A0A5K4FEF6_SCHMA Loading...

FERM domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FEF6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 806 aa.

						>A0A5K4FEF6_SCHMA|A0A5K4FEF6
MKLSGRNKTKESSKKRRTDDPENRDSEKVPHSNTITDDSIHCKVRLLDDTQTPIEFTIKKADSGSVLFKKVCQSIGDLVEYDYFGLRYTDKDNIRQWLELDKSVYKQLKDCKSFVVNFRVKHYPPDPVNDLAQSISRYLVYLQIRRDLTQGRLLCPPSIVGELGALVAQAEIGDAPSEHVETPNSDVNHCTPPLYDSRLDSVESTESTNMSNNNDCDQCIQGETLNYTACCEMLRKLKIIFNQTPEVEAQIMKEYQKLRGLKAVDAETELLRRASQLPTYGIDPVPATPMQKVYLPVSTSATENNSPPNEVKATNGKQNSVTLSPQPVNLPEGATFYLGITSTGVVTFVGRQRNAEYTWDQIHRLGCDGKLFLIYLKRDHNHTGRKLFRTKYILHSFRCKSKTAAFAFWHWVVDRKCFFTLKQASEAKKIKPTTNIFSRSHAYRFSGRSQQELRACTGSIANLPQQSFSRVSSFRRVIGLYPNSDSGGAFSRSTLPGRLRPSNDYFGNRSEKSKTLDEVSPLMSAFSDIPIKRIPDTVVEQPCEEDLLNSTKASPTINDKKLNNADGDEKDLVIQAAVESWIEPTQIVQQTVSAEKINIQPVALEKCSEPNMVVRKRTENGTLTSTDYTQAVIALDKTLDHHSSLSQPDELTKSKIQTYIHVSNGEAVRIRDDFKVCANGPTNKKFNYQLITSNGETSPVSVHSYTLKENCHQQNQQQKEYTHNNEHRSSIQTYAITLTATAFVVLVGVIALLETTPTTSNHYDQNVFYQTVRHNFLVDNFQEYVYTPLKMSIVNGFSFLMSYINP
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.5	Very low	38.4	Very low	248 Å²	248	176.6 Å²	176.6	100%	1.222	89%	0.89	S	S	*	*				0	152.5	0	-93	169.4	156.9	0	0	109.7
2	K	35.7	Very low	38.1	Very low	191 Å²	191	169.8 Å²	169.8	83%	0.83	87%	0.871	S	S	*	*			trans	-30.7	159	167.5	-65.2	172.6	176.6	177.7	0	116.4
3	L	34.9	Very low	38.7	Very low	149 Å²	149	166.5 Å²	166.5	78%	0.78	87%	0.872	S	S	*	*			cis	-170.9	152	-8	-109.4	165.1	0	0	0	110.5
4	S	36.4	Very low	38.6	Very low	121 Å²	121	168.8 Å²	168.8	85%	0.846	87%	0.872	S	S	*	*			trans	46.5	131.3	138.7	-168.8	0	0	0	0	124.5
5	G	38.7	Very low	39.4	Very low	70 Å²	70	171.5 Å²	171.5	72%	0.722	87%	0.874	S	S	*	*			trans	141.3	138.1	140.4	0	0	0	0	0	115.3
6	R	44.5	Very low	39.1	Very low	246 Å²	246	174.7 Å²	174.7	93%	0.928	87%	0.872	S	S	*	*			cis	-165.9	134.9	-4.3	-164.3	175.7	-168.7	164.7	2.8	109.7
7	N	35.6	Very low	39.6	Very low	160 Å²	160	178.8 Å²	178.8	86%	0.856	88%	0.875	S	S	*	*			trans	-80.5	159.2	175.9	-79.8	-18.7	0	0	0	113.3
8	K	45.3	Very low	39.5	Very low	214 Å²	214	175.1 Å²	175.1	93%	0.93	87%	0.865	S	S	*	*			trans	-150.8	115.5	155.2	-105.6	-176.6	-178.5	178.6	0	112.6
9	T	34.1	Very low	39.7	Very low	139 Å²	139	172.9 Å²	172.9	85%	0.853	86%	0.857	S	S	*	*			trans	-94.4	165.8	165.1	12.5	0	0	0	0	110.8
10	K	46	Very low	40.1	Very low	215 Å²	215	172.3 Å²	172.3	94%	0.935	86%	0.857	S	S	*	*			trans	-136.2	148	163.6	-102.5	-171.9	173.4	-174.5	0	110.1
11	E	34.6	Very low	40.4	Very low	190 Å²	190	169.4 Å²	169.4	89%	0.888	85%	0.851	S	S	*	*			trans	-123	-179.6	-160.2	-150.7	-178.3	160.7	0	0	112.8
12	S	35.4	Very low	40.7	Very low	94 Å²	94	166.8 Å²	166.8	66%	0.657	84%	0.836	S	S	*	*			trans	-70.1	178.5	-165.4	77.2	0	0	0	0	117.7
13	S	45.7	Very low	40.8	Very low	128 Å²	128	163.6 Å²	163.6	90%	0.895	83%	0.828	S	S	*	*			trans	-144.6	143.8	150.9	-77.2	0	0	0	0	110.3
14	K	37.1	Very low	41.2	Very low	198 Å²	198	167.4 Å²	167.4	86%	0.861	83%	0.831	S	S	*	*			trans	-138.7	146.4	-168.7	-162.6	177.4	-168	172.6	0	108.5
15	K	50.1	Low	41.3	Very low	210 Å²	210	168.8 Å²	168.8	91%	0.913	83%	0.83	S	S	*	*			trans	-137.7	135.4	171.9	-154.5	171.1	-174.7	177.7	0	111.5
16	R	34.9	Very low	41.6	Very low	222 Å²	222	171 Å²	171	84%	0.838	83%	0.833	S	S	*	*			trans	-106	160.9	178.9	-72.2	174	165.2	163.7	-7	110.5
17	R	47.7	Very low	41.2	Very low	245 Å²	245	168.6 Å²	168.6	93%	0.925	83%	0.833	S	S	*	*			trans	-155.9	157.9	133.5	-106.9	170.2	-172.8	-175.8	-1	110.1
18	T	38.4	Very low	41.3	Very low	112 Å²	112	170.4 Å²	170.4	69%	0.687	83%	0.833	S	S	*	*			trans	-95.1	-178	-171.3	43.3	0	0	0	0	109.7
19	D	42.7	Very low	41.3	Very low	134 Å²	134	165.5 Å²	165.5	72%	0.717	82%	0.821	S	S	*	*			cis	-155.3	162	40.2	-62	-66.4	0	0	0	114.4
20	D	47.5	Very low	41.7	Very low	159 Å²	159	164.4 Å²	164.4	85%	0.85	82%	0.816	S	S	*	*			trans	60	149.8	155.1	-64.6	-29	0	0	0	127
21	P	46	Very low	41.4	Very low	113 Å²	113	162.4 Å²	162.4	73%	0.734	81%	0.81	S	S	*	*			trans	-125.9	144.8	-171.4	39.4	-21.6	0	0	0	116.2
22	E	44	Very low	41.6	Very low	193 Å²	193	158.8 Å²	158.8	90%	0.902	81%	0.806	S	S	*	*			trans	-159.2	121.1	149.9	-124	177.8	-178	0	0	114.9
23	N	37.2	Very low	41.9	Very low	124 Å²	124	161.6 Å²	161.6	66%	0.663	81%	0.813	S	S	*	*			trans	34.3	113.2	137.8	-161.8	7.9	0	0	0	121.1
24	R	43.2	Very low	41.6	Very low	228 Å²	228	161.5 Å²	161.5	86%	0.86	81%	0.808	S	S	*	*				178.2	148.7	113.8	-95.9	168.6	-167.7	-167.5	4.2	114.2
25	D	37.9	Very low	42.1	Very low	151 Å²	151	160 Å²	160	81%	0.807	81%	0.807	S	S	*	*			trans	-64.5	140.6	-177.4	-55.8	-77.2	0	0	0	114.2
26	S	45.9	Very low	42.5	Very low	115 Å²	115	154.8 Å²	154.8	80%	0.804	79%	0.793	S	S	*	*			trans	-159	93.4	162.7	-73.8	0	0	0	0	109.5	K28	S26-K28 PolarHBondContact O-N 2.92Å; S26-K28 VanDerWaalsContact O-N 3.17Å
27	E	36.7	Very low	44.3	Very low	197 Å²	197	149.4 Å²	149.4	92%	0.921	78%	0.781	S	S	*	*			trans	-58.8	111.6	176.3	-172	173.7	-166.9	0	0	110.6
28	K	38	Very low	46.3	Very low	197 Å²	197	142.4 Å²	142.4	86%	0.857	76%	0.762	S	S	*	*			trans	-106.4	99.5	-172.8	-138.2	174.8	-170.5	177	0	111.4	S26	S26-K28 PolarHBondContact O-N 2.92Å; S26-K28 VanDerWaalsContact O-N 3.17Å
29	V	45.3	Very low	48.9	Very low	112 Å²	112	138.6 Å²	138.6	68%	0.679	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-51.4	129.1	178	179.6	0	0	0	0	111.6	H31	V29-H31 PolarHBondContact O-N 3.1Å; V29-H31 PolarHBondContact O-ND1 3.16Å
30	P	40.5	Very low	51.3	Low	116 Å²	116	133 Å²	133	75%	0.753	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-67.4	126.1	174.8	28.5	-33.3	0	0	0	109.7	S32	P30-S32 PolarHBondContact O-N 3.41Å
31	H	41.5	Very low	53.5	Low	173 Å²	173	130.5 Å²	130.5	80%	0.801	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-63.4	136.8	179.1	-73	19.4	0	0	0	110.9	V29 N33	V29-H31 PolarHBondContact O-N 3.1Å; V29-H31 PolarHBondContact O-ND1 3.16Å; H31-N33 PolarHBondContact O-N 3.2Å
32	S	38.8	Very low	55.8	Low	114 Å²	114	125.1 Å²	125.1	80%	0.797	66%	0.658	S	S	*	*			trans	-64.9	116	-178.8	43.1	0	0	0	0	111.4	P30 T34	P30-S32 PolarHBondContact O-N 3.41Å; S32-T34 PolarHBondContact O-N 3.36Å
33	N	41.3	Very low	58.4	Low	152 Å²	152	120.3 Å²	120.3	81%	0.813	63%	0.634	S	S	*	*			trans	-64.2	127	165	-77.9	-33.2	0	0	0	109.3	H31 I35	H31-N33 PolarHBondContact O-N 3.2Å; N33-I35 PolarHBondContact O-N 3.4Å
34	T	39.4	Very low	61.2	Low	127 Å²	127	114.4 Å²	114.4	78%	0.779	60%	0.602	S	S	*	*			trans	-59.4	107.3	170.2	46.3	0	0	0	0	109.9	S32 T36	S32-T34 PolarHBondContact O-N 3.36Å; T34-T36 VanDerWaalsContact C-N 3.32Å; T34-T36 PolarHBondContact O-N 2.91Å
35	I	47.3	Very low	63.7	Low	166 Å²	166	105.6 Å²	105.6	85%	0.851	57%	0.569	S	S	*	*			trans	-72.1	90.5	172.5	-57.3	175.2	0	0	0	107.4	N33 D37	N33-I35 PolarHBondContact O-N 3.4Å; I35-D37 PolarHBondContact O-N 2.91Å
36	T	59	Low	66.4	Low	101 Å²	101	99 Å²	99	62%	0.62	53%	0.534	S	S	*	.			trans	-68.2	116.1	168.9	52.4	0	0	0	0	108.3	T34 D38	T34-T36 VanDerWaalsContact C-N 3.32Å; T34-T36 PolarHBondContact O-N 2.91Å; T36-D38 PolarHBondContact O-N 2.73Å; T36-D38 VanDerWaalsContact O-N 3.1Å
37	D	73.1	Confident	68.6	Low	109 Å²	109	93.8 Å²	93.8	58%	0.583	50%	0.497	S	S	*	.			trans	-60.6	117.2	179.6	-171.5	-5.4	0	0	0	110.2	I35 S39 K60	I35-D37 PolarHBondContact O-N 2.91Å; D37-S39 VanDerWaalsContact CG-OG 3.28Å; D37-S39 VanDerWaalsContact OD1-CB 3.25Å; D37-S39 WeakPolarHBondContact OD1-CB 2.87Å; D37-S39 PolarHBondContact OD1-N 3.19Å; D37-S39 PolarHBondContact OD1-OG 2.98Å; D37-S39 PolarHBondContact OD2-OG 2.99Å; D37-K60 WeakPolarHBondContact O-CE 3.2Å; D37-K60 PolarHBondContact O-NZ 3.44Å
38	D	88.9	Confident	70.9	Confident	98 Å²	98	85.1 Å²	85.1	52%	0.524	46%	0.457	S	S	.	.			trans	-95.8	7.4	-179.3	-103.8	-1.6	0	0	0	113.5	T36 K59 K60	T36-D38 PolarHBondContact O-N 2.73Å; T36-D38 VanDerWaalsContact O-N 3.1Å; D38-K59 CarbonylContact O-C 3.45Å; D38-K59 WeakPolarHBondContact O-CA 3.23Å; D38-K60 WeakPolarHBondContact O-CG 3.28Å; D38-K60 PolarHBondContact O-N 2.89Å; D38-K60 IonicContact OD1-NZ 3.6Å; D38-K60 PolarHBondContact OD1-NZ 2.94Å
39	S	92.3	Very high	72.7	Confident	31 Å²	31	79.1 Å²	79.1	22%	0.217	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	158.9	168.8	79.7	0	0	0	0	112.5	D37 I58	D37-S39 VanDerWaalsContact CG-OG 3.28Å; D37-S39 VanDerWaalsContact OD1-CB 3.25Å; D37-S39 WeakPolarHBondContact OD1-CB 2.87Å; D37-S39 PolarHBondContact OD1-N 3.19Å; D37-S39 PolarHBondContact OD1-OG 2.98Å; D37-S39 PolarHBondContact OD2-OG 2.99Å; S39-I58 CarbonylContact C-O 3.57Å; S39-I58 WeakPolarHBondContact CA-O 3.25Å
40	I	92.8	Very high	74.2	Confident	18 Å²	18	76 Å²	76	9%	0.092	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	146.4	166	55.2	168.7	0	0	0	108.3	I58 K60 Y105 F114	I40-I58 HydrophobicContact CD1-CD1 3.97Å; I40-I58 HydrophobicContact CD1-CG1 3.92Å; I40-I58 HydrophobicContact CG1-CD1 4.14Å; I40-I58 HydrophobicContact CG1-CG1 3.53Å; I40-I58 PolarHBondContact N-O 3.42Å; I40-I58 PolarHBondContact O-N 2.84Å; I40-K60 HydrophobicContact CG2-CG 4.04Å; I40-Y105 HydrophobicContact CD1-CD2 4.3Å; I40-Y105 HydrophobicContact CG2-CD2 4.14Å; I40-F114 HydrophobicContact CD1-CD1 3.78Å; I40-F114 HydrophobicContact CD1-CE1 3.56Å; I40-F114 HydrophobicContact CD1-CZ 4.42Å
41	H	93.9	Very high	76.1	Confident	106 Å²	106	72.8 Å²	72.8	49%	0.491	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	123	172.9	-66.8	-91	0	0	0	109.5	T57 F114	H41-T57 PolarHBondContact CE1-OG1 3.24Å; H41-F114 WeakPolarHBondContact O-CB 3.39Å
42	C	96	Very high	78.3	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.5	177.1	-172.4	0	0	0	0	109.7	F56 I58 L67 F114	C42-F56 PolarHBondContact N-O 3.28Å; C42-F56 PolarHBondContact O-N 3.04Å; C42-I58 HydrophobicContact CB-CD1 4.14Å; C42-L67 HydrophobicContact CB-CD2 4.39Å; C42-F114 CarbonylContact C-O 3.56Å; C42-F114 WeakPolarHBondContact CA-O 3.44Å; C42-F114 PolarHBondContact SG-O 3.47Å
43	K	96.7	Very high	80.9	Confident	91 Å²	91	66.3 Å²	66.3	40%	0.396	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	132	176.9	-46.8	-158.8	-173.5	-148.2	0	110	P53 I54 E55 F114 V115 V116	K43-P53 HydrophobicContact CB-CB 4.12Å; K43-I54 CarbonylContact C-O 3.59Å; K43-I54 WeakPolarHBondContact CA-O 3.14Å; K43-E55 HydrophobicContact CD-CG 4.32Å; K43-E55 WeakPolarHBondContact CD-OE1 3.33Å; K43-E55 WeakPolarHBondContact CE-OE1 3.37Å; K43-E55 HydrophobicContact CG-CG 4.14Å; K43-E55 IonicContact NZ-OE1 2.63Å; K43-E55 PolarHBondContact NZ-OE1 3.36Å; K43-F114 PolarHBondContact N-O 2.88Å; K43-V115 HydrophobicContact CB-CG2 4.27Å; K43-V115 WeakPolarHBondContact O-CA 3.45Å; K43-V116 PolarHBondContact O-N 3.29Å
44	V	96.9	Very high	83.4	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	105.5	-178	-176.5	0	0	0	0	109	L46 P53 I54 F56 L67 V71 L86 V116 F118	V44-L46 HydrophobicContact CG1-CD2 4.22Å; V44-L46 PolarHBondContact O-N 2.85Å; V44-P53 WeakPolarHBondContact O-CA 3.4Å; V44-I54 PolarHBondContact N-O 3.39Å; V44-I54 PolarHBondContact O-N 3.14Å; V44-F56 HydrophobicContact CB-CD2 4.29Å; V44-F56 HydrophobicContact CB-CE2 4.06Å; V44-F56 HydrophobicContact CG2-CD2 3.55Å; V44-F56 HydrophobicContact CG2-CE2 3.71Å; V44-L67 HydrophobicContact CG2-CD1 4.41Å; V44-V71 HydrophobicContact CB-CG2 4.35Å; V44-V71 HydrophobicContact CG1-CG1 4.16Å; V44-V71 HydrophobicContact CG1-CG2 3.95Å; V44-V71 HydrophobicContact CG2-CG2 3.78Å; V44-L86 HydrophobicContact CG1-CD2 4Å; V44-V116 CarbonylContact C-O 3.58Å; V44-V116 WeakPolarHBondContact CA-O 3.3Å; V44-V116 HydrophobicContact CB-CG2 4.3Å; V44-V116 HydrophobicContact CG1-CG2 4.34Å; V44-V116 HydrophobicContact CG2-CG2 3.7Å; V44-F118 HydrophobicContact CG1-CB 4.25Å
45	R	95.7	Very high	86.1	Confident	43 Å²	43	59.3 Å²	59.3	16%	0.162	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	120.4	168.8	-76.7	175	176.9	158.6	4.9	108.4	P53 V115 V116 N117 F118 D546	R45-P53 HydrophobicContact CG-CB 4.25Å; R45-P53 HydrophobicContact CG-CG 3.86Å; R45-V115 HydrophobicContact CG-CG1 4.32Å; R45-V116 PolarHBondContact N-O 2.78Å; R45-N117 CarbonylContact O-C 3.58Å; R45-N117 WeakPolarHBondContact O-CA 3.26Å; R45-F118 PolarHBondContact O-N 2.91Å; R45-D546 IonicContact CZ-OD1 2.97Å; R45-D546 IonicContact CZ-OD2 3.18Å; R45-D546 IonicContact NH1-OD1 2.7Å; R45-D546 IonicContact NH1-OD2 2.75Å; R45-D546 PolarHBondContact NH1-OD2 3.44Å; R45-D546 IonicContact NH2-OD1 3.96Å; R45-D546 PolarHBondContact NH2-OD1 3.34Å; R45-D546 IonicContact NH2-OD2 2.74Å; R45-D546 PolarHBondContact NH2-OD2 3.21Å
