141	88%	0.877	80%	0.802	S	S	*	*			trans	-136.6	120.9	134.3	-59.8	-175.4	0	0	0	107.7
367	L	27.7	Very low	31.5	Very low	149 Å²	149	138 Å²	138	78%	0.78	79%	0.792	S	S	*	*			trans	-151.9	145.2	167.5	-102.8	172.8	0	0	0	106.5
368	P	33.4	Very low	31.5	Very low	111 Å²	111	139.7 Å²	139.7	72%	0.721	79%	0.791	S	S	*	*				-153.3	-171.1	110.3	40.5	-21.8	0	0	0	112.8
369	P	32.8	Very low	31.7	Very low	113 Å²	113	138.5 Å²	138.5	73%	0.734	79%	0.788	S	S	*	*				-134.2	165.7	-61.3	39.2	-25.4	0	0	0	112.6
370	K	27.7	Very low	31.5	Very low	211 Å²	211	138.7 Å²	138.7	92%	0.917	78%	0.779	S	S	*	*			trans	-141.2	157.4	152	-81	-156.4	176.4	-177.2	0	113.3
371	L	31.5	Very low	31.5	Very low	174 Å²	174	139.9 Å²	139.9	91%	0.911	77%	0.772	S	S	*	*			trans	-51.5	158.5	-168.7	-63.1	157.1	0	0	0	116.4
372	K	33.1	Very low	31.4	Very low	184 Å²	184	142.9 Å²	142.9	80%	0.8	78%	0.776	S	S	*	*			trans	-87.2	136.3	178.4	-73.5	-176.8	176.6	-179.9	0	113.4
373	N	31	Very low	31.2	Very low	153 Å²	153	138.9 Å²	138.9	82%	0.818	77%	0.773	S	S	*	*			trans	63.5	148.2	139.2	-54.9	8.6	0	0	0	118.8
374	A	33.4	Very low	31.3	Very low	86 Å²	86	140.5 Å²	140.5	71%	0.711	78%	0.783	S	S	*	*			cis	-147	161.1	7.7	0	0	0	0	0	114.1
375	S	31.9	Very low	31.5	Very low	102 Å²	102	140.8 Å²	140.8	71%	0.713	78%	0.779	S	S	*	*			trans	39	101	150.4	55.8	0	0	0	0	119.9
376	L	31.8	Very low	31.6	Very low	171 Å²	171	143 Å²	143	90%	0.895	79%	0.786	S	S	*	*				74.6	148.1	75.1	-69.6	175	0	0	0	116.3
377	P	42.3	Very low	31.6	Very low	107 Å²	107	139.7 Å²	139.7	70%	0.695	78%	0.778	S	S	*	*			trans	-139.2	-172.1	-135.4	45.1	-28.2	0	0	0	116.2
378	S	31.2	Very low	31.9	Very low	118 Å²	118	138.8 Å²	138.8	83%	0.825	77%	0.774	S	S	*	*			trans	-167.3	152.5	134.9	-87	0	0	0	0	115.8
379	A	31.9	Very low	31.8	Very low	88 Å²	88	143.1 Å²	143.1	73%	0.727	78%	0.776	S	S	*	*			trans	-6	157.6	148.8	0	0	0	0	0	120.9
380	E	31.2	Very low	31.6	Very low	141 Å²	141	145 Å²	145	66%	0.659	78%	0.779	S	S	*	*			cis	-160.8	164.1	4.8	-127.2	-168.6	147.2	0	0	113.8
381	R	31.4	Very low	31.6	Very low	188 Å²	188	139.7 Å²	139.7	71%	0.709	77%	0.769	S	S	*	*			trans	61.7	122.7	150.9	-68.8	178.6	-161.2	-178.5	17.6	124.4
382	M	31	Very low	31.6	Very low	173 Å²	173	136.3 Å²	136.3	85%	0.852	76%	0.76	S	S	*	*				73.9	100.5	129.2	-67	-175.2	172	0	0	123.7
383	A	28.5	Very low	31.4	Very low	89 Å²	89	132 Å²	132	74%	0.736	75%	0.752	S	S	*	*				87.5	155.6	112.8	0	0	0	0	0	123.4
384	T	32.7	Very low	31.3	Very low	129 Å²	129	136 Å²	136	79%	0.791	76%	0.756	S	S	*	*			trans	87	86	164.9	65.2	0	0	0	0	121.6
385	S	28.8	Very low	31.3	Very low	104 Å²	104	138 Å²	138	73%	0.727	76%	0.759	S	S	*	*				49.6	119.1	125.1	63.8	0	0	0	0	123.7
386	R	30.8	Very low	31.2	Very low	240 Å²	240	139.6 Å²	139.6	91%	0.906	76%	0.76	S	S	*	*				178.5	119.6	119.9	-94.5	161.6	-178.4	-168.7	-0.2	107.3
387	S	29.5	Very low	31.1	Very low	102 Å²	102	136 Å²	136	71%	0.713	75%	0.749	S	S	*	*				72.9	126.3	68.8	-158.4	0	0	0	0	114.1
388	D	33.6	Very low	30.6	Very low	130 Å²	130	143.1 Å²	143.1	70%	0.695	76%	0.762	S	S	*	*			trans	108.4	140.8	160.3	-63.6	3.3	0	0	0	117.2
389	R	30.8	Very low	30.4	Very low	203 Å²	203	142 Å²	142	77%	0.766	75%	0.754	S	S	*	*			cis	-179.1	131.1	-30	-116.2	173.3	-175.5	-137.9	2.5	107.8
390	L	29	Very low	30.3	Very low	152 Å²	152	147.8 Å²	147.8	80%	0.796	76%	0.758	S	S	*	*			trans	62.1	169.6	152.4	-59.6	166.7	0	0	0	116.9
391	S	28.7	Very low	30.3	Very low	100 Å²	100	144 Å²	144	70%	0.699	76%	0.757	S	S	*	*			cis	-169.2	160	-36.1	56.6	0	0	0	0	112.1
392	S	30.6	Very low	30.3	Very low	103 Å²	103	141.4 Å²	141.4	72%	0.72	75%	0.753	S	S	*	*			trans	89.8	109	144.8	-138.7	0	0	0	0	123.2
393	S	29.7	Very low	30.2	Very low	92 Å²	92	143.2 Å²	143.2	64%	0.643	75%	0.752	S	S	*	*				59.7	127.4	121.9	71.5	0	0	0	0	125.9
394	R	29.1	Very low	30.3	Very low	239 Å²	239	148.3 Å²	148.3	90%	0.902	76%	0.757	S	S	*	*			trans	67.1	146.5	141.2	-63.6	176.4	-179.8	176.2	-0.6	116.9
395	V	32.8	Very low	30.1	Very low	127 Å²	127	148.2 Å²	148.2	77%	0.77	76%	0.756	S	S	*	*				-158.8	161.5	62.9	158.4	0	0	0	0	112.6
396	D	28.8	Very low	30.5	Very low	136 Å²	136	148.2 Å²	148.2	73%	0.727	75%	0.754	S	S	*	*			trans	-23.9	171.2	160.8	-67.7	-91.8	0	0	0	121.4
397	S	31.4	Very low	30.3	Very low	95 Å²	95	141.8 Å²	141.8	66%	0.664	75%	0.746	S	S	*	*			cis	-179.3	151.7	-24	-88.6	0	0	0	0	108.6
398	R	30.7	Very low	30.4	Very low	257 Å²	257	142.9 Å²	142.9	97%	0.97	75%	0.754	S	S	*	*			trans	-167.5	163.6	159.4	-110.4	163.6	-163.6	-156.7	2.4	112.9
399	S	28	Very low	30.1	Very low	95 Å²	95	144.7 Å²	144.7	66%	0.664	76%	0.762	S	S	*	*			trans	-151.4	172.9	-155.2	53.6	0	0	0	0	116
400	Y	30.2	Very low	30.4	Very low	208 Å²	208	139.8 Å²	139.8	82%	0.816	76%	0.757	S	S	*	*			trans	71.2	142.7	176.3	-65.3	-83.4	0	0	0	117.6
401	G	31.3	Very low	30.5	Very low	62 Å²	62	139.5 Å²	139.5	64%	0.639	76%	0.756	S	S	*	*			cis	-179.3	175.5	-5.7	0	0	0	0	0	115.6
402	H	31.3	Very low	30.5	Very low	134 Å²	134	139.4 Å²	139.4	62%	0.62	76%	0.755	S	S	*	*			trans	8.2	141.1	155.5	-47	-71.6	0	0	0	120.8
403	Y	28.8	Very low	30.7	Very low	210 Å²	210	141.2 Å²	141.2	82%	0.824	76%	0.756	S	S	*	*			cis	-136.9	-143.7	5.9	-65	-80.2	0	0	0	109.4
404	K	30.4	Very low	30.7	Very low	196 Å²	196	143.8 Å²	143.8	85%	0.852	76%	0.762	S	S	*	*			cis	-157.2	171.9	-0.5	-147.1	176.9	178.2	-179.1	0	111.5
405	V	27.5	Very low	30.7	Very low	127 Å²	127	138.5 Å²	138.5	77%	0.77	76%	0.757	S	S	*	*			trans	-155.1	157.4	-166.5	163.2	0	0	0	0	107.9
406	P	37.1	Very low	30.6	Very low	105 Å²	105	136.1 Å²	136.1	68%	0.682	75%	0.75	S	S	*	*			cis	-132.1	176.1	2.7	35.4	-15.6	0	0	0	118.1
407	S	27.9	Very low	30.6	Very low	105 Å²	105	137.4 Å²	137.4	73%	0.734	76%	0.757	S	S	*	*			trans	72.1	144.1	138.1	62.1	0	0	0	0	125.3
408	S	30.3	Very low	30.6	Very low	125 Å²	125	138.8 Å²	138.8	87%	0.874	76%	0.764	S	S	*	*			trans	99.7	144.3	156.8	71	0	0	0	0	120.7
409	L	27.7	Very low	30.5	Very low	167 Å²	167	130.7 Å²	130.7	87%	0.874	75%	0.752	S	S	*	*			trans	-92.7	-178.5	-171.8	-88.4	156.8	0	0	0	111
410	P	38.2	Very low	30.6	Very low	100 Å²	100	133.8 Å²	133.8	65%	0.649	76%	0.76	S	S	*	*			cis	-153.6	-173.5	29.3	46.8	-25	0	0	0	119.8
411	D	29.6	Very low	30.4	Very low	146 Å²	146	132.8 Å²	132.8	78%	0.781	76%	0.756	S	S	*	*			trans	60.8	151.1	144	-66.8	-18.6	0	0	0	123.3
412	S	29.8	Very low	30	Very low	98 Å²	98	134.9 Å²	134.9	69%	0.685	76%	0.761	S	S	*	*			cis	-170.9	-172.1	-16.4	56.8	0	0	0	0	111.8
413	I	33.4	Very low	30.3	Very low	142 Å²	142	133.5 Å²	133.5	73%	0.728	76%	0.764	S	S	*	*			trans	116	102.5	158.5	-61.3	171.8	0	0	0	118.2
414	N	30.1	Very low	30.1	Very low	145 Å²	145	134.2 Å²	134.2	78%	0.775	77%	0.765	S	S	*	*			trans	58	149.5	137.1	-62.6	-4.8	0	0	0	122.2
415	T	30.1	Very low	29.9	Very low	129 Å²	129	130.7 Å²	130.7	79%	0.791	76%	0.76	S	S	*	*			cis	-160	167.4	3.7	-120.7	0	0	0	0	113.4
416	A	31.1	Very low	29.8	Very low	77 Å²	77	130.5 Å²	130.5	64%	0.636	76%	0.759	S	S	*	*			trans	94.4	105.8	158.5	0	0	0	0	0	122.2
417	N	28	Very low	29.3	Very low	162 Å²	162	131.9 Å²	131.9	87%	0.866	77%	0.765	S	S	*	*			trans	79.8	125.9	138.3	-65.7	-2.6	0	0	0	122.6
418	P	31.7	Very low	29.2	Very low	125 Å²	125	131.4 Å²	131.4	81%	0.812	76%	0.762	S	S	*	*			trans	-119.1	165.8	-179.3	43.1	-33.7	0	0	0	115.5
419	A	28.9	Very low	29	Very low	86 Å²	86	132.2 Å²	132.2	71%	0.711	76%	0.756	S	S	*	*			trans	-168.3	116.2	154	0	0	0	0	0	114.3
420	L	28.7	Very low	29.2	Very low	160 Å²	160	129.3 Å²	129.3	84%	0.838	75%	0.75	S	S	*	*			trans	58.1	142.3	142.8	-41.7	178.5	0	0	0	119.9
421	Y	27.8	Very low	28.8	Very low	188 Å²	188	133.2 Å²	133.2	74%	0.737	76%	0.759	S	S	*	*			cis	-157	158	-4.7	-145.4	-110.7	0	0	0	113.7
422	S	22.5	Very low	28.7	Very low	106 Å²	106	130.7 Å²	130.7	74%	0.741	76%	0.759	S	S	*	*			trans	-156.7	161.7	161.1	-111.2	0	0	0	0	109.3
423	P	36.4	Very low	28.6	Very low	104 Å²	104	131.2 Å²	131.2	68%	0.675	76%	0.761	S	S	*	*				-122.5	148.2	-116.7	39.2	-31.4	0	0	0	117.3
424	R	25.1	Very low	28.4	Very low	226 Å²	226	130.8 Å²	130.8	85%	0.853	77%	0.766	S	S	*	*			trans	178	139.3	134.2	-101.2	164.7	178.7	-177.8	-0.6	114.4
425	T	26.2	Very low	28.4	Very low	121 Å²	121	128.3 Å²	128.3	74%	0.742	76%	0.759	S	S	*	*			trans	5.5	146.7	145.4	48.8	0	0	0	0	120.1
426	V	25.6	Very low	28.3	Very low	124 Å²	124	131.9 Å²	131.9	75%	0.752	76%	0.76	S	S	*	*			cis	-153.3	128.3	40.8	177.5	0	0	0	0	110.1
427	V	26.4	Very low	28.4	Very low	133 Å²	133	135.2 Å²	135.2	81%	0.806	76%	0.762	S	S	*	*				45.6	128.2	106.8	-163.4	0	0	0	0	119
428	S	25.2	Very low	28.4	Very low	96 Å²	96	135.6 Å²	135.6	67%	0.671	76%	0.756	S	S	*	*			trans	-172.2	148.1	156	-106.3	0	0	0	0	107
429	D	27.3	Very low	28.5	Very low	141 Å²	141	133.2 Å²	133.2	75%	0.754	74%	0.743	S	S	*	*			cis	-130.3	-154	-10.1	-72.7	-50.5	0	0	0	107.5
430	S	31.4	Very low	28.5	Very low	106 Å²	106	137.6 Å²	137.6	74%	0.741	75%	0.749	S	S	*	*			cis	-151.3	-176.2	9.7	-50.9	0	0	0	0	108.3
431	E	29.9	Very low	28.6	Very low	182 Å²	182	141.6 Å²	141.6	85%	0.85	75%	0.753	S	S	*	*			cis	-149	139.1	4.5	-158.2	167.1	-95.2	0	0	109.8
432	A	28	Very low	28.5	Very low	93 Å²	93	138.2 Å²	138.2	77%	0.769	76%	0.755	S	S	*	*			trans	55.2	144.9	163.5	0	0	0	0	0	120.6
433	C	27.6	Very low	28.9	Very low	109 Å²	109	141.6 Å²	141.6	74%	0.736	76%	0.764	S	S	*	*			cis	-157.2	136.9	0.7	-138	0	0	0	0	112.5
434	T	28.1	Very low	28.5	Very low	134 Å²	134	142 Å²	142	82%	0.822	77%	0.769	S	S	*	*			trans	42.7	152.7	145.5	59.3	0	0	0	0	122.3
435	S	29.4	Very low	28.7	Very low	92 Å²	92	136 Å²	136	64%	0.643	77%	0.768	S	S	*	*			cis	-160.5	142.1	11.3	107.3	0	0	0	0	113.6
436	Y	29.6	Very low	28.9	Very low	205 Å²	205	141.5 Å²	141.5	80%	0.804	78%	0.775	S	S	*	*			trans	64.3	155.7	155.6	-79	-106.8	0	0	0	118.6
437	E	32.8	Very low	29.3	Very low	147 Å²	147	143.8 Å²	143.8	69%	0.687	78%	0.78	S	S	*	*			cis	-166.3	-165.7	-23.6	-134.1	-162.8	165.6	0	0	108.3
438	F	28.6	Very low	29.9	Very low	169 Å²	169	143.4 Å²	143.4	74%	0.741	78%	0.78	S	S	*	*			cis	-150.5	-138.8	5.8	-174.2	-138	0	0	0	111.8
439	S	33	Very low	30.2	Very low	75 Å²	75	145.9 Å²	145.9	52%	0.524	79%	0.791	S	S	.	*			trans	-86.6	151.4	-170.7	-71.8	0	0	0	0	115
440	Q	29.4	Very low	30.3	Very low	179 Å²	179	142.7 Å²	142.7	84%	0.836	79%	0.792	S	S	*	*			cis	94.5	123.6	31.8	-82.9	-158.7	15	0	0	116.7
441	R	29.7	Very low	30.2	Very low	244 Å²	244	149.7 Å²	149.7	92%	0.921	80%	0.802	S	S	*	*				-173.3	156.1	122.7	-104.9	175.8	-173.9	-177.3	3.1	113.1
442	C	27.4	Very low	30.3	Very low	117 Å²	117	148.7 Å²	148.7	79%	0.791	80%	0.801	S	S	*	*			trans	-137.5	162.7	178.1	-59.4	0	0	0	0	110.4
443	L	30.7	Very low	30.8	Very low	176 Å²	176	149.8 Å²	149.8	92%	0.921	80%	0.801	S	S	*	*				169.5	179.1	127.9	-90.4	166.8	0	0	0	113
444	S	26.5	Very low	30.8	Very low	113 Å²	113	151.6 Å²	151.6	79%	0.79	80%	0.803	S	S	*	*			trans	-138.2	158.3	-157.5	58.7	0	0	0	0	115.6
445	A	31	Very low	30.9	Very low	100 Å²	100	153.5 Å²	153.5	83%	0.826	80%	0.803	S	S	*	*			trans	177.6	161.4	159.3	0	0	0	0	0	110.3
446	R	29.4	Very low	30.7	Very low	237 Å²	237	152.3 Å²	152.3	89%	0.894	81%	0.805	S	S	*	*			cis	-169.5	147.1	-31.9	-171.5	178	-171.3	177.9	3.6	107.7
447	M	33.3	Very low	30.7	Very low	172 Å²	172	151.9 Å²	151.9	85%	0.847	81%	0.807	S	S	*	*			trans	-83.4	157.7	174.7	-71.6	-72.6	-159.2	0	0	113.3
448	P	39.5	Very low	30.4	Very low	124 Å²	124	151.5 Å²	151.5	81%	0.805	82%	0.815	S	S	*	*			trans	-134.3	176.8	134	38.2	-26.6	0	0	0	113.8
449	T	32.3	Very low	30.5	Very low	148 Å²	148	150 Å²	150	91%	0.908	82%	0.819	S	S	*	*			trans	-124.4	156.5	-168.6	50	0	0	0	0	113.8
450	G	28.3	Very low	30	Very low	74 Å²	74	156.1 Å²	156.1	76%	0.763	83%	0.831	S	S	*	*			trans	177.3	105.1	172	0	0	0	0	0	118.1
451	R	29.3	Very low	29.8	Very low	254 Å²	254	157.6 Å²	157.6	96%	0.958	83%	0.83	S	S	*	*			trans	36.3	139.7	151.5	-58.3	-170.5	-177.1	-148.8	1.7	123.6
452	L	33.3	Very low	29.9	Very low	160 Å²	160	151.5 Å²	151.5	84%	0.838	82%	0.822	S	S	*	*			trans	-73	164.4	156.3	-88.1	164	0	0	0	111.4
453	P	36.7	Very low	29.8	Very low	117 Å²	117	157.5 Å²	157.5	76%	0.76	83%	0.828	S	S	*	*			cis	-154.4	170.1	49.4	45.7	-24.9	0	0	0	121.4
454	D	28.1	Very low	29.9	Very low	147 Å²	147	155 Å²	155	79%	0.786	82%	0.823	S	S	*	*			trans	64.2	161.2	145.6	-119.7	-26.2	0	0	0	126.2
455	E	29.7	Very low	29.9	Very low	174 Å²	174	156.9 Å²	156.9	81%	0.813	82%	0.824	S	S	*	*			trans	59.9	116.5	163.7	-77.1	-97.8	107.4	0	0	118.9
456	G	25.1	Very low	29.7	Very low	66 Å²	66	157.5 Å²	157.5	68%	0.68	82%	0.817	S	S	*	*			trans	-87.2	175.7	-171.1	0	0	0	0	0	117.3
457	K	30.7	Very low	29.7	Very low	197 Å²	197	157.5 Å²	157.5	86%	0.857	82%	0.817	S	S	*	*			trans	-158.6	150	148.4	-108.3	137.1	-167.2	154.9	0	112.8
458	T	25.8	Very low	29.2	Very low	138 Å²	138	157.7 Å²	157.7	85%	0.847	82%	0.816	S	S	*	*			trans	-61.3	133.5	172.3	49.6	0	0	0	0	112.3
459	V	31	Very low	28.7	Very low	138 Å²	138	157.5 Å²	157.5	84%	0.836	82%	0.815	S	S	*	*			trans	-128.5	134.5	162.4	179.4	0	0	0	0	109.1
460	R	23.2	Very low	28.4	Very low	204 Å²	204	157 Å²	157	77%	0.77	81%	0.811	S	S	*	*			trans	-101.2	-178.8	176	-81.2	-177.5	170.3	179.5	-1.6	110.4
461	Y	24.1	Very low	28.5	Very low	209 Å²	209	160 Å²	160	82%	0.82	81%	0.814	S	S	*	*			trans	86.5	154.9	162.3	-48.5	-69.9	0	0	0	116.7
462	P	32.7	Very low	28.5	Very low	117 Å²	117	151.1 Å²	151.1	76%	0.76	80%	0.802	S	S	*	*			cis	-123.3	159.9	-16	24.1	-3.8	0	0	0	114.1
463	R	24.9	Very low	28.1	Very low	242 Å²	242	148.7 Å²	148.7	91%	0.913	80%	0.798	S	S	*	*			trans	-86.1	132.5	155.5	-75.9	-177.4	176.3	176.2	-2.3	109.3
464	P	32.2	Very low	27.8	Very low	125 Å²	125	152.1 Å²	152.1	81%	0.812	81%	0.807	S	S	*	*			trans	-84	162.9	146.7	34.2	-29.8	0	0	0	110.4
465	N	26.4	Very low	27.7	Very low	151 Å²	151	154.5 Å²	154.5	81%	0.807	81%	0.81	S	S	*	*			trans	-140.8	166.4	178.4	-168.1	13.6	0	0	0	108.5
466	V	26.6	Very low	27.4	Very low	114 Å²	114	151 Å²	151	69%	0.691	81%	0.805	S	S	*	*			trans	72.8	136.4	-178.8	-169.1	0	0	0	0	111.4
467	R	30.1	Very low	27.4	Very low	237 Å²	237	155.9 Å²	155.9	89%	0.894	82%	0.816	S	S	*	*			cis	-148	159.5	28.3	-140.7	153.5	-146.8	166.4	3.3	111.5
468	E	24	Very low	27.1	Very low	176 Å²	176	151.2 Å²	151.2	82%	0.822	81%	0.808	S	S	*	*			trans	-75.6	163	174.6	-59	174.3	124.9	0	0	113
469	P	28.2	Very low	27.2	Very low	120 Å²	120	152.8 Å²	152.8	78%	0.779	81%	0.81	S	S	*	*				-131.8	155.1	116.5	37.9	-31.7	0	0	0	114.6
470	V	26.4	Very low	27	Very low	136 Å²	136	151.6 Å²	151.6	82%	0.824	81%	0.805	S	S	*	*			trans	-69.3	130.8	-175.2	178.6	0	0	0	0	112.7
471	V	30.7	Very low	27.4	Very low	137 Å²	137	153.7 Å²	153.7	83%	0.83	81%	0.813	S	S	*	*			trans	-129.8	137.1	164.7	-179.6	0	0	0	0	109.5
472	G	28.5	Very low	27.6	Very low	68 Å²	68	151.6 Å²	151.6	70%	0.701	82%	0.815	S	S	*	*			trans	-78.8	145.2	-168.4	0	0	0	0	0	115.8	M474	G472-M474 PolarHBondContact O-N 3.37Å
473	S	25.7	Very low	27.2	Very low	109 Å²	109	154.9 Å²	154.9	76%	0.762	82%	0.82	S	S	*	*			trans	-29	113.5	167.5	156.2	0	0	0	0	116
474	M	28.9	Very low	27.4	Very low	190 Å²	190	150.9 Å²	150.9	94%	0.936	82%	0.817	S	S	*	*			trans	-138.7	157.3	133.5	-81.1	-139.6	164.1	0	0	110.1	G472	G472-M474 PolarHBondContact O-N 3.37Å
475	K	26.1	Very low	27	Very low	196 Å²	196	155.7 Å²	155.7	85%	0.852	82%	0.819	S	S	*	*			trans	-96.6	134.2	-156.4	-59.1	170.7	-176.9	175.5	0	112.3
476	S	24.9	Very low	27	Very low	102 Å²	102	159.8 Å²	159.8	71%	0.713	82%	0.823	S	S	*	*			trans	-102.5	133.8	163.2	46.8	0	0	0	0	110.3
477	N	23.8	Very low	26.8	Very low	168 Å²	168	160.9 Å²	160.9	90%	0.898	83%	0.83	S	S	*	*			trans	-103.9	85.8	168.3	-88.9	1.2	0	0	0	108.8
478	S	25.8	Very low	26.6	Very low	99 Å²	99	156.7 Å²	156.7	69%	0.692	82%	0.824	S	S	*	*			trans	-135.3	88	175.8	-49.6	0	0	0	0	108.2
479	L	28	Very low	26.5	Very low	170 Å²	170	158.7 Å²	158.7	89%	0.89	82%	0.824	S	S	*	*			trans	-91.7	118.8	174.7	-78.6	178	0	0	0	110
480	P	27	Very low	26.4	Very low	114 Å²	114	163.1 Å²	163.1	74%	0.74	83%	0.825	S	S	*	*			trans	-76.7	147.9	177.1	32.4	-34.6	0	0	0	110.8
481	R	30	Very low	26.2	Very low	247 Å²	247	161 Å²	161	93%	0.932	82%	0.816	S	S	*	*			trans	-124.3	83.3	160.6	-74.9	-170.7	174.4	172	0.3	109.7
482	L	28.5	Very low	26.1	Very low	166 Å²	166	159.1 Å²	159.1	87%	0.869	81%	0.809	S	S	*	*			trans	-63.3	136.4	167.3	-151	85.8	0	0	0	109
483	H	25.1	Very low	25.8	Very low	186 Å²	186	164.7 Å²	164.7	86%	0.861	82%	0.817	S	S	*	*			trans	-64.1	140.6	163.8	-85.5	-34.7	0	0	0	110.3
484	N	28	Very low	26	Very low	157 Å²	157	167 Å²	167	84%	0.84	82%	0.82	S	S	*	*			trans	-147.9	145.3	139	-152.2	-13	0	0	0	111.3
485	R	23.6	Very low	26	Very low	226 Å²	226	163.9 Å²	163.9	85%	0.853	81%	0.811	S	S	*	*			trans	-78.3	136.3	172	-68.9	172.4	166.7	179.3	-6	109.2
486	R	27.3	Very low	26	Very low	238 Å²	238	160.4 Å²	160.4	90%	0.898	81%	0.807	S	S	*	*			trans	-164.5	130.6	135.7	-108.8	158.1	-166.9	-172.2	3	113
487	T	22.7	Very low	26.3	Very low	137 Å²	137	164.6 Å²	164.6	84%	0.84	81%	0.812	S	S	*	*			trans	-50.1	128.8	168.2	44	0	0	0	0	113.5
488	I	26	Very low	26.6	Very low	149 Å²	149	161.9 Å²	161.9	76%	0.764	80%	0.802	S	S	*	*			trans	-135.1	146.4	151.9	-66.6	-172.4	0	0	0	107.7
489	R	22.5	Very low	26.7	Very low	218 Å²	218	164 Å²	164	82%	0.823	81%	0.805	S	S	*	*			trans	-137.2	114.4	-167.6	174	-166.7	-170.2	169.4	4.2	109.7
490	W	25.4	Very low	26.8	Very low	213 Å²	213	164.5 Å²	164.5	81%	0.807	80%	0.803	S	S	*	*			trans	-148.1	136.4	168	-51.4	101.1	0	0	0	106.3
491	S	22.6	Very low	26.9	Very low	91 Å²	91	162.4 Å²	162.4	64%	0.636	80%	0.802	S	S	*	*			cis	52.2	79.9	3.1	70	0	0	0	0	115.1
492	S	27.8	Very low	26.8	Very low	97 Å²	97	160.5 Å²	160.5	68%	0.678	80%	0.801	S	S	*	*			trans	-114.8	89.1	154.3	-162.7	0	0	0	0	108.8
493	E	22.6	Very low	27.2	Very low	186 Å²	186	157.8 Å²	157.8	87%	0.869	79%	0.793	S	S	*	*			trans	-56.8	145.1	150	-170.6	167.3	-145.4	0	0	108
494	L	29.2	Very low	27.6	Very low	156 Å²	156	154.3 Å²	154.3	82%	0.817	79%	0.787	S	S	*	*			trans	-135.4	133	-179.1	-128	172.5	0	0	0	109.7
495	V	29.1	Very low	27.5	Very low	126 Å²	126	155.1 Å²	155.1	76%	0.764	79%	0.786	S	S	*	*			trans	-80.5	148.9	-158.1	175	0	0	0	0	113.2
496	T	25.4	Very low	27.8	Very low	123 Å²	123	150.1 Å²	150.1	76%	0.755	78%	0.781	S	S	*	*			trans	-43.1	134.6	-176.9	51.1	0	0	0	0	117.9
497	K	31.1	Very low	27.9	Very low	189 Å²	189	145.2 Å²	145.2	82%	0.822	78%	0.777	S	S	*	*			trans	-147.5	118.1	134.3	-84.3	-176.9	179.4	176.8	0	106.1
498	T	30.1	Very low	28.2	Very low	112 Å²	112	143 Å²	143	69%	0.687	77%	0.773	S	S	*	*				47.1	112.2	80.3	65.3	0	0	0	0	111.5
499	D	29.4	Very low	28.3	Very low	142 Å²	142	143.5 Å²	143.5	76%	0.759	78%	0.777	S	S	*	*			cis	-152.6	165.2	22.7	-94.6	-14.1	0	0	0	114.3
500	E	29.7	Very low	28.6	Very low	182 Å²	182	139.2 Å²	139.2	85%	0.85	78%	0.775	S	S	*	*			trans	51.2	127.2	151.1	-67.2	-60.5	104.6	0	0	122.4
501	G	29.1	Very low	28.9	Very low	70 Å²	70	134.6 Å²	134.6	72%	0.722	78%	0.775	S	S	*	*			trans	144	110.5	159.8	0	0	0	0	0	116.2
502	F	28.1	Very low	29.1	Very low	207 Å²	207	137.9 Å²	137.9	91%	0.908	79%	0.785	S	S	*	*			trans	-89.6	153.5	179.8	-89.5	-101.8	0	0	0	114.4
503	P	36.1	Very low	29.3	Very low	108 Å²	108	138.8 Å²	138.8	70%	0.701	79%	0.792	S	S	*	*			trans	-95.3	179.9	-178.8	40.4	-38	0	0	0	113.8
504	P	34.8	Very low	29.4	Very low	114 Å²	114	137.8 Å²	137.8	74%	0.74	79%	0.792	S	S	*	*				-149.8	155.6	104.6	38.4	-22.4	0	0	0	117.9
505	Q	26	Very low	29.3	Very low	173 Å²	173	133.5 Å²	133.5	81%	0.808	79%	0.786	S	S	*	*			trans	30.5	130	144	-52.8	177.8	3.4	0	0	120.2
506	T	29.1	Very low	29	Very low	122 Å²	122	134 Å²	134	75%	0.748	79%	0.789	S	S	*	*				-176.3	158.1	83.5	27.3	0	0	0	0	114.6
507	V	30.4	Very low	29	Very low	134 Å²	134	134.4 Å²	134.4	81%	0.812	79%	0.791	S	S	*	*			trans	54.2	124.4	158.2	-61.6	0	0	0	0	123.6
508	A	28.4	Very low	28.7	Very low	92 Å²	92	131 Å²	131	76%	0.76	79%	0.791	S	S	*	*				38.2	151.2	128.1	0	0	0	0	0	122.3
509	D	27.7	Very low	28.4	Very low	159 Å²	159	129.3 Å²	129.3	85%	0.85	79%	0.788	S	S	*	*			cis	-151.4	176.1	10.6	-145.5	-19.7	0	0	0	112.8
510	V	28.9	Very low	28.3	Very low	128 Å²	128	128.3 Å²	128.3	78%	0.776	79%	0.79	S	S	*	*			trans	-113.4	141.1	179.9	177.7	0	0	0	0	111.4
511	S	30.9	Very low	28.2	Very low	115 Å²	115	128.8 Å²	128.8	80%	0.804	79%	0.792	S	S	*	*			trans	-155.7	115.5	166	-153.3	0	0	0	0	114.4
512	D	27.4	Very low	28.1	Very low	161 Å²	161	133.9 Å²	133.9	86%	0.861	80%	0.801	S	S	*	*			trans	-97.6	147.7	153.3	-81.1	-52.4	0	0	0	108.7
513	S	31.3	Very low	27.9	Very low	116 Å²	116	129.4 Å²	129.4	81%	0.811	80%	0.796	S	S	*	*			trans	-159.6	141	163.8	-174.8	0	0	0	0	112.9
514	D	24.8	Very low	27.5	Very low	164 Å²	164	132.6 Å²	132.6	88%	0.877	81%	0.806	S	S	*	*			trans	-70.9	165.9	171.9	-66.6	-71	0	0	0	113.5
515	G	26.7	Very low	27	Very low	66 Å²	66	132 Å²	132	68%	0.68	80%	0.804	S	S	*	*				136.5	108	129.3	0	0	0	0	0	119.9
516	V	24.8	Very low	27.1	Very low	137 Å²	137	130 Å²	130	83%	0.83	81%	0.806	S	S	*	*			trans	62.3	116.6	136.1	-175.1	0	0	0	0	120.6
517	V	24.9	Very low	27	Very low	131 Å²	131	129.9 Å²	129.9	79%	0.794	81%	0.806	S	S	*	*			trans	22.4	108.6	141.3	-170.5	0	0	0	0	118.8
518	S	24.5	Very low	26.7	Very low	118 Å²	118	132.8 Å²	132.8	83%	0.825	81%	0.807	S	S	*	*			trans	-159	146.2	133.1	-86.9	0	0	0	0	111.4
519	A	23.3	Very low	26.6	Very low	76 Å²	76	139 Å²	139	63%	0.628	81%	0.813	S	S	*	*			trans	-147.6	104.8	171.2	0	0	0	0	0	110.1
520	P	27.7	Very low	26.4	Very low	122 Å²	122	136.1 Å²	136.1	79%	0.792	81%	0.811	S	S	*	*			trans	-87.1	144	163.8	33.7	-30	0	0	0	110.4
521	E	26.4	Very low	26.3	Very low	192 Å²	192	138.8 Å²	138.8	90%	0.897	82%	0.817	S	S	*	*			trans	-79	139	171.7	-60.9	-172.1	136.2	0	0	111.2
522	L	27.9	Very low	26	Very low	176 Å²	176	141 Å²	141	92%	0.921	82%	0.82	S	S	*	*			trans	-133.5	133.5	156.9	-78.2	179.3	0	0	0	109.8
523	S	25	Very low	25.9	Very low	114 Å²	114	142.1 Å²	142.1	80%	0.797	82%	0.817	S	S	*	*			trans	-102	114.9	-174.7	52.6	0	0	0	0	111.8
524	L	27.3	Very low	25.6	Very low	175 Å²	175	141.9 Å²	141.9	92%	0.916	82%	0.815	S	S	*	*			trans	-131.3	161.8	166.9	-74.8	178.3	0	0	0	111.8
525	S	23.7	Very low	25.6	Very low	100 Å²	100	138.9 Å²	138.9	70%	0.699	81%	0.807	S	S	*	*			trans	-81.4	161.5	-164.9	39.8	0	0	0	0	114.5
526	P	28.5	Very low	25.6	Very low	131 Å²	131	146.9 Å²	146.9	85%	0.851	82%	0.818	S	S	*	*			trans	-80.1	125.3	-172.3	30.9	-34.8	0	0	0	113.2
527	V	26.2	Very low	25.6	Very low	121 Å²	121	149.6 Å²	149.6	73%	0.733	82%	0.822	S	S	*	*			trans	-114	135.4	165.4	179.2	0	0	0	0	108.7	Y529	V527-Y529 HydrophobicContact CG1-CD2 4.35Å; V527-Y529 HydrophobicContact CG1-CE2 4.13Å
528	K	24.5	Very low	25.7	Very low	195 Å²	195	148.8 Å²	148.8	85%	0.848	82%	0.819	S	S	*	*			trans	-78.6	137.8	176.7	-59.2	173.9	-177.4	174.2	0	110
529	Y	26.4	Very low	25.8	Very low	223 Å²	223	148.4 Å²	148.4	88%	0.875	82%	0.817	S	S	*	*			trans	-137.1	159.6	150	-90.1	-71.1	0	0	0	111.3	V527	V527-Y529 HydrophobicContact CG1-CD2 4.35Å; V527-Y529 HydrophobicContact CG1-CE2 4.13Å
530	A	24.3	Very low	25.9	Very low	98 Å²	98	147.2 Å²	147.2	81%	0.81	81%	0.807	S	S	*	*			trans	-86.1	176.9	-168.4	0	0	0	0	0	112.9
531	M	25.5	Very low	26.3	Very low	184 Å²	184	147.3 Å²	147.3	91%	0.906	80%	0.795	S	S	*	*			trans	-70.3	142.5	173.9	-67.8	-173	173.7	0	0	111.9
532	D	25.4	Very low	26.8	Very low	161 Å²	161	143.4 Å²	143.4	86%	0.861	78%	0.784	S	S	*	*				-143.5	172	129.1	-149	-14.6	0	0	0	110.6
533	K	25.9	Very low	27.1	Very low	185 Å²	185	137.5 Å²	137.5	80%	0.804	75%	0.753	S	S	*	*			trans	-121	119.1	-172.1	-62.2	170.9	-177.8	168.5	0	112.4
534	S	23.1	Very low	27.6	Very low	111 Å²	111	138.9 Å²	138.9	78%	0.776	75%	0.752	S	S	*	*			trans	-170.3	137.8	139.3	52	0	0	0	0	113.1
535	S	26.1	Very low	28.6	Very low	101 Å²	101	134.3 Å²	134.3	71%	0.706	73%	0.726	S	S	*	*			trans	16.8	99	149.9	55.8	0	0	0	0	119.5
536	Y	25.7	Very low	29.9	Very low	233 Å²	233	130.2 Å²	130.2	91%	0.914	70%	0.697	S	S	*	*				-166.7	110.9	124.3	-102.8	-71.6	0	0	0	108.2
537	Q	25.5	Very low	31.1	Very low	194 Å²	194	127.3 Å²	127.3	91%	0.907	67%	0.671	S	S	*	*			trans	-104.3	117.2	171.3	-94.8	-162.1	-35.7	0	0	110.1
538	P	26.7	Very low	32.4	Very low	114 Å²	114	122.6 Å²	122.6	74%	0.74	64%	0.643	S	S	*	*			trans	-72.8	140.3	161.8	31.3	-32.2	0	0	0	109.4	A540	P538-A540 VanDerWaalsContact C-N 3.35Å; P538-A540 PolarHBondContact O-N 2.78Å
539	S	26.3	Very low	33.6	Very low	110 Å²	110	115.2 Å²	115.2	77%	0.769	61%	0.61	S	S	*	*			trans	-76.1	77.6	-173.1	59.2	0	0	0	0	113.1	K541	S539-K541 PolarHBondContact O-N 3.02Å
540	A	26.1	Very low	35	Very low	52 Å²	52	108 Å²	108	43%	0.43	60%	0.596	S	S	.	*			trans	-76.2	65.2	176	0	0	0	0	0	112.2	P538 T542 I543	P538-A540 VanDerWaalsContact C-N 3.35Å; P538-A540 PolarHBondContact O-N 2.78Å; A540-T542 PolarHBondContact O-N 3.31Å; A540-I543 HydrophobicContact CB-CD1 3.93Å; A540-I543 HydrophobicContact CB-CG1 4.34Å; A540-I543 PolarHBondContact O-N 2.88Å
541	K	34.9	Very low	36.6	Very low	123 Å²	123	108.9 Å²	108.9	54%	0.535	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-49.3	-21.8	-174.6	-73.7	-166.3	171.4	-163.9	0	115.5	S539 I543	S539-K541 PolarHBondContact O-N 3.02Å; K541-I543 PolarHBondContact O-N 2.96Å
542	T	37.8	Very low	37.9	Very low	110 Å²	110	100.9 Å²	100.9	68%	0.675	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-8.1	179.2	-11.8	0	0	0	0	114.9	A540	A540-T542 PolarHBondContact O-N 3.31Å
543	I	35.2	Very low	39.4	Very low	52 Å²	52	97 Å²	97	27%	0.267	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-41.6	-178.2	-60.5	179	0	0	0	111.3	A540 K541 E545 V546	A540-I543 HydrophobicContact CB-CD1 3.93Å; A540-I543 HydrophobicContact CB-CG1 4.34Å; A540-I543 PolarHBondContact O-N 2.88Å; K541-I543 PolarHBondContact O-N 2.96Å; I543-E545 PolarHBondContact O-N 2.89Å; I543-V546 PolarHBondContact O-N 3.34Å
544	D	35.4	Very low	40.8	Very low	144 Å²	144	91.2 Å²	91.2	77%	0.77	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-19.6	-169.7	-57.8	-49.5	0	0	0	114	V546	D544-V546 PolarHBondContact O-N 3.45Å
545	E	47.2	Very low	42	Very low	78 Å²	78	87.4 Å²	87.4	36%	0.364	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	12	176.9	-64.6	-172.9	155.4	0	0	114.3	I543 R703 I852	I543-E545 PolarHBondContact O-N 2.89Å; E545-R703 PolarHBondContact O-NH1 2.81Å; E545-R703 PolarHBondContact O-NH2 3.45Å; E545-I852 PolarHBondContact OE1-N 3.31Å; E545-I852 WeakPolarHBondContact OE2-CB 3.25Å
546	V	51.1	Low	43	Very low	15 Å²	15	85.5 Å²	85.5	9%	0.091	46%	0.46	C	S	.	.	S	Bend	trans	-118.3	86.9	-176.2	-159.5	0	0	0	0	111.1	I543 D544 S548 W736	I543-V546 PolarHBondContact O-N 3.34Å; D544-V546 PolarHBondContact O-N 3.45Å; V546-S548 PolarHBondContact O-N 3.42Å; V546-W736 PolarHBondContact O-NE1 3.2Å
547	F	53.6	Low	44.2	Very low	69 Å²	69	78.7 Å²	78.7	30%	0.303	44%	0.439	S	S	.	.			trans	-36.8	126.2	176.6	-62.2	-65.7	0	0	0	112.3	P886 D887	F547-P886 HydrophobicContact CE1-CB 3.74Å; F547-P886 HydrophobicContact CZ-CB 3.73Å; F547-D887 HydrophobicContact CE2-CB 4.21Å
548	S	52.7	Low	45.1	Very low	22 Å²	22	71.2 Å²	71.2	15%	0.154	41%	0.408	C	S	.	.			trans	-62.3	151	167.4	73.3	0	0	0	0	109.3	V546 A550 E551 Y552	V546-S548 PolarHBondContact O-N 3.42Å; S548-A550 PolarHBondContact O-N 3.15Å; S548-A550 VanDerWaalsContact O-N 3.11Å; S548-A550 PolarHBondContact OG-N 3.28Å; S548-E551 WeakPolarHBondContact CA-OE2 3.33Å; S548-E551 WeakPolarHBondContact CB-OE2 3.29Å; S548-E551 PolarHBondContact N-OE2 2.63Å; S548-E551 PolarHBondContact O-N 3.22Å; S548-E551 WeakPolarHBondContact OG-CG 3.39Å; S548-E551 PolarHBondContact OG-N 3.29Å; S548-E551 PolarHBondContact OG-OE2 2.91Å; S548-Y552 WeakPolarHBondContact O-CB 3.35Å; S548-Y552 PolarHBondContact O-N 3.1Å
549	R	51.6	Low	45.9	Very low	40 Å²	40	67.7 Å²	67.7	15%	0.151	39%	0.389	C	S	.	.	H	α-helix	trans	-51.9	-35.2	171.8	178.8	-164.3	166	116.8	-11.1	112	Q553 E689 V706 N708	R549-Q553 HydrophobicContact CG-CG 4.02Å; R549-Q553 VanDerWaalsContact O-CB 3.25Å; R549-Q553 WeakPolarHBondContact O-CB 3.34Å; R549-Q553 VanDerWaalsContact O-CG 3.27Å; R549-Q553 WeakPolarHBondContact O-CG 3.14Å; R549-Q553 PolarHBondContact O-N 3.49Å; R549-E689 VanDerWaalsContact CB-OE2 3.23Å; R549-E689 WeakPolarHBondContact CB-OE2 3.4Å; R549-E689 WeakPolarHBondContact CD-OE1 3.42Å; R549-E689 IonicContact NE-OE1 2.84Å; R549-V706 HydrophobicContact CB-CG1 4.25Å; R549-N708 PolarHBondContact NH1-ND2 2.95Å; R549-N708 PolarHBondContact NH1-OD1 2.8Å
550	A	54	Low	46.6	Very low	71 Å²	71	67.7 Å²	67.7	59%	0.587	38%	0.38	S	S	*	.	H	α-helix	trans	-67.4	-48.6	-176.4	0	0	0	0	0	112.4	S548 Y552 Q553 A554	S548-A550 PolarHBondContact O-N 3.15Å; S548-A550 VanDerWaalsContact O-N 3.11Å; S548-A550 PolarHBondContact OG-N 3.28Å; A550-Y552 VanDerWaalsContact C-N 3.32Å; A550-Y552 PolarHBondContact O-N 2.99Å; A550-Q553 PolarHBondContact O-N 2.81Å; A550-A554 WeakPolarHBondContact O-CB 3.3Å; A550-A554 PolarHBondContact O-N 2.81Å
551	E	59.4	Low	47.1	Very low	117 Å²	117	73.3 Å²	73.3	55%	0.547	39%	0.39	S	S	.	.	H	α-helix	trans	-60.5	-45.9	174.8	-67.1	150.9	146.5	0	0	110.3	S548 Q553 A554 W555	S548-E551 WeakPolarHBondContact CA-OE2 3.33Å; S548-E551 WeakPolarHBondContact CB-OE2 3.29Å; S548-E551 PolarHBondContact N-OE2 2.63Å; S548-E551 PolarHBondContact O-N 3.22Å; S548-E551 WeakPolarHBondContact OG-CG 3.39Å; S548-E551 PolarHBondContact OG-N 3.29Å; S548-E551 PolarHBondContact OG-OE2 2.91Å; E551-Q553 PolarHBondContact O-N 2.71Å; E551-A554 WeakPolarHBondContact O-CB 3.35Å; E551-A554 PolarHBondContact O-N 2.8Å; E551-W555 PolarHBondContact O-N 3Å
552	Y	52.5	Low	47.2	Very low	16 Å²	16	71.1 Å²	71.1	6%	0.063	38%	0.382	C	S	.	.	H	α-helix	trans	-64.9	-42.9	-179.1	-171.9	-83.3	0	0	0	112.9	S548 A550 A554 W555 V556 E705 K863	S548-Y552 WeakPolarHBondContact O-CB 3.35Å; S548-Y552 PolarHBondContact O-N 3.1Å; A550-Y552 VanDerWaalsContact C-N 3.32Å; A550-Y552 PolarHBondContact O-N 2.99Å; Y552-A554 VanDerWaalsContact C-N 3.35Å; Y552-W555 HydrophobicContact CD2-CE3 4.1Å; Y552-W555 AromaticContact CE2-CE3 3.47Å; Y552-W555 HydrophobicContact CE2-CE3 3.47Å; Y552-W555 VanDerWaalsContact CE2-CE3 3.47Å; Y552-W555 AromaticContact CE2-CZ3 3.51Å; Y552-W555 HydrophobicContact CE2-CZ3 3.51Å; Y552-W555 AromaticContact CZ-CE3 3.73Å; Y552-W555 AromaticContact CZ-CZ3 3.7Å; Y552-W555 WeakPolarHBondContact O-CB 3.28Å; Y552-W555 PolarHBondContact O-N 3.06Å; Y552-W555 WeakPolarHBondContact OH-CZ3 3.32Å; Y552-V556 HydrophobicContact CD1-CG2 4.22Å; Y552-V556 HydrophobicContact CE1-CG2 3.32Å; Y552-V556 PolarHBondContact O-N 3.45Å; Y552-V556 VanDerWaalsContact O-N 3.09Å; Y552-E705 HydrophobicContact CD1-CG 3.76Å; Y552-E705 HydrophobicContact CD2-CG 4.35Å; Y552-E705 HydrophobicContact CE1-CB 4.42Å; Y552-E705 HydrophobicContact CE1-CG 3.29Å; Y552-E705 WeakPolarHBondContact CE1-OE1 3.38Å; Y552-E705 WeakPolarHBondContact CE1-OE2 3.4Å; Y552-E705 HydrophobicContact CE2-CG 3.89Å; Y552-E705 HydrophobicContact CG-CG 4.28Å; Y552-E705 VanDerWaalsContact CZ-OE1 3.23Å; Y552-E705 VanDerWaalsContact OH-CD 3.26Å; Y552-E705 PolarHBondContact OH-OE1 3.14Å; Y552-K863 WeakPolarHBondContact OH-CE 3.42Å; Y552-K863 PolarHBondContact OH-NZ 3.19Å
553	Q	56.2	Low	47.1	Very low	79 Å²	79	70.1 Å²	70.1	37%	0.369	38%	0.376	S	S	.	.	H	α-helix	trans	-70.3	-30.2	175.1	-73.1	-165.1	-47.1	0	0	112.3	R549 A550 E551 W555 N557	R549-Q553 HydrophobicContact CG-CG 4.02Å; R549-Q553 VanDerWaalsContact O-CB 3.25Å; R549-Q553 WeakPolarHBondContact O-CB 3.34Å; R549-Q553 VanDerWaalsContact O-CG 3.27Å; R549-Q553 WeakPolarHBondContact O-CG 3.14Å; R549-Q553 PolarHBondContact O-N 3.49Å; A550-Q553 PolarHBondContact O-N 2.81Å; E551-Q553 PolarHBondContact O-N 2.71Å; Q553-W555 VanDerWaalsContact C-N 3.29Å; Q553-N557 WeakPolarHBondContact O-CB 3.32Å; Q553-N557 PolarHBondContact O-N 3.33Å; Q553-N557 PolarHBondContact O-ND2 3.34Å
554	A	56.5	Low	47	Very low	64 Å²	64	70.2 Å²	70.2	53%	0.529	38%	0.384	S	S	.	.	H	α-helix	trans	-62.3	-40.5	171	0	0	0	0	0	110.9	A550 E551 Y552 N557 S558	A550-A554 WeakPolarHBondContact O-CB 3.3Å; A550-A554 PolarHBondContact O-N 2.81Å; E551-A554 WeakPolarHBondContact O-CB 3.35Å; E551-A554 PolarHBondContact O-N 2.8Å; Y552-A554 VanDerWaalsContact C-N 3.35Å; A554-N557 CarbonylContact O-C 3.55Å; A554-N557 PolarHBondContact O-N 3.32Å; A554-S558 PolarHBondContact O-N 3.42Å
555	W	47.4	Very low	47	Very low	31 Å²	31	69.7 Å²	69.7	12%	0.117	38%	0.379	C	S	.	.	H	α-helix	trans	-67.2	-50.6	178.2	175.4	58.3	0	0	0	114.2	E551 Y552 Q553 N557 S558 A559 K863 A884 P886	E551-W555 PolarHBondContact O-N 3Å; Y552-W555 HydrophobicContact CD2-CE3 4.1Å; Y552-W555 AromaticContact CE2-CE3 3.47Å; Y552-W555 HydrophobicContact CE2-CE3 3.47Å; Y552-W555 VanDerWaalsContact CE2-CE3 3.47Å; Y552-W555 AromaticContact CE2-CZ3 3.51Å; Y552-W555 HydrophobicContact CE2-CZ3 3.51Å; Y552-W555 AromaticContact CZ-CE3 3.73Å; Y552-W555 AromaticContact CZ-CZ3 3.7Å; Y552-W555 WeakPolarHBondContact O-CB 3.28Å; Y552-W555 PolarHBondContact O-N 3.06Å; Y552-W555 WeakPolarHBondContact OH-CZ3 3.32Å; Q553-W555 VanDerWaalsContact C-N 3.29Å; W555-N557 PolarHBondContact O-N 3.2Å; W555-S558 PolarHBondContact O-N 3.33Å; W555-S558 PolarHBondContact O-OG 3.47Å; W555-A559 PolarHBondContact O-N 3Å; W555-K863 HydrophobicContact CH2-CB 3.89Å; W555-K863 HydrophobicContact CH2-CD 3.97Å; W555-K863 HydrophobicContact CH2-CG 3.66Å; W555-K863 HydrophobicContact CZ3-CD 3.88Å; W555-K863 HydrophobicContact CZ3-CG 3.9Å; W555-A884 PolarHBondContact NE1-O 3.22Å; W555-P886 HydrophobicContact CB-CG 4.28Å; W555-P886 VanDerWaalsContact CD2-CD 3.41Å; W555-P886 HydrophobicContact CD2-CG 3.62Å; W555-P886 HydrophobicContact CE3-CG 3.89Å; W555-P886 HydrophobicContact CG-CG 3.76Å; W555-P886 HydrophobicContact CZ3-CG 4.45Å
556	V	47.8	Very low	46.4	Very low	61 Å²	61	73.8 Å²	73.8	37%	0.37	39%	0.391	S	S	.	.	H	α-helix	trans	-59.4	-26.8	176.7	172.5	0	0	0	0	112.1	Y552 N560	Y552-V556 HydrophobicContact CD1-CG2 4.22Å; Y552-V556 HydrophobicContact CE1-CG2 3.32Å; Y552-V556 PolarHBondContact O-N 3.45Å; Y552-V556 VanDerWaalsContact O-N 3.09Å; V556-N560 PolarHBondContact O-ND2 2.89Å
557	N	49.8	Very low	45.7	Very low	90 Å²	90	80 Å²	80	48%	0.481	42%	0.423	S	S	.	.	H	α-helix	trans	-87.3	-12.8	174	-71	-62.8	0	0	0	114.3	Q553 A554 W555 R561	Q553-N557 WeakPolarHBondContact O-CB 3.32Å; Q553-N557 PolarHBondContact O-N 3.33Å; Q553-N557 PolarHBondContact O-ND2 3.34Å; A554-N557 CarbonylContact O-C 3.55Å; A554-N557 PolarHBondContact O-N 3.32Å; W555-N557 PolarHBondContact O-N 3.2Å; N557-R561 WeakPolarHBondContact O-CG 3.33Å
558	S	45.7	Very low	44.7	Very low	37 Å²	37	85.3 Å²	85.3	26%	0.259	45%	0.446	S	S	.	.	H	α-helix	trans	-80.8	-40.5	175.3	71.5	0	0	0	0	111.9	A554 W555 N560 R561 Q562	A554-S558 PolarHBondContact O-N 3.42Å; W555-S558 PolarHBondContact O-N 3.33Å; W555-S558 PolarHBondContact O-OG 3.47Å; S558-N560 VanDerWaalsContact C-N 3.31Å; S558-N560 PolarHBondContact O-N 2.87Å; S558-R561 WeakPolarHBondContact O-CA 3.47Å; S558-R561 WeakPolarHBondContact O-CB 3.32Å; S558-R561 PolarHBondContact O-N 3.37Å; S558-Q562 PolarHBondContact O-N 3.37Å
559	A	42.1	Very low	43.6	Very low	40 Å²	40	89.3 Å²	89.3	33%	0.331	47%	0.474	S	S	.	.	H	α-helix	trans	-56.2	-43.3	174.1	0	0	0	0	0	112.4	W555 R561 T563	W555-A559 PolarHBondContact O-N 3Å; A559-R561 VanDerWaalsContact C-N 3.26Å; A559-R561 PolarHBondContact O-N 2.87Å; A559-T563 PolarHBondContact O-N 3.33Å; A559-T563 PolarHBondContact O-OG1 2.89Å
560	N	42.5	Very low	42.6	Very low	110 Å²	110	95.9 Å²	95.9	59%	0.588	51%	0.506	S	S	*	.	H	α-helix	trans	-64	-27.7	173.1	-84.5	-57.4	0	0	0	113.2	V556 S558 A564	V556-N560 PolarHBondContact O-ND2 2.89Å; S558-N560 VanDerWaalsContact C-N 3.31Å; S558-N560 PolarHBondContact O-N 2.87Å; N560-A564 PolarHBondContact O-N 2.88Å
561	R	35.1	Very low	41.3	Very low	171 Å²	171	100.9 Å²	100.9	65%	0.645	52%	0.52	S	S	*	.	H	α-helix	trans	-79.8	-39.5	178.3	-74.5	175.2	-177.8	-156.4	2	113.3	N557 S558 A559 T563 A564 M565	N557-R561 WeakPolarHBondContact O-CG 3.33Å; S558-R561 WeakPolarHBondContact O-CA 3.47Å; S558-R561 WeakPolarHBondContact O-CB 3.32Å; S558-R561 PolarHBondContact O-N 3.37Å; A559-R561 VanDerWaalsContact C-N 3.26Å; A559-R561 PolarHBondContact O-N 2.87Å; R561-T563 VanDerWaalsContact C-N 3.27Å; R561-T563 PolarHBondContact O-N 3.33Å; R561-A564 CarbonylContact O-C 3.52Å; R561-A564 PolarHBondContact O-N 2.97Å; R561-A564 VanDerWaalsContact O-N 3.12Å; R561-M565 WeakPolarHBondContact O-CG 3.47Å; R561-M565 PolarHBondContact O-N 3.04Å
562	Q	37.4	Very low	39.9	Very low	76 Å²	76	106.4 Å²	106.4	36%	0.355	54%	0.535	S	S	.	.	H	α-helix	trans	-59.6	-41.5	176.9	-77.6	169.7	-38	0	0	111.1	S558 A564 M565 R566	S558-Q562 PolarHBondContact O-N 3.37Å; Q562-A564 PolarHBondContact O-N 2.69Å; Q562-M565 PolarHBondContact O-N 3.31Å; Q562-R566 PolarHBondContact O-N 3.02Å; Q562-R566 VanDerWaalsContact O-N 3.07Å
563	T	35.9	Very low	38.9	Very low	89 Å²	89	111.5 Å²	111.5	55%	0.546	57%	0.57	S	S	.	*	H	α-helix	trans	-60.5	-43.7	173.6	-47.7	0	0	0	0	111.9	A559 R561 M565	A559-T563 PolarHBondContact O-N 3.33Å; A559-T563 PolarHBondContact O-OG1 2.89Å; R561-T563 VanDerWaalsContact C-N 3.27Å; R561-T563 PolarHBondContact O-N 3.33Å; T563-M565 PolarHBondContact O-N 3.18Å
564	A	33.3	Very low	37.8	Very low	54 Å²	54	116.9 Å²	116.9	45%	0.446	60%	0.595	S	S	.	*	H	α-helix	trans	-70.3	-25.4	177.5	0	0	0	0	0	114.2	N560 R561 Q562	N560-A564 PolarHBondContact O-N 2.88Å; R561-A564 CarbonylContact O-C 3.52Å; R561-A564 PolarHBondContact O-N 2.97Å; R561-A564 VanDerWaalsContact O-N 3.12Å; Q562-A564 PolarHBondContact O-N 2.69Å
565	M	34.8	Very low	36.5	Very low	134 Å²	134	122.9 Å²	122.9	66%	0.66	61%	0.609	S	S	*	*	H	α-helix	trans	-79.8	-39.1	174.8	-67.9	-158.9	-148	0	0	112.6	R561 Q562 T563 L567 K568	R561-M565 WeakPolarHBondContact O-CG 3.47Å; R561-M565 PolarHBondContact O-N 3.04Å; Q562-M565 PolarHBondContact O-N 3.31Å; T563-M565 PolarHBondContact O-N 3.18Å; M565-L567 PolarHBondContact O-N 3.19Å; M565-K568 PolarHBondContact O-N 2.75Å
566	R	35.3	Very low	35.7	Very low	164 Å²	164	130.6 Å²	130.6	62%	0.619	65%	0.646	S	S	*	*	H	α-helix	trans	-57.5	-33.3	175.4	-95.5	177.6	166.7	141.5	-3.8	112.3	Q562 K568 E870	Q562-R566 PolarHBondContact O-N 3.02Å; Q562-R566 VanDerWaalsContact O-N 3.07Å; R566-K568 VanDerWaalsContact C-N 3.35Å; R566-K568 PolarHBondContact O-N 3.37Å; R566-E870 IonicContact NH1-OE1 3.73Å
567	L	36.6	Very low	35	Very low	146 Å²	146	133.3 Å²	133.3	76%	0.764	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-13.3	174.1	-94	144.7	0	0	0	115.3	M565	M565-L567 PolarHBondContact O-N 3.19Å
568	K	33.1	Very low	34.1	Very low	179 Å²	179	136.8 Å²	136.8	78%	0.778	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	3.1	179.6	-75.7	-171.5	172.8	-171.9	0	114.8	M565 R566 Q570	M565-K568 PolarHBondContact O-N 2.75Å; R566-K568 VanDerWaalsContact C-N 3.35Å; R566-K568 PolarHBondContact O-N 3.37Å; K568-Q570 VanDerWaalsContact C-N 3.28Å; K568-Q570 PolarHBondContact O-N 3.29Å
569	S	29.3	Very low	33.7	Very low	106 Å²	106	139.3 Å²	139.3	74%	0.741	69%	0.692	S	S	*	*	S	Bend	trans	-81.6	5.1	-178.3	-154.6	0	0	0	0	115
570	Q	30.6	Very low	33.3	Very low	179 Å²	179	145.8 Å²	145.8	84%	0.836	72%	0.716	S	S	*	*	S	Bend	trans	-127.1	50	179.9	-70.8	-164.9	-6.3	0	0	113.9	K568	K568-Q570 VanDerWaalsContact C-N 3.28Å; K568-Q570 PolarHBondContact O-N 3.29Å
571	M	26.8	Very low	32.8	Very low	176 Å²	176	148.8 Å²	148.8	87%	0.867	73%	0.726	S	S	*	*			trans	-137.4	110.8	156	-83	-63.3	152	0	0	109.8
572	R	28.6	Very low	32.9	Very low	233 Å²	233	146 Å²	146	88%	0.879	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-85.8	132.8	164.3	-70.7	-176.8	178.7	179.4	-0	108.1	H574	R572-H574 PolarHBondContact O-N 3.06Å
573	P	31.8	Very low	32.6	Very low	122 Å²	122	145.8 Å²	145.8	79%	0.792	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-73.2	126.4	173.3	30.1	-32.4	0	0	0	109.8
574	H	33.1	Very low	32.9	Very low	192 Å²	192	147.4 Å²	147.4	89%	0.889	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-85.5	157.4	155.1	-104.6	-100.2	0	0	0	109.9	R572	R572-H574 PolarHBondContact O-N 3.06Å
575	K	28.7	Very low	32.8	Very low	191 Å²	191	150.1 Å²	150.1	83%	0.83	78%	0.776	S	S	*	*			trans	-126.7	119.7	-158.9	175.7	-165.6	-179.8	-169	0	108.7
576	E	32.3	Very low	32.7	Very low	192 Å²	192	155 Å²	155	90%	0.897	79%	0.787	S	S	*	*			trans	-140.7	136.1	168.8	-121.2	151.2	-131.8	0	0	112
577	T	33	Very low	32.5	Very low	118 Å²	118	151.4 Å²	151.4	72%	0.724	79%	0.792	S	S	*	*			trans	-79	169.6	179.5	26.4	0	0	0	0	111.2
578	E	30.8	Very low	32.2	Very low	164 Å²	164	150.2 Å²	150.2	77%	0.766	80%	0.796	S	S	*	*			cis	-156.7	-166	17.1	-119.5	-91.7	114.4	0	0	108.9
579	P	36.2	Very low	32.1	Very low	90 Å²	90	145.4 Å²	145.4	58%	0.584	79%	0.79	S	S	*	*				-132	-143.5	-119.8	49.9	-32.3	0	0	0	116.2
580	Q	33.5	Very low	32.2	Very low	175 Å²	175	149.9 Å²	149.9	82%	0.818	80%	0.796	S	S	*	*			trans	89.8	143.4	176.3	-55	-171.6	-4.9	0	0	116.6
581	E	32.6	Very low	32.3	Very low	174 Å²	174	147.4 Å²	147.4	81%	0.813	80%	0.798	S	S	*	*			cis	-158.6	171.3	-21.2	-106.1	-69.2	93	0	0	106.9
582	P	37.5	Very low	32.4	Very low	111 Å²	111	150.3 Å²	150.3	72%	0.721	80%	0.8	S	S	*	*			trans	-108.8	167.9	-154.3	41.1	-39.2	0	0	0	118
583	G	31.4	Very low	32.4	Very low	72 Å²	72	144.1 Å²	144.1	74%	0.742	79%	0.792	S	S	*	*			trans	-173.7	140.2	165.5	0	0	0	0	0	113.4
584	P	42.3	Very low	32.4	Very low	123 Å²	123	143.7 Å²	143.7	80%	0.799	79%	0.792	S	S	*	*			trans	-129.6	155.1	-159.9	41.5	-26.5	0	0	0	119.4
585	S	31	Very low	32.2	Very low	111 Å²	111	140.6 Å²	140.6	78%	0.776	79%	0.792	S	S	*	*			trans	93.5	144.3	138.9	83.5	0	0	0	0	123.3
586	R	31.5	Very low	32.4	Very low	238 Å²	238	140.2 Å²	140.2	90%	0.898	80%	0.796	S	S	*	*			trans	96.5	96.8	135.1	-142.4	168.5	-170.5	171.9	1.6	121.6
587	A	32.3	Very low	33.1	Very low	87 Å²	87	135.7 Å²	135.7	72%	0.719	78%	0.783	S	S	*	*				68.7	107.4	128.3	0	0	0	0	0	123.5
588	S	29.7	Very low	33.6	Very low	122 Å²	122	135.8 Å²	135.8	85%	0.853	79%	0.785	S	S	*	*				87.5	147.4	117.5	-154.2	0	0	0	0	122.5
589	A	31.7	Very low	33.6	Very low	78 Å²	78	136.9 Å²	136.9	65%	0.645	79%	0.79	S	S	*	*			trans	87.1	96.8	152.6	0	0	0	0	0	122.3
590	K	30.3	Very low	33.3	Very low	200 Å²	200	135.4 Å²	135.4	87%	0.87	79%	0.791	S	S	*	*				56.4	120.9	127.7	-59.1	170.8	-177.6	174	0	120.5
591	S	32.3	Very low	33.2	Very low	126 Å²	126	134.3 Å²	134.3	88%	0.881	79%	0.79	S	S	*	*				-165.5	169.3	120.3	-91.4	0	0	0	0	114.8
592	R	29.5	Very low	33.1	Very low	237 Å²	237	131.6 Å²	131.6	89%	0.894	78%	0.781	S	S	*	*			trans	-92.2	171.9	175.2	-56.2	170	169.9	164.3	-7.2	109
593	S	29.4	Very low	32.6	Very low	104 Å²	104	135.1 Å²	135.1	73%	0.727	79%	0.785	S	S	*	*			cis	-168.1	151	-2.7	22.1	0	0	0	0	110.8
594	S	30.8	Very low	32.5	Very low	112 Å²	112	135.8 Å²	135.8	78%	0.783	78%	0.783	S	S	*	*			trans	18.2	122.5	152.7	60.7	0	0	0	0	123.3
595	S	30.3	Very low	31.9	Very low	127 Å²	127	139.1 Å²	139.1	89%	0.888	79%	0.788	S	S	*	*			trans	-168.5	172.1	130.9	58	0	0	0	0	112.2
596	M	31.8	Very low	31.7	Very low	184 Å²	184	140.2 Å²	140.2	91%	0.906	79%	0.79	S	S	*	*			trans	-106.3	170.9	-172.9	-73.6	-129.5	85.1	0	0	114.3
597	P	47.7	Very low	32	Very low	97 Å²	97	134 Å²	134	63%	0.63	78%	0.781	S	S	*	*			trans	-115.4	175.3	-162	43.3	-36.3	0	0	0	116.8
598	P	44	Very low	31.9	Very low	119 Å²	119	140.8 Å²	140.8	77%	0.773	79%	0.788	S	S	*	*			trans	-122.6	-176.5	160.3	40.1	-28.2	0	0	0	113.3
599	H	30	Very low	31.7	Very low	187 Å²	187	145.9 Å²	145.9	87%	0.866	79%	0.788	S	S	*	*				-173.7	147.1	-56.4	-122.1	-77.8	0	0	0	109
600	G	29.9	Very low	31.4	Very low	60 Å²	60	146.6 Å²	146.6	62%	0.619	79%	0.794	S	S	*	*			trans	160.9	105.8	175.6	0	0	0	0	0	112.4
601	L	31.8	Very low	31.4	Very low	151 Å²	151	144.2 Å²	144.2	79%	0.791	80%	0.796	S	S	*	*				77.2	126.8	62.6	-61.5	179.4	0	0	0	112.8
602	L	30.8	Very low	31	Very low	117 Å²	117	147.6 Å²	147.6	61%	0.613	80%	0.798	S	S	*	*			cis	-162.7	158.9	2	-100.6	172.4	0	0	0	113.7
603	F	26.3	Very low	30.9	Very low	185 Å²	185	140.9 Å²	140.9	81%	0.811	79%	0.793	S	S	*	*			trans	59.5	153.5	150.4	-69.6	-42.7	0	0	0	121.7
604	A	29.3	Very low	30.8	Very low	86 Å²	86	143.5 Å²	143.5	71%	0.711	80%	0.798	S	S	*	*			cis	-161.6	174.1	-10	0	0	0	0	0	113.6
605	E	28.7	Very low	30.6	Very low	193 Å²	193	144 Å²	144	90%	0.902	80%	0.797	S	S	*	*			trans	75.3	151.9	159.5	-74.6	-174.1	170.3	0	0	123.4
606	V	28.7	Very low	30.4	Very low	134 Å²	134	144.6 Å²	144.6	81%	0.812	79%	0.789	S	S	*	*			trans	-162.8	132.2	-160.7	172.5	0	0	0	0	106.7
607	P	36.9	Very low	30.2	Very low	108 Å²	108	142.5 Å²	142.5	70%	0.701	78%	0.777	S	S	*	*				-162.7	149.8	87.5	40.7	-18	0	0	0	122
608	R	29.1	Very low	29.2	Very low	229 Å²	229	147.4 Å²	147.4	86%	0.864	78%	0.783	S	S	*	*			trans	76.3	127.5	136.1	-75.8	173.1	179.5	178.9	1.7	123.5
609	R	26	Very low	28.3	Very low	230 Å²	230	147.1 Å²	147.1	87%	0.868	78%	0.784	S	S	*	*			trans	86.7	92.9	138	-80.3	-174.5	171.6	173.2	-3.1	121.2
610	A	25.1	Very low	28.4	Very low	93 Å²	93	143.8 Å²	143.8	77%	0.769	78%	0.779	S	S	*	*				64.9	114.1	107.4	0	0	0	0	0	121.6
611	T	31.7	Very low	28.4	Very low	149 Å²	149	150.1 Å²	150.1	91%	0.914	79%	0.792	S	S	*	*			trans	-150.3	157.2	132.1	15.9	0	0	0	0	109.6
612	E	23.5	Very low	28.1	Very low	198 Å²	198	150.4 Å²	150.4	93%	0.925	79%	0.793	S	S	*	*			trans	-111.3	143.5	-179.7	-63	173.5	125.6	0	0	110.9
613	A	26.5	Very low	28	Very low	95 Å²	95	150.4 Å²	150.4	79%	0.785	80%	0.803	S	S	*	*			trans	-156.5	132.7	162.3	0	0	0	0	0	112.4
614	L	27	Very low	28.1	Very low	160 Å²	160	150.8 Å²	150.8	84%	0.838	80%	0.799	S	S	*	*			trans	11.6	143.4	136.1	-47	176.1	0	0	0	117.4
615	T	26.7	Very low	28	Very low	121 Å²	121	154.8 Å²	154.8	74%	0.742	80%	0.797	S	S	*	*			cis	-166.4	-177.5	26.6	-16.9	0	0	0	0	108
616	L	26.6	Very low	27.9	Very low	141 Å²	141	151.5 Å²	151.5	74%	0.738	79%	0.792	S	S	*	*			cis	-157.9	-167.2	1.9	-172.3	43.8	0	0	0	108.5
617	E	28.5	Very low	27.8	Very low	140 Å²	140	152.6 Å²	152.6	65%	0.654	79%	0.792	S	S	*	*			trans	77.7	146.8	162.8	-67.1	-61.6	108.4	0	0	120
618	R	26.5	Very low	27.3	Very low	200 Å²	200	153.7 Å²	153.7	76%	0.755	79%	0.792	S	S	*	*				-169	104.7	-62.1	176.5	176.8	-161.9	179.3	3.8	110.6
619	S	24	Very low	27.3	Very low	112 Å²	112	147.7 Å²	147.7	78%	0.783	78%	0.781	S	S	*	*			trans	65.3	176.3	161.2	-50.5	0	0	0	0	117.1
620	P	32.9	Very low	27.4	Very low	117 Å²	117	140.3 Å²	140.3	76%	0.76	76%	0.764	S	S	*	*				-126.2	147.7	-71.8	36.7	-23.5	0	0	0	113.1
621	Q	29.6	Very low	27.6	Very low	193 Å²	193	141.8 Å²	141.8	90%	0.902	77%	0.766	S	S	*	*			trans	-127.6	135	175.9	-81.2	-81.5	-52.3	0	0	112.2
622	I	25.6	Very low	27.5	Very low	157 Å²	157	142.3 Å²	142.3	81%	0.805	76%	0.762	S	S	*	*			trans	-81.1	124.5	-178.9	-65.8	160.7	0	0	0	109.3
623	S	29	Very low	27.8	Very low	117 Å²	117	137.8 Å²	137.8	82%	0.818	75%	0.75	S	S	*	*			trans	-114.1	124.3	168.2	-173.2	0	0	0	0	110.1
624	R	27.7	Very low	28	Very low	193 Å²	193	145.5 Å²	145.5	73%	0.728	76%	0.759	S	S	*	*			trans	-94.5	115.7	176.1	-75.4	-174.3	175.1	-163.9	-1.8	109.9
625	Y	26.8	Very low	28.1	Very low	170 Å²	170	146.7 Å²	146.7	67%	0.667	75%	0.752	S	S	*	*			trans	42.5	110	154.9	-57.4	-67.8	0	0	0	118.9	R799	Y625-R799 PolarHBondContact OH-NH1 3.1Å
626	P	27.1	Very low	28.3	Very low	125 Å²	125	152.7 Å²	152.7	81%	0.812	76%	0.761	S	S	*	*			trans	-78.2	130.9	175.1	32.2	-33	0	0	0	112.1
627	I	27.6	Very low	28.6	Very low	157 Å²	157	155.5 Å²	155.5	81%	0.805	76%	0.763	S	S	*	*			trans	-88.4	96.5	157.4	-52	177.9	0	0	0	106.8	V629	I627-V629 VanDerWaalsContact C-N 3.3Å; I627-V629 HydrophobicContact CG2-CG2 3.98Å; I627-V629 PolarHBondContact O-N 3.23Å
628	D	25.5	Very low	29.1	Very low	130 Å²	130	154.3 Å²	154.3	70%	0.695	77%	0.768	S	S	*	*			trans	-76.1	80.2	178.9	-165.8	-20.5	0	0	0	111.2	S630	D628-S630 VanDerWaalsContact C-N 3.3Å; D628-S630 PolarHBondContact O-N 3.33Å; D628-S630 WeakPolarHBondContact OD1-CA 3.46Å; D628-S630 WeakPolarHBondContact OD1-CB 3.16Å; D628-S630 PolarHBondContact OD1-N 3.25Å; D628-S630 VanDerWaalsContact OD1-N 3.12Å; D628-S630 PolarHBondContact OD1-OG 3.16Å
629	V	30.1	Very low	29.9	Very low	104 Å²	104	148.6 Å²	148.6	63%	0.63	75%	0.752	S	S	*	*			trans	-84.1	79.9	160.9	-174.3	0	0	0	0	108	I627	I627-V629 VanDerWaalsContact C-N 3.3Å; I627-V629 HydrophobicContact CG2-CG2 3.98Å; I627-V629 PolarHBondContact O-N 3.23Å
630	S	28	Very low	31.5	Very low	74 Å²	74	147.2 Å²	147.2	52%	0.517	73%	0.733	S	S	.	*			trans	-56.4	130.5	-176.5	-38.6	0	0	0	0	111.5	D628 L632	D628-S630 VanDerWaalsContact C-N 3.3Å; D628-S630 PolarHBondContact O-N 3.33Å; D628-S630 WeakPolarHBondContact OD1-CA 3.46Å; D628-S630 WeakPolarHBondContact OD1-CB 3.16Å; D628-S630 PolarHBondContact OD1-N 3.25Å; D628-S630 VanDerWaalsContact OD1-N 3.12Å; D628-S630 PolarHBondContact OD1-OG 3.16Å; S630-L632 PolarHBondContact O-N 2.95Å
631	P	29.6	Very low	32.4	Very low	124 Å²	124	146.6 Å²	146.6	81%	0.805	72%	0.722	S	S	*	*			trans	-76.4	91.4	-174.7	29.9	-35.1	0	0	0	111.8	P633	P631-P633 WeakPolarHBondContact O-CD 3.34Å
632	L	28.8	Very low	33.7	Very low	161 Å²	161	138.1 Å²	138.1	84%	0.843	69%	0.685	S	S	*	*			trans	11.4	76.2	169.7	-72	174.9	0	0	0	116.4	S630	S630-L632 PolarHBondContact O-N 2.95Å
633	P	29.5	Very low	34.8	Very low	102 Å²	102	134.6 Å²	134.6	66%	0.662	67%	0.674	S	S	*	*			trans	-63.9	156.5	164.2	29.3	-34.4	0	0	0	109.7	P631 R635	P631-P633 WeakPolarHBondContact O-CD 3.34Å; P633-R635 PolarHBondContact O-N 2.99Å
634	R	30.3	Very low	35.8	Very low	258 Å²	258	131 Å²	131	97%	0.974	65%	0.649	S	S	*	*	S	Bend	trans	-73.5	48.6	-167.3	-66.9	-179.4	172.3	-177.1	-1.5	115.8
635	R	29.6	Very low	36.6	Very low	184 Å²	184	124.5 Å²	124.5	69%	0.694	63%	0.629	S	S	*	*			trans	-104.7	101.7	159.5	-84	-174.6	170.3	157.7	-0.4	109.6	S302 P633 Y637	S302-R635 PolarHBondContact OG-NH1 3.48Å; P633-R635 PolarHBondContact O-N 2.99Å; R635-Y637 PolarHBondContact O-N 3.13Å
636	R	31.7	Very low	36.9	Very low	247 Å²	247	121 Å²	121	93%	0.932	63%	0.625	S	S	*	*			trans	-66.9	96.6	165.6	-69.3	-177.4	-179.5	179.3	0.5	108.6
637	Y	32.4	Very low	37	Very low	200 Å²	200	122.3 Å²	122.3	78%	0.784	63%	0.625	S	S	*	*			trans	-56.5	133.4	145.6	-73.6	-88.1	0	0	0	107	R635 L639	R635-Y637 PolarHBondContact O-N 3.13Å; Y637-L639 PolarHBondContact O-N 2.77Å
638	P	39.6	Very low	37.3	Very low	115 Å²	115	119.7 Å²	119.7	75%	0.747	62%	0.621	S	S	*	*			trans	-68.5	98.6	179.2	27.4	-32.8	0	0	0	108.7	Q640	P638-Q640 PolarHBondContact O-N 2.78Å
639	L	42.5	Very low	37.3	Very low	80 Å²	80	122.5 Å²	122.5	42%	0.419	63%	0.627	S	S	.	*			trans	-58.1	109.9	167.3	-72.9	174.6	0	0	0	107.4	Y637 I641	Y637-L639 PolarHBondContact O-N 2.77Å; L639-I641 PolarHBondContact O-N 3.07Å
640	Q	56.9	Low	37.4	Very low	83 Å²	83	126.5 Å²	126.5	39%	0.388	64%	0.636	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-66.4	128.6	175	-76.5	171.4	-39.2	0	0	108.4	P638 A642 F769 A770	P638-Q640 PolarHBondContact O-N 2.78Å; Q640-A642 PolarHBondContact O-N 3.26Å; Q640-F769 HydrophobicContact CB-CD1 4.09Å; Q640-F769 HydrophobicContact CB-CE1 4.29Å; Q640-A770 PolarHBondContact O-N 3.06Å
641	I	52.8	Low	37.4	Very low	105 Å²	105	128.3 Å²	128.3	54%	0.538	66%	0.656	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.5	110.6	173.1	-62.3	176	0	0	0	106	L639 S643 A770 N772	L639-I641 PolarHBondContact O-N 3.07Å; I641-S643 PolarHBondContact O-N 3.36Å; I641-S643 VanDerWaalsContact O-N 3.14Å; I641-A770 WeakPolarHBondContact CA-O 3.25Å; I641-N772 WeakPolarHBondContact CG2-ND2 3.29Å
642	A	56	Low	37.2	Very low	15 Å²	15	125.3 Å²	125.3	12%	0.124	65%	0.647	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-71	110.8	174.1	0	0	0	0	0	108.4	Q640 S644 L750 A770 L771	Q640-A642 PolarHBondContact O-N 3.26Å; A642-S644 VanDerWaalsContact C-N 3.26Å; A642-S644 PolarHBondContact O-N 3.15Å; A642-L750 HydrophobicContact CB-CD2 3.73Å; A642-A770 PolarHBondContact N-O 3.16Å; A642-A770 VanDerWaalsContact N-O 3.15Å; A642-L771 HydrophobicContact CB-CD1 4.01Å
643	S	49.8	Very low	37.2	Very low	83 Å²	83	122.9 Å²	122.9	58%	0.58	64%	0.639	S	S	*	*			trans	-92	31.4	-176.5	62.9	0	0	0	0	112.6	I641 N645 V646	I641-S643 PolarHBondContact O-N 3.36Å; I641-S643 VanDerWaalsContact O-N 3.14Å; S643-N645 VanDerWaalsContact C-N 3.28Å; S643-N645 PolarHBondContact O-N 3.16Å; S643-V646 VanDerWaalsContact O-CG2 3.27Å; S643-V646 WeakPolarHBondContact O-CG2 3.37Å
644	S	50.6	Low	37.1	Very low	41 Å²	41	122.3 Å²	122.3	29%	0.287	64%	0.637	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.5	-9.8	-170.7	34.4	0	0	0	0	114.9	A642 V646 S749	A642-S644 VanDerWaalsContact C-N 3.26Å; A642-S644 PolarHBondContact O-N 3.15Å; S644-V646 VanDerWaalsContact C-N 3.31Å; S644-V646 PolarHBondContact O-N 2.99Å; S644-S749 WeakPolarHBondContact CB-O 3.37Å; S644-S749 PolarHBondContact OG-O 2.86Å
645	N	43.1	Very low	37.3	Very low	56 Å²	56	115 Å²	115	30%	0.299	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.2	12.1	179.5	-64.6	7.3	0	0	0	114.1	S643 N772 E774	S643-N645 VanDerWaalsContact C-N 3.28Å; S643-N645 PolarHBondContact O-N 3.16Å; N645-N772 PolarHBondContact ND2-O 3.28Å; N645-E774 PolarHBondContact ND2-N 2.94Å; N645-E774 VanDerWaalsContact ND2-N 3.15Å
646	V	33.3	Very low	37.2	Very low	98 Å²	98	111.3 Å²	111.3	59%	0.594	62%	0.621	S	S	*	*			trans	-92	113.3	164.8	-84	0	0	0	0	110.7	S643 S644 S648	S643-V646 VanDerWaalsContact O-CG2 3.27Å; S643-V646 WeakPolarHBondContact O-CG2 3.37Å; S644-V646 VanDerWaalsContact C-N 3.31Å; S644-V646 PolarHBondContact O-N 2.99Å; V646-S648 PolarHBondContact O-N 3.03Å; V646-S648 VanDerWaalsContact O-N 3.13Å
647	N	30	Very low	37.2	Very low	152 Å²	152	104.3 Å²	104.3	81%	0.813	61%	0.61	S	S	*	*	S	Bend	trans	-55.4	118.2	157.7	-84	-34.3	0	0	0	109
648	S	32.9	Very low	37.2	Very low	102 Å²	102	100.5 Å²	100.5	71%	0.713	61%	0.608	S	S	*	*	S	Bend	trans	49	73	158.5	62.2	0	0	0	0	118.2	V646	V646-S648 PolarHBondContact O-N 3.03Å; V646-S648 VanDerWaalsContact O-N 3.13Å
649	F	26.3	Very low	36.8	Very low	189 Å²	189	100.8 Å²	100.8	83%	0.829	60%	0.6	S	S	*	*			trans	-144.2	30.5	157.1	-89	-59.3	0	0	0	116.4
650	F	31.1	Very low	36.3	Very low	187 Å²	187	97.8 Å²	97.8	82%	0.82	59%	0.587	S	S	*	*			trans	-135.5	64.2	163.7	-87.6	-69	0	0	0	113.2	G652	F650-G652 VanDerWaalsContact C-N 3.27Å; F650-G652 PolarHBondContact O-N 3.41Å; F650-G652 VanDerWaalsContact O-N 3.13Å
651	A	28.2	Very low	35.5	Very low	112 Å²	112	101.2 Å²	101.2	93%	0.926	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	83.8	154.1	0	0	0	0	0	108.3
652	G	26.2	Very low	34.9	Very low	61 Å²	61	100.3 Å²	100.3	63%	0.629	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-171.1	-2.1	-170.9	0	0	0	0	0	119.4	F650	F650-G652 VanDerWaalsContact C-N 3.27Å; F650-G652 PolarHBondContact O-N 3.41Å; F650-G652 VanDerWaalsContact O-N 3.13Å
653	V	27.9	Very low	34.7	Very low	110 Å²	110	104.6 Å²	104.6	67%	0.667	63%	0.632	S	S	*	*			trans	-134.6	92.7	172.1	-173.4	0	0	0	0	109.6
654	S	28.8	Very low	35.6	Very low	90 Å²	90	102 Å²	102	63%	0.629	62%	0.619	S	S	*	*			trans	-80.1	130.6	174.4	-62.9	0	0	0	0	110.4	T656	S654-T656 PolarHBondContact O-N 3.24Å
655	P	33.1	Very low	37.3	Very low	106 Å²	106	100.5 Å²	100.5	69%	0.688	61%	0.608	S	S	*	*			trans	-72.8	92.7	167	29.9	-32.3	0	0	0	109.3	S657	P655-S657 VanDerWaalsContact C-N 3.28Å; P655-S657 PolarHBondContact O-N 3.42Å
656	T	27.6	Very low	39.5	Very low	105 Å²	105	100.8 Å²	100.8	64%	0.644	61%	0.613	S	S	*	*			trans	-77.9	73.9	178.7	51	0	0	0	0	111.5	S654	S654-T656 PolarHBondContact O-N 3.24Å
657	S	32.9	Very low	42.3	Very low	100 Å²	100	96.1 Å²	96.1	70%	0.699	59%	0.585	S	S	*	*			trans	-106.7	87.5	165.1	56.8	0	0	0	0	109.7	P655 H659	P655-S657 VanDerWaalsContact C-N 3.28Å; P655-S657 PolarHBondContact O-N 3.42Å; S657-H659 PolarHBondContact O-N 3.38Å
658	T	30.8	Very low	45.3	Very low	121 Å²	121	90.4 Å²	90.4	74%	0.742	56%	0.556	S	S	*	*			trans	-76.1	69.8	176.9	49.4	0	0	0	0	112
659	H	32.9	Very low	48	Very low	121 Å²	121	85.8 Å²	85.8	56%	0.56	52%	0.524	S	S	*	.	S	Bend	trans	-134.6	128.9	141.8	-96.4	-76.9	0	0	0	107.1	S657 Q661	S657-H659 PolarHBondContact O-N 3.38Å; H659-Q661 PolarHBondContact O-N 3.43Å
660	G	30.9	Very low	51.1	Low	16 Å²	16	77.7 Å²	77.7	17%	0.165	49%	0.489	C	S	.	.			trans	-63.3	101.4	178	0	0	0	0	0	110.1	R177	R177-G660 PolarHBondContact NE-O 2.86Å; R177-G660 PolarHBondContact NH2-O 2.94Å
661	Q	40.6	Very low	54.1	Low	155 Å²	155	68.8 Å²	68.8	72%	0.724	45%	0.45	S	S	*	.			trans	-93	148.6	164.5	-68.9	-170	-0.9	0	0	109.6	H659 S663	H659-Q661 PolarHBondContact O-N 3.43Å; Q661-S663 PolarHBondContact O-N 3.48Å
662	T	39.6	Very low	57.2	Low	86 Å²	86	65 Å²	65	53%	0.528	41%	0.414	S	S	.	.			trans	-59.1	118.3	170.2	26.6	0	0	0	0	107.5	R177 G664	R177-T662 PolarHBondContact NH1-OG1 2.86Å; R177-T662 VanDerWaalsContact NH2-N 3.14Å; T662-G664 PolarHBondContact O-N 2.85Å
663	S	51.5	Low	60.5	Low	106 Å²	106	62.1 Å²	62.1	74%	0.741	38%	0.384	S	S	*	.	S	Bend	trans	-79	41.8	-157.7	51.9	0	0	0	0	115.4	Q661 R727	Q661-S663 PolarHBondContact O-N 3.48Å; S663-R727 PolarHBondContact O-NH2 3.46Å
664	G	69.9	Low	63.6	Low	29 Å²	29	59.1 Å²	59.1	30%	0.299	36%	0.362	S	S	.	.			trans	-67.9	162.9	156.9	0	0	0	0	0	111.5	T662 E725	T662-G664 PolarHBondContact O-N 2.85Å; G664-E725 WeakPolarHBondContact CA-OE2 3.23Å
665	S	86.7	Confident	66.7	Low	8 Å²	8	54.8 Å²	54.8	6%	0.056	33%	0.332	C	S	.	.			trans	-86.4	147.2	172.3	163	0	0	0	0	110.6	F667 E725 S726	S665-F667 PolarHBondContact O-N 3.16Å; S665-F667 WeakPolarHBondContact OG-CD2 3.2Å; S665-F667 PolarHBondContact OG-N 3.49Å; S665-E725 WeakPolarHBondContact CB-O 3.44Å; S665-S726 WeakPolarHBondContact CB-O 3.39Å; S665-S726 PolarHBondContact OG-O 3.26Å
666	P	89	Confident	69.4	Low	63 Å²	63	52.5 Å²	52.5	41%	0.409	31%	0.312	S	S	.	.	S	Bend	trans	-68.4	-11.3	176.1	30.3	-36.5	0	0	0	113.4	T668 M758 L762	P666-T668 VanDerWaalsContact C-N 3.29Å; P666-T668 PolarHBondContact O-N 3.27Å; P666-M758 HydrophobicContact CG-SD 4.34Å; P666-L762 HydrophobicContact CB-CD1 4.16Å; P666-L762 HydrophobicContact CB-CD2 3.93Å; P666-L762 HydrophobicContact CG-CD1 3.84Å; P666-L762 HydrophobicContact CG-CD2 4.09Å
667	F	92	Very high	72.4	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	29%	0.289	C	S	.	.			trans	-76.8	76.9	-179.2	-64.1	-67	0	0	0	112.4	S665 W724 E725 S726 L752 L753 M758 L761 L762 F785	S665-F667 PolarHBondContact O-N 3.16Å; S665-F667 WeakPolarHBondContact OG-CD2 3.2Å; S665-F667 PolarHBondContact OG-N 3.49Å; F667-W724 CarbonylContact O-C 3.42Å; F667-E725 PolarHBondContact O-N 3.14Å; F667-E725 VanDerWaalsContact O-N 3.07Å; F667-S726 PolarHBondContact O-N 3.17Å; F667-L752 HydrophobicContact CB-CD1 4.31Å; F667-L752 HydrophobicContact CD2-CB 3.59Å; F667-L752 HydrophobicContact CD2-CD1 4.28Å; F667-L752 HydrophobicContact CE2-CB 3.71Å; F667-L752 WeakPolarHBondContact CE2-O 3.3Å; F667-L752 HydrophobicContact CG-CB 4.31Å; F667-L752 HydrophobicContact CG-CD1 4.26Å; F667-L752 HydrophobicContact CZ-CB 4.48Å; F667-L753 HydrophobicContact CD2-CD2 4.41Å; F667-L753 HydrophobicContact CE2-CD2 4.31Å; F667-M758 HydrophobicContact CE2-CB 4.47Å; F667-M758 HydrophobicContact CE2-CG 3.86Å; F667-M758 HydrophobicContact CZ-CB 4.33Å; F667-M758 HydrophobicContact CZ-CG 3.81Å; F667-L761 HydrophobicContact CE1-CB 3.71Å; F667-L761 HydrophobicContact CE1-CD1 3.89Å; F667-L761 HydrophobicContact CE1-CG 4.49Å; F667-L761 HydrophobicContact CZ-CB 4.06Å; F667-L761 HydrophobicContact CZ-CD1 4.06Å; F667-L762 HydrophobicContact CD1-CD2 4.32Å; F667-L762 HydrophobicContact CE1-CD2 3.8Å; F667-L762 HydrophobicContact CE1-CG 4.22Å; F667-L762 HydrophobicContact CZ-CD2 4.14Å; F667-L762 HydrophobicContact CZ-CG 4.19Å; F667-F785 HydrophobicContact CB-CE2 4.37Å; F667-F785 HydrophobicContact CB-CZ 4.47Å; F667-F785 AromaticContact CD1-CD1 3.81Å; F667-F785 HydrophobicContact CD1-CD1 3.81Å; F667-F785 AromaticContact CD1-CD2 3.87Å; F667-F785 HydrophobicContact CD1-CD2 3.87Å; F667-F785 AromaticContact CD1-CE1 3.86Å; F667-F785 HydrophobicContact CD1-CE1 3.86Å; F667-F785 AromaticContact CD1-CE2 3.94Å; F667-F785 HydrophobicContact CD1-CE2 3.94Å; F667-F785 AromaticContact CD1-CG 3.81Å; F667-F785 HydrophobicContact CD1-CG 3.81Å; F667-F785 AromaticContact CD1-CZ 3.93Å; F667-F785 HydrophobicContact CD1-CZ 3.93Å; F667-F785 HydrophobicContact CE1-CB 4.46Å; F667-F785 AromaticContact CE1-CD1 3.92Å; F667-F785 HydrophobicContact CE1-CD1 3.92Å; F667-F785 HydrophobicContact CE1-CE1 4.29Å; F667-F785 HydrophobicContact CE1-CG 4.07Å
668	T	91.9	Very high	75.2	Confident	32 Å²	32	44.6 Å²	44.6	20%	0.196	26%	0.258	C	S	.	.			trans	-123.4	113.1	167.3	-52.7	0	0	0	0	109.6	P666 V723 W724 E725 M788	P666-T668 VanDerWaalsContact C-N 3.29Å; P666-T668 PolarHBondContact O-N 3.27Å; T668-V723 CarbonylContact C-O 3.6Å; T668-V723 VanDerWaalsContact CA-O 3.3Å; T668-V723 WeakPolarHBondContact CA-O 3.36Å; T668-W724 HydrophobicContact CG2-CB 4.05Å; T668-W724 HydrophobicContact CG2-CG 4.31Å; T668-E725 PolarHBondContact OG1-N 3.09Å; T668-M788 HydrophobicContact CG2-CG 3.98Å; T668-M788 HydrophobicContact CG2-SD 4.08Å; T668-M788 WeakPolarHBondContact O-CG 3.16Å; T668-M788 PolarHBondContact O-N 3.34Å; T668-M788 VanDerWaalsContact O-N 3.15Å
669	G	90.6	Very high	77.9	Confident	4 Å²	4	43.3 Å²	43.3	4%	0.041	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	150.9	-145.9	-167.5	0	0	0	0	0	112	V723 L786 M791	G669-V723 PolarHBondContact N-O 2.82Å; G669-V723 WeakPolarHBondContact O-CG2 2.93Å; G669-V723 PolarHBondContact O-N 3.34Å; G669-L786 CarbonylContact C-O 3.59Å; G669-L786 WeakPolarHBondContact CA-O 3.33Å; G669-M791 WeakPolarHBondContact CA-SD 3.43Å
670	L	91.6	Very high	80.5	Confident	19 Å²	19	45.2 Å²	45.2	10%	0.099	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	118.4	-178.4	-161.4	69	0	0	0	110.5	E720 F785 L786 M791 I809	L670-E720 HydrophobicContact CD1-CB 4.09Å; L670-E720 HydrophobicContact CD2-CB 4Å; L670-E720 HydrophobicContact CD2-CG 3.9Å; L670-E720 HydrophobicContact CG-CB 4.15Å; L670-E720 HydrophobicContact CG-CG 4.39Å; L670-F785 WeakPolarHBondContact O-CA 3.45Å; L670-F785 VanDerWaalsContact O-CD2 3.3Å; L670-F785 WeakPolarHBondContact O-CD2 3.36Å; L670-L786 HydrophobicContact CB-CB 4.43Å; L670-L786 PolarHBondContact N-O 3.2Å; L670-L786 PolarHBondContact O-N 3.03Å; L670-M791 HydrophobicContact CB-CE 3.91Å; L670-M791 HydrophobicContact CB-CG 4.23Å; L670-M791 HydrophobicContact CB-SD 3.76Å; L670-M791 HydrophobicContact CD1-CE 4.18Å; L670-M791 HydrophobicContact CG-CE 4.49Å; L670-M791 PolarHBondContact N-SD 3.06Å; L670-M791 VanDerWaalsContact N-SD 3.36Å; L670-I809 HydrophobicContact CD2-CD1 4.16Å
671	L	94.3	Very high	83.1	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	118.4	172.6	-177.7	68.5	0	0	0	109.2	I673 V696 I721 V723 V729 L752	L671-I673 HydrophobicContact CD2-CD1 3.86Å; L671-I673 HydrophobicContact CD2-CG1 4.22Å; L671-I673 HydrophobicContact CG-CD1 4.22Å; L671-I673 HydrophobicContact CG-CG1 4Å; L671-V696 HydrophobicContact CD2-CG2 4.41Å; L671-I721 PolarHBondContact N-O 3.42Å; L671-I721 PolarHBondContact O-N 2.86Å; L671-V723 HydrophobicContact CB-CG1 3.7Å; L671-V723 HydrophobicContact CB-CG2 4.01Å; L671-V723 HydrophobicContact CD2-CG1 4.07Å; L671-V729 HydrophobicContact CD2-CG2 3.64Å; L671-L752 HydrophobicContact CD1-CD2 4.09Å; L671-L752 HydrophobicContact CD2-CD1 4.41Å; L671-L752 HydrophobicContact CD2-CD2 4.41Å
672	I	93.3	Very high	84.8	Confident	33 Å²	33	45.4 Å²	45.4	17%	0.169	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	123	177.7	-54.1	177.1	0	0	0	108.4	F719 E720 L783 G784 L786 I809	I672-F719 WeakPolarHBondContact CA-O 3.39Å; I672-E720 HydrophobicContact CG1-CG 4.2Å; I672-L783 CarbonylContact O-C 3.54Å; I672-L783 WeakPolarHBondContact O-CA 3.31Å; I672-G784 PolarHBondContact N-O 3.12Å; I672-G784 PolarHBondContact O-N 2.93Å; I672-L786 HydrophobicContact CD1-CD1 3.65Å; I672-L786 HydrophobicContact CG1-CD1 4.47Å; I672-I809 HydrophobicContact CD1-CD1 3.65Å; I672-I809 HydrophobicContact CD1-CG1 4.13Å; I672-I809 HydrophobicContact CG1-CD1 4.44Å
673	I	95.1	Very high	86.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	112.4	177.9	-49.7	-170	0	0	0	109.6	L671 I675 I694 S718 F719 I721 V729 L783	L671-I673 HydrophobicContact CD2-CD1 3.86Å; L671-I673 HydrophobicContact CD2-CG1 4.22Å; L671-I673 HydrophobicContact CG-CD1 4.22Å; L671-I673 HydrophobicContact CG-CG1 4Å; I673-I675 HydrophobicContact CG2-CG1 4.27Å; I673-I694 HydrophobicContact CB-CD1 4.39Å; I673-I694 HydrophobicContact CD1-CG2 3.89Å; I673-I694 HydrophobicContact CG2-CD1 4.13Å; I673-S718 CarbonylContact O-C 3.58Å; I673-S718 WeakPolarHBondContact O-CA 3.46Å; I673-F719 PolarHBondContact N-O 3.07Å; I673-F719 PolarHBondContact O-N 3.3Å; I673-I721 HydrophobicContact CD1-CD1 4.01Å; I673-I721 HydrophobicContact CG1-CD1 4.41Å; I673-V729 HydrophobicContact CD1-CG1 3.73Å; I673-L783 HydrophobicContact CB-CD2 4.26Å; I673-L783 HydrophobicContact CD1-CD2 4.1Å; I673-L783 HydrophobicContact CG1-CD2 3.72Å; I673-L783 HydrophobicContact CG2-CD2 4.05Å
674	Q	92.5	Very high	87	Confident	47 Å²	47	41.3 Å²	41.3	22%	0.22	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	116.8	177.1	175.4	165.8	70.8	0	0	110.1	F676 S718 L781 R782	Q674-F676 HydrophobicContact CG-CD1 4.35Å; Q674-F676 HydrophobicContact CG-CE1 3.86Å; Q674-F676 HydrophobicContact CG-CE2 4.14Å; Q674-F676 HydrophobicContact CG-CZ 3.75Å; Q674-S718 WeakPolarHBondContact CG-OG 3.33Å; Q674-S718 PolarHBondContact NE2-OG 2.8Å; Q674-L781 CarbonylContact O-C 3.55Å; Q674-L781 WeakPolarHBondContact O-CA 3.21Å; Q674-L781 WeakPolarHBondContact O-CB 3.04Å; Q674-R782 HydrophobicContact CB-CB 4.32Å; Q674-R782 PolarHBondContact N-O 3.39Å; Q674-R782 PolarHBondContact O-N 2.77Å
675	I	93.4	Very high	86.9	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	108.3	-179.1	-60.9	178.5	0	0	0	108.9	I673 C692 I694 T704 W715 R716 E717 L731 L779	I673-I675 HydrophobicContact CG2-CG1 4.27Å; I675-C692 HydrophobicContact CD1-CB 4.27Å; I675-I694 HydrophobicContact CD1-CD1 3.82Å; I675-I694 HydrophobicContact CD1-CG1 4.19Å; I675-T704 HydrophobicContact CD1-CG2 3.92Å; I675-W715 HydrophobicContact CG2-CB 4.19Å; I675-W715 HydrophobicContact CG2-CD2 4.33Å; I675-W715 HydrophobicContact CG2-CE3 3.8Å; I675-R716 VanDerWaalsContact O-CA 3.27Å; I675-R716 WeakPolarHBondContact O-CA 3.4Å; I675-R716 PolarHBondContact O-N 3.03Å; I675-E717 PolarHBondContact N-O 3.41Å; I675-E717 PolarHBondContact O-N 3.07Å; I675-L731 HydrophobicContact CD1-CD2 3.94Å; I675-L779 HydrophobicContact CD1-CD2 4.39Å; I675-L779 HydrophobicContact CG2-CD1 3.74Å; I675-L779 HydrophobicContact CG2-CD2 4.26Å; I675-L779 HydrophobicContact CG2-CG 4.11Å
676	F	89.5	Confident	85.8	Confident	58 Å²	58	48.9 Å²	48.9	25%	0.254	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-62.4	-179	-60.6	-79	0	0	0	111.9	Q674 Q714 W715 R716 I780 R782	Q674-F676 HydrophobicContact CG-CD1 4.35Å; Q674-F676 HydrophobicContact CG-CE1 3.86Å; Q674-F676 HydrophobicContact CG-CE2 4.14Å; Q674-F676 HydrophobicContact CG-CZ 3.75Å; F676-Q714 CarbonylContact O-C 3.59Å; F676-Q714 WeakPolarHBondContact O-CA 3.26Å; F676-W715 PolarHBondContact O-N 2.98Å; F676-R716 PolarHBondContact O-N 3.31Å; F676-I780 HydrophobicContact CB-CB 4.46Å; F676-I780 HydrophobicContact CB-CG2 4.31Å; F676-I780 WeakPolarHBondContact CB-O 3.17Å; F676-I780 HydrophobicContact CD2-CG2 4.17Å; F676-I780 PolarHBondContact N-O 3.49Å; F676-R782 HydrophobicContact CE2-CB 3.74Å; F676-R782 HydrophobicContact CZ-CB 4.22Å
677	E	91.6	Very high	84.9	Confident	34 Å²	34	51 Å²	51	16%	0.159	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	148.8	-174.3	66.2	177	-171.4	0	0	114.7	R679 F713 Q714 I780	E677-R679 HydrophobicContact CG-CG 4.4Å; E677-R679 IonicContact OE1-CZ 3.6Å; E677-R679 IonicContact OE1-NE 2.69Å; E677-R679 PolarHBondContact OE1-NE 3.04Å; E677-R679 IonicContact OE1-NH2 2.65Å; E677-R679 PolarHBondContact OE1-NH2 3.47Å; E677-F713 CarbonylContact C-O 3.59Å; E677-F713 VanDerWaalsContact CA-O 3.27Å; E677-F713 WeakPolarHBondContact CA-O 3.39Å; E677-Q714 HydrophobicContact CB-CB 4.39Å; E677-Q714 HydrophobicContact CB-CG 3.87Å; E677-Q714 PolarHBondContact OE2-NE2 3.05Å; E677-I780 HydrophobicContact CG-CB 3.98Å; E677-I780 HydrophobicContact CG-CG1 3.87Å; E677-I780 PolarHBondContact N-O 3.17Å; E677-I780 PolarHBondContact O-N 2.89Å
678	G	90.6	Very high	84.2	Confident	5 Å²	5	51.9 Å²	51.9	5%	0.052	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	116.7	170.7	0	0	0	0	0	112.5	F713	G678-F713 PolarHBondContact N-O 2.97Å
679	R	88.6	Confident	84.1	Confident	93 Å²	93	51.8 Å²	51.8	35%	0.351	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	145.7	175.8	-62.7	-176.5	-179.5	165.8	3	111.4	E677 L681 Q778 I780	E677-R679 HydrophobicContact CG-CG 4.4Å; E677-R679 IonicContact OE1-CZ 3.6Å; E677-R679 IonicContact OE1-NE 2.69Å; E677-R679 PolarHBondContact OE1-NE 3.04Å; E677-R679 IonicContact OE1-NH2 2.65Å; E677-R679 PolarHBondContact OE1-NH2 3.47Å; R679-L681 PolarHBondContact O-N 3.32Å; R679-Q778 HydrophobicContact CB-CB 4.29Å; R679-Q778 PolarHBondContact N-O 3.37Å; R679-Q778 PolarHBondContact O-N 2.88Å; R679-I780 HydrophobicContact CG-CG1 4.24Å
680	F	86.9	Confident	84.2	Confident	161 Å²	161	51.6 Å²	51.6	71%	0.706	26%	0.258	S	S	*	.	S	Bend	trans	55.6	20.9	176.7	-46.7	-69.1	0	0	0	115.4
681	L	86.6	Confident	84.3	Confident	19 Å²	19	51.6 Å²	51.6	10%	0.099	26%	0.257	C	S	.	.			trans	-65.4	138.5	175.8	-54.5	-171.2	0	0	0	110.5	R679 A683 L690 F713 W715 I733 L773	R679-L681 PolarHBondContact O-N 3.32Å; L681-A683 PolarHBondContact O-N 3.37Å; L681-L690 HydrophobicContact CB-CD1 3.97Å; L681-L690 HydrophobicContact CD1-CD1 3.83Å; L681-F713 HydrophobicContact CB-CD2 4.29Å; L681-F713 HydrophobicContact CB-CE2 4.34Å; L681-F713 HydrophobicContact CD1-CB 4.19Å; L681-F713 HydrophobicContact CD1-CD2 4.17Å; L681-F713 HydrophobicContact CD1-CG 4.09Å; L681-W715 HydrophobicContact CD1-CH2 3.86Å; L681-W715 HydrophobicContact CD1-CZ3 4.29Å; L681-I733 HydrophobicContact CD1-CD1 3.74Å; L681-I733 HydrophobicContact CD1-CG2 4.44Å; L681-I733 HydrophobicContact CD2-CD1 3.83Å; L681-I733 HydrophobicContact CG-CD1 4.47Å; L681-L773 HydrophobicContact CD2-CD1 3.7Å
682	R	74.9	Confident	84.3	Confident	156 Å²	156	51.6 Å²	51.6	59%	0.589	26%	0.257	S	S	*	.			trans	-90.6	76.1	-176.8	-83	-175.2	159.9	-174.8	-7.1	111	H746	R682-H746 PolarHBondContact N-CE1 3.06Å; R682-H746 VanDerWaalsContact N-CE1 3.32Å; R682-H746 PolarHBondContact N-NE2 3.13Å
683	A	69.8	Low	84.5	Confident	21 Å²	21	50.6 Å²	50.6	17%	0.174	25%	0.252	C	S	.	.			trans	-57.9	132.9	153.4	0	0	0	0	0	109.7	L681 D688 F713	L681-A683 PolarHBondContact O-N 3.37Å; A683-D688 WeakPolarHBondContact CA-OD2 3.39Å; A683-D688 HydrophobicContact CB-CB 3.76Å; A683-F713 HydrophobicContact CB-CZ 4.21Å
684	S	67.4	Low	84.6	Confident	86 Å²	86	50.6 Å²	50.6	60%	0.601	25%	0.252	S	S	*	.	S	Bend	trans	-74.4	-50	169.8	179.2	0	0	0	0	110.2	D688	S684-D688 VanDerWaalsContact N-CG 3.3Å; S684-D688 PolarHBondContact N-OD2 2.95Å
685	N	68.1	Low	84.7	Confident	89 Å²	89	50.1 Å²	50.1	48%	0.476	25%	0.25	S	C	.	.	S	Bend	trans	-120.2	159.2	-176	-53	-2.3	0	0	0	108.7	T687 D688	N685-T687 PolarHBondContact O-N 2.95Å; N685-T687 VanDerWaalsContact O-N 3.14Å; N685-D688 WeakPolarHBondContact CB-OD1 3.39Å; N685-D688 PolarHBondContact N-OD1 3.37Å; N685-D688 WeakPolarHBondContact O-CB 3.24Å; N685-D688 PolarHBondContact O-N 3.38Å
686	D	64.5	Low	84.8	Confident	107 Å²	107	50.2 Å²	50.2	57%	0.572	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-17.1	175.2	-70.3	-39.1	0	0	0	113.4	R709	D686-R709 WeakPolarHBondContact OD1-CD 3.49Å; D686-R709 IonicContact OD1-CZ 2.65Å; D686-R709 IonicContact OD1-NE 2.74Å; D686-R709 IonicContact OD1-NH1 3.1Å; D686-R709 PolarHBondContact OD1-NH1 3.09Å
687	T	69.7	Low	85	Confident	106 Å²	106	50 Å²	50	65%	0.65	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-3.2	172.8	58.9	0	0	0	0	114.1	N685 E689	N685-T687 PolarHBondContact O-N 2.95Å; N685-T687 VanDerWaalsContact O-N 3.14Å; T687-E689 WeakPolarHBondContact O-CG 3.18Å; T687-E689 PolarHBondContact O-N 3.28Å; T687-E689 VanDerWaalsContact O-N 3.15Å
688	D	78	Confident	85	Confident	19 Å²	19	53.6 Å²	53.6	10%	0.102	28%	0.277	C	S	.	.			trans	-62.7	117.4	174.9	-81.7	43.2	0	0	0	109.4	A683 S684 N685 R745	A683-D688 WeakPolarHBondContact CA-OD2 3.39Å; A683-D688 HydrophobicContact CB-CB 3.76Å; S684-D688 VanDerWaalsContact N-CG 3.3Å; S684-D688 PolarHBondContact N-OD2 2.95Å; N685-D688 WeakPolarHBondContact CB-OD1 3.39Å; N685-D688 PolarHBondContact N-OD1 3.37Å; N685-D688 WeakPolarHBondContact O-CB 3.24Å; N685-D688 PolarHBondContact O-N 3.38Å; D688-R745 IonicContact OD2-CZ 3.64Å; D688-R745 IonicContact OD2-NE 3.13Å; D688-R745 IonicContact OD2-NH2 3.47Å; D688-R745 PolarHBondContact OD2-NH2 3.49Å
689	E	89.5	Confident	84.9	Confident	31 Å²	31	55.6 Å²	55.6	15%	0.145	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	128	173.6	-37.9	-148.6	116.4	0	0	109.4	R549 T687 V706 N708 S735 W736	R549-E689 VanDerWaalsContact CB-OE2 3.23Å; R549-E689 WeakPolarHBondContact CB-OE2 3.4Å; R549-E689 WeakPolarHBondContact CD-OE1 3.42Å; R549-E689 IonicContact NE-OE1 2.84Å; T687-E689 WeakPolarHBondContact O-CG 3.18Å; T687-E689 PolarHBondContact O-N 3.28Å; T687-E689 VanDerWaalsContact O-N 3.15Å; E689-V706 HydrophobicContact CB-CG1 3.35Å; E689-V706 HydrophobicContact CG-CG1 4.35Å; E689-N708 HydrophobicContact CB-CB 4.34Å; E689-N708 HydrophobicContact CG-CB 4Å; E689-S735 CarbonylContact O-C 3.58Å; E689-S735 WeakPolarHBondContact O-CA 3.49Å; E689-W736 PolarHBondContact O-N 2.86Å
690	L	92.2	Very high	85.1	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	144	-173.7	-56.3	-175.1	0	0	0	110.8	L681 K707 F713 W715 I733 Y734 R745	L681-L690 HydrophobicContact CB-CD1 3.97Å; L681-L690 HydrophobicContact CD1-CD1 3.83Å; L690-K707 PolarHBondContact N-O 3.35Å; L690-K707 PolarHBondContact O-N 3.48Å; L690-F713 HydrophobicContact CB-CD1 4.03Å; L690-F713 HydrophobicContact CB-CE1 3.89Å; L690-F713 HydrophobicContact CD1-CD1 3.98Å; L690-F713 HydrophobicContact CD1-CE1 3.56Å; L690-F713 HydrophobicContact CD1-CE2 4.26Å; L690-F713 HydrophobicContact CD1-CZ 3.71Å; L690-F713 HydrophobicContact CG-CD1 4.15Å; L690-F713 HydrophobicContact CG-CE1 3.56Å; L690-F713 HydrophobicContact CG-CZ 4.07Å; L690-W715 HydrophobicContact CB-CZ2 4.34Å; L690-I733 HydrophobicContact CB-CG2 3.92Å; L690-I733 HydrophobicContact CD1-CG2 4.15Å; L690-I733 HydrophobicContact CG-CG2 4.46Å; L690-Y734 VanDerWaalsContact CA-O 3.27Å; L690-Y734 WeakPolarHBondContact CA-O 3.29Å; L690-R745 HydrophobicContact CD2-CG 4.06Å
691	Y	94	Very high	85.4	Confident	19 Å²	19	47.4 Å²	47.4	8%	0.075	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	152.6	168.4	67.6	-81.7	0	0	0	110.2	V693 R703 E705 V706 I733 Y734 W736 H742	Y691-V693 HydrophobicContact CD2-CG2 4.03Å; Y691-V693 HydrophobicContact CE2-CG2 3.58Å; Y691-R703 HydrophobicContact CD2-CG 3.74Å; Y691-R703 HydrophobicContact CE2-CG 4.07Å; Y691-E705 WeakPolarHBondContact CB-O 3.38Å; Y691-V706 HydrophobicContact CD1-CG2 4.15Å; Y691-V706 HydrophobicContact CG-CG2 4.39Å; Y691-I733 WeakPolarHBondContact O-CA 3.48Å; Y691-Y734 HydrophobicContact CE2-CD2 4.27Å; Y691-Y734 HydrophobicContact CE2-CG 4.49Å; Y691-Y734 PolarHBondContact N-O 3.05Å; Y691-Y734 PolarHBondContact O-N 2.92Å; Y691-W736 HydrophobicContact CD1-CB 4.07Å; Y691-W736 HydrophobicContact CE1-CB 4.14Å; Y691-H742 HydrophobicContact CE1-CB 4.39Å; Y691-H742 AromaticContact CE1-ND1 3.57Å; Y691-H742 AromaticContact CZ-ND1 3.62Å; Y691-H742 PolarHBondContact OH-ND1 2.88Å
692	C	95.1	Very high	85.8	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	135.5	173.9	-162.7	0	0	0	0	110.3	I675 R703 T704 Y732 I733	I675-C692 HydrophobicContact CD1-CB 4.27Å; C692-R703 WeakPolarHBondContact O-CA 3.47Å; C692-T704 HydrophobicContact CB-CG2 3.75Å; C692-T704 PolarHBondContact N-OG1 3.35Å; C692-T704 PolarHBondContact O-N 3.07Å; C692-T704 PolarHBondContact O-OG1 3.22Å; C692-Y732 CarbonylContact C-O 3.46Å; C692-Y732 WeakPolarHBondContact CA-O 3.41Å; C692-I733 HydrophobicContact CB-CG1 4.46Å
693	V	95.8	Very high	86.7	Confident	11 Å²	11	42.2 Å²	42.2	7%	0.067	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	137.3	165.4	168.2	0	0	0	0	107.4	Y691 E695 R703 L731 Y732 Y734	Y691-V693 HydrophobicContact CD2-CG2 4.03Å; Y691-V693 HydrophobicContact CE2-CG2 3.58Å; V693-E695 HydrophobicContact CG1-CG 4.09Å; V693-R703 HydrophobicContact CG2-CG 4.43Å; V693-L731 WeakPolarHBondContact O-CA 3.37Å; V693-Y732 PolarHBondContact N-O 2.58Å; V693-Y732 PolarHBondContact O-N 2.84Å; V693-Y734 HydrophobicContact CB-CD2 4.27Å; V693-Y734 HydrophobicContact CB-CE2 4.06Å; V693-Y734 HydrophobicContact CG2-CD2 3.8Å; V693-Y734 HydrophobicContact CG2-CE2 3.86Å
694	I	97.2	Very high	87.9	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	121.8	175.3	-52.4	179.9	0	0	0	107.9	I673 I675 R701 A702 F719 I721 V729 L731	I673-I694 HydrophobicContact CB-CD1 4.39Å; I673-I694 HydrophobicContact CD1-CG2 3.89Å; I673-I694 HydrophobicContact CG2-CD1 4.13Å; I675-I694 HydrophobicContact CD1-CD1 3.82Å; I675-I694 HydrophobicContact CD1-CG1 4.19Å; I694-R701 PolarHBondContact O-N 3.22Å; I694-A702 HydrophobicContact CB-CB 4.19Å; I694-A702 HydrophobicContact CD1-CB 4.09Å; I694-A702 HydrophobicContact CG1-CB 4.4Å; I694-A702 PolarHBondContact N-O 3.41Å; I694-A702 PolarHBondContact O-N 3.1Å; I694-F719 HydrophobicContact CD1-CD2 3.79Å; I694-F719 HydrophobicContact CD1-CE2 4.39Å; I694-F719 HydrophobicContact CD1-CG 4.32Å; I694-I721 HydrophobicContact CG2-CD1 3.91Å; I694-V729 HydrophobicContact CG2-CG1 4.01Å; I694-L731 HydrophobicContact CG1-CD2 4.21Å
695	E	96	Very high	88.9	Confident	37 Å²	37	38.7 Å²	38.7	17%	0.173	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	145.1	170.4	-53.1	-171.3	167.7	0	0	109.8	V693 E699 H700 V729 E730 Y732	V693-E695 HydrophobicContact CG1-CG 4.09Å; E695-E699 CarbonylContact C-O 3.59Å; E695-E699 WeakPolarHBondContact CA-O 3.49Å; E695-H700 HydrophobicContact CG-CB 4.44Å; E695-V729 CarbonylContact O-C 3.45Å; E695-V729 WeakPolarHBondContact O-CA 3.22Å; E695-E730 HydrophobicContact CB-CB 4.42Å; E695-E730 PolarHBondContact N-O 3.36Å; E695-E730 PolarHBondContact O-N 3.04Å; E695-Y732 HydrophobicContact CB-CE2 4.42Å; E695-Y732 HydrophobicContact CG-CD2 4.04Å; E695-Y732 HydrophobicContact CG-CE2 3.98Å; E695-Y732 WeakPolarHBondContact OE2-CE2 3.41Å
696	V	95	Very high	89.9	Confident	3 Å²	3	35 Å²	35	2%	0.018	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	123.7	170.8	-174.9	0	0	0	0	107.6	L671 T698 E699 R701 I721 V723 V728 V729	L671-V696 HydrophobicContact CD2-CG2 4.41Å; V696-T698 PolarHBondContact O-N 2.93Å; V696-E699 PolarHBondContact N-O 3.26Å; V696-E699 PolarHBondContact O-N 3.48Å; V696-R701 HydrophobicContact CB-CG 4.02Å; V696-R701 HydrophobicContact CG2-CB 4.43Å; V696-R701 HydrophobicContact CG2-CG 3.97Å; V696-I721 HydrophobicContact CG2-CG2 4.07Å; V696-V723 HydrophobicContact CG1-CG1 4Å; V696-V728 CarbonylContact C-O 3.55Å; V696-V728 WeakPolarHBondContact CA-O 3.22Å; V696-V729 HydrophobicContact CG2-CG2 4.43Å
697	D	93.1	Very high	91.1	Very high	52 Å²	52	31.3 Å²	31.3	28%	0.278	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.1	44.9	-173.1	-49.9	-57.7	0	0	0	113.1	E699 S726 R727 V728	D697-E699 VanDerWaalsContact C-N 3.26Å; D697-E699 PolarHBondContact O-N 3.26Å; D697-S726 WeakPolarHBondContact OD2-CA 3.29Å; D697-S726 WeakPolarHBondContact OD2-CB 3.5Å; D697-S726 PolarHBondContact OD2-OG 3.48Å; D697-R727 PolarHBondContact OD1-N 3.41Å; D697-R727 PolarHBondContact OD2-N 3.1Å; D697-V728 PolarHBondContact N-O 3.36Å; D697-V728 PolarHBondContact OD1-N 3.17Å