46	L	93.7	Very high	88.4	Confident	13 Å²	13	52 Å²	52	7%	0.068	28%	0.275	C	S	.	.			trans	-80	-177.5	176.1	-70.3	-169.1	0	0	0	111.5	V44 D48 I54 I75 F118 R119	V44-L46 HydrophobicContact CG1-CD2 4.22Å; V44-L46 PolarHBondContact O-N 2.85Å; L46-D48 VanDerWaalsContact C-N 3.34Å; L46-I54 HydrophobicContact CD1-CD1 3.65Å; L46-I54 HydrophobicContact CD1-CG1 4.35Å; L46-I54 HydrophobicContact CD2-CD1 4.31Å; L46-I54 HydrophobicContact CG-CD1 4.04Å; L46-I54 HydrophobicContact CG-CG1 4.48Å; L46-I75 HydrophobicContact CD1-CG1 4.34Å; L46-I75 HydrophobicContact CD2-CD1 3.79Å; L46-I75 HydrophobicContact CD2-CG1 4.14Å; L46-F118 HydrophobicContact CD2-CB 3.87Å; L46-F118 HydrophobicContact CD2-CD1 4.38Å; L46-F118 HydrophobicContact CD2-CG 4.23Å; L46-R119 PolarHBondContact O-NH1 2.86Å
47	L	92.1	Very high	90.2	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.026	27%	0.267	C	S	.	.	S	Bend	trans	-68.6	-32.3	-176.1	-86.5	158.5	0	0	0	113.5	F84 F118 L139 L142 Q143	L47-F84 HydrophobicContact CD1-CE1 4.34Å; L47-F118 HydrophobicContact CD1-CD1 3.86Å; L47-F118 HydrophobicContact CD1-CE1 3.79Å; L47-F118 HydrophobicContact CG-CD1 4.11Å; L47-L139 HydrophobicContact CD1-CB 3.82Å; L47-L139 HydrophobicContact CD1-CD2 3.9Å; L47-L139 HydrophobicContact CD1-CG 4.43Å; L47-L139 WeakPolarHBondContact CD1-O 3.37Å; L47-L142 HydrophobicContact CB-CB 4.03Å; L47-L142 HydrophobicContact CB-CD1 4.23Å; L47-Q143 HydrophobicContact CD2-CB 3.75Å; L47-Q143 HydrophobicContact CD2-CG 4.31Å
48	D	85.5	Confident	91.2	Very high	15 Å²	15	45.6 Å²	45.6	8%	0.08	24%	0.24	C	C	.	.			trans	-82.2	108.7	168.2	175.8	12.1	0	0	0	109.4	L46 T50 Q51 L142 V471	L46-D48 VanDerWaalsContact C-N 3.34Å; D48-T50 PolarHBondContact O-N 3.44Å; D48-T50 WeakPolarHBondContact OD1-CA 3.47Å; D48-T50 VanDerWaalsContact OD1-CB 3.26Å; D48-T50 WeakPolarHBondContact OD1-CB 3.32Å; D48-T50 WeakPolarHBondContact OD1-CG2 3.37Å; D48-T50 PolarHBondContact OD1-N 2.75Å; D48-T50 PolarHBondContact OD1-OG1 2.74Å; D48-T50 PolarHBondContact OD2-OG1 2.93Å; D48-Q51 HydrophobicContact CB-CB 4.4Å; D48-Q51 WeakPolarHBondContact O-CB 3.13Å; D48-Q51 PolarHBondContact O-N 3.5Å; D48-L142 HydrophobicContact CB-CD1 4.45Å; D48-V471 VanDerWaalsContact OD2-CG1 3.25Å; D48-V471 WeakPolarHBondContact OD2-CG1 3.49Å
49	D	77	Confident	91.5	Very high	72 Å²	72	47.6 Å²	47.6	39%	0.385	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-8.4	176.6	-74.4	-8.6	0	0	0	112.6	Q51 R119 R146	D49-Q51 VanDerWaalsContact C-N 3.32Å; D49-R119 IonicContact OD1-NH2 3.68Å; D49-R119 PolarHBondContact OD1-NH2 3.06Å; D49-R119 VanDerWaalsContact OD1-NH2 3.08Å; D49-R146 IonicContact OD1-CZ 2.79Å; D49-R146 IonicContact OD1-NH1 2.82Å; D49-R146 PolarHBondContact OD1-NH1 3.35Å; D49-R146 IonicContact OD1-NH2 3.5Å; D49-R146 PolarHBondContact OD1-NH2 3.48Å; D49-R146 IonicContact OD2-CZ 3.72Å; D49-R146 IonicContact OD2-NH1 2.78Å; D49-R146 PolarHBondContact OD2-NH1 3.03Å; D49-R146 IonicContact OD2-NH2 3.26Å; D49-R146 PolarHBondContact OD2-NH2 3.33Å
50	T	75	Confident	91.7	Very high	46 Å²	46	48.8 Å²	48.8	28%	0.282	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-22.3	172.2	79	0	0	0	0	112.4	D48	D48-T50 PolarHBondContact O-N 3.44Å; D48-T50 WeakPolarHBondContact OD1-CA 3.47Å; D48-T50 VanDerWaalsContact OD1-CB 3.26Å; D48-T50 WeakPolarHBondContact OD1-CB 3.32Å; D48-T50 WeakPolarHBondContact OD1-CG2 3.37Å; D48-T50 PolarHBondContact OD1-N 2.75Å; D48-T50 PolarHBondContact OD1-OG1 2.74Å; D48-T50 PolarHBondContact OD2-OG1 2.93Å
51	Q	81.4	Confident	91.8	Very high	48 Å²	48	52 Å²	52	22%	0.224	28%	0.275	C	S	.	.	S	Bend	trans	-78.6	135.7	-179.7	-169.2	176.3	15.7	0	0	112	D48 D49	D48-Q51 HydrophobicContact CB-CB 4.4Å; D48-Q51 WeakPolarHBondContact O-CB 3.13Å; D48-Q51 PolarHBondContact O-N 3.5Å; D49-Q51 VanDerWaalsContact C-N 3.32Å
52	T	87.6	Confident	91.9	Very high	106 Å²	106	48.6 Å²	48.6	65%	0.65	26%	0.26	S	S	*	.	P	Polyproline II helix	trans	-59.4	135	172.6	52.5	0	0	0	0	111.1	I54	T52-I54 PolarHBondContact O-N 3.26Å
53	P	93	Very high	92	Very high	46 Å²	46	50 Å²	50	30%	0.299	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-56.3	137.9	177.9	-23.1	32.3	0	0	0	112.4	K43 V44 R45	K43-P53 HydrophobicContact CB-CB 4.12Å; V44-P53 WeakPolarHBondContact O-CA 3.4Å; R45-P53 HydrophobicContact CG-CB 4.25Å; R45-P53 HydrophobicContact CG-CG 3.86Å
54	I	94	Very high	92	Very high	27 Å²	27	45.7 Å²	45.7	14%	0.138	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	130.3	175.9	-51.1	171.8	0	0	0	108.9	K43 V44 L46 T52 F56 L495	K43-I54 CarbonylContact C-O 3.59Å; K43-I54 WeakPolarHBondContact CA-O 3.14Å; V44-I54 PolarHBondContact N-O 3.39Å; V44-I54 PolarHBondContact O-N 3.14Å; L46-I54 HydrophobicContact CD1-CD1 3.65Å; L46-I54 HydrophobicContact CD1-CG1 4.35Å; L46-I54 HydrophobicContact CD2-CD1 4.31Å; L46-I54 HydrophobicContact CG-CD1 4.04Å; L46-I54 HydrophobicContact CG-CG1 4.48Å; T52-I54 PolarHBondContact O-N 3.26Å; I54-F56 HydrophobicContact CB-CD2 4.42Å; I54-F56 HydrophobicContact CB-CE2 3.72Å; I54-F56 HydrophobicContact CB-CZ 4.27Å; I54-F56 HydrophobicContact CG2-CD2 4.06Å; I54-F56 HydrophobicContact CG2-CE1 4.34Å; I54-F56 HydrophobicContact CG2-CE2 3.41Å; I54-F56 VanDerWaalsContact CG2-CE2 3.41Å; I54-F56 HydrophobicContact CG2-CZ 3.58Å; I54-L495 HydrophobicContact CD1-CD1 3.45Å; I54-L495 VanDerWaalsContact CD1-CD1 3.45Å; I54-L495 HydrophobicContact CG1-CD1 4.17Å
55	E	95.7	Very high	91.9	Very high	104 Å²	104	48.3 Å²	48.3	49%	0.486	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	130.7	176.4	-54.2	-161.3	167.6	0	0	111.6	K43	K43-E55 HydrophobicContact CD-CG 4.32Å; K43-E55 WeakPolarHBondContact CD-OE1 3.33Å; K43-E55 WeakPolarHBondContact CE-OE1 3.37Å; K43-E55 HydrophobicContact CG-CG 4.14Å; K43-E55 IonicContact NZ-OE1 2.63Å; K43-E55 PolarHBondContact NZ-OE1 3.36Å
56	F	96.5	Very high	92	Very high	12 Å²	12	48.7 Å²	48.7	5%	0.053	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	125	176.3	-66	-88.8	0	0	0	110.9	C42 V44 I54 I58 L67 K70 V71	C42-F56 PolarHBondContact N-O 3.28Å; C42-F56 PolarHBondContact O-N 3.04Å; V44-F56 HydrophobicContact CB-CD2 4.29Å; V44-F56 HydrophobicContact CB-CE2 4.06Å; V44-F56 HydrophobicContact CG2-CD2 3.55Å; V44-F56 HydrophobicContact CG2-CE2 3.71Å; I54-F56 HydrophobicContact CB-CD2 4.42Å; I54-F56 HydrophobicContact CB-CE2 3.72Å; I54-F56 HydrophobicContact CB-CZ 4.27Å; I54-F56 HydrophobicContact CG2-CD2 4.06Å; I54-F56 HydrophobicContact CG2-CE1 4.34Å; I54-F56 HydrophobicContact CG2-CE2 3.41Å; I54-F56 VanDerWaalsContact CG2-CE2 3.41Å; I54-F56 HydrophobicContact CG2-CZ 3.58Å; F56-I58 HydrophobicContact CB-CG2 4.5Å; F56-L67 HydrophobicContact CB-CD1 3.87Å; F56-L67 HydrophobicContact CD2-CD1 4.22Å; F56-L67 HydrophobicContact CG-CD1 4.11Å; F56-K70 HydrophobicContact CD1-CB 3.83Å; F56-K70 HydrophobicContact CD1-CD 4.29Å; F56-K70 HydrophobicContact CE1-CB 3.81Å; F56-V71 HydrophobicContact CD2-CG2 4.23Å; F56-V71 HydrophobicContact CE2-CG2 3.64Å; F56-V71 HydrophobicContact CZ-CG2 3.92Å
57	T	95.9	Very high	92.2	Very high	73 Å²	73	48.1 Å²	48.1	45%	0.448	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	125.3	165.3	-46.9	0	0	0	0	109.6	H41 K70	H41-T57 PolarHBondContact CE1-OG1 3.24Å; T57-K70 PolarHBondContact O-NZ 3.19Å
58	I	94.9	Very high	92.4	Very high	3 Å²	3	48.4 Å²	48.4	2%	0.015	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	153.3	176.2	63.5	-178.3	0	0	0	109.3	S39 I40 C42 F56 D62 L67 K70 V104	S39-I58 CarbonylContact C-O 3.57Å; S39-I58 WeakPolarHBondContact CA-O 3.25Å; I40-I58 HydrophobicContact CD1-CD1 3.97Å; I40-I58 HydrophobicContact CD1-CG1 3.92Å; I40-I58 HydrophobicContact CG1-CD1 4.14Å; I40-I58 HydrophobicContact CG1-CG1 3.53Å; I40-I58 PolarHBondContact N-O 3.42Å; I40-I58 PolarHBondContact O-N 2.84Å; C42-I58 HydrophobicContact CB-CD1 4.14Å; F56-I58 HydrophobicContact CB-CG2 4.5Å; I58-D62 WeakPolarHBondContact CA-OD2 3.25Å; I58-D62 HydrophobicContact CB-CB 4.25Å; I58-L67 HydrophobicContact CD1-CD2 4.28Å; I58-L67 HydrophobicContact CG2-CB 4.42Å; I58-L67 HydrophobicContact CG2-CD1 4.06Å; I58-K70 HydrophobicContact CG2-CD 4.36Å; I58-V104 HydrophobicContact CD1-CB 3.63Å; I58-V104 HydrophobicContact CD1-CG1 3.63Å; I58-V104 HydrophobicContact CD1-CG2 3.88Å
59	K	95.6	Very high	93	Very high	140 Å²	140	54.1 Å²	54.1	61%	0.609	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	152.5	174.7	-59.1	-178.5	178.7	-175.8	0	110.1	D38 A61 D62	D38-K59 CarbonylContact O-C 3.45Å; D38-K59 WeakPolarHBondContact O-CA 3.23Å; K59-A61 PolarHBondContact O-N 3.25Å; K59-A61 VanDerWaalsContact O-N 3.09Å; K59-D62 PolarHBondContact N-OD2 3.22Å; K59-D62 WeakPolarHBondContact O-CB 3.32Å; K59-D62 PolarHBondContact O-N 2.96Å
60	K	95.3	Very high	93.9	Very high	56 Å²	56	54.1 Å²	54.1	24%	0.243	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-28.1	174.1	-66.8	171	-160.2	149.9	0	112.9	D37 D38 I40 S103 Y105	D37-K60 WeakPolarHBondContact O-CE 3.2Å; D37-K60 PolarHBondContact O-NZ 3.44Å; D38-K60 WeakPolarHBondContact O-CG 3.28Å; D38-K60 PolarHBondContact O-N 2.89Å; D38-K60 IonicContact OD1-NZ 3.6Å; D38-K60 PolarHBondContact OD1-NZ 2.94Å; I40-K60 HydrophobicContact CG2-CG 4.04Å; K60-S103 PolarHBondContact O-OG 3.08Å; K60-Y105 HydrophobicContact CB-CD1 4.15Å; K60-Y105 HydrophobicContact CB-CG 4.03Å; K60-Y105 HydrophobicContact CG-CD1 4.28Å; K60-Y105 HydrophobicContact CG-CD2 4.05Å; K60-Y105 HydrophobicContact CG-CE2 4.47Å; K60-Y105 HydrophobicContact CG-CG 3.94Å
61	A	95.3	Very high	94.9	Very high	87 Å²	87	51.9 Å²	51.9	72%	0.719	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-19.3	175.1	0	0	0	0	0	114.4	K59 S63	K59-A61 PolarHBondContact O-N 3.25Å; K59-A61 VanDerWaalsContact O-N 3.09Å; A61-S63 PolarHBondContact O-N 3.38Å
62	D	97.1	Very high	95.6	Very high	34 Å²	34	50 Å²	50	18%	0.182	27%	0.274	C	S	.	.			trans	-65.1	132.6	-174.8	-71.2	-11.5	0	0	0	111.1	I58 K59 V66 S103 V104	I58-D62 WeakPolarHBondContact CA-OD2 3.25Å; I58-D62 HydrophobicContact CB-CB 4.25Å; K59-D62 PolarHBondContact N-OD2 3.22Å; K59-D62 WeakPolarHBondContact O-CB 3.32Å; K59-D62 PolarHBondContact O-N 2.96Å; D62-V66 HydrophobicContact CB-CB 4.17Å; D62-V66 HydrophobicContact CB-CG1 4.22Å; D62-S103 WeakPolarHBondContact O-CA 3.37Å; D62-V104 PolarHBondContact O-N 3.42Å
63	S	96.6	Very high	95.9	Very high	30 Å²	30	49.5 Å²	49.5	21%	0.21	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-77.4	160.2	177.1	54.5	0	0	0	0	112.6	A61 S65 V66 L67 L100 K102	A61-S63 PolarHBondContact O-N 3.38Å; S63-S65 PolarHBondContact O-N 3.2Å; S63-S65 VanDerWaalsContact O-N 3.12Å; S63-S65 PolarHBondContact OG-OG 3.26Å; S63-V66 WeakPolarHBondContact O-CB 3.35Å; S63-V66 PolarHBondContact O-N 3.03Å; S63-L67 PolarHBondContact O-N 2.79Å; S63-L100 WeakPolarHBondContact CB-O 3.08Å; S63-K102 CarbonylContact C-O 3.52Å; S63-K102 VanDerWaalsContact CA-O 3.26Å; S63-K102 WeakPolarHBondContact CA-O 3.35Å
64	G	96.5	Very high	95.8	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-53.5	-32.5	175.5	0	0	0	0	0	113.2	V66 L67 F68 L100 K102	G64-V66 VanDerWaalsContact C-N 3.33Å; G64-V66 PolarHBondContact O-N 2.93Å; G64-L67 PolarHBondContact O-N 2.89Å; G64-F68 VanDerWaalsContact O-CB 3.24Å; G64-F68 WeakPolarHBondContact O-CB 3.49Å; G64-F68 PolarHBondContact O-N 2.79Å; G64-L100 PolarHBondContact N-O 3.19Å; G64-K102 PolarHBondContact N-O 3.26Å
65	S	96.1	Very high	95.6	Very high	54 Å²	54	47.8 Å²	47.8	38%	0.378	25%	0.254	S	S	.	.	H	α-helix	trans	-61.1	-33.4	173.1	57.3	0	0	0	0	114.4	S63 K69 L100	S63-S65 PolarHBondContact O-N 3.2Å; S63-S65 VanDerWaalsContact O-N 3.12Å; S63-S65 PolarHBondContact OG-OG 3.26Å; S65-K69 VanDerWaalsContact O-CB 3.25Å; S65-K69 WeakPolarHBondContact O-CB 3.22Å; S65-K69 PolarHBondContact O-N 3.47Å; S65-L100 WeakPolarHBondContact CB-O 3.49Å; S65-L100 PolarHBondContact N-O 3.46Å; S65-L100 PolarHBondContact OG-O 2.89Å
66	V	97	Very high	95.1	Very high	52 Å²	52	43.6 Å²	43.6	32%	0.315	24%	0.239	S	C	.	.	H	α-helix	trans	-71	-47	177.8	176.6	0	0	0	0	110.4	D62 S63 G64 K70	D62-V66 HydrophobicContact CB-CB 4.17Å; D62-V66 HydrophobicContact CB-CG1 4.22Å; S63-V66 WeakPolarHBondContact O-CB 3.35Å; S63-V66 PolarHBondContact O-N 3.03Å; G64-V66 VanDerWaalsContact C-N 3.33Å; G64-V66 PolarHBondContact O-N 2.93Å; V66-K70 WeakPolarHBondContact O-CG 3.42Å; V66-K70 PolarHBondContact O-N 3.17Å; V66-K70 VanDerWaalsContact O-N 3.13Å
67	L	97.7	Very high	94.7	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62.6	-48.3	175.2	176.3	61.7	0	0	0	110.9	C42 V44 F56 I58 S63 G64 K69 K70 V71 L86 L98 V104 V116	C42-L67 HydrophobicContact CB-CD2 4.39Å; V44-L67 HydrophobicContact CG2-CD1 4.41Å; F56-L67 HydrophobicContact CB-CD1 3.87Å; F56-L67 HydrophobicContact CD2-CD1 4.22Å; F56-L67 HydrophobicContact CG-CD1 4.11Å; I58-L67 HydrophobicContact CD1-CD2 4.28Å; I58-L67 HydrophobicContact CG2-CB 4.42Å; I58-L67 HydrophobicContact CG2-CD1 4.06Å; S63-L67 PolarHBondContact O-N 2.79Å; G64-L67 PolarHBondContact O-N 2.89Å; L67-K69 VanDerWaalsContact C-N 3.34Å; L67-K69 PolarHBondContact O-N 3.37Å; L67-K70 WeakPolarHBondContact O-CB 3.46Å; L67-K70 PolarHBondContact O-N 2.92Å; L67-V71 HydrophobicContact CD1-CG2 4.36Å; L67-V71 WeakPolarHBondContact O-CG2 3.44Å; L67-V71 PolarHBondContact O-N 3.22Å; L67-L86 HydrophobicContact CD2-CD1 3.91Å; L67-L86 HydrophobicContact CG-CD1 3.84Å; L67-L98 HydrophobicContact CD2-CD2 4.13Å; L67-V104 HydrophobicContact CB-CG2 4.06Å; L67-V104 HydrophobicContact CD2-CG1 4.05Å; L67-V104 HydrophobicContact CD2-CG2 4.11Å; L67-V116 HydrophobicContact CD2-CG2 4.4Å
68	F	97.6	Very high	94.5	Very high	12 Å²	12	43.4 Å²	43.4	5%	0.053	24%	0.236	C	C	.	.	H	α-helix	trans	-62.4	-40.1	-178.5	-173.1	-129.6	0	0	0	112.2	G64 V71 C72 Y81 F84 L86 L100 F118	G64-F68 VanDerWaalsContact O-CB 3.24Å; G64-F68 WeakPolarHBondContact O-CB 3.49Å; G64-F68 PolarHBondContact O-N 2.79Å; F68-V71 PolarHBondContact O-N 2.81Å; F68-C72 PolarHBondContact O-N 3.36Å; F68-C72 PolarHBondContact O-SG 2.85Å; F68-Y81 AromaticContact CE1-CD2 3.97Å; F68-Y81 HydrophobicContact CE1-CD2 3.97Å; F68-Y81 WeakPolarHBondContact CZ-O 3.28Å; F68-F84 HydrophobicContact CZ-CB 4.33Å; F68-L86 HydrophobicContact CB-CD1 4.13Å; F68-L86 HydrophobicContact CD2-CD1 4.11Å; F68-L86 HydrophobicContact CD2-CD2 4.5Å; F68-L86 HydrophobicContact CD2-CG 3.82Å; F68-L86 HydrophobicContact CE2-CG 4.49Å; F68-L100 HydrophobicContact CB-CD2 3.84Å; F68-L100 HydrophobicContact CD1-CD1 4.07Å; F68-L100 HydrophobicContact CD1-CD2 4.07Å; F68-L100 HydrophobicContact CE1-CD1 4.49Å; F68-L100 HydrophobicContact CG-CD2 4.12Å; F68-F118 HydrophobicContact CE2-CD2 4.2Å; F68-F118 AromaticContact CE2-CE2 3.91Å; F68-F118 HydrophobicContact CE2-CE2 3.91Å
69	K	96.4	Very high	94.5	Very high	135 Å²	135	45 Å²	45	59%	0.587	25%	0.245	S	C	*	.	H	α-helix	trans	-60.9	-46.4	173.3	-174.2	176.5	179.9	179.6	0	112	S65 L67 V71 C72 Q73	S65-K69 VanDerWaalsContact O-CB 3.25Å; S65-K69 WeakPolarHBondContact O-CB 3.22Å; S65-K69 PolarHBondContact O-N 3.47Å; L67-K69 VanDerWaalsContact C-N 3.34Å; L67-K69 PolarHBondContact O-N 3.37Å; K69-V71 VanDerWaalsContact C-N 3.27Å; K69-V71 PolarHBondContact O-N 3.35Å; K69-C72 PolarHBondContact O-N 3.15Å; K69-Q73 HydrophobicContact CG-CG 4.46Å; K69-Q73 WeakPolarHBondContact O-CB 3.43Å; K69-Q73 VanDerWaalsContact O-CG 3.24Å; K69-Q73 WeakPolarHBondContact O-CG 3.43Å; K69-Q73 PolarHBondContact O-N 3.33Å
70	K	96.7	Very high	94.4	Very high	71 Å²	71	38.3 Å²	38.3	31%	0.309	22%	0.216	S	C	.	.	H	α-helix	trans	-56.6	-41.7	175.2	-74.5	173.2	170.6	175.5	0	111.7	F56 T57 I58 V66 L67 S74	F56-K70 HydrophobicContact CD1-CB 3.83Å; F56-K70 HydrophobicContact CD1-CD 4.29Å; F56-K70 HydrophobicContact CE1-CB 3.81Å; T57-K70 PolarHBondContact O-NZ 3.19Å; I58-K70 HydrophobicContact CG2-CD 4.36Å; V66-K70 WeakPolarHBondContact O-CG 3.42Å; V66-K70 PolarHBondContact O-N 3.17Å; V66-K70 VanDerWaalsContact O-N 3.13Å; L67-K70 WeakPolarHBondContact O-CB 3.46Å; L67-K70 PolarHBondContact O-N 2.92Å; K70-S74 PolarHBondContact O-N 3.41Å
71	V	96.6	Very high	94.4	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.7	-52.1	176.3	174	0	0	0	0	111.5	V44 F56 L67 F68 K69 Q73 S74 I75 L86 F118	V44-V71 HydrophobicContact CB-CG2 4.35Å; V44-V71 HydrophobicContact CG1-CG1 4.16Å; V44-V71 HydrophobicContact CG1-CG2 3.95Å; V44-V71 HydrophobicContact CG2-CG2 3.78Å; F56-V71 HydrophobicContact CD2-CG2 4.23Å; F56-V71 HydrophobicContact CE2-CG2 3.64Å; F56-V71 HydrophobicContact CZ-CG2 3.92Å; L67-V71 HydrophobicContact CD1-CG2 4.36Å; L67-V71 WeakPolarHBondContact O-CG2 3.44Å; L67-V71 PolarHBondContact O-N 3.22Å; F68-V71 PolarHBondContact O-N 2.81Å; K69-V71 VanDerWaalsContact C-N 3.27Å; K69-V71 PolarHBondContact O-N 3.35Å; V71-Q73 VanDerWaalsContact C-N 3.27Å; V71-Q73 PolarHBondContact O-N 3.37Å; V71-S74 PolarHBondContact O-N 2.87Å; V71-S74 PolarHBondContact O-OG 2.64Å; V71-I75 HydrophobicContact CG1-CD1 3.68Å; V71-I75 HydrophobicContact CG1-CG1 4.5Å; V71-I75 WeakPolarHBondContact O-CG1 3.48Å; V71-I75 PolarHBondContact O-N 3.17Å; V71-I75 VanDerWaalsContact O-N 3.11Å; V71-L86 HydrophobicContact CG1-CD2 4.39Å; V71-L86 HydrophobicContact CG2-CD1 4.44Å; V71-L86 HydrophobicContact CG2-CD2 4.38Å; V71-F118 HydrophobicContact CG1-CD2 3.69Å; V71-F118 HydrophobicContact CG1-CE2 4.24Å; V71-F118 HydrophobicContact CG1-CG 4.31Å
72	C	95.5	Very high	94.5	Very high	8 Å²	8	36.5 Å²	36.5	5%	0.054	19%	0.191	C	C	.	.	H	α-helix	trans	-60.7	-35.4	180	-64.2	0	0	0	0	112.9	F68 K69 D77 L78 Y81	F68-C72 PolarHBondContact O-N 3.36Å; F68-C72 PolarHBondContact O-SG 2.85Å; K69-C72 PolarHBondContact O-N 3.15Å; C72-D77 PolarHBondContact O-N 3.11Å; C72-L78 HydrophobicContact CB-CB 4.31Å; C72-L78 PolarHBondContact O-N 3.26Å; C72-L78 VanDerWaalsContact O-N 3.1Å; C72-Y81 VanDerWaalsContact SG-CB 3.59Å
73	Q	93.5	Very high	94.5	Very high	95 Å²	95	34.9 Å²	34.9	44%	0.444	18%	0.182	S	C	.	.	H	α-helix	trans	-64	-47.2	171.9	-69.4	177.5	-53.2	0	0	111.3	K69 V71 I75 G76 D77	K69-Q73 HydrophobicContact CG-CG 4.46Å; K69-Q73 WeakPolarHBondContact O-CB 3.43Å; K69-Q73 VanDerWaalsContact O-CG 3.24Å; K69-Q73 WeakPolarHBondContact O-CG 3.43Å; K69-Q73 PolarHBondContact O-N 3.33Å; V71-Q73 VanDerWaalsContact C-N 3.27Å; V71-Q73 PolarHBondContact O-N 3.37Å; Q73-I75 PolarHBondContact O-N 3.37Å; Q73-G76 PolarHBondContact O-N 3.14Å; Q73-G76 VanDerWaalsContact O-N 3.1Å; Q73-D77 WeakPolarHBondContact CG-OD1 3.48Å; Q73-D77 PolarHBondContact O-N 2.93Å
74	S	91.6	Very high	94.6	Very high	22 Å²	22	33.6 Å²	33.6	15%	0.154	17%	0.173	C	C	.	.	H	α-helix	trans	-63	-25.8	-179.9	73.4	0	0	0	0	114.7	K70 V71 G76 L495	K70-S74 PolarHBondContact O-N 3.41Å; V71-S74 PolarHBondContact O-N 2.87Å; V71-S74 PolarHBondContact O-OG 2.64Å; S74-G76 VanDerWaalsContact C-N 3.3Å; S74-L495 WeakPolarHBondContact O-CD2 3.34Å
75	I	89.7	Confident	94.6	Very high	15 Å²	15	33.9 Å²	33.9	8%	0.077	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-9.6	179	-66	167.5	0	0	0	112.1	L46 V71 Q73 F118 I135 L139	L46-I75 HydrophobicContact CD1-CG1 4.34Å; L46-I75 HydrophobicContact CD2-CD1 3.79Å; L46-I75 HydrophobicContact CD2-CG1 4.14Å; V71-I75 HydrophobicContact CG1-CD1 3.68Å; V71-I75 HydrophobicContact CG1-CG1 4.5Å; V71-I75 WeakPolarHBondContact O-CG1 3.48Å; V71-I75 PolarHBondContact O-N 3.17Å; V71-I75 VanDerWaalsContact O-N 3.11Å; Q73-I75 PolarHBondContact O-N 3.37Å; I75-F118 HydrophobicContact CD1-CD1 3.93Å; I75-F118 HydrophobicContact CD1-CD2 3.97Å; I75-F118 HydrophobicContact CD1-CE1 3.76Å; I75-F118 HydrophobicContact CD1-CE2 3.79Å; I75-F118 HydrophobicContact CD1-CG 4.03Å; I75-F118 HydrophobicContact CD1-CZ 3.69Å; I75-I135 HydrophobicContact CG2-CD1 4.39Å; I75-I135 HydrophobicContact CG2-CG1 4.48Å; I75-L139 HydrophobicContact CG2-CD1 3.95Å; I75-L139 HydrophobicContact CG2-CD2 4.21Å
76	G	85.7	Confident	94.7	Very high	16 Å²	16	31.4 Å²	31.4	17%	0.165	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	119.2	42.7	-179.8	0	0	0	0	0	113.4	Q73 S74 L78	Q73-G76 PolarHBondContact O-N 3.14Å; Q73-G76 VanDerWaalsContact O-N 3.1Å; S74-G76 VanDerWaalsContact C-N 3.3Å; G76-L78 VanDerWaalsContact C-N 3.31Å; G76-L78 PolarHBondContact O-N 3.09Å
77	D	87.6	Confident	94.7	Very high	78 Å²	78	30.1 Å²	30.1	42%	0.417	15%	0.148	S	C	.	.			trans	49.8	46.3	-177.6	-67.4	-54.3	0	0	0	113.9	C72 Q73 V79 Q466	C72-D77 PolarHBondContact O-N 3.11Å; Q73-D77 WeakPolarHBondContact CG-OD1 3.48Å; Q73-D77 PolarHBondContact O-N 2.93Å; D77-V79 PolarHBondContact O-N 2.74Å; D77-V79 VanDerWaalsContact O-N 3.08Å; D77-Q466 PolarHBondContact OD2-NE2 3.47Å
78	L	92.4	Very high	94.6	Very high	4 Å²	4	31.2 Å²	31.2	2%	0.021	15%	0.152	C	C	.	.			trans	-49.6	112	-176.3	177.7	64.4	0	0	0	112.1	C72 G76 Y81 F84 F118 I135 L139	C72-L78 HydrophobicContact CB-CB 4.31Å; C72-L78 PolarHBondContact O-N 3.26Å; C72-L78 VanDerWaalsContact O-N 3.1Å; G76-L78 VanDerWaalsContact C-N 3.31Å; G76-L78 PolarHBondContact O-N 3.09Å; L78-Y81 WeakPolarHBondContact O-CD1 3.39Å; L78-F84 HydrophobicContact CD1-CE2 4.35Å; L78-F84 HydrophobicContact CD2-CD2 3.75Å; L78-F84 HydrophobicContact CD2-CE2 3.96Å; L78-F84 HydrophobicContact CD2-CG 4.24Å; L78-F118 HydrophobicContact CD2-CZ 3.85Å; L78-I135 HydrophobicContact CD1-CG1 4.47Å; L78-I135 HydrophobicContact CD1-CG2 4.13Å; L78-L139 HydrophobicContact CD1-CD1 4Å; L78-L139 HydrophobicContact CD2-CD1 3.94Å
79	V	93.3	Very high	94.4	Very high	35 Å²	35	34 Å²	34	21%	0.212	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-34.6	-174.9	-179.4	0	0	0	0	111.7	D77 Y81 R448 I460 L463	D77-V79 PolarHBondContact O-N 2.74Å; D77-V79 VanDerWaalsContact O-N 3.08Å; V79-Y81 WeakPolarHBondContact O-CD1 3.26Å; V79-Y81 PolarHBondContact O-N 3.36Å; V79-R448 PolarHBondContact O-NH2 3.38Å; V79-I460 HydrophobicContact CB-CG2 4.25Å; V79-I460 HydrophobicContact CG1-CG1 4.08Å; V79-I460 HydrophobicContact CG1-CG2 3.92Å; V79-L463 HydrophobicContact CB-CD1 4.45Å; V79-L463 HydrophobicContact CG1-CD1 3.91Å; V79-L463 HydrophobicContact CG2-CD1 3.83Å
80	E	95.2	Very high	94.2	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.005	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	33.6	-176.4	-57.5	175.3	107.8	0	0	111.9	D82 Y83 L131 A132 Q133 S136 I460	E80-D82 PolarHBondContact O-N 3.26Å; E80-Y83 HydrophobicContact CB-CD2 4.15Å; E80-Y83 HydrophobicContact CB-CE2 4.5Å; E80-Y83 PolarHBondContact O-N 3.3Å; E80-L131 WeakPolarHBondContact OE1-CA 3.49Å; E80-A132 PolarHBondContact OE1-N 3.44Å; E80-A132 PolarHBondContact OE2-N 2.78Å; E80-Q133 WeakPolarHBondContact OE2-CB 3.5Å; E80-Q133 PolarHBondContact OE2-N 3.48Å; E80-S136 WeakPolarHBondContact OE2-CB 3.36Å; E80-S136 PolarHBondContact OE2-OG 3.43Å; E80-I460 HydrophobicContact CG-CG2 3.86Å
81	Y	95.6	Very high	93.9	Very high	92 Å²	92	31.4 Å²	31.4	36%	0.361	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-58.6	-21.2	-173.2	60.6	-102.2	0	0	0	114.5	F68 C72 L78 V79 Y83 F84	F68-Y81 AromaticContact CE1-CD2 3.97Å; F68-Y81 HydrophobicContact CE1-CD2 3.97Å; F68-Y81 WeakPolarHBondContact CZ-O 3.28Å; C72-Y81 VanDerWaalsContact SG-CB 3.59Å; L78-Y81 WeakPolarHBondContact O-CD1 3.39Å; V79-Y81 WeakPolarHBondContact O-CD1 3.26Å; V79-Y81 PolarHBondContact O-N 3.36Å; Y81-Y83 PolarHBondContact O-N 3.1Å; Y81-F84 WeakPolarHBondContact O-CA 3.37Å; Y81-F84 WeakPolarHBondContact O-CB 3.38Å; Y81-F84 PolarHBondContact O-N 2.72Å
82	D	96.5	Very high	93.5	Very high	12 Å²	12	35.2 Å²	35.2	6%	0.064	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-62.7	-25.7	-179.4	-59.2	-84.4	0	0	0	112.9	E80 F84 H122 F418 G447 R448 L453	E80-D82 PolarHBondContact O-N 3.26Å; D82-F84 PolarHBondContact O-N 3.31Å; D82-H122 PolarHBondContact O-CD2 3.35Å; D82-H122 VanDerWaalsContact O-CD2 3.28Å; D82-F418 HydrophobicContact CB-CE2 4.03Å; D82-G447 WeakPolarHBondContact OD1-CA 3.44Å; D82-R448 PolarHBondContact OD1-N 2.92Å; D82-R448 IonicContact OD2-CZ 2.68Å; D82-R448 IonicContact OD2-NE 3.07Å; D82-R448 PolarHBondContact OD2-NE 3.49Å; D82-R448 IonicContact OD2-NH2 2.75Å; D82-R448 PolarHBondContact OD2-NH2 3Å; D82-L453 HydrophobicContact CB-CD1 4.09Å
83	Y	97.3	Very high	93.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-70	-12	172.4	-69.5	-74.2	0	0	0	113.4	E80 Y81 K121 H122 P124 D130 L131 F418 Q450 L453	E80-Y83 HydrophobicContact CB-CD2 4.15Å; E80-Y83 HydrophobicContact CB-CE2 4.5Å; E80-Y83 PolarHBondContact O-N 3.3Å; Y81-Y83 PolarHBondContact O-N 3.1Å; Y83-K121 PolarHBondContact O-N 3.49Å; Y83-H122 HydrophobicContact CD1-CB 4.2Å; Y83-H122 WeakPolarHBondContact CD1-O 3.35Å; Y83-H122 PolarHBondContact O-N 2.79Å; Y83-P124 HydrophobicContact CE1-CB 4Å; Y83-D130 PolarHBondContact OH-O 2.96Å; Y83-L131 HydrophobicContact CD2-CD2 3.45Å; Y83-L131 VanDerWaalsContact CD2-CD2 3.45Å; Y83-L131 HydrophobicContact CE2-CD2 3.3Å; Y83-L131 HydrophobicContact CG-CD2 4.14Å; Y83-F418 AromaticContact CD1-CE1 3.95Å; Y83-F418 HydrophobicContact CD1-CE1 3.95Å; Y83-F418 AromaticContact CD1-CZ 3.61Å; Y83-F418 HydrophobicContact CD1-CZ 3.61Å; Y83-F418 AromaticContact CE1-CE1 3.74Å; Y83-F418 HydrophobicContact CE1-CE1 3.74Å; Y83-F418 AromaticContact CE1-CZ 3.55Å; Y83-F418 HydrophobicContact CE1-CZ 3.55Å; Y83-F418 HydrophobicContact CG-CZ 4.28Å; Y83-Q450 HydrophobicContact CE1-CG 4.44Å; Y83-L453 HydrophobicContact CD2-CD1 4.13Å; Y83-L453 HydrophobicContact CE2-CD1 3.68Å