698	T	91.1	Very high	91.9	Very high	111 Å²	111	27.3 Å²	27.3	68%	0.681	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.8	9.2	-176.2	69.5	0	0	0	0	116.6	V696	V696-T698 PolarHBondContact O-N 2.93Å
699	E	90.2	Very high	92.1	Very high	47 Å²	47	32.9 Å²	32.9	22%	0.22	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	126.6	168.4	-60.6	-161.4	114.4	0	0	111	E695 V696 D697 R701 K972	E695-E699 CarbonylContact C-O 3.59Å; E695-E699 WeakPolarHBondContact CA-O 3.49Å; V696-E699 PolarHBondContact N-O 3.26Å; V696-E699 PolarHBondContact O-N 3.48Å; D697-E699 VanDerWaalsContact C-N 3.26Å; D697-E699 PolarHBondContact O-N 3.26Å; E699-R701 WeakPolarHBondContact O-CG 3.4Å; E699-R701 PolarHBondContact O-N 3.49Å; E699-R701 IonicContact OE2-CZ 3.62Å; E699-R701 IonicContact OE2-NE 3.8Å; E699-R701 IonicContact OE2-NH2 3.41Å; E699-R701 PolarHBondContact OE2-NH2 3.13Å; E699-K972 WeakPolarHBondContact OE1-CE 3.49Å; E699-K972 IonicContact OE1-NZ 2.74Å; E699-K972 PolarHBondContact OE1-NZ 3.44Å
700	H	91.4	Very high	91.8	Very high	67 Å²	67	35.4 Å²	35.4	31%	0.31	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	122.8	171.5	177.6	-155.4	0	0	0	110.7	E695 A702 L857	E695-H700 HydrophobicContact CG-CB 4.44Å; H700-A702 PolarHBondContact NE2-O 2.85Å; H700-L857 HydrophobicContact CB-CD2 4.43Å; H700-L857 WeakPolarHBondContact O-CD2 3.42Å
701	R	94.4	Very high	91.3	Very high	14 Å²	14	36.9 Å²	36.9	5%	0.053	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	-25.1	-175.9	-64.1	-47.8	-171.3	128.1	-4.3	115.1	I694 V696 E699 I721 L857 C858	I694-R701 PolarHBondContact O-N 3.22Å; V696-R701 HydrophobicContact CB-CG 4.02Å; V696-R701 HydrophobicContact CG2-CB 4.43Å; V696-R701 HydrophobicContact CG2-CG 3.97Å; E699-R701 WeakPolarHBondContact O-CG 3.4Å; E699-R701 PolarHBondContact O-N 3.49Å; E699-R701 IonicContact OE2-CZ 3.62Å; E699-R701 IonicContact OE2-NE 3.8Å; E699-R701 IonicContact OE2-NH2 3.41Å; E699-R701 PolarHBondContact OE2-NH2 3.13Å; R701-I721 HydrophobicContact CB-CD1 4.04Å; R701-I721 HydrophobicContact CB-CG1 4.23Å; R701-I721 HydrophobicContact CB-CG2 3.65Å; R701-I721 HydrophobicContact CG-CG2 3.75Å; R701-L857 CarbonylContact O-C 3.52Å; R701-L857 WeakPolarHBondContact O-CA 3.41Å; R701-C858 PolarHBondContact O-N 3.43Å
702	A	95.5	Very high	90.8	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.008	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	156.6	179.5	0	0	0	0	0	112.8	I694 H700 F719 I721	I694-A702 HydrophobicContact CB-CB 4.19Å; I694-A702 HydrophobicContact CD1-CB 4.09Å; I694-A702 HydrophobicContact CG1-CB 4.4Å; I694-A702 PolarHBondContact N-O 3.41Å; I694-A702 PolarHBondContact O-N 3.1Å; H700-A702 PolarHBondContact NE2-O 2.85Å; A702-F719 HydrophobicContact CB-CB 3.97Å; A702-F719 HydrophobicContact CB-CD1 3.5Å; A702-F719 HydrophobicContact CB-CD2 4.34Å; A702-F719 HydrophobicContact CB-CE1 4.08Å; A702-F719 HydrophobicContact CB-CG 3.65Å; A702-I721 HydrophobicContact CB-CD1 4.08Å; A702-I721 HydrophobicContact CB-CG1 4.47Å
703	R	93.3	Very high	90.4	Very high	66 Å²	66	44 Å²	44	25%	0.249	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	130.4	-179.7	-171.1	-176.5	71	-168.9	2.9	110.2	E545 Y691 C692 V693 F719	E545-R703 PolarHBondContact O-NH1 2.81Å; E545-R703 PolarHBondContact O-NH2 3.45Å; Y691-R703 HydrophobicContact CD2-CG 3.74Å; Y691-R703 HydrophobicContact CE2-CG 4.07Å; C692-R703 WeakPolarHBondContact O-CA 3.47Å; V693-R703 HydrophobicContact CG2-CG 4.43Å; R703-F719 WeakPolarHBondContact O-CZ 3.5Å
704	T	93.7	Very high	90.1	Very high	5 Å²	5	46.2 Å²	46.2	3%	0.031	24%	0.235	C	C	.	.			trans	-76.4	171.2	173.6	70.8	0	0	0	0	112.2	I675 C692 W715 E717 F719	I675-T704 HydrophobicContact CD1-CG2 3.92Å; C692-T704 HydrophobicContact CB-CG2 3.75Å; C692-T704 PolarHBondContact N-OG1 3.35Å; C692-T704 PolarHBondContact O-N 3.07Å; C692-T704 PolarHBondContact O-OG1 3.22Å; T704-W715 VanDerWaalsContact CB-CD1 3.44Å; T704-W715 HydrophobicContact CG2-CG 4.2Å; T704-W715 PolarHBondContact OG1-NE1 3.47Å; T704-W715 VanDerWaalsContact OG1-NE1 3.1Å; T704-E717 WeakPolarHBondContact CB-OE1 2.77Å; T704-F719 HydrophobicContact CG2-CE2 3.97Å; T704-F719 HydrophobicContact CG2-CZ 4.28Å
705	E	88.6	Confident	89.8	Confident	28 Å²	28	46.5 Å²	46.5	13%	0.131	24%	0.236	C	C	.	.			trans	-56.1	158.2	160.1	-68.8	172.7	-145.3	0	0	113.8	Y552 Y691 K707 W715 E717	Y552-E705 HydrophobicContact CD1-CG 3.76Å; Y552-E705 HydrophobicContact CD2-CG 4.35Å; Y552-E705 HydrophobicContact CE1-CB 4.42Å; Y552-E705 HydrophobicContact CE1-CG 3.29Å; Y552-E705 WeakPolarHBondContact CE1-OE1 3.38Å; Y552-E705 WeakPolarHBondContact CE1-OE2 3.4Å; Y552-E705 HydrophobicContact CE2-CG 3.89Å; Y552-E705 HydrophobicContact CG-CG 4.28Å; Y552-E705 VanDerWaalsContact CZ-OE1 3.23Å; Y552-E705 VanDerWaalsContact OH-CD 3.26Å; Y552-E705 PolarHBondContact OH-OE1 3.14Å; Y691-E705 WeakPolarHBondContact CB-O 3.38Å; E705-K707 HydrophobicContact CB-CD 4.22Å; E705-K707 HydrophobicContact CB-CG 4.44Å; E705-K707 VanDerWaalsContact CD-NZ 3.31Å; E705-K707 IonicContact OE1-NZ 2.69Å; E705-K707 WeakPolarHBondContact OE2-CE 3.35Å; E705-K707 IonicContact OE2-NZ 2.8Å; E705-K707 PolarHBondContact OE2-NZ 2.76Å; E705-W715 PolarHBondContact O-NE1 2.77Å; E705-E717 VanDerWaalsContact CB-OE1 3.28Å; E705-E717 WeakPolarHBondContact CB-OE1 3.41Å; E705-E717 WeakPolarHBondContact CG-OE1 3.39Å; E705-E717 PolarHBondContact N-OE1 2.69Å; E705-E717 PolarHBondContact N-OE2 3.27Å
706	V	90.4	Very high	89.4	Confident	10 Å²	10	51.2 Å²	51.2	6%	0.061	25%	0.252	C	S	.	.			trans	-81.8	110.9	166.1	177.4	0	0	0	0	109.3	R549 E689 Y691 W736	R549-V706 HydrophobicContact CB-CG1 4.25Å; E689-V706 HydrophobicContact CB-CG1 3.35Å; E689-V706 HydrophobicContact CG-CG1 4.35Å; Y691-V706 HydrophobicContact CD1-CG2 4.15Å; Y691-V706 HydrophobicContact CG-CG2 4.39Å; V706-W736 HydrophobicContact CG1-CB 3.97Å; V706-W736 HydrophobicContact CG1-CD2 4.33Å; V706-W736 HydrophobicContact CG1-CG 4.09Å; V706-W736 HydrophobicContact CG2-CB 4.23Å; V706-W736 HydrophobicContact CG2-CG 3.99Å
707	K	88.7	Confident	89.2	Confident	30 Å²	30	51.2 Å²	51.2	13%	0.13	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	139.3	178.6	-54.6	-71.3	-160.1	-178.5	0	110.1	L690 E705 A711 F713 Q714 W715	L690-K707 PolarHBondContact N-O 3.35Å; L690-K707 PolarHBondContact O-N 3.48Å; E705-K707 HydrophobicContact CB-CD 4.22Å; E705-K707 HydrophobicContact CB-CG 4.44Å; E705-K707 VanDerWaalsContact CD-NZ 3.31Å; E705-K707 IonicContact OE1-NZ 2.69Å; E705-K707 WeakPolarHBondContact OE2-CE 3.35Å; E705-K707 IonicContact OE2-NZ 2.8Å; E705-K707 PolarHBondContact OE2-NZ 2.76Å; K707-A711 HydrophobicContact CB-CB 4.39Å; K707-F713 WeakPolarHBondContact O-CD1 3.45Å; K707-F713 WeakPolarHBondContact O-CE1 3.47Å; K707-Q714 WeakPolarHBondContact CE-O 3.38Å; K707-W715 HydrophobicContact CG-CD2 4.45Å; K707-W715 HydrophobicContact CG-CG 4.08Å; K707-W715 VanDerWaalsContact CG-NE1 3.33Å; K707-W715 PolarHBondContact NZ-O 3.49Å
708	N	86.7	Confident	89.2	Confident	23 Å²	23	49.1 Å²	49.1	12%	0.123	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	176.3	177.3	76.4	2	0	0	0	112.6	R549 E689 A710 A711 F713	R549-N708 PolarHBondContact NH1-ND2 2.95Å; R549-N708 PolarHBondContact NH1-OD1 2.8Å; E689-N708 HydrophobicContact CB-CB 4.34Å; E689-N708 HydrophobicContact CG-CB 4Å; N708-A710 VanDerWaalsContact C-N 3.25Å; N708-A710 PolarHBondContact O-N 3.04Å; N708-A710 WeakPolarHBondContact OD1-CB 3.38Å; N708-A710 PolarHBondContact OD1-N 3.12Å; N708-A711 WeakPolarHBondContact O-CB 3.23Å; N708-A711 PolarHBondContact O-N 3.14Å; N708-A711 PolarHBondContact OD1-N 3.28Å; N708-F713 VanDerWaalsContact C-CE1 3.42Å
709	R	82.2	Confident	89.4	Confident	135 Å²	135	43.9 Å²	43.9	51%	0.509	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-57.5	-34.3	-178.7	-156.7	-170.5	-167.8	175.1	3.8	113.5	D686 A711 K712 F713	D686-R709 WeakPolarHBondContact OD1-CD 3.49Å; D686-R709 IonicContact OD1-CZ 2.65Å; D686-R709 IonicContact OD1-NE 2.74Å; D686-R709 IonicContact OD1-NH1 3.1Å; D686-R709 PolarHBondContact OD1-NH1 3.09Å; R709-A711 VanDerWaalsContact C-N 3.3Å; R709-A711 PolarHBondContact O-N 2.96Å; R709-K712 WeakPolarHBondContact O-CA 3.42Å; R709-K712 PolarHBondContact O-N 2.84Å; R709-F713 HydrophobicContact CB-CE2 4.3Å; R709-F713 HydrophobicContact CB-CZ 3.96Å; R709-F713 HydrophobicContact CG-CE2 4.13Å; R709-F713 HydrophobicContact CG-CZ 4.27Å
710	A	82.3	Confident	89.5	Confident	85 Å²	85	42.6 Å²	42.6	70%	0.702	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-66.3	-30.5	177.2	0	0	0	0	0	112.9	N708 K712	N708-A710 VanDerWaalsContact C-N 3.25Å; N708-A710 PolarHBondContact O-N 3.04Å; N708-A710 WeakPolarHBondContact OD1-CB 3.38Å; N708-A710 PolarHBondContact OD1-N 3.12Å; A710-K712 PolarHBondContact O-N 3.07Å
711	A	81.6	Confident	89.7	Confident	31 Å²	31	39.4 Å²	39.4	26%	0.256	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-78.2	6.1	169.9	0	0	0	0	0	113.4	K707 N708 R709 F713 Q714	K707-A711 HydrophobicContact CB-CB 4.39Å; N708-A711 WeakPolarHBondContact O-CB 3.23Å; N708-A711 PolarHBondContact O-N 3.14Å; N708-A711 PolarHBondContact OD1-N 3.28Å; R709-A711 VanDerWaalsContact C-N 3.3Å; R709-A711 PolarHBondContact O-N 2.96Å; A711-F713 PolarHBondContact O-N 2.92Å; A711-Q714 PolarHBondContact O-N 2.88Å
712	K	84.5	Confident	89.6	Confident	156 Å²	156	39.6 Å²	39.6	68%	0.678	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	23.6	-177.9	-58.1	178	-177.8	175.1	0	114	R709 A710 Q714	R709-K712 WeakPolarHBondContact O-CA 3.42Å; R709-K712 PolarHBondContact O-N 2.84Å; A710-K712 PolarHBondContact O-N 3.07Å; K712-Q714 HydrophobicContact CB-CG 4.29Å; K712-Q714 PolarHBondContact O-N 2.87Å
713	F	87.2	Confident	89.5	Confident	12 Å²	12	39.7 Å²	39.7	5%	0.053	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.1	35.6	-170.6	-49.7	-66.1	0	0	0	113.6	E677 G678 L681 A683 L690 K707 N708 R709 A711 W715	E677-F713 CarbonylContact C-O 3.59Å; E677-F713 VanDerWaalsContact CA-O 3.27Å; E677-F713 WeakPolarHBondContact CA-O 3.39Å; G678-F713 PolarHBondContact N-O 2.97Å; L681-F713 HydrophobicContact CB-CD2 4.29Å; L681-F713 HydrophobicContact CB-CE2 4.34Å; L681-F713 HydrophobicContact CD1-CB 4.19Å; L681-F713 HydrophobicContact CD1-CD2 4.17Å; L681-F713 HydrophobicContact CD1-CG 4.09Å; A683-F713 HydrophobicContact CB-CZ 4.21Å; L690-F713 HydrophobicContact CB-CD1 4.03Å; L690-F713 HydrophobicContact CB-CE1 3.89Å; L690-F713 HydrophobicContact CD1-CD1 3.98Å; L690-F713 HydrophobicContact CD1-CE1 3.56Å; L690-F713 HydrophobicContact CD1-CE2 4.26Å; L690-F713 HydrophobicContact CD1-CZ 3.71Å; L690-F713 HydrophobicContact CG-CD1 4.15Å; L690-F713 HydrophobicContact CG-CE1 3.56Å; L690-F713 HydrophobicContact CG-CZ 4.07Å; K707-F713 WeakPolarHBondContact O-CD1 3.45Å; K707-F713 WeakPolarHBondContact O-CE1 3.47Å; N708-F713 VanDerWaalsContact C-CE1 3.42Å; R709-F713 HydrophobicContact CB-CE2 4.3Å; R709-F713 HydrophobicContact CB-CZ 3.96Å; R709-F713 HydrophobicContact CG-CE2 4.13Å; R709-F713 HydrophobicContact CG-CZ 4.27Å; A711-F713 PolarHBondContact O-N 2.92Å; F713-W715 HydrophobicContact CB-CH2 3.99Å; F713-W715 HydrophobicContact CB-CZ3 4.05Å; F713-W715 WeakPolarHBondContact O-CZ3 3.29Å; F713-W715 PolarHBondContact O-N 2.71Å
714	Q	89.3	Confident	89.4	Confident	58 Å²	58	37.7 Å²	37.7	27%	0.271	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	104.7	169.2	-60	-156.4	-19	0	0	109	F676 E677 K707 A711 K712 R716	F676-Q714 CarbonylContact O-C 3.59Å; F676-Q714 WeakPolarHBondContact O-CA 3.26Å; E677-Q714 HydrophobicContact CB-CB 4.39Å; E677-Q714 HydrophobicContact CB-CG 3.87Å; E677-Q714 PolarHBondContact OE2-NE2 3.05Å; K707-Q714 WeakPolarHBondContact CE-O 3.38Å; A711-Q714 PolarHBondContact O-N 2.88Å; K712-Q714 HydrophobicContact CB-CG 4.29Å; K712-Q714 PolarHBondContact O-N 2.87Å; Q714-R716 VanDerWaalsContact OE1-NE 3.14Å
715	W	90.5	Very high	89.3	Confident	6 Å²	6	40.8 Å²	40.8	2%	0.023	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	-60.8	173.6	-73.2	-78.2	0	0	0	110.6	I675 F676 L681 L690 T704 E705 K707 F713 E717 I733 L779	I675-W715 HydrophobicContact CG2-CB 4.19Å; I675-W715 HydrophobicContact CG2-CD2 4.33Å; I675-W715 HydrophobicContact CG2-CE3 3.8Å; F676-W715 PolarHBondContact O-N 2.98Å; L681-W715 HydrophobicContact CD1-CH2 3.86Å; L681-W715 HydrophobicContact CD1-CZ3 4.29Å; L690-W715 HydrophobicContact CB-CZ2 4.34Å; T704-W715 VanDerWaalsContact CB-CD1 3.44Å; T704-W715 HydrophobicContact CG2-CG 4.2Å; T704-W715 PolarHBondContact OG1-NE1 3.47Å; T704-W715 VanDerWaalsContact OG1-NE1 3.1Å; E705-W715 PolarHBondContact O-NE1 2.77Å; K707-W715 HydrophobicContact CG-CD2 4.45Å; K707-W715 HydrophobicContact CG-CG 4.08Å; K707-W715 VanDerWaalsContact CG-NE1 3.33Å; K707-W715 PolarHBondContact NZ-O 3.49Å; F713-W715 HydrophobicContact CB-CH2 3.99Å; F713-W715 HydrophobicContact CB-CZ3 4.05Å; F713-W715 WeakPolarHBondContact O-CZ3 3.29Å; F713-W715 PolarHBondContact O-N 2.71Å; W715-E717 PolarHBondContact O-N 3.2Å; W715-I733 HydrophobicContact CH2-CD1 4.3Å; W715-L779 HydrophobicContact CE3-CD1 4.18Å; W715-L779 HydrophobicContact CZ3-CD1 3.74Å
716	R	88.4	Confident	89.5	Confident	136 Å²	136	39.6 Å²	39.6	51%	0.513	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	56.5	35.6	-171.9	-53.9	174.4	177.6	-117.3	3.6	112	I675 F676 Q714	I675-R716 VanDerWaalsContact O-CA 3.27Å; I675-R716 WeakPolarHBondContact O-CA 3.4Å; I675-R716 PolarHBondContact O-N 3.03Å; F676-R716 PolarHBondContact O-N 3.31Å; Q714-R716 VanDerWaalsContact OE1-NE 3.14Å
717	E	91.1	Very high	89.7	Confident	3 Å²	3	44.1 Å²	44.1	1%	0.014	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	142.3	176.4	-72.9	173.6	-90.2	0	0	109.9	I675 T704 E705 W715 F719 E862 K863	I675-E717 PolarHBondContact N-O 3.41Å; I675-E717 PolarHBondContact O-N 3.07Å; T704-E717 WeakPolarHBondContact CB-OE1 2.77Å; E705-E717 VanDerWaalsContact CB-OE1 3.28Å; E705-E717 WeakPolarHBondContact CB-OE1 3.41Å; E705-E717 WeakPolarHBondContact CG-OE1 3.39Å; E705-E717 PolarHBondContact N-OE1 2.69Å; E705-E717 PolarHBondContact N-OE2 3.27Å; W715-E717 PolarHBondContact O-N 3.2Å; E717-F719 HydrophobicContact CB-CE2 3.78Å; E717-F719 HydrophobicContact CB-CZ 3.96Å; E717-E862 WeakPolarHBondContact CA-OE2 3.46Å; E717-K863 WeakPolarHBondContact OE2-CE 3.43Å; E717-K863 IonicContact OE2-NZ 3.74Å; E717-K863 PolarHBondContact OE2-NZ 2.88Å
718	S	92	Very high	90	Very high	8 Å²	8	44.3 Å²	44.3	6%	0.056	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	145.1	178.1	-39.2	0	0	0	0	109.9	I673 Q674 S860 V861 E862	I673-S718 CarbonylContact O-C 3.58Å; I673-S718 WeakPolarHBondContact O-CA 3.46Å; Q674-S718 WeakPolarHBondContact CG-OG 3.33Å; Q674-S718 PolarHBondContact NE2-OG 2.8Å; S718-S860 CarbonylContact O-C 3.57Å; S718-S860 VanDerWaalsContact O-CA 3.3Å; S718-S860 WeakPolarHBondContact O-CA 3.28Å; S718-V861 WeakPolarHBondContact O-CG2 3.45Å; S718-V861 PolarHBondContact O-N 3.28Å; S718-E862 WeakPolarHBondContact CB-OE1 3.41Å; S718-E862 VanDerWaalsContact N-CD 3.27Å; S718-E862 PolarHBondContact N-OE1 2.88Å; S718-E862 PolarHBondContact N-OE2 2.91Å; S718-E862 PolarHBondContact OG-OE1 3.43Å
719	F	95.5	Very high	90.5	Very high	1 Å²	1	43.2 Å²	43.2	0%	0.004	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	136.1	-178.9	-59.7	-84.8	0	0	0	109.9	I672 I673 I694 A702 R703 T704 E717 I721	I672-F719 WeakPolarHBondContact CA-O 3.39Å; I673-F719 PolarHBondContact N-O 3.07Å; I673-F719 PolarHBondContact O-N 3.3Å; I694-F719 HydrophobicContact CD1-CD2 3.79Å; I694-F719 HydrophobicContact CD1-CE2 4.39Å; I694-F719 HydrophobicContact CD1-CG 4.32Å; A702-F719 HydrophobicContact CB-CB 3.97Å; A702-F719 HydrophobicContact CB-CD1 3.5Å; A702-F719 HydrophobicContact CB-CD2 4.34Å; A702-F719 HydrophobicContact CB-CE1 4.08Å; A702-F719 HydrophobicContact CB-CG 3.65Å; R703-F719 WeakPolarHBondContact O-CZ 3.5Å; T704-F719 HydrophobicContact CG2-CE2 3.97Å; T704-F719 HydrophobicContact CG2-CZ 4.28Å; E717-F719 HydrophobicContact CB-CE2 3.78Å; E717-F719 HydrophobicContact CB-CZ 3.96Å; F719-I721 HydrophobicContact CB-CD1 4.23Å; F719-I721 HydrophobicContact CB-CG1 4.17Å
720	E	93.1	Very high	91.1	Very high	19 Å²	19	37.5 Å²	37.5	9%	0.089	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	106.2	175.3	-83.8	164.3	-146.3	0	0	107.2	L670 I672 I809 C858 V861 K864	L670-E720 HydrophobicContact CD1-CB 4.09Å; L670-E720 HydrophobicContact CD2-CB 4Å; L670-E720 HydrophobicContact CD2-CG 3.9Å; L670-E720 HydrophobicContact CG-CB 4.15Å; L670-E720 HydrophobicContact CG-CG 4.39Å; I672-E720 HydrophobicContact CG1-CG 4.2Å; E720-I809 HydrophobicContact CG-CD1 4.19Å; E720-I809 WeakPolarHBondContact OE1-CD1 3.31Å; E720-C858 PolarHBondContact O-SG 2.91Å; E720-C858 VanDerWaalsContact O-SG 3.37Å; E720-V861 HydrophobicContact CB-CG2 4.13Å; E720-V861 HydrophobicContact CG-CG2 3.71Å; E720-V861 WeakPolarHBondContact OE1-CG1 3.35Å; E720-V861 VanDerWaalsContact OE1-CG2 3.26Å; E720-V861 WeakPolarHBondContact OE1-CG2 3.25Å; E720-K864 IonicContact OE2-NZ 3.25Å; E720-K864 PolarHBondContact OE2-NZ 3.3Å
721	I	94.4	Very high	91.8	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	120.7	-169.1	-63.6	169.4	0	0	0	109.1	L671 I673 I694 V696 R701 A702 F719 V723 C858	L671-I721 PolarHBondContact N-O 3.42Å; L671-I721 PolarHBondContact O-N 2.86Å; I673-I721 HydrophobicContact CD1-CD1 4.01Å; I673-I721 HydrophobicContact CG1-CD1 4.41Å; I694-I721 HydrophobicContact CG2-CD1 3.91Å; V696-I721 HydrophobicContact CG2-CG2 4.07Å; R701-I721 HydrophobicContact CB-CD1 4.04Å; R701-I721 HydrophobicContact CB-CG1 4.23Å; R701-I721 HydrophobicContact CB-CG2 3.65Å; R701-I721 HydrophobicContact CG-CG2 3.75Å; A702-I721 HydrophobicContact CB-CD1 4.08Å; A702-I721 HydrophobicContact CB-CG1 4.47Å; F719-I721 HydrophobicContact CB-CD1 4.23Å; F719-I721 HydrophobicContact CB-CG1 4.17Å; I721-V723 HydrophobicContact CG2-CG1 4.16Å; I721-V723 PolarHBondContact O-N 2.8Å; I721-C858 HydrophobicContact CG1-CB 4.47Å
722	D	92	Very high	92.5	Very high	19 Å²	19	33.3 Å²	33.3	10%	0.102	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	130.3	171.3	-55.7	-65.1	0	0	0	110.1	W724 K896	D722-W724 VanDerWaalsContact C-CZ3 3.47Å; D722-W724 HydrophobicContact CB-CH2 3.27Å; D722-W724 HydrophobicContact CB-CZ2 3.71Å; D722-W724 HydrophobicContact CB-CZ3 3.88Å; D722-W724 WeakPolarHBondContact O-CZ3 3.43Å; D722-K896 IonicContact OD2-NZ 2.71Å; D722-K896 PolarHBondContact OD2-NZ 3.1Å
723	V	93.2	Very high	93	Very high	3 Å²	3	25.9 Å²	25.9	2%	0.018	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	149.5	-179.2	-65	0	0	0	0	111.7	T668 G669 L671 V696 I721 F785	T668-V723 CarbonylContact C-O 3.6Å; T668-V723 VanDerWaalsContact CA-O 3.3Å; T668-V723 WeakPolarHBondContact CA-O 3.36Å; G669-V723 PolarHBondContact N-O 2.82Å; G669-V723 WeakPolarHBondContact O-CG2 2.93Å; G669-V723 PolarHBondContact O-N 3.34Å; L671-V723 HydrophobicContact CB-CG1 3.7Å; L671-V723 HydrophobicContact CB-CG2 4.01Å; L671-V723 HydrophobicContact CD2-CG1 4.07Å; V696-V723 HydrophobicContact CG1-CG1 4Å; I721-V723 HydrophobicContact CG2-CG1 4.16Å; I721-V723 PolarHBondContact O-N 2.8Å; V723-F785 HydrophobicContact CG2-CD2 4.41Å; V723-F785 HydrophobicContact CG2-CE2 3.88Å
724	W	91.2	Very high	93.3	Very high	24 Å²	24	27.9 Å²	27.9	9%	0.091	12%	0.12	C	C	.	.	S	Bend	trans	-147.1	118.5	178.8	-41.2	-122.8	0	0	0	110.4	F667 T668 D722 S726 R975 I976 N1002	F667-W724 CarbonylContact O-C 3.42Å; T668-W724 HydrophobicContact CG2-CB 4.05Å; T668-W724 HydrophobicContact CG2-CG 4.31Å; D722-W724 VanDerWaalsContact C-CZ3 3.47Å; D722-W724 HydrophobicContact CB-CH2 3.27Å; D722-W724 HydrophobicContact CB-CZ2 3.71Å; D722-W724 HydrophobicContact CB-CZ3 3.88Å; D722-W724 WeakPolarHBondContact O-CZ3 3.43Å; W724-S726 PolarHBondContact N-OG 3.49Å; W724-S726 PolarHBondContact O-N 2.98Å; W724-S726 VanDerWaalsContact O-N 3.12Å; W724-R975 HydrophobicContact CD2-CG 3.71Å; W724-R975 VanDerWaalsContact CD2-NE 3.34Å; W724-R975 VanDerWaalsContact CE2-CG 3.42Å; W724-R975 VanDerWaalsContact CE2-O 3.3Å; W724-R975 HydrophobicContact CE3-CG 4.27Å; W724-R975 HydrophobicContact CG-CG 4.03Å; W724-R975 HydrophobicContact CH2-CG 4.39Å; W724-R975 HydrophobicContact CZ2-CG 3.82Å; W724-R975 WeakPolarHBondContact CZ2-O 3.49Å; W724-R975 PolarHBondContact NE1-O 3.12Å; W724-R975 PolarHBondContact O-NH2 3.25Å; W724-R975 VanDerWaalsContact O-NH2 3.14Å; W724-I976 HydrophobicContact CH2-CG1 3.92Å; W724-I976 HydrophobicContact CZ2-CG1 4.14Å; W724-N1002 PolarHBondContact NE1-ND2 3.18Å
725	E	92	Very high	93.3	Very high	69 Å²	69	25.8 Å²	25.8	32%	0.322	11%	0.112	S	C	.	.	S	Bend	trans	47.1	31.9	-172.3	-62.8	-176.1	-145	0	0	114	G664 S665 F667 T668 K1003	G664-E725 WeakPolarHBondContact CA-OE2 3.23Å; S665-E725 WeakPolarHBondContact CB-O 3.44Å; F667-E725 PolarHBondContact O-N 3.14Å; F667-E725 VanDerWaalsContact O-N 3.07Å; T668-E725 PolarHBondContact OG1-N 3.09Å; E725-K1003 WeakPolarHBondContact OE1-CE 3.16Å; E725-K1003 IonicContact OE1-NZ 2.81Å; E725-K1003 PolarHBondContact OE1-NZ 3.06Å; E725-K1003 IonicContact OE2-NZ 2.8Å
726	S	94.2	Very high	93.2	Very high	3 Å²	3	27.6 Å²	27.6	2%	0.021	12%	0.118	C	C	.	.			trans	-77.6	150.1	-170.1	-74.1	0	0	0	0	114	S665 F667 D697 W724	S665-S726 WeakPolarHBondContact CB-O 3.39Å; S665-S726 PolarHBondContact OG-O 3.26Å; F667-S726 PolarHBondContact O-N 3.17Å; D697-S726 WeakPolarHBondContact OD2-CA 3.29Å; D697-S726 WeakPolarHBondContact OD2-CB 3.5Å; D697-S726 PolarHBondContact OD2-OG 3.48Å; W724-S726 PolarHBondContact N-OG 3.49Å; W724-S726 PolarHBondContact O-N 2.98Å; W724-S726 VanDerWaalsContact O-N 3.12Å
727	R	94.5	Very high	92.9	Very high	106 Å²	106	24.5 Å²	24.5	40%	0.4	11%	0.11	S	C	.	.			trans	-130.9	-36.4	-167.3	-55.4	-177.9	-170	-132.4	-5.9	113.5	S663 D697 L752 L753	S663-R727 PolarHBondContact O-NH2 3.46Å; D697-R727 PolarHBondContact OD1-N 3.41Å; D697-R727 PolarHBondContact OD2-N 3.1Å; R727-L752 PolarHBondContact O-N 2.99Å; R727-L753 HydrophobicContact CB-CD1 4.4Å; R727-L753 HydrophobicContact CG-CD1 4.14Å
728	V	94.4	Very high	92.3	Very high	33 Å²	33	28 Å²	28	20%	0.2	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	133.8	-172.8	-170.8	0	0	0	0	110.5	V696 D697 E730 S749	V696-V728 CarbonylContact C-O 3.55Å; V696-V728 WeakPolarHBondContact CA-O 3.22Å; D697-V728 PolarHBondContact N-O 3.36Å; D697-V728 PolarHBondContact OD1-N 3.17Å; V728-E730 HydrophobicContact CG1-CG 3.76Å; V728-S749 WeakPolarHBondContact CG1-OG 3.31Å
729	V	96.3	Very high	91.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	130.3	165.3	-175.5	0	0	0	0	107.8	L671 I673 I694 E695 V696 L731 S749 L750 L752	L671-V729 HydrophobicContact CD2-CG2 3.64Å; I673-V729 HydrophobicContact CD1-CG1 3.73Å; I694-V729 HydrophobicContact CG2-CG1 4.01Å; E695-V729 CarbonylContact O-C 3.45Å; E695-V729 WeakPolarHBondContact O-CA 3.22Å; V696-V729 HydrophobicContact CG2-CG2 4.43Å; V729-L731 HydrophobicContact CG1-CD1 3.87Å; V729-L731 HydrophobicContact CG1-CG 4.46Å; V729-S749 CarbonylContact O-C 3.28Å; V729-S749 WeakPolarHBondContact O-CA 3.35Å; V729-L750 HydrophobicContact CB-CB 4.35Å; V729-L750 PolarHBondContact N-O 3.44Å; V729-L750 PolarHBondContact O-N 3.28Å; V729-L752 HydrophobicContact CG2-CD1 4.13Å; V729-L752 HydrophobicContact CG2-CD2 3.77Å; V729-L752 HydrophobicContact CG2-CG 3.98Å
730	E	96.2	Very high	90.8	Very high	15 Å²	15	41 Å²	41	7%	0.07	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	136.7	176.2	-55.9	-145.2	103.2	0	0	110.6	E695 V728 Y732 R747 S749	E695-E730 HydrophobicContact CB-CB 4.42Å; E695-E730 PolarHBondContact N-O 3.36Å; E695-E730 PolarHBondContact O-N 3.04Å; V728-E730 HydrophobicContact CG1-CG 3.76Å; E730-Y732 HydrophobicContact CB-CD2 4.19Å; E730-Y732 HydrophobicContact CB-CE2 3.49Å; E730-Y732 VanDerWaalsContact CB-CE2 3.49Å; E730-Y732 PolarHBondContact OE2-OH 2.92Å; E730-R747 IonicContact OE1-CZ 2.9Å; E730-R747 IonicContact OE1-NE 2.67Å; E730-R747 PolarHBondContact OE1-NE 3.18Å; E730-R747 IonicContact OE1-NH2 2.62Å; E730-R747 PolarHBondContact OE1-NH2 3.27Å; E730-R747 IonicContact OE2-CZ 3.29Å; E730-R747 IonicContact OE2-NE 3.66Å; E730-R747 IonicContact OE2-NH2 2.71Å; E730-R747 PolarHBondContact OE2-NH2 3.26Å; E730-S749 PolarHBondContact OE1-OG 2.71Å
731	L	97.1	Very high	90.1	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	113.3	-176.9	-64.4	103.5	0	0	0	109.3	I675 V693 I694 V729 R747 G748 L750 L771 L779 L781	I675-L731 HydrophobicContact CD1-CD2 3.94Å; V693-L731 WeakPolarHBondContact O-CA 3.37Å; I694-L731 HydrophobicContact CG1-CD2 4.21Å; V729-L731 HydrophobicContact CG1-CD1 3.87Å; V729-L731 HydrophobicContact CG1-CG 4.46Å; L731-R747 CarbonylContact O-C 3.43Å; L731-R747 WeakPolarHBondContact O-CA 3.37Å; L731-G748 PolarHBondContact N-O 2.83Å; L731-G748 PolarHBondContact O-N 3.17Å; L731-L750 HydrophobicContact CD1-CD1 4.18Å; L731-L771 HydrophobicContact CD1-CD2 3.84Å; L731-L779 HydrophobicContact CB-CD2 4.31Å; L731-L779 HydrophobicContact CD2-CD2 3.75Å; L731-L781 HydrophobicContact CD2-CD2 4.32Å
732	Y	95.5	Very high	89.8	Confident	27 Å²	27	50.8 Å²	50.8	11%	0.106	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	119.2	-174.6	-66.8	-88.9	0	0	0	109.7	C692 V693 E695 E730 Y734 L744 R747	C692-Y732 CarbonylContact C-O 3.46Å; C692-Y732 WeakPolarHBondContact CA-O 3.41Å; V693-Y732 PolarHBondContact N-O 2.58Å; V693-Y732 PolarHBondContact O-N 2.84Å; E695-Y732 HydrophobicContact CB-CE2 4.42Å; E695-Y732 HydrophobicContact CG-CD2 4.04Å; E695-Y732 HydrophobicContact CG-CE2 3.98Å; E695-Y732 WeakPolarHBondContact OE2-CE2 3.41Å; E730-Y732 HydrophobicContact CB-CD2 4.19Å; E730-Y732 HydrophobicContact CB-CE2 3.49Å; E730-Y732 VanDerWaalsContact CB-CE2 3.49Å; E730-Y732 PolarHBondContact OE2-OH 2.92Å; Y732-Y734 HydrophobicContact CG-CE2 4.48Å; Y732-L744 HydrophobicContact CD1-CD1 3.78Å; Y732-L744 HydrophobicContact CD1-CD2 4.16Å; Y732-L744 HydrophobicContact CG-CD1 4.33Å; Y732-R747 HydrophobicContact CD1-CB 4.27Å; Y732-R747 HydrophobicContact CD1-CG 3.94Å; Y732-R747 HydrophobicContact CE1-CB 4.38Å; Y732-R747 HydrophobicContact CE1-CG 3.67Å; Y732-R747 VanDerWaalsContact OH-CZ 3.31Å; Y732-R747 PolarHBondContact OH-NE 2.86Å; Y732-R747 PolarHBondContact OH-NH2 2.8Å; Y732-R747 VanDerWaalsContact OH-NH2 3.17Å
733	I	94.8	Very high	89.7	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	118	176.1	-51.8	-175.1	0	0	0	109.1	L681 L690 Y691 C692 W715 R745 H746 L773 L779	L681-I733 HydrophobicContact CD1-CD1 3.74Å; L681-I733 HydrophobicContact CD1-CG2 4.44Å; L681-I733 HydrophobicContact CD2-CD1 3.83Å; L681-I733 HydrophobicContact CG-CD1 4.47Å; L690-I733 HydrophobicContact CB-CG2 3.92Å; L690-I733 HydrophobicContact CD1-CG2 4.15Å; L690-I733 HydrophobicContact CG-CG2 4.46Å; Y691-I733 WeakPolarHBondContact O-CA 3.48Å; C692-I733 HydrophobicContact CB-CG1 4.46Å; W715-I733 HydrophobicContact CH2-CD1 4.3Å; I733-R745 WeakPolarHBondContact O-CA 3.37Å; I733-R745 WeakPolarHBondContact O-CB 3.32Å; I733-R745 PolarHBondContact O-N 3Å; I733-H746 HydrophobicContact CB-CB 4.03Å; I733-H746 HydrophobicContact CD1-CB 4.35Å; I733-H746 HydrophobicContact CG1-CB 4.3Å; I733-H746 PolarHBondContact N-O 2.89Å; I733-H746 PolarHBondContact O-N 3.42Å; I733-L773 HydrophobicContact CD1-CD1 3.52Å; I733-L773 HydrophobicContact CG1-CD1 4.4Å; I733-L779 HydrophobicContact CD1-CD1 4.36Å
734	Y	93	Very high	89.5	Confident	55 Å²	55	60.6 Å²	60.6	22%	0.216	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	145.6	178.2	-71.7	-89.5	0	0	0	110.7	L690 Y691 V693 Y732 H742 K743 L744	L690-Y734 VanDerWaalsContact CA-O 3.27Å; L690-Y734 WeakPolarHBondContact CA-O 3.29Å; Y691-Y734 HydrophobicContact CE2-CD2 4.27Å; Y691-Y734 HydrophobicContact CE2-CG 4.49Å; Y691-Y734 PolarHBondContact N-O 3.05Å; Y691-Y734 PolarHBondContact O-N 2.92Å; V693-Y734 HydrophobicContact CB-CD2 4.27Å; V693-Y734 HydrophobicContact CB-CE2 4.06Å; V693-Y734 HydrophobicContact CG2-CD2 3.8Å; V693-Y734 HydrophobicContact CG2-CE2 3.86Å; Y732-Y734 HydrophobicContact CG-CE2 4.48Å; Y734-H742 HydrophobicContact CD1-CB 4.44Å; Y734-K743 CarbonylContact C-O 3.55Å; Y734-K743 WeakPolarHBondContact CA-O 3.2Å; Y734-L744 HydrophobicContact CD1-CB 4.17Å; Y734-L744 HydrophobicContact CD1-CD1 4.24Å; Y734-L744 HydrophobicContact CD2-CD1 4.33Å; Y734-L744 HydrophobicContact CE1-CB 3.89Å; Y734-L744 HydrophobicContact CE1-CD1 3.93Å; Y734-L744 HydrophobicContact CE2-CD1 4.05Å; Y734-L744 HydrophobicContact CG-CD1 4.42Å
735	S	91	Very high	89.5	Confident	14 Å²	14	63.2 Å²	63.2	10%	0.098	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	120	162.3	58.9	0	0	0	0	110.1	E689 H742 K743	E689-S735 CarbonylContact O-C 3.58Å; E689-S735 WeakPolarHBondContact O-CA 3.49Å; S735-H742 WeakPolarHBondContact O-CA 3.18Å; S735-H742 WeakPolarHBondContact O-CB 3.13Å; S735-K743 PolarHBondContact N-O 2.95Å; S735-K743 PolarHBondContact O-N 3.4Å; S735-K743 PolarHBondContact OG-O 3.36Å
736	W	87	Confident	89.6	Confident	43 Å²	43	60.1 Å²	60.1	16%	0.163	27%	0.269	C	S	.	.			trans	-69.7	149.4	176.7	-174.1	84.9	0	0	0	111.2	V546 E689 Y691 V706 P738 H742	V546-W736 PolarHBondContact O-NE1 3.2Å; E689-W736 PolarHBondContact O-N 2.86Å; Y691-W736 HydrophobicContact CD1-CB 4.07Å; Y691-W736 HydrophobicContact CE1-CB 4.14Å; V706-W736 HydrophobicContact CG1-CB 3.97Å; V706-W736 HydrophobicContact CG1-CD2 4.33Å; V706-W736 HydrophobicContact CG1-CG 4.09Å; V706-W736 HydrophobicContact CG2-CB 4.23Å; V706-W736 HydrophobicContact CG2-CG 3.99Å; W736-P738 HydrophobicContact CH2-CB 3.66Å; W736-P738 HydrophobicContact CH2-CG 4.17Å; W736-P738 HydrophobicContact CZ2-CB 4.14Å; W736-P738 HydrophobicContact CZ3-CB 4.17Å; W736-P738 HydrophobicContact CZ3-CG 4.19Å; W736-H742 AromaticContact CD1-CE1 3.23Å; W736-H742 AromaticContact CD1-NE2 3.4Å; W736-H742 AromaticContact CG-NE2 3.89Å; W736-H742 AromaticContact NE1-CE1 3.69Å; W736-H742 AromaticContact NE1-NE2 3.73Å
737	H	82.9	Confident	89.6	Confident	71 Å²	71	64.9 Å²	64.9	33%	0.329	29%	0.286	S	S	.	.			trans	-157.3	125.3	172.5	-169.7	-86.5	0	0	0	110.8	Q739 F740 H742	H737-Q739 PolarHBondContact ND1-N 3.4Å; H737-Q739 PolarHBondContact O-N 3.45Å; H737-F740 HydrophobicContact CB-CB 4.42Å; H737-F740 AromaticContact CE1-CD2 3.11Å; H737-F740 WeakPolarHBondContact CE1-CD2 3.43Å; H737-F740 AromaticContact CE1-CE2 3.57Å; H737-F740 AromaticContact CE1-CG 3.85Å; H737-F740 WeakPolarHBondContact ND1-CB 3.19Å; H737-F740 AromaticContact ND1-CD2 3.25Å; H737-F740 VanDerWaalsContact ND1-CD2 3.25Å; H737-F740 WeakPolarHBondContact ND1-CD2 3.43Å; H737-F740 AromaticContact ND1-CG 3.58Å; H737-F740 PolarHBondContact ND1-N 2.94Å; H737-F740 AromaticContact NE2-CD2 3.82Å; H737-F740 PolarHBondContact O-N 3.31Å; H737-F740 VanDerWaalsContact O-O 3.13Å; H737-H742 PolarHBondContact N-CD2 3.4Å; H737-H742 PolarHBondContact N-NE2 3.44Å; H737-H742 PolarHBondContact O-NE2 2.92Å
738	P	78.4	Confident	89.6	Confident	78 Å²	78	59.9 Å²	59.9	51%	0.506	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-14	-167.6	25.5	-35.1	0	0	0	115.4	W736	W736-P738 HydrophobicContact CH2-CB 3.66Å; W736-P738 HydrophobicContact CH2-CG 4.17Å; W736-P738 HydrophobicContact CZ2-CB 4.14Å; W736-P738 HydrophobicContact CZ3-CB 4.17Å; W736-P738 HydrophobicContact CZ3-CG 4.19Å
739	Q	76.8	Confident	89.5	Confident	151 Å²	151	59.1 Å²	59.1	71%	0.706	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.6	-3.2	-173.6	-63.8	-178.5	-41.8	0	0	114.2	H737	H737-Q739 PolarHBondContact ND1-N 3.4Å; H737-Q739 PolarHBondContact O-N 3.45Å
740	F	78.5	Confident	89.4	Confident	131 Å²	131	59.5 Å²	59.5	58%	0.575	27%	0.266	S	S	*	.	S	Bend	trans	-137.7	150	-174.3	-61.1	-45.1	0	0	0	110.2	H737 H742	H737-F740 HydrophobicContact CB-CB 4.42Å; H737-F740 AromaticContact CE1-CD2 3.11Å; H737-F740 WeakPolarHBondContact CE1-CD2 3.43Å; H737-F740 AromaticContact CE1-CE2 3.57Å; H737-F740 AromaticContact CE1-CG 3.85Å; H737-F740 WeakPolarHBondContact ND1-CB 3.19Å; H737-F740 AromaticContact ND1-CD2 3.25Å; H737-F740 VanDerWaalsContact ND1-CD2 3.25Å; H737-F740 WeakPolarHBondContact ND1-CD2 3.43Å; H737-F740 AromaticContact ND1-CG 3.58Å; H737-F740 PolarHBondContact ND1-N 2.94Å; H737-F740 AromaticContact NE2-CD2 3.82Å; H737-F740 PolarHBondContact O-N 3.31Å; H737-F740 VanDerWaalsContact O-O 3.13Å; F740-H742 PolarHBondContact O-N 2.73Å
741	R	79	Confident	89.2	Confident	199 Å²	199	63 Å²	63	75%	0.751	28%	0.282	S	S	*	.	P	Polyproline II helix	trans	-50.6	125.5	176.6	-175.7	176.6	-179.2	175.9	0.9	110.9	K743	R741-K743 PolarHBondContact O-N 2.89Å
742	H	88.2	Confident	88.9	Confident	24 Å²	24	63 Å²	63	11%	0.111	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-59.5	134.1	179	-57.9	164	0	0	0	110.4	Y691 Y734 S735 W736 H737 F740	Y691-H742 HydrophobicContact CE1-CB 4.39Å; Y691-H742 AromaticContact CE1-ND1 3.57Å; Y691-H742 AromaticContact CZ-ND1 3.62Å; Y691-H742 PolarHBondContact OH-ND1 2.88Å; Y734-H742 HydrophobicContact CD1-CB 4.44Å; S735-H742 WeakPolarHBondContact O-CA 3.18Å; S735-H742 WeakPolarHBondContact O-CB 3.13Å; W736-H742 AromaticContact CD1-CE1 3.23Å; W736-H742 AromaticContact CD1-NE2 3.4Å; W736-H742 AromaticContact CG-NE2 3.89Å; W736-H742 AromaticContact NE1-CE1 3.69Å; W736-H742 AromaticContact NE1-NE2 3.73Å; H737-H742 PolarHBondContact N-CD2 3.4Å; H737-H742 PolarHBondContact N-NE2 3.44Å; H737-H742 PolarHBondContact O-NE2 2.92Å; F740-H742 PolarHBondContact O-N 2.73Å
743	K	88.8	Confident	88.8	Confident	141 Å²	141	64.9 Å²	64.9	61%	0.613	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98	131.3	-174.2	-59.1	-176.5	-179.7	-177.8	0	109.5	Y734 S735 R741 R745	Y734-K743 CarbonylContact C-O 3.55Å; Y734-K743 WeakPolarHBondContact CA-O 3.2Å; S735-K743 PolarHBondContact N-O 2.95Å; S735-K743 PolarHBondContact O-N 3.4Å; S735-K743 PolarHBondContact OG-O 3.36Å; R741-K743 PolarHBondContact O-N 2.89Å; K743-R745 PolarHBondContact O-N 3.32Å
744	L	90.7	Very high	88.5	Confident	88 Å²	88	67.9 Å²	67.9	46%	0.461	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	135.5	171.2	-174.6	65.3	0	0	0	108.9	Y732 Y734	Y732-L744 HydrophobicContact CD1-CD1 3.78Å; Y732-L744 HydrophobicContact CD1-CD2 4.16Å; Y732-L744 HydrophobicContact CG-CD1 4.33Å; Y734-L744 HydrophobicContact CD1-CB 4.17Å; Y734-L744 HydrophobicContact CD1-CD1 4.24Å; Y734-L744 HydrophobicContact CD2-CD1 4.33Å; Y734-L744 HydrophobicContact CE1-CB 3.89Å; Y734-L744 HydrophobicContact CE1-CD1 3.93Å; Y734-L744 HydrophobicContact CE2-CD1 4.05Å; Y734-L744 HydrophobicContact CG-CD1 4.42Å
745	R	91.3	Very high	88.1	Confident	79 Å²	79	68.4 Å²	68.4	30%	0.298	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	-39.5	179.5	-63.8	-58.6	-134.3	170.7	2.9	112.3	D688 L690 I733 K743	D688-R745 IonicContact OD2-CZ 3.64Å; D688-R745 IonicContact OD2-NE 3.13Å; D688-R745 IonicContact OD2-NH2 3.47Å; D688-R745 PolarHBondContact OD2-NH2 3.49Å; L690-R745 HydrophobicContact CD2-CG 4.06Å; I733-R745 WeakPolarHBondContact O-CA 3.37Å; I733-R745 WeakPolarHBondContact O-CB 3.32Å; I733-R745 PolarHBondContact O-N 3Å; K743-R745 PolarHBondContact O-N 3.32Å
746	H	93.4	Very high	87.6	Confident	3 Å²	3	73.4 Å²	73.4	1%	0.014	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	149.3	-177.1	-52.2	-78.8	0	0	0	112	R682 I733 L773 E774 R776	R682-H746 PolarHBondContact N-CE1 3.06Å; R682-H746 VanDerWaalsContact N-CE1 3.32Å; R682-H746 PolarHBondContact N-NE2 3.13Å; I733-H746 HydrophobicContact CB-CB 4.03Å; I733-H746 HydrophobicContact CD1-CB 4.35Å; I733-H746 HydrophobicContact CG1-CB 4.3Å; I733-H746 PolarHBondContact N-O 2.89Å; I733-H746 PolarHBondContact O-N 3.42Å; H746-L773 HydrophobicContact CB-CB 4.04Å; H746-L773 HydrophobicContact CB-CD1 3.91Å; H746-E774 CarbonylContact C-O 3.59Å; H746-E774 VanDerWaalsContact CA-O 3.22Å; H746-E774 WeakPolarHBondContact CA-O 3.48Å; H746-R776 PolarHBondContact CE1-O 3.01Å; H746-R776 PolarHBondContact ND1-O 3.05Å
747	R	94.7	Very high	87.6	Confident	104 Å²	104	71.6 Å²	71.6	39%	0.392	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	142.7	170.8	-176.2	-175.7	-177.6	-179.5	6.1	110.4	E730 L731 Y732 L773 E774	E730-R747 IonicContact OE1-CZ 2.9Å; E730-R747 IonicContact OE1-NE 2.67Å; E730-R747 PolarHBondContact OE1-NE 3.18Å; E730-R747 IonicContact OE1-NH2 2.62Å; E730-R747 PolarHBondContact OE1-NH2 3.27Å; E730-R747 IonicContact OE2-CZ 3.29Å; E730-R747 IonicContact OE2-NE 3.66Å; E730-R747 IonicContact OE2-NH2 2.71Å; E730-R747 PolarHBondContact OE2-NH2 3.26Å; L731-R747 CarbonylContact O-C 3.43Å; L731-R747 WeakPolarHBondContact O-CA 3.37Å; Y732-R747 HydrophobicContact CD1-CB 4.27Å; Y732-R747 HydrophobicContact CD1-CG 3.94Å; Y732-R747 HydrophobicContact CE1-CB 4.38Å; Y732-R747 HydrophobicContact CE1-CG 3.67Å; Y732-R747 VanDerWaalsContact OH-CZ 3.31Å; Y732-R747 PolarHBondContact OH-NE 2.86Å; Y732-R747 PolarHBondContact OH-NH2 2.8Å; Y732-R747 VanDerWaalsContact OH-NH2 3.17Å; R747-L773 CarbonylContact O-C 3.51Å; R747-L773 VanDerWaalsContact O-CA 3.28Å; R747-L773 WeakPolarHBondContact O-CA 3.42Å; R747-E774 PolarHBondContact N-O 3.07Å; R747-E774 PolarHBondContact O-N 3.22Å
748	G	93.2	Very high	88	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	152.3	163.3	0	0	0	0	0	110.4	L731	L731-G748 PolarHBondContact N-O 2.83Å; L731-G748 PolarHBondContact O-N 3.17Å
749	S	93.2	Very high	88.4	Confident	17 Å²	17	69.9 Å²	69.9	12%	0.119	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	146	178.2	-165.8	0	0	0	0	109.9	S644 V728 V729 E730	S644-S749 WeakPolarHBondContact CB-O 3.37Å; S644-S749 PolarHBondContact OG-O 2.86Å; V728-S749 WeakPolarHBondContact CG1-OG 3.31Å; V729-S749 CarbonylContact O-C 3.28Å; V729-S749 WeakPolarHBondContact O-CA 3.35Å; E730-S749 PolarHBondContact OE1-OG 2.71Å
750	L	92.9	Very high	88.8	Confident	9 Å²	9	64.1 Å²	64.1	5%	0.047	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	122.7	175.6	-73.9	171	0	0	0	108.8	A642 V729 L731 L771 L781 L783	A642-L750 HydrophobicContact CB-CD2 3.73Å; V729-L750 HydrophobicContact CB-CB 4.35Å; V729-L750 PolarHBondContact N-O 3.44Å; V729-L750 PolarHBondContact O-N 3.28Å; L731-L750 HydrophobicContact CD1-CD1 4.18Å; L750-L771 HydrophobicContact CD1-CD2 4.09Å; L750-L771 HydrophobicContact CD2-CD1 3.9Å; L750-L771 HydrophobicContact CG-CD1 4.11Å; L750-L771 HydrophobicContact CG-CD2 4.06Å; L750-L781 HydrophobicContact CD1-CD1 4.03Å; L750-L781 HydrophobicContact CD1-CD2 4.19Å; L750-L783 HydrophobicContact CD1-CD1 4.06Å
751	Q	92.8	Very high	89.2	Confident	89 Å²	89	57.9 Å²	57.9	42%	0.416	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	111.5	176	-61.1	-64.8	-52.6	0	0	108.1	L753 D754	Q751-L753 PolarHBondContact O-N 3.38Å; Q751-D754 HydrophobicContact CB-CB 4.49Å; Q751-D754 VanDerWaalsContact O-CB 3.23Å; Q751-D754 WeakPolarHBondContact O-CB 3.31Å; Q751-D754 PolarHBondContact O-N 3.17Å
752	L	91.5	Very high	89.6	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-28.5	179.9	-64.9	176.3	0	0	0	111.9	F667 L671 R727 V729 D754 L757 L761	F667-L752 HydrophobicContact CB-CD1 4.31Å; F667-L752 HydrophobicContact CD2-CB 3.59Å; F667-L752 HydrophobicContact CD2-CD1 4.28Å; F667-L752 HydrophobicContact CE2-CB 3.71Å; F667-L752 WeakPolarHBondContact CE2-O 3.3Å; F667-L752 HydrophobicContact CG-CB 4.31Å; F667-L752 HydrophobicContact CG-CD1 4.26Å; F667-L752 HydrophobicContact CZ-CB 4.48Å; L671-L752 HydrophobicContact CD1-CD2 4.09Å; L671-L752 HydrophobicContact CD2-CD1 4.41Å; L671-L752 HydrophobicContact CD2-CD2 4.41Å; R727-L752 PolarHBondContact O-N 2.99Å; V729-L752 HydrophobicContact CG2-CD1 4.13Å; V729-L752 HydrophobicContact CG2-CD2 3.77Å; V729-L752 HydrophobicContact CG2-CG 3.98Å; L752-D754 VanDerWaalsContact C-N 3.28Å; L752-D754 PolarHBondContact O-N 3.42Å; L752-L757 HydrophobicContact CD2-CD2 4.36Å; L752-L761 HydrophobicContact CD2-CD1 4.26Å