84	F	97.8	Very high	93.1	Very high	3 Å²	3	36.2 Å²	36.2	1%	0.013	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	170.5	-172	-57.6	-91.3	0	0	0	112.1	L47 F68 L78 Y81 D82 F118 R119 V120 L139 V140	L47-F84 HydrophobicContact CD1-CE1 4.34Å; F68-F84 HydrophobicContact CZ-CB 4.33Å; L78-F84 HydrophobicContact CD1-CE2 4.35Å; L78-F84 HydrophobicContact CD2-CD2 3.75Å; L78-F84 HydrophobicContact CD2-CE2 3.96Å; L78-F84 HydrophobicContact CD2-CG 4.24Å; Y81-F84 WeakPolarHBondContact O-CA 3.37Å; Y81-F84 WeakPolarHBondContact O-CB 3.38Å; Y81-F84 PolarHBondContact O-N 2.72Å; D82-F84 PolarHBondContact O-N 3.31Å; F84-F118 HydrophobicContact CB-CE1 4.35Å; F84-F118 HydrophobicContact CB-CE2 3.73Å; F84-F118 HydrophobicContact CB-CZ 3.55Å; F84-F118 AromaticContact CD1-CE1 3.61Å; F84-F118 HydrophobicContact CD1-CE1 3.61Å; F84-F118 AromaticContact CD1-CZ 3.54Å; F84-F118 HydrophobicContact CD1-CZ 3.54Å; F84-F118 HydrophobicContact CD2-CZ 4.41Å; F84-F118 HydrophobicContact CE1-CE1 4.22Å; F84-F118 HydrophobicContact CE1-CZ 4.36Å; F84-F118 HydrophobicContact CG-CE1 4.15Å; F84-F118 HydrophobicContact CG-CE2 4.28Å; F84-F118 AromaticContact CG-CZ 3.57Å; F84-F118 HydrophobicContact CG-CZ 3.57Å; F84-R119 CarbonylContact C-O 3.56Å; F84-R119 WeakPolarHBondContact CA-O 3.46Å; F84-V120 HydrophobicContact CD1-CG2 4.05Å; F84-V120 HydrophobicContact CE1-CG2 3.75Å; F84-L139 HydrophobicContact CE1-CB 3.56Å; F84-L139 HydrophobicContact CE1-CD1 4.11Å; F84-L139 HydrophobicContact CE1-CG 4.47Å; F84-L139 HydrophobicContact CZ-CB 3.71Å; F84-L139 HydrophobicContact CZ-CD1 3.97Å; F84-V140 HydrophobicContact CZ-CG2 4.32Å
85	G	97.4	Very high	93.2	Very high	6 Å²	6	37.4 Å²	37.4	6%	0.062	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.1	171.4	174.9	0	0	0	0	0	112.8	F118 R119	G85-F118 WeakPolarHBondContact O-CA 3.38Å; G85-R119 PolarHBondContact N-O 3.35Å; G85-R119 PolarHBondContact O-N 2.8Å
86	L	97.8	Very high	93.4	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.016	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	128	170.1	-62.1	173.7	0	0	0	108.8	V44 L67 F68 V71 L98 V116 N117 F118	V44-L86 HydrophobicContact CG1-CD2 4Å; L67-L86 HydrophobicContact CD2-CD1 3.91Å; L67-L86 HydrophobicContact CG-CD1 3.84Å; F68-L86 HydrophobicContact CB-CD1 4.13Å; F68-L86 HydrophobicContact CD2-CD1 4.11Å; F68-L86 HydrophobicContact CD2-CD2 4.5Å; F68-L86 HydrophobicContact CD2-CG 3.82Å; F68-L86 HydrophobicContact CE2-CG 4.49Å; V71-L86 HydrophobicContact CG1-CD2 4.39Å; V71-L86 HydrophobicContact CG2-CD1 4.44Å; V71-L86 HydrophobicContact CG2-CD2 4.38Å; L86-L98 HydrophobicContact CB-CB 3.99Å; L86-L98 HydrophobicContact CB-CD2 4.06Å; L86-L98 HydrophobicContact CD1-CD2 3.79Å; L86-L98 WeakPolarHBondContact O-CB 3.05Å; L86-L98 PolarHBondContact O-N 3.47Å; L86-V116 HydrophobicContact CB-CB 4.4Å; L86-V116 HydrophobicContact CB-CG2 4.4Å; L86-V116 HydrophobicContact CD1-CG2 4.28Å; L86-V116 HydrophobicContact CD2-CG2 4.05Å; L86-V116 HydrophobicContact CG-CG2 4.47Å; L86-N117 WeakPolarHBondContact CA-O 3.48Å; L86-F118 HydrophobicContact CD2-CB 4.05Å; L86-F118 HydrophobicContact CD2-CD2 4.21Å
87	R	96	Very high	93.9	Very high	25 Å²	25	40 Å²	40	9%	0.094	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	148.5	172.7	68	172.4	-167.4	-173.2	-0	111.6	Q96 W97 V116 N117 R119 E540	R87-Q96 CarbonylContact C-O 3.57Å; R87-Q96 WeakPolarHBondContact CA-O 3.33Å; R87-Q96 WeakPolarHBondContact CB-O 3.08Å; R87-W97 HydrophobicContact CB-CD2 4.31Å; R87-W97 HydrophobicContact CB-CE3 3.88Å; R87-W97 HydrophobicContact CB-CZ3 4.01Å; R87-V116 CarbonylContact O-C 3.56Å; R87-V116 WeakPolarHBondContact O-CA 3.46Å; R87-N117 HydrophobicContact CG-CB 3.87Å; R87-N117 PolarHBondContact N-O 2.77Å; R87-N117 PolarHBondContact O-N 3.34Å; R87-N117 PolarHBondContact O-ND2 3.5Å; R87-R119 HydrophobicContact CG-CG 4.16Å; R87-E540 IonicContact CZ-OE1 2.95Å; R87-E540 IonicContact CZ-OE2 3.02Å; R87-E540 IonicContact NH1-OE1 2.67Å; R87-E540 IonicContact NH1-OE2 2.7Å; R87-E540 PolarHBondContact NH1-OE2 3.21Å; R87-E540 IonicContact NH2-OE1 3.18Å; R87-E540 PolarHBondContact NH2-OE1 2.61Å; R87-E540 IonicContact NH2-OE2 3.13Å; R87-E540 PolarHBondContact NH2-OE2 2.81Å
88	Y	96	Very high	94.3	Very high	23 Å²	23	36.8 Å²	36.8	9%	0.09	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	172	171.9	66.9	-80.6	0	0	0	109.9	D90 R95 Q96 L98 L108	Y88-D90 HydrophobicContact CE2-CB 4.09Å; Y88-R95 CarbonylContact O-C 3.45Å; Y88-R95 WeakPolarHBondContact O-CA 3.46Å; Y88-Q96 HydrophobicContact CD1-CB 4.05Å; Y88-Q96 HydrophobicContact CD2-CB 4.44Å; Y88-Q96 HydrophobicContact CE1-CB 3.57Å; Y88-Q96 HydrophobicContact CE2-CB 4.02Å; Y88-Q96 HydrophobicContact CE2-CG 4.19Å; Y88-Q96 HydrophobicContact CG-CB 4.46Å; Y88-Q96 PolarHBondContact N-O 2.63Å; Y88-Q96 PolarHBondContact O-N 3.08Å; Y88-L98 HydrophobicContact CD1-CD1 4.44Å; Y88-L98 HydrophobicContact CE1-CD1 4.34Å; Y88-L108 HydrophobicContact CD1-CD2 3.85Å; Y88-L108 HydrophobicContact CD2-CD2 3.45Å; Y88-L108 VanDerWaalsContact CD2-CD2 3.45Å; Y88-L108 HydrophobicContact CE1-CD2 4.28Å; Y88-L108 HydrophobicContact CE2-CD2 3.91Å; Y88-L108 HydrophobicContact CG-CD2 3.41Å; Y88-L108 VanDerWaalsContact CG-CD2 3.41Å
89	T	93.8	Very high	94.4	Very high	69 Å²	69	39.2 Å²	39.2	42%	0.423	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	123.8	171.2	-61.3	0	0	0	0	107.2	N93	T89-N93 HydrophobicContact CG2-CB 4.33Å
90	D	91.4	Very high	94.5	Very high	20 Å²	20	39.7 Å²	39.7	11%	0.107	19%	0.189	C	C	.	.			trans	-76.9	179	178.9	68.8	27.2	0	0	0	112.3	Y88 D92 N93 I94 Q96 T403	Y88-D90 HydrophobicContact CE2-CB 4.09Å; D90-D92 PolarHBondContact O-N 3.35Å; D90-D92 WeakPolarHBondContact OD1-CA 3.5Å; D90-D92 WeakPolarHBondContact OD1-CB 3.28Å; D90-D92 PolarHBondContact OD1-N 3.17Å; D90-N93 WeakPolarHBondContact O-CA 3.4Å; D90-N93 PolarHBondContact O-N 2.92Å; D90-N93 PolarHBondContact OD1-N 3.2Å; D90-I94 VanDerWaalsContact CG-O 3.23Å; D90-I94 PolarHBondContact N-O 3.15Å; D90-I94 WeakPolarHBondContact OD1-CB 3.42Å; D90-I94 PolarHBondContact OD1-N 3.22Å; D90-Q96 HydrophobicContact CB-CG 4.08Å; D90-Q96 WeakPolarHBondContact OD2-CG 3.45Å; D90-Q96 PolarHBondContact OD2-NE2 3.23Å; D90-T403 WeakPolarHBondContact OD2-CG2 3.3Å
91	K	90.6	Very high	94.3	Very high	133 Å²	133	44.9 Å²	44.9	58%	0.578	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-20.7	179.3	67.5	-174.6	171.6	-165.3	0	115	N93 D110	K91-N93 PolarHBondContact O-N 3.15Å; K91-D110 HydrophobicContact CD-CB 4.08Å; K91-D110 IonicContact NZ-OD2 2.78Å; K91-D110 PolarHBondContact NZ-OD2 3.17Å
92	D	89.4	Confident	94.2	Very high	80 Å²	80	43 Å²	43	43%	0.428	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	8.5	177.2	-61.7	-16.1	0	0	0	111.2	D90 I94 T403	D90-D92 PolarHBondContact O-N 3.35Å; D90-D92 WeakPolarHBondContact OD1-CA 3.5Å; D90-D92 WeakPolarHBondContact OD1-CB 3.28Å; D90-D92 PolarHBondContact OD1-N 3.17Å; D92-I94 HydrophobicContact CB-CG1 3.92Å; D92-I94 PolarHBondContact O-N 2.93Å; D92-T403 WeakPolarHBondContact OD2-CB 3.42Å; D92-T403 PolarHBondContact OD2-OG1 2.58Å
93	N	89.9	Confident	94.2	Very high	98 Å²	98	43.2 Å²	43.2	52%	0.524	21%	0.213	S	C	.	.	S	Bend	trans	56.5	26	-167.2	-62.6	-44	0	0	0	113.6	T89 D90 K91	T89-N93 HydrophobicContact CG2-CB 4.33Å; D90-N93 WeakPolarHBondContact O-CA 3.4Å; D90-N93 PolarHBondContact O-N 2.92Å; D90-N93 PolarHBondContact OD1-N 3.2Å; K91-N93 PolarHBondContact O-N 3.15Å
94	I	90.9	Very high	94.1	Very high	26 Å²	26	43.2 Å²	43.2	13%	0.133	21%	0.213	C	C	.	.			trans	-92.9	131.5	175.3	-56.6	-55.7	0	0	0	109	D90 D92 T403 A404 A407	D90-I94 VanDerWaalsContact CG-O 3.23Å; D90-I94 PolarHBondContact N-O 3.15Å; D90-I94 WeakPolarHBondContact OD1-CB 3.42Å; D90-I94 PolarHBondContact OD1-N 3.22Å; D92-I94 HydrophobicContact CB-CG1 3.92Å; D92-I94 PolarHBondContact O-N 2.93Å; I94-T403 HydrophobicContact CB-CG2 4.36Å; I94-T403 HydrophobicContact CG1-CG2 4.35Å; I94-T403 HydrophobicContact CG2-CG2 4.48Å; I94-A404 HydrophobicContact CD1-CB 3.99Å; I94-A404 HydrophobicContact CG1-CB 4.48Å; I94-A407 HydrophobicContact CG2-CB 4.18Å
95	R	92.9	Very high	94	Very high	47 Å²	47	47.1 Å²	47.1	18%	0.177	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	140.7	173.7	-67	178.2	-65.8	-170	4.7	109.4	Y88 D283 W411 E540	Y88-R95 CarbonylContact O-C 3.45Å; Y88-R95 WeakPolarHBondContact O-CA 3.46Å; R95-D283 IonicContact CZ-OD1 2.67Å; R95-D283 IonicContact CZ-OD2 2.82Å; R95-D283 IonicContact NE-OD2 3.4Å; R95-D283 IonicContact NH1-OD1 2.88Å; R95-D283 PolarHBondContact NH1-OD1 3.3Å; R95-D283 IonicContact NH1-OD2 3.83Å; R95-D283 PolarHBondContact NH1-OD2 2.92Å; R95-D283 IonicContact NH2-OD1 2.98Å; R95-D283 PolarHBondContact NH2-OD1 2.97Å; R95-D283 IonicContact NH2-OD2 3.17Å; R95-D283 PolarHBondContact NH2-OD2 3.42Å; R95-W411 HydrophobicContact CB-CH2 4.3Å; R95-W411 HydrophobicContact CB-CZ2 4.2Å; R95-W411 VanDerWaalsContact O-CZ2 3.31Å; R95-W411 WeakPolarHBondContact O-CZ2 3.44Å; R95-E540 IonicContact NH1-OE2 3.11Å
96	Q	94.2	Very high	93.9	Very high	32 Å²	32	54.3 Å²	54.3	15%	0.15	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	143.5	177.7	-60.4	-63.5	-7.1	0	0	109.5	R87 Y88 D90	R87-Q96 CarbonylContact C-O 3.57Å; R87-Q96 WeakPolarHBondContact CA-O 3.33Å; R87-Q96 WeakPolarHBondContact CB-O 3.08Å; Y88-Q96 HydrophobicContact CD1-CB 4.05Å; Y88-Q96 HydrophobicContact CD2-CB 4.44Å; Y88-Q96 HydrophobicContact CE1-CB 3.57Å; Y88-Q96 HydrophobicContact CE2-CB 4.02Å; Y88-Q96 HydrophobicContact CE2-CG 4.19Å; Y88-Q96 HydrophobicContact CG-CB 4.46Å; Y88-Q96 PolarHBondContact N-O 2.63Å; Y88-Q96 PolarHBondContact O-N 3.08Å; D90-Q96 HydrophobicContact CB-CG 4.08Å; D90-Q96 WeakPolarHBondContact OD2-CG 3.45Å; D90-Q96 PolarHBondContact OD2-NE2 3.23Å
97	W	95.9	Very high	93.8	Very high	53 Å²	53	55.1 Å²	55.1	20%	0.201	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	138.7	163.1	-68	103.8	0	0	0	108.9	R87 E99 R119 K121 W411	R87-W97 HydrophobicContact CB-CD2 4.31Å; R87-W97 HydrophobicContact CB-CE3 3.88Å; R87-W97 HydrophobicContact CB-CZ3 4.01Å; W97-E99 PolarHBondContact O-N 2.91Å; W97-R119 HydrophobicContact CH2-CB 4.04Å; W97-R119 HydrophobicContact CZ3-CB 4.34Å; W97-K121 HydrophobicContact CD2-CD 4.1Å; W97-K121 HydrophobicContact CD2-CG 4.11Å; W97-K121 HydrophobicContact CE3-CB 4.33Å; W97-K121 HydrophobicContact CE3-CD 4.06Å; W97-K121 HydrophobicContact CE3-CG 4.23Å; W97-K121 HydrophobicContact CH2-CB 3.73Å; W97-K121 HydrophobicContact CH2-CG 4.21Å; W97-K121 HydrophobicContact CZ2-CB 4.02Å; W97-K121 HydrophobicContact CZ2-CG 4.07Å; W97-K121 HydrophobicContact CZ3-CB 3.9Å; W97-K121 HydrophobicContact CZ3-CD 4.45Å; W97-K121 HydrophobicContact CZ3-CG 4.28Å; W97-W411 AromaticContact CD1-CD1 3.5Å; W97-W411 VanDerWaalsContact CD1-CD1 3.5Å; W97-W411 AromaticContact CD1-NE1 3.52Å
98	L	96.1	Very high	93.8	Very high	10 Å²	10	54 Å²	54	5%	0.052	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-66.1	118.7	175.1	-172.1	75.4	0	0	0	109.6	L67 L86 Y88 L100 V104 Q107	L67-L98 HydrophobicContact CD2-CD2 4.13Å; L86-L98 HydrophobicContact CB-CB 3.99Å; L86-L98 HydrophobicContact CB-CD2 4.06Å; L86-L98 HydrophobicContact CD1-CD2 3.79Å; L86-L98 WeakPolarHBondContact O-CB 3.05Å; L86-L98 PolarHBondContact O-N 3.47Å; Y88-L98 HydrophobicContact CD1-CD1 4.44Å; Y88-L98 HydrophobicContact CE1-CD1 4.34Å; L98-L100 PolarHBondContact O-N 2.88Å; L98-V104 HydrophobicContact CD1-CG1 4.37Å; L98-V104 HydrophobicContact CD2-CG2 4.27Å; L98-Q107 HydrophobicContact CD1-CB 4.32Å
99	E	94.4	Very high	93.7	Very high	56 Å²	56	57.9 Å²	57.9	26%	0.262	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-72.8	118	177.7	-66.1	179.6	-88.3	0	0	109.4	W97 D101 K102 Q107	W97-E99 PolarHBondContact O-N 2.91Å; E99-D101 VanDerWaalsContact C-N 3.29Å; E99-D101 PolarHBondContact O-N 3.24Å; E99-K102 HydrophobicContact CB-CB 4.24Å; E99-K102 HydrophobicContact CB-CD 4.05Å; E99-K102 HydrophobicContact CB-CG 4.21Å; E99-K102 VanDerWaalsContact CD-CE 3.47Å; E99-K102 PolarHBondContact O-N 3.47Å; E99-K102 WeakPolarHBondContact OE1-CD 3.44Å; E99-K102 WeakPolarHBondContact OE1-CE 3Å; E99-K102 IonicContact OE1-NZ 3.08Å; E99-K102 PolarHBondContact OE1-NZ 3.08Å; E99-K102 WeakPolarHBondContact OE2-CE 3.25Å; E99-K102 IonicContact OE2-NZ 2.75Å; E99-K102 PolarHBondContact OE2-NZ 3.33Å; E99-Q107 PolarHBondContact O-NE2 2.89Å
100	L	94.8	Very high	93.6	Very high	44 Å²	44	58.3 Å²	58.3	23%	0.23	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-20.9	-170.3	-60.4	-176.4	0	0	0	113.6	S63 G64 S65 F68 L98	S63-L100 WeakPolarHBondContact CB-O 3.08Å; G64-L100 PolarHBondContact N-O 3.19Å; S65-L100 WeakPolarHBondContact CB-O 3.49Å; S65-L100 PolarHBondContact N-O 3.46Å; S65-L100 PolarHBondContact OG-O 2.89Å; F68-L100 HydrophobicContact CB-CD2 3.84Å; F68-L100 HydrophobicContact CD1-CD1 4.07Å; F68-L100 HydrophobicContact CD1-CD2 4.07Å; F68-L100 HydrophobicContact CE1-CD1 4.49Å; F68-L100 HydrophobicContact CG-CD2 4.12Å; L98-L100 PolarHBondContact O-N 2.88Å