753	L	92.1	Very high	89.3	Confident	67 Å²	67	55.6 Å²	55.6	35%	0.351	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	8.7	176.6	-59.4	176.9	0	0	0	114.2	F667 R727 Q751 P755 M758	F667-L753 HydrophobicContact CD2-CD2 4.41Å; F667-L753 HydrophobicContact CE2-CD2 4.31Å; R727-L753 HydrophobicContact CB-CD1 4.4Å; R727-L753 HydrophobicContact CG-CD1 4.14Å; Q751-L753 PolarHBondContact O-N 3.38Å; L753-P755 WeakPolarHBondContact O-CD 3.4Å; L753-M758 HydrophobicContact CD2-SD 4.23Å
754	D	88.5	Confident	88.6	Confident	63 Å²	63	52.4 Å²	52.4	34%	0.337	27%	0.267	S	S	.	.			trans	-61.2	125.1	172.5	-176.7	-35.8	0	0	0	109.9	Q751 L752 L756 L757 M758	Q751-D754 HydrophobicContact CB-CB 4.49Å; Q751-D754 VanDerWaalsContact O-CB 3.23Å; Q751-D754 WeakPolarHBondContact O-CB 3.31Å; Q751-D754 PolarHBondContact O-N 3.17Å; L752-D754 VanDerWaalsContact C-N 3.28Å; L752-D754 PolarHBondContact O-N 3.42Å; D754-L756 PolarHBondContact O-N 3.19Å; D754-L756 WeakPolarHBondContact OD1-CB 3.44Å; D754-L756 PolarHBondContact OD1-N 3.26Å; D754-L757 HydrophobicContact CB-CB 4.12Å; D754-L757 PolarHBondContact O-N 3.26Å; D754-M758 WeakPolarHBondContact O-CB 3.45Å; D754-M758 PolarHBondContact O-N 2.71Å
755	P	84.2	Confident	87.7	Confident	66 Å²	66	55.5 Å²	55.5	43%	0.429	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-19.9	179.6	-27.1	35.9	0	0	0	115.6	L753 P759	L753-P755 WeakPolarHBondContact O-CD 3.4Å; P755-P759 WeakPolarHBondContact O-CD 3.44Å; P755-P759 WeakPolarHBondContact O-CG 3.35Å
756	L	81.8	Confident	87.2	Confident	118 Å²	118	55 Å²	55	62%	0.618	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-14.4	176.6	-58	179	0	0	0	113.5	D754 Q767	D754-L756 PolarHBondContact O-N 3.19Å; D754-L756 WeakPolarHBondContact OD1-CB 3.44Å; D754-L756 PolarHBondContact OD1-N 3.26Å; L756-Q767 PolarHBondContact O-NE2 2.98Å; L756-Q767 PolarHBondContact O-OE1 3.05Å
757	L	86.2	Confident	86.6	Confident	6 Å²	6	56 Å²	56	3%	0.031	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-46.5	-179.3	173.7	66	0	0	0	111.6	L752 D754 S760 L761 F769 L783	L752-L757 HydrophobicContact CD2-CD2 4.36Å; D754-L757 HydrophobicContact CB-CB 4.12Å; D754-L757 PolarHBondContact O-N 3.26Å; L757-S760 PolarHBondContact O-N 3.5Å; L757-L761 HydrophobicContact CD1-CD1 3.71Å; L757-L761 HydrophobicContact CD1-CD2 4.16Å; L757-L761 HydrophobicContact CD1-CG 3.72Å; L757-L761 HydrophobicContact CD2-CD1 4.18Å; L757-L761 HydrophobicContact CG-CD1 3.74Å; L757-L761 HydrophobicContact CG-CG 4.06Å; L757-L761 PolarHBondContact O-N 3.23Å; L757-L761 VanDerWaalsContact O-N 3.16Å; L757-F769 HydrophobicContact CD1-CE2 3.66Å; L757-F769 HydrophobicContact CD1-CZ 3.47Å; L757-F769 VanDerWaalsContact CD1-CZ 3.47Å; L757-L783 HydrophobicContact CD1-CD1 3.88Å; L757-L783 HydrophobicContact CD2-CD1 3.89Å
758	M	91.6	Very high	86.1	Confident	56 Å²	56	52.9 Å²	52.9	28%	0.276	28%	0.28	S	S	.	.	H	α-helix	trans	-56.6	-47	-169.4	-174.4	-168.1	74.9	0	0	113.6	P666 F667 L753 D754 S760 L761 L762	P666-M758 HydrophobicContact CG-SD 4.34Å; F667-M758 HydrophobicContact CE2-CB 4.47Å; F667-M758 HydrophobicContact CE2-CG 3.86Å; F667-M758 HydrophobicContact CZ-CB 4.33Å; F667-M758 HydrophobicContact CZ-CG 3.81Å; L753-M758 HydrophobicContact CD2-SD 4.23Å; D754-M758 WeakPolarHBondContact O-CB 3.45Å; D754-M758 PolarHBondContact O-N 2.71Å; M758-S760 PolarHBondContact O-N 2.95Å; M758-L761 PolarHBondContact O-N 2.9Å; M758-L762 HydrophobicContact CE-CD1 4.5Å; M758-L762 HydrophobicContact CG-CD1 3.72Å; M758-L762 HydrophobicContact CG-CG 4.26Å; M758-L762 WeakPolarHBondContact O-CG 3.47Å; M758-L762 PolarHBondContact O-N 2.86Å; M758-L762 HydrophobicContact SD-CD1 4.28Å
759	P	87.3	Confident	85.5	Confident	57 Å²	57	53.4 Å²	53.4	37%	0.37	28%	0.283	S	S	.	.	H	α-helix	trans	-63.4	-42.7	-178.6	-21.5	34.7	0	0	0	112.3	P755 L761 L762 E763	P755-P759 WeakPolarHBondContact O-CD 3.44Å; P755-P759 WeakPolarHBondContact O-CG 3.35Å; P759-L761 PolarHBondContact O-N 3.42Å; P759-L762 PolarHBondContact O-N 3.26Å; P759-E763 WeakPolarHBondContact O-CB 3.49Å; P759-E763 WeakPolarHBondContact O-CG 3.22Å; P759-E763 PolarHBondContact O-N 3.04Å
760	S	85.6	Confident	85.2	Confident	30 Å²	30	52.9 Å²	52.9	21%	0.21	28%	0.279	C	S	.	.	H	α-helix	trans	-57.8	-48.4	177.3	-48.6	0	0	0	0	111.8	L757 M758 E763 N764 R765 Q767	L757-S760 PolarHBondContact O-N 3.5Å; M758-S760 PolarHBondContact O-N 2.95Å; S760-E763 CarbonylContact O-C 3.49Å; S760-E763 PolarHBondContact O-N 2.9Å; S760-N764 PolarHBondContact O-N 3.14Å; S760-R765 WeakPolarHBondContact O-CA 3.5Å; S760-R765 WeakPolarHBondContact O-CB 3.49Å; S760-R765 PolarHBondContact O-N 3.17Å; S760-Q767 PolarHBondContact OG-OE1 2.87Å
761	L	86.9	Confident	85.2	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-66.5	-39.4	-179.1	-67.8	-172.4	0	0	0	112.5	F667 L752 L757 M758 P759 E763 N764 L783 F785	F667-L761 HydrophobicContact CE1-CB 3.71Å; F667-L761 HydrophobicContact CE1-CD1 3.89Å; F667-L761 HydrophobicContact CE1-CG 4.49Å; F667-L761 HydrophobicContact CZ-CB 4.06Å; F667-L761 HydrophobicContact CZ-CD1 4.06Å; L752-L761 HydrophobicContact CD2-CD1 4.26Å; L757-L761 HydrophobicContact CD1-CD1 3.71Å; L757-L761 HydrophobicContact CD1-CD2 4.16Å; L757-L761 HydrophobicContact CD1-CG 3.72Å; L757-L761 HydrophobicContact CD2-CD1 4.18Å; L757-L761 HydrophobicContact CG-CD1 3.74Å; L757-L761 HydrophobicContact CG-CG 4.06Å; L757-L761 PolarHBondContact O-N 3.23Å; L757-L761 VanDerWaalsContact O-N 3.16Å; M758-L761 PolarHBondContact O-N 2.9Å; P759-L761 PolarHBondContact O-N 3.42Å; L761-E763 VanDerWaalsContact C-N 3.33Å; L761-N764 WeakPolarHBondContact O-CA 3.45Å; L761-N764 PolarHBondContact O-N 3.34Å; L761-L783 HydrophobicContact CD2-CB 3.98Å; L761-F785 HydrophobicContact CB-CB 4.01Å; L761-F785 HydrophobicContact CD2-CB 4.41Å
762	L	86.8	Confident	85.1	Confident	68 Å²	68	50.7 Å²	50.7	36%	0.356	27%	0.27	S	S	.	.	H	α-helix	trans	-73	-25.9	178.6	-64.4	177.1	0	0	0	112.9	P666 F667 M758 P759 N764 F785	P666-L762 HydrophobicContact CB-CD1 4.16Å; P666-L762 HydrophobicContact CB-CD2 3.93Å; P666-L762 HydrophobicContact CG-CD1 3.84Å; P666-L762 HydrophobicContact CG-CD2 4.09Å; F667-L762 HydrophobicContact CD1-CD2 4.32Å; F667-L762 HydrophobicContact CE1-CD2 3.8Å; F667-L762 HydrophobicContact CE1-CG 4.22Å; F667-L762 HydrophobicContact CZ-CD2 4.14Å; F667-L762 HydrophobicContact CZ-CG 4.19Å; M758-L762 HydrophobicContact CE-CD1 4.5Å; M758-L762 HydrophobicContact CG-CD1 3.72Å; M758-L762 HydrophobicContact CG-CG 4.26Å; M758-L762 WeakPolarHBondContact O-CG 3.47Å; M758-L762 PolarHBondContact O-N 2.86Å; M758-L762 HydrophobicContact SD-CD1 4.28Å; P759-L762 PolarHBondContact O-N 3.26Å; L762-N764 PolarHBondContact O-N 2.96Å; L762-F785 HydrophobicContact CD2-CD1 4.22Å; L762-F785 HydrophobicContact CD2-CE1 3.99Å
763	E	80.9	Confident	85.2	Confident	106 Å²	106	51 Å²	51	50%	0.495	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	6.8	165.4	-69.4	-176.4	-150.9	0	0	113.1	P759 S760 L761 R765	P759-E763 WeakPolarHBondContact O-CB 3.49Å; P759-E763 WeakPolarHBondContact O-CG 3.22Å; P759-E763 PolarHBondContact O-N 3.04Å; S760-E763 CarbonylContact O-C 3.49Å; S760-E763 PolarHBondContact O-N 2.9Å; L761-E763 VanDerWaalsContact C-N 3.33Å; E763-R765 HydrophobicContact CB-CG 3.98Å; E763-R765 PolarHBondContact O-N 3.42Å; E763-R765 IonicContact OE2-CZ 3.97Å; E763-R765 IonicContact OE2-NE 2.61Å; E763-R765 PolarHBondContact OE2-NE 2.98Å; E763-R765 IonicContact OE2-NH2 2.64Å; E763-R765 PolarHBondContact OE2-NH2 3.34Å
764	N	74.5	Confident	85	Confident	74 Å²	74	53.7 Å²	53.7	40%	0.396	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.2	19.4	-177.9	-38.3	-83	0	0	0	113.9	S760 L761 L762 F785 L790	S760-N764 PolarHBondContact O-N 3.14Å; L761-N764 WeakPolarHBondContact O-CA 3.45Å; L761-N764 PolarHBondContact O-N 3.34Å; L762-N764 PolarHBondContact O-N 2.96Å; N764-F785 PolarHBondContact OD1-O 3.47Å; N764-L790 WeakPolarHBondContact OD1-CD1 3.38Å
765	R	73.3	Confident	84.9	Confident	154 Å²	154	55 Å²	55	58%	0.581	30%	0.295	S	S	*	.			trans	-82.3	123.3	176.2	-51.9	-176.6	-170.1	-140.6	10.4	109.7	S760 E763 Q767	S760-R765 WeakPolarHBondContact O-CA 3.5Å; S760-R765 WeakPolarHBondContact O-CB 3.49Å; S760-R765 PolarHBondContact O-N 3.17Å; E763-R765 HydrophobicContact CB-CG 3.98Å; E763-R765 PolarHBondContact O-N 3.42Å; E763-R765 IonicContact OE2-CZ 3.97Å; E763-R765 IonicContact OE2-NE 2.61Å; E763-R765 PolarHBondContact OE2-NE 2.98Å; E763-R765 IonicContact OE2-NH2 2.64Å; E763-R765 PolarHBondContact OE2-NH2 3.34Å; R765-Q767 PolarHBondContact O-N 2.88Å
766	S	79.9	Confident	85	Confident	68 Å²	68	60.1 Å²	60.1	48%	0.476	31%	0.305	S	S	.	.			trans	-71.7	129.2	172.6	75.5	0	0	0	0	111.4	L783	S766-L783 CarbonylContact C-O 3.57Å; S766-L783 WeakPolarHBondContact CA-O 3.45Å
767	Q	81	Confident	85.3	Confident	25 Å²	25	55 Å²	55	12%	0.117	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	136.7	-177.7	-162.2	173.3	-11.4	0	0	109.9	L756 S760 R765 F769 R782 L783	L756-Q767 PolarHBondContact O-NE2 2.98Å; L756-Q767 PolarHBondContact O-OE1 3.05Å; S760-Q767 PolarHBondContact OG-OE1 2.87Å; R765-Q767 PolarHBondContact O-N 2.88Å; Q767-F769 HydrophobicContact CB-CE2 3.72Å; Q767-F769 HydrophobicContact CB-CZ 3.71Å; Q767-F769 HydrophobicContact CG-CE1 3.93Å; Q767-F769 HydrophobicContact CG-CE2 3.81Å; Q767-F769 HydrophobicContact CG-CZ 3.32Å; Q767-F769 WeakPolarHBondContact O-CE2 3.4Å; Q767-R782 VanDerWaalsContact O-CA 3.32Å; Q767-R782 WeakPolarHBondContact O-CA 3.34Å; Q767-L783 PolarHBondContact N-O 2.86Å; Q767-L783 PolarHBondContact O-N 2.56Å
768	S	83.3	Confident	85.6	Confident	37 Å²	37	56.6 Å²	56.6	26%	0.259	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	132	-171.3	-53.3	0	0	0	0	111.3	L781 R782	S768-L781 CarbonylContact C-O 3.55Å; S768-L781 WeakPolarHBondContact CA-O 3.13Å; S768-R782 PolarHBondContact OG-NE 3.29Å; S768-R782 VanDerWaalsContact OG-NE 3.12Å
769	F	81.3	Confident	85.6	Confident	12 Å²	12	53.9 Å²	53.9	5%	0.053	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	155.9	-165	-60.5	-79.8	0	0	0	112.7	Q640 L757 Q767 L781 L783	Q640-F769 HydrophobicContact CB-CD1 4.09Å; Q640-F769 HydrophobicContact CB-CE1 4.29Å; L757-F769 HydrophobicContact CD1-CE2 3.66Å; L757-F769 HydrophobicContact CD1-CZ 3.47Å; L757-F769 VanDerWaalsContact CD1-CZ 3.47Å; Q767-F769 HydrophobicContact CB-CE2 3.72Å; Q767-F769 HydrophobicContact CB-CZ 3.71Å; Q767-F769 HydrophobicContact CG-CE1 3.93Å; Q767-F769 HydrophobicContact CG-CE2 3.81Å; Q767-F769 HydrophobicContact CG-CZ 3.32Å; Q767-F769 WeakPolarHBondContact O-CE2 3.4Å; F769-L781 HydrophobicContact CB-CD1 4.38Å; F769-L781 HydrophobicContact CD2-CD1 4.11Å; F769-L781 PolarHBondContact N-O 3.04Å; F769-L781 PolarHBondContact O-N 3.32Å; F769-L783 HydrophobicContact CE2-CB 4.45Å; F769-L783 HydrophobicContact CE2-CD1 4.38Å; F769-L783 HydrophobicContact CE2-CG 4.42Å
770	A	87.7	Confident	85.8	Confident	5 Å²	5	51.9 Å²	51.9	4%	0.041	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	96.5	153.7	0	0	0	0	0	107.8	Q640 I641 A642 N772 I780	Q640-A770 PolarHBondContact O-N 3.06Å; I641-A770 WeakPolarHBondContact CA-O 3.25Å; A642-A770 PolarHBondContact N-O 3.16Å; A642-A770 VanDerWaalsContact N-O 3.15Å; A770-N772 PolarHBondContact O-N 3.37Å; A770-I780 HydrophobicContact CB-CD1 3.82Å
771	L	91.7	Very high	86.2	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	118.6	174.4	171.5	60.4	0	0	0	108.7	A642 L731 L750 L773 Q778 L779 L781	A642-L771 HydrophobicContact CB-CD1 4.01Å; L731-L771 HydrophobicContact CD1-CD2 3.84Å; L750-L771 HydrophobicContact CD1-CD2 4.09Å; L750-L771 HydrophobicContact CD2-CD1 3.9Å; L750-L771 HydrophobicContact CG-CD1 4.11Å; L750-L771 HydrophobicContact CG-CD2 4.06Å; L771-L773 HydrophobicContact CD2-CD2 4.14Å; L771-L773 HydrophobicContact CG-CD2 4.06Å; L771-Q778 CarbonylContact O-C 3.6Å; L771-Q778 VanDerWaalsContact O-CA 3.23Å; L771-Q778 WeakPolarHBondContact O-CA 3.33Å; L771-L779 HydrophobicContact CB-CB 4.49Å; L771-L779 PolarHBondContact N-O 3.34Å; L771-L779 PolarHBondContact O-N 3.32Å; L771-L781 HydrophobicContact CB-CD2 3.91Å; L771-L781 HydrophobicContact CD2-CD2 3.92Å
772	N	91.3	Very high	86.2	Confident	53 Å²	53	55 Å²	55	28%	0.283	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	143.1	170.9	-71.1	-30.2	0	0	0	110.3	I641 N645 A770 Q778	I641-N772 WeakPolarHBondContact CG2-ND2 3.29Å; N645-N772 PolarHBondContact ND2-O 3.28Å; A770-N772 PolarHBondContact O-N 3.37Å; N772-Q778 WeakPolarHBondContact OD1-CG 3.36Å; N772-Q778 PolarHBondContact OD1-NE2 2.83Å
773	L	92.6	Very high	86.5	Confident	7 Å²	7	51.7 Å²	51.7	4%	0.037	25%	0.251	C	S	.	.			trans	-118.3	136.5	178.9	-51	176.1	0	0	0	111.2	L681 I733 H746 R747 L771 P775 R776 G777 L779	L681-L773 HydrophobicContact CD2-CD1 3.7Å; I733-L773 HydrophobicContact CD1-CD1 3.52Å; I733-L773 HydrophobicContact CG1-CD1 4.4Å; H746-L773 HydrophobicContact CB-CB 4.04Å; H746-L773 HydrophobicContact CB-CD1 3.91Å; R747-L773 CarbonylContact O-C 3.51Å; R747-L773 VanDerWaalsContact O-CA 3.28Å; R747-L773 WeakPolarHBondContact O-CA 3.42Å; L771-L773 HydrophobicContact CD2-CD2 4.14Å; L771-L773 HydrophobicContact CG-CD2 4.06Å; L773-P775 CarbonylContact O-C 3.59Å; L773-R776 CarbonylContact O-C 3.52Å; L773-R776 VanDerWaalsContact O-C 3.28Å; L773-R776 VanDerWaalsContact O-CA 3.25Å; L773-R776 WeakPolarHBondContact O-CA 3.3Å; L773-R776 PolarHBondContact O-N 3.01Å; L773-G777 PolarHBondContact N-O 3.34Å; L773-G777 PolarHBondContact O-N 2.78Å; L773-L779 HydrophobicContact CD1-CB 4.25Å; L773-L779 HydrophobicContact CD2-CB 4.24Å; L773-L779 HydrophobicContact CG-CB 4.48Å
774	E	88.9	Confident	86.9	Confident	122 Å²	122	47 Å²	47	57%	0.57	23%	0.232	S	C	*	.	B	Isolated β-bridge	trans	-79.3	141.8	168.5	-169	178.1	-174.6	0	0	109.3	N645 H746 R747	N645-E774 PolarHBondContact ND2-N 2.94Å; N645-E774 VanDerWaalsContact ND2-N 3.15Å; H746-E774 CarbonylContact C-O 3.59Å; H746-E774 VanDerWaalsContact CA-O 3.22Å; H746-E774 WeakPolarHBondContact CA-O 3.48Å; R747-E774 PolarHBondContact N-O 3.07Å; R747-E774 PolarHBondContact O-N 3.22Å
775	P	86.9	Confident	87.6	Confident	92 Å²	92	43.6 Å²	43.6	60%	0.597	21%	0.213	S	C	*	.	S	Bend	cis	-76.7	-29.8	-4.8	30.5	-34.7	0	0	0	113.5	L773	L773-P775 CarbonylContact O-C 3.59Å
776	R	85.5	Confident	88.3	Confident	172 Å²	172	37.5 Å²	37.5	65%	0.649	19%	0.192	S	C	*	.	S	Bend	trans	-153.3	134.9	169.6	-73.1	-167.7	174.4	178.4	-1.9	110.1	H746 L773	H746-R776 PolarHBondContact CE1-O 3.01Å; H746-R776 PolarHBondContact ND1-O 3.05Å; L773-R776 CarbonylContact O-C 3.52Å; L773-R776 VanDerWaalsContact O-C 3.28Å; L773-R776 VanDerWaalsContact O-CA 3.25Å; L773-R776 WeakPolarHBondContact O-CA 3.3Å; L773-R776 PolarHBondContact O-N 3.01Å
777	G	88.7	Confident	88.6	Confident	10 Å²	10	36 Å²	36	10%	0.103	18%	0.181	C	C	.	.			trans	161.7	170.5	173.3	0	0	0	0	0	110.5	L773	L773-G777 PolarHBondContact N-O 3.34Å; L773-G777 PolarHBondContact O-N 2.78Å
778	Q	92.1	Very high	88.9	Confident	40 Å²	40	35.6 Å²	35.6	19%	0.187	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	136.9	167.7	-76.8	-175.9	-23.6	0	0	110.3	R679 L771 N772	R679-Q778 HydrophobicContact CB-CB 4.29Å; R679-Q778 PolarHBondContact N-O 3.37Å; R679-Q778 PolarHBondContact O-N 2.88Å; L771-Q778 CarbonylContact O-C 3.6Å; L771-Q778 VanDerWaalsContact O-CA 3.23Å; L771-Q778 WeakPolarHBondContact O-CA 3.33Å; N772-Q778 WeakPolarHBondContact OD1-CG 3.36Å; N772-Q778 PolarHBondContact OD1-NE2 2.83Å
779	L	91.9	Very high	88.9	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	120.2	170.2	-162.8	62.5	0	0	0	108.9	I675 W715 L731 I733 L771 L773 L781	I675-L779 HydrophobicContact CD1-CD2 4.39Å; I675-L779 HydrophobicContact CG2-CD1 3.74Å; I675-L779 HydrophobicContact CG2-CD2 4.26Å; I675-L779 HydrophobicContact CG2-CG 4.11Å; W715-L779 HydrophobicContact CE3-CD1 4.18Å; W715-L779 HydrophobicContact CZ3-CD1 3.74Å; L731-L779 HydrophobicContact CB-CD2 4.31Å; L731-L779 HydrophobicContact CD2-CD2 3.75Å; I733-L779 HydrophobicContact CD1-CD1 4.36Å; L771-L779 HydrophobicContact CB-CB 4.49Å; L771-L779 PolarHBondContact N-O 3.34Å; L771-L779 PolarHBondContact O-N 3.32Å; L773-L779 HydrophobicContact CD1-CB 4.25Å; L773-L779 HydrophobicContact CD2-CB 4.24Å; L773-L779 HydrophobicContact CG-CB 4.48Å; L779-L781 HydrophobicContact CB-CD2 4.37Å; L779-L781 HydrophobicContact CD2-CD2 4.05Å; L779-L781 HydrophobicContact CG-CD2 4.25Å
780	I	91	Very high	88.9	Confident	14 Å²	14	40.6 Å²	40.6	7%	0.072	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	112.9	174.7	-52.1	-55.5	0	0	0	107.5	F676 E677 R679 A770	F676-I780 HydrophobicContact CB-CB 4.46Å; F676-I780 HydrophobicContact CB-CG2 4.31Å; F676-I780 WeakPolarHBondContact CB-O 3.17Å; F676-I780 HydrophobicContact CD2-CG2 4.17Å; F676-I780 PolarHBondContact N-O 3.49Å; E677-I780 HydrophobicContact CG-CB 3.98Å; E677-I780 HydrophobicContact CG-CG1 3.87Å; E677-I780 PolarHBondContact N-O 3.17Å; E677-I780 PolarHBondContact O-N 2.89Å; R679-I780 HydrophobicContact CG-CG1 4.24Å; A770-I780 HydrophobicContact CB-CD1 3.82Å
781	L	94	Very high	88.6	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	163.2	-173.2	66.4	87.8	0	0	0	112.2	Q674 L731 L750 S768 F769 L771 L779 L783	Q674-L781 CarbonylContact O-C 3.55Å; Q674-L781 WeakPolarHBondContact O-CA 3.21Å; Q674-L781 WeakPolarHBondContact O-CB 3.04Å; L731-L781 HydrophobicContact CD2-CD2 4.32Å; L750-L781 HydrophobicContact CD1-CD1 4.03Å; L750-L781 HydrophobicContact CD1-CD2 4.19Å; S768-L781 CarbonylContact C-O 3.55Å; S768-L781 WeakPolarHBondContact CA-O 3.13Å; F769-L781 HydrophobicContact CB-CD1 4.38Å; F769-L781 HydrophobicContact CD2-CD1 4.11Å; F769-L781 PolarHBondContact N-O 3.04Å; F769-L781 PolarHBondContact O-N 3.32Å; L771-L781 HydrophobicContact CB-CD2 3.91Å; L771-L781 HydrophobicContact CD2-CD2 3.92Å; L779-L781 HydrophobicContact CB-CD2 4.37Å; L779-L781 HydrophobicContact CD2-CD2 4.05Å; L779-L781 HydrophobicContact CG-CD2 4.25Å; L781-L783 HydrophobicContact CD1-CD2 4.17Å; L781-L783 HydrophobicContact CD1-CG 3.98Å
782	R	88	Confident	88.2	Confident	94 Å²	94	41.5 Å²	41.5	36%	0.355	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	133.7	171.1	169.9	-173.8	-65.7	172.2	-7.3	109.4	Q674 F676 Q767 S768	Q674-R782 HydrophobicContact CB-CB 4.32Å; Q674-R782 PolarHBondContact N-O 3.39Å; Q674-R782 PolarHBondContact O-N 2.77Å; F676-R782 HydrophobicContact CE2-CB 3.74Å; F676-R782 HydrophobicContact CZ-CB 4.22Å; Q767-R782 VanDerWaalsContact O-CA 3.32Å; Q767-R782 WeakPolarHBondContact O-CA 3.34Å; S768-R782 PolarHBondContact OG-NE 3.29Å; S768-R782 VanDerWaalsContact OG-NE 3.12Å
783	L	91.1	Very high	87.4	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	144.6	168.7	-63.9	-176.9	0	0	0	109.8	I672 I673 L750 L757 L761 S766 Q767 F769 L781	I672-L783 CarbonylContact O-C 3.54Å; I672-L783 WeakPolarHBondContact O-CA 3.31Å; I673-L783 HydrophobicContact CB-CD2 4.26Å; I673-L783 HydrophobicContact CD1-CD2 4.1Å; I673-L783 HydrophobicContact CG1-CD2 3.72Å; I673-L783 HydrophobicContact CG2-CD2 4.05Å; L750-L783 HydrophobicContact CD1-CD1 4.06Å; L757-L783 HydrophobicContact CD1-CD1 3.88Å; L757-L783 HydrophobicContact CD2-CD1 3.89Å; L761-L783 HydrophobicContact CD2-CB 3.98Å; S766-L783 CarbonylContact C-O 3.57Å; S766-L783 WeakPolarHBondContact CA-O 3.45Å; Q767-L783 PolarHBondContact N-O 2.86Å; Q767-L783 PolarHBondContact O-N 2.56Å; F769-L783 HydrophobicContact CE2-CB 4.45Å; F769-L783 HydrophobicContact CE2-CD1 4.38Å; F769-L783 HydrophobicContact CE2-CG 4.42Å; L781-L783 HydrophobicContact CD1-CD2 4.17Å; L781-L783 HydrophobicContact CD1-CG 3.98Å
784	G	89.5	Confident	86.3	Confident	8 Å²	8	45.6 Å²	45.6	8%	0.082	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	163.4	164.9	0	0	0	0	0	109.5	I672	I672-G784 PolarHBondContact N-O 3.12Å; I672-G784 PolarHBondContact O-N 2.93Å
785	F	90.9	Very high	84.5	Confident	2 Å²	2	44 Å²	44	1%	0.009	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	138.1	179.3	175.5	-110.9	0	0	0	110.2	F667 L670 V723 L761 L762 N764	F667-F785 HydrophobicContact CB-CE2 4.37Å; F667-F785 HydrophobicContact CB-CZ 4.47Å; F667-F785 AromaticContact CD1-CD1 3.81Å; F667-F785 HydrophobicContact CD1-CD1 3.81Å; F667-F785 AromaticContact CD1-CD2 3.87Å; F667-F785 HydrophobicContact CD1-CD2 3.87Å; F667-F785 AromaticContact CD1-CE1 3.86Å; F667-F785 HydrophobicContact CD1-CE1 3.86Å; F667-F785 AromaticContact CD1-CE2 3.94Å; F667-F785 HydrophobicContact CD1-CE2 3.94Å; F667-F785 AromaticContact CD1-CG 3.81Å; F667-F785 HydrophobicContact CD1-CG 3.81Å; F667-F785 AromaticContact CD1-CZ 3.93Å; F667-F785 HydrophobicContact CD1-CZ 3.93Å; F667-F785 HydrophobicContact CE1-CB 4.46Å; F667-F785 AromaticContact CE1-CD1 3.92Å; F667-F785 HydrophobicContact CE1-CD1 3.92Å; F667-F785 HydrophobicContact CE1-CE1 4.29Å; F667-F785 HydrophobicContact CE1-CG 4.07Å; L670-F785 WeakPolarHBondContact O-CA 3.45Å; L670-F785 VanDerWaalsContact O-CD2 3.3Å; L670-F785 WeakPolarHBondContact O-CD2 3.36Å; V723-F785 HydrophobicContact CG2-CD2 4.41Å; V723-F785 HydrophobicContact CG2-CE2 3.88Å; L761-F785 HydrophobicContact CB-CB 4.01Å; L761-F785 HydrophobicContact CD2-CB 4.41Å; L762-F785 HydrophobicContact CD2-CD1 4.22Å; L762-F785 HydrophobicContact CD2-CE1 3.99Å; N764-F785 PolarHBondContact OD1-O 3.47Å
786	L	86.6	Confident	82.2	Confident	25 Å²	25	42.9 Å²	42.9	13%	0.131	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	119.4	166.9	-79.4	68	0	0	0	107.7	G669 L670 I672 M791 P808 I809	G669-L786 CarbonylContact C-O 3.59Å; G669-L786 WeakPolarHBondContact CA-O 3.33Å; L670-L786 HydrophobicContact CB-CB 4.43Å; L670-L786 PolarHBondContact N-O 3.2Å; L670-L786 PolarHBondContact O-N 3.03Å; I672-L786 HydrophobicContact CD1-CD1 3.65Å; I672-L786 HydrophobicContact CG1-CD1 4.47Å; L786-M791 HydrophobicContact CB-CG 4.29Å; L786-P808 HydrophobicContact CD2-CB 4.04Å; L786-P808 HydrophobicContact CD2-CG 4.46Å; L786-I809 HydrophobicContact CD2-CG1 4.29Å
787	S	87.8	Confident	79.8	Confident	36 Å²	36	35.2 Å²	35.2	25%	0.252	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	156.8	172.3	69.5	0	0	0	0	111.8	L789 L790 M791	S787-L789 PolarHBondContact O-N 3.1Å; S787-L790 PolarHBondContact O-N 3.35Å; S787-M791 PolarHBondContact O-N 3.35Å; S787-M791 VanDerWaalsContact O-N 3.1Å
788	M	86.7	Confident	77	Confident	18 Å²	18	38.4 Å²	38.4	9%	0.089	19%	0.186	C	C	.	.	H	α-helix	trans	-51.6	-32.2	173.4	-69.2	-137.6	-49.9	0	0	113.8	T668 L790 M791 Y792 L1000 N1002	T668-M788 HydrophobicContact CG2-CG 3.98Å; T668-M788 HydrophobicContact CG2-SD 4.08Å; T668-M788 WeakPolarHBondContact O-CG 3.16Å; T668-M788 PolarHBondContact O-N 3.34Å; T668-M788 VanDerWaalsContact O-N 3.15Å; M788-L790 PolarHBondContact O-N 2.94Å; M788-M791 PolarHBondContact O-N 3.08Å; M788-Y792 HydrophobicContact CB-CD2 3.91Å; M788-Y792 HydrophobicContact CB-CE2 4.14Å; M788-Y792 HydrophobicContact CG-CD2 4.3Å; M788-Y792 HydrophobicContact CG-CE2 4.03Å; M788-Y792 VanDerWaalsContact O-CD2 3.29Å; M788-Y792 WeakPolarHBondContact O-CD2 3.23Å; M788-Y792 PolarHBondContact O-N 2.92Å; M788-Y792 HydrophobicContact SD-CD2 4.15Å; M788-Y792 HydrophobicContact SD-CE2 3.71Å; M788-L1000 HydrophobicContact CE-CB 4.2Å; M788-L1000 WeakPolarHBondContact CE-O 3.38Å; M788-N1002 HydrophobicContact CE-CB 3.85Å; M788-N1002 HydrophobicContact SD-CB 4.38Å; M788-N1002 PolarHBondContact SD-ND2 3.15Å
789	L	83.5	Confident	74.2	Confident	99 Å²	99	42 Å²	42	52%	0.518	20%	0.198	S	C	.	.	H	α-helix	trans	-63.9	-26.3	179	-176.7	142.9	0	0	0	112.5	S787 S985 L1000	S787-L789 PolarHBondContact O-N 3.1Å; L789-S985 WeakPolarHBondContact O-CB 3.45Å; L789-S985 PolarHBondContact O-OG 2.99Å; L789-L1000 HydrophobicContact CB-CD1 4.08Å; L789-L1000 HydrophobicContact CD1-CD1 4.5Å; L789-L1000 HydrophobicContact CG-CD1 4.45Å
790	L	81.1	Confident	71.5	Confident	54 Å²	54	48.2 Å²	48.2	28%	0.283	24%	0.239	S	C	.	.	H	α-helix	trans	-88.9	-46.2	173	-62.8	178.9	0	0	0	112.1	N764 S787 M788 Y792 R793	N764-L790 WeakPolarHBondContact OD1-CD1 3.38Å; S787-L790 PolarHBondContact O-N 3.35Å; M788-L790 PolarHBondContact O-N 2.94Å; L790-Y792 PolarHBondContact O-N 3.1Å; L790-R793 VanDerWaalsContact O-CB 3.29Å; L790-R793 WeakPolarHBondContact O-CB 3.4Å; L790-R793 PolarHBondContact O-N 3.31Å
791	M	80.6	Confident	69.4	Low	18 Å²	18	48.5 Å²	48.5	9%	0.089	24%	0.242	C	C	.	.	H	α-helix	trans	-53.3	-52.9	178.3	-64.2	175.9	74.2	0	0	111.7	G669 L670 L786 S787 M788 R793	G669-M791 WeakPolarHBondContact CA-SD 3.43Å; L670-M791 HydrophobicContact CB-CE 3.91Å; L670-M791 HydrophobicContact CB-CG 4.23Å; L670-M791 HydrophobicContact CB-SD 3.76Å; L670-M791 HydrophobicContact CD1-CE 4.18Å; L670-M791 HydrophobicContact CG-CE 4.49Å; L670-M791 PolarHBondContact N-SD 3.06Å; L670-M791 VanDerWaalsContact N-SD 3.36Å; L786-M791 HydrophobicContact CB-CG 4.29Å; S787-M791 PolarHBondContact O-N 3.35Å; S787-M791 VanDerWaalsContact O-N 3.1Å; M788-M791 PolarHBondContact O-N 3.08Å; M791-R793 PolarHBondContact O-N 3.5Å
792	Y	83.2	Confident	67.5	Low	6 Å²	6	51.3 Å²	51.3	2%	0.024	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	18.7	-175.1	-56.8	-67.9	0	0	0	112.4	M788 L790 R794 P979 L980 C983 T984 S985 L1000	M788-Y792 HydrophobicContact CB-CD2 3.91Å; M788-Y792 HydrophobicContact CB-CE2 4.14Å; M788-Y792 HydrophobicContact CG-CD2 4.3Å; M788-Y792 HydrophobicContact CG-CE2 4.03Å; M788-Y792 VanDerWaalsContact O-CD2 3.29Å; M788-Y792 WeakPolarHBondContact O-CD2 3.23Å; M788-Y792 PolarHBondContact O-N 2.92Å; M788-Y792 HydrophobicContact SD-CD2 4.15Å; M788-Y792 HydrophobicContact SD-CE2 3.71Å; L790-Y792 PolarHBondContact O-N 3.1Å; Y792-R794 PolarHBondContact O-N 3.33Å; Y792-P979 HydrophobicContact CE1-CB 4.12Å; Y792-P979 WeakPolarHBondContact CE1-O 3.49Å; Y792-P979 HydrophobicContact CE2-CB 3.89Å; Y792-P979 WeakPolarHBondContact OH-CB 3.12Å; Y792-L980 HydrophobicContact CE1-CD2 4.29Å; Y792-C983 HydrophobicContact CD1-CB 4.15Å; Y792-C983 HydrophobicContact CD2-CB 4.2Å; Y792-C983 HydrophobicContact CG-CB 3.9Å; Y792-T984 CarbonylContact O-C 3.57Å; Y792-T984 VanDerWaalsContact O-CA 3.25Å; Y792-T984 WeakPolarHBondContact O-CA 3.38Å; Y792-S985 PolarHBondContact O-N 2.78Å; Y792-L1000 HydrophobicContact CD2-CD2 4.39Å
793	R	74.6	Confident	65.8	Low	128 Å²	128	47.4 Å²	47.4	48%	0.483	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-26.6	174.5	-159.9	-179.7	165.2	165.4	-4	112.5	L790 M791 Q795 S985 V986	L790-R793 VanDerWaalsContact O-CB 3.29Å; L790-R793 WeakPolarHBondContact O-CB 3.4Å; L790-R793 PolarHBondContact O-N 3.31Å; M791-R793 PolarHBondContact O-N 3.5Å; R793-Q795 HydrophobicContact CG-CB 4.18Å; R793-Q795 WeakPolarHBondContact O-CG 2.95Å; R793-Q795 PolarHBondContact O-N 3.47Å; R793-S985 WeakPolarHBondContact CA-OG 3.27Å; R793-V986 HydrophobicContact CG-CG2 3.88Å; R793-V986 VanDerWaalsContact O-CG2 3.25Å; R793-V986 WeakPolarHBondContact O-CG2 3.21Å
794	R	69.7	Low	64.1	Low	19 Å²	19	47.6 Å²	47.6	7%	0.072	25%	0.245	C	C	.	.			trans	45.8	33	174.3	-60.7	177.7	-174.8	-90.5	5	113.3	Y792 W806 L899 C900 M902 P905 L980 C983	Y792-R794 PolarHBondContact O-N 3.33Å; R794-W806 WeakPolarHBondContact O-CZ3 3.36Å; R794-L899 PolarHBondContact NH1-O 3.29Å; R794-L899 PolarHBondContact NH2-O 3.21Å; R794-C900 PolarHBondContact NH1-O 3.44Å; R794-M902 WeakPolarHBondContact CD-O 3.3Å; R794-M902 WeakPolarHBondContact CG-O 3.46Å; R794-M902 PolarHBondContact NH1-O 3.34Å; R794-P905 VanDerWaalsContact CD-CD 3.5Å; R794-L980 PolarHBondContact NH2-O 3.12Å; R794-C983 PolarHBondContact NE-O 2.85Å; R794-C983 PolarHBondContact NH2-O 3.04Å
795	Q	52.2	Low	61.8	Low	87 Å²	87	47.4 Å²	47.4	41%	0.407	24%	0.243	S	C	.	.			trans	-118	112.7	-173.7	-90.9	-176.7	-15.9	0	0	111	R793 V986	R793-Q795 HydrophobicContact CG-CB 4.18Å; R793-Q795 WeakPolarHBondContact O-CG 2.95Å; R793-Q795 PolarHBondContact O-N 3.47Å; Q795-V986 HydrophobicContact CG-CG2 4.02Å
796	L	37.8	Very low	59.3	Low	70 Å²	70	49 Å²	49	37%	0.366	25%	0.249	S	C	.	.			trans	57.5	110.5	151.4	-50.8	172.1	0	0	0	117.7	W806 N814 I815 E816	L796-W806 VanDerWaalsContact CA-CH2 3.45Å; L796-W806 VanDerWaalsContact N-CH2 3.27Å; L796-N814 HydrophobicContact CB-CB 3.81Å; L796-N814 HydrophobicContact CD1-CB 4.46Å; L796-N814 PolarHBondContact O-OD1 3.33Å; L796-I815 CarbonylContact C-O 3.58Å; L796-I815 WeakPolarHBondContact CA-O 3.25Å; L796-E816 HydrophobicContact CD2-CB 4.46Å; L796-E816 HydrophobicContact CD2-CG 3.94Å
797	A	34.4	Very low	57.3	Low	10 Å²	10	48.7 Å²	48.7	8%	0.083	25%	0.247	C	C	.	.			trans	-135.8	123.6	159.3	0	0	0	0	0	119.3	R799 A805 Q813 I815	A797-R799 PolarHBondContact O-N 2.82Å; A797-A805 WeakPolarHBondContact CA-O 3.14Å; A797-A805 WeakPolarHBondContact CB-O 3.19Å; A797-Q813 CarbonylContact C-O 3.56Å; A797-Q813 WeakPolarHBondContact CA-O 3.5Å; A797-Q813 WeakPolarHBondContact CB-O 3.45Å; A797-I815 PolarHBondContact N-O 2.99Å; A797-I815 VanDerWaalsContact N-O 3.1Å; A797-I815 WeakPolarHBondContact O-CB 3.28Å; A797-I815 PolarHBondContact O-N 3.31Å
798	L	30.6	Very low	54.9	Low	78 Å²	78	51.1 Å²	51.1	41%	0.408	26%	0.262	S	S	.	.			trans	-73.2	77.1	-170.7	-113	161.3	0	0	0	111.8	Q813 N814 I815	L798-Q813 HydrophobicContact CB-CB 3.21Å; L798-Q813 HydrophobicContact CB-CG 4.47Å; L798-Q813 HydrophobicContact CD1-CB 3.97Å; L798-Q813 HydrophobicContact CG-CB 4.22Å; L798-Q813 PolarHBondContact N-O 2.82Å; L798-N814 VanDerWaalsContact CB-N 3.32Å; L798-N814 VanDerWaalsContact CG-O 3.3Å; L798-N814 WeakPolarHBondContact CG-O 3.11Å; L798-I815 HydrophobicContact CB-CG1 4.37Å; L798-I815 HydrophobicContact CD2-CD1 3.63Å; L798-I815 HydrophobicContact CD2-CG1 3.7Å; L798-I815 HydrophobicContact CG-CB 4.43Å; L798-I815 HydrophobicContact CG-CD1 4.22Å; L798-I815 HydrophobicContact CG-CG1 3.85Å
799	R	32.6	Very low	52.9	Low	115 Å²	115	53.7 Å²	53.7	43%	0.434	28%	0.275	S	S	.	.	S	Bend	trans	-150.8	152	139.8	-80.7	-147	168.7	-170.1	-4.6	111.2	Y625 A797 S801 A805	Y625-R799 PolarHBondContact OH-NH1 3.1Å; A797-R799 PolarHBondContact O-N 2.82Å; R799-S801 PolarHBondContact O-N 3.1Å; R799-A805 VanDerWaalsContact O-CB 3.28Å; R799-A805 WeakPolarHBondContact O-CB 3.34Å
800	P	36.2	Very low	50.8	Low	131 Å²	131	51.6 Å²	51.6	85%	0.851	27%	0.266	S	S	*	.			trans	-74	69.6	168.1	33.2	-35.5	0	0	0	110.5
801	S	47	Very low	48.7	Very low	20 Å²	20	53.4 Å²	53.4	14%	0.14	27%	0.272	C	S	.	.			trans	-102.8	136	161.8	167.9	0	0	0	0	108.6	R799 Y803 W804 E872	R799-S801 PolarHBondContact O-N 3.1Å; S801-Y803 VanDerWaalsContact C-N 3.33Å; S801-Y803 PolarHBondContact O-N 2.85Å; S801-W804 PolarHBondContact OG-N 3.37Å; S801-E872 WeakPolarHBondContact CB-OE1 3.44Å; S801-E872 WeakPolarHBondContact OG-CG 3.14Å; S801-E872 PolarHBondContact OG-OE1 2.89Å
802	T	53.7	Low	46.7	Very low	59 Å²	59	62 Å²	62	36%	0.362	31%	0.312	S	S	.	.	S	Bend	trans	-75.1	-20.2	-173.2	36.8	0	0	0	0	114.1	I818	T802-I818 HydrophobicContact CG2-CD1 4.16Å
803	Y	52.4	Low	44.5	Very low	13 Å²	13	67.1 Å²	67.1	5%	0.051	34%	0.336	C	S	.	.	S	Bend	trans	-125.4	-44.9	-176.4	-64.8	-90	0	0	0	113	S801 L823 E827 L836 I871 P875 W898	S801-Y803 VanDerWaalsContact C-N 3.33Å; S801-Y803 PolarHBondContact O-N 2.85Å; Y803-L823 HydrophobicContact CD1-CD2 4.25Å; Y803-L823 HydrophobicContact CE1-CD1 4.17Å; Y803-L823 HydrophobicContact CE1-CD2 4Å; Y803-E827 PolarHBondContact OH-OE1 3.31Å; Y803-L836 HydrophobicContact CD1-CB 4.28Å; Y803-L836 HydrophobicContact CD1-CD2 3.44Å; Y803-L836 VanDerWaalsContact CD1-CD2 3.44Å; Y803-L836 HydrophobicContact CE1-CB 3.72Å; Y803-L836 HydrophobicContact CE1-CD2 3.78Å; Y803-L836 HydrophobicContact CE1-CG 4.43Å; Y803-L836 HydrophobicContact CG-CD2 4.04Å; Y803-I871 HydrophobicContact CD2-CG2 4.34Å; Y803-I871 HydrophobicContact CG-CG2 4.45Å; Y803-P875 HydrophobicContact CE2-CB 3.74Å; Y803-P875 HydrophobicContact CE2-CG 3.68Å; Y803-P875 WeakPolarHBondContact OH-CG 3.45Å; Y803-W898 AromaticContact CD1-NE1 3.95Å
804	W	54.9	Low	42.7	Very low	4 Å²	4	66.5 Å²	66.5	2%	0.015	34%	0.343	C	S	.	.			trans	-113.8	14.8	-161.3	-49.2	133.4	0	0	0	116.3	S801 W806 I807 L836 V868 I871 E872 V894 W898	S801-W804 PolarHBondContact OG-N 3.37Å; W804-W806 PolarHBondContact O-N 2.85Å; W804-I807 HydrophobicContact CB-CD1 4.38Å; W804-L836 HydrophobicContact CH2-CD2 3.74Å; W804-L836 HydrophobicContact CZ2-CD2 3.51Å; W804-V868 HydrophobicContact CB-CG1 4.35Å; W804-V868 VanDerWaalsContact CD1-CG1 3.46Å; W804-V868 HydrophobicContact CG-CG1 4.06Å; W804-V868 HydrophobicContact CG-CG2 4.37Å; W804-I871 HydrophobicContact CZ2-CD1 4.32Å; W804-I871 HydrophobicContact CZ2-CG2 4.25Å; W804-E872 HydrophobicContact CG-CG 4.45Å; W804-V894 HydrophobicContact CH2-CG1 3.71Å; W804-V894 HydrophobicContact CZ2-CG1 3.46Å; W804-V894 VanDerWaalsContact CZ2-CG1 3.46Å; W804-W898 HydrophobicContact CH2-CB 3.78Å; W804-W898 AromaticContact CH2-CD1 3.68Å; W804-W898 HydrophobicContact CH2-CG 4.13Å; W804-W898 HydrophobicContact CZ3-CB 3.79Å; W804-W898 AromaticContact CZ3-CD1 3.62Å; W804-W898 HydrophobicContact CZ3-CG 4.12Å
805	A	41.8	Very low	41.4	Very low	4 Å²	4	68.4 Å²	68.4	3%	0.033	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	31.2	172.1	0	0	0	0	0	114.4	A797 R799	A797-A805 WeakPolarHBondContact CA-O 3.14Å; A797-A805 WeakPolarHBondContact CB-O 3.19Å; R799-A805 VanDerWaalsContact O-CB 3.28Å; R799-A805 WeakPolarHBondContact O-CB 3.34Å
806	W	37.7	Very low	41.1	Very low	36 Å²	36	72.2 Å²	72.2	14%	0.136	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-145.2	-10.4	-163.1	-64.9	88.3	0	0	0	114.3	R794 L796 W804 P808 I815 A901 P903	R794-W806 WeakPolarHBondContact O-CZ3 3.36Å; L796-W806 VanDerWaalsContact CA-CH2 3.45Å; L796-W806 VanDerWaalsContact N-CH2 3.27Å; W804-W806 PolarHBondContact O-N 2.85Å; W806-P808 VanDerWaalsContact O-CD 3.28Å; W806-P808 WeakPolarHBondContact O-CD 3.47Å; W806-I815 WeakPolarHBondContact CH2-O 3.47Å; W806-I815 WeakPolarHBondContact CZ2-O 3.3Å; W806-A901 HydrophobicContact CB-CB 3.77Å; W806-A901 VanDerWaalsContact CB-O 3.23Å; W806-A901 WeakPolarHBondContact CB-O 3.19Å; W806-P903 HydrophobicContact CZ3-CB 4.18Å
807	I	44	Very low	42	Very low	17 Å²	17	69.6 Å²	69.6	9%	0.087	36%	0.362	C	S	.	.			trans	-76.3	115	178.7	-57.2	178.8	0	0	0	108.7	W804 I809 V810	W804-I807 HydrophobicContact CB-CD1 4.38Å; I807-I809 HydrophobicContact CG2-CB 4.4Å; I807-I809 PolarHBondContact O-N 2.78Å; I807-V810 HydrophobicContact CB-CG2 4.19Å; I807-V810 HydrophobicContact CG2-CG2 3.91Å; I807-V810 PolarHBondContact O-N 3.31Å
808	P	39	Very low	43.6	Very low	88 Å²	88	70.8 Å²	70.8	57%	0.571	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-2.7	-169.5	-23.3	34.8	0	0	0	116.2	L786 W806	L786-P808 HydrophobicContact CD2-CB 4.04Å; L786-P808 HydrophobicContact CD2-CG 4.46Å; W806-P808 VanDerWaalsContact O-CD 3.28Å; W806-P808 WeakPolarHBondContact O-CD 3.47Å
809	I	43.7	Very low	45.9	Very low	71 Å²	71	70.6 Å²	70.6	36%	0.364	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-16.1	-169.6	-60.8	164.2	0	0	0	111.5	L670 I672 E720 L786 I807	L670-I809 HydrophobicContact CD2-CD1 4.16Å; I672-I809 HydrophobicContact CD1-CD1 3.65Å; I672-I809 HydrophobicContact CD1-CG1 4.13Å; I672-I809 HydrophobicContact CG1-CD1 4.44Å; E720-I809 HydrophobicContact CG-CD1 4.19Å; E720-I809 WeakPolarHBondContact OE1-CD1 3.31Å; L786-I809 HydrophobicContact CD2-CG1 4.29Å; I807-I809 HydrophobicContact CG2-CB 4.4Å; I807-I809 PolarHBondContact O-N 2.78Å
810	V	40	Very low	48.5	Very low	55 Å²	55	65.9 Å²	65.9	33%	0.333	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	-35.1	-166.4	-160.7	0	0	0	0	114.1	I807 L865	I807-V810 HydrophobicContact CB-CG2 4.19Å; I807-V810 HydrophobicContact CG2-CG2 3.91Å; I807-V810 PolarHBondContact O-N 3.31Å; V810-L865 HydrophobicContact CG1-CD2 4.33Å; V810-L865 HydrophobicContact CG2-CD2 3.93Å
811	F	37.2	Very low	50.8	Low	92 Å²	92	61.9 Å²	61.9	40%	0.404	33%	0.331	S	S	.	.			trans	-138.1	116.8	-172.7	-59.6	-63.8	0	0	0	113.5	Q813	F811-Q813 PolarHBondContact O-N 3.34Å
812	E	37.8	Very low	52.7	Low	199 Å²	199	62.9 Å²	62.9	93%	0.93	34%	0.336	S	S	*	.			trans	-97.6	49.8	-165.5	-164.1	-175.5	-131.3	0	0	113.9
813	Q	38	Very low	54.2	Low	114 Å²	114	60.6 Å²	60.6	53%	0.533	32%	0.322	S	S	.	.	S	Bend	trans	-146.3	168	-174.8	-52.4	-173.2	-15.6	0	0	108.6	A797 L798 F811	A797-Q813 CarbonylContact C-O 3.56Å; A797-Q813 WeakPolarHBondContact CA-O 3.5Å; A797-Q813 WeakPolarHBondContact CB-O 3.45Å; L798-Q813 HydrophobicContact CB-CB 3.21Å; L798-Q813 HydrophobicContact CB-CG 4.47Å; L798-Q813 HydrophobicContact CD1-CB 3.97Å; L798-Q813 HydrophobicContact CG-CB 4.22Å; L798-Q813 PolarHBondContact N-O 2.82Å; F811-Q813 PolarHBondContact O-N 3.34Å
814	N	36.7	Very low	55.7	Low	115 Å²	115	60.7 Å²	60.7	62%	0.615	32%	0.324	S	S	*	.			trans	-117.8	108.9	-175	-60.8	-54.1	0	0	0	120.3	L796 L798	L796-N814 HydrophobicContact CB-CB 3.81Å; L796-N814 HydrophobicContact CD1-CB 4.46Å; L796-N814 PolarHBondContact O-OD1 3.33Å; L798-N814 VanDerWaalsContact CB-N 3.32Å; L798-N814 VanDerWaalsContact CG-O 3.3Å; L798-N814 WeakPolarHBondContact CG-O 3.11Å
815	I	42.2	Very low	57.2	Low	58 Å²	58	67.6 Å²	67.6	30%	0.297	36%	0.356	S	S	.	.			trans	-123.9	149.7	169.4	-99.9	167.8	0	0	0	111.3	L796 A797 L798 W806	L796-I815 CarbonylContact C-O 3.58Å; L796-I815 WeakPolarHBondContact CA-O 3.25Å; A797-I815 PolarHBondContact N-O 2.99Å; A797-I815 VanDerWaalsContact N-O 3.1Å; A797-I815 WeakPolarHBondContact O-CB 3.28Å; A797-I815 PolarHBondContact O-N 3.31Å; L798-I815 HydrophobicContact CB-CG1 4.37Å; L798-I815 HydrophobicContact CD2-CD1 3.63Å; L798-I815 HydrophobicContact CD2-CG1 3.7Å; L798-I815 HydrophobicContact CG-CB 4.43Å; L798-I815 HydrophobicContact CG-CD1 4.22Å; L798-I815 HydrophobicContact CG-CG1 3.85Å; W806-I815 WeakPolarHBondContact CH2-O 3.47Å; W806-I815 WeakPolarHBondContact CZ2-O 3.3Å
816	E	45.8	Very low	59.3	Low	167 Å²	167	75.4 Å²	75.4	78%	0.78	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-65.6	139	172.8	-62.7	-178.5	140.2	0	0	113.8	L796	L796-E816 HydrophobicContact CD2-CB 4.46Å; L796-E816 HydrophobicContact CD2-CG 3.94Å
817	G	56.2	Low	61.5	Low	16 Å²	16	75.5 Å²	75.5	17%	0.165	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-76.8	142.7	-175.5	0	0	0	0	0	112.1	P819	G817-P819 WeakPolarHBondContact O-CD 3.44Å
818	I	67.5	Low	63.3	Low	35 Å²	35	78.9 Å²	78.9	18%	0.179	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-64.2	117.1	171.6	-53.6	176.3	0	0	0	107.1	T802 T822 L823	T802-I818 HydrophobicContact CG2-CD1 4.16Å; I818-T822 HydrophobicContact CG2-CG2 4.05Å; I818-L823 HydrophobicContact CG2-CB 3.94Å
819	P	80.1	Confident	65.2	Low	74 Å²	74	76.5 Å²	76.5	48%	0.481	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-62.1	146.8	176.4	-22.1	35	0	0	0	110	G817 A821 T822 L823	G817-P819 WeakPolarHBondContact O-CD 3.44Å; P819-A821 PolarHBondContact O-N 3.02Å; P819-A821 VanDerWaalsContact O-N 3.09Å; P819-T822 WeakPolarHBondContact O-CA 3.44Å; P819-T822 WeakPolarHBondContact O-CB 3.12Å; P819-T822 PolarHBondContact O-N 3.13Å; P819-L823 PolarHBondContact O-N 3.28Å