101	D	91.9	Very high	93.6	Very high	110 Å²	110	58.4 Å²	58.4	59%	0.588	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-7.9	178.1	69.2	-31.7	0	0	0	113.7	E99	E99-D101 VanDerWaalsContact C-N 3.29Å; E99-D101 PolarHBondContact O-N 3.24Å
102	K	93.3	Very high	93.2	Very high	53 Å²	53	61.3 Å²	61.3	23%	0.23	29%	0.289	C	S	.	.	S	Bend	trans	-105.9	152.2	179.4	-65.5	-178.5	-167.6	169.1	0	111.7	S63 G64 E99 V104 Q107	S63-K102 CarbonylContact C-O 3.52Å; S63-K102 VanDerWaalsContact CA-O 3.26Å; S63-K102 WeakPolarHBondContact CA-O 3.35Å; G64-K102 PolarHBondContact N-O 3.26Å; E99-K102 HydrophobicContact CB-CB 4.24Å; E99-K102 HydrophobicContact CB-CD 4.05Å; E99-K102 HydrophobicContact CB-CG 4.21Å; E99-K102 VanDerWaalsContact CD-CE 3.47Å; E99-K102 PolarHBondContact O-N 3.47Å; E99-K102 WeakPolarHBondContact OE1-CD 3.44Å; E99-K102 WeakPolarHBondContact OE1-CE 3Å; E99-K102 IonicContact OE1-NZ 3.08Å; E99-K102 PolarHBondContact OE1-NZ 3.08Å; E99-K102 WeakPolarHBondContact OE2-CE 3.25Å; E99-K102 IonicContact OE2-NZ 2.75Å; E99-K102 PolarHBondContact OE2-NZ 3.33Å; K102-V104 PolarHBondContact O-N 3.05Å; K102-Q107 HydrophobicContact CB-CG 4.36Å; K102-Q107 PolarHBondContact O-NE2 2.94Å
103	S	95.8	Very high	93.2	Very high	16 Å²	16	60.1 Å²	60.1	11%	0.112	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-56.3	136.2	172.2	149.2	0	0	0	0	110.8	K60 D62 Y105 K106 Q107	K60-S103 PolarHBondContact O-OG 3.08Å; D62-S103 WeakPolarHBondContact O-CA 3.37Å; S103-Y105 PolarHBondContact OG-N 3.3Å; S103-K106 PolarHBondContact O-N 3.49Å; S103-K106 PolarHBondContact OG-N 2.99Å; S103-K106 VanDerWaalsContact OG-N 3.13Å; S103-Q107 WeakPolarHBondContact O-CG 3.19Å; S103-Q107 PolarHBondContact O-N 3.12Å; S103-Q107 PolarHBondContact O-NE2 2.83Å
104	V	96.5	Very high	93.4	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-64.5	-44.1	176.2	-179	0	0	0	0	110.3	I58 D62 L67 L98 K102 K106 Q107 L108	I58-V104 HydrophobicContact CD1-CB 3.63Å; I58-V104 HydrophobicContact CD1-CG1 3.63Å; I58-V104 HydrophobicContact CD1-CG2 3.88Å; D62-V104 PolarHBondContact O-N 3.42Å; L67-V104 HydrophobicContact CB-CG2 4.06Å; L67-V104 HydrophobicContact CD2-CG1 4.05Å; L67-V104 HydrophobicContact CD2-CG2 4.11Å; L98-V104 HydrophobicContact CD1-CG1 4.37Å; L98-V104 HydrophobicContact CD2-CG2 4.27Å; K102-V104 PolarHBondContact O-N 3.05Å; V104-K106 VanDerWaalsContact C-N 3.33Å; V104-K106 PolarHBondContact O-N 3.15Å; V104-Q107 PolarHBondContact O-N 3.24Å; V104-Q107 VanDerWaalsContact O-N 3.12Å; V104-L108 HydrophobicContact CG1-CD1 3.61Å; V104-L108 HydrophobicContact CG1-CG 4.19Å; V104-L108 PolarHBondContact O-N 2.84Å
105	Y	96.1	Very high	93.6	Very high	86 Å²	86	58.1 Å²	58.1	34%	0.337	28%	0.275	S	S	.	.	H	α-helix	trans	-55.3	-46.4	176.2	176.9	-107	0	0	0	112.2	I40 K60 S103 Q107 L108 K109 F114	I40-Y105 HydrophobicContact CD1-CD2 4.3Å; I40-Y105 HydrophobicContact CG2-CD2 4.14Å; K60-Y105 HydrophobicContact CB-CD1 4.15Å; K60-Y105 HydrophobicContact CB-CG 4.03Å; K60-Y105 HydrophobicContact CG-CD1 4.28Å; K60-Y105 HydrophobicContact CG-CD2 4.05Å; K60-Y105 HydrophobicContact CG-CE2 4.47Å; K60-Y105 HydrophobicContact CG-CG 3.94Å; S103-Y105 PolarHBondContact OG-N 3.3Å; Y105-Q107 PolarHBondContact O-N 2.82Å; Y105-L108 PolarHBondContact O-N 3.24Å; Y105-K109 HydrophobicContact CD2-CB 4.35Å; Y105-K109 HydrophobicContact CE1-CD 4.4Å; Y105-K109 HydrophobicContact CE2-CB 4.04Å; Y105-K109 WeakPolarHBondContact O-CB 3.5Å; Y105-K109 WeakPolarHBondContact O-CG 3.5Å; Y105-K109 PolarHBondContact O-N 3.3Å; Y105-F114 HydrophobicContact CD2-CE1 4.12Å; Y105-F114 AromaticContact CD2-CZ 3.88Å; Y105-F114 HydrophobicContact CD2-CZ 3.88Å; Y105-F114 HydrophobicContact CE2-CZ 4.23Å
106	K	94.9	Very high	93.8	Very high	157 Å²	157	55.9 Å²	55.9	68%	0.683	27%	0.267	S	S	*	.	H	α-helix	trans	-64.4	-24.2	-179.1	-71	-176.3	-178.4	177.5	0	113.9	S103 V104	S103-K106 PolarHBondContact O-N 3.49Å; S103-K106 PolarHBondContact OG-N 2.99Å; S103-K106 VanDerWaalsContact OG-N 3.13Å; V104-K106 VanDerWaalsContact C-N 3.33Å; V104-K106 PolarHBondContact O-N 3.15Å
107	Q	94.8	Very high	93.9	Very high	20 Å²	20	55.4 Å²	55.4	9%	0.093	27%	0.265	C	S	.	.	H	α-helix	trans	-86.5	-42.1	177.3	-67.7	175.5	80.7	0	0	111.8	L98 E99 K102 S103 V104 Y105	L98-Q107 HydrophobicContact CD1-CB 4.32Å; E99-Q107 PolarHBondContact O-NE2 2.89Å; K102-Q107 HydrophobicContact CB-CG 4.36Å; K102-Q107 PolarHBondContact O-NE2 2.94Å; S103-Q107 WeakPolarHBondContact O-CG 3.19Å; S103-Q107 PolarHBondContact O-N 3.12Å; S103-Q107 PolarHBondContact O-NE2 2.83Å; V104-Q107 PolarHBondContact O-N 3.24Å; V104-Q107 VanDerWaalsContact O-N 3.12Å; Y105-Q107 PolarHBondContact O-N 2.82Å
108	L	95.6	Very high	94	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-94.4	-12.9	-172.5	-60.1	-177.5	0	0	0	115	Y88 V104 Y105 D110 C111 F114 V116	Y88-L108 HydrophobicContact CD1-CD2 3.85Å; Y88-L108 HydrophobicContact CD2-CD2 3.45Å; Y88-L108 VanDerWaalsContact CD2-CD2 3.45Å; Y88-L108 HydrophobicContact CE1-CD2 4.28Å; Y88-L108 HydrophobicContact CE2-CD2 3.91Å; Y88-L108 HydrophobicContact CG-CD2 3.41Å; Y88-L108 VanDerWaalsContact CG-CD2 3.41Å; V104-L108 HydrophobicContact CG1-CD1 3.61Å; V104-L108 HydrophobicContact CG1-CG 4.19Å; V104-L108 PolarHBondContact O-N 2.84Å; Y105-L108 PolarHBondContact O-N 3.24Å; L108-D110 PolarHBondContact O-N 3.3Å; L108-D110 VanDerWaalsContact O-N 3.08Å; L108-C111 VanDerWaalsContact O-CB 3.28Å; L108-C111 WeakPolarHBondContact O-CB 3.44Å; L108-C111 PolarHBondContact O-N 2.92Å; L108-F114 HydrophobicContact CB-CD1 3.61Å; L108-F114 HydrophobicContact CB-CE1 3.62Å; L108-F114 HydrophobicContact CB-CG 4.46Å; L108-F114 HydrophobicContact CB-CZ 4.48Å; L108-F114 HydrophobicContact CD1-CD1 3.94Å; L108-F114 HydrophobicContact CG-CD1 4.43Å; L108-V116 HydrophobicContact CD1-CG1 3.71Å; L108-V116 HydrophobicContact CD2-CG1 4.38Å
109	K	93.8	Very high	94	Very high	104 Å²	104	52.5 Å²	52.5	45%	0.452	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-24.8	-176.4	61.6	170.4	-169.3	80.5	0	115.9	Y105	Y105-K109 HydrophobicContact CD2-CB 4.35Å; Y105-K109 HydrophobicContact CE1-CD 4.4Å; Y105-K109 HydrophobicContact CE2-CB 4.04Å; Y105-K109 WeakPolarHBondContact O-CB 3.5Å; Y105-K109 WeakPolarHBondContact O-CG 3.5Å; Y105-K109 PolarHBondContact O-N 3.3Å
110	D	92	Very high	94.1	Very high	79 Å²	79	50 Å²	50	42%	0.422	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-0.9	177.9	-66.2	9.8	0	0	0	112	K91 L108	K91-D110 HydrophobicContact CD-CB 4.08Å; K91-D110 IonicContact NZ-OD2 2.78Å; K91-D110 PolarHBondContact NZ-OD2 3.17Å; L108-D110 PolarHBondContact O-N 3.3Å; L108-D110 VanDerWaalsContact O-N 3.08Å
111	C	91.7	Very high	94.3	Very high	22 Å²	22	49.1 Å²	49.1	15%	0.149	24%	0.236	C	C	.	.	S	Bend	trans	-86.4	158	179.6	-59.1	0	0	0	0	110.6	L108 S113	L108-C111 VanDerWaalsContact O-CB 3.28Å; L108-C111 WeakPolarHBondContact O-CB 3.44Å; L108-C111 PolarHBondContact O-N 2.92Å; C111-S113 PolarHBondContact O-N 3.25Å
112	K	83.1	Confident	94.5	Very high	193 Å²	193	44 Å²	44	84%	0.839	21%	0.209	S	C	*	.	S	Bend	trans	-58.6	-29.7	179.6	-65.2	-178.2	178.4	-179.8	0	113.4
113	S	88.7	Confident	94.7	Very high	56 Å²	56	42 Å²	42	39%	0.392	20%	0.2	S	C	.	.	S	Bend	trans	-158	160	-179.4	60.8	0	0	0	0	111.3	C111 V115	C111-S113 PolarHBondContact O-N 3.25Å; S113-V115 PolarHBondContact O-N 3.32Å; S113-V115 VanDerWaalsContact OG-CG2 3.3Å; S113-V115 WeakPolarHBondContact OG-CG2 3.25Å
114	F	93.8	Very high	94.8	Very high	55 Å²	55	41.2 Å²	41.2	24%	0.241	19%	0.194	C	C	.	.	S	Bend	trans	-81.9	55.8	173.3	-73.3	-92.3	0	0	0	111.2	I40 H41 C42 K43 Y105 L108	I40-F114 HydrophobicContact CD1-CD1 3.78Å; I40-F114 HydrophobicContact CD1-CE1 3.56Å; I40-F114 HydrophobicContact CD1-CZ 4.42Å; H41-F114 WeakPolarHBondContact O-CB 3.39Å; C42-F114 CarbonylContact C-O 3.56Å; C42-F114 WeakPolarHBondContact CA-O 3.44Å; C42-F114 PolarHBondContact SG-O 3.47Å; K43-F114 PolarHBondContact N-O 2.88Å; Y105-F114 HydrophobicContact CD2-CE1 4.12Å; Y105-F114 AromaticContact CD2-CZ 3.88Å; Y105-F114 HydrophobicContact CD2-CZ 3.88Å; Y105-F114 HydrophobicContact CE2-CZ 4.23Å; L108-F114 HydrophobicContact CB-CD1 3.61Å; L108-F114 HydrophobicContact CB-CE1 3.62Å; L108-F114 HydrophobicContact CB-CG 4.46Å; L108-F114 HydrophobicContact CB-CZ 4.48Å; L108-F114 HydrophobicContact CD1-CD1 3.94Å; L108-F114 HydrophobicContact CG-CD1 4.43Å
115	V	94.9	Very high	94.8	Very high	26 Å²	26	43.4 Å²	43.4	16%	0.158	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	127.8	178.2	-179.1	0	0	0	0	109.9	K43 R45 S113	K43-V115 HydrophobicContact CB-CG2 4.27Å; K43-V115 WeakPolarHBondContact O-CA 3.45Å; R45-V115 HydrophobicContact CG-CG1 4.32Å; S113-V115 PolarHBondContact O-N 3.32Å; S113-V115 VanDerWaalsContact OG-CG2 3.3Å; S113-V115 WeakPolarHBondContact OG-CG2 3.25Å
116	V	97	Very high	94.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	159.4	172.9	-56.1	0	0	0	0	110.2	K43 V44 R45 L67 L86 R87 L108	K43-V116 PolarHBondContact O-N 3.29Å; V44-V116 CarbonylContact C-O 3.58Å; V44-V116 WeakPolarHBondContact CA-O 3.3Å; V44-V116 HydrophobicContact CB-CG2 4.3Å; V44-V116 HydrophobicContact CG1-CG2 4.34Å; V44-V116 HydrophobicContact CG2-CG2 3.7Å; R45-V116 PolarHBondContact N-O 2.78Å; L67-V116 HydrophobicContact CD2-CG2 4.4Å; L86-V116 HydrophobicContact CB-CB 4.4Å; L86-V116 HydrophobicContact CB-CG2 4.4Å; L86-V116 HydrophobicContact CD1-CG2 4.28Å; L86-V116 HydrophobicContact CD2-CG2 4.05Å; L86-V116 HydrophobicContact CG-CG2 4.47Å; R87-V116 CarbonylContact O-C 3.56Å; R87-V116 WeakPolarHBondContact O-CA 3.46Å; L108-V116 HydrophobicContact CD1-CG1 3.71Å; L108-V116 HydrophobicContact CD2-CG1 4.38Å
117	N	96.6	Very high	94.8	Very high	22 Å²	22	34.4 Å²	34.4	12%	0.118	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	123.4	-176.1	-52.9	-99.9	0	0	0	109.1	R45 L86 R87 R119	R45-N117 CarbonylContact O-C 3.58Å; R45-N117 WeakPolarHBondContact O-CA 3.26Å; L86-N117 WeakPolarHBondContact CA-O 3.48Å; R87-N117 HydrophobicContact CG-CB 3.87Å; R87-N117 PolarHBondContact N-O 2.77Å; R87-N117 PolarHBondContact O-N 3.34Å; R87-N117 PolarHBondContact O-ND2 3.5Å; N117-R119 HydrophobicContact CB-CG 4.33Å
118	F	97.4	Very high	94.9	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	121.9	172.5	-179.9	-93.6	0	0	0	109.6	V44 R45 L46 L47 F68 V71 I75 L78 F84 G85 L86 L139	V44-F118 HydrophobicContact CG1-CB 4.25Å; R45-F118 PolarHBondContact O-N 2.91Å; L46-F118 HydrophobicContact CD2-CB 3.87Å; L46-F118 HydrophobicContact CD2-CD1 4.38Å; L46-F118 HydrophobicContact CD2-CG 4.23Å; L47-F118 HydrophobicContact CD1-CD1 3.86Å; L47-F118 HydrophobicContact CD1-CE1 3.79Å; L47-F118 HydrophobicContact CG-CD1 4.11Å; F68-F118 HydrophobicContact CE2-CD2 4.2Å; F68-F118 AromaticContact CE2-CE2 3.91Å; F68-F118 HydrophobicContact CE2-CE2 3.91Å; V71-F118 HydrophobicContact CG1-CD2 3.69Å; V71-F118 HydrophobicContact CG1-CE2 4.24Å; V71-F118 HydrophobicContact CG1-CG 4.31Å; I75-F118 HydrophobicContact CD1-CD1 3.93Å; I75-F118 HydrophobicContact CD1-CD2 3.97Å; I75-F118 HydrophobicContact CD1-CE1 3.76Å; I75-F118 HydrophobicContact CD1-CE2 3.79Å; I75-F118 HydrophobicContact CD1-CG 4.03Å; I75-F118 HydrophobicContact CD1-CZ 3.69Å; L78-F118 HydrophobicContact CD2-CZ 3.85Å; F84-F118 HydrophobicContact CB-CE1 4.35Å; F84-F118 HydrophobicContact CB-CE2 3.73Å; F84-F118 HydrophobicContact CB-CZ 3.55Å; F84-F118 AromaticContact CD1-CE1 3.61Å; F84-F118 HydrophobicContact CD1-CE1 3.61Å; F84-F118 AromaticContact CD1-CZ 3.54Å; F84-F118 HydrophobicContact CD1-CZ 3.54Å; F84-F118 HydrophobicContact CD2-CZ 4.41Å; F84-F118 HydrophobicContact CE1-CE1 4.22Å; F84-F118 HydrophobicContact CE1-CZ 4.36Å; F84-F118 HydrophobicContact CG-CE1 4.15Å; F84-F118 HydrophobicContact CG-CE2 4.28Å; F84-F118 AromaticContact CG-CZ 3.57Å; F84-F118 HydrophobicContact CG-CZ 3.57Å; G85-F118 WeakPolarHBondContact O-CA 3.38Å; L86-F118 HydrophobicContact CD2-CB 4.05Å; L86-F118 HydrophobicContact CD2-CD2 4.21Å; F118-L139 HydrophobicContact CE1-CD1 4.33Å; F118-L139 HydrophobicContact CE1-CD2 4.47Å