820	L	86.2	Confident	67	Low	16 Å²	16	77 Å²	77	8%	0.084	43%	0.425	C	S	.	.	H	α-helix	trans	-52.8	-39.3	-172.7	179.7	59	0	0	0	113.2	L823 V824 P834 W898 M902 L906 V944 N945 T948	L820-L823 PolarHBondContact O-N 2.82Å; L820-V824 PolarHBondContact O-N 3.22Å; L820-P834 HydrophobicContact CD1-CG 3.49Å; L820-P834 VanDerWaalsContact CD1-CG 3.49Å; L820-W898 HydrophobicContact CD1-CH2 3.65Å; L820-W898 HydrophobicContact CD1-CZ2 3.72Å; L820-M902 HydrophobicContact CD1-SD 4.34Å; L820-M902 HydrophobicContact CD2-SD 4.22Å; L820-L906 HydrophobicContact CD2-CD1 3.6Å; L820-V944 HydrophobicContact CD2-CG1 4.48Å; L820-V944 HydrophobicContact CG-CG1 3.91Å; L820-N945 HydrophobicContact CD2-CB 4.35Å; L820-T948 HydrophobicContact CD2-CG2 4.42Å
821	A	85.4	Confident	69.1	Low	46 Å²	46	79.3 Å²	79.3	38%	0.38	43%	0.428	S	S	.	.	H	α-helix	trans	-62.9	-45.2	174.8	0	0	0	0	0	113	P819 L823 V824 E825 V944	P819-A821 PolarHBondContact O-N 3.02Å; P819-A821 VanDerWaalsContact O-N 3.09Å; A821-L823 VanDerWaalsContact C-N 3.3Å; A821-L823 PolarHBondContact O-N 2.83Å; A821-V824 PolarHBondContact O-N 3.46Å; A821-E825 WeakPolarHBondContact O-CB 3.41Å; A821-E825 PolarHBondContact O-N 2.84Å; A821-V944 HydrophobicContact CB-CB 4.38Å; A821-V944 HydrophobicContact CB-CG2 4.03Å
822	T	85.7	Confident	71.6	Confident	41 Å²	41	79.8 Å²	79.8	25%	0.252	43%	0.432	S	S	.	.	H	α-helix	trans	-69	-26.5	177.8	-50	0	0	0	0	112.5	I818 P819 R826	I818-T822 HydrophobicContact CG2-CG2 4.05Å; P819-T822 WeakPolarHBondContact O-CA 3.44Å; P819-T822 WeakPolarHBondContact O-CB 3.12Å; P819-T822 PolarHBondContact O-N 3.13Å; T822-R826 WeakPolarHBondContact O-CB 3.25Å; T822-R826 WeakPolarHBondContact O-CD 3.38Å; T822-R826 WeakPolarHBondContact O-CG 3.39Å; T822-R826 PolarHBondContact O-N 3.48Å; T822-R826 VanDerWaalsContact O-N 3.13Å
823	L	85.2	Confident	74.1	Confident	12 Å²	12	71 Å²	71	6%	0.063	39%	0.392	C	S	.	.	H	α-helix	trans	-66	-53.4	172.1	175.2	59.5	0	0	0	110.2	Y803 I818 P819 L820 A821 E825 R826 E827 P834	Y803-L823 HydrophobicContact CD1-CD2 4.25Å; Y803-L823 HydrophobicContact CE1-CD1 4.17Å; Y803-L823 HydrophobicContact CE1-CD2 4Å; I818-L823 HydrophobicContact CG2-CB 3.94Å; P819-L823 PolarHBondContact O-N 3.28Å; L820-L823 PolarHBondContact O-N 2.82Å; A821-L823 VanDerWaalsContact C-N 3.3Å; A821-L823 PolarHBondContact O-N 2.83Å; L823-E825 PolarHBondContact O-N 3.38Å; L823-R826 PolarHBondContact O-N 2.92Å; L823-R826 VanDerWaalsContact O-N 3.13Å; L823-E827 HydrophobicContact CD1-CG 4.48Å; L823-E827 WeakPolarHBondContact O-CG 3.11Å; L823-E827 PolarHBondContact O-N 2.93Å; L823-P834 HydrophobicContact CD2-CB 4.39Å; L823-P834 HydrophobicContact CD2-CG 4.22Å
824	V	85.3	Confident	76.5	Confident	15 Å²	15	65.6 Å²	65.6	9%	0.091	37%	0.366	C	S	.	.	H	α-helix	trans	-62.7	-40.3	180	173.1	0	0	0	0	112.1	L820 A821 R826 E827 A828 Y831 P834 V944	L820-V824 PolarHBondContact O-N 3.22Å; A821-V824 PolarHBondContact O-N 3.46Å; V824-R826 VanDerWaalsContact C-N 3.34Å; V824-R826 PolarHBondContact O-N 3.34Å; V824-E827 PolarHBondContact O-N 3Å; V824-A828 PolarHBondContact O-N 2.62Å; V824-Y831 WeakPolarHBondContact CG1-O 3.46Å; V824-P834 HydrophobicContact CG2-CB 4.42Å; V824-P834 HydrophobicContact CG2-CG 3.65Å; V824-V944 HydrophobicContact CB-CG1 3.92Å; V824-V944 HydrophobicContact CG1-CG1 4.37Å; V824-V944 HydrophobicContact CG2-CG1 3.5Å
825	E	86.5	Confident	79	Confident	148 Å²	148	60.8 Å²	60.8	69%	0.692	34%	0.341	S	S	*	.	H	α-helix	trans	-58.1	-43.8	172.7	-176.2	-178.1	-154.8	0	0	112.1	A821 L823 A828	A821-E825 WeakPolarHBondContact O-CB 3.41Å; A821-E825 PolarHBondContact O-N 2.84Å; L823-E825 PolarHBondContact O-N 3.38Å; E825-A828 PolarHBondContact O-N 3.31Å
826	R	84.5	Confident	81.3	Confident	168 Å²	168	58 Å²	58	63%	0.634	33%	0.326	S	S	*	.	H	α-helix	trans	-72.4	-28.1	178.9	-75.8	172.6	-179.9	-172.6	3.2	114.1	T822 L823 V824 A828	T822-R826 WeakPolarHBondContact O-CB 3.25Å; T822-R826 WeakPolarHBondContact O-CD 3.38Å; T822-R826 WeakPolarHBondContact O-CG 3.39Å; T822-R826 PolarHBondContact O-N 3.48Å; T822-R826 VanDerWaalsContact O-N 3.13Å; L823-R826 PolarHBondContact O-N 2.92Å; L823-R826 VanDerWaalsContact O-N 3.13Å; V824-R826 VanDerWaalsContact C-N 3.34Å; V824-R826 PolarHBondContact O-N 3.34Å; R826-A828 VanDerWaalsContact C-N 3.26Å
827	E	83.7	Confident	83.5	Confident	38 Å²	38	50 Å²	50	18%	0.178	29%	0.289	C	S	.	.	H	α-helix	trans	-67.2	-29.4	174.4	-74.2	174.5	-151.7	0	0	112.3	Y803 L823 V824 S829 P834 I835	Y803-E827 PolarHBondContact OH-OE1 3.31Å; L823-E827 HydrophobicContact CD1-CG 4.48Å; L823-E827 WeakPolarHBondContact O-CG 3.11Å; L823-E827 PolarHBondContact O-N 2.93Å; V824-E827 PolarHBondContact O-N 3Å; E827-S829 PolarHBondContact O-N 3.24Å; E827-S829 PolarHBondContact OE2-OG 2.67Å; E827-P834 WeakPolarHBondContact OE1-CA 3.35Å; E827-P834 WeakPolarHBondContact OE1-CB 3.4Å; E827-I835 HydrophobicContact CG-CG2 4.44Å; E827-I835 WeakPolarHBondContact OE2-CB 3.43Å; E827-I835 WeakPolarHBondContact OE2-CG2 3.35Å; E827-I835 PolarHBondContact OE2-N 2.94Å
828	A	82.2	Confident	85.2	Confident	89 Å²	89	50.6 Å²	50.6	74%	0.736	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	29.3	-175.3	0	0	0	0	0	113.6	V824 E825 R826 G830	V824-A828 PolarHBondContact O-N 2.62Å; E825-A828 PolarHBondContact O-N 3.31Å; R826-A828 VanDerWaalsContact C-N 3.26Å; A828-G830 VanDerWaalsContact C-N 3.29Å; A828-G830 PolarHBondContact O-N 3.49Å
829	S	79.4	Confident	86.5	Confident	38 Å²	38	51.5 Å²	51.5	27%	0.266	29%	0.289	S	S	.	.			trans	-78.2	-9.1	-168.1	60.6	0	0	0	0	114.5	E827 Y831	E827-S829 PolarHBondContact O-N 3.24Å; E827-S829 PolarHBondContact OE2-OG 2.67Å; S829-Y831 VanDerWaalsContact C-N 3.29Å; S829-Y831 WeakPolarHBondContact O-CD2 3.23Å
830	G	81.1	Confident	87.3	Confident	81 Å²	81	48 Å²	48	84%	0.835	27%	0.266	S	S	*	.	S	Bend	trans	82.9	-2.1	-175.5	0	0	0	0	0	114.7	A828	A828-G830 VanDerWaalsContact C-N 3.29Å; A828-G830 PolarHBondContact O-N 3.49Å
831	Y	84.3	Confident	87.7	Confident	103 Å²	103	47.7 Å²	47.7	40%	0.404	27%	0.265	S	S	.	.	S	Bend	trans	-103.6	152.9	177.2	-59.7	-78.6	0	0	0	111.6	V824 S829 V833 I835 I838	V824-Y831 WeakPolarHBondContact CG1-O 3.46Å; S829-Y831 VanDerWaalsContact C-N 3.29Å; S829-Y831 WeakPolarHBondContact O-CD2 3.23Å; Y831-V833 PolarHBondContact O-N 3.29Å; Y831-I835 HydrophobicContact CD2-CD1 4.14Å; Y831-I835 HydrophobicContact CE2-CD1 4.04Å; Y831-I838 HydrophobicContact CD1-CD1 3.77Å; Y831-I838 HydrophobicContact CD2-CD1 3.84Å; Y831-I838 HydrophobicContact CE1-CD1 4.4Å; Y831-I838 HydrophobicContact CE2-CD1 4.47Å; Y831-I838 HydrophobicContact CG-CD1 3.45Å; Y831-I838 VanDerWaalsContact CG-CD1 3.45Å
832	E	89.4	Confident	88.2	Confident	103 Å²	103	50.8 Å²	50.8	48%	0.481	27%	0.272	S	S	.	.	S	Bend	trans	-88.2	15.3	171.2	-55.9	-164.5	128.7	0	0	113.1	N943 V944 C947	E832-N943 PolarHBondContact OE1-ND2 3.28Å; E832-N943 PolarHBondContact OE2-ND2 2.83Å; E832-V944 WeakPolarHBondContact O-CG1 3.13Å; E832-C947 HydrophobicContact CB-CB 4Å; E832-C947 PolarHBondContact OE2-SG 2.89Å
833	V	89.7	Confident	88.6	Confident	14 Å²	14	50 Å²	50	9%	0.085	27%	0.265	C	S	.	.	S	Bend	trans	-139.4	137.3	-176.8	-179.4	0	0	0	0	107.5	Y831 I835 V837 I838 C947 T948 A951	Y831-V833 PolarHBondContact O-N 3.29Å; V833-I835 PolarHBondContact O-N 2.95Å; V833-V837 HydrophobicContact CG1-CB 4.08Å; V833-V837 HydrophobicContact CG1-CG1 3.77Å; V833-I838 HydrophobicContact CB-CD1 4.18Å; V833-I838 HydrophobicContact CB-CG1 4.18Å; V833-I838 HydrophobicContact CG1-CG1 4.02Å; V833-C947 VanDerWaalsContact CG2-C 3.49Å; V833-C947 HydrophobicContact CG2-CB 3.87Å; V833-T948 HydrophobicContact CG1-CG2 4.31Å; V833-A951 HydrophobicContact CG1-CB 4.18Å
834	P	89.9	Confident	89.1	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.262	C	S	.	.			trans	-53	133.1	-179.7	-29.5	36.3	0	0	0	112.9	L820 L823 V824 E827 L836 V837 I838 W898	L820-P834 HydrophobicContact CD1-CG 3.49Å; L820-P834 VanDerWaalsContact CD1-CG 3.49Å; L823-P834 HydrophobicContact CD2-CB 4.39Å; L823-P834 HydrophobicContact CD2-CG 4.22Å; V824-P834 HydrophobicContact CG2-CB 4.42Å; V824-P834 HydrophobicContact CG2-CG 3.65Å; E827-P834 WeakPolarHBondContact OE1-CA 3.35Å; E827-P834 WeakPolarHBondContact OE1-CB 3.4Å; P834-L836 PolarHBondContact O-N 2.89Å; P834-L836 VanDerWaalsContact O-N 3.11Å; P834-V837 HydrophobicContact CB-CB 4.42Å; P834-V837 HydrophobicContact CB-CG2 4.15Å; P834-V837 HydrophobicContact CG-CG2 4.46Å; P834-V837 WeakPolarHBondContact O-CB 3.08Å; P834-V837 PolarHBondContact O-N 3.3Å; P834-I838 PolarHBondContact O-N 2.91Å; P834-W898 HydrophobicContact CB-CZ2 4.23Å; P834-W898 HydrophobicContact CG-CH2 4.04Å; P834-W898 HydrophobicContact CG-CZ2 3.69Å
835	I	88.2	Confident	89.5	Confident	14 Å²	14	51.1 Å²	51.1	7%	0.072	27%	0.269	C	S	.	.	H	α-helix	trans	-57.4	-33	-176.3	-169.3	58.8	0	0	0	111.9	E827 Y831 V833 I838 R839 P875 L876	E827-I835 HydrophobicContact CG-CG2 4.44Å; E827-I835 WeakPolarHBondContact OE2-CB 3.43Å; E827-I835 WeakPolarHBondContact OE2-CG2 3.35Å; E827-I835 PolarHBondContact OE2-N 2.94Å; Y831-I835 HydrophobicContact CD2-CD1 4.14Å; Y831-I835 HydrophobicContact CE2-CD1 4.04Å; V833-I835 PolarHBondContact O-N 2.95Å; I835-I838 PolarHBondContact O-N 3.46Å; I835-R839 HydrophobicContact CD1-CG 4.37Å; I835-R839 HydrophobicContact CG1-CG 4.33Å; I835-R839 WeakPolarHBondContact O-CB 3.44Å; I835-R839 VanDerWaalsContact O-CG 3.29Å; I835-R839 WeakPolarHBondContact O-CG 3.39Å; I835-R839 PolarHBondContact O-N 2.8Å; I835-P875 HydrophobicContact CG2-CB 4.09Å; I835-P875 HydrophobicContact CG2-CG 4.01Å; I835-L876 HydrophobicContact CD1-CD1 4.19Å; I835-L876 HydrophobicContact CG1-CD1 3.85Å
836	L	90.4	Very high	89.9	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.8	-42.6	175.3	178.2	63	0	0	0	112.6	Y803 W804 P834 R839 L840 I871	Y803-L836 HydrophobicContact CD1-CB 4.28Å; Y803-L836 HydrophobicContact CD1-CD2 3.44Å; Y803-L836 VanDerWaalsContact CD1-CD2 3.44Å; Y803-L836 HydrophobicContact CE1-CB 3.72Å; Y803-L836 HydrophobicContact CE1-CD2 3.78Å; Y803-L836 HydrophobicContact CE1-CG 4.43Å; Y803-L836 HydrophobicContact CG-CD2 4.04Å; W804-L836 HydrophobicContact CH2-CD2 3.74Å; W804-L836 HydrophobicContact CZ2-CD2 3.51Å; P834-L836 PolarHBondContact O-N 2.89Å; P834-L836 VanDerWaalsContact O-N 3.11Å; L836-R839 PolarHBondContact O-N 3.07Å; L836-L840 HydrophobicContact CD1-CD1 3.82Å; L836-L840 HydrophobicContact CD1-CG 4Å; L836-L840 HydrophobicContact CG-CD1 3.87Å; L836-L840 HydrophobicContact CG-CG 4.45Å; L836-L840 WeakPolarHBondContact O-CB 3.27Å; L836-L840 VanDerWaalsContact O-CG 3.29Å; L836-L840 WeakPolarHBondContact O-CG 3.25Å; L836-L840 PolarHBondContact O-N 2.98Å; L836-I871 HydrophobicContact CD1-CD1 3.81Å; L836-I871 HydrophobicContact CD1-CG1 4.04Å; L836-I871 HydrophobicContact CD1-CG2 3.84Å; L836-I871 HydrophobicContact CD2-CG2 3.78Å; L836-I871 HydrophobicContact CG-CG2 4.4Å
837	V	92.3	Very high	90.2	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.8	-45.5	177	167.1	0	0	0	0	109.9	V833 P834 I841 F895 W898	V833-V837 HydrophobicContact CG1-CB 4.08Å; V833-V837 HydrophobicContact CG1-CG1 3.77Å; P834-V837 HydrophobicContact CB-CB 4.42Å; P834-V837 HydrophobicContact CB-CG2 4.15Å; P834-V837 HydrophobicContact CG-CG2 4.46Å; P834-V837 WeakPolarHBondContact O-CB 3.08Å; P834-V837 PolarHBondContact O-N 3.3Å; V837-I841 HydrophobicContact CG1-CD1 3.82Å; V837-I841 WeakPolarHBondContact O-CB 3.42Å; V837-I841 VanDerWaalsContact O-CG1 3.32Å; V837-I841 WeakPolarHBondContact O-CG1 3.05Å; V837-I841 PolarHBondContact O-N 2.99Å; V837-F895 HydrophobicContact CG1-CE2 4.27Å; V837-W898 HydrophobicContact CG2-CD2 3.63Å; V837-W898 HydrophobicContact CG2-CE3 3.45Å; V837-W898 VanDerWaalsContact CG2-CE3 3.45Å; V837-W898 HydrophobicContact CG2-CG 4.48Å; V837-W898 HydrophobicContact CG2-CH2 3.7Å; V837-W898 HydrophobicContact CG2-CZ2 3.86Å; V837-W898 HydrophobicContact CG2-CZ3 3.48Å; V837-W898 VanDerWaalsContact CG2-CZ3 3.48Å
838	I	93	Very high	90.1	Very high	27 Å²	27	44.4 Å²	44.4	14%	0.138	24%	0.241	C	C	.	.	H	α-helix	trans	-59.4	-52.8	176.9	-60.9	173.2	0	0	0	110.4	Y831 V833 P834 I835 L840 I841 Q842	Y831-I838 HydrophobicContact CD1-CD1 3.77Å; Y831-I838 HydrophobicContact CD2-CD1 3.84Å; Y831-I838 HydrophobicContact CE1-CD1 4.4Å; Y831-I838 HydrophobicContact CE2-CD1 4.47Å; Y831-I838 HydrophobicContact CG-CD1 3.45Å; Y831-I838 VanDerWaalsContact CG-CD1 3.45Å; V833-I838 HydrophobicContact CB-CD1 4.18Å; V833-I838 HydrophobicContact CB-CG1 4.18Å; V833-I838 HydrophobicContact CG1-CG1 4.02Å; P834-I838 PolarHBondContact O-N 2.91Å; I835-I838 PolarHBondContact O-N 3.46Å; I838-L840 PolarHBondContact O-N 3.5Å; I838-I841 PolarHBondContact O-N 3.11Å; I838-Q842 HydrophobicContact CG2-CG 4.31Å; I838-Q842 WeakPolarHBondContact O-CB 3.42Å; I838-Q842 VanDerWaalsContact O-CG 3.26Å; I838-Q842 WeakPolarHBondContact O-CG 3.03Å; I838-Q842 PolarHBondContact O-N 3.11Å
839	R	94.4	Very high	90.3	Very high	54 Å²	54	41.2 Å²	41.2	20%	0.204	21%	0.211	C	C	.	.	H	α-helix	trans	-65.4	-38.7	-176.6	-70.3	-175.2	75.8	-133.3	-3.6	113.1	I835 L836 E843 P875 L876 A878 L880	I835-R839 HydrophobicContact CD1-CG 4.37Å; I835-R839 HydrophobicContact CG1-CG 4.33Å; I835-R839 WeakPolarHBondContact O-CB 3.44Å; I835-R839 VanDerWaalsContact O-CG 3.29Å; I835-R839 WeakPolarHBondContact O-CG 3.39Å; I835-R839 PolarHBondContact O-N 2.8Å; L836-R839 PolarHBondContact O-N 3.07Å; R839-E843 WeakPolarHBondContact O-CB 3.08Å; R839-E843 PolarHBondContact O-N 3.3Å; R839-P875 PolarHBondContact NH1-O 3.37Å; R839-L876 PolarHBondContact NH1-O 3.17Å; R839-A878 VanDerWaalsContact CZ-O 3.3Å; R839-A878 PolarHBondContact NH1-O 2.86Å; R839-A878 PolarHBondContact NH2-O 3.32Å; R839-L880 HydrophobicContact CB-CD1 3.77Å
840	L	95.7	Very high	90.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-65.3	-48	175.5	-75.2	169.7	0	0	0	111.5	L836 I838 E843 I844 L880 L891 V894 F895	L836-L840 HydrophobicContact CD1-CD1 3.82Å; L836-L840 HydrophobicContact CD1-CG 4Å; L836-L840 HydrophobicContact CG-CD1 3.87Å; L836-L840 HydrophobicContact CG-CG 4.45Å; L836-L840 WeakPolarHBondContact O-CB 3.27Å; L836-L840 VanDerWaalsContact O-CG 3.29Å; L836-L840 WeakPolarHBondContact O-CG 3.25Å; L836-L840 PolarHBondContact O-N 2.98Å; I838-L840 PolarHBondContact O-N 3.5Å; L840-E843 PolarHBondContact O-N 3.09Å; L840-I844 WeakPolarHBondContact O-CB 3.14Å; L840-I844 WeakPolarHBondContact O-CD1 3.5Å; L840-I844 WeakPolarHBondContact O-CG1 3.18Å; L840-I844 PolarHBondContact O-N 2.66Å; L840-L880 HydrophobicContact CD2-CD1 4.32Å; L840-L891 HydrophobicContact CD2-CB 4.31Å; L840-L891 HydrophobicContact CD2-CD2 4.11Å; L840-V894 HydrophobicContact CD1-CG1 4.01Å; L840-F895 HydrophobicContact CB-CD2 4.21Å; L840-F895 HydrophobicContact CD1-CB 4.3Å; L840-F895 HydrophobicContact CD1-CD2 4.31Å
841	I	96	Very high	90.4	Very high	10 Å²	10	39.9 Å²	39.9	5%	0.051	18%	0.184	C	C	.	.	H	α-helix	trans	-59.8	-50.4	177.4	-73.2	170.6	0	0	0	110.4	V837 I838 E843 I844 E845 F895 A951 H955	V837-I841 HydrophobicContact CG1-CD1 3.82Å; V837-I841 WeakPolarHBondContact O-CB 3.42Å; V837-I841 VanDerWaalsContact O-CG1 3.32Å; V837-I841 WeakPolarHBondContact O-CG1 3.05Å; V837-I841 PolarHBondContact O-N 2.99Å; I838-I841 PolarHBondContact O-N 3.11Å; I841-E843 VanDerWaalsContact C-N 3.34Å; I841-E843 PolarHBondContact O-N 2.71Å; I841-I844 PolarHBondContact O-N 3.46Å; I841-E845 HydrophobicContact CG2-CG 4.36Å; I841-E845 WeakPolarHBondContact O-CG 3.42Å; I841-E845 PolarHBondContact O-N 2.81Å; I841-F895 HydrophobicContact CD1-CE2 3.84Å; I841-F895 HydrophobicContact CD1-CZ 3.93Å; I841-F895 HydrophobicContact CG1-CD2 4.46Å; I841-F895 HydrophobicContact CG1-CE2 3.66Å; I841-F895 HydrophobicContact CG1-CZ 3.91Å; I841-A951 HydrophobicContact CD1-CB 4.3Å; I841-H955 HydrophobicContact CD1-CB 4.17Å; I841-H955 HydrophobicContact CG1-CB 4.24Å; I841-H955 HydrophobicContact CG2-CB 3.89Å
842	Q	94.9	Very high	90.3	Very high	112 Å²	112	38.4 Å²	38.4	52%	0.523	18%	0.182	S	C	.	.	H	α-helix	trans	-56.6	-45.7	179.3	-76.6	174.1	-20	0	0	112.2	I838 E845 R846	I838-Q842 HydrophobicContact CG2-CG 4.31Å; I838-Q842 WeakPolarHBondContact O-CB 3.42Å; I838-Q842 VanDerWaalsContact O-CG 3.26Å; I838-Q842 WeakPolarHBondContact O-CG 3.03Å; I838-Q842 PolarHBondContact O-N 3.11Å; Q842-E845 PolarHBondContact O-N 2.75Å; Q842-R846 WeakPolarHBondContact O-CB 3.3Å; Q842-R846 PolarHBondContact O-N 2.65Å
843	E	95	Very high	90	Very high	23 Å²	23	34.1 Å²	34.1	11%	0.107	17%	0.166	C	C	.	.	H	α-helix	trans	-71.6	-34.9	-178.5	-178.7	60.5	-164	0	0	112.8	R839 L840 I841 R846 R847 L880 L891	R839-E843 WeakPolarHBondContact O-CB 3.08Å; R839-E843 PolarHBondContact O-N 3.3Å; L840-E843 PolarHBondContact O-N 3.09Å; I841-E843 VanDerWaalsContact C-N 3.34Å; I841-E843 PolarHBondContact O-N 2.71Å; E843-R846 VanDerWaalsContact CD-NH2 3.34Å; E843-R846 IonicContact OE1-CZ 3.39Å; E843-R846 IonicContact OE1-NE 3.09Å; E843-R846 IonicContact OE1-NH2 2.81Å; E843-R846 PolarHBondContact OE1-NH2 3.4Å; E843-R846 IonicContact OE2-CZ 3.94Å; E843-R846 IonicContact OE2-NE 2.69Å; E843-R846 PolarHBondContact OE2-NE 2.69Å; E843-R846 IonicContact OE2-NH2 3.81Å; E843-R846 PolarHBondContact OE2-NH2 2.98Å; E843-R847 WeakPolarHBondContact O-CD 3.37Å; E843-R847 WeakPolarHBondContact O-CG 3.25Å; E843-R847 PolarHBondContact O-N 3.28Å; E843-R847 IonicContact OE1-CZ 3Å; E843-R847 IonicContact OE1-NE 3.72Å; E843-R847 PolarHBondContact OE1-NE 3.38Å; E843-R847 IonicContact OE1-NH2 3.3Å; E843-R847 PolarHBondContact OE1-NH2 3.26Å; E843-L880 HydrophobicContact CB-CB 4.44Å; E843-L880 HydrophobicContact CG-CB 4.05Å; E843-L880 VanDerWaalsContact CG-O 3.3Å; E843-L880 WeakPolarHBondContact CG-O 3.48Å; E843-L891 HydrophobicContact CB-CD1 4.38Å; E843-L891 HydrophobicContact CG-CD1 3.63Å
844	I	95.5	Very high	90.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66.3	-45.1	173.6	-68.4	164.8	0	0	0	110.3	L840 I841 R847 L849 L854 I888 L891 T892	L840-I844 WeakPolarHBondContact O-CB 3.14Å; L840-I844 WeakPolarHBondContact O-CD1 3.5Å; L840-I844 WeakPolarHBondContact O-CG1 3.18Å; L840-I844 PolarHBondContact O-N 2.66Å; I841-I844 PolarHBondContact O-N 3.46Å; I844-R847 PolarHBondContact O-N 3.41Å; I844-L849 HydrophobicContact CG2-CD2 4.06Å; I844-L854 HydrophobicContact CG2-CD1 4.36Å; I844-L854 HydrophobicContact CG2-CD2 4.22Å; I844-I888 HydrophobicContact CG1-CG1 4.5Å; I844-I888 HydrophobicContact CG2-CD1 4.39Å; I844-L891 HydrophobicContact CD1-CB 4.17Å; I844-L891 HydrophobicContact CG1-CB 4.02Å; I844-L891 HydrophobicContact CG1-CD1 4.42Å; I844-T892 HydrophobicContact CD1-CG2 4.07Å
845	E	94.2	Very high	90.2	Very high	51 Å²	51	33.5 Å²	33.5	24%	0.238	16%	0.162	C	C	.	.	H	α-helix	trans	-63.6	-42	175.6	-67.1	-170.1	159.4	0	0	112.3	I841 Q842 R847 G848 L849 H955 N958 R1019	I841-E845 HydrophobicContact CG2-CG 4.36Å; I841-E845 WeakPolarHBondContact O-CG 3.42Å; I841-E845 PolarHBondContact O-N 2.81Å; Q842-E845 PolarHBondContact O-N 2.75Å; E845-R847 VanDerWaalsContact C-N 3.29Å; E845-R847 PolarHBondContact O-N 2.99Å; E845-G848 PolarHBondContact O-N 3.26Å; E845-L849 HydrophobicContact CB-CD2 4.49Å; E845-L849 HydrophobicContact CG-CD1 4.17Å; E845-L849 HydrophobicContact CG-CD2 4.13Å; E845-H955 VanDerWaalsContact CG-ND1 3.32Å; E845-H955 WeakPolarHBondContact CG-ND1 3.47Å; E845-H955 IonicContact OE1-CE1 3.63Å; E845-H955 IonicContact OE1-CG 2.74Å; E845-H955 IonicContact OE1-ND1 3.02Å; E845-H955 PolarHBondContact OE1-ND1 3.42Å; E845-N958 PolarHBondContact OE1-ND2 2.89Å; E845-R1019 IonicContact OE2-NH1 3.99Å
846	R	94.2	Very high	90.4	Very high	146 Å²	146	33.5 Å²	33.5	55%	0.551	16%	0.163	S	C	*	.	H	α-helix	trans	-66	-26.1	-179.4	-166.7	-161.6	66.1	68.1	2.1	113.6	Q842 E843	Q842-R846 WeakPolarHBondContact O-CB 3.3Å; Q842-R846 PolarHBondContact O-N 2.65Å; E843-R846 VanDerWaalsContact CD-NH2 3.34Å; E843-R846 IonicContact OE1-CZ 3.39Å; E843-R846 IonicContact OE1-NE 3.09Å; E843-R846 IonicContact OE1-NH2 2.81Å; E843-R846 PolarHBondContact OE1-NH2 3.4Å; E843-R846 IonicContact OE2-CZ 3.94Å; E843-R846 IonicContact OE2-NE 2.69Å; E843-R846 PolarHBondContact OE2-NE 2.69Å; E843-R846 IonicContact OE2-NH2 3.81Å; E843-R846 PolarHBondContact OE2-NH2 2.98Å
847	R	90.5	Very high	90.5	Very high	51 Å²	51	34.6 Å²	34.6	19%	0.192	17%	0.168	C	C	.	.	H	α-helix	trans	-80.8	-29.7	-178.9	-77.8	170.1	-179.5	-134.3	9.1	114.4	E843 I844 E845 L880 S881 V885 P886 I888	E843-R847 WeakPolarHBondContact O-CD 3.37Å; E843-R847 WeakPolarHBondContact O-CG 3.25Å; E843-R847 PolarHBondContact O-N 3.28Å; E843-R847 IonicContact OE1-CZ 3Å; E843-R847 IonicContact OE1-NE 3.72Å; E843-R847 PolarHBondContact OE1-NE 3.38Å; E843-R847 IonicContact OE1-NH2 3.3Å; E843-R847 PolarHBondContact OE1-NH2 3.26Å; I844-R847 PolarHBondContact O-N 3.41Å; E845-R847 VanDerWaalsContact C-N 3.29Å; E845-R847 PolarHBondContact O-N 2.99Å; R847-L880 PolarHBondContact NH2-O 2.64Å; R847-S881 PolarHBondContact NH2-O 2.9Å; R847-S881 VanDerWaalsContact NH2-O 3.15Å; R847-V885 PolarHBondContact NH1-O 3.41Å; R847-V885 PolarHBondContact NH2-O 3.45Å; R847-P886 PolarHBondContact NH1-O 3.07Å; R847-I888 HydrophobicContact CB-CD1 3.76Å; R847-I888 HydrophobicContact CG-CD1 4.5Å
848	G	81.7	Confident	90.6	Very high	17 Å²	17	34.9 Å²	34.9	18%	0.175	17%	0.17	C	C	.	.			trans	125.3	111.5	-177.4	0	0	0	0	0	112.3	E845 D850 S851	E845-G848 PolarHBondContact O-N 3.26Å; G848-D850 PolarHBondContact O-N 3.25Å; G848-S851 WeakPolarHBondContact O-CB 3.29Å; G848-S851 PolarHBondContact O-N 3.41Å; G848-S851 PolarHBondContact O-OG 3.09Å
849	L	86.1	Confident	90.5	Very high	21 Å²	21	33.7 Å²	33.7	11%	0.11	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-4.9	178.8	-59.1	-175.4	0	0	0	113.6	I844 E845 S851 L854 N958 V959 Q962	I844-L849 HydrophobicContact CG2-CD2 4.06Å; E845-L849 HydrophobicContact CB-CD2 4.49Å; E845-L849 HydrophobicContact CG-CD1 4.17Å; E845-L849 HydrophobicContact CG-CD2 4.13Å; L849-S851 VanDerWaalsContact C-N 3.32Å; L849-L854 HydrophobicContact CD2-CD2 4.13Å; L849-N958 HydrophobicContact CD1-CB 3.75Å; L849-V959 HydrophobicContact CD1-CG2 4.34Å; L849-V959 HydrophobicContact CD2-CG2 4.02Å; L849-Q962 HydrophobicContact CB-CB 4.22Å; L849-Q962 HydrophobicContact CB-CG 3.85Å
850	D	80.6	Confident	90.3	Very high	68 Å²	68	31.1 Å²	31.1	36%	0.364	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-5	171.3	63.9	-43.2	0	0	0	113.6	G848 I852 H965	G848-D850 PolarHBondContact O-N 3.25Å; D850-I852 PolarHBondContact O-N 3.18Å; D850-H965 HydrophobicContact CB-CB 3.99Å
851	S	82.4	Confident	89.9	Confident	23 Å²	23	31.8 Å²	31.8	16%	0.161	16%	0.159	C	C	.	.			trans	-46.2	126	173.1	-63.9	0	0	0	0	112	G848 L849 G853 L854 S966	G848-S851 WeakPolarHBondContact O-CB 3.29Å; G848-S851 PolarHBondContact O-N 3.41Å; G848-S851 PolarHBondContact O-OG 3.09Å; L849-S851 VanDerWaalsContact C-N 3.32Å; S851-G853 PolarHBondContact O-N 3.43Å; S851-L854 PolarHBondContact O-N 2.81Å; S851-S966 WeakPolarHBondContact O-CB 3.39Å
852	I	81.3	Confident	89.4	Confident	73 Å²	73	34.1 Å²	34.1	37%	0.374	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	127	-172	-58.6	176.4	0	0	0	110.8	E545 D850 L854	E545-I852 PolarHBondContact OE1-N 3.31Å; E545-I852 WeakPolarHBondContact OE2-CB 3.25Å; D850-I852 PolarHBondContact O-N 3.18Å; I852-L854 VanDerWaalsContact C-N 3.34Å; I852-L854 PolarHBondContact O-N 2.73Å
853	G	83.6	Confident	89	Confident	13 Å²	13	29.7 Å²	29.7	13%	0.134	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	17.5	175.2	0	0	0	0	0	115.5	S851 Y855 V856 L857 S966	S851-G853 PolarHBondContact O-N 3.43Å; G853-Y855 PolarHBondContact O-N 3.43Å; G853-V856 WeakPolarHBondContact O-CB 3.33Å; G853-V856 PolarHBondContact O-N 2.82Å; G853-L857 PolarHBondContact O-N 2.87Å; G853-S966 PolarHBondContact N-O 2.85Å; G853-S966 VanDerWaalsContact N-O 3.1Å
854	L	91.3	Very high	88.8	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.9	134.4	174.6	-165	72.9	0	0	0	111.8	I844 L849 S851 I852 V856 I888 T892 V959 L968	I844-L854 HydrophobicContact CG2-CD1 4.36Å; I844-L854 HydrophobicContact CG2-CD2 4.22Å; L849-L854 HydrophobicContact CD2-CD2 4.13Å; S851-L854 PolarHBondContact O-N 2.81Å; I852-L854 VanDerWaalsContact C-N 3.34Å; I852-L854 PolarHBondContact O-N 2.73Å; L854-V856 PolarHBondContact O-N 2.92Å; L854-I888 HydrophobicContact CD1-CD1 3.79Å; L854-I888 HydrophobicContact CD1-CG1 4.07Å; L854-I888 HydrophobicContact CD1-CG2 4.35Å; L854-T892 HydrophobicContact CD1-CG2 3.55Å; L854-T892 HydrophobicContact CG-CG2 4.07Å; L854-V959 HydrophobicContact CD2-CG1 4.12Å; L854-V959 HydrophobicContact CD2-CG2 4.21Å; L854-L968 WeakPolarHBondContact O-CD2 3.47Å
855	Y	93.8	Very high	88.2	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	-22.3	-172.6	-67.2	-69.2	0	0	0	117.8	G853 T892 F895 K896 H955 V959 F977	G853-Y855 PolarHBondContact O-N 3.43Å; Y855-T892 VanDerWaalsContact CD1-CB 3.47Å; Y855-T892 HydrophobicContact CD1-CG2 3.85Å; Y855-T892 HydrophobicContact CD2-CG2 4.38Å; Y855-T892 VanDerWaalsContact CE1-CB 3.46Å; Y855-T892 HydrophobicContact CE1-CG2 3.65Å; Y855-T892 HydrophobicContact CE2-CG2 4.24Å; Y855-T892 HydrophobicContact CG-CG2 4.2Å; Y855-F895 HydrophobicContact CE1-CB 4.45Å; Y855-F895 AromaticContact CE1-CD1 3.68Å; Y855-F895 HydrophobicContact CE1-CD1 3.68Å; Y855-F895 HydrophobicContact CE1-CE1 4.42Å; Y855-F895 HydrophobicContact CE1-CG 4.47Å; Y855-F895 AromaticContact CZ-CD1 3.91Å; Y855-F895 WeakPolarHBondContact OH-CD1 3.09Å; Y855-K896 HydrophobicContact CD1-CD 4.35Å; Y855-K896 HydrophobicContact CD1-CG 4.11Å; Y855-K896 PolarHBondContact O-NZ 3.34Å; Y855-H955 AromaticContact CE2-NE2 3.7Å; Y855-H955 AromaticContact CZ-NE2 3.83Å; Y855-H955 PolarHBondContact OH-CD2 3.49Å; Y855-H955 PolarHBondContact OH-NE2 2.94Å; Y855-V959 HydrophobicContact CE2-CG2 4.25Å; Y855-F977 AromaticContact CD1-CE2 3.79Å; Y855-F977 HydrophobicContact CD1-CE2 3.79Å; Y855-F977 AromaticContact CD1-CZ 3.54Å; Y855-F977 HydrophobicContact CD1-CZ 3.54Å; Y855-F977 HydrophobicContact CD2-CE2 4.12Å; Y855-F977 HydrophobicContact CD2-CZ 4.32Å; Y855-F977 HydrophobicContact CE1-CE2 4.27Å; Y855-F977 AromaticContact CE1-CZ 3.6Å; Y855-F977 HydrophobicContact CE1-CZ 3.6Å; Y855-F977 HydrophobicContact CE2-CZ 4.33Å; Y855-F977 AromaticContact CG-CE2 3.73Å; Y855-F977 HydrophobicContact CG-CE2 3.73Å; Y855-F977 AromaticContact CG-CZ 3.94Å; Y855-F977 HydrophobicContact CG-CZ 3.94Å; Y855-F977 AromaticContact CZ-CZ 3.99Å
856	V	92.4	Very high	87.8	Confident	15 Å²	15	33.7 Å²	33.7	9%	0.091	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-41.6	175.1	-178	0	0	0	0	110.9	G853 L854 L968 I976	G853-V856 WeakPolarHBondContact O-CB 3.33Å; G853-V856 PolarHBondContact O-N 2.82Å; L854-V856 PolarHBondContact O-N 2.92Å; V856-L968 HydrophobicContact CG2-CD1 3.66Å; V856-I976 HydrophobicContact CG2-CD1 3.99Å
857	L	92.7	Very high	87.6	Confident	23 Å²	23	27 Å²	27	12%	0.12	15%	0.153	C	C	.	.	S	Bend	trans	-77.6	145.3	172.6	-64.2	179.3	0	0	0	110.8	H700 R701 G853 N889	H700-L857 HydrophobicContact CB-CD2 4.43Å; H700-L857 WeakPolarHBondContact O-CD2 3.42Å; R701-L857 CarbonylContact O-C 3.52Å; R701-L857 WeakPolarHBondContact O-CA 3.41Å; G853-L857 PolarHBondContact O-N 2.87Å; L857-N889 WeakPolarHBondContact CB-OD1 3.38Å
858	C	93.1	Very high	87.3	Confident	5 Å²	5	25 Å²	25	3%	0.034	15%	0.147	C	C	.	.	B	Isolated β-bridge	trans	-113.4	126.7	-176.8	-55.6	0	0	0	0	109.8	R701 E720 I721	R701-C858 PolarHBondContact O-N 3.43Å; E720-C858 PolarHBondContact O-SG 2.91Å; E720-C858 VanDerWaalsContact O-SG 3.37Å; I721-C858 HydrophobicContact CG1-CB 4.47Å
859	G	91.3	Very high	87.4	Confident	2 Å²	2	27.2 Å²	27.2	2%	0.021	16%	0.159	C	C	.	.			trans	-67.9	159.1	170.5	0	0	0	0	0	111.4	S893	G859-S893 PolarHBondContact N-OG 2.62Å
860	S	90.2	Very high	87.4	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.007	16%	0.163	C	C	.	.			trans	-70.4	144.2	177.6	118.3	0	0	0	0	111.8	S718 E862 K863 K864	S718-S860 CarbonylContact O-C 3.57Å; S718-S860 VanDerWaalsContact O-CA 3.3Å; S718-S860 WeakPolarHBondContact O-CA 3.28Å; S860-E862 VanDerWaalsContact C-N 3.32Å; S860-E862 WeakPolarHBondContact CB-OE2 3.29Å; S860-E862 PolarHBondContact O-N 3.44Å; S860-E862 PolarHBondContact OG-N 3.43Å; S860-E862 PolarHBondContact OG-OE2 3.07Å; S860-K863 VanDerWaalsContact CB-CE 3.49Å; S860-K863 WeakPolarHBondContact O-CB 3.06Å; S860-K863 PolarHBondContact O-N 2.91Å; S860-K863 WeakPolarHBondContact OG-CE 3.42Å; S860-K863 WeakPolarHBondContact OG-CG 3.3Å; S860-K864 PolarHBondContact O-N 3.21Å
861	V	88.2	Confident	87.7	Confident	13 Å²	13	25 Å²	25	8%	0.079	15%	0.146	C	C	.	.	H	α-helix	trans	-65.5	-34.6	-176.4	176.7	0	0	0	0	111.4	S718 E720 K863 K864 L865	S718-V861 WeakPolarHBondContact O-CG2 3.45Å; S718-V861 PolarHBondContact O-N 3.28Å; E720-V861 HydrophobicContact CB-CG2 4.13Å; E720-V861 HydrophobicContact CG-CG2 3.71Å; E720-V861 WeakPolarHBondContact OE1-CG1 3.35Å; E720-V861 VanDerWaalsContact OE1-CG2 3.26Å; E720-V861 WeakPolarHBondContact OE1-CG2 3.25Å; V861-K863 VanDerWaalsContact C-N 3.31Å; V861-K863 PolarHBondContact O-N 2.66Å; V861-K864 WeakPolarHBondContact O-CB 3.43Å; V861-K864 PolarHBondContact O-N 2.96Å; V861-L865 HydrophobicContact CG1-CD1 3.92Å; V861-L865 HydrophobicContact CG1-CG 4.15Å; V861-L865 WeakPolarHBondContact O-CB 3.19Å; V861-L865 VanDerWaalsContact O-CG 3.25Å; V861-L865 WeakPolarHBondContact O-CG 3.24Å; V861-L865 PolarHBondContact O-N 3.49Å
862	E	85.8	Confident	87.6	Confident	60 Å²	60	26.8 Å²	26.8	28%	0.28	15%	0.152	S	C	.	.	H	α-helix	trans	-60.9	-43.3	176.8	-61	71.1	-155.2	0	0	111	E717 S718 S860 L865 C866	E717-E862 WeakPolarHBondContact CA-OE2 3.46Å; S718-E862 WeakPolarHBondContact CB-OE1 3.41Å; S718-E862 VanDerWaalsContact N-CD 3.27Å; S718-E862 PolarHBondContact N-OE1 2.88Å; S718-E862 PolarHBondContact N-OE2 2.91Å; S718-E862 PolarHBondContact OG-OE1 3.43Å; S860-E862 VanDerWaalsContact C-N 3.32Å; S860-E862 WeakPolarHBondContact CB-OE2 3.29Å; S860-E862 PolarHBondContact O-N 3.44Å; S860-E862 PolarHBondContact OG-N 3.43Å; S860-E862 PolarHBondContact OG-OE2 3.07Å; E862-L865 PolarHBondContact O-N 3.45Å; E862-C866 PolarHBondContact O-N 3.11Å; E862-C866 VanDerWaalsContact O-N 3.09Å; E862-C866 PolarHBondContact O-SG 3.44Å; E862-C866 VanDerWaalsContact O-SG 3.41Å
863	K	86.4	Confident	87.7	Confident	18 Å²	18	27.3 Å²	27.3	8%	0.078	16%	0.162	C	C	.	.	H	α-helix	trans	-66.9	-43.6	177.2	-57.4	165.9	-153.6	-172.4	0	110.4	Y552 W555 E717 S860 V861 C866 L867 V890	Y552-K863 WeakPolarHBondContact OH-CE 3.42Å; Y552-K863 PolarHBondContact OH-NZ 3.19Å; W555-K863 HydrophobicContact CH2-CB 3.89Å; W555-K863 HydrophobicContact CH2-CD 3.97Å; W555-K863 HydrophobicContact CH2-CG 3.66Å; W555-K863 HydrophobicContact CZ3-CD 3.88Å; W555-K863 HydrophobicContact CZ3-CG 3.9Å; E717-K863 WeakPolarHBondContact OE2-CE 3.43Å; E717-K863 IonicContact OE2-NZ 3.74Å; E717-K863 PolarHBondContact OE2-NZ 2.88Å; S860-K863 VanDerWaalsContact CB-CE 3.49Å; S860-K863 WeakPolarHBondContact O-CB 3.06Å; S860-K863 PolarHBondContact O-N 2.91Å; S860-K863 WeakPolarHBondContact OG-CE 3.42Å; S860-K863 WeakPolarHBondContact OG-CG 3.3Å; V861-K863 VanDerWaalsContact C-N 3.31Å; V861-K863 PolarHBondContact O-N 2.66Å; K863-C866 PolarHBondContact O-N 2.98Å; K863-L867 PolarHBondContact O-N 2.97Å; K863-L867 VanDerWaalsContact O-N 3.16Å; K863-V890 HydrophobicContact CB-CG1 4.2Å; K863-V890 HydrophobicContact CB-CG2 3.76Å; K863-V890 HydrophobicContact CD-CG2 4.18Å
864	K	89.1	Confident	87.6	Confident	5 Å²	5	29.6 Å²	29.6	2%	0.022	17%	0.171	C	C	.	.	H	α-helix	trans	-55.3	-50	173.9	-160	171.6	70.2	160.8	0	110.9	E720 S860 V861 L867 V868 V890 V894 D897	E720-K864 IonicContact OE2-NZ 3.25Å; E720-K864 PolarHBondContact OE2-NZ 3.3Å; S860-K864 PolarHBondContact O-N 3.21Å; V861-K864 WeakPolarHBondContact O-CB 3.43Å; V861-K864 PolarHBondContact O-N 2.96Å; K864-L867 PolarHBondContact O-N 2.93Å; K864-V868 WeakPolarHBondContact O-CB 3.45Å; K864-V868 WeakPolarHBondContact O-CG2 3.37Å; K864-V868 PolarHBondContact O-N 2.77Å; K864-V890 HydrophobicContact CB-CG1 4.48Å; K864-V894 HydrophobicContact CD-CG2 4.5Å; K864-V894 HydrophobicContact CG-CG2 3.66Å; K864-D897 VanDerWaalsContact CD-OD2 3.25Å; K864-D897 WeakPolarHBondContact CD-OD2 3.23Å; K864-D897 WeakPolarHBondContact CE-OD2 3.35Å; K864-D897 IonicContact NZ-OD1 2.7Å; K864-D897 PolarHBondContact NZ-OD1 2.92Å; K864-D897 IonicContact NZ-OD2 3.24Å; K864-D897 PolarHBondContact NZ-OD2 3.03Å
865	L	84.3	Confident	87.3	Confident	64 Å²	64	30.6 Å²	30.6	34%	0.335	18%	0.178	S	C	.	.	H	α-helix	trans	-65	-37.1	-179.9	-71.3	172.6	0	0	0	113.5	V810 V861 E862 S869	V810-L865 HydrophobicContact CG1-CD2 4.33Å; V810-L865 HydrophobicContact CG2-CD2 3.93Å; V861-L865 HydrophobicContact CG1-CD1 3.92Å; V861-L865 HydrophobicContact CG1-CG 4.15Å; V861-L865 WeakPolarHBondContact O-CB 3.19Å; V861-L865 VanDerWaalsContact O-CG 3.25Å; V861-L865 WeakPolarHBondContact O-CG 3.24Å; V861-L865 PolarHBondContact O-N 3.49Å; E862-L865 PolarHBondContact O-N 3.45Å; L865-S869 PolarHBondContact O-N 2.76Å
866	C	86.2	Confident	87	Confident	89 Å²	89	35.7 Å²	35.7	60%	0.601	20%	0.204	S	C	*	.	H	α-helix	trans	-61.5	-49.2	172.7	-71.8	0	0	0	0	111.9	E862 K863 S869 E870	E862-C866 PolarHBondContact O-N 3.11Å; E862-C866 VanDerWaalsContact O-N 3.09Å; E862-C866 PolarHBondContact O-SG 3.44Å; E862-C866 VanDerWaalsContact O-SG 3.41Å; K863-C866 PolarHBondContact O-N 2.98Å; C866-S869 PolarHBondContact O-N 2.81Å; C866-E870 PolarHBondContact O-N 3.03Å
867	L	89.1	Confident	86.8	Confident	7 Å²	7	38.6 Å²	38.6	4%	0.037	22%	0.222	C	C	.	.	H	α-helix	trans	-65.3	-43.5	178.2	172.5	58.2	0	0	0	112.1	K863 K864 S869 E870 I871 L880 V885 V890 L891 V894	K863-L867 PolarHBondContact O-N 2.97Å; K863-L867 VanDerWaalsContact O-N 3.16Å; K864-L867 PolarHBondContact O-N 2.93Å; L867-S869 VanDerWaalsContact C-N 3.29Å; L867-S869 PolarHBondContact O-N 3.05Å; L867-E870 PolarHBondContact O-N 3.26Å; L867-E870 VanDerWaalsContact O-N 3.09Å; L867-I871 HydrophobicContact CD1-CD1 3.86Å; L867-I871 HydrophobicContact CD1-CG1 4.11Å; L867-I871 HydrophobicContact CD2-CD1 4.46Å; L867-I871 HydrophobicContact CG-CD1 3.74Å; L867-I871 HydrophobicContact CG-CG1 4.46Å; L867-I871 WeakPolarHBondContact O-CG1 3.16Å; L867-I871 PolarHBondContact O-N 3.34Å; L867-L880 HydrophobicContact CD1-CD2 3.66Å; L867-V885 HydrophobicContact CD1-CG2 4.08Å; L867-V885 HydrophobicContact CD2-CG1 4.31Å; L867-V885 HydrophobicContact CD2-CG2 4.08Å; L867-V885 HydrophobicContact CG-CG2 4.5Å; L867-V890 HydrophobicContact CD2-CG1 4.22Å; L867-L891 HydrophobicContact CD2-CD2 3.67Å; L867-V894 HydrophobicContact CD2-CG2 3.96Å; L867-V894 HydrophobicContact CG-CG2 4.48Å
868	V	84.6	Confident	86.7	Confident	9 Å²	9	37.5 Å²	37.5	6%	0.055	22%	0.216	C	C	.	.	H	α-helix	trans	-48.6	-49.4	171.2	149.3	0	0	0	0	110.7	W804 K864 E870 I871 E872 V894	W804-V868 HydrophobicContact CB-CG1 4.35Å; W804-V868 VanDerWaalsContact CD1-CG1 3.46Å; W804-V868 HydrophobicContact CG-CG1 4.06Å; W804-V868 HydrophobicContact CG-CG2 4.37Å; K864-V868 WeakPolarHBondContact O-CB 3.45Å; K864-V868 WeakPolarHBondContact O-CG2 3.37Å; K864-V868 PolarHBondContact O-N 2.77Å; V868-E870 VanDerWaalsContact C-N 3.32Å; V868-E870 PolarHBondContact O-N 2.8Å; V868-I871 PolarHBondContact O-N 2.77Å; V868-E872 WeakPolarHBondContact O-CG 3.48Å; V868-E872 PolarHBondContact O-N 3.36Å; V868-V894 HydrophobicContact CG2-CG2 4.49Å
869	S	83	Confident	86.7	Confident	62 Å²	62	39.7 Å²	39.7	43%	0.434	23%	0.227	S	C	.	.	H	α-helix	trans	-67.1	-28.8	-179.2	-166.9	0	0	0	0	113.8	L865 C866 L867 S873	L865-S869 PolarHBondContact O-N 2.76Å; C866-S869 PolarHBondContact O-N 2.81Å; L867-S869 VanDerWaalsContact C-N 3.29Å; L867-S869 PolarHBondContact O-N 3.05Å; S869-S873 PolarHBondContact O-N 2.85Å
870	E	86.4	Confident	86.9	Confident	43 Å²	43	39.9 Å²	39.9	20%	0.201	23%	0.228	C	C	.	.	H	α-helix	trans	-76	-40.4	173.8	-162.4	176.7	170.5	0	0	112	R566 C866 L867 V868 E872 S873 N874 A878 D879	R566-E870 IonicContact NH1-OE1 3.73Å; C866-E870 PolarHBondContact O-N 3.03Å; L867-E870 PolarHBondContact O-N 3.26Å; L867-E870 VanDerWaalsContact O-N 3.09Å; V868-E870 VanDerWaalsContact C-N 3.32Å; V868-E870 PolarHBondContact O-N 2.8Å; E870-E872 VanDerWaalsContact C-N 3.34Å; E870-E872 PolarHBondContact O-N 2.89Å; E870-S873 WeakPolarHBondContact O-CB 3.25Å; E870-S873 PolarHBondContact O-N 3.21Å; E870-N874 PolarHBondContact O-N 3.45Å; E870-A878 HydrophobicContact CB-CB 4.24Å; E870-A878 HydrophobicContact CG-CB 3.9Å; E870-D879 PolarHBondContact OE1-N 2.95Å
871	I	86.7	Confident	87	Confident	0 Å²	0	41 Å²	41	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58.7	-43.9	173.2	-69.5	162.8	0	0	0	111	Y803 W804 L836 L867 V868 S873 N874 P875 A878 V894	Y803-I871 HydrophobicContact CD2-CG2 4.34Å; Y803-I871 HydrophobicContact CG-CG2 4.45Å; W804-I871 HydrophobicContact CZ2-CD1 4.32Å; W804-I871 HydrophobicContact CZ2-CG2 4.25Å; L836-I871 HydrophobicContact CD1-CD1 3.81Å; L836-I871 HydrophobicContact CD1-CG1 4.04Å; L836-I871 HydrophobicContact CD1-CG2 3.84Å; L836-I871 HydrophobicContact CD2-CG2 3.78Å; L836-I871 HydrophobicContact CG-CG2 4.4Å; L867-I871 HydrophobicContact CD1-CD1 3.86Å; L867-I871 HydrophobicContact CD1-CG1 4.11Å; L867-I871 HydrophobicContact CD2-CD1 4.46Å; L867-I871 HydrophobicContact CG-CD1 3.74Å; L867-I871 HydrophobicContact CG-CG1 4.46Å; L867-I871 WeakPolarHBondContact O-CG1 3.16Å; L867-I871 PolarHBondContact O-N 3.34Å; V868-I871 PolarHBondContact O-N 2.77Å; I871-S873 VanDerWaalsContact C-N 3.26Å; I871-S873 PolarHBondContact O-N 2.61Å; I871-N874 CarbonylContact O-C 3.57Å; I871-N874 VanDerWaalsContact O-C 3.29Å; I871-N874 PolarHBondContact O-N 3.25Å; I871-P875 HydrophobicContact CG2-CB 4.32Å; I871-P875 WeakPolarHBondContact O-CD 3.39Å; I871-P875 VanDerWaalsContact O-N 3.13Å; I871-A878 HydrophobicContact CG1-CB 3.96Å; I871-V894 HydrophobicContact CD1-CG1 4.02Å
872	E	80	Confident	87.1	Confident	61 Å²	61	42.9 Å²	42.9	29%	0.285	25%	0.248	S	C	.	.	H	α-helix	trans	-62.1	-33.1	173.8	-69.6	-176.6	138.9	0	0	112.7	S801 W804 V868 E870	S801-E872 WeakPolarHBondContact CB-OE1 3.44Å; S801-E872 WeakPolarHBondContact OG-CG 3.14Å; S801-E872 PolarHBondContact OG-OE1 2.89Å; W804-E872 HydrophobicContact CG-CG 4.45Å; V868-E872 WeakPolarHBondContact O-CG 3.48Å; V868-E872 PolarHBondContact O-N 3.36Å; E870-E872 VanDerWaalsContact C-N 3.34Å; E870-E872 PolarHBondContact O-N 2.89Å
873	S	83.1	Confident	87.3	Confident	83 Å²	83	46.8 Å²	46.8	58%	0.58	27%	0.267	S	S	*	.	H	α-helix	trans	-71.5	-40.3	178.7	-169.6	0	0	0	0	112.1	S869 E870 I871	S869-S873 PolarHBondContact O-N 2.85Å; E870-S873 WeakPolarHBondContact O-CB 3.25Å; E870-S873 PolarHBondContact O-N 3.21Å; I871-S873 VanDerWaalsContact C-N 3.26Å; I871-S873 PolarHBondContact O-N 2.61Å
874	N	83.2	Confident	87.5	Confident	61 Å²	61	46.5 Å²	46.5	33%	0.326	27%	0.268	S	S	.	.			trans	-170.8	117.2	165.2	178.4	-26	0	0	0	110.4	E870 I871 L876 T877 A878	E870-N874 PolarHBondContact O-N 3.45Å; I871-N874 CarbonylContact O-C 3.57Å; I871-N874 VanDerWaalsContact O-C 3.29Å; I871-N874 PolarHBondContact O-N 3.25Å; N874-L876 VanDerWaalsContact C-N 3.3Å; N874-L876 PolarHBondContact O-N 2.89Å; N874-L876 WeakPolarHBondContact OD1-CA 3.12Å; N874-L876 WeakPolarHBondContact OD1-CB 3.24Å; N874-L876 PolarHBondContact OD1-N 3.13Å; N874-T877 WeakPolarHBondContact CB-OG1 3.33Å; N874-T877 PolarHBondContact O-N 2.86Å; N874-T877 PolarHBondContact OD1-N 2.92Å; N874-A878 PolarHBondContact O-N 3.36Å
875	P	84.8	Confident	87.6	Confident	22 Å²	22	46.6 Å²	46.6	14%	0.143	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-20.7	-174.4	32.9	-40.8	0	0	0	113.9	Y803 I835 R839 I871	Y803-P875 HydrophobicContact CE2-CB 3.74Å; Y803-P875 HydrophobicContact CE2-CG 3.68Å; Y803-P875 WeakPolarHBondContact OH-CG 3.45Å; I835-P875 HydrophobicContact CG2-CB 4.09Å; I835-P875 HydrophobicContact CG2-CG 4.01Å; R839-P875 PolarHBondContact NH1-O 3.37Å; I871-P875 HydrophobicContact CG2-CB 4.32Å; I871-P875 WeakPolarHBondContact O-CD 3.39Å; I871-P875 VanDerWaalsContact O-N 3.13Å
876	L	85.8	Confident	87.9	Confident	106 Å²	106	44.7 Å²	44.7	56%	0.555	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-34	177.2	-175.8	69.5	0	0	0	111.4	I835 R839 N874	I835-L876 HydrophobicContact CD1-CD1 4.19Å; I835-L876 HydrophobicContact CG1-CD1 3.85Å; R839-L876 PolarHBondContact NH1-O 3.17Å; N874-L876 VanDerWaalsContact C-N 3.3Å; N874-L876 PolarHBondContact O-N 2.89Å; N874-L876 WeakPolarHBondContact OD1-CA 3.12Å; N874-L876 WeakPolarHBondContact OD1-CB 3.24Å; N874-L876 PolarHBondContact OD1-N 3.13Å
877	T	89.1	Confident	88.1	Confident	76 Å²	76	41.5 Å²	41.5	47%	0.466	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-9.5	-176.8	67.7	0	0	0	0	115	N874 D879	N874-T877 WeakPolarHBondContact CB-OG1 3.33Å; N874-T877 PolarHBondContact O-N 2.86Å; N874-T877 PolarHBondContact OD1-N 2.92Å; T877-D879 PolarHBondContact O-N 3.24Å
878	A	91.2	Very high	88.3	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.24	C	C	.	.	S	Bend	trans	-58.9	132.1	178.1	0	0	0	0	0	111.1	R839 E870 I871 N874 L880	R839-A878 VanDerWaalsContact CZ-O 3.3Å; R839-A878 PolarHBondContact NH1-O 2.86Å; R839-A878 PolarHBondContact NH2-O 3.32Å; E870-A878 HydrophobicContact CB-CB 4.24Å; E870-A878 HydrophobicContact CG-CB 3.9Å; I871-A878 HydrophobicContact CG1-CB 3.96Å; N874-A878 PolarHBondContact O-N 3.36Å; A878-L880 PolarHBondContact O-N 3.14Å
879	D	93.3	Very high	88.7	Confident	51 Å²	51	42.7 Å²	42.7	27%	0.273	24%	0.243	S	C	.	.			trans	-79.5	112	-174.3	-163.1	-14.6	0	0	0	111.4	E870 T877 S881 A884	E870-D879 PolarHBondContact OE1-N 2.95Å; T877-D879 PolarHBondContact O-N 3.24Å; D879-S881 WeakPolarHBondContact OD1-CB 3.11Å; D879-S881 PolarHBondContact OD1-N 2.87Å; D879-S881 PolarHBondContact OD1-OG 2.91Å; D879-A884 HydrophobicContact CB-CB 3.66Å; D879-A884 WeakPolarHBondContact OD2-CB 3.44Å
880	L	94.6	Very high	89.2	Confident	6 Å²	6	39.7 Å²	39.7	3%	0.031	22%	0.222	C	C	.	.			trans	-101.8	5	178.1	-52.1	-173.8	0	0	0	112.4	R839 L840 E843 R847 L867 A878 L891	R839-L880 HydrophobicContact CB-CD1 3.77Å; L840-L880 HydrophobicContact CD2-CD1 4.32Å; E843-L880 HydrophobicContact CB-CB 4.44Å; E843-L880 HydrophobicContact CG-CB 4.05Å; E843-L880 VanDerWaalsContact CG-O 3.3Å; E843-L880 WeakPolarHBondContact CG-O 3.48Å; R847-L880 PolarHBondContact NH2-O 2.64Å; L867-L880 HydrophobicContact CD1-CD2 3.66Å; A878-L880 PolarHBondContact O-N 3.14Å; L880-L891 HydrophobicContact CD2-CD2 4.37Å
881	S	92.4	Very high	89.6	Confident	26 Å²	26	37.7 Å²	37.7	18%	0.182	21%	0.213	C	C	.	.	S	Bend	trans	-60.7	157.7	-176.4	63.9	0	0	0	0	112.8	R847 D879 E883 A884 V885	R847-S881 PolarHBondContact NH2-O 2.9Å; R847-S881 VanDerWaalsContact NH2-O 3.15Å; D879-S881 WeakPolarHBondContact OD1-CB 3.11Å; D879-S881 PolarHBondContact OD1-N 2.87Å; D879-S881 PolarHBondContact OD1-OG 2.91Å; S881-E883 WeakPolarHBondContact CB-OE2 3.47Å; S881-E883 PolarHBondContact O-N 2.82Å; S881-A884 PolarHBondContact O-N 3.3Å; S881-A884 VanDerWaalsContact O-N 3.07Å; S881-A884 WeakPolarHBondContact OG-CB 3.25Å; S881-A884 PolarHBondContact OG-N 3.45Å; S881-V885 PolarHBondContact O-N 2.89Å
882	P	90.5	Very high	90.1	Very high	51 Å²	51	37.7 Å²	37.7	33%	0.331	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-20.6	173.6	26.1	-32.7	0	0	0	112.2	P886	P882-P886 WeakPolarHBondContact O-CA 3.37Å; P882-P886 VanDerWaalsContact O-CB 3.31Å; P882-P886 WeakPolarHBondContact O-CB 3.43Å
883	E	89.5	Confident	90.7	Very high	142 Å²	142	35 Å²	35	66%	0.664	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-31.7	170.9	-65	75.5	-168.5	0	0	113.1	S881	S881-E883 WeakPolarHBondContact CB-OE2 3.47Å; S881-E883 PolarHBondContact O-N 2.82Å
884	A	90.2	Very high	91.1	Very high	13 Å²	13	31.1 Å²	31.1	11%	0.107	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-21.6	-178.2	0	0	0	0	0	114.6	W555 D879 S881	W555-A884 PolarHBondContact NE1-O 3.22Å; D879-A884 HydrophobicContact CB-CB 3.66Å; D879-A884 WeakPolarHBondContact OD2-CB 3.44Å; S881-A884 PolarHBondContact O-N 3.3Å; S881-A884 VanDerWaalsContact O-N 3.07Å; S881-A884 WeakPolarHBondContact OG-CB 3.25Å; S881-A884 PolarHBondContact OG-N 3.45Å
885	V	92.5	Very high	91.7	Very high	6 Å²	6	28.2 Å²	28.2	4%	0.036	16%	0.158	C	C	.	.			trans	-146.2	81.2	173.5	-170.8	0	0	0	0	108.3	R847 L867 S881 D887 V890 L891	R847-V885 PolarHBondContact NH1-O 3.41Å; R847-V885 PolarHBondContact NH2-O 3.45Å; L867-V885 HydrophobicContact CD1-CG2 4.08Å; L867-V885 HydrophobicContact CD2-CG1 4.31Å; L867-V885 HydrophobicContact CD2-CG2 4.08Å; L867-V885 HydrophobicContact CG-CG2 4.5Å; S881-V885 PolarHBondContact O-N 2.89Å; V885-D887 PolarHBondContact O-N 3.12Å; V885-V890 HydrophobicContact CG1-CB 4.02Å; V885-V890 HydrophobicContact CG1-CG1 4.11Å; V885-L891 HydrophobicContact CB-CD2 4.24Å; V885-L891 HydrophobicContact CG1-CD2 3.89Å; V885-L891 HydrophobicContact CG1-CG 4.21Å; V885-L891 HydrophobicContact CG2-CD2 4.47Å
886	P	89.5	Confident	92.1	Very high	25 Å²	25	27.7 Å²	27.7	16%	0.162	15%	0.154	C	C	.	.			trans	-68.5	-38.3	-172.5	25.7	-32.8	0	0	0	112.6	F547 W555 R847 P882 I888	F547-P886 HydrophobicContact CE1-CB 3.74Å; F547-P886 HydrophobicContact CZ-CB 3.73Å; W555-P886 HydrophobicContact CB-CG 4.28Å; W555-P886 VanDerWaalsContact CD2-CD 3.41Å; W555-P886 HydrophobicContact CD2-CG 3.62Å; W555-P886 HydrophobicContact CE3-CG 3.89Å; W555-P886 HydrophobicContact CG-CG 3.76Å; W555-P886 HydrophobicContact CZ3-CG 4.45Å; R847-P886 PolarHBondContact NH1-O 3.07Å; P882-P886 WeakPolarHBondContact O-CA 3.37Å; P882-P886 VanDerWaalsContact O-CB 3.31Å; P882-P886 WeakPolarHBondContact O-CB 3.43Å; P886-I888 PolarHBondContact O-N 2.97Å
887	D	89.6	Confident	92.2	Very high	21 Å²	21	23.9 Å²	23.9	11%	0.112	13%	0.134	C	C	.	.			trans	-75.3	103.3	178.6	-177.7	11.3	0	0	0	111.4	F547 V885 N889 V890	F547-D887 HydrophobicContact CE2-CB 4.21Å; V885-D887 PolarHBondContact O-N 3.12Å; D887-N889 PolarHBondContact O-N 2.78Å; D887-N889 VanDerWaalsContact O-N 3.13Å; D887-N889 VanDerWaalsContact OD1-CB 3.3Å; D887-N889 WeakPolarHBondContact OD1-CB 3.49Å; D887-N889 PolarHBondContact OD1-N 3.39Å; D887-N889 PolarHBondContact OD1-ND2 2.89Å; D887-V890 HydrophobicContact CB-CG2 4.01Å; D887-V890 WeakPolarHBondContact O-CB 3.49Å; D887-V890 PolarHBondContact O-N 2.93Å
888	I	93.3	Very high	92.2	Very high	18 Å²	18	20.6 Å²	20.6	9%	0.092	11%	0.113	C	C	.	.	H	α-helix	trans	-56.7	-26.6	177.2	-166.3	171.1	0	0	0	112.5	I844 R847 L854 P886 V890 L891 T892	I844-I888 HydrophobicContact CG1-CG1 4.5Å; I844-I888 HydrophobicContact CG2-CD1 4.39Å; R847-I888 HydrophobicContact CB-CD1 3.76Å; R847-I888 HydrophobicContact CG-CD1 4.5Å; L854-I888 HydrophobicContact CD1-CD1 3.79Å; L854-I888 HydrophobicContact CD1-CG1 4.07Å; L854-I888 HydrophobicContact CD1-CG2 4.35Å; P886-I888 PolarHBondContact O-N 2.97Å; I888-V890 PolarHBondContact O-N 2.61Å; I888-L891 WeakPolarHBondContact O-CB 3.4Å; I888-L891 PolarHBondContact O-N 2.73Å; I888-T892 PolarHBondContact O-N 2.88Å
889	N	93.5	Very high	92.2	Very high	23 Å²	23	20.6 Å²	20.6	12%	0.123	11%	0.113	C	C	.	.	H	α-helix	trans	-66.8	-28	-179.5	-55.5	-71.7	0	0	0	111.6	L857 D887 T892 S893	L857-N889 WeakPolarHBondContact CB-OD1 3.38Å; D887-N889 PolarHBondContact O-N 2.78Å; D887-N889 VanDerWaalsContact O-N 3.13Å; D887-N889 VanDerWaalsContact OD1-CB 3.3Å; D887-N889 WeakPolarHBondContact OD1-CB 3.49Å; D887-N889 PolarHBondContact OD1-N 3.39Å; D887-N889 PolarHBondContact OD1-ND2 2.89Å; N889-T892 VanDerWaalsContact CA-OG1 3.31Å; N889-T892 WeakPolarHBondContact CA-OG1 3.18Å; N889-T892 PolarHBondContact O-N 3.46Å; N889-T892 PolarHBondContact O-OG1 2.85Å; N889-S893 WeakPolarHBondContact O-CB 3.44Å; N889-S893 PolarHBondContact O-N 2.81Å; N889-S893 PolarHBondContact O-OG 3.46Å
890	V	93.7	Very high	91.9	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.7	-43.9	171.4	-179.6	0	0	0	0	110.7	K863 K864 L867 V885 D887 I888 S893 V894	K863-V890 HydrophobicContact CB-CG1 4.2Å; K863-V890 HydrophobicContact CB-CG2 3.76Å; K863-V890 HydrophobicContact CD-CG2 4.18Å; K864-V890 HydrophobicContact CB-CG1 4.48Å; L867-V890 HydrophobicContact CD2-CG1 4.22Å; V885-V890 HydrophobicContact CG1-CB 4.02Å; V885-V890 HydrophobicContact CG1-CG1 4.11Å; D887-V890 HydrophobicContact CB-CG2 4.01Å; D887-V890 WeakPolarHBondContact O-CB 3.49Å; D887-V890 PolarHBondContact O-N 2.93Å; I888-V890 PolarHBondContact O-N 2.61Å; V890-S893 PolarHBondContact O-N 3.36Å; V890-V894 WeakPolarHBondContact O-CG2 3.39Å; V890-V894 PolarHBondContact O-N 3.28Å
891	L	95.7	Very high	91.1	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-62.4	-43.9	175.2	-58.6	-176.6	0	0	0	111.2	L840 E843 I844 L867 L880 V885 I888 S893 V894 F895	L840-L891 HydrophobicContact CD2-CB 4.31Å; L840-L891 HydrophobicContact CD2-CD2 4.11Å; E843-L891 HydrophobicContact CB-CD1 4.38Å; E843-L891 HydrophobicContact CG-CD1 3.63Å; I844-L891 HydrophobicContact CD1-CB 4.17Å; I844-L891 HydrophobicContact CG1-CB 4.02Å; I844-L891 HydrophobicContact CG1-CD1 4.42Å; L867-L891 HydrophobicContact CD2-CD2 3.67Å; L880-L891 HydrophobicContact CD2-CD2 4.37Å; V885-L891 HydrophobicContact CB-CD2 4.24Å; V885-L891 HydrophobicContact CG1-CD2 3.89Å; V885-L891 HydrophobicContact CG1-CG 4.21Å; V885-L891 HydrophobicContact CG2-CD2 4.47Å; I888-L891 WeakPolarHBondContact O-CB 3.4Å; I888-L891 PolarHBondContact O-N 2.73Å; L891-S893 VanDerWaalsContact C-N 3.33Å; L891-S893 PolarHBondContact O-N 3.15Å; L891-V894 PolarHBondContact O-N 3.1Å; L891-F895 WeakPolarHBondContact O-CB 3.44Å; L891-F895 PolarHBondContact O-N 2.74Å
892	T	95.7	Very high	90.5	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-64.8	-35.3	176.7	64	0	0	0	0	112.9	I844 L854 Y855 I888 N889 F895 K896	I844-T892 HydrophobicContact CD1-CG2 4.07Å; L854-T892 HydrophobicContact CD1-CG2 3.55Å; L854-T892 HydrophobicContact CG-CG2 4.07Å; Y855-T892 VanDerWaalsContact CD1-CB 3.47Å; Y855-T892 HydrophobicContact CD1-CG2 3.85Å; Y855-T892 HydrophobicContact CD2-CG2 4.38Å; Y855-T892 VanDerWaalsContact CE1-CB 3.46Å; Y855-T892 HydrophobicContact CE1-CG2 3.65Å; Y855-T892 HydrophobicContact CE2-CG2 4.24Å; Y855-T892 HydrophobicContact CG-CG2 4.2Å; I888-T892 PolarHBondContact O-N 2.88Å; N889-T892 VanDerWaalsContact CA-OG1 3.31Å; N889-T892 WeakPolarHBondContact CA-OG1 3.18Å; N889-T892 PolarHBondContact O-N 3.46Å; N889-T892 PolarHBondContact O-OG1 2.85Å; T892-F895 PolarHBondContact O-N 2.87Å; T892-K896 WeakPolarHBondContact O-CG 3.14Å; T892-K896 PolarHBondContact O-N 2.82Å
893	S	93.1	Very high	89.9	Confident	6 Å²	6	18.6 Å²	18.6	4%	0.042	10%	0.102	C	C	.	.	H	α-helix	trans	-66.4	-47.2	173.9	-72	0	0	0	0	111.5	G859 N889 V890 L891 F895 K896 D897	G859-S893 PolarHBondContact N-OG 2.62Å; N889-S893 WeakPolarHBondContact O-CB 3.44Å; N889-S893 PolarHBondContact O-N 2.81Å; N889-S893 PolarHBondContact O-OG 3.46Å; V890-S893 PolarHBondContact O-N 3.36Å; L891-S893 VanDerWaalsContact C-N 3.33Å; L891-S893 PolarHBondContact O-N 3.15Å; S893-F895 PolarHBondContact O-N 2.91Å; S893-K896 PolarHBondContact O-N 2.88Å; S893-K896 VanDerWaalsContact O-N 3.16Å; S893-D897 WeakPolarHBondContact O-CB 3.44Å; S893-D897 PolarHBondContact O-N 2.87Å; S893-D897 VanDerWaalsContact O-OD1 3.12Å
894	V	93	Very high	89.6	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-58.9	-36	174.8	175.6	0	0	0	0	111.8	W804 L840 K864 L867 V868 I871 V890 L891 W898	W804-V894 HydrophobicContact CH2-CG1 3.71Å; W804-V894 HydrophobicContact CZ2-CG1 3.46Å; W804-V894 VanDerWaalsContact CZ2-CG1 3.46Å; L840-V894 HydrophobicContact CD1-CG1 4.01Å; K864-V894 HydrophobicContact CD-CG2 4.5Å; K864-V894 HydrophobicContact CG-CG2 3.66Å; L867-V894 HydrophobicContact CD2-CG2 3.96Å; L867-V894 HydrophobicContact CG-CG2 4.48Å; V868-V894 HydrophobicContact CG2-CG2 4.49Å; I871-V894 HydrophobicContact CD1-CG1 4.02Å; V890-V894 WeakPolarHBondContact O-CG2 3.39Å; V890-V894 PolarHBondContact O-N 3.28Å; L891-V894 PolarHBondContact O-N 3.1Å; V894-W898 PolarHBondContact O-N 2.9Å
895	F	94.9	Very high	89.6	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-68.5	-41.5	175.6	-174.5	-104.4	0	0	0	113.2	V837 L840 I841 Y855 L891 T892 S893 W898 L899 V952 F977	V837-F895 HydrophobicContact CG1-CE2 4.27Å; L840-F895 HydrophobicContact CB-CD2 4.21Å; L840-F895 HydrophobicContact CD1-CB 4.3Å; L840-F895 HydrophobicContact CD1-CD2 4.31Å; I841-F895 HydrophobicContact CD1-CE2 3.84Å; I841-F895 HydrophobicContact CD1-CZ 3.93Å; I841-F895 HydrophobicContact CG1-CD2 4.46Å; I841-F895 HydrophobicContact CG1-CE2 3.66Å; I841-F895 HydrophobicContact CG1-CZ 3.91Å; Y855-F895 HydrophobicContact CE1-CB 4.45Å; Y855-F895 AromaticContact CE1-CD1 3.68Å; Y855-F895 HydrophobicContact CE1-CD1 3.68Å; Y855-F895 HydrophobicContact CE1-CE1 4.42Å; Y855-F895 HydrophobicContact CE1-CG 4.47Å; Y855-F895 AromaticContact CZ-CD1 3.91Å; Y855-F895 WeakPolarHBondContact OH-CD1 3.09Å; L891-F895 WeakPolarHBondContact O-CB 3.44Å; L891-F895 PolarHBondContact O-N 2.74Å; T892-F895 PolarHBondContact O-N 2.87Å; S893-F895 PolarHBondContact O-N 2.91Å; F895-W898 PolarHBondContact O-N 2.84Å; F895-L899 HydrophobicContact CD1-CD1 4.4Å; F895-L899 HydrophobicContact CE1-CD1 4.04Å; F895-L899 HydrophobicContact CZ-CD1 4.43Å; F895-L899 PolarHBondContact O-N 2.89Å; F895-V952 HydrophobicContact CZ-CG1 4.46Å; F895-V952 HydrophobicContact CZ-CG2 4.1Å; F895-F977 HydrophobicContact CD1-CE1 4.06Å; F895-F977 HydrophobicContact CD1-CZ 4.18Å; F895-F977 AromaticContact CE1-CE1 3.77Å; F895-F977 HydrophobicContact CE1-CE1 3.77Å; F895-F977 HydrophobicContact CE1-CZ 4.11Å
896	K	92.8	Very high	89.6	Confident	11 Å²	11	14.4 Å²	14.4	5%	0.048	8%	0.08	C	C	.	.	H	α-helix	trans	-64.3	-44.7	173.3	-71.6	-168	-58.9	-178.2	0	111.4	D722 Y855 T892 S893 W898 L899 C900 I976 F977 L980	D722-K896 IonicContact OD2-NZ 2.71Å; D722-K896 PolarHBondContact OD2-NZ 3.1Å; Y855-K896 HydrophobicContact CD1-CD 4.35Å; Y855-K896 HydrophobicContact CD1-CG 4.11Å; Y855-K896 PolarHBondContact O-NZ 3.34Å; T892-K896 WeakPolarHBondContact O-CG 3.14Å; T892-K896 PolarHBondContact O-N 2.82Å; S893-K896 PolarHBondContact O-N 2.88Å; S893-K896 VanDerWaalsContact O-N 3.16Å; K896-W898 VanDerWaalsContact C-N 3.27Å; K896-W898 PolarHBondContact O-N 2.92Å; K896-L899 PolarHBondContact O-N 3.37Å; K896-C900 PolarHBondContact O-N 3.35Å; K896-C900 VanDerWaalsContact O-N 3.14Å; K896-I976 HydrophobicContact CD-CG2 3.56Å; K896-F977 HydrophobicContact CG-CZ 4.37Å; K896-L980 HydrophobicContact CB-CD1 3.89Å; K896-L980 HydrophobicContact CD-CD1 4.3Å; K896-L980 HydrophobicContact CG-CD1 3.84Å
897	D	87.9	Confident	89.8	Confident	26 Å²	26	13.4 Å²	13.4	14%	0.139	7%	0.073	C	C	.	.	H	α-helix	trans	-53.2	-45.1	174.3	-76.2	18.6	0	0	0	110.9	K864 S893 L899 C900 A901	K864-D897 VanDerWaalsContact CD-OD2 3.25Å; K864-D897 WeakPolarHBondContact CD-OD2 3.23Å; K864-D897 WeakPolarHBondContact CE-OD2 3.35Å; K864-D897 IonicContact NZ-OD1 2.7Å; K864-D897 PolarHBondContact NZ-OD1 2.92Å; K864-D897 IonicContact NZ-OD2 3.24Å; K864-D897 PolarHBondContact NZ-OD2 3.03Å; S893-D897 WeakPolarHBondContact O-CB 3.44Å; S893-D897 PolarHBondContact O-N 2.87Å; S893-D897 VanDerWaalsContact O-OD1 3.12Å; D897-L899 PolarHBondContact O-N 2.75Å; D897-C900 CarbonylContact O-C 3.52Å; D897-C900 PolarHBondContact O-N 3.46Å; D897-A901 WeakPolarHBondContact O-CB 3.41Å; D897-A901 PolarHBondContact O-N 3.07Å
898	W	89.9	Confident	89.8	Confident	7 Å²	7	13.2 Å²	13.2	3%	0.027	7%	0.074	C	C	.	.	H	α-helix	trans	-57	-46.8	178.7	-166.7	79.3	0	0	0	113.8	Y803 W804 L820 P834 V837 V894 F895 K896 C900 A901 M902 T948	Y803-W898 AromaticContact CD1-NE1 3.95Å; W804-W898 HydrophobicContact CH2-CB 3.78Å; W804-W898 AromaticContact CH2-CD1 3.68Å; W804-W898 HydrophobicContact CH2-CG 4.13Å; W804-W898 HydrophobicContact CZ3-CB 3.79Å; W804-W898 AromaticContact CZ3-CD1 3.62Å; W804-W898 HydrophobicContact CZ3-CG 4.12Å; L820-W898 HydrophobicContact CD1-CH2 3.65Å; L820-W898 HydrophobicContact CD1-CZ2 3.72Å; P834-W898 HydrophobicContact CB-CZ2 4.23Å; P834-W898 HydrophobicContact CG-CH2 4.04Å; P834-W898 HydrophobicContact CG-CZ2 3.69Å; V837-W898 HydrophobicContact CG2-CD2 3.63Å; V837-W898 HydrophobicContact CG2-CE3 3.45Å; V837-W898 VanDerWaalsContact CG2-CE3 3.45Å; V837-W898 HydrophobicContact CG2-CG 4.48Å; V837-W898 HydrophobicContact CG2-CH2 3.7Å; V837-W898 HydrophobicContact CG2-CZ2 3.86Å; V837-W898 HydrophobicContact CG2-CZ3 3.48Å; V837-W898 VanDerWaalsContact CG2-CZ3 3.48Å; V894-W898 PolarHBondContact O-N 2.9Å; F895-W898 PolarHBondContact O-N 2.84Å; K896-W898 VanDerWaalsContact C-N 3.27Å; K896-W898 PolarHBondContact O-N 2.92Å; W898-C900 VanDerWaalsContact C-N 3.3Å; W898-C900 PolarHBondContact O-N 2.93Å; W898-A901 PolarHBondContact O-N 3.07Å; W898-M902 HydrophobicContact CE3-SD 4.34Å; W898-M902 HydrophobicContact CH2-CE 4.28Å; W898-M902 HydrophobicContact CH2-CG 4.22Å; W898-M902 HydrophobicContact CH2-SD 3.32Å; W898-M902 WeakPolarHBondContact CH2-SD 3.23Å; W898-M902 HydrophobicContact CZ2-CG 4.17Å; W898-M902 HydrophobicContact CZ2-SD 3.83Å; W898-M902 HydrophobicContact CZ3-CE 3.98Å; W898-M902 HydrophobicContact CZ3-SD 3.63Å; W898-M902 PolarHBondContact O-N 3.36Å; W898-T948 HydrophobicContact CH2-CG2 3.9Å; W898-T948 HydrophobicContact CZ3-CG2 3.95Å
899	L	90.9	Very high	89.5	Confident	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-67.8	-32.3	179.4	-62.9	169.3	0	0	0	112	R794 F895 K896 D897 M902 L906 V952 F977 L980 L981	R794-L899 PolarHBondContact NH1-O 3.29Å; R794-L899 PolarHBondContact NH2-O 3.21Å; F895-L899 HydrophobicContact CD1-CD1 4.4Å; F895-L899 HydrophobicContact CE1-CD1 4.04Å; F895-L899 HydrophobicContact CZ-CD1 4.43Å; F895-L899 PolarHBondContact O-N 2.89Å; K896-L899 PolarHBondContact O-N 3.37Å; D897-L899 PolarHBondContact O-N 2.75Å; L899-M902 HydrophobicContact CD2-CE 4.11Å; L899-L906 HydrophobicContact CD2-CD2 4.39Å; L899-V952 HydrophobicContact CD1-CG1 4.5Å; L899-V952 HydrophobicContact CD2-CG2 4.17Å; L899-F977 HydrophobicContact CD1-CD1 3.85Å; L899-F977 HydrophobicContact CD1-CE1 3.65Å; L899-L980 HydrophobicContact CB-CB 3.77Å; L899-L980 HydrophobicContact CB-CD1 4.48Å; L899-L980 HydrophobicContact CD1-CB 4.47Å; L899-L980 HydrophobicContact CD1-CD1 4.44Å; L899-L981 HydrophobicContact CD1-CD2 4.35Å; L899-L981 HydrophobicContact CD2-CD2 3.99Å
900	C	86.3	Confident	89.2	Confident	26 Å²	26	15 Å²	15	18%	0.176	9%	0.089	C	C	.	.	H	α-helix	trans	-74.2	-35.2	173.5	-161.2	0	0	0	0	113.1	R794 K896 D897 W898 L980	R794-C900 PolarHBondContact NH1-O 3.44Å; K896-C900 PolarHBondContact O-N 3.35Å; K896-C900 VanDerWaalsContact O-N 3.14Å; D897-C900 CarbonylContact O-C 3.52Å; D897-C900 PolarHBondContact O-N 3.46Å; W898-C900 VanDerWaalsContact C-N 3.3Å; W898-C900 PolarHBondContact O-N 2.93Å; C900-L980 HydrophobicContact CB-CD2 3.82Å
901	A	78.6	Confident	89.1	Confident	7 Å²	7	15.6 Å²	15.6	6%	0.058	9%	0.092	C	C	.	.	H	α-helix	trans	-73.2	-25.9	-173.6	0	0	0	0	0	114.1	W806 D897 W898	W806-A901 HydrophobicContact CB-CB 3.77Å; W806-A901 VanDerWaalsContact CB-O 3.23Å; W806-A901 WeakPolarHBondContact CB-O 3.19Å; D897-A901 WeakPolarHBondContact O-CB 3.41Å; D897-A901 PolarHBondContact O-N 3.07Å; W898-A901 PolarHBondContact O-N 3.07Å
902	M	80.6	Confident	89	Confident	15 Å²	15	15.6 Å²	15.6	7%	0.074	9%	0.092	C	C	.	.	S	Bend	trans	-57.2	138.2	-179.9	-70.5	-174.3	-62.6	0	0	112.2	R794 L820 W898 L899 E904 L906	R794-M902 WeakPolarHBondContact CD-O 3.3Å; R794-M902 WeakPolarHBondContact CG-O 3.46Å; R794-M902 PolarHBondContact NH1-O 3.34Å; L820-M902 HydrophobicContact CD1-SD 4.34Å; L820-M902 HydrophobicContact CD2-SD 4.22Å; W898-M902 HydrophobicContact CE3-SD 4.34Å; W898-M902 HydrophobicContact CH2-CE 4.28Å; W898-M902 HydrophobicContact CH2-CG 4.22Å; W898-M902 HydrophobicContact CH2-SD 3.32Å; W898-M902 WeakPolarHBondContact CH2-SD 3.23Å; W898-M902 HydrophobicContact CZ2-CG 4.17Å; W898-M902 HydrophobicContact CZ2-SD 3.83Å; W898-M902 HydrophobicContact CZ3-CE 3.98Å; W898-M902 HydrophobicContact CZ3-SD 3.63Å; W898-M902 PolarHBondContact O-N 3.36Å; L899-M902 HydrophobicContact CD2-CE 4.11Å; M902-E904 VanDerWaalsContact CB-O 3.23Å; M902-E904 WeakPolarHBondContact CB-O 3.32Å; M902-E904 PolarHBondContact O-N 2.74Å; M902-L906 HydrophobicContact CE-CB 3.74Å; M902-L906 HydrophobicContact CE-CD1 4.14Å; M902-L906 HydrophobicContact CE-CG 4.45Å; M902-L906 HydrophobicContact SD-CD1 4.37Å
903	P	76	Confident	88.8	Confident	44 Å²	44	16.6 Å²	16.6	29%	0.286	10%	0.097	S	C	.	.	S	Bend	trans	-66.6	-18.9	-176.3	27.3	-36.1	0	0	0	113.8	W806	W806-P903 HydrophobicContact CZ3-CB 4.18Å
904	E	83.4	Confident	88.7	Confident	72 Å²	72	19.7 Å²	19.7	34%	0.336	12%	0.116	S	C	.	.	S	Bend	trans	-125.3	147.2	162.6	-164.7	174.4	-165	0	0	108.6	M902 S908 S909	M902-E904 VanDerWaalsContact CB-O 3.23Å; M902-E904 WeakPolarHBondContact CB-O 3.32Å; M902-E904 PolarHBondContact O-N 2.74Å; E904-S908 WeakPolarHBondContact OE1-CA 2.93Å; E904-S908 VanDerWaalsContact OE1-CB 3.28Å; E904-S908 WeakPolarHBondContact OE1-CB 3.35Å; E904-S909 PolarHBondContact OE1-N 2.69Å
905	P	90.8	Very high	88.8	Confident	1 Å²	1	19.7 Å²	19.7	1%	0.006	12%	0.116	C	C	.	.			trans	-50.2	150.1	163.3	22.3	-35.9	0	0	0	112.1	R794 I907 L981	R794-P905 VanDerWaalsContact CD-CD 3.5Å; P905-I907 WeakPolarHBondContact CB-O 3.36Å; P905-I907 WeakPolarHBondContact CG-O 3.33Å; P905-I907 CarbonylContact O-C 3.58Å; P905-I907 PolarHBondContact O-N 3.01Å; P905-I907 VanDerWaalsContact O-N 3.17Å; P905-L981 WeakPolarHBondContact CB-O 2.97Å
906	L	93	Very high	88.7	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.116	C	C	.	.	S	Bend	trans	-57	-37.1	-176.6	-172.3	56.1	0	0	0	112	L820 L899 M902 N945 T948 L949 V952 L981	L820-L906 HydrophobicContact CD2-CD1 3.6Å; L899-L906 HydrophobicContact CD2-CD2 4.39Å; M902-L906 HydrophobicContact CE-CB 3.74Å; M902-L906 HydrophobicContact CE-CD1 4.14Å; M902-L906 HydrophobicContact CE-CG 4.45Å; M902-L906 HydrophobicContact SD-CD1 4.37Å; L906-N945 HydrophobicContact CD1-CB 4.29Å; L906-N945 PolarHBondContact O-ND2 2.83Å; L906-T948 HydrophobicContact CD1-CG2 3.81Å; L906-T948 HydrophobicContact CD2-CG2 4.08Å; L906-L949 HydrophobicContact CD2-CB 4.07Å; L906-L949 HydrophobicContact CD2-CD1 4.03Å; L906-L949 HydrophobicContact CG-CB 4.41Å; L906-V952 HydrophobicContact CD2-CG2 4.21Å; L906-L981 HydrophobicContact CB-CD2 3.92Å; L906-L981 HydrophobicContact CD2-CD2 3.72Å; L906-L981 HydrophobicContact CG-CD2 4.44Å; L906-L981 PolarHBondContact N-O 2.86Å
907	I	93.8	Very high	88.7	Confident	4 Å²	4	22.8 Å²	22.8	2%	0.021	13%	0.133	C	C	.	.	S	Bend	trans	-97.5	116.4	169.1	-63.5	172.1	0	0	0	107	P905 T911 L938 L941 L949 L981 F982	P905-I907 WeakPolarHBondContact CB-O 3.36Å; P905-I907 WeakPolarHBondContact CG-O 3.33Å; P905-I907 CarbonylContact O-C 3.58Å; P905-I907 PolarHBondContact O-N 3.01Å; P905-I907 VanDerWaalsContact O-N 3.17Å; I907-T911 HydrophobicContact CG2-CG2 3.96Å; I907-L938 HydrophobicContact CD1-CD2 4.01Å; I907-L938 HydrophobicContact CG1-CD2 4.46Å; I907-L941 HydrophobicContact CG1-CD1 4.19Å; I907-L941 HydrophobicContact CG2-CD2 4.45Å; I907-L949 HydrophobicContact CD1-CD1 3.98Å; I907-L949 HydrophobicContact CD1-CD2 3.87Å; I907-L949 HydrophobicContact CG1-CD1 4.25Å; I907-L949 HydrophobicContact CG1-CD2 3.97Å; I907-L981 PolarHBondContact N-O 2.94Å; I907-F982 HydrophobicContact CB-CD1 4.12Å; I907-F982 HydrophobicContact CB-CE1 4.26Å; I907-F982 HydrophobicContact CD1-CD1 4Å; I907-F982 HydrophobicContact CD1-CE1 3.33Å; I907-F982 HydrophobicContact CD1-CZ 3.85Å; I907-F982 HydrophobicContact CG1-CE1 4.36Å; I907-F982 HydrophobicContact CG2-CD1 4.12Å; I907-F982 HydrophobicContact CG2-CE1 4.17Å
908	S	89.9	Confident	89	Confident	17 Å²	17	22 Å²	22	12%	0.119	13%	0.13	C	C	.	.			trans	-56.5	156.2	-172	84.4	0	0	0	0	112.7	E904 C910 T911 Y912	E904-S908 WeakPolarHBondContact OE1-CA 2.93Å; E904-S908 VanDerWaalsContact OE1-CB 3.28Å; E904-S908 WeakPolarHBondContact OE1-CB 3.35Å; S908-C910 PolarHBondContact O-N 3.43Å; S908-C910 VanDerWaalsContact O-N 3.16Å; S908-C910 PolarHBondContact OG-N 3.2Å; S908-T911 PolarHBondContact O-N 2.83Å; S908-T911 VanDerWaalsContact O-N 3.16Å; S908-T911 WeakPolarHBondContact OG-CB 3.37Å; S908-T911 PolarHBondContact OG-N 2.85Å; S908-T911 PolarHBondContact OG-OG1 2.87Å; S908-Y912 WeakPolarHBondContact O-CB 3.45Å; S908-Y912 PolarHBondContact O-N 3.38Å
909	S	87	Confident	89.1	Confident	3 Å²	3	23.9 Å²	23.9	2%	0.021	14%	0.137	C	C	.	.	H	α-helix	trans	-59.9	-31.3	180	-55.1	0	0	0	0	112.5	E904 Q913 T984	E904-S909 PolarHBondContact OE1-N 2.69Å; S909-Q913 WeakPolarHBondContact O-CG 3.32Å; S909-Q913 PolarHBondContact O-N 2.84Å; S909-T984 WeakPolarHBondContact OG-CG2 3.28Å
910	C	87.1	Confident	89.2	Confident	75 Å²	75	30.1 Å²	30.1	51%	0.507	16%	0.161	S	C	.	.	H	α-helix	trans	-72.2	-53	174.9	-177.6	0	0	0	0	110.9	S908 Y912 Q913 T914	S908-C910 PolarHBondContact O-N 3.43Å; S908-C910 VanDerWaalsContact O-N 3.16Å; S908-C910 PolarHBondContact OG-N 3.2Å; C910-Y912 VanDerWaalsContact C-N 3.26Å; C910-Y912 PolarHBondContact O-N 2.83Å; C910-Q913 PolarHBondContact O-N 3.02Å; C910-Q913 VanDerWaalsContact O-N 3.13Å; C910-T914 PolarHBondContact O-N 2.74Å; C910-T914 VanDerWaalsContact O-N 3.13Å; C910-T914 PolarHBondContact O-OG1 2.77Å
911	T	91.8	Very high	89.5	Confident	13 Å²	13	33.7 Å²	33.7	8%	0.08	18%	0.181	C	C	.	.	H	α-helix	trans	-56.9	-39.9	178.6	-48.3	0	0	0	0	111.4	I907 S908 T914 L915 V937 L941	I907-T911 HydrophobicContact CG2-CG2 3.96Å; S908-T911 PolarHBondContact O-N 2.83Å; S908-T911 VanDerWaalsContact O-N 3.16Å; S908-T911 WeakPolarHBondContact OG-CB 3.37Å; S908-T911 PolarHBondContact OG-N 2.85Å; S908-T911 PolarHBondContact OG-OG1 2.87Å; T911-T914 PolarHBondContact O-N 3Å; T911-L915 WeakPolarHBondContact O-CB 3.36Å; T911-L915 PolarHBondContact O-N 3.22Å; T911-V937 HydrophobicContact CG2-CG1 3.95Å; T911-L941 HydrophobicContact CG2-CD2 3.88Å; T911-L941 HydrophobicContact CG2-CG 4.19Å
912	Y	92.4	Very high	90	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.2	-43.7	177.8	177.5	-147.2	0	0	0	112.4	S908 C910 L915 V916 F982 L999 L1004 A1005 L1008	S908-Y912 WeakPolarHBondContact O-CB 3.45Å; S908-Y912 PolarHBondContact O-N 3.38Å; C910-Y912 VanDerWaalsContact C-N 3.26Å; C910-Y912 PolarHBondContact O-N 2.83Å; Y912-L915 PolarHBondContact O-N 3.48Å; Y912-V916 HydrophobicContact CD2-CG2 3.84Å; Y912-V916 HydrophobicContact CE2-CG2 3.58Å; Y912-V916 VanDerWaalsContact O-CG2 3.29Å; Y912-V916 WeakPolarHBondContact O-CG2 3.19Å; Y912-V916 PolarHBondContact O-N 2.84Å; Y912-F982 HydrophobicContact CD1-CB 3.91Å; Y912-F982 WeakPolarHBondContact CD1-O 3.41Å; Y912-F982 HydrophobicContact CD2-CB 3.97Å; Y912-F982 AromaticContact CD2-CD1 3.46Å; Y912-F982 HydrophobicContact CD2-CD1 3.46Å; Y912-F982 VanDerWaalsContact CD2-CD1 3.46Å; Y912-F982 HydrophobicContact CD2-CE1 4.2Å; Y912-F982 AromaticContact CD2-CG 3.92Å; Y912-F982 HydrophobicContact CD2-CG 3.92Å; Y912-F982 HydrophobicContact CE1-CB 3.8Å; Y912-F982 HydrophobicContact CE2-CB 3.86Å; Y912-F982 AromaticContact CE2-CD1 3.88Å; Y912-F982 HydrophobicContact CE2-CD1 3.88Å; Y912-F982 AromaticContact CE2-CG 3.9Å; Y912-F982 HydrophobicContact CE2-CG 3.9Å; Y912-F982 HydrophobicContact CG-CB 4.01Å; Y912-F982 AromaticContact CG-CD1 3.93Å; Y912-F982 HydrophobicContact CG-CD1 3.93Å; Y912-F982 HydrophobicContact CG-CG 4.36Å; Y912-L999 HydrophobicContact CD1-CD2 3.64Å; Y912-L999 HydrophobicContact CE1-CD2 4.02Å; Y912-L1004 HydrophobicContact CE2-CD2 4.23Å; Y912-L1004 WeakPolarHBondContact OH-CD2 3.36Å; Y912-A1005 WeakPolarHBondContact OH-CB 3.33Å; Y912-L1008 HydrophobicContact CD2-CD2 3.77Å; Y912-L1008 HydrophobicContact CE2-CD2 3.6Å
913	Q	90.9	Very high	90.3	Very high	22 Å²	22	38.6 Å²	38.6	10%	0.103	21%	0.208	C	C	.	.	H	α-helix	trans	-61.7	-48.3	175.5	-62.3	-84.6	-43.8	0	0	110.6	S909 C910 L915 V916 D917 I997 L999	S909-Q913 WeakPolarHBondContact O-CG 3.32Å; S909-Q913 PolarHBondContact O-N 2.84Å; C910-Q913 PolarHBondContact O-N 3.02Å; C910-Q913 VanDerWaalsContact O-N 3.13Å; Q913-L915 VanDerWaalsContact C-N 3.28Å; Q913-L915 PolarHBondContact O-N 3.29Å; Q913-V916 PolarHBondContact O-N 3.17Å; Q913-V916 VanDerWaalsContact O-N 3.16Å; Q913-D917 PolarHBondContact O-N 3.21Å; Q913-I997 PolarHBondContact NE2-O 2.99Å; Q913-L999 HydrophobicContact CG-CD2 4.43Å; Q913-L999 VanDerWaalsContact NE2-CD2 3.26Å
914	T	92.7	Very high	90.6	Very high	70 Å²	70	41.7 Å²	41.7	43%	0.429	23%	0.227	S	C	.	.	H	α-helix	trans	-60	-37.1	176.3	-48.7	0	0	0	0	112.5	C910 T911 D917 A918 V937	C910-T914 PolarHBondContact O-N 2.74Å; C910-T914 VanDerWaalsContact O-N 3.13Å; C910-T914 PolarHBondContact O-OG1 2.77Å; T911-T914 PolarHBondContact O-N 3Å; T914-D917 PolarHBondContact O-N 2.71Å; T914-A918 VanDerWaalsContact O-CB 3.3Å; T914-A918 WeakPolarHBondContact O-CB 3.19Å; T914-A918 PolarHBondContact O-N 2.85Å; T914-V937 HydrophobicContact CG2-CG1 3.87Å; T914-V937 HydrophobicContact CG2-CG2 3.93Å
915	L	93.9	Very high	90.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-70.1	-32.6	179.1	-165.7	68.9	0	0	0	111.8	T911 Y912 Q913 W919 I934 V937 L938 F982 L1008 V1012	T911-L915 WeakPolarHBondContact O-CB 3.36Å; T911-L915 PolarHBondContact O-N 3.22Å; Y912-L915 PolarHBondContact O-N 3.48Å; Q913-L915 VanDerWaalsContact C-N 3.28Å; Q913-L915 PolarHBondContact O-N 3.29Å; L915-W919 WeakPolarHBondContact O-CB 3.37Å; L915-W919 PolarHBondContact O-N 3.09Å; L915-I934 HydrophobicContact CD1-CD1 4.02Å; L915-I934 HydrophobicContact CD1-CG2 4.12Å; L915-V937 HydrophobicContact CB-CG1 4Å; L915-V937 HydrophobicContact CD1-CB 3.96Å; L915-V937 HydrophobicContact CD1-CG1 3.88Å; L915-L938 HydrophobicContact CD1-CD2 4.13Å; L915-L938 HydrophobicContact CD1-CG 4.05Å; L915-L938 HydrophobicContact CD2-CD2 3.87Å; L915-F982 HydrophobicContact CD2-CE1 3.79Å; L915-F982 HydrophobicContact CD2-CZ 4.43Å; L915-L1008 HydrophobicContact CB-CD2 4.38Å; L915-L1008 HydrophobicContact CD2-CD2 3.88Å; L915-L1008 HydrophobicContact CD2-CG 4.4Å; L915-L1008 HydrophobicContact CG-CD1 4.29Å; L915-L1008 HydrophobicContact CG-CD2 4.06Å; L915-V1012 HydrophobicContact CD2-CG2 4.47Å
916	V	93.4	Very high	90.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-71	-39.9	172.6	173.8	0	0	0	0	111.4	Y912 Q913 W919 R920 I997 L1004 L1008	Y912-V916 HydrophobicContact CD2-CG2 3.84Å; Y912-V916 HydrophobicContact CE2-CG2 3.58Å; Y912-V916 VanDerWaalsContact O-CG2 3.29Å; Y912-V916 WeakPolarHBondContact O-CG2 3.19Å; Y912-V916 PolarHBondContact O-N 2.84Å; Q913-V916 PolarHBondContact O-N 3.17Å; Q913-V916 VanDerWaalsContact O-N 3.16Å; V916-W919 PolarHBondContact O-N 3.02Å; V916-R920 WeakPolarHBondContact O-CD 3.41Å; V916-R920 VanDerWaalsContact O-CG 3.24Å; V916-R920 WeakPolarHBondContact O-CG 3.49Å; V916-R920 PolarHBondContact O-N 3.17Å; V916-I997 HydrophobicContact CB-CD1 3.79Å; V916-I997 HydrophobicContact CG1-CD1 3.48Å; V916-I997 VanDerWaalsContact CG1-CD1 3.48Å; V916-I997 HydrophobicContact CG1-CG1 4.11Å; V916-L1004 HydrophobicContact CG1-CD1 4.27Å; V916-L1004 HydrophobicContact CG1-CD2 4.15Å; V916-L1004 HydrophobicContact CG2-CD2 3.61Å; V916-L1008 HydrophobicContact CG2-CD2 3.8Å
917	D	92.8	Very high	90.1	Very high	76 Å²	76	53.8 Å²	53.8	41%	0.406	28%	0.28	S	S	.	.	H	α-helix	trans	-70.3	-38.2	176.5	-71.8	-31.8	0	0	0	112.4	Q913 T914 W919 R920	Q913-D917 PolarHBondContact O-N 3.21Å; T914-D917 PolarHBondContact O-N 2.71Å; D917-W919 VanDerWaalsContact C-N 3.35Å; D917-R920 PolarHBondContact O-N 2.8Å; D917-R920 WeakPolarHBondContact OD1-CD 3.4Å; D917-R920 IonicContact OD1-CZ 3.88Å; D917-R920 IonicContact OD1-NE 3.21Å; D917-R920 IonicContact OD1-NH1 2.75Å; D917-R920 PolarHBondContact OD1-NH1 2.84Å
918	A	93.4	Very high	89.8	Confident	9 Å²	9	56.2 Å²	56.2	7%	0.074	29%	0.291	C	S	.	.	H	α-helix	trans	-58.2	-44.3	166.6	0	0	0	0	0	112.2	T914 V921 C922 L933 I934 V937	T914-A918 VanDerWaalsContact O-CB 3.3Å; T914-A918 WeakPolarHBondContact O-CB 3.19Å; T914-A918 PolarHBondContact O-N 2.85Å; A918-V921 VanDerWaalsContact O-CG2 3.3Å; A918-V921 WeakPolarHBondContact O-CG2 3.26Å; A918-V921 PolarHBondContact O-N 2.79Å; A918-C922 PolarHBondContact O-N 2.93Å; A918-C922 PolarHBondContact O-SG 2.83Å; A918-L933 HydrophobicContact CB-CD1 4.25Å; A918-L933 HydrophobicContact CB-CD2 4.16Å; A918-L933 HydrophobicContact CB-CG 3.89Å; A918-L933 WeakPolarHBondContact O-CD2 3.47Å; A918-I934 HydrophobicContact CB-CD1 4.27Å; A918-V937 HydrophobicContact CB-CG2 4.02Å
919	W	93.5	Very high	89.8	Confident	47 Å²	47	56.5 Å²	56.5	18%	0.178	30%	0.297	C	S	.	.	H	α-helix	trans	-67.4	-34.5	178.5	-179.1	73.7	0	0	0	113.4	L915 V916 D917 V921 C922 I934 R1007 L1008 T1011	L915-W919 WeakPolarHBondContact O-CB 3.37Å; L915-W919 PolarHBondContact O-N 3.09Å; V916-W919 PolarHBondContact O-N 3.02Å; D917-W919 VanDerWaalsContact C-N 3.35Å; W919-V921 PolarHBondContact O-N 2.91Å; W919-C922 WeakPolarHBondContact O-CB 3.17Å; W919-C922 PolarHBondContact O-N 2.86Å; W919-I934 HydrophobicContact CB-CD1 4.14Å; W919-R1007 HydrophobicContact CH2-CB 4.05Å; W919-R1007 HydrophobicContact CZ2-CB 4.04Å; W919-L1008 HydrophobicContact CB-CD1 3.4Å; W919-L1008 HydrophobicContact CD2-CD1 4Å; W919-L1008 HydrophobicContact CG-CD1 3.43Å; W919-L1008 VanDerWaalsContact CG-CD1 3.43Å; W919-T1011 PolarHBondContact NE1-OG1 2.69Å
920	R	91.5	Very high	90	Very high	132 Å²	132	57.2 Å²	57.2	50%	0.498	30%	0.301	S	S	.	.	H	α-helix	trans	-62.2	-23.5	175.4	-78.5	161.6	166.2	-179.3	-5.5	113.8	V916 D917	V916-R920 WeakPolarHBondContact O-CD 3.41Å; V916-R920 VanDerWaalsContact O-CG 3.24Å; V916-R920 WeakPolarHBondContact O-CG 3.49Å; V916-R920 PolarHBondContact O-N 3.17Å; D917-R920 PolarHBondContact O-N 2.8Å; D917-R920 WeakPolarHBondContact OD1-CD 3.4Å; D917-R920 IonicContact OD1-CZ 3.88Å; D917-R920 IonicContact OD1-NE 3.21Å; D917-R920 IonicContact OD1-NH1 2.75Å; D917-R920 PolarHBondContact OD1-NH1 2.84Å
921	V	92.7	Very high	90.1	Very high	100 Å²	100	53.9 Å²	53.9	61%	0.606	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	4.7	177.4	-56.9	0	0	0	0	113.8	A918 W919 I923 L933	A918-V921 VanDerWaalsContact O-CG2 3.3Å; A918-V921 WeakPolarHBondContact O-CG2 3.26Å; A918-V921 PolarHBondContact O-N 2.79Å; W919-V921 PolarHBondContact O-N 2.91Å; V921-I923 PolarHBondContact O-N 2.86Å; V921-L933 HydrophobicContact CG2-CD2 3.7Å
922	C	89.3	Confident	90.1	Very high	26 Å²	26	59.6 Å²	59.6	18%	0.176	30%	0.298	C	S	.	.			trans	-65	132.8	175.5	-75.8	0	0	0	0	111.6	A918 W919 N930	A918-C922 PolarHBondContact O-N 2.93Å; A918-C922 PolarHBondContact O-SG 2.83Å; W919-C922 WeakPolarHBondContact O-CB 3.17Å; W919-C922 PolarHBondContact O-N 2.86Å; C922-N930 WeakPolarHBondContact CA-OD1 3.27Å; C922-N930 HydrophobicContact CB-CB 4.4Å; C922-N930 VanDerWaalsContact CB-OD1 3.27Å; C922-N930 WeakPolarHBondContact CB-OD1 3.43Å
923	I	88	Confident	90.1	Very high	100 Å²	100	62.9 Å²	62.9	51%	0.513	32%	0.315	S	S	.	.			trans	-96.3	122.7	-177.6	-58	173	0	0	0	108.1	V921 E925 D926 N930	V921-I923 PolarHBondContact O-N 2.86Å; I923-E925 PolarHBondContact O-N 3.48Å; I923-D926 HydrophobicContact CB-CB 4.07Å; I923-D926 HydrophobicContact CG2-CB 4.41Å; I923-D926 PolarHBondContact O-N 2.67Å; I923-N930 PolarHBondContact N-OD1 2.91Å; I923-N930 PolarHBondContact O-ND2 2.84Å
924	P	81.6	Confident	90.2	Very high	108 Å²	108	61.8 Å²	61.8	70%	0.701	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-32.9	-169.2	-32.4	36.5	0	0	0	116.7
925	E	82.3	Confident	90.1	Very high	116 Å²	116	58.6 Å²	58.6	54%	0.542	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-23.9	-178.4	-45.4	-54.6	146.8	0	0	114	S61 I923 R927	S61-E925 VanDerWaalsContact CB-CG 3.41Å; S61-E925 WeakPolarHBondContact CB-OE1 3.36Å; S61-E925 PolarHBondContact OG-OE1 3.25Å; I923-E925 PolarHBondContact O-N 3.48Å; E925-R927 PolarHBondContact O-N 2.83Å
926	D	88.1	Confident	90	Very high	71 Å²	71	60.2 Å²	60.2	38%	0.38	31%	0.307	S	S	.	.			trans	-84.1	68.9	-176.5	-170.8	6.2	0	0	0	110.5	I923 E928 G929 N930	I923-D926 HydrophobicContact CB-CB 4.07Å; I923-D926 HydrophobicContact CG2-CB 4.41Å; I923-D926 PolarHBondContact O-N 2.67Å; D926-E928 PolarHBondContact O-N 3.49Å; D926-G929 PolarHBondContact O-N 2.8Å; D926-G929 PolarHBondContact OD1-N 3.06Å; D926-G929 WeakPolarHBondContact OD2-CA 3.41Å; D926-N930 WeakPolarHBondContact O-CB 3.33Å; D926-N930 PolarHBondContact O-N 2.8Å; D926-N930 PolarHBondContact O-ND2 2.63Å; D926-N930 VanDerWaalsContact O-ND2 3.16Å; D926-N930 PolarHBondContact O-OD1 3.19Å
927	R	87.1	Confident	90	Very high	140 Å²	140	61.1 Å²	61.1	53%	0.528	31%	0.312	S	S	.	.	H	α-helix	trans	-55.5	-34.1	178.9	-170.7	177.8	-173.2	162.5	6.3	112	E925 F931 N1014 L1015	E925-R927 PolarHBondContact O-N 2.83Å; R927-F931 WeakPolarHBondContact O-CB 3.28Å; R927-F931 PolarHBondContact O-N 2.89Å; R927-N1014 PolarHBondContact NH2-O 3.2Å; R927-L1015 HydrophobicContact CG-CD2 3.81Å
928	E	86.7	Confident	90	Very high	55 Å²	55	57.5 Å²	57.5	26%	0.257	29%	0.293	S	S	.	.	H	α-helix	trans	-77.9	-47.5	-176.5	-179	60.1	-166.5	0	0	112.2	D926 F931 R932 L1044	D926-E928 PolarHBondContact O-N 3.49Å; E928-F931 WeakPolarHBondContact O-CB 3.47Å; E928-F931 PolarHBondContact O-N 2.84Å; E928-R932 WeakPolarHBondContact O-CG 3.36Å; E928-R932 PolarHBondContact O-N 3.18Å; E928-R932 IonicContact OE1-CZ 2.73Å; E928-R932 IonicContact OE1-NE 2.74Å; E928-R932 PolarHBondContact OE1-NE 2.82Å; E928-R932 IonicContact OE1-NH2 3.95Å; E928-R932 PolarHBondContact OE1-NH2 3.14Å; E928-L1044 VanDerWaalsContact OE1-CD1 3.26Å; E928-L1044 WeakPolarHBondContact OE1-CD1 3.27Å; E928-L1044 WeakPolarHBondContact OE2-CD1 3.41Å
929	G	90.4	Very high	89.8	Confident	24 Å²	24	59 Å²	59	25%	0.247	30%	0.3	C	S	.	.	H	α-helix	trans	-62.4	-43.7	173	0	0	0	0	0	112	D926 F931 R932 L933	D926-G929 PolarHBondContact O-N 2.8Å; D926-G929 PolarHBondContact OD1-N 3.06Å; D926-G929 WeakPolarHBondContact OD2-CA 3.41Å; G929-F931 VanDerWaalsContact C-N 3.34Å; G929-F931 PolarHBondContact O-N 3.15Å; G929-R932 PolarHBondContact O-N 3.22Å; G929-L933 VanDerWaalsContact O-CB 3.24Å; G929-L933 WeakPolarHBondContact O-CB 3.45Å; G929-L933 PolarHBondContact O-N 2.98Å
930	N	91.5	Very high	89.7	Confident	18 Å²	18	61.6 Å²	61.6	10%	0.096	32%	0.324	C	S	.	.	H	α-helix	trans	-60.2	-42.9	173.4	-65.2	-16.1	0	0	0	111.6	C922 I923 D926 L933 I934 L1015	C922-N930 WeakPolarHBondContact CA-OD1 3.27Å; C922-N930 HydrophobicContact CB-CB 4.4Å; C922-N930 VanDerWaalsContact CB-OD1 3.27Å; C922-N930 WeakPolarHBondContact CB-OD1 3.43Å; I923-N930 PolarHBondContact N-OD1 2.91Å; I923-N930 PolarHBondContact O-ND2 2.84Å; D926-N930 WeakPolarHBondContact O-CB 3.33Å; D926-N930 PolarHBondContact O-N 2.8Å; D926-N930 PolarHBondContact O-ND2 2.63Å; D926-N930 VanDerWaalsContact O-ND2 3.16Å; D926-N930 PolarHBondContact O-OD1 3.19Å; N930-L933 PolarHBondContact O-N 2.85Å; N930-I934 VanDerWaalsContact O-CB 3.24Å; N930-I934 WeakPolarHBondContact O-CB 3.45Å; N930-I934 VanDerWaalsContact O-CG1 3.24Å; N930-I934 WeakPolarHBondContact O-CG1 3.44Å; N930-I934 PolarHBondContact O-N 2.79Å; N930-L1015 HydrophobicContact CB-CD1 4.21Å; N930-L1015 HydrophobicContact CB-CD2 4.44Å