119	R	97.1	Very high	94.8	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.008	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	164.2	-174.7	-64.2	-64.6	179.6	-99.4	12	111.6	L46 D49 F84 G85 R87 W97 N117 K121	L46-R119 PolarHBondContact O-NH1 2.86Å; D49-R119 IonicContact OD1-NH2 3.68Å; D49-R119 PolarHBondContact OD1-NH2 3.06Å; D49-R119 VanDerWaalsContact OD1-NH2 3.08Å; F84-R119 CarbonylContact C-O 3.56Å; F84-R119 WeakPolarHBondContact CA-O 3.46Å; G85-R119 PolarHBondContact N-O 3.35Å; G85-R119 PolarHBondContact O-N 2.8Å; R87-R119 HydrophobicContact CG-CG 4.16Å; W97-R119 HydrophobicContact CH2-CB 4.04Å; W97-R119 HydrophobicContact CZ3-CB 4.34Å; N117-R119 HydrophobicContact CB-CG 4.33Å; R119-K121 PolarHBondContact O-N 2.63Å
120	V	97.4	Very high	94.8	Very high	4 Å²	4	36.3 Å²	36.3	2%	0.024	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	121.1	170	-178.6	0	0	0	0	109	F84 H122 Y123 V140 Q143	F84-V120 HydrophobicContact CD1-CG2 4.05Å; F84-V120 HydrophobicContact CE1-CG2 3.75Å; V120-H122 WeakPolarHBondContact CG1-O 3.32Å; V120-Y123 HydrophobicContact CB-CD2 4.44Å; V120-Y123 HydrophobicContact CB-CE1 4.28Å; V120-Y123 HydrophobicContact CB-CE2 3.89Å; V120-Y123 HydrophobicContact CG1-CD1 4.13Å; V120-Y123 HydrophobicContact CG1-CD2 3.71Å; V120-Y123 HydrophobicContact CG1-CE1 4.13Å; V120-Y123 HydrophobicContact CG1-CE2 3.67Å; V120-Y123 HydrophobicContact CG1-CG 3.92Å; V120-Y123 WeakPolarHBondContact O-CE2 3.25Å; V120-V140 HydrophobicContact CG2-CG2 4.04Å; V120-Q143 HydrophobicContact CB-CB 4.46Å; V120-Q143 HydrophobicContact CB-CG 3.93Å; V120-Q143 HydrophobicContact CG2-CB 3.65Å; V120-Q143 HydrophobicContact CG2-CG 3.66Å
121	K	97	Very high	95	Very high	26 Å²	26	32.7 Å²	32.7	11%	0.113	17%	0.172	C	C	.	.	S	Bend	trans	-95.9	-36.2	-178.8	179.6	171	173.8	-91.5	0	111.9	Y83 W97 R119 D414 R415	Y83-K121 PolarHBondContact O-N 3.49Å; W97-K121 HydrophobicContact CD2-CD 4.1Å; W97-K121 HydrophobicContact CD2-CG 4.11Å; W97-K121 HydrophobicContact CE3-CB 4.33Å; W97-K121 HydrophobicContact CE3-CD 4.06Å; W97-K121 HydrophobicContact CE3-CG 4.23Å; W97-K121 HydrophobicContact CH2-CB 3.73Å; W97-K121 HydrophobicContact CH2-CG 4.21Å; W97-K121 HydrophobicContact CZ2-CB 4.02Å; W97-K121 HydrophobicContact CZ2-CG 4.07Å; W97-K121 HydrophobicContact CZ3-CB 3.9Å; W97-K121 HydrophobicContact CZ3-CD 4.45Å; W97-K121 HydrophobicContact CZ3-CG 4.28Å; R119-K121 PolarHBondContact O-N 2.63Å; K121-D414 WeakPolarHBondContact CE-OD2 3.39Å; K121-D414 IonicContact NZ-OD1 3.35Å; K121-D414 PolarHBondContact NZ-OD1 2.77Å; K121-D414 IonicContact NZ-OD2 3.08Å; K121-D414 PolarHBondContact NZ-OD2 2.78Å; K121-R415 PolarHBondContact O-NE 3.24Å; K121-R415 PolarHBondContact O-NH2 2.8Å
122	H	97.4	Very high	95.1	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.009	17%	0.17	C	C	.	.	S	Bend	trans	-125.4	117.6	174.9	-57.3	-54.3	0	0	0	108.6	D82 Y83 V120 D414 R415 F418 F419	D82-H122 PolarHBondContact O-CD2 3.35Å; D82-H122 VanDerWaalsContact O-CD2 3.28Å; Y83-H122 HydrophobicContact CD1-CB 4.2Å; Y83-H122 WeakPolarHBondContact CD1-O 3.35Å; Y83-H122 PolarHBondContact O-N 2.79Å; V120-H122 WeakPolarHBondContact CG1-O 3.32Å; H122-D414 IonicContact CE1-OD2 3.04Å; H122-D414 PolarHBondContact CE1-OD2 3.12Å; H122-D414 IonicContact NE2-OD2 2.79Å; H122-D414 PolarHBondContact NE2-OD2 3.39Å; H122-R415 WeakPolarHBondContact ND1-CD 3.3Å; H122-R415 PolarHBondContact ND1-NE 3.23Å; H122-F418 HydrophobicContact CB-CD1 3.75Å; H122-F418 HydrophobicContact CB-CE1 3.66Å; H122-F418 HydrophobicContact CB-CG 4.21Å; H122-F418 HydrophobicContact CB-CZ 4.07Å; H122-F418 AromaticContact CD2-CD1 3.93Å; H122-F418 AromaticContact CD2-CD2 3.38Å; H122-F418 WeakPolarHBondContact CD2-CD2 3.2Å; H122-F418 AromaticContact CD2-CE2 3.78Å; H122-F418 AromaticContact CD2-CG 3.45Å; H122-F418 VanDerWaalsContact CD2-CG 3.45Å; H122-F418 WeakPolarHBondContact CD2-CG 3.25Å; H122-F418 AromaticContact CG-CD1 3.7Å; H122-F418 AromaticContact CG-CG 3.66Å; H122-F418 AromaticContact NE2-CD2 3.84Å; H122-F418 AromaticContact NE2-CG 3.81Å; H122-F419 HydrophobicContact CB-CE2 4.09Å; H122-F419 HydrophobicContact CB-CZ 4.35Å
123	Y	97.6	Very high	95.5	Very high	10 Å²	10	23.4 Å²	23.4	4%	0.039	13%	0.132	C	C	.	.			trans	-85.4	121.1	179	-73.3	-109.9	0	0	0	108.1	V120 Q143 I144 R152 Y280 G281 F419	V120-Y123 HydrophobicContact CB-CD2 4.44Å; V120-Y123 HydrophobicContact CB-CE1 4.28Å; V120-Y123 HydrophobicContact CB-CE2 3.89Å; V120-Y123 HydrophobicContact CG1-CD1 4.13Å; V120-Y123 HydrophobicContact CG1-CD2 3.71Å; V120-Y123 HydrophobicContact CG1-CE1 4.13Å; V120-Y123 HydrophobicContact CG1-CE2 3.67Å; V120-Y123 HydrophobicContact CG1-CG 3.92Å; V120-Y123 WeakPolarHBondContact O-CE2 3.25Å; Y123-Q143 HydrophobicContact CE1-CG 3.86Å; Y123-Q143 WeakPolarHBondContact OH-CG 3.34Å; Y123-I144 HydrophobicContact CE1-CD1 4.28Å; Y123-R152 PolarHBondContact OH-NH2 3.02Å; Y123-Y280 HydrophobicContact CD1-CE1 4.34Å; Y123-Y280 HydrophobicContact CD1-CE2 4.24Å; Y123-G281 VanDerWaalsContact CD2-CA 3.48Å; Y123-F419 WeakPolarHBondContact O-CZ 3.38Å
124	P	97	Very high	95.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.124	C	C	.	.			trans	-61.9	132.7	175.8	25.1	-33.5	0	0	0	110.1	Y83 D126 P127 D130 L131 Y280	Y83-P124 HydrophobicContact CE1-CB 4Å; P124-D126 PolarHBondContact O-N 3.26Å; P124-P127 HydrophobicContact CG-CB 3.85Å; P124-D130 HydrophobicContact CB-CB 3.69Å; P124-L131 HydrophobicContact CG-CD1 4.06Å; P124-L131 HydrophobicContact CG-CD2 4.46Å; P124-L131 HydrophobicContact CG-CG 4.13Å; P124-Y280 VanDerWaalsContact O-CE1 3.29Å; P124-Y280 WeakPolarHBondContact O-CE1 3.41Å; P124-Y280 PolarHBondContact O-OH 3.28Å; P124-Y280 VanDerWaalsContact O-OH 3.07Å
125	P	96.1	Very high	95.6	Very high	46 Å²	46	20.4 Å²	20.4	30%	0.299	12%	0.116	S	C	.	.	S	Bend	trans	-50.9	-40.8	172.8	-21.1	22.9	0	0	0	112.9	D130 F419	P125-D130 VanDerWaalsContact CD-OD2 3.29Å; P125-D130 WeakPolarHBondContact CD-OD2 3.33Å; P125-F419 HydrophobicContact CG-CE1 4.02Å
126	D	96.1	Very high	95.7	Very high	55 Å²	55	19.2 Å²	19.2	29%	0.294	11%	0.109	S	C	.	.	S	Bend	trans	-125.5	89.7	175.4	-174.9	-17.7	0	0	0	109.5	P124 V128 N129 D130	P124-D126 PolarHBondContact O-N 3.26Å; D126-V128 PolarHBondContact O-N 3.48Å; D126-V128 PolarHBondContact OD1-N 2.82Å; D126-V128 VanDerWaalsContact OD1-N 3.12Å; D126-N129 PolarHBondContact O-N 2.82Å; D126-N129 PolarHBondContact OD1-N 3.29Å; D126-N129 PolarHBondContact OD2-ND2 3.25Å; D126-D130 PolarHBondContact N-OD2 2.78Å; D126-D130 WeakPolarHBondContact O-CB 3.35Å; D126-D130 PolarHBondContact O-N 3.36Å
127	P	96.8	Very high	95.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-17	-177.7	23.6	-34.4	0	0	0	114.5	P124 V140 L271	P124-P127 HydrophobicContact CG-CB 3.85Å; P127-V140 HydrophobicContact CB-CG1 4.39Å; P127-L271 HydrophobicContact CB-CB 4.27Å; P127-L271 HydrophobicContact CB-CD2 4.16Å; P127-L271 HydrophobicContact CG-CB 3.91Å; P127-L271 HydrophobicContact CG-CD2 4.33Å
128	V	95.6	Very high	95.5	Very high	39 Å²	39	21.7 Å²	21.7	24%	0.236	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-42.1	179.3	-176.9	0	0	0	0	110.3	D126 T268 R272	D126-V128 PolarHBondContact O-N 3.48Å; D126-V128 PolarHBondContact OD1-N 2.82Å; D126-V128 VanDerWaalsContact OD1-N 3.12Å; V128-T268 HydrophobicContact CG1-CG2 3.86Å; V128-T268 HydrophobicContact CG2-CG2 3.93Å; V128-R272 HydrophobicContact CG2-CB 4.18Å
129	N	93.8	Very high	95.4	Very high	115 Å²	115	22.2 Å²	22.2	62%	0.615	12%	0.119	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-25.9	-174.2	-64	-54.1	0	0	0	114.7	D126 L131	D126-N129 PolarHBondContact O-N 2.82Å; D126-N129 PolarHBondContact OD1-N 3.29Å; D126-N129 PolarHBondContact OD2-ND2 3.25Å; N129-L131 VanDerWaalsContact C-N 3.34Å
130	D	94.5	Very high	95.4	Very high	10 Å²	10	22.1 Å²	22.1	5%	0.053	12%	0.119	C	C	.	.	S	Bend	trans	-81.6	-9.5	179	-76.4	-35.9	0	0	0	114.1	Y83 P124 P125 D126 Q450 R454	Y83-D130 PolarHBondContact OH-O 2.96Å; P124-D130 HydrophobicContact CB-CB 3.69Å; P125-D130 VanDerWaalsContact CD-OD2 3.29Å; P125-D130 WeakPolarHBondContact CD-OD2 3.33Å; D126-D130 PolarHBondContact N-OD2 2.78Å; D126-D130 WeakPolarHBondContact O-CB 3.35Å; D126-D130 PolarHBondContact O-N 3.36Å; D130-Q450 VanDerWaalsContact CG-NE2 3.35Å; D130-Q450 PolarHBondContact OD2-NE2 3.17Å; D130-Q450 VanDerWaalsContact OD2-NE2 3.09Å; D130-R454 VanDerWaalsContact CG-NH2 3.28Å; D130-R454 IonicContact OD1-CZ 3.12Å; D130-R454 IonicContact OD1-NE 2.9Å; D130-R454 PolarHBondContact OD1-NE 3.32Å; D130-R454 IonicContact OD1-NH2 2.71Å; D130-R454 PolarHBondContact OD1-NH2 2.89Å; D130-R454 IonicContact OD2-NH2 3.88Å; D130-R454 PolarHBondContact OD2-NH2 3.42Å; D130-R454 VanDerWaalsContact OD2-NH2 3.07Å
131	L	95.4	Very high	95.4	Very high	3 Å²	3	22.1 Å²	22.1	2%	0.016	12%	0.119	C	C	.	.			trans	-117.6	116.5	-179.6	-63.7	-179.5	0	0	0	110.5	E80 Y83 P124 N129 R137 V140	E80-L131 WeakPolarHBondContact OE1-CA 3.49Å; Y83-L131 HydrophobicContact CD2-CD2 3.45Å; Y83-L131 VanDerWaalsContact CD2-CD2 3.45Å; Y83-L131 HydrophobicContact CE2-CD2 3.3Å; Y83-L131 HydrophobicContact CG-CD2 4.14Å; P124-L131 HydrophobicContact CG-CD1 4.06Å; P124-L131 HydrophobicContact CG-CD2 4.46Å; P124-L131 HydrophobicContact CG-CG 4.13Å; N129-L131 VanDerWaalsContact C-N 3.34Å; L131-R137 HydrophobicContact CB-CG 3.71Å; L131-R137 HydrophobicContact CD1-CG 4.01Å; L131-R137 PolarHBondContact O-NH1 2.84Å; L131-V140 HydrophobicContact CD1-CB 4.43Å; L131-V140 HydrophobicContact CD1-CG2 3.78Å
132	A	93.5	Very high	95.3	Very high	14 Å²	14	21.5 Å²	21.5	12%	0.116	12%	0.116	C	C	.	.			trans	-74.2	-45.7	179.6	0	0	0	0	0	112.5	E80 R137 T457 I460 A461	E80-A132 PolarHBondContact OE1-N 3.44Å; E80-A132 PolarHBondContact OE2-N 2.78Å; A132-R137 VanDerWaalsContact C-NH1 3.3Å; A132-R137 PolarHBondContact O-NH1 3.28Å; A132-T457 HydrophobicContact CB-CG2 4.21Å; A132-I460 HydrophobicContact CB-CB 4.08Å; A132-I460 HydrophobicContact CB-CG2 3.74Å; A132-A461 HydrophobicContact CB-CB 4.13Å
133	Q	92.2	Very high	95.2	Very high	7 Å²	7	21.5 Å²	21.5	3%	0.033	12%	0.116	C	C	.	.	S	Bend	trans	-87.6	142.3	-170.4	-53.5	-167.7	-54.1	0	0	112.7	E80 I135 S136 R137 I460	E80-Q133 WeakPolarHBondContact OE2-CB 3.5Å; E80-Q133 PolarHBondContact OE2-N 3.48Å; Q133-I135 VanDerWaalsContact C-N 3.3Å; Q133-I135 HydrophobicContact CB-CG2 3.91Å; Q133-I135 PolarHBondContact O-N 2.87Å; Q133-S136 WeakPolarHBondContact O-CB 3.41Å; Q133-S136 PolarHBondContact O-N 3.34Å; Q133-R137 PolarHBondContact O-N 3.16Å; Q133-I460 HydrophobicContact CG-CG2 3.8Å
134	S	92.3	Very high	95.1	Very high	33 Å²	33	21 Å²	21	23%	0.231	11%	0.114	C	C	.	.	H	α-helix	trans	-62.9	-35.5	177.6	56.3	0	0	0	0	112.8	R137 Y138 Q465	S134-R137 PolarHBondContact O-N 2.96Å; S134-Y138 WeakPolarHBondContact O-CB 3.04Å; S134-Y138 PolarHBondContact O-N 2.94Å; S134-Q465 PolarHBondContact OG-OE1 3.37Å
135	I	92.9	Very high	94.9	Very high	15 Å²	15	22.6 Å²	22.6	8%	0.077	12%	0.12	C	C	.	.	H	α-helix	trans	-61.7	-43.9	173.6	-179.7	60.1	0	0	0	111.5	I75 L78 Q133 R137 Y138 L139 F468	I75-I135 HydrophobicContact CG2-CD1 4.39Å; I75-I135 HydrophobicContact CG2-CG1 4.48Å; L78-I135 HydrophobicContact CD1-CG1 4.47Å; L78-I135 HydrophobicContact CD1-CG2 4.13Å; Q133-I135 VanDerWaalsContact C-N 3.3Å; Q133-I135 HydrophobicContact CB-CG2 3.91Å; Q133-I135 PolarHBondContact O-N 2.87Å; I135-R137 PolarHBondContact O-N 2.73Å; I135-Y138 HydrophobicContact CD1-CD1 4.48Å; I135-Y138 PolarHBondContact O-N 3.04Å; I135-L139 HydrophobicContact CD1-CD1 4.14Å; I135-L139 HydrophobicContact CD1-CD2 4.33Å; I135-L139 HydrophobicContact CD1-CG 3.99Å; I135-L139 HydrophobicContact CG1-CD1 3.94Å; I135-L139 HydrophobicContact CG1-CG 4.27Å; I135-L139 VanDerWaalsContact O-CG 3.26Å; I135-L139 WeakPolarHBondContact O-CG 3.43Å; I135-L139 PolarHBondContact O-N 3.24Å; I135-F468 VanDerWaalsContact CA-CE1 3.46Å; I135-F468 HydrophobicContact CB-CD1 3.79Å; I135-F468 HydrophobicContact CB-CE1 3.71Å; I135-F468 HydrophobicContact CB-CG 4.5Å; I135-F468 HydrophobicContact CB-CZ 4.36Å; I135-F468 HydrophobicContact CD1-CB 4.17Å; I135-F468 HydrophobicContact CD1-CD1 3.89Å; I135-F468 HydrophobicContact CD1-CD2 3.9Å; I135-F468 HydrophobicContact CD1-CE1 4.25Å; I135-F468 HydrophobicContact CD1-CE2 4.26Å; I135-F468 HydrophobicContact CD1-CG 3.71Å; I135-F468 HydrophobicContact CD1-CZ 4.42Å; I135-F468 HydrophobicContact CG1-CD1 4.33Å
136	S	95.1	Very high	94.8	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-60.3	-45.7	178.8	-50.5	0	0	0	0	111.4	E80 Q133 L139 V140	E80-S136 WeakPolarHBondContact OE2-CB 3.36Å; E80-S136 PolarHBondContact OE2-OG 3.43Å; Q133-S136 WeakPolarHBondContact O-CB 3.41Å; Q133-S136 PolarHBondContact O-N 3.34Å; S136-L139 PolarHBondContact O-N 3.49Å; S136-V140 WeakPolarHBondContact O-CG2 3.42Å; S136-V140 PolarHBondContact O-N 3.49Å; S136-V140 VanDerWaalsContact O-N 3.08Å