931	F	89.4	Confident	89.7	Confident	5 Å²	5	55.7 Å²	55.7	2%	0.022	30%	0.302	C	S	.	.	H	α-helix	trans	-59.7	-54.9	175.5	-178.8	-79.8	0	0	0	110.5	R927 E928 G929 L933 I934 F935 L1015 L1044 I1045	R927-F931 WeakPolarHBondContact O-CB 3.28Å; R927-F931 PolarHBondContact O-N 2.89Å; E928-F931 WeakPolarHBondContact O-CB 3.47Å; E928-F931 PolarHBondContact O-N 2.84Å; G929-F931 VanDerWaalsContact C-N 3.34Å; G929-F931 PolarHBondContact O-N 3.15Å; F931-L933 VanDerWaalsContact C-N 3.27Å; F931-L933 PolarHBondContact O-N 3.19Å; F931-I934 PolarHBondContact O-N 3.23Å; F931-F935 HydrophobicContact CD1-CD2 4.04Å; F931-F935 AromaticContact CD2-CD2 3.59Å; F931-F935 HydrophobicContact CD2-CD2 3.59Å; F931-F935 AromaticContact CD2-CE2 3.55Å; F931-F935 HydrophobicContact CD2-CE2 3.55Å; F931-F935 HydrophobicContact CE1-CB 4.38Å; F931-F935 HydrophobicContact CE1-CD2 4.02Å; F931-F935 HydrophobicContact CE1-CG 4.24Å; F931-F935 AromaticContact CE2-CD2 3.6Å; F931-F935 HydrophobicContact CE2-CD2 3.6Å; F931-F935 AromaticContact CE2-CE2 3.45Å; F931-F935 HydrophobicContact CE2-CE2 3.45Å; F931-F935 VanDerWaalsContact CE2-CE2 3.45Å; F931-F935 HydrophobicContact CE2-CG 4.34Å; F931-F935 HydrophobicContact CE2-CZ 4.09Å; F931-F935 AromaticContact CG-CD2 3.81Å; F931-F935 HydrophobicContact CG-CD2 3.81Å; F931-F935 HydrophobicContact CG-CE2 4.24Å; F931-F935 AromaticContact CZ-CD2 3.82Å; F931-F935 HydrophobicContact CZ-CD2 3.82Å; F931-F935 HydrophobicContact CZ-CE2 4.07Å; F931-F935 HydrophobicContact CZ-CG 4.14Å; F931-F935 WeakPolarHBondContact O-CB 3.31Å; F931-F935 WeakPolarHBondContact O-CD2 3.42Å; F931-F935 PolarHBondContact O-N 3.21Å; F931-L1015 HydrophobicContact CD2-CB 4.36Å; F931-L1044 HydrophobicContact CD1-CB 4.42Å; F931-L1044 HydrophobicContact CD1-CD1 4.14Å; F931-L1044 HydrophobicContact CE1-CB 3.61Å; F931-L1044 HydrophobicContact CE1-CD1 4.15Å; F931-L1044 HydrophobicContact CE1-CG 4.41Å; F931-L1044 HydrophobicContact CZ-CB 3.91Å; F931-I1045 HydrophobicContact CE2-CD1 4.17Å; F931-I1045 HydrophobicContact CZ-CD1 3.93Å; F931-I1045 HydrophobicContact CZ-CG1 3.99Å
932	R	90.1	Very high	89.7	Confident	133 Å²	133	54.6 Å²	54.6	50%	0.502	30%	0.297	S	S	.	.	H	α-helix	trans	-58.9	-38.5	-179.5	-69.1	176.9	-169.2	-166.3	4.2	112.7	E928 G929 G936	E928-R932 WeakPolarHBondContact O-CG 3.36Å; E928-R932 PolarHBondContact O-N 3.18Å; E928-R932 IonicContact OE1-CZ 2.73Å; E928-R932 IonicContact OE1-NE 2.74Å; E928-R932 PolarHBondContact OE1-NE 2.82Å; E928-R932 IonicContact OE1-NH2 3.95Å; E928-R932 PolarHBondContact OE1-NH2 3.14Å; G929-R932 PolarHBondContact O-N 3.22Å; R932-G936 WeakPolarHBondContact O-CA 3.44Å; R932-G936 PolarHBondContact O-N 3.22Å
933	L	92.3	Very high	89.7	Confident	68 Å²	68	56.9 Å²	56.9	36%	0.356	31%	0.307	S	S	.	.	H	α-helix	trans	-69.6	-51.3	178.5	-179.3	63.6	0	0	0	112	A918 V921 G929 N930 F931 V937	A918-L933 HydrophobicContact CB-CD1 4.25Å; A918-L933 HydrophobicContact CB-CD2 4.16Å; A918-L933 HydrophobicContact CB-CG 3.89Å; A918-L933 WeakPolarHBondContact O-CD2 3.47Å; V921-L933 HydrophobicContact CG2-CD2 3.7Å; G929-L933 VanDerWaalsContact O-CB 3.24Å; G929-L933 WeakPolarHBondContact O-CB 3.45Å; G929-L933 PolarHBondContact O-N 2.98Å; N930-L933 PolarHBondContact O-N 2.85Å; F931-L933 VanDerWaalsContact C-N 3.27Å; F931-L933 PolarHBondContact O-N 3.19Å; L933-V937 WeakPolarHBondContact O-CG2 3.32Å; L933-V937 PolarHBondContact O-N 3.01Å
934	I	93	Very high	89.8	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65.5	-47.3	-178.9	-70.7	-66.5	0	0	0	111.1	L915 A918 W919 N930 F931 V937 L938 V1012 L1015	L915-I934 HydrophobicContact CD1-CD1 4.02Å; L915-I934 HydrophobicContact CD1-CG2 4.12Å; A918-I934 HydrophobicContact CB-CD1 4.27Å; W919-I934 HydrophobicContact CB-CD1 4.14Å; N930-I934 VanDerWaalsContact O-CB 3.24Å; N930-I934 WeakPolarHBondContact O-CB 3.45Å; N930-I934 VanDerWaalsContact O-CG1 3.24Å; N930-I934 WeakPolarHBondContact O-CG1 3.44Å; N930-I934 PolarHBondContact O-N 2.79Å; F931-I934 PolarHBondContact O-N 3.23Å; I934-V937 PolarHBondContact O-N 2.94Å; I934-L938 HydrophobicContact CG2-CD1 4.36Å; I934-L938 WeakPolarHBondContact O-CG 3.33Å; I934-L938 PolarHBondContact O-N 3.22Å; I934-V1012 HydrophobicContact CG2-CG2 4Å; I934-L1015 HydrophobicContact CB-CD1 4.17Å; I934-L1015 HydrophobicContact CG1-CD1 4.02Å; I934-L1015 HydrophobicContact CG2-CD1 4.32Å
935	F	91.2	Very high	90.4	Very high	3 Å²	3	49 Å²	49	1%	0.013	26%	0.262	C	S	.	.	H	α-helix	trans	-71.6	-33.2	178.8	-77	-86.2	0	0	0	112.6	F931 V937 L938 D939 L1015 W1016 I1045 W1049	F931-F935 HydrophobicContact CD1-CD2 4.04Å; F931-F935 AromaticContact CD2-CD2 3.59Å; F931-F935 HydrophobicContact CD2-CD2 3.59Å; F931-F935 AromaticContact CD2-CE2 3.55Å; F931-F935 HydrophobicContact CD2-CE2 3.55Å; F931-F935 HydrophobicContact CE1-CB 4.38Å; F931-F935 HydrophobicContact CE1-CD2 4.02Å; F931-F935 HydrophobicContact CE1-CG 4.24Å; F931-F935 AromaticContact CE2-CD2 3.6Å; F931-F935 HydrophobicContact CE2-CD2 3.6Å; F931-F935 AromaticContact CE2-CE2 3.45Å; F931-F935 HydrophobicContact CE2-CE2 3.45Å; F931-F935 VanDerWaalsContact CE2-CE2 3.45Å; F931-F935 HydrophobicContact CE2-CG 4.34Å; F931-F935 HydrophobicContact CE2-CZ 4.09Å; F931-F935 AromaticContact CG-CD2 3.81Å; F931-F935 HydrophobicContact CG-CD2 3.81Å; F931-F935 HydrophobicContact CG-CE2 4.24Å; F931-F935 AromaticContact CZ-CD2 3.82Å; F931-F935 HydrophobicContact CZ-CD2 3.82Å; F931-F935 HydrophobicContact CZ-CE2 4.07Å; F931-F935 HydrophobicContact CZ-CG 4.14Å; F931-F935 WeakPolarHBondContact O-CB 3.31Å; F931-F935 WeakPolarHBondContact O-CD2 3.42Å; F931-F935 PolarHBondContact O-N 3.21Å; F935-V937 VanDerWaalsContact C-N 3.25Å; F935-V937 PolarHBondContact O-N 2.88Å; F935-L938 HydrophobicContact CD1-CD1 4.23Å; F935-L938 HydrophobicContact CE1-CD1 4.29Å; F935-L938 CarbonylContact O-C 3.53Å; F935-L938 PolarHBondContact O-N 3.47Å; F935-D939 PolarHBondContact O-N 3.01Å; F935-L1015 HydrophobicContact CE2-CB 4Å; F935-W1016 HydrophobicContact CE1-CD2 4.23Å; F935-W1016 AromaticContact CE1-CE3 3.5Å; F935-W1016 HydrophobicContact CE1-CE3 3.5Å; F935-W1016 VanDerWaalsContact CE1-CE3 3.5Å; F935-W1016 HydrophobicContact CE1-CH2 4.07Å; F935-W1016 AromaticContact CE1-CZ3 3.43Å; F935-W1016 HydrophobicContact CE1-CZ3 3.43Å; F935-W1016 VanDerWaalsContact CE1-CZ3 3.43Å; F935-W1016 HydrophobicContact CZ-CD2 4.09Å; F935-W1016 AromaticContact CZ-CE3 3.47Å; F935-W1016 HydrophobicContact CZ-CE3 3.47Å; F935-W1016 VanDerWaalsContact CZ-CE3 3.47Å; F935-W1016 AromaticContact CZ-CZ3 3.92Å; F935-W1016 HydrophobicContact CZ-CZ3 3.92Å; F935-I1045 HydrophobicContact CD1-CD1 4.13Å; F935-I1045 HydrophobicContact CE1-CD1 3.59Å; F935-I1045 HydrophobicContact CE1-CG1 4.44Å; F935-I1045 HydrophobicContact CZ-CD1 3.89Å; F935-W1049 HydrophobicContact CD1-CZ2 4.26Å
936	G	92	Very high	90.9	Very high	34 Å²	34	45.1 Å²	45.1	35%	0.351	24%	0.243	S	C	.	.	H	α-helix	trans	-61.4	-29.6	171.9	0	0	0	0	0	114	R932	R932-G936 WeakPolarHBondContact O-CA 3.44Å; R932-G936 PolarHBondContact O-N 3.22Å
937	V	93.7	Very high	91.1	Very high	18 Å²	18	42.8 Å²	42.8	11%	0.109	23%	0.232	C	C	.	.	H	α-helix	trans	-76.7	-37	170.7	174.4	0	0	0	0	111.8	T911 T914 L915 A918 L933 I934 F935 D939 C940	T911-V937 HydrophobicContact CG2-CG1 3.95Å; T914-V937 HydrophobicContact CG2-CG1 3.87Å; T914-V937 HydrophobicContact CG2-CG2 3.93Å; L915-V937 HydrophobicContact CB-CG1 4Å; L915-V937 HydrophobicContact CD1-CB 3.96Å; L915-V937 HydrophobicContact CD1-CG1 3.88Å; A918-V937 HydrophobicContact CB-CG2 4.02Å; L933-V937 WeakPolarHBondContact O-CG2 3.32Å; L933-V937 PolarHBondContact O-N 3.01Å; I934-V937 PolarHBondContact O-N 2.94Å; F935-V937 VanDerWaalsContact C-N 3.25Å; F935-V937 PolarHBondContact O-N 2.88Å; V937-D939 VanDerWaalsContact C-N 3.32Å; V937-C940 WeakPolarHBondContact O-CB 3.27Å; V937-C940 PolarHBondContact O-N 2.84Å
938	L	92.5	Very high	91.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-70.8	-26.7	176.1	-65.6	174.3	0	0	0	112.8	I907 L915 I934 F935 C940 L941 L949 V1012 W1016 W1049	I907-L938 HydrophobicContact CD1-CD2 4.01Å; I907-L938 HydrophobicContact CG1-CD2 4.46Å; L915-L938 HydrophobicContact CD1-CD2 4.13Å; L915-L938 HydrophobicContact CD1-CG 4.05Å; L915-L938 HydrophobicContact CD2-CD2 3.87Å; I934-L938 HydrophobicContact CG2-CD1 4.36Å; I934-L938 WeakPolarHBondContact O-CG 3.33Å; I934-L938 PolarHBondContact O-N 3.22Å; F935-L938 HydrophobicContact CD1-CD1 4.23Å; F935-L938 HydrophobicContact CE1-CD1 4.29Å; F935-L938 CarbonylContact O-C 3.53Å; F935-L938 PolarHBondContact O-N 3.47Å; L938-C940 PolarHBondContact O-N 2.57Å; L938-L941 HydrophobicContact CB-CD1 4.49Å; L938-L941 HydrophobicContact CD2-CD1 4.08Å; L938-L941 VanDerWaalsContact O-CB 3.3Å; L938-L941 WeakPolarHBondContact O-CB 3.44Å; L938-L941 WeakPolarHBondContact O-CD1 3.33Å; L938-L941 VanDerWaalsContact O-CG 3.28Å; L938-L941 WeakPolarHBondContact O-CG 3.37Å; L938-L941 PolarHBondContact O-N 2.9Å; L938-L941 VanDerWaalsContact O-N 3.1Å; L938-L949 HydrophobicContact CD2-CD2 4.04Å; L938-V1012 HydrophobicContact CD1-CG1 4.12Å; L938-W1016 HydrophobicContact CD1-CZ3 4.44Å; L938-W1049 HydrophobicContact CB-CH2 3.78Å; L938-W1049 HydrophobicContact CB-CZ2 3.74Å
939	D	89.4	Confident	91.9	Very high	42 Å²	42	33.7 Å²	33.7	23%	0.225	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-19.7	175.6	-96.2	-54.3	0	0	0	113.3	F935 V937 L941 K946 W1049	F935-D939 PolarHBondContact O-N 3.01Å; V937-D939 VanDerWaalsContact C-N 3.32Å; D939-L941 PolarHBondContact O-N 3.29Å; D939-K946 IonicContact OD1-NZ 2.62Å; D939-K946 PolarHBondContact OD1-NZ 2.92Å; D939-W1049 HydrophobicContact CB-CZ2 4.41Å; D939-W1049 VanDerWaalsContact CG-NE1 3.28Å; D939-W1049 PolarHBondContact OD1-NE1 3.35Å; D939-W1049 PolarHBondContact OD2-NE1 3.44Å
940	C	90.8	Very high	92	Very high	101 Å²	101	33.8 Å²	33.8	68%	0.682	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-0.6	172.3	-63.1	0	0	0	0	114	V937 L938	V937-C940 WeakPolarHBondContact O-CB 3.27Å; V937-C940 PolarHBondContact O-N 2.84Å; L938-C940 PolarHBondContact O-N 2.57Å
941	L	92.7	Very high	92.1	Very high	8 Å²	8	33.8 Å²	33.8	4%	0.042	19%	0.193	C	C	.	.	S	Bend	trans	-71.8	144.2	175.2	-70.8	169.1	0	0	0	111.5	I907 T911 L938 D939 N943 N945 K946 L949	I907-L941 HydrophobicContact CG1-CD1 4.19Å; I907-L941 HydrophobicContact CG2-CD2 4.45Å; T911-L941 HydrophobicContact CG2-CD2 3.88Å; T911-L941 HydrophobicContact CG2-CG 4.19Å; L938-L941 HydrophobicContact CB-CD1 4.49Å; L938-L941 HydrophobicContact CD2-CD1 4.08Å; L938-L941 VanDerWaalsContact O-CB 3.3Å; L938-L941 WeakPolarHBondContact O-CB 3.44Å; L938-L941 WeakPolarHBondContact O-CD1 3.33Å; L938-L941 VanDerWaalsContact O-CG 3.28Å; L938-L941 WeakPolarHBondContact O-CG 3.37Å; L938-L941 PolarHBondContact O-N 2.9Å; L938-L941 VanDerWaalsContact O-N 3.1Å; D939-L941 PolarHBondContact O-N 3.29Å; L941-N943 PolarHBondContact O-N 2.88Å; L941-N945 HydrophobicContact CB-CB 4.46Å; L941-K946 HydrophobicContact CB-CB 4.13Å; L941-K946 HydrophobicContact CB-CG 4.44Å; L941-L949 HydrophobicContact CD1-CD2 3.68Å
942	P	91.8	Very high	92.4	Very high	77 Å²	77	33.6 Å²	33.6	50%	0.5	19%	0.192	S	C	.	.			trans	-53.8	140.1	170.4	-24.2	33.6	0	0	0	111.2	V944 N945 K946	P942-V944 VanDerWaalsContact C-N 3.25Å; P942-V944 PolarHBondContact O-N 3.38Å; P942-N945 WeakPolarHBondContact O-CA 3.35Å; P942-N945 WeakPolarHBondContact O-CB 3.27Å; P942-N945 PolarHBondContact O-N 2.91Å; P942-K946 WeakPolarHBondContact O-CB 3.45Å; P942-K946 PolarHBondContact O-N 3.35Å
943	N	89.9	Confident	92.6	Very high	73 Å²	73	27.4 Å²	27.4	39%	0.39	17%	0.168	S	C	.	.	H	α-helix	trans	-56	-36.3	-165.1	-162.9	57.2	0	0	0	114.3	E832 L941 K946 C947	E832-N943 PolarHBondContact OE1-ND2 3.28Å; E832-N943 PolarHBondContact OE2-ND2 2.83Å; L941-N943 PolarHBondContact O-N 2.88Å; N943-K946 WeakPolarHBondContact O-CB 3.48Å; N943-K946 PolarHBondContact O-N 2.7Å; N943-C947 WeakPolarHBondContact O-CB 3.36Å; N943-C947 PolarHBondContact O-N 3.3Å; N943-C947 PolarHBondContact O-SG 3.23Å
944	V	90.1	Very high	92.6	Very high	24 Å²	24	24.4 Å²	24.4	15%	0.145	15%	0.153	C	C	.	.	H	α-helix	trans	-69.2	-42.1	177.6	-169.8	0	0	0	0	112	L820 A821 V824 E832 P942 K946 T948	L820-V944 HydrophobicContact CD2-CG1 4.48Å; L820-V944 HydrophobicContact CG-CG1 3.91Å; A821-V944 HydrophobicContact CB-CB 4.38Å; A821-V944 HydrophobicContact CB-CG2 4.03Å; V824-V944 HydrophobicContact CB-CG1 3.92Å; V824-V944 HydrophobicContact CG1-CG1 4.37Å; V824-V944 HydrophobicContact CG2-CG1 3.5Å; E832-V944 WeakPolarHBondContact O-CG1 3.13Å; P942-V944 VanDerWaalsContact C-N 3.25Å; P942-V944 PolarHBondContact O-N 3.38Å; V944-K946 VanDerWaalsContact C-N 3.28Å; V944-K946 PolarHBondContact O-N 2.58Å; V944-T948 WeakPolarHBondContact O-CB 3.39Å; V944-T948 PolarHBondContact O-N 2.86Å; V944-T948 PolarHBondContact O-OG1 3.05Å
945	N	93.5	Very high	92.7	Very high	20 Å²	20	24.4 Å²	24.4	11%	0.107	15%	0.153	C	C	.	.	H	α-helix	trans	-60.3	-41.6	169.3	-66.9	59.4	0	0	0	110.7	L820 L906 L941 P942 T948 L949	L820-N945 HydrophobicContact CD2-CB 4.35Å; L906-N945 HydrophobicContact CD1-CB 4.29Å; L906-N945 PolarHBondContact O-ND2 2.83Å; L941-N945 HydrophobicContact CB-CB 4.46Å; P942-N945 WeakPolarHBondContact O-CA 3.35Å; P942-N945 WeakPolarHBondContact O-CB 3.27Å; P942-N945 PolarHBondContact O-N 2.91Å; N945-T948 PolarHBondContact O-N 2.85Å; N945-L949 VanDerWaalsContact O-CB 3.32Å; N945-L949 WeakPolarHBondContact O-CB 3.4Å; N945-L949 PolarHBondContact O-N 2.88Å
946	K	93.1	Very high	92.8	Very high	33 Å²	33	24.2 Å²	24.2	14%	0.143	15%	0.152	C	C	.	.	H	α-helix	trans	-62.2	-55.3	-178.1	-160.6	168.7	86.2	161.8	0	111.4	D939 L941 P942 N943 V944 T948 L949 I950 W1049	D939-K946 IonicContact OD1-NZ 2.62Å; D939-K946 PolarHBondContact OD1-NZ 2.92Å; L941-K946 HydrophobicContact CB-CB 4.13Å; L941-K946 HydrophobicContact CB-CG 4.44Å; P942-K946 WeakPolarHBondContact O-CB 3.45Å; P942-K946 PolarHBondContact O-N 3.35Å; N943-K946 WeakPolarHBondContact O-CB 3.48Å; N943-K946 PolarHBondContact O-N 2.7Å; V944-K946 VanDerWaalsContact C-N 3.28Å; V944-K946 PolarHBondContact O-N 2.58Å; K946-T948 VanDerWaalsContact C-N 3.35Å; K946-T948 PolarHBondContact O-N 2.85Å; K946-L949 WeakPolarHBondContact O-CB 2.96Å; K946-L949 PolarHBondContact O-N 3.32Å; K946-I950 WeakPolarHBondContact O-CG1 3.43Å; K946-I950 PolarHBondContact O-N 2.82Å; K946-I950 VanDerWaalsContact O-N 3.11Å; K946-W1049 HydrophobicContact CB-CZ3 4.38Å; K946-W1049 HydrophobicContact CD-CE3 4.19Å; K946-W1049 HydrophobicContact CD-CH2 3.75Å; K946-W1049 HydrophobicContact CD-CZ2 4.08Å; K946-W1049 HydrophobicContact CD-CZ3 3.84Å; K946-W1049 HydrophobicContact CG-CE3 3.76Å; K946-W1049 HydrophobicContact CG-CH2 3.38Å; K946-W1049 HydrophobicContact CG-CZ2 4.2Å; K946-W1049 HydrophobicContact CG-CZ3 3.13Å
947	C	92.7	Very high	92.8	Very high	23 Å²	23	24.6 Å²	24.6	16%	0.155	14%	0.144	C	C	.	.	H	α-helix	trans	-64.8	-36.4	177.6	-68.5	0	0	0	0	112.6	E832 V833 N943 I950 A951	E832-C947 HydrophobicContact CB-CB 4Å; E832-C947 PolarHBondContact OE2-SG 2.89Å; V833-C947 VanDerWaalsContact CG2-C 3.49Å; V833-C947 HydrophobicContact CG2-CB 3.87Å; N943-C947 WeakPolarHBondContact O-CB 3.36Å; N943-C947 PolarHBondContact O-N 3.3Å; N943-C947 PolarHBondContact O-SG 3.23Å; C947-I950 WeakPolarHBondContact O-CB 3.36Å; C947-I950 PolarHBondContact O-N 3.29Å; C947-A951 PolarHBondContact O-N 2.7Å; C947-A951 VanDerWaalsContact O-N 3.14Å
948	T	94.6	Very high	92.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65.4	-39.3	174.2	-60	0	0	0	0	111.4	L820 V833 W898 L906 V944 N945 K946 I950 A951 V952	L820-T948 HydrophobicContact CD2-CG2 4.42Å; V833-T948 HydrophobicContact CG1-CG2 4.31Å; W898-T948 HydrophobicContact CH2-CG2 3.9Å; W898-T948 HydrophobicContact CZ3-CG2 3.95Å; L906-T948 HydrophobicContact CD1-CG2 3.81Å; L906-T948 HydrophobicContact CD2-CG2 4.08Å; V944-T948 WeakPolarHBondContact O-CB 3.39Å; V944-T948 PolarHBondContact O-N 2.86Å; V944-T948 PolarHBondContact O-OG1 3.05Å; N945-T948 PolarHBondContact O-N 2.85Å; K946-T948 VanDerWaalsContact C-N 3.35Å; K946-T948 PolarHBondContact O-N 2.85Å; T948-I950 VanDerWaalsContact C-N 3.34Å; T948-I950 PolarHBondContact O-N 2.77Å; T948-A951 PolarHBondContact O-N 2.71Å; T948-V952 WeakPolarHBondContact O-CG2 3.39Å; T948-V952 PolarHBondContact O-N 2.86Å
949	L	95	Very high	92.6	Very high	3 Å²	3	25.1 Å²	25.1	2%	0.016	15%	0.146	C	C	.	.	H	α-helix	trans	-63.4	-38.2	174.7	-177.4	66.2	0	0	0	111.7	L906 I907 L938 L941 N945 K946 V952 M953	L906-L949 HydrophobicContact CD2-CB 4.07Å; L906-L949 HydrophobicContact CD2-CD1 4.03Å; L906-L949 HydrophobicContact CG-CB 4.41Å; I907-L949 HydrophobicContact CD1-CD1 3.98Å; I907-L949 HydrophobicContact CD1-CD2 3.87Å; I907-L949 HydrophobicContact CG1-CD1 4.25Å; I907-L949 HydrophobicContact CG1-CD2 3.97Å; L938-L949 HydrophobicContact CD2-CD2 4.04Å; L941-L949 HydrophobicContact CD1-CD2 3.68Å; N945-L949 VanDerWaalsContact O-CB 3.32Å; N945-L949 WeakPolarHBondContact O-CB 3.4Å; N945-L949 PolarHBondContact O-N 2.88Å; K946-L949 WeakPolarHBondContact O-CB 2.96Å; K946-L949 PolarHBondContact O-N 3.32Å; L949-V952 PolarHBondContact O-N 2.87Å; L949-M953 HydrophobicContact CD1-CG 3.69Å; L949-M953 HydrophobicContact CD1-SD 4.4Å; L949-M953 HydrophobicContact CG-CG 4.01Å; L949-M953 VanDerWaalsContact O-CB 3.28Å; L949-M953 WeakPolarHBondContact O-CB 3.44Å; L949-M953 WeakPolarHBondContact O-CG 3.05Å; L949-M953 PolarHBondContact O-N 2.84Å
950	I	92.8	Very high	92.6	Very high	27 Å²	27	24.5 Å²	24.5	14%	0.138	14%	0.143	C	C	.	.	H	α-helix	trans	-57.3	-51.1	171.9	-53.9	167.8	0	0	0	110.2	K946 C947 T948 V952 M953 D954 W1016 W1049	K946-I950 WeakPolarHBondContact O-CG1 3.43Å; K946-I950 PolarHBondContact O-N 2.82Å; K946-I950 VanDerWaalsContact O-N 3.11Å; C947-I950 WeakPolarHBondContact O-CB 3.36Å; C947-I950 PolarHBondContact O-N 3.29Å; T948-I950 VanDerWaalsContact C-N 3.34Å; T948-I950 PolarHBondContact O-N 2.77Å; I950-V952 VanDerWaalsContact C-N 3.33Å; I950-V952 PolarHBondContact O-N 3.05Å; I950-M953 PolarHBondContact O-N 3.42Å; I950-D954 VanDerWaalsContact O-CB 3.28Å; I950-D954 WeakPolarHBondContact O-CB 3.19Å; I950-D954 PolarHBondContact O-N 2.85Å; I950-W1016 HydrophobicContact CB-CZ2 4.5Å; I950-W1016 HydrophobicContact CG2-CZ2 4.42Å; I950-W1049 HydrophobicContact CD1-CE3 3.75Å; I950-W1049 HydrophobicContact CD1-CZ3 4.47Å; I950-W1049 HydrophobicContact CG1-CE3 3.53Å; I950-W1049 HydrophobicContact CG1-CZ3 3.9Å
951	A	93.2	Very high	92.5	Very high	18 Å²	18	23.2 Å²	23.2	15%	0.149	14%	0.135	C	C	.	.	H	α-helix	trans	-58.9	-44.5	-176.6	0	0	0	0	0	111.8	V833 I841 C947 T948 H955	V833-A951 HydrophobicContact CG1-CB 4.18Å; I841-A951 HydrophobicContact CD1-CB 4.3Å; C947-A951 PolarHBondContact O-N 2.7Å; C947-A951 VanDerWaalsContact O-N 3.14Å; T948-A951 PolarHBondContact O-N 2.71Å; A951-H955 WeakPolarHBondContact O-CB 3.37Å; A951-H955 PolarHBondContact O-N 2.79Å
952	V	95.6	Very high	91.9	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.8	-52.2	175.1	178	0	0	0	0	111.1	F895 L899 L906 T948 L949 I950 H955 L956 L981	F895-V952 HydrophobicContact CZ-CG1 4.46Å; F895-V952 HydrophobicContact CZ-CG2 4.1Å; L899-V952 HydrophobicContact CD1-CG1 4.5Å; L899-V952 HydrophobicContact CD2-CG2 4.17Å; L906-V952 HydrophobicContact CD2-CG2 4.21Å; T948-V952 WeakPolarHBondContact O-CG2 3.39Å; T948-V952 PolarHBondContact O-N 2.86Å; L949-V952 PolarHBondContact O-N 2.87Å; I950-V952 VanDerWaalsContact C-N 3.33Å; I950-V952 PolarHBondContact O-N 3.05Å; V952-H955 WeakPolarHBondContact O-CB 3.32Å; V952-H955 PolarHBondContact O-N 2.88Å; V952-L956 HydrophobicContact CG1-CD1 3.96Å; V952-L956 HydrophobicContact CG1-CG 4.18Å; V952-L956 VanDerWaalsContact O-CG 3.31Å; V952-L956 WeakPolarHBondContact O-CG 3.45Å; V952-L956 PolarHBondContact O-N 2.67Å; V952-L981 HydrophobicContact CG1-CD1 4.46Å; V952-L981 HydrophobicContact CG1-CD2 4.37Å
953	M	94.7	Very high	90.7	Very high	3 Å²	3	23.6 Å²	23.6	2%	0.015	13%	0.134	C	C	.	.	H	α-helix	trans	-69.7	-37.3	-172.1	-68.4	-68.7	-74.7	0	0	113.3	L949 I950 H955 L956 K957 M1009 V1012 L1013 W1016	L949-M953 HydrophobicContact CD1-CG 3.69Å; L949-M953 HydrophobicContact CD1-SD 4.4Å; L949-M953 HydrophobicContact CG-CG 4.01Å; L949-M953 VanDerWaalsContact O-CB 3.28Å; L949-M953 WeakPolarHBondContact O-CB 3.44Å; L949-M953 WeakPolarHBondContact O-CG 3.05Å; L949-M953 PolarHBondContact O-N 2.84Å; I950-M953 PolarHBondContact O-N 3.42Å; M953-H955 VanDerWaalsContact C-N 3.34Å; M953-L956 PolarHBondContact O-N 2.99Å; M953-L956 HydrophobicContact SD-CD1 4.38Å; M953-K957 WeakPolarHBondContact O-CB 3.47Å; M953-K957 PolarHBondContact O-N 2.91Å; M953-M1009 HydrophobicContact CE-CE 4.28Å; M953-M1009 HydrophobicContact SD-CE 3.51Å; M953-M1009 VanDerWaalsContact SD-CE 3.51Å; M953-M1009 HydrophobicContact SD-SD 4.26Å; M953-V1012 HydrophobicContact CE-CB 4.38Å; M953-V1012 HydrophobicContact CE-CG1 3.66Å; M953-L1013 HydrophobicContact CE-CD2 3.65Å; M953-L1013 HydrophobicContact CE-CG 3.88Å; M953-L1013 HydrophobicContact SD-CD2 4.2Å; M953-W1016 HydrophobicContact CB-CD2 3.66Å; M953-W1016 VanDerWaalsContact CB-CE2 3.42Å; M953-W1016 HydrophobicContact CB-CE3 3.9Å; M953-W1016 HydrophobicContact CB-CG 4.35Å; M953-W1016 HydrophobicContact CB-CH2 3.81Å; M953-W1016 HydrophobicContact CB-CZ2 3.55Å; M953-W1016 HydrophobicContact CB-CZ3 3.95Å; M953-W1016 HydrophobicContact CE-CD2 4.06Å; M953-W1016 HydrophobicContact CE-CE3 3.59Å; M953-W1016 HydrophobicContact CE-CG 4.48Å; M953-W1016 HydrophobicContact CE-CZ3 4.15Å; M953-W1016 HydrophobicContact CG-CD2 4.33Å; M953-W1016 HydrophobicContact CG-CE3 4.06Å; M953-W1016 HydrophobicContact CG-CH2 4.03Å; M953-W1016 HydrophobicContact CG-CZ2 4.29Å; M953-W1016 HydrophobicContact CG-CZ3 3.88Å
954	D	92.9	Very high	89.6	Confident	5 Å²	5	25.4 Å²	25.4	3%	0.027	15%	0.15	C	C	.	.	H	α-helix	trans	-59.3	-45.5	169.8	-84.7	10.5	0	0	0	110.8	I950 K957 N958 W1016 R1019 K1050	I950-D954 VanDerWaalsContact O-CB 3.28Å; I950-D954 WeakPolarHBondContact O-CB 3.19Å; I950-D954 PolarHBondContact O-N 2.85Å; D954-K957 WeakPolarHBondContact O-CB 3.4Å; D954-K957 PolarHBondContact O-N 3.23Å; D954-N958 VanDerWaalsContact O-CG 3.26Å; D954-N958 PolarHBondContact O-N 2.83Å; D954-N958 PolarHBondContact O-OD1 2.79Å; D954-W1016 PolarHBondContact OD1-NE1 2.68Å; D954-W1016 VanDerWaalsContact OD1-NE1 3.09Å; D954-R1019 IonicContact OD2-CZ 2.73Å; D954-R1019 IonicContact OD2-NE 2.7Å; D954-R1019 PolarHBondContact OD2-NE 2.83Å; D954-R1019 IonicContact OD2-NH2 2.79Å; D954-R1019 PolarHBondContact OD2-NH2 3Å; D954-R1019 VanDerWaalsContact OD2-NH2 3.09Å; D954-K1050 IonicContact OD2-NZ 3.13Å
955	H	94.1	Very high	88.2	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-63.4	-47.1	178	178.8	58.8	0	0	0	111.9	I841 E845 Y855 A951 V952 M953 K957 N958 V959	I841-H955 HydrophobicContact CD1-CB 4.17Å; I841-H955 HydrophobicContact CG1-CB 4.24Å; I841-H955 HydrophobicContact CG2-CB 3.89Å; E845-H955 VanDerWaalsContact CG-ND1 3.32Å; E845-H955 WeakPolarHBondContact CG-ND1 3.47Å; E845-H955 IonicContact OE1-CE1 3.63Å; E845-H955 IonicContact OE1-CG 2.74Å; E845-H955 IonicContact OE1-ND1 3.02Å; E845-H955 PolarHBondContact OE1-ND1 3.42Å; Y855-H955 AromaticContact CE2-NE2 3.7Å; Y855-H955 AromaticContact CZ-NE2 3.83Å; Y855-H955 PolarHBondContact OH-CD2 3.49Å; Y855-H955 PolarHBondContact OH-NE2 2.94Å; A951-H955 WeakPolarHBondContact O-CB 3.37Å; A951-H955 PolarHBondContact O-N 2.79Å; V952-H955 WeakPolarHBondContact O-CB 3.32Å; V952-H955 PolarHBondContact O-N 2.88Å; M953-H955 VanDerWaalsContact C-N 3.34Å; H955-K957 PolarHBondContact O-N 2.83Å; H955-N958 WeakPolarHBondContact O-CB 3.4Å; H955-N958 PolarHBondContact O-N 3.21Å; H955-V959 WeakPolarHBondContact O-CG2 3.27Å; H955-V959 PolarHBondContact O-N 3.42Å
956	L	94.5	Very high	87	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-58.8	-33.5	175.8	-66.6	-175	0	0	0	111.9	V952 M953 L960 L973 F977 M1009 L1013	V952-L956 HydrophobicContact CG1-CD1 3.96Å; V952-L956 HydrophobicContact CG1-CG 4.18Å; V952-L956 VanDerWaalsContact O-CG 3.31Å; V952-L956 WeakPolarHBondContact O-CG 3.45Å; V952-L956 PolarHBondContact O-N 2.67Å; M953-L956 PolarHBondContact O-N 2.99Å; M953-L956 HydrophobicContact SD-CD1 4.38Å; L956-L960 VanDerWaalsContact O-CG 3.3Å; L956-L960 WeakPolarHBondContact O-CG 3.36Å; L956-L960 PolarHBondContact O-N 2.93Å; L956-L960 VanDerWaalsContact O-N 3.11Å; L956-L973 HydrophobicContact CB-CD2 4Å; L956-L973 HydrophobicContact CD2-CD1 4.08Å; L956-L973 HydrophobicContact CD2-CD2 4.1Å; L956-L973 HydrophobicContact CD2-CG 4.36Å; L956-L973 HydrophobicContact CG-CD2 4.44Å; L956-F977 HydrophobicContact CD1-CB 4.12Å; L956-F977 HydrophobicContact CD1-CD1 4.05Å; L956-F977 HydrophobicContact CD1-CD2 4.38Å; L956-F977 HydrophobicContact CD1-CG 3.91Å; L956-F977 HydrophobicContact CD2-CD1 4.1Å; L956-F977 HydrophobicContact CD2-CD2 3.76Å; L956-F977 HydrophobicContact CD2-CE1 3.94Å; L956-F977 HydrophobicContact CD2-CE2 3.58Å; L956-F977 HydrophobicContact CD2-CG 4.01Å; L956-F977 HydrophobicContact CD2-CZ 3.67Å; L956-M1009 HydrophobicContact CD1-CE 3.57Å; L956-L1013 HydrophobicContact CB-CD2 4.35Å
957	K	91.3	Very high	86	Confident	41 Å²	41	30 Å²	30	18%	0.178	18%	0.183	C	C	.	.	H	α-helix	trans	-68.9	-43.5	171.1	-87.8	-79.3	176.5	160.3	0	113.4	M953 D954 H955 V959 L960 S961 L1013 W1016	M953-K957 WeakPolarHBondContact O-CB 3.47Å; M953-K957 PolarHBondContact O-N 2.91Å; D954-K957 WeakPolarHBondContact O-CB 3.4Å; D954-K957 PolarHBondContact O-N 3.23Å; H955-K957 PolarHBondContact O-N 2.83Å; K957-V959 VanDerWaalsContact C-N 3.33Å; K957-V959 PolarHBondContact O-N 3.17Å; K957-L960 PolarHBondContact O-N 2.89Å; K957-S961 PolarHBondContact O-N 2.78Å; K957-L1013 WeakPolarHBondContact CE-O 3.3Å; K957-L1013 HydrophobicContact CG-CD2 4.36Å; K957-L1013 PolarHBondContact NZ-O 3.43Å; K957-W1016 WeakPolarHBondContact CE-O 3.19Å; K957-W1016 PolarHBondContact NZ-O 3.14Å
958	N	91.5	Very high	85.5	Confident	30 Å²	30	29 Å²	29	16%	0.16	18%	0.176	C	C	.	.	H	α-helix	trans	-59.5	-45.3	175.4	-67.5	-15.8	0	0	0	110.8	E845 L849 D954 H955 L960 S961 R1019	E845-N958 PolarHBondContact OE1-ND2 2.89Å; L849-N958 HydrophobicContact CD1-CB 3.75Å; D954-N958 VanDerWaalsContact O-CG 3.26Å; D954-N958 PolarHBondContact O-N 2.83Å; D954-N958 PolarHBondContact O-OD1 2.79Å; H955-N958 WeakPolarHBondContact O-CB 3.4Å; H955-N958 PolarHBondContact O-N 3.21Å; N958-L960 PolarHBondContact O-N 3.03Å; N958-S961 WeakPolarHBondContact O-CB 3.1Å; N958-S961 PolarHBondContact O-N 2.93Å; N958-S961 VanDerWaalsContact O-N 3.15Å; N958-S961 PolarHBondContact O-OG 2.88Å; N958-R1019 WeakPolarHBondContact OD1-CB 3.45Å
959	V	91.1	Very high	85.2	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-58.8	-47.4	175.5	176.6	0	0	0	0	111	L849 L854 Y855 H955 K957 S961 Q962 A963 L968	L849-V959 HydrophobicContact CD1-CG2 4.34Å; L849-V959 HydrophobicContact CD2-CG2 4.02Å; L854-V959 HydrophobicContact CD2-CG1 4.12Å; L854-V959 HydrophobicContact CD2-CG2 4.21Å; Y855-V959 HydrophobicContact CE2-CG2 4.25Å; H955-V959 WeakPolarHBondContact O-CG2 3.27Å; H955-V959 PolarHBondContact O-N 3.42Å; K957-V959 VanDerWaalsContact C-N 3.33Å; K957-V959 PolarHBondContact O-N 3.17Å; V959-S961 PolarHBondContact O-N 3.38Å; V959-Q962 PolarHBondContact O-N 3.45Å; V959-A963 PolarHBondContact O-N 3.03Å; V959-L968 HydrophobicContact CG1-CD2 3.66Å
960	L	89.8	Confident	85	Confident	28 Å²	28	35.3 Å²	35.3	15%	0.147	22%	0.215	C	C	.	.	H	α-helix	trans	-65.5	-21.1	178.7	-73.3	172.2	0	0	0	113.9	L956 K957 N958 Q962 A963 V970 L973 L1013	L956-L960 VanDerWaalsContact O-CG 3.3Å; L956-L960 WeakPolarHBondContact O-CG 3.36Å; L956-L960 PolarHBondContact O-N 2.93Å; L956-L960 VanDerWaalsContact O-N 3.11Å; K957-L960 PolarHBondContact O-N 2.89Å; N958-L960 PolarHBondContact O-N 3.03Å; L960-Q962 PolarHBondContact O-N 3.04Å; L960-A963 VanDerWaalsContact O-CB 3.22Å; L960-A963 WeakPolarHBondContact O-CB 3.4Å; L960-A963 PolarHBondContact O-N 3.44Å; L960-V970 HydrophobicContact CD1-CG1 4.42Å; L960-V970 HydrophobicContact CD1-CG2 4.16Å; L960-V970 HydrophobicContact CD2-CB 4.47Å; L960-V970 HydrophobicContact CD2-CG2 3.98Å; L960-L973 HydrophobicContact CD1-CD2 3.66Å; L960-L973 HydrophobicContact CD2-CB 4.41Å; L960-L973 HydrophobicContact CD2-CD2 3.99Å; L960-L973 HydrophobicContact CG-CD2 3.69Å; L960-L1013 HydrophobicContact CD1-CD1 4.33Å
961	S	87.4	Confident	84.9	Confident	74 Å²	74	36.2 Å²	36.2	52%	0.517	23%	0.231	S	C	.	.	H	α-helix	trans	-65.3	-26.2	171.7	79.8	0	0	0	0	112.9	K957 N958 V959	K957-S961 PolarHBondContact O-N 2.78Å; N958-S961 WeakPolarHBondContact O-CB 3.1Å; N958-S961 PolarHBondContact O-N 2.93Å; N958-S961 VanDerWaalsContact O-N 3.15Å; N958-S961 PolarHBondContact O-OG 2.88Å; V959-S961 PolarHBondContact O-N 3.38Å
962	Q	81	Confident	84.8	Confident	69 Å²	69	39.1 Å²	39.1	32%	0.322	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	6.9	178.7	-52.9	-50.6	-56.3	0	0	113.1	L849 V959 L960 P964 H965 S966	L849-Q962 HydrophobicContact CB-CB 4.22Å; L849-Q962 HydrophobicContact CB-CG 3.85Å; V959-Q962 PolarHBondContact O-N 3.45Å; L960-Q962 PolarHBondContact O-N 3.04Å; Q962-P964 VanDerWaalsContact C-N 3.3Å; Q962-P964 VanDerWaalsContact O-N 3.15Å; Q962-H965 PolarHBondContact O-N 3.37Å; Q962-S966 PolarHBondContact O-N 3.32Å; Q962-S966 PolarHBondContact O-OG 3.17Å
963	A	67.1	Low	84.7	Confident	24 Å²	24	39.1 Å²	39.1	20%	0.198	24%	0.24	C	C	.	.	H	α-helix	trans	-48.9	-36.2	179.2	0	0	0	0	0	115.8	V959 L960 H965 G967 L968	V959-A963 PolarHBondContact O-N 3.03Å; L960-A963 VanDerWaalsContact O-CB 3.22Å; L960-A963 WeakPolarHBondContact O-CB 3.4Å; L960-A963 PolarHBondContact O-N 3.44Å; A963-H965 PolarHBondContact O-N 2.91Å; A963-H965 VanDerWaalsContact O-N 3.14Å; A963-G967 PolarHBondContact O-N 2.83Å; A963-G967 VanDerWaalsContact O-N 3.1Å; A963-L968 WeakPolarHBondContact CB-O 3.46Å
964	P	65.6	Low	84.7	Confident	111 Å²	111	39 Å²	39	72%	0.721	24%	0.24	S	C	*	.	H	α-helix	trans	-63.3	-14.3	176.4	-23.8	35.8	0	0	0	114.9	Q962	Q962-P964 VanDerWaalsContact C-N 3.3Å; Q962-P964 VanDerWaalsContact O-N 3.15Å
965	H	60.4	Low	84.7	Confident	121 Å²	121	42.1 Å²	42.1	56%	0.56	25%	0.251	S	S	*	.	H	α-helix	trans	-110.7	-39.1	-178.2	-59.1	-30.7	0	0	0	112.5	D850 Q962 A963	D850-H965 HydrophobicContact CB-CB 3.99Å; Q962-H965 PolarHBondContact O-N 3.37Å; A963-H965 PolarHBondContact O-N 2.91Å; A963-H965 VanDerWaalsContact O-N 3.14Å
966	S	68.9	Low	84.7	Confident	3 Å²	3	42.4 Å²	42.4	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-81.8	-14.3	178.4	59.2	0	0	0	0	114.5	S851 G853 Q962 L968	S851-S966 WeakPolarHBondContact O-CB 3.39Å; G853-S966 PolarHBondContact N-O 2.85Å; G853-S966 VanDerWaalsContact N-O 3.1Å; Q962-S966 PolarHBondContact O-N 3.32Å; Q962-S966 PolarHBondContact O-OG 3.17Å; S966-L968 VanDerWaalsContact C-N 3.31Å
967	G	71.9	Confident	84.7	Confident	51 Å²	51	42.4 Å²	42.4	53%	0.526	25%	0.253	S	S	.	.			trans	79.2	7.8	-178.2	0	0	0	0	0	114.8	A963 T969	A963-G967 PolarHBondContact O-N 2.83Å; A963-G967 VanDerWaalsContact O-N 3.1Å; G967-T969 PolarHBondContact O-N 3.18Å
968	L	83.1	Confident	84.9	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.01	24%	0.244	C	C	.	.			trans	-88.9	100.6	-173.3	-175.9	53.1	0	0	0	112.4	L854 V856 V959 A963 S966 K972 L973	L854-L968 WeakPolarHBondContact O-CD2 3.47Å; V856-L968 HydrophobicContact CG2-CD1 3.66Å; V959-L968 HydrophobicContact CG1-CD2 3.66Å; A963-L968 WeakPolarHBondContact CB-O 3.46Å; S966-L968 VanDerWaalsContact C-N 3.31Å; L968-K972 HydrophobicContact CD1-CB 4.02Å; L968-L973 HydrophobicContact CD1-CB 4.33Å; L968-L973 HydrophobicContact CD1-CD1 4.45Å; L968-L973 HydrophobicContact CD2-CD1 3.7Å; L968-L973 HydrophobicContact CG-CB 4.44Å; L968-L973 HydrophobicContact CG-CD1 4.29Å
969	T	88.1	Confident	84.9	Confident	75 Å²	75	39.1 Å²	39.1	46%	0.46	24%	0.237	S	C	.	.			trans	-76.5	153.1	176.4	74.7	0	0	0	0	112.1	G967 G971 K972 L973	G967-T969 PolarHBondContact O-N 3.18Å; T969-G971 PolarHBondContact O-N 2.86Å; T969-K972 PolarHBondContact O-N 2.91Å; T969-K972 PolarHBondContact OG1-N 3.38Å; T969-L973 PolarHBondContact O-N 3.47Å
970	V	90.8	Very high	85.1	Confident	59 Å²	59	39.4 Å²	39.4	36%	0.358	24%	0.238	S	C	.	.	H	α-helix	trans	-51.3	-42.2	174.6	-173.6	0	0	0	0	111.4	L960 L973 C974	L960-V970 HydrophobicContact CD1-CG1 4.42Å; L960-V970 HydrophobicContact CD1-CG2 4.16Å; L960-V970 HydrophobicContact CD2-CB 4.47Å; L960-V970 HydrophobicContact CD2-CG2 3.98Å; V970-L973 PolarHBondContact O-N 2.97Å; V970-C974 WeakPolarHBondContact O-CB 3.22Å; V970-C974 PolarHBondContact O-N 3.12Å; V970-C974 PolarHBondContact O-SG 2.94Å
971	G	91.2	Very high	85.3	Confident	46 Å²	46	38 Å²	38	47%	0.474	23%	0.231	S	C	.	.	H	α-helix	trans	-62.2	-42.8	178.3	0	0	0	0	0	113.5	T969 R975	T969-G971 PolarHBondContact O-N 2.86Å; G971-R975 VanDerWaalsContact O-CB 3.32Å; G971-R975 WeakPolarHBondContact O-CB 3.37Å; G971-R975 PolarHBondContact O-N 3.37Å
972	K	90.3	Very high	85.5	Confident	79 Å²	79	34.6 Å²	34.6	34%	0.343	21%	0.207	S	C	.	.	H	α-helix	trans	-66.1	-42.7	175.6	-68.4	-172.7	-168.2	-164.5	0	111.3	E699 L968 T969 R975 I976	E699-K972 WeakPolarHBondContact OE1-CE 3.49Å; E699-K972 IonicContact OE1-NZ 2.74Å; E699-K972 PolarHBondContact OE1-NZ 3.44Å; L968-K972 HydrophobicContact CD1-CB 4.02Å; T969-K972 PolarHBondContact O-N 2.91Å; T969-K972 PolarHBondContact OG1-N 3.38Å; K972-R975 PolarHBondContact O-N 3.36Å; K972-I976 WeakPolarHBondContact O-CD1 3.43Å; K972-I976 WeakPolarHBondContact O-CG1 3.21Å; K972-I976 PolarHBondContact O-N 2.97Å; K972-I976 VanDerWaalsContact O-N 3.17Å
973	L	93.4	Very high	85.8	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.5	-46.2	177.1	-167.7	78.8	0	0	0	112	L956 L960 L968 T969 V970 R975 I976 F977 L1013	L956-L973 HydrophobicContact CB-CD2 4Å; L956-L973 HydrophobicContact CD2-CD1 4.08Å; L956-L973 HydrophobicContact CD2-CD2 4.1Å; L956-L973 HydrophobicContact CD2-CG 4.36Å; L956-L973 HydrophobicContact CG-CD2 4.44Å; L960-L973 HydrophobicContact CD1-CD2 3.66Å; L960-L973 HydrophobicContact CD2-CB 4.41Å; L960-L973 HydrophobicContact CD2-CD2 3.99Å; L960-L973 HydrophobicContact CG-CD2 3.69Å; L968-L973 HydrophobicContact CD1-CB 4.33Å; L968-L973 HydrophobicContact CD1-CD1 4.45Å; L968-L973 HydrophobicContact CD2-CD1 3.7Å; L968-L973 HydrophobicContact CG-CB 4.44Å; L968-L973 HydrophobicContact CG-CD1 4.29Å; T969-L973 PolarHBondContact O-N 3.47Å; V970-L973 PolarHBondContact O-N 2.97Å; L973-R975 VanDerWaalsContact C-N 3.35Å; L973-R975 PolarHBondContact O-N 3.35Å; L973-I976 PolarHBondContact O-N 2.84Å; L973-F977 HydrophobicContact CD1-CD2 3.68Å; L973-F977 HydrophobicContact CD1-CE2 3.74Å; L973-F977 HydrophobicContact CG-CD2 3.97Å; L973-F977 PolarHBondContact O-N 3.32Å; L973-L1013 HydrophobicContact CD2-CD1 4.45Å
974	C	95.4	Very high	86.5	Confident	2 Å²	2	30.3 Å²	30.3	1%	0.014	18%	0.183	C	C	.	.	H	α-helix	trans	-61.5	-41.5	177	-68.6	0	0	0	0	112.3	V970 I976 F977 A978 T1006 M1009 G1010	V970-C974 WeakPolarHBondContact O-CB 3.22Å; V970-C974 PolarHBondContact O-N 3.12Å; V970-C974 PolarHBondContact O-SG 2.94Å; C974-I976 PolarHBondContact O-N 3.21Å; C974-F977 PolarHBondContact O-N 3.31Å; C974-A978 WeakPolarHBondContact O-CB 3.45Å; C974-A978 PolarHBondContact O-N 3.23Å; C974-T1006 HydrophobicContact CB-CG2 3.73Å; C974-M1009 HydrophobicContact CB-CB 4.2Å; C974-M1009 HydrophobicContact CB-CG 4.16Å; C974-G1010 VanDerWaalsContact SG-CA 3.53Å; C974-G1010 PolarHBondContact SG-N 2.66Å; C974-G1010 VanDerWaalsContact SG-N 3.45Å
975	R	92.3	Very high	87	Confident	69 Å²	69	27 Å²	27	26%	0.26	16%	0.162	S	C	.	.	H	α-helix	trans	-60.7	-31.7	177.2	179.5	169.2	173.2	179.6	-4.1	112.2	W724 G971 K972 L973 T1006	W724-R975 HydrophobicContact CD2-CG 3.71Å; W724-R975 VanDerWaalsContact CD2-NE 3.34Å; W724-R975 VanDerWaalsContact CE2-CG 3.42Å; W724-R975 VanDerWaalsContact CE2-O 3.3Å; W724-R975 HydrophobicContact CE3-CG 4.27Å; W724-R975 HydrophobicContact CG-CG 4.03Å; W724-R975 HydrophobicContact CH2-CG 4.39Å; W724-R975 HydrophobicContact CZ2-CG 3.82Å; W724-R975 WeakPolarHBondContact CZ2-O 3.49Å; W724-R975 PolarHBondContact NE1-O 3.12Å; W724-R975 PolarHBondContact O-NH2 3.25Å; W724-R975 VanDerWaalsContact O-NH2 3.14Å; G971-R975 VanDerWaalsContact O-CB 3.32Å; G971-R975 WeakPolarHBondContact O-CB 3.37Å; G971-R975 PolarHBondContact O-N 3.37Å; K972-R975 PolarHBondContact O-N 3.36Å; L973-R975 VanDerWaalsContact C-N 3.35Å; L973-R975 PolarHBondContact O-N 3.35Å; R975-T1006 HydrophobicContact CB-CG2 4.47Å
976	I	93.1	Very high	87.3	Confident	7 Å²	7	22.7 Å²	22.7	4%	0.036	15%	0.145	C	C	.	.	H	α-helix	trans	-79.5	-53.1	173.9	-65.2	161.8	0	0	0	111.8	W724 V856 K896 K972 L973 C974 L980	W724-I976 HydrophobicContact CH2-CG1 3.92Å; W724-I976 HydrophobicContact CZ2-CG1 4.14Å; V856-I976 HydrophobicContact CG2-CD1 3.99Å; K896-I976 HydrophobicContact CD-CG2 3.56Å; K972-I976 WeakPolarHBondContact O-CD1 3.43Å; K972-I976 WeakPolarHBondContact O-CG1 3.21Å; K972-I976 PolarHBondContact O-N 2.97Å; K972-I976 VanDerWaalsContact O-N 3.17Å; L973-I976 PolarHBondContact O-N 2.84Å; C974-I976 PolarHBondContact O-N 3.21Å; I976-L980 WeakPolarHBondContact O-CG 3.47Å
977	F	95.9	Very high	86.7	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-88.1	-25.9	-167.3	-84.1	-84.8	0	0	0	115.6	Y855 F895 K896 L899 L956 L973 C974 L980 L981 M1009	Y855-F977 AromaticContact CD1-CE2 3.79Å; Y855-F977 HydrophobicContact CD1-CE2 3.79Å; Y855-F977 AromaticContact CD1-CZ 3.54Å; Y855-F977 HydrophobicContact CD1-CZ 3.54Å; Y855-F977 HydrophobicContact CD2-CE2 4.12Å; Y855-F977 HydrophobicContact CD2-CZ 4.32Å; Y855-F977 HydrophobicContact CE1-CE2 4.27Å; Y855-F977 AromaticContact CE1-CZ 3.6Å; Y855-F977 HydrophobicContact CE1-CZ 3.6Å; Y855-F977 HydrophobicContact CE2-CZ 4.33Å; Y855-F977 AromaticContact CG-CE2 3.73Å; Y855-F977 HydrophobicContact CG-CE2 3.73Å; Y855-F977 AromaticContact CG-CZ 3.94Å; Y855-F977 HydrophobicContact CG-CZ 3.94Å; Y855-F977 AromaticContact CZ-CZ 3.99Å; F895-F977 HydrophobicContact CD1-CE1 4.06Å; F895-F977 HydrophobicContact CD1-CZ 4.18Å; F895-F977 AromaticContact CE1-CE1 3.77Å; F895-F977 HydrophobicContact CE1-CE1 3.77Å; F895-F977 HydrophobicContact CE1-CZ 4.11Å; K896-F977 HydrophobicContact CG-CZ 4.37Å; L899-F977 HydrophobicContact CD1-CD1 3.85Å; L899-F977 HydrophobicContact CD1-CE1 3.65Å; L956-F977 HydrophobicContact CD1-CB 4.12Å; L956-F977 HydrophobicContact CD1-CD1 4.05Å; L956-F977 HydrophobicContact CD1-CD2 4.38Å; L956-F977 HydrophobicContact CD1-CG 3.91Å; L956-F977 HydrophobicContact CD2-CD1 4.1Å; L956-F977 HydrophobicContact CD2-CD2 3.76Å; L956-F977 HydrophobicContact CD2-CE1 3.94Å; L956-F977 HydrophobicContact CD2-CE2 3.58Å; L956-F977 HydrophobicContact CD2-CG 4.01Å; L956-F977 HydrophobicContact CD2-CZ 3.67Å; L973-F977 HydrophobicContact CD1-CD2 3.68Å; L973-F977 HydrophobicContact CD1-CE2 3.74Å; L973-F977 HydrophobicContact CG-CD2 3.97Å; L973-F977 PolarHBondContact O-N 3.32Å; C974-F977 PolarHBondContact O-N 3.31Å; F977-L980 HydrophobicContact CD1-CD1 4.02Å; F977-L980 HydrophobicContact CE1-CD1 4.24Å; F977-L980 WeakPolarHBondContact O-CB 3.48Å; F977-L980 PolarHBondContact O-N 3.46Å; F977-L981 HydrophobicContact CB-CD1 4.43Å; F977-L981 WeakPolarHBondContact O-CG 3.36Å; F977-L981 PolarHBondContact O-N 3.01Å; F977-L981 VanDerWaalsContact O-N 3.1Å; F977-M1009 HydrophobicContact CB-CE 4.19Å
978	A	95.5	Very high	85.6	Confident	0 Å²	0	27 Å²	27	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.9	-44	-179.2	0	0	0	0	0	112.8	C974 L980 L981 F982 A1005 M1009	C974-A978 WeakPolarHBondContact O-CB 3.45Å; C974-A978 PolarHBondContact O-N 3.23Å; A978-L980 VanDerWaalsContact C-N 3.32Å; A978-L980 PolarHBondContact O-N 2.9Å; A978-L981 PolarHBondContact O-N 3.02Å; A978-F982 HydrophobicContact CB-CD2 4Å; A978-F982 HydrophobicContact CB-CE2 4.24Å; A978-F982 VanDerWaalsContact O-CD2 3.22Å; A978-F982 WeakPolarHBondContact O-CD2 3.18Å; A978-F982 PolarHBondContact O-N 3.41Å; A978-A1005 VanDerWaalsContact CB-C 3.44Å; A978-A1005 HydrophobicContact CB-CB 3.83Å; A978-A1005 WeakPolarHBondContact CB-O 3.46Å; A978-M1009 HydrophobicContact CB-CB 3.63Å; A978-M1009 HydrophobicContact CB-CG 4.03Å
979	P	91.9	Very high	83.6	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.013	20%	0.197	C	C	.	.	H	α-helix	trans	-59.6	-41.3	174.6	-26.2	38	0	0	0	113	Y792 L981 C983 N1002	Y792-P979 HydrophobicContact CE1-CB 4.12Å; Y792-P979 WeakPolarHBondContact CE1-O 3.49Å; Y792-P979 HydrophobicContact CE2-CB 3.89Å; Y792-P979 WeakPolarHBondContact OH-CB 3.12Å; P979-L981 VanDerWaalsContact C-N 3.27Å; P979-L981 PolarHBondContact O-N 3.48Å; P979-C983 HydrophobicContact CB-CB 4.5Å; P979-C983 VanDerWaalsContact O-CB 3.29Å; P979-C983 WeakPolarHBondContact O-CB 3.45Å; P979-C983 PolarHBondContact O-N 3.18Å; P979-N1002 WeakPolarHBondContact CG-ND2 3.45Å
980	L	93.3	Very high	81.6	Confident	5 Å²	5	31 Å²	31	3%	0.026	19%	0.192	C	C	.	.	H	α-helix	trans	-61.9	-34.5	178.8	-57.5	177.4	0	0	0	112.6	Y792 R794 K896 L899 C900 I976 F977 A978	Y792-L980 HydrophobicContact CE1-CD2 4.29Å; R794-L980 PolarHBondContact NH2-O 3.12Å; K896-L980 HydrophobicContact CB-CD1 3.89Å; K896-L980 HydrophobicContact CD-CD1 4.3Å; K896-L980 HydrophobicContact CG-CD1 3.84Å; L899-L980 HydrophobicContact CB-CB 3.77Å; L899-L980 HydrophobicContact CB-CD1 4.48Å; L899-L980 HydrophobicContact CD1-CB 4.47Å; L899-L980 HydrophobicContact CD1-CD1 4.44Å; C900-L980 HydrophobicContact CB-CD2 3.82Å; I976-L980 WeakPolarHBondContact O-CG 3.47Å; F977-L980 HydrophobicContact CD1-CD1 4.02Å; F977-L980 HydrophobicContact CE1-CD1 4.24Å; F977-L980 WeakPolarHBondContact O-CB 3.48Å; F977-L980 PolarHBondContact O-N 3.46Å; A978-L980 VanDerWaalsContact C-N 3.32Å; A978-L980 PolarHBondContact O-N 2.9Å
981	L	94.9	Very high	79.4	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-95	-29.2	-173.6	-66.7	173.7	0	0	0	115.1	L899 P905 L906 I907 V952 F977 A978 P979 M1009	L899-L981 HydrophobicContact CD1-CD2 4.35Å; L899-L981 HydrophobicContact CD2-CD2 3.99Å; P905-L981 WeakPolarHBondContact CB-O 2.97Å; L906-L981 HydrophobicContact CB-CD2 3.92Å; L906-L981 HydrophobicContact CD2-CD2 3.72Å; L906-L981 HydrophobicContact CG-CD2 4.44Å; L906-L981 PolarHBondContact N-O 2.86Å; I907-L981 PolarHBondContact N-O 2.94Å; V952-L981 HydrophobicContact CG1-CD1 4.46Å; V952-L981 HydrophobicContact CG1-CD2 4.37Å; F977-L981 HydrophobicContact CB-CD1 4.43Å; F977-L981 WeakPolarHBondContact O-CG 3.36Å; F977-L981 PolarHBondContact O-N 3.01Å; F977-L981 VanDerWaalsContact O-N 3.1Å; A978-L981 PolarHBondContact O-N 3.02Å; P979-L981 VanDerWaalsContact C-N 3.27Å; P979-L981 PolarHBondContact O-N 3.48Å; L981-M1009 HydrophobicContact CD1-CE 3.47Å; L981-M1009 VanDerWaalsContact CD1-CE 3.47Å; L981-M1009 HydrophobicContact CD1-SD 3.95Å
982	F	92.1	Very high	77.2	Confident	1 Å²	1	42 Å²	42	0%	0.004	23%	0.228	C	C	.	.	H	α-helix	trans	-115.4	-30.6	-174.6	-59.7	-71.7	0	0	0	114.5	I907 Y912 L915 A978 A1005 L1008 M1009	I907-F982 HydrophobicContact CB-CD1 4.12Å; I907-F982 HydrophobicContact CB-CE1 4.26Å; I907-F982 HydrophobicContact CD1-CD1 4Å; I907-F982 HydrophobicContact CD1-CE1 3.33Å; I907-F982 HydrophobicContact CD1-CZ 3.85Å; I907-F982 HydrophobicContact CG1-CE1 4.36Å; I907-F982 HydrophobicContact CG2-CD1 4.12Å; I907-F982 HydrophobicContact CG2-CE1 4.17Å; Y912-F982 HydrophobicContact CD1-CB 3.91Å; Y912-F982 WeakPolarHBondContact CD1-O 3.41Å; Y912-F982 HydrophobicContact CD2-CB 3.97Å; Y912-F982 AromaticContact CD2-CD1 3.46Å; Y912-F982 HydrophobicContact CD2-CD1 3.46Å; Y912-F982 VanDerWaalsContact CD2-CD1 3.46Å; Y912-F982 HydrophobicContact CD2-CE1 4.2Å; Y912-F982 AromaticContact CD2-CG 3.92Å; Y912-F982 HydrophobicContact CD2-CG 3.92Å; Y912-F982 HydrophobicContact CE1-CB 3.8Å; Y912-F982 HydrophobicContact CE2-CB 3.86Å; Y912-F982 AromaticContact CE2-CD1 3.88Å; Y912-F982 HydrophobicContact CE2-CD1 3.88Å; Y912-F982 AromaticContact CE2-CG 3.9Å; Y912-F982 HydrophobicContact CE2-CG 3.9Å; Y912-F982 HydrophobicContact CG-CB 4.01Å; Y912-F982 AromaticContact CG-CD1 3.93Å; Y912-F982 HydrophobicContact CG-CD1 3.93Å; Y912-F982 HydrophobicContact CG-CG 4.36Å; L915-F982 HydrophobicContact CD2-CE1 3.79Å; L915-F982 HydrophobicContact CD2-CZ 4.43Å; A978-F982 HydrophobicContact CB-CD2 4Å; A978-F982 HydrophobicContact CB-CE2 4.24Å; A978-F982 VanDerWaalsContact O-CD2 3.22Å; A978-F982 WeakPolarHBondContact O-CD2 3.18Å; A978-F982 PolarHBondContact O-N 3.41Å; F982-A1005 HydrophobicContact CD2-CB 4.34Å; F982-L1008 HydrophobicContact CE1-CD2 4.06Å; F982-L1008 HydrophobicContact CZ-CD2 4.24Å; F982-L1008 HydrophobicContact CZ-CG 4.5Å; F982-M1009 HydrophobicContact CE2-CB 3.96Å; F982-M1009 HydrophobicContact CE2-CG 4.42Å; F982-M1009 HydrophobicContact CE2-SD 3.8Å; F982-M1009 HydrophobicContact CZ-SD 4.26Å
983	C	86.4	Confident	75.2	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.258	C	S	.	.			trans	-83.7	140	-165.1	-70.6	0	0	0	0	113.8	Y792 R794 P979 L999 L1000	Y792-C983 HydrophobicContact CD1-CB 4.15Å; Y792-C983 HydrophobicContact CD2-CB 4.2Å; Y792-C983 HydrophobicContact CG-CB 3.9Å; R794-C983 PolarHBondContact NE-O 2.85Å; R794-C983 PolarHBondContact NH2-O 3.04Å; P979-C983 HydrophobicContact CB-CB 4.5Å; P979-C983 VanDerWaalsContact O-CB 3.29Å; P979-C983 WeakPolarHBondContact O-CB 3.45Å; P979-C983 PolarHBondContact O-N 3.18Å; C983-L999 PolarHBondContact SG-O 2.91Å; C983-L1000 HydrophobicContact CB-CD2 4.23Å
984	T	82	Confident	73.1	Confident	4 Å²	4	53.4 Å²	53.4	3%	0.025	29%	0.289	C	S	.	.			trans	-142.1	147.6	164.7	178.8	0	0	0	0	109	Y792 S909 V986 L999 L1000	Y792-T984 CarbonylContact O-C 3.57Å; Y792-T984 VanDerWaalsContact O-CA 3.25Å; Y792-T984 WeakPolarHBondContact O-CA 3.38Å; S909-T984 WeakPolarHBondContact OG-CG2 3.28Å; T984-V986 WeakPolarHBondContact CG2-O 3.42Å; T984-V986 PolarHBondContact OG1-N 2.89Å; T984-V986 PolarHBondContact OG1-O 3.19Å; T984-L999 HydrophobicContact CG2-CB 4.29Å; T984-L999 HydrophobicContact CG2-CD1 3.87Å; T984-L999 WeakPolarHBondContact O-CB 3.32Å; T984-L1000 WeakPolarHBondContact O-CD2 3.42Å
985	S	76	Confident	71.1	Confident	40 Å²	40	56.1 Å²	56.1	28%	0.28	31%	0.306	S	S	.	.	S	Bend	trans	-94.3	-2	166.9	74.1	0	0	0	0	113	L789 Y792 R793	L789-S985 WeakPolarHBondContact O-CB 3.45Å; L789-S985 PolarHBondContact O-OG 2.99Å; Y792-S985 PolarHBondContact O-N 2.78Å; R793-S985 WeakPolarHBondContact CA-OG 3.27Å
986	V	66.7	Low	69.8	Low	31 Å²	31	58 Å²	58	19%	0.188	33%	0.325	C	S	.	.	S	Bend	trans	-114.8	115.3	-179.7	179.3	0	0	0	0	109.7	R793 Q795 T984 T988	R793-V986 HydrophobicContact CG-CG2 3.88Å; R793-V986 VanDerWaalsContact O-CG2 3.25Å; R793-V986 WeakPolarHBondContact O-CG2 3.21Å; Q795-V986 HydrophobicContact CG-CG2 4.02Å; T984-V986 WeakPolarHBondContact CG2-O 3.42Å; T984-V986 PolarHBondContact OG1-N 2.89Å; T984-V986 PolarHBondContact OG1-O 3.19Å; V986-T988 HydrophobicContact CG1-CG2 4.02Å; V986-T988 PolarHBondContact O-N 3.48Å
987	A	55.7	Low	69	Low	61 Å²	61	58 Å²	58	50%	0.504	33%	0.325	S	S	.	.			trans	-77.2	83	175	0	0	0	0	0	110.7	C989 L990	A987-C989 VanDerWaalsContact C-N 3.32Å; A987-C989 PolarHBondContact O-N 3.34Å; A987-L990 HydrophobicContact CB-CB 4.4Å; A987-L990 HydrophobicContact CB-CD1 3.91Å
988	T	49.5	Very low	68.5	Low	85 Å²	85	62.9 Å²	62.9	52%	0.521	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-23.1	-172.9	49.4	0	0	0	0	115	V986	V986-T988 HydrophobicContact CG1-CG2 4.02Å; V986-T988 PolarHBondContact O-N 3.48Å
989	C	41.8	Very low	67.9	Low	94 Å²	94	63.6 Å²	63.6	64%	0.635	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136	38.2	-167.5	-155.1	0	0	0	0	114.2	A987	A987-C989 VanDerWaalsContact C-N 3.32Å; A987-C989 PolarHBondContact O-N 3.34Å
990	L	44.7	Very low	67.6	Low	65 Å²	65	65 Å²	65	34%	0.34	36%	0.362	S	S	.	.			trans	-131.4	81.5	-171.2	-69.2	162.7	0	0	0	112.4	A987 T995	A987-L990 HydrophobicContact CB-CB 4.4Å; A987-L990 HydrophobicContact CB-CD1 3.91Å; L990-T995 HydrophobicContact CD1-CG2 3.69Å; L990-T995 VanDerWaalsContact CD1-OG1 3.3Å; L990-T995 WeakPolarHBondContact CD1-OG1 3.33Å; L990-T995 WeakPolarHBondContact CD2-OG1 3.47Å
991	K	45.7	Very low	67.4	Low	210 Å²	210	67.5 Å²	67.5	91%	0.913	38%	0.376	S	S	*	.			trans	-80.7	-20.6	165.3	-76.2	-176.7	176.9	176.1	0	112.6
992	D	44.2	Very low	67	Low	128 Å²	128	68.3 Å²	68.3	68%	0.684	38%	0.38	S	S	*	.	S	Bend	trans	-83.8	134.6	177.6	-66.6	-56.6	0	0	0	111.9	S994	D992-S994 PolarHBondContact O-N 3.11Å
993	K	49	Very low	67	Low	224 Å²	224	74.4 Å²	74.4	97%	0.974	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	18.6	-172.9	-58.1	177.2	-177.8	175.2	0	113.9
994	S	49.3	Very low	67.2	Low	94 Å²	94	75.7 Å²	75.7	66%	0.657	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	12.8	-165.5	-162.9	0	0	0	0	114.6	D992 T996	D992-S994 PolarHBondContact O-N 3.11Å; S994-T996 PolarHBondContact O-N 2.95Å
995	T	53.4	Low	67.7	Low	58 Å²	58	75.5 Å²	75.5	36%	0.356	41%	0.412	S	S	.	.			trans	-75.6	89.6	-180	-44.3	0	0	0	0	110.3	L990	L990-T995 HydrophobicContact CD1-CG2 3.69Å; L990-T995 VanDerWaalsContact CD1-OG1 3.3Å; L990-T995 WeakPolarHBondContact CD1-OG1 3.33Å; L990-T995 WeakPolarHBondContact CD2-OG1 3.47Å
996	T	64.9	Low	68.6	Low	108 Å²	108	75 Å²	75	66%	0.663	41%	0.407	S	S	*	.			trans	-86.9	-13.5	-178.1	58.3	0	0	0	0	114	S994	S994-T996 PolarHBondContact O-N 2.95Å
997	I	76.5	Confident	69.8	Low	9 Å²	9	77 Å²	77	5%	0.046	41%	0.411	C	S	.	.	S	Bend	trans	-104	126.3	-176.7	-58.9	149.1	0	0	0	110	Q913 V916 L999 L1004	Q913-I997 PolarHBondContact NE2-O 2.99Å; V916-I997 HydrophobicContact CB-CD1 3.79Å; V916-I997 HydrophobicContact CG1-CD1 3.48Å; V916-I997 VanDerWaalsContact CG1-CD1 3.48Å; V916-I997 HydrophobicContact CG1-CG1 4.11Å; I997-L999 PolarHBondContact O-N 3.28Å; I997-L1004 HydrophobicContact CG2-CD1 4.17Å; I997-L1004 HydrophobicContact CG2-CD2 4.16Å
998	N	84.3	Confident	71.6	Confident	101 Å²	101	74.1 Å²	74.1	54%	0.54	39%	0.387	S	S	.	.			trans	-67.3	113.5	171.5	176.7	11.7	0	0	0	110.5	L1000 D1001	N998-L1000 PolarHBondContact O-N 2.95Å; N998-L1000 VanDerWaalsContact O-N 3.11Å; N998-L1000 PolarHBondContact OD1-N 2.91Å; N998-D1001 HydrophobicContact CB-CB 4.28Å; N998-D1001 WeakPolarHBondContact O-CB 3.17Å; N998-D1001 PolarHBondContact O-N 3.26Å
999	L	84.2	Confident	73.8	Confident	15 Å²	15	70.1 Å²	70.1	8%	0.079	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-14.9	179	-69	166.9	0	0	0	113.8	Y912 Q913 C983 T984 I997	Y912-L999 HydrophobicContact CD1-CD2 3.64Å; Y912-L999 HydrophobicContact CE1-CD2 4.02Å; Q913-L999 HydrophobicContact CG-CD2 4.43Å; Q913-L999 VanDerWaalsContact NE2-CD2 3.26Å; C983-L999 PolarHBondContact SG-O 2.91Å; T984-L999 HydrophobicContact CG2-CB 4.29Å; T984-L999 HydrophobicContact CG2-CD1 3.87Å; T984-L999 WeakPolarHBondContact O-CB 3.32Å; I997-L999 PolarHBondContact O-N 3.28Å
1000	L	86.2	Confident	76.3	Confident	32 Å²	32	66.2 Å²	66.2	17%	0.168	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	11.2	173.6	-61.6	179.3	0	0	0	113.9	M788 L789 Y792 C983 T984 N998 N1002	M788-L1000 HydrophobicContact CE-CB 4.2Å; M788-L1000 WeakPolarHBondContact CE-O 3.38Å; L789-L1000 HydrophobicContact CB-CD1 4.08Å; L789-L1000 HydrophobicContact CD1-CD1 4.5Å; L789-L1000 HydrophobicContact CG-CD1 4.45Å; Y792-L1000 HydrophobicContact CD2-CD2 4.39Å; C983-L1000 HydrophobicContact CB-CD2 4.23Å; T984-L1000 WeakPolarHBondContact O-CD2 3.42Å; N998-L1000 PolarHBondContact O-N 2.95Å; N998-L1000 VanDerWaalsContact O-N 3.11Å; N998-L1000 PolarHBondContact OD1-N 2.91Å; L1000-N1002 PolarHBondContact O-N 2.84Å
1001	D	88.4	Confident	78.5	Confident	58 Å²	58	65 Å²	65	31%	0.31	33%	0.333	S	S	.	.			trans	-72.6	93.9	173.4	-172.1	-18.6	0	0	0	110.9	N998 K1003 L1004 A1005	N998-D1001 HydrophobicContact CB-CB 4.28Å; N998-D1001 WeakPolarHBondContact O-CB 3.17Å; N998-D1001 PolarHBondContact O-N 3.26Å; D1001-K1003 VanDerWaalsContact C-N 3.27Å; D1001-K1003 PolarHBondContact O-N 3.32Å; D1001-K1003 PolarHBondContact OD1-N 3.19Å; D1001-L1004 HydrophobicContact CB-CB 3.89Å; D1001-L1004 VanDerWaalsContact CG-CB 3.42Å; D1001-L1004 PolarHBondContact O-N 3.41Å; D1001-L1004 PolarHBondContact OD1-N 3Å; D1001-A1005 WeakPolarHBondContact O-CB 3.46Å; D1001-A1005 PolarHBondContact O-N 2.92Å
1002	N	87.1	Confident	80.8	Confident	16 Å²	16	55.1 Å²	55.1	9%	0.086	29%	0.291	C	S	.	.	H	α-helix	trans	-61.5	-32.2	179.2	-157.6	-51.8	0	0	0	112.7	W724 M788 P979 L1000 T1006	W724-N1002 PolarHBondContact NE1-ND2 3.18Å; M788-N1002 HydrophobicContact CE-CB 3.85Å; M788-N1002 HydrophobicContact SD-CB 4.38Å; M788-N1002 PolarHBondContact SD-ND2 3.15Å; P979-N1002 WeakPolarHBondContact CG-ND2 3.45Å; L1000-N1002 PolarHBondContact O-N 2.84Å; N1002-T1006 WeakPolarHBondContact O-CB 3.37Å; N1002-T1006 PolarHBondContact O-N 3.05Å; N1002-T1006 PolarHBondContact O-OG1 2.87Å; N1002-T1006 PolarHBondContact OD1-OG1 2.86Å
1003	K	90.4	Very high	83	Confident	129 Å²	129	49.1 Å²	49.1	56%	0.561	26%	0.259	S	S	*	.	H	α-helix	trans	-75.3	-41.2	-178.5	-64.1	-178.4	-176.9	177.5	0	110.5	E725 D1001 R1007	E725-K1003 WeakPolarHBondContact OE1-CE 3.16Å; E725-K1003 IonicContact OE1-NZ 2.81Å; E725-K1003 PolarHBondContact OE1-NZ 3.06Å; E725-K1003 IonicContact OE2-NZ 2.8Å; D1001-K1003 VanDerWaalsContact C-N 3.27Å; D1001-K1003 PolarHBondContact O-N 3.32Å; D1001-K1003 PolarHBondContact OD1-N 3.19Å; K1003-R1007 VanDerWaalsContact O-CG 3.29Å; K1003-R1007 WeakPolarHBondContact O-CG 3.02Å; K1003-R1007 PolarHBondContact O-N 3.4Å; K1003-R1007 VanDerWaalsContact O-N 3.17Å
1004	L	92	Very high	85	Confident	27 Å²	27	43.2 Å²	43.2	14%	0.141	24%	0.238	C	C	.	.	H	α-helix	trans	-64.1	-47.2	171.7	-175.5	147.6	0	0	0	111.2	Y912 V916 I997 D1001 T1006 R1007 L1008	Y912-L1004 HydrophobicContact CE2-CD2 4.23Å; Y912-L1004 WeakPolarHBondContact OH-CD2 3.36Å; V916-L1004 HydrophobicContact CG1-CD1 4.27Å; V916-L1004 HydrophobicContact CG1-CD2 4.15Å; V916-L1004 HydrophobicContact CG2-CD2 3.61Å; I997-L1004 HydrophobicContact CG2-CD1 4.17Å; I997-L1004 HydrophobicContact CG2-CD2 4.16Å; D1001-L1004 HydrophobicContact CB-CB 3.89Å; D1001-L1004 VanDerWaalsContact CG-CB 3.42Å; D1001-L1004 PolarHBondContact O-N 3.41Å; D1001-L1004 PolarHBondContact OD1-N 3Å; L1004-T1006 PolarHBondContact O-N 2.86Å; L1004-R1007 PolarHBondContact O-N 2.6Å; L1004-L1008 PolarHBondContact O-N 2.78Å
1005	A	92.8	Very high	86.9	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-57	-48.2	175.6	0	0	0	0	0	112	Y912 A978 F982 D1001 R1007 L1008 M1009	Y912-A1005 WeakPolarHBondContact OH-CB 3.33Å; A978-A1005 VanDerWaalsContact CB-C 3.44Å; A978-A1005 HydrophobicContact CB-CB 3.83Å; A978-A1005 WeakPolarHBondContact CB-O 3.46Å; F982-A1005 HydrophobicContact CD2-CB 4.34Å; D1001-A1005 WeakPolarHBondContact O-CB 3.46Å; D1001-A1005 PolarHBondContact O-N 2.92Å; A1005-R1007 VanDerWaalsContact C-N 3.32Å; A1005-R1007 PolarHBondContact O-N 3.03Å; A1005-L1008 PolarHBondContact O-N 2.86Å; A1005-M1009 VanDerWaalsContact O-CB 3.31Å; A1005-M1009 WeakPolarHBondContact O-CB 3.25Å; A1005-M1009 PolarHBondContact O-N 2.95Å
1006	T	93.6	Very high	88.6	Confident	29 Å²	29	36.7 Å²	36.7	18%	0.178	19%	0.193	C	C	.	.	H	α-helix	trans	-58.4	-40.5	179	-66.7	0	0	0	0	112.3	C974 R975 N1002 L1004 G1010	C974-T1006 HydrophobicContact CB-CG2 3.73Å; R975-T1006 HydrophobicContact CB-CG2 4.47Å; N1002-T1006 WeakPolarHBondContact O-CB 3.37Å; N1002-T1006 PolarHBondContact O-N 3.05Å; N1002-T1006 PolarHBondContact O-OG1 2.87Å; N1002-T1006 PolarHBondContact OD1-OG1 2.86Å; L1004-T1006 PolarHBondContact O-N 2.86Å; T1006-G1010 PolarHBondContact O-N 3.06Å
1007	R	92.4	Very high	89.3	Confident	74 Å²	74	32.2 Å²	32.2	28%	0.279	17%	0.166	S	C	.	.	H	α-helix	trans	-75.4	-37.6	-179.9	-68.9	174.8	74.3	-138.2	2.2	112.8	K132 S133 C134 W919 K1003 L1004 A1005 G1010 T1011	K132-R1007 PolarHBondContact O-NE 2.85Å; K132-R1007 VanDerWaalsContact O-NE 3.14Å; K132-R1007 PolarHBondContact O-NH2 2.99Å; S133-R1007 PolarHBondContact O-NH2 3.37Å; C134-R1007 WeakPolarHBondContact SG-CD 3.45Å; C134-R1007 PolarHBondContact SG-NE 3.47Å; C134-R1007 VanDerWaalsContact SG-NE 3.38Å; W919-R1007 HydrophobicContact CH2-CB 4.05Å; W919-R1007 HydrophobicContact CZ2-CB 4.04Å; K1003-R1007 VanDerWaalsContact O-CG 3.29Å; K1003-R1007 WeakPolarHBondContact O-CG 3.02Å; K1003-R1007 PolarHBondContact O-N 3.4Å; K1003-R1007 VanDerWaalsContact O-N 3.17Å; L1004-R1007 PolarHBondContact O-N 2.6Å; A1005-R1007 VanDerWaalsContact C-N 3.32Å; A1005-R1007 PolarHBondContact O-N 3.03Å; R1007-G1010 PolarHBondContact O-N 3.28Å; R1007-T1011 PolarHBondContact O-N 2.94Å; R1007-T1011 VanDerWaalsContact O-N 3.08Å; R1007-T1011 PolarHBondContact O-OG1 2.9Å
1008	L	94.4	Very high	89.2	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.5	-51	171.3	-173.7	66	0	0	0	110.3	Y912 L915 V916 W919 F982 L1004 A1005 G1010 T1011 V1012	Y912-L1008 HydrophobicContact CD2-CD2 3.77Å; Y912-L1008 HydrophobicContact CE2-CD2 3.6Å; L915-L1008 HydrophobicContact CB-CD2 4.38Å; L915-L1008 HydrophobicContact CD2-CD2 3.88Å; L915-L1008 HydrophobicContact CD2-CG 4.4Å; L915-L1008 HydrophobicContact CG-CD1 4.29Å; L915-L1008 HydrophobicContact CG-CD2 4.06Å; V916-L1008 HydrophobicContact CG2-CD2 3.8Å; W919-L1008 HydrophobicContact CB-CD1 3.4Å; W919-L1008 HydrophobicContact CD2-CD1 4Å; W919-L1008 HydrophobicContact CG-CD1 3.43Å; W919-L1008 VanDerWaalsContact CG-CD1 3.43Å; F982-L1008 HydrophobicContact CE1-CD2 4.06Å; F982-L1008 HydrophobicContact CZ-CD2 4.24Å; F982-L1008 HydrophobicContact CZ-CG 4.5Å; L1004-L1008 PolarHBondContact O-N 2.78Å; A1005-L1008 PolarHBondContact O-N 2.86Å; L1008-G1010 VanDerWaalsContact C-N 3.32Å; L1008-G1010 PolarHBondContact O-N 3.16Å; L1008-T1011 WeakPolarHBondContact O-CA 3.28Å; L1008-T1011 WeakPolarHBondContact O-CB 3.18Å; L1008-T1011 PolarHBondContact O-N 2.85Å; L1008-V1012 HydrophobicContact CG-CG2 4.45Å; L1008-V1012 WeakPolarHBondContact O-CG2 3.35Å; L1008-V1012 PolarHBondContact O-N 2.74Å
1009	M	94.6	Very high	88.2	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-54.1	-46	176.3	-170.6	62.4	-179.6	0	0	112.3	M953 L956 C974 F977 A978 L981 F982 A1005 T1011 V1012 L1013	M953-M1009 HydrophobicContact CE-CE 4.28Å; M953-M1009 HydrophobicContact SD-CE 3.51Å; M953-M1009 VanDerWaalsContact SD-CE 3.51Å; M953-M1009 HydrophobicContact SD-SD 4.26Å; L956-M1009 HydrophobicContact CD1-CE 3.57Å; C974-M1009 HydrophobicContact CB-CB 4.2Å; C974-M1009 HydrophobicContact CB-CG 4.16Å; F977-M1009 HydrophobicContact CB-CE 4.19Å; A978-M1009 HydrophobicContact CB-CB 3.63Å; A978-M1009 HydrophobicContact CB-CG 4.03Å; L981-M1009 HydrophobicContact CD1-CE 3.47Å; L981-M1009 VanDerWaalsContact CD1-CE 3.47Å; L981-M1009 HydrophobicContact CD1-SD 3.95Å; F982-M1009 HydrophobicContact CE2-CB 3.96Å; F982-M1009 HydrophobicContact CE2-CG 4.42Å; F982-M1009 HydrophobicContact CE2-SD 3.8Å; F982-M1009 HydrophobicContact CZ-SD 4.26Å; A1005-M1009 VanDerWaalsContact O-CB 3.31Å; A1005-M1009 WeakPolarHBondContact O-CB 3.25Å; A1005-M1009 PolarHBondContact O-N 2.95Å; M1009-T1011 VanDerWaalsContact C-N 3.27Å; M1009-T1011 PolarHBondContact O-N 3.04Å; M1009-V1012 PolarHBondContact O-N 2.73Å; M1009-L1013 HydrophobicContact CE-CD1 4Å; M1009-L1013 HydrophobicContact CE-CG 4.21Å; M1009-L1013 HydrophobicContact CG-CD1 4.19Å; M1009-L1013 WeakPolarHBondContact O-CB 3.23Å; M1009-L1013 WeakPolarHBondContact O-CG 3.23Å; M1009-L1013 PolarHBondContact O-N 2.65Å
1010	G	93.7	Very high	86.3	Confident	12 Å²	12	41.2 Å²	41.2	12%	0.124	21%	0.211	C	C	.	.	H	α-helix	trans	-61.8	-34.4	176	0	0	0	0	0	113.1	C974 T1006 R1007 L1008 N1014	C974-G1010 VanDerWaalsContact SG-CA 3.53Å; C974-G1010 PolarHBondContact SG-N 2.66Å; C974-G1010 VanDerWaalsContact SG-N 3.45Å; T1006-G1010 PolarHBondContact O-N 3.06Å; R1007-G1010 PolarHBondContact O-N 3.28Å; L1008-G1010 VanDerWaalsContact C-N 3.32Å; L1008-G1010 PolarHBondContact O-N 3.16Å; G1010-N1014 WeakPolarHBondContact O-CB 3.48Å; G1010-N1014 PolarHBondContact O-N 3.2Å; G1010-N1014 PolarHBondContact O-ND2 3.12Å
1011	T	91.6	Very high	84	Confident	38 Å²	38	45.4 Å²	45.4	23%	0.233	23%	0.234	C	C	.	.	H	α-helix	trans	-73.6	-45.9	176.5	-50.8	0	0	0	0	111.5	W919 R1007 L1008 M1009 L1013 N1014 L1015	W919-T1011 PolarHBondContact NE1-OG1 2.69Å; R1007-T1011 PolarHBondContact O-N 2.94Å; R1007-T1011 VanDerWaalsContact O-N 3.08Å; R1007-T1011 PolarHBondContact O-OG1 2.9Å; L1008-T1011 WeakPolarHBondContact O-CA 3.28Å; L1008-T1011 WeakPolarHBondContact O-CB 3.18Å; L1008-T1011 PolarHBondContact O-N 2.85Å; M1009-T1011 VanDerWaalsContact C-N 3.27Å; M1009-T1011 PolarHBondContact O-N 3.04Å; T1011-L1013 VanDerWaalsContact C-N 3.34Å; T1011-L1013 PolarHBondContact O-N 2.74Å; T1011-N1014 PolarHBondContact O-N 3.22Å; T1011-N1014 VanDerWaalsContact O-N 3.14Å; T1011-L1015 HydrophobicContact CG2-CD1 4.35Å; T1011-L1015 WeakPolarHBondContact O-CG 3.42Å; T1011-L1015 PolarHBondContact O-N 3.13Å
1012	V	93.3	Very high	81.4	Confident	4 Å²	4	49.8 Å²	49.8	2%	0.024	26%	0.257	C	S	.	.	H	α-helix	trans	-59.7	-45.2	175.3	-178.5	0	0	0	0	110.2	L915 I934 L938 M953 L1008 M1009 N1014 L1015 W1016	L915-V1012 HydrophobicContact CD2-CG2 4.47Å; I934-V1012 HydrophobicContact CG2-CG2 4Å; L938-V1012 HydrophobicContact CD1-CG1 4.12Å; M953-V1012 HydrophobicContact CE-CB 4.38Å; M953-V1012 HydrophobicContact CE-CG1 3.66Å; L1008-V1012 HydrophobicContact CG-CG2 4.45Å; L1008-V1012 WeakPolarHBondContact O-CG2 3.35Å; L1008-V1012 PolarHBondContact O-N 2.74Å; M1009-V1012 PolarHBondContact O-N 2.73Å; V1012-N1014 PolarHBondContact O-N 2.76Å; V1012-L1015 PolarHBondContact O-N 3.31Å; V1012-W1016 HydrophobicContact CG1-CE3 4.12Å; V1012-W1016 WeakPolarHBondContact O-CB 3.15Å; V1012-W1016 PolarHBondContact O-N 2.9Å
1013	L	91.8	Very high	78.8	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-62.5	-38.7	173.7	-80.2	171.1	0	0	0	112.7	M953 L956 K957 L960 L973 M1009 T1011 L1015 W1016	M953-L1013 HydrophobicContact CE-CD2 3.65Å; M953-L1013 HydrophobicContact CE-CG 3.88Å; M953-L1013 HydrophobicContact SD-CD2 4.2Å; L956-L1013 HydrophobicContact CB-CD2 4.35Å; K957-L1013 WeakPolarHBondContact CE-O 3.3Å; K957-L1013 HydrophobicContact CG-CD2 4.36Å; K957-L1013 PolarHBondContact NZ-O 3.43Å; L960-L1013 HydrophobicContact CD1-CD1 4.33Å; L973-L1013 HydrophobicContact CD2-CD1 4.45Å; M1009-L1013 HydrophobicContact CE-CD1 4Å; M1009-L1013 HydrophobicContact CE-CG 4.21Å; M1009-L1013 HydrophobicContact CG-CD1 4.19Å; M1009-L1013 WeakPolarHBondContact O-CB 3.23Å; M1009-L1013 WeakPolarHBondContact O-CG 3.23Å; M1009-L1013 PolarHBondContact O-N 2.65Å; T1011-L1013 VanDerWaalsContact C-N 3.34Å; T1011-L1013 PolarHBondContact O-N 2.74Å; L1013-L1015 VanDerWaalsContact C-N 3.28Å; L1013-L1015 PolarHBondContact O-N 3.11Å; L1013-W1016 PolarHBondContact O-N 3.37Å
1014	N	89.6	Confident	76.1	Confident	100 Å²	100	53.9 Å²	53.9	54%	0.535	29%	0.292	S	S	.	.	H	α-helix	trans	-67.4	-29.4	176.8	-75.5	-19.2	0	0	0	112.8	R927 G1010 T1011 V1012	R927-N1014 PolarHBondContact NH2-O 3.2Å; G1010-N1014 WeakPolarHBondContact O-CB 3.48Å; G1010-N1014 PolarHBondContact O-N 3.2Å; G1010-N1014 PolarHBondContact O-ND2 3.12Å; T1011-N1014 PolarHBondContact O-N 3.22Å; T1011-N1014 VanDerWaalsContact O-N 3.14Å; V1012-N1014 PolarHBondContact O-N 2.76Å
1015	L	89.9	Confident	73.1	Confident	10 Å²	10	57.2 Å²	57.2	5%	0.052	32%	0.318	C	S	.	.	H	α-helix	trans	-81.5	-27.3	172.7	-63.5	172.9	0	0	0	112.8	R927 N930 F931 I934 F935 T1011 V1012 L1013	R927-L1015 HydrophobicContact CG-CD2 3.81Å; N930-L1015 HydrophobicContact CB-CD1 4.21Å; N930-L1015 HydrophobicContact CB-CD2 4.44Å; F931-L1015 HydrophobicContact CD2-CB 4.36Å; I934-L1015 HydrophobicContact CB-CD1 4.17Å; I934-L1015 HydrophobicContact CG1-CD1 4.02Å; I934-L1015 HydrophobicContact CG2-CD1 4.32Å; F935-L1015 HydrophobicContact CE2-CB 4Å; T1011-L1015 HydrophobicContact CG2-CD1 4.35Å; T1011-L1015 WeakPolarHBondContact O-CG 3.42Å; T1011-L1015 PolarHBondContact O-N 3.13Å; V1012-L1015 PolarHBondContact O-N 3.31Å; L1013-L1015 VanDerWaalsContact C-N 3.28Å; L1013-L1015 PolarHBondContact O-N 3.11Å
1016	W	89.7	Confident	70.1	Confident	4 Å²	4	64.6 Å²	64.6	2%	0.015	36%	0.357	C	S	.	.	S	Bend	trans	-64.7	132.2	-179.2	-155.3	-80.1	0	0	0	111.9	F935 L938 I950 M953 D954 K957 V1012 L1013	F935-W1016 HydrophobicContact CE1-CD2 4.23Å; F935-W1016 AromaticContact CE1-CE3 3.5Å; F935-W1016 HydrophobicContact CE1-CE3 3.5Å; F935-W1016 VanDerWaalsContact CE1-CE3 3.5Å; F935-W1016 HydrophobicContact CE1-CH2 4.07Å; F935-W1016 AromaticContact CE1-CZ3 3.43Å; F935-W1016 HydrophobicContact CE1-CZ3 3.43Å; F935-W1016 VanDerWaalsContact CE1-CZ3 3.43Å; F935-W1016 HydrophobicContact CZ-CD2 4.09Å; F935-W1016 AromaticContact CZ-CE3 3.47Å; F935-W1016 HydrophobicContact CZ-CE3 3.47Å; F935-W1016 VanDerWaalsContact CZ-CE3 3.47Å; F935-W1016 AromaticContact CZ-CZ3 3.92Å; F935-W1016 HydrophobicContact CZ-CZ3 3.92Å; L938-W1016 HydrophobicContact CD1-CZ3 4.44Å; I950-W1016 HydrophobicContact CB-CZ2 4.5Å; I950-W1016 HydrophobicContact CG2-CZ2 4.42Å; M953-W1016 HydrophobicContact CB-CD2 3.66Å; M953-W1016 VanDerWaalsContact CB-CE2 3.42Å; M953-W1016 HydrophobicContact CB-CE3 3.9Å; M953-W1016 HydrophobicContact CB-CG 4.35Å; M953-W1016 HydrophobicContact CB-CH2 3.81Å; M953-W1016 HydrophobicContact CB-CZ2 3.55Å; M953-W1016 HydrophobicContact CB-CZ3 3.95Å; M953-W1016 HydrophobicContact CE-CD2 4.06Å; M953-W1016 HydrophobicContact CE-CE3 3.59Å; M953-W1016 HydrophobicContact CE-CG 4.48Å; M953-W1016 HydrophobicContact CE-CZ3 4.15Å; M953-W1016 HydrophobicContact CG-CD2 4.33Å; M953-W1016 HydrophobicContact CG-CE3 4.06Å; M953-W1016 HydrophobicContact CG-CH2 4.03Å; M953-W1016 HydrophobicContact CG-CZ2 4.29Å; M953-W1016 HydrophobicContact CG-CZ3 3.88Å; D954-W1016 PolarHBondContact OD1-NE1 2.68Å; D954-W1016 VanDerWaalsContact OD1-NE1 3.09Å; K957-W1016 WeakPolarHBondContact CE-O 3.19Å; K957-W1016 PolarHBondContact NZ-O 3.14Å; V1012-W1016 HydrophobicContact CG1-CE3 4.12Å; V1012-W1016 WeakPolarHBondContact O-CB 3.15Å; V1012-W1016 PolarHBondContact O-N 2.9Å; L1013-W1016 PolarHBondContact O-N 3.37Å
1017	P	79.8	Confident	66.9	Low	14 Å²	14	66.6 Å²	66.6	9%	0.091	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-68.8	162.7	-179.4	29.5	-36.7	0	0	0	112	V1042 I1045	P1017-V1042 HydrophobicContact CB-CG2 4.19Å; P1017-I1045 HydrophobicContact CG-CB 4.18Å; P1017-I1045 HydrophobicContact CG-CD1 3.58Å; P1017-I1045 HydrophobicContact CG-CG2 4.09Å
1018	S	72.7	Confident	63.9	Low	91 Å²	91	68.2 Å²	68.2	64%	0.636	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-76	148.8	165.1	-59.1	0	0	0	0	109.9	M1020	S1018-M1020 PolarHBondContact O-N 2.95Å
1019	R	64.1	Low	60.8	Low	101 Å²	101	76 Å²	76	38%	0.381	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-65.3	131.3	174.2	-139.8	177	-147.3	-176.7	13.9	109.6	E845 D954 N958 N1021	E845-R1019 IonicContact OE2-NH1 3.99Å; D954-R1019 IonicContact OD2-CZ 2.73Å; D954-R1019 IonicContact OD2-NE 2.7Å; D954-R1019 PolarHBondContact OD2-NE 2.83Å; D954-R1019 IonicContact OD2-NH2 2.79Å; D954-R1019 PolarHBondContact OD2-NH2 3Å; D954-R1019 VanDerWaalsContact OD2-NH2 3.09Å; N958-R1019 WeakPolarHBondContact OD1-CB 3.45Å; R1019-N1021 PolarHBondContact O-N 3.15Å
1020	M	43.8	Very low	57.6	Low	122 Å²	122	83.6 Å²	83.6	60%	0.601	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-72.6	116.3	177.5	-165.4	96.7	80.9	0	0	109.3	S1018 N1022 V1042	S1018-M1020 PolarHBondContact O-N 2.95Å; M1020-N1022 PolarHBondContact O-N 3.41Å; M1020-V1042 HydrophobicContact CE-CG1 3.6Å; M1020-V1042 HydrophobicContact SD-CG1 4.34Å
1021	N	38.9	Very low	54.4	Low	120 Å²	120	87 Å²	87	64%	0.642	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-72.2	124.6	164.3	-79.8	-17.3	0	0	0	108.4	R1019 S1023	R1019-N1021 PolarHBondContact O-N 3.15Å; N1021-S1023 PolarHBondContact O-N 3.34Å
1022	N	34	Very low	51.3	Low	151 Å²	151	89.6 Å²	89.6	81%	0.807	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	33.7	175.5	-97.6	2.1	0	0	0	112.8	M1020	M1020-N1022 PolarHBondContact O-N 3.41Å
1023	S	32	Very low	48.1	Very low	88 Å²	88	95.3 Å²	95.3	62%	0.615	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	-29.2	-173.5	-55.2	0	0	0	0	113.4	N1021 S1025	N1021-S1023 PolarHBondContact O-N 3.34Å; S1023-S1025 PolarHBondContact O-N 3.36Å
1024	D	32.7	Very low	44.9	Very low	142 Å²	142	100.3 Å²	100.3	76%	0.759	63%	0.631	S	S	*	*			trans	-94.9	5.4	-163	-57.4	-19.8	0	0	0	113.6	N1026	D1024-N1026 PolarHBondContact O-N 2.86Å; D1024-N1026 VanDerWaalsContact O-N 3.15Å
1025	S	30.4	Very low	42	Very low	97 Å²	97	98.3 Å²	98.3	68%	0.678	63%	0.634	S	S	*	*	S	Bend	trans	-80	18.5	-178.2	54.2	0	0	0	0	114.9	S1023	S1023-S1025 PolarHBondContact O-N 3.36Å
1026	N	28.4	Very low	38.9	Very low	156 Å²	156	102.9 Å²	102.9	83%	0.834	67%	0.673	S	S	*	*	S	Bend	trans	-145.9	77.4	178.6	-86	-77	0	0	0	111.8	D1024	D1024-N1026 PolarHBondContact O-N 2.86Å; D1024-N1026 VanDerWaalsContact O-N 3.15Å
1027	G	28.1	Very low	36.1	Very low	71 Å²	71	110 Å²	110	73%	0.732	71%	0.711	S	S	*	*	S	Bend	trans	-179	90.9	175.8	0	0	0	0	0	117.4
1028	S	29.3	Very low	34.2	Very low	107 Å²	107	114.4 Å²	114.4	75%	0.748	74%	0.738	S	S	*	*			trans	58.4	98.9	154.2	-170.9	0	0	0	0	119.2	N1030	S1028-N1030 PolarHBondContact O-N 3Å; S1028-N1030 VanDerWaalsContact O-N 3.15Å
1029	D	27.4	Very low	32.4	Very low	165 Å²	165	118.5 Å²	118.5	88%	0.882	74%	0.744	S	S	*	*			trans	-60.6	108.7	144	-76.5	-55.8	0	0	0	109.5
1030	N	27.8	Very low	31.4	Very low	160 Å²	160	118.4 Å²	118.4	86%	0.856	75%	0.751	S	S	*	*			trans	177.1	132.1	152.7	-97.1	-49.2	0	0	0	110.9	S1028	S1028-N1030 PolarHBondContact O-N 3Å; S1028-N1030 VanDerWaalsContact O-N 3.15Å
1031	G	27.8	Very low	31	Very low	83 Å²	83	113.8 Å²	113.8	86%	0.856	73%	0.731	S	S	*	*			trans	123.6	134.7	174.4	0	0	0	0	0	113.5
1032	A	25.5	Very low	31	Very low	94 Å²	94	109.7 Å²	109.7	78%	0.777	71%	0.71	S	S	*	*			trans	-102.7	156.6	-169	0	0	0	0	0	114.6
1033	S	26.2	Very low	31.3	Very low	123 Å²	123	105.6 Å²	105.6	86%	0.86	69%	0.693	S	S	*	*			trans	58.5	73.4	153.9	60.6	0	0	0	0	119.5
1034	A	25.4	Very low	31.6	Very low	107 Å²	107	102 Å²	102	88%	0.884	67%	0.667	S	S	*	*	S	Bend	trans	-160.2	143.1	139.1	0	0	0	0	0	111.7
1035	G	27	Very low	32.2	Very low	59 Å²	59	95.8 Å²	95.8	61%	0.608	63%	0.633	S	S	*	*			trans	88.8	36.2	156.8	0	0	0	0	0	119.8	L1037	G1035-L1037 PolarHBondContact O-N 2.9Å
1036	A	26.1	Very low	32.7	Very low	106 Å²	106	94.7 Å²	94.7	88%	0.876	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	37.4	177.7	0	0	0	0	0	115.5
1037	L	31.5	Very low	33.4	Very low	152 Å²	152	93.2 Å²	93.2	80%	0.796	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.5	8.6	-170.7	-96	164.9	0	0	0	114.9	G1035	G1035-L1037 PolarHBondContact O-N 2.9Å
1038	T	38.1	Very low	34.1	Very low	108 Å²	108	94.7 Å²	94.7	66%	0.663	59%	0.594	S	S	*	*	S	Bend	trans	-114.1	-10.7	-173.9	52.2	0	0	0	0	115.1
1039	K	36.8	Very low	34.9	Very low	177 Å²	177	90.9 Å²	90.9	77%	0.77	56%	0.563	S	S	*	*	S	Bend	trans	-82.4	-29.8	-175.2	-73.1	-172.3	173.1	-177.7	0	114.2	S1043	K1039-S1043 PolarHBondContact O-N 2.99Å
1040	D	42.8	Very low	35.8	Very low	99 Å²	99	87.1 Å²	87.1	53%	0.529	54%	0.539	S	S	.	.	H	α-helix	trans	-72.1	-47.4	-167.7	-57.5	-29.2	0	0	0	113.2	V1042 S1043 L1044	D1040-V1042 PolarHBondContact O-N 2.75Å; D1040-V1042 VanDerWaalsContact O-N 3.17Å; D1040-S1043 WeakPolarHBondContact O-CB 3.44Å; D1040-S1043 PolarHBondContact O-N 3.43Å; D1040-S1043 VanDerWaalsContact O-N 3.08Å; D1040-L1044 WeakPolarHBondContact O-CG 3.35Å; D1040-L1044 PolarHBondContact O-N 2.97Å
1041	S	34.1	Very low	36.1	Very low	24 Å²	24	82.7 Å²	82.7	17%	0.168	53%	0.531	C	S	.	.	H	α-helix	trans	-61.6	-27.5	-178.4	-48.2	0	0	0	0	114
1042	V	40	Very low	36.1	Very low	35 Å²	35	81.3 Å²	81.3	21%	0.212	52%	0.517	C	S	.	.	H	α-helix	trans	-81.5	-38.3	176.1	-174.6	0	0	0	0	110.8	P1017 M1020 D1040 L1044 N1046	P1017-V1042 HydrophobicContact CB-CG2 4.19Å; M1020-V1042 HydrophobicContact CE-CG1 3.6Å; M1020-V1042 HydrophobicContact SD-CG1 4.34Å; D1040-V1042 PolarHBondContact O-N 2.75Å; D1040-V1042 VanDerWaalsContact O-N 3.17Å; V1042-L1044 VanDerWaalsContact C-N 3.29Å; V1042-L1044 PolarHBondContact O-N 3.31Å; V1042-N1046 PolarHBondContact O-N 3.27Å
1043	S	40.4	Very low	36.2	Very low	64 Å²	64	87 Å²	87	45%	0.448	52%	0.524	S	S	.	.	H	α-helix	trans	-58.1	-42.2	172.7	-168.4	0	0	0	0	111.5	K1039 D1040 N1046 M1047	K1039-S1043 PolarHBondContact O-N 2.99Å; D1040-S1043 WeakPolarHBondContact O-CB 3.44Å; D1040-S1043 PolarHBondContact O-N 3.43Å; D1040-S1043 VanDerWaalsContact O-N 3.08Å; S1043-N1046 PolarHBondContact O-N 3.4Å; S1043-M1047 VanDerWaalsContact O-CB 3.3Å; S1043-M1047 WeakPolarHBondContact O-CB 3.38Å; S1043-M1047 PolarHBondContact O-N 3.13Å
1044	L	38.7	Very low	36.3	Very low	12 Å²	12	87.8 Å²	87.8	6%	0.063	52%	0.518	C	S	.	.	H	α-helix	trans	-63.1	-45.5	-177.8	-72.2	160.4	0	0	0	113.6	E928 F931 D1040 V1042 N1046 M1047 Y1048	E928-L1044 VanDerWaalsContact OE1-CD1 3.26Å; E928-L1044 WeakPolarHBondContact OE1-CD1 3.27Å; E928-L1044 WeakPolarHBondContact OE2-CD1 3.41Å; F931-L1044 HydrophobicContact CD1-CB 4.42Å; F931-L1044 HydrophobicContact CD1-CD1 4.14Å; F931-L1044 HydrophobicContact CE1-CB 3.61Å; F931-L1044 HydrophobicContact CE1-CD1 4.15Å; F931-L1044 HydrophobicContact CE1-CG 4.41Å; F931-L1044 HydrophobicContact CZ-CB 3.91Å; D1040-L1044 WeakPolarHBondContact O-CG 3.35Å; D1040-L1044 PolarHBondContact O-N 2.97Å; V1042-L1044 VanDerWaalsContact C-N 3.29Å; V1042-L1044 PolarHBondContact O-N 3.31Å; L1044-N1046 VanDerWaalsContact C-N 3.35Å; L1044-N1046 PolarHBondContact O-N 3.33Å; L1044-M1047 WeakPolarHBondContact O-CB 3.45Å; L1044-M1047 PolarHBondContact O-N 3.44Å; L1044-M1047 VanDerWaalsContact O-N 3.17Å; L1044-Y1048 HydrophobicContact CD2-CD2 4.37Å; L1044-Y1048 HydrophobicContact CD2-CE2 3.91Å; L1044-Y1048 WeakPolarHBondContact O-CB 3.43Å; L1044-Y1048 WeakPolarHBondContact O-CD2 3.47Å; L1044-Y1048 PolarHBondContact O-N 2.9Å
1045	I	45.1	Very low	36.4	Very low	12 Å²	12	87 Å²	87	6%	0.062	50%	0.504	C	S	.	.	H	α-helix	trans	-72.2	-28.8	177	-105.4	157.3	0	0	0	112.7	F931 F935 P1017 M1047 W1049 K1050	F931-I1045 HydrophobicContact CE2-CD1 4.17Å; F931-I1045 HydrophobicContact CZ-CD1 3.93Å; F931-I1045 HydrophobicContact CZ-CG1 3.99Å; F935-I1045 HydrophobicContact CD1-CD1 4.13Å; F935-I1045 HydrophobicContact CE1-CD1 3.59Å; F935-I1045 HydrophobicContact CE1-CG1 4.44Å; F935-I1045 HydrophobicContact CZ-CD1 3.89Å; P1017-I1045 HydrophobicContact CG-CB 4.18Å; P1017-I1045 HydrophobicContact CG-CD1 3.58Å; P1017-I1045 HydrophobicContact CG-CG2 4.09Å; I1045-M1047 VanDerWaalsContact C-N 3.3Å; I1045-W1049 HydrophobicContact CG1-CB 4.49Å; I1045-W1049 HydrophobicContact CG1-CG 4.33Å; I1045-W1049 WeakPolarHBondContact O-CA 3.43Å; I1045-W1049 WeakPolarHBondContact O-CB 3.12Å; I1045-W1049 PolarHBondContact O-N 3.46Å; I1045-K1050 PolarHBondContact O-N 3.45Å
1046	N	40.2	Very low	36.4	Very low	75 Å²	75	93.9 Å²	93.9	40%	0.401	52%	0.52	S	S	.	.	H	α-helix	trans	-65.9	-35.7	168.9	-79.3	-5.3	0	0	0	111.8	V1042 S1043 L1044 K1050 G1051	V1042-N1046 PolarHBondContact O-N 3.27Å; S1043-N1046 PolarHBondContact O-N 3.4Å; L1044-N1046 VanDerWaalsContact C-N 3.35Å; L1044-N1046 PolarHBondContact O-N 3.33Å; N1046-K1050 CarbonylContact O-C 3.29Å; N1046-K1050 VanDerWaalsContact O-C 3.29Å; N1046-G1051 PolarHBondContact O-N 3.3Å; N1046-G1051 VanDerWaalsContact O-N 3.13Å
1047	M	42.9	Very low	36.4	Very low	124 Å²	124	93.5 Å²	93.5	61%	0.611	51%	0.511	S	S	*	.	H	α-helix	trans	-75.7	-42.5	179.4	-171.2	-171.8	-52.5	0	0	113.4	S1043 L1044 I1045	S1043-M1047 VanDerWaalsContact O-CB 3.3Å; S1043-M1047 WeakPolarHBondContact O-CB 3.38Å; S1043-M1047 PolarHBondContact O-N 3.13Å; L1044-M1047 WeakPolarHBondContact O-CB 3.45Å; L1044-M1047 PolarHBondContact O-N 3.44Å; L1044-M1047 VanDerWaalsContact O-N 3.17Å; I1045-M1047 VanDerWaalsContact C-N 3.3Å
1048	Y	43.3	Very low	36	Very low	102 Å²	102	90 Å²	90	40%	0.4	50%	0.5	S	S	.	.	H	α-helix	trans	-89.4	-38	-176.3	-81.3	-111.2	0	0	0	113.4	L1044	L1044-Y1048 HydrophobicContact CD2-CD2 4.37Å; L1044-Y1048 HydrophobicContact CD2-CE2 3.91Å; L1044-Y1048 WeakPolarHBondContact O-CB 3.43Å; L1044-Y1048 WeakPolarHBondContact O-CD2 3.47Å; L1044-Y1048 PolarHBondContact O-N 2.9Å
1049	W	46.6	Very low	35.5	Very low	28 Å²	28	94.8 Å²	94.8	11%	0.106	54%	0.535	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-33.8	-168	-70.4	58.8	0	0	0	114.1	F935 L938 D939 K946 I950 I1045	F935-W1049 HydrophobicContact CD1-CZ2 4.26Å; L938-W1049 HydrophobicContact CB-CH2 3.78Å; L938-W1049 HydrophobicContact CB-CZ2 3.74Å; D939-W1049 HydrophobicContact CB-CZ2 4.41Å; D939-W1049 VanDerWaalsContact CG-NE1 3.28Å; D939-W1049 PolarHBondContact OD1-NE1 3.35Å; D939-W1049 PolarHBondContact OD2-NE1 3.44Å; K946-W1049 HydrophobicContact CB-CZ3 4.38Å; K946-W1049 HydrophobicContact CD-CE3 4.19Å; K946-W1049 HydrophobicContact CD-CH2 3.75Å; K946-W1049 HydrophobicContact CD-CZ2 4.08Å; K946-W1049 HydrophobicContact CD-CZ3 3.84Å; K946-W1049 HydrophobicContact CG-CE3 3.76Å; K946-W1049 HydrophobicContact CG-CH2 3.38Å; K946-W1049 HydrophobicContact CG-CZ2 4.2Å; K946-W1049 HydrophobicContact CG-CZ3 3.13Å; I950-W1049 HydrophobicContact CD1-CE3 3.75Å; I950-W1049 HydrophobicContact CD1-CZ3 4.47Å; I950-W1049 HydrophobicContact CG1-CE3 3.53Å; I950-W1049 HydrophobicContact CG1-CZ3 3.9Å; I1045-W1049 HydrophobicContact CG1-CB 4.49Å; I1045-W1049 HydrophobicContact CG1-CG 4.33Å; I1045-W1049 WeakPolarHBondContact O-CA 3.43Å; I1045-W1049 WeakPolarHBondContact O-CB 3.12Å; I1045-W1049 PolarHBondContact O-N 3.46Å
1050	K	45.5	Very low	35.5	Very low	85 Å²	85	90.7 Å²	90.7	37%	0.37	52%	0.523	S	S	.	.	S	Bend	trans	-99.3	15.9	174	-59.5	178.3	177.2	171.2	0	113.4	D954 I1045 N1046 G1052	D954-K1050 IonicContact OD2-NZ 3.13Å; I1045-K1050 PolarHBondContact O-N 3.45Å; N1046-K1050 CarbonylContact O-C 3.29Å; N1046-K1050 VanDerWaalsContact O-C 3.29Å; K1050-G1052 PolarHBondContact O-N 3.4Å
1051	G	33.1	Very low	35.1	Very low	68 Å²	68	90.3 Å²	90.3	70%	0.701	52%	0.523	S	S	*	.			trans	-72.5	39.1	173.1	0	0	0	0	0	114.2	N1046	N1046-G1051 PolarHBondContact O-N 3.3Å; N1046-G1051 VanDerWaalsContact O-N 3.13Å
1052	G	29.4	Very low	35.2	Very low	54 Å²	54	93.9 Å²	93.9	56%	0.557	54%	0.543	S	S	*	.	S	Bend	trans	-158.3	145.3	-177.1	0	0	0	0	0	110.3	K1050 L1054	K1050-G1052 PolarHBondContact O-N 3.4Å; G1052-L1054 PolarHBondContact O-N 3.39Å
1053	K	27.2	Very low	34.9	Very low	212 Å²	212	97.4 Å²	97.4	92%	0.922	56%	0.562	S	S	*	*			trans	-65.6	96.6	-170.3	-66.5	-179.1	-179.9	179.5	0	112.8
1054	L	28.1	Very low	34.5	Very low	140 Å²	140	99.5 Å²	99.5	73%	0.733	57%	0.569	S	S	*	*			trans	-73.1	123.9	146.5	-80.1	164.1	0	0	0	107.7	G1052	G1052-L1054 PolarHBondContact O-N 3.39Å
1055	P	26.5	Very low	34.3	Very low	90 Å²	90	105.3 Å²	105.3	58%	0.584	60%	0.603	S	S	*	*			trans	-72.9	132.3	176.5	29.8	-33.2	0	0	0	110.1	S1057	P1055-S1057 PolarHBondContact O-N 3.47Å
1056	E	27.6	Very low	33.5	Very low	205 Å²	205	112 Å²	112	96%	0.958	64%	0.642	S	S	*	*	S	Bend	trans	-75.6	36	-178.4	-58.2	-177.4	121.1	0	0	113.1
1057	S	26.1	Very low	33	Very low	97 Å²	97	114.8 Å²	114.8	68%	0.678	66%	0.66	S	S	*	*			trans	-129	34.4	-164.3	70.4	0	0	0	0	114.7	P1055	P1055-S1057 PolarHBondContact O-N 3.47Å
1058	S	23.8	Very low	32.1	Very low	80 Å²	80	114.1 Å²	114.1	56%	0.559	66%	0.664	S	S	*	*			trans	-159.6	70.3	168.8	44.7	0	0	0	0	113.3
1059	C	28.4	Very low	31.1	Very low	208 Å²	208	115.2 Å²	115.2	100%	1.405	69%	0.689	S	S	*	*			trans	-139	0	160	-77.6	0	0	0	0	108.8

Retrieved 1,059 of 1,059 residues in 1203.3 ms (Link to these results)

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