137	R	95.8	Very high	94.6	Very high	61 Å²	61	19 Å²	19	23%	0.23	10%	0.097	C	C	.	.	H	α-helix	trans	-62.2	-45.1	176.3	-67.2	-168.9	-65	-83.7	0.6	111.5	L131 A132 Q133 S134 I135 L139 V140 Y141 L271	L131-R137 HydrophobicContact CB-CG 3.71Å; L131-R137 HydrophobicContact CD1-CG 4.01Å; L131-R137 PolarHBondContact O-NH1 2.84Å; A132-R137 VanDerWaalsContact C-NH1 3.3Å; A132-R137 PolarHBondContact O-NH1 3.28Å; Q133-R137 PolarHBondContact O-N 3.16Å; S134-R137 PolarHBondContact O-N 2.96Å; I135-R137 PolarHBondContact O-N 2.73Å; R137-L139 PolarHBondContact O-N 2.75Å; R137-V140 PolarHBondContact O-N 3.35Å; R137-Y141 PolarHBondContact O-N 3.43Å; R137-L271 HydrophobicContact CB-CD1 4.08Å
138	Y	95.1	Very high	94.4	Very high	13 Å²	13	19 Å²	19	5%	0.051	10%	0.097	C	C	.	.	H	α-helix	trans	-61.8	-40.2	176.9	178	-110.9	0	0	0	113.1	S134 I135 V140 Y141 L142 F468 R470 V471	S134-Y138 WeakPolarHBondContact O-CB 3.04Å; S134-Y138 PolarHBondContact O-N 2.94Å; I135-Y138 HydrophobicContact CD1-CD1 4.48Å; I135-Y138 PolarHBondContact O-N 3.04Å; Y138-V140 PolarHBondContact O-N 3.08Å; Y138-Y141 AromaticContact CD2-CD1 3.97Å; Y138-Y141 HydrophobicContact CD2-CD1 3.97Å; Y138-Y141 AromaticContact CE2-CD1 3.93Å; Y138-Y141 HydrophobicContact CE2-CD1 3.93Å; Y138-Y141 HydrophobicContact CE2-CE1 4.22Å; Y138-Y141 WeakPolarHBondContact O-CB 3.2Å; Y138-Y141 PolarHBondContact O-N 3.21Å; Y138-L142 HydrophobicContact CD1-CD1 4.25Å; Y138-L142 HydrophobicContact CE1-CD1 3.65Å; Y138-L142 HydrophobicContact CE1-CG 4.11Å; Y138-L142 HydrophobicContact CE2-CD2 4.28Å; Y138-L142 HydrophobicContact CE2-CG 4.26Å; Y138-L142 PolarHBondContact O-N 2.67Å; Y138-F468 AromaticContact CD1-CD2 3.82Å; Y138-F468 HydrophobicContact CD1-CD2 3.82Å; Y138-F468 AromaticContact CD1-CE2 3.38Å; Y138-F468 HydrophobicContact CD1-CE2 3.38Å; Y138-F468 HydrophobicContact CD1-CZ 4.33Å; Y138-F468 HydrophobicContact CD2-CE2 4.3Å; Y138-F468 HydrophobicContact CE1-CD2 4.24Å; Y138-F468 HydrophobicContact CE1-CE2 4.1Å; Y138-F468 HydrophobicContact CG-CD2 4.38Å; Y138-F468 AromaticContact CG-CE2 3.5Å; Y138-F468 HydrophobicContact CG-CE2 3.5Å; Y138-F468 HydrophobicContact CG-CZ 4.16Å; Y138-R470 HydrophobicContact CD2-CG 4.08Å; Y138-R470 HydrophobicContact CE2-CB 4.19Å; Y138-R470 HydrophobicContact CE2-CG 3.8Å; Y138-V471 PolarHBondContact OH-N 3.36Å; Y138-V471 PolarHBondContact OH-O 3.13Å
139	L	95.6	Very high	94.2	Very high	12 Å²	12	18.6 Å²	18.6	6%	0.063	10%	0.095	C	C	.	.	H	α-helix	trans	-65.4	-37	175.3	-65.7	168.6	0	0	0	111.8	L47 I75 L78 F84 F118 I135 S136 R137 L142 Q143	L47-L139 HydrophobicContact CD1-CB 3.82Å; L47-L139 HydrophobicContact CD1-CD2 3.9Å; L47-L139 HydrophobicContact CD1-CG 4.43Å; L47-L139 WeakPolarHBondContact CD1-O 3.37Å; I75-L139 HydrophobicContact CG2-CD1 3.95Å; I75-L139 HydrophobicContact CG2-CD2 4.21Å; L78-L139 HydrophobicContact CD1-CD1 4Å; L78-L139 HydrophobicContact CD2-CD1 3.94Å; F84-L139 HydrophobicContact CE1-CB 3.56Å; F84-L139 HydrophobicContact CE1-CD1 4.11Å; F84-L139 HydrophobicContact CE1-CG 4.47Å; F84-L139 HydrophobicContact CZ-CB 3.71Å; F84-L139 HydrophobicContact CZ-CD1 3.97Å; F118-L139 HydrophobicContact CE1-CD1 4.33Å; F118-L139 HydrophobicContact CE1-CD2 4.47Å; I135-L139 HydrophobicContact CD1-CD1 4.14Å; I135-L139 HydrophobicContact CD1-CD2 4.33Å; I135-L139 HydrophobicContact CD1-CG 3.99Å; I135-L139 HydrophobicContact CG1-CD1 3.94Å; I135-L139 HydrophobicContact CG1-CG 4.27Å; I135-L139 VanDerWaalsContact O-CG 3.26Å; I135-L139 WeakPolarHBondContact O-CG 3.43Å; I135-L139 PolarHBondContact O-N 3.24Å; S136-L139 PolarHBondContact O-N 3.49Å; R137-L139 PolarHBondContact O-N 2.75Å; L139-L142 PolarHBondContact O-N 2.65Å; L139-Q143 PolarHBondContact O-N 3.24Å; L139-Q143 VanDerWaalsContact O-N 3.15Å
140	V	96.9	Very high	93.9	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-68.7	-36.2	171.6	-179.3	0	0	0	0	111.3	F84 V120 P127 L131 S136 R137 Y138 Q143 I144 L271	F84-V140 HydrophobicContact CZ-CG2 4.32Å; V120-V140 HydrophobicContact CG2-CG2 4.04Å; P127-V140 HydrophobicContact CB-CG1 4.39Å; L131-V140 HydrophobicContact CD1-CB 4.43Å; L131-V140 HydrophobicContact CD1-CG2 3.78Å; S136-V140 WeakPolarHBondContact O-CG2 3.42Å; S136-V140 PolarHBondContact O-N 3.49Å; S136-V140 VanDerWaalsContact O-N 3.08Å; R137-V140 PolarHBondContact O-N 3.35Å; Y138-V140 PolarHBondContact O-N 3.08Å; V140-Q143 WeakPolarHBondContact O-CB 3.48Å; V140-Q143 PolarHBondContact O-N 3.05Å; V140-I144 HydrophobicContact CG1-CG1 4.31Å; V140-I144 WeakPolarHBondContact O-CG1 3.48Å; V140-I144 PolarHBondContact O-N 3.34Å; V140-L271 HydrophobicContact CB-CD2 4.1Å; V140-L271 HydrophobicContact CG1-CD2 3.65Å
141	Y	96.5	Very high	93.6	Very high	4 Å²	4	15.1 Å²	15.1	2%	0.016	8%	0.077	C	C	.	.	H	α-helix	trans	-58.1	-48.9	172.8	159.4	-90.3	0	0	0	111.3	R137 Y138 Q143 I144 R145 A170 E171 E267 L270	R137-Y141 PolarHBondContact O-N 3.43Å; Y138-Y141 AromaticContact CD2-CD1 3.97Å; Y138-Y141 HydrophobicContact CD2-CD1 3.97Å; Y138-Y141 AromaticContact CE2-CD1 3.93Å; Y138-Y141 HydrophobicContact CE2-CD1 3.93Å; Y138-Y141 HydrophobicContact CE2-CE1 4.22Å; Y138-Y141 WeakPolarHBondContact O-CB 3.2Å; Y138-Y141 PolarHBondContact O-N 3.21Å; Y141-Q143 VanDerWaalsContact C-N 3.27Å; Y141-Q143 PolarHBondContact O-N 3.45Å; Y141-I144 PolarHBondContact O-N 2.93Å; Y141-I144 VanDerWaalsContact O-N 3.08Å; Y141-R145 WeakPolarHBondContact O-CB 3.38Å; Y141-R145 PolarHBondContact O-N 3.07Å; Y141-A170 HydrophobicContact CE2-CB 4.1Å; Y141-E171 WeakPolarHBondContact OH-CG 3.29Å; Y141-E171 PolarHBondContact OH-OE1 3.24Å; Y141-E267 HydrophobicContact CD1-CG 4.12Å; Y141-E267 HydrophobicContact CD2-CB 4Å; Y141-E267 HydrophobicContact CD2-CG 3.73Å; Y141-E267 HydrophobicContact CE1-CG 4.34Å; Y141-E267 HydrophobicContact CE2-CG 3.95Å; Y141-E267 HydrophobicContact CG-CB 4.27Å; Y141-E267 HydrophobicContact CG-CG 3.83Å; Y141-L270 HydrophobicContact CD2-CD2 3.73Å; Y141-L270 HydrophobicContact CE2-CD2 3.61Å
142	L	95	Very high	93.3	Very high	13 Å²	13	16.2 Å²	16.2	7%	0.068	8%	0.081	C	C	.	.	H	α-helix	trans	-58.9	-39.1	176.9	-70.9	178.5	0	0	0	112.1	L47 D48 Y138 L139 R146	L47-L142 HydrophobicContact CB-CB 4.03Å; L47-L142 HydrophobicContact CB-CD1 4.23Å; D48-L142 HydrophobicContact CB-CD1 4.45Å; Y138-L142 HydrophobicContact CD1-CD1 4.25Å; Y138-L142 HydrophobicContact CE1-CD1 3.65Å; Y138-L142 HydrophobicContact CE1-CG 4.11Å; Y138-L142 HydrophobicContact CE2-CD2 4.28Å; Y138-L142 HydrophobicContact CE2-CG 4.26Å; Y138-L142 PolarHBondContact O-N 2.67Å; L139-L142 PolarHBondContact O-N 2.65Å; L142-R146 PolarHBondContact O-N 3.44Å
143	Q	95.9	Very high	93.3	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.005	8%	0.077	C	C	.	.	H	α-helix	trans	-65	-41.6	175.2	-177.8	65.7	83.3	0	0	112.4	L47 V120 Y123 L139 V140 Y141 R146 D147	L47-Q143 HydrophobicContact CD2-CB 3.75Å; L47-Q143 HydrophobicContact CD2-CG 4.31Å; V120-Q143 HydrophobicContact CB-CB 4.46Å; V120-Q143 HydrophobicContact CB-CG 3.93Å; V120-Q143 HydrophobicContact CG2-CB 3.65Å; V120-Q143 HydrophobicContact CG2-CG 3.66Å; Y123-Q143 HydrophobicContact CE1-CG 3.86Å; Y123-Q143 WeakPolarHBondContact OH-CG 3.34Å; L139-Q143 PolarHBondContact O-N 3.24Å; L139-Q143 VanDerWaalsContact O-N 3.15Å; V140-Q143 WeakPolarHBondContact O-CB 3.48Å; V140-Q143 PolarHBondContact O-N 3.05Å; Y141-Q143 VanDerWaalsContact C-N 3.27Å; Y141-Q143 PolarHBondContact O-N 3.45Å; Q143-R146 WeakPolarHBondContact O-CB 3.2Å; Q143-R146 PolarHBondContact O-N 3.25Å; Q143-D147 PolarHBondContact NE2-OD1 3.39Å; Q143-D147 PolarHBondContact O-N 2.87Å
144	I	95.4	Very high	93.1	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-69.4	-40.7	177.5	-68.5	-60.1	0	0	0	111.3	Y123 V140 Y141 R146 D147 L148 L153 L270 L271 A274 Y280	Y123-I144 HydrophobicContact CE1-CD1 4.28Å; V140-I144 HydrophobicContact CG1-CG1 4.31Å; V140-I144 WeakPolarHBondContact O-CG1 3.48Å; V140-I144 PolarHBondContact O-N 3.34Å; Y141-I144 PolarHBondContact O-N 2.93Å; Y141-I144 VanDerWaalsContact O-N 3.08Å; I144-R146 VanDerWaalsContact C-N 3.29Å; I144-R146 PolarHBondContact O-N 3.5Å; I144-D147 PolarHBondContact O-N 3.39Å; I144-L148 HydrophobicContact CG2-CD1 4.35Å; I144-L148 WeakPolarHBondContact O-CG 3.36Å; I144-L148 PolarHBondContact O-N 3.13Å; I144-L153 HydrophobicContact CD1-CD2 4.27Å; I144-L153 HydrophobicContact CG2-CD2 3.85Å; I144-L270 HydrophobicContact CG2-CD2 4.34Å; I144-L270 HydrophobicContact CG2-CG 4.49Å; I144-L271 HydrophobicContact CG1-CD2 4.31Å; I144-A274 HydrophobicContact CD1-CB 4.42Å; I144-A274 HydrophobicContact CG1-CB 4.47Å; I144-A274 HydrophobicContact CG2-CB 3.69Å; I144-Y280 HydrophobicContact CD1-CD2 3.72Å; I144-Y280 HydrophobicContact CD1-CE2 3.55Å; I144-Y280 HydrophobicContact CG1-CE2 4.26Å
145	R	93	Very high	92.8	Very high	34 Å²	34	17.7 Å²	17.7	13%	0.128	9%	0.086	C	C	.	.	H	α-helix	trans	-56.5	-44.2	172	-179.4	-89.4	147.9	87.3	-4.5	111	Y141 L148 T149 V167 E171 L237 S473	Y141-R145 WeakPolarHBondContact O-CB 3.38Å; Y141-R145 PolarHBondContact O-N 3.07Å; R145-L148 PolarHBondContact O-N 2.84Å; R145-T149 PolarHBondContact NE-OG1 3.08Å; R145-T149 PolarHBondContact O-N 3.4Å; R145-T149 VanDerWaalsContact O-N 3.13Å; R145-T149 PolarHBondContact O-OG1 3.23Å; R145-V167 HydrophobicContact CG-CG1 4.24Å; R145-E171 IonicContact CZ-OE1 3.94Å; R145-E171 IonicContact NH1-OE1 3.94Å; R145-E171 PolarHBondContact NH1-OE1 2.68Å; R145-E171 IonicContact NH1-OE2 3.03Å; R145-L237 PolarHBondContact NH2-O 2.97Å; R145-S473 VanDerWaalsContact NH1-CB 3.32Å; R145-S473 PolarHBondContact NH1-OG 3.01Å
146	R	92.4	Very high	92.6	Very high	22 Å²	22	18.8 Å²	18.8	8%	0.083	9%	0.094	C	C	.	.	H	α-helix	trans	-58.9	-46.9	171.9	-174.9	-157.9	-161.3	69	14.4	111.8	D49 L142 Q143 I144 L148 T149 Q150 E540	D49-R146 IonicContact OD1-CZ 2.79Å; D49-R146 IonicContact OD1-NH1 2.82Å; D49-R146 PolarHBondContact OD1-NH1 3.35Å; D49-R146 IonicContact OD1-NH2 3.5Å; D49-R146 PolarHBondContact OD1-NH2 3.48Å; D49-R146 IonicContact OD2-CZ 3.72Å; D49-R146 IonicContact OD2-NH1 2.78Å; D49-R146 PolarHBondContact OD2-NH1 3.03Å; D49-R146 IonicContact OD2-NH2 3.26Å; D49-R146 PolarHBondContact OD2-NH2 3.33Å; L142-R146 PolarHBondContact O-N 3.44Å; Q143-R146 WeakPolarHBondContact O-CB 3.2Å; Q143-R146 PolarHBondContact O-N 3.25Å; I144-R146 VanDerWaalsContact C-N 3.29Å; I144-R146 PolarHBondContact O-N 3.5Å; R146-L148 VanDerWaalsContact C-N 3.3Å; R146-L148 PolarHBondContact O-N 2.9Å; R146-T149 PolarHBondContact O-N 3.5Å; R146-Q150 HydrophobicContact CG-CG 4.2Å; R146-Q150 WeakPolarHBondContact O-CB 3.45Å; R146-Q150 WeakPolarHBondContact O-CG 3.4Å; R146-Q150 PolarHBondContact O-N 3.45Å; R146-E540 IonicContact CZ-OE1 3.33Å; R146-E540 VanDerWaalsContact CZ-OE1 3.28Å; R146-E540 IonicContact NE-OE1 2.8Å; R146-E540 PolarHBondContact NE-OE1 2.99Å; R146-E540 IonicContact NH2-OE1 2.98Å; R146-E540 PolarHBondContact NH2-OE1 3.46Å
147	D	93.5	Very high	92.3	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.011	13%	0.127	C	C	.	.	H	α-helix	trans	-67.1	-31.3	-174.9	-63.7	-16.1	0	0	0	112.8	Q143 I144 G151 R152 L153	Q143-D147 PolarHBondContact NE2-OD1 3.39Å; Q143-D147 PolarHBondContact O-N 2.87Å; I144-D147 PolarHBondContact O-N 3.39Å; D147-G151 PolarHBondContact O-N 3.43Å; D147-G151 VanDerWaalsContact O-N 3.11Å; D147-R152 HydrophobicContact CB-CB 4.26Å; D147-R152 VanDerWaalsContact CG-CZ 3.48Å; D147-R152 PolarHBondContact O-N 2.86Å; D147-R152 IonicContact OD1-CZ 2.85Å; D147-R152 IonicContact OD1-NE 2.69Å; D147-R152 PolarHBondContact OD1-NE 3.15Å; D147-R152 IonicContact OD1-NH2 3.45Å; D147-R152 PolarHBondContact OD1-NH2 3.43Å; D147-R152 IonicContact OD2-CZ 2.85Å; D147-R152 IonicContact OD2-NE 2.63Å; D147-R152 IonicContact OD2-NH2 2.67Å; D147-R152 PolarHBondContact OD2-NH2 3.26Å; D147-L153 HydrophobicContact CB-CB 3.88Å; D147-L153 PolarHBondContact O-N 2.9Å
148	L	92.9	Very high	92	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.01	15%	0.149	C	C	.	.	H	α-helix	trans	-66.3	-53	169.5	-69.3	169.6	0	0	0	111.3	I144 R145 R146 Q150 G151 L153 C155 V167 I239 F241 L270	I144-L148 HydrophobicContact CG2-CD1 4.35Å; I144-L148 WeakPolarHBondContact O-CG 3.36Å; I144-L148 PolarHBondContact O-N 3.13Å; R145-L148 PolarHBondContact O-N 2.84Å; R146-L148 VanDerWaalsContact C-N 3.3Å; R146-L148 PolarHBondContact O-N 2.9Å; L148-Q150 VanDerWaalsContact C-N 3.28Å; L148-Q150 PolarHBondContact O-N 2.94Å; L148-G151 PolarHBondContact O-N 3.17Å; L148-G151 VanDerWaalsContact O-N 3.17Å; L148-L153 HydrophobicContact CD2-CB 4.3Å; L148-L153 HydrophobicContact CD2-CD2 3.89Å; L148-L153 HydrophobicContact CD2-CG 4.23Å; L148-L153 HydrophobicContact CG-CD2 4.15Å; L148-C155 WeakPolarHBondContact CD2-SG 3.37Å; L148-V167 HydrophobicContact CD1-CG2 4.13Å; L148-I239 WeakPolarHBondContact CB-O 3.49Å; L148-F241 PolarHBondContact O-N 3.32Å; L148-L270 HydrophobicContact CD1-CD1 4.34Å; L148-L270 HydrophobicContact CD1-CD2 4.47Å
149	T	90.3	Very high	91.9	Very high	30 Å²	30	26.8 Å²	26.8	18%	0.184	16%	0.155	C	C	.	.	H	α-helix	trans	-59.8	-37	179	-59.3	0	0	0	0	112.3	R145 R146 K238 I239	R145-T149 PolarHBondContact NE-OG1 3.08Å; R145-T149 PolarHBondContact O-N 3.4Å; R145-T149 VanDerWaalsContact O-N 3.13Å; R145-T149 PolarHBondContact O-OG1 3.23Å; R146-T149 PolarHBondContact O-N 3.5Å; T149-K238 HydrophobicContact CG2-CD 4.3Å; T149-K238 HydrophobicContact CG2-CG 4.26Å; T149-K238 WeakPolarHBondContact CG2-O 3.5Å; T149-K238 PolarHBondContact OG1-O 3.46Å; T149-I239 PolarHBondContact N-O 2.88Å; T149-I239 PolarHBondContact OG1-O 3.48Å
150	Q	88.7	Confident	91.8	Very high	44 Å²	44	26.9 Å²	26.9	21%	0.206	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-11	179.7	-68.9	-176.2	-23.4	0	0	114	R146 L148 R152 V538 E540	R146-Q150 HydrophobicContact CG-CG 4.2Å; R146-Q150 WeakPolarHBondContact O-CB 3.45Å; R146-Q150 WeakPolarHBondContact O-CG 3.4Å; R146-Q150 PolarHBondContact O-N 3.45Å; L148-Q150 VanDerWaalsContact C-N 3.28Å; L148-Q150 PolarHBondContact O-N 2.94Å; Q150-R152 VanDerWaalsContact C-N 3.29Å; Q150-R152 PolarHBondContact O-N 2.88Å; Q150-V538 WeakPolarHBondContact O-CG1 3.38Å; Q150-E540 PolarHBondContact NE2-OE1 2.81Å; Q150-E540 PolarHBondContact OE1-OE1 3.24Å
151	G	87.5	Confident	91.6	Very high	8 Å²	8	27.1 Å²	27.1	8%	0.082	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.7	14.1	-179.2	0	0	0	0	0	114.4	D147 L148	D147-G151 PolarHBondContact O-N 3.43Å; D147-G151 VanDerWaalsContact O-N 3.11Å; L148-G151 PolarHBondContact O-N 3.17Å; L148-G151 VanDerWaalsContact O-N 3.17Å
152	R	89.6	Confident	91.6	Very high	26 Å²	26	29.9 Å²	29.9	10%	0.098	17%	0.172	C	C	.	.			trans	-75	-35	175.6	-171.3	166.3	72.6	105.7	-12.8	111.5	Y123 D147 Q150 I282 V538	Y123-R152 PolarHBondContact OH-NH2 3.02Å; D147-R152 HydrophobicContact CB-CB 4.26Å; D147-R152 VanDerWaalsContact CG-CZ 3.48Å; D147-R152 PolarHBondContact O-N 2.86Å; D147-R152 IonicContact OD1-CZ 2.85Å; D147-R152 IonicContact OD1-NE 2.69Å; D147-R152 PolarHBondContact OD1-NE 3.15Å; D147-R152 IonicContact OD1-NH2 3.45Å; D147-R152 PolarHBondContact OD1-NH2 3.43Å; D147-R152 IonicContact OD2-CZ 2.85Å; D147-R152 IonicContact OD2-NE 2.63Å; D147-R152 IonicContact OD2-NH2 2.67Å; D147-R152 PolarHBondContact OD2-NH2 3.26Å; Q150-R152 VanDerWaalsContact C-N 3.29Å; Q150-R152 PolarHBondContact O-N 2.88Å; R152-I282 WeakPolarHBondContact CD-O 3.45Å; R152-I282 WeakPolarHBondContact CG-O 3.49Å; R152-I282 PolarHBondContact NH1-O 3.32Å; R152-V538 HydrophobicContact CB-CG1 4.07Å
153	L	92.8	Very high	91.6	Very high	6 Å²	6	29.3 Å²	29.3	3%	0.031	17%	0.169	C	C	.	.	S	Bend	trans	-91.7	103.6	172	-171.6	59.1	0	0	0	109.3	I144 D147 L148 C155 A274 L277	I144-L153 HydrophobicContact CD1-CD2 4.27Å; I144-L153 HydrophobicContact CG2-CD2 3.85Å; D147-L153 HydrophobicContact CB-CB 3.88Å; D147-L153 PolarHBondContact O-N 2.9Å; L148-L153 HydrophobicContact CD2-CB 4.3Å; L148-L153 HydrophobicContact CD2-CD2 3.89Å; L148-L153 HydrophobicContact CD2-CG 4.23Å; L148-L153 HydrophobicContact CG-CD2 4.15Å; L153-C155 PolarHBondContact O-N 2.98Å; L153-A274 HydrophobicContact CD2-CB 4.05Å; L153-L277 HydrophobicContact CD1-CB 3.89Å; L153-L277 HydrophobicContact CD1-CD1 3.87Å; L153-L277 HydrophobicContact CD1-CG 4.47Å; L153-L277 HydrophobicContact CD2-CD1 4.06Å; L153-L277 HydrophobicContact CG-CD1 3.81Å
154	L	87.3	Confident	91.6	Very high	49 Å²	49	29.3 Å²	29.3	26%	0.257	17%	0.168	S	C	.	.			trans	-76.7	113.9	179.4	-62.5	-179.4	0	0	0	110.9	T279 R351	L154-T279 HydrophobicContact CB-CG2 4.17Å; L154-T279 HydrophobicContact CD1-CG2 3.89Å; L154-T279 HydrophobicContact CG-CG2 3.98Å; L154-T279 PolarHBondContact N-OG1 3.09Å; L154-R351 HydrophobicContact CD1-CB 3.78Å; L154-R351 HydrophobicContact CD1-CG 3.86Å
155	C	87.6	Confident	91.6	Very high	30 Å²	30	29.3 Å²	29.3	20%	0.203	17%	0.168	C	C	.	.			trans	-94.4	129.6	174.2	-55.8	0	0	0	0	110.8	L148 L153 L163	L148-C155 WeakPolarHBondContact CD2-SG 3.37Å; L153-C155 PolarHBondContact O-N 2.98Å; C155-L163 HydrophobicContact CB-CD1 4.05Å; C155-L163 WeakPolarHBondContact SG-CD1 3.4Å
156	P	88.1	Confident	91.8	Very high	38 Å²	38	27.8 Å²	27.8	25%	0.247	16%	0.163	C	C	.	.			trans	-57.4	143.5	162.1	-24	34.2	0	0	0	111.2	S158 I159 V160	P156-S158 PolarHBondContact O-N 2.83Å; P156-S158 VanDerWaalsContact O-N 3.11Å; P156-I159 HydrophobicContact CB-CG1 4.43Å; P156-I159 HydrophobicContact CG-CD1 4.46Å; P156-I159 WeakPolarHBondContact O-CG1 3.33Å; P156-I159 PolarHBondContact O-N 3.4Å; P156-I159 VanDerWaalsContact O-N 3.15Å; P156-V160 PolarHBondContact O-N 3.37Å
157	P	87.5	Confident	91.9	Very high	107 Å²	107	26.7 Å²	26.7	70%	0.695	16%	0.159	S	C	*	.	G	3₁₀ helix	trans	-55.2	-31.3	177.5	-27.4	35.4	0	0	0	113.6	I159 V160	P157-I159 PolarHBondContact O-N 3.38Å; P157-I159 VanDerWaalsContact O-N 3.16Å; P157-V160 VanDerWaalsContact O-CG1 3.32Å; P157-V160 WeakPolarHBondContact O-CG1 3.4Å; P157-V160 PolarHBondContact O-N 3.43Å
158	S	90.4	Very high	91.9	Very high	98 Å²	98	26.6 Å²	26.6	69%	0.685	16%	0.158	S	C	*	.	G	3₁₀ helix	trans	-64.6	-16.5	-179.1	60.8	0	0	0	0	115.4	P156	P156-S158 PolarHBondContact O-N 2.83Å; P156-S158 VanDerWaalsContact O-N 3.11Å
159	I	93.3	Very high	91.9	Very high	36 Å²	36	26.7 Å²	26.7	19%	0.185	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-123.1	3.9	-179.4	67.4	170	0	0	0	112.9	P156 P157 G161 E162 L163 L277	P156-I159 HydrophobicContact CB-CG1 4.43Å; P156-I159 HydrophobicContact CG-CD1 4.46Å; P156-I159 WeakPolarHBondContact O-CG1 3.33Å; P156-I159 PolarHBondContact O-N 3.4Å; P156-I159 VanDerWaalsContact O-N 3.15Å; P157-I159 PolarHBondContact O-N 3.38Å; P157-I159 VanDerWaalsContact O-N 3.16Å; I159-G161 PolarHBondContact O-N 2.88Å; I159-E162 WeakPolarHBondContact CG2-OE2 3.39Å; I159-E162 PolarHBondContact O-N 3.13Å; I159-L163 HydrophobicContact CD1-CD1 3.69Å; I159-L163 HydrophobicContact CD1-CG 4.3Å; I159-L163 HydrophobicContact CG1-CD1 3.96Å; I159-L163 HydrophobicContact CG1-CG 4.42Å; I159-L163 WeakPolarHBondContact O-CG 3.45Å; I159-L163 PolarHBondContact O-N 2.78Å; I159-L277 HydrophobicContact CD1-CD2 3.56Å
160	V	92.7	Very high	92.1	Very high	15 Å²	15	26 Å²	26	9%	0.091	16%	0.156	C	C	.	.	H	α-helix	trans	-65.1	-40.8	-172.9	77.4	0	0	0	0	111.3	P156 P157 G164 I240 V247	P156-V160 PolarHBondContact O-N 3.37Å; P157-V160 VanDerWaalsContact O-CG1 3.32Å; P157-V160 WeakPolarHBondContact O-CG1 3.4Å; P157-V160 PolarHBondContact O-N 3.43Å; V160-G164 PolarHBondContact O-N 2.97Å; V160-I240 HydrophobicContact CG2-CD1 3.52Å; V160-I240 HydrophobicContact CG2-CG2 4.11Å; V160-I240 VanDerWaalsContact O-CD1 3.25Å; V160-I240 WeakPolarHBondContact O-CD1 3.33Å; V160-V247 HydrophobicContact CG1-CG1 4.35Å; V160-V247 HydrophobicContact CG2-CG1 4.07Å
161	G	94	Very high	92.1	Very high	4 Å²	4	24.7 Å²	24.7	4%	0.041	15%	0.15	C	C	.	.	H	α-helix	trans	-62.3	-45.6	172.5	0	0	0	0	0	112.6	I159 G164 A165	I159-G161 PolarHBondContact O-N 2.88Å; G161-G164 PolarHBondContact O-N 2.79Å; G161-A165 WeakPolarHBondContact O-CB 3.36Å; G161-A165 PolarHBondContact O-N 2.75Å
162	E	95.5	Very high	92.2	Very high	63 Å²	63	26 Å²	26	29%	0.294	16%	0.155	S	C	.	.	H	α-helix	trans	-62.3	-46.8	-179.3	-51.4	-175.6	129.4	0	0	112.6	I159 A165 L166 E254 R273	I159-E162 WeakPolarHBondContact CG2-OE2 3.39Å; I159-E162 PolarHBondContact O-N 3.13Å; E162-A165 PolarHBondContact O-N 3.08Å; E162-L166 WeakPolarHBondContact O-CG 3.49Å; E162-L166 PolarHBondContact O-N 3.5Å; E162-L166 VanDerWaalsContact O-N 3.08Å; E162-E254 HydrophobicContact CG-CG 4.3Å; E162-R273 IonicContact OE1-NH1 2.71Å; E162-R273 PolarHBondContact OE1-NH1 2.8Å; E162-R273 IonicContact OE2-CZ 3.83Å; E162-R273 IonicContact OE2-NH1 3.63Å; E162-R273 PolarHBondContact OE2-NH1 3.4Å
163	L	95.8	Very high	92.2	Very high	1 Å²	1	26 Å²	26	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-66.6	-39.8	178.9	-66.7	175	0	0	0	111	C155 I159 L166 V167 L270 R273 L277	C155-L163 HydrophobicContact CB-CD1 4.05Å; C155-L163 WeakPolarHBondContact SG-CD1 3.4Å; I159-L163 HydrophobicContact CD1-CD1 3.69Å; I159-L163 HydrophobicContact CD1-CG 4.3Å; I159-L163 HydrophobicContact CG1-CD1 3.96Å; I159-L163 HydrophobicContact CG1-CG 4.42Å; I159-L163 WeakPolarHBondContact O-CG 3.45Å; I159-L163 PolarHBondContact O-N 2.78Å; L163-L166 PolarHBondContact O-N 2.71Å; L163-V167 WeakPolarHBondContact O-CG2 3.38Å; L163-V167 PolarHBondContact O-N 3.25Å; L163-L270 HydrophobicContact CB-CD1 4.19Å; L163-L270 HydrophobicContact CD2-CD1 3.74Å; L163-R273 HydrophobicContact CD2-CB 3.72Å; L163-L277 HydrophobicContact CD1-CD1 4.08Å
164	G	94.8	Very high	92.1	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-68.4	-37.8	177.3	0	0	0	0	0	112.9	V160 G161 L166 V167 A168	V160-G164 PolarHBondContact O-N 2.97Å; G161-G164 PolarHBondContact O-N 2.79Å; G164-L166 PolarHBondContact O-N 3.08Å; G164-V167 PolarHBondContact O-N 2.71Å; G164-A168 PolarHBondContact O-N 2.92Å
165	A	95.5	Very high	92.1	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-61.9	-40.4	174.4	0	0	0	0	0	112.4	G161 E162 A168 Q169 E254 L258	G161-A165 WeakPolarHBondContact O-CB 3.36Å; G161-A165 PolarHBondContact O-N 2.75Å; E162-A165 PolarHBondContact O-N 3.08Å; A165-A168 PolarHBondContact O-N 2.85Å; A165-Q169 WeakPolarHBondContact O-CB 3.37Å; A165-Q169 PolarHBondContact O-N 2.9Å; A165-E254 HydrophobicContact CB-CB 3.69Å; A165-L258 HydrophobicContact CB-CD1 3.81Å
166	L	96.7	Very high	91.9	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-64.6	-38.1	175	-72.2	163.4	0	0	0	112.4	E162 L163 G164 A170 L258 L261 A266 E269 L270	E162-L166 WeakPolarHBondContact O-CG 3.49Å; E162-L166 PolarHBondContact O-N 3.5Å; E162-L166 VanDerWaalsContact O-N 3.08Å; L163-L166 PolarHBondContact O-N 2.71Å; G164-L166 PolarHBondContact O-N 3.08Å; L166-A170 WeakPolarHBondContact O-CB 3.31Å; L166-A170 PolarHBondContact O-N 3.18Å; L166-A170 VanDerWaalsContact O-N 3.08Å; L166-L258 HydrophobicContact CD2-CD1 3.93Å; L166-L258 HydrophobicContact CG-CD1 4.13Å; L166-L261 HydrophobicContact CD2-CD2 4.21Å; L166-A266 HydrophobicContact CD2-CB 4.27Å; L166-E269 HydrophobicContact CD1-CB 4.5Å; L166-E269 HydrophobicContact CD1-CG 3.85Å; L166-E269 HydrophobicContact CD2-CB 3.9Å; L166-E269 HydrophobicContact CD2-CG 3.65Å; L166-E269 HydrophobicContact CG-CG 4.43Å; L166-L270 HydrophobicContact CB-CB 4.19Å; L166-L270 HydrophobicContact CB-CD1 4.06Å; L166-L270 HydrophobicContact CD1-CB 4.46Å; L166-L270 HydrophobicContact CD1-CD1 4.38Å
167	V	94.5	Very high	91.2	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-68.6	-41.2	173.7	179.4	0	0	0	0	110.9	R145 L148 L163 G164 A170 E171 L237 I239 L270	R145-V167 HydrophobicContact CG-CG1 4.24Å; L148-V167 HydrophobicContact CD1-CG2 4.13Å; L163-V167 WeakPolarHBondContact O-CG2 3.38Å; L163-V167 PolarHBondContact O-N 3.25Å; G164-V167 PolarHBondContact O-N 2.71Å; V167-A170 PolarHBondContact O-N 2.87Å; V167-E171 HydrophobicContact CG1-CG 3.91Å; V167-E171 WeakPolarHBondContact O-CB 3.42Å; V167-E171 VanDerWaalsContact O-CG 3.25Å; V167-E171 WeakPolarHBondContact O-CG 3.34Å; V167-E171 PolarHBondContact O-N 3.48Å; V167-L237 HydrophobicContact CG1-CD2 4.25Å; V167-I239 HydrophobicContact CB-CG2 3.61Å; V167-I239 HydrophobicContact CG1-CG1 4.43Å; V167-I239 HydrophobicContact CG1-CG2 3.79Å; V167-I239 HydrophobicContact CG2-CG2 3.9Å; V167-L270 HydrophobicContact CG2-CD1 4.14Å; V167-L270 HydrophobicContact CG2-CD2 3.59Å
168	A	93.4	Very high	90.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-59.2	-49.2	175.1	0	0	0	0	0	111.8	G164 A165 A170 E171 I172 L234 Y255	G164-A168 PolarHBondContact O-N 2.92Å; A165-A168 PolarHBondContact O-N 2.85Å; A168-A170 VanDerWaalsContact C-N 3.27Å; A168-A170 PolarHBondContact O-N 3Å; A168-E171 PolarHBondContact O-N 2.86Å; A168-I172 HydrophobicContact CB-CD1 4.29Å; A168-I172 VanDerWaalsContact O-CB 3.28Å; A168-I172 WeakPolarHBondContact O-CB 3.41Å; A168-I172 PolarHBondContact O-N 3.5Å; A168-L234 HydrophobicContact CB-CD2 3.53Å; A168-Y255 HydrophobicContact CB-CD1 3.86Å; A168-Y255 HydrophobicContact CB-CD2 3.93Å; A168-Y255 HydrophobicContact CB-CE1 3.81Å; A168-Y255 HydrophobicContact CB-CE2 3.91Å; A168-Y255 HydrophobicContact CB-CG 3.93Å
169	Q	94.6	Very high	88.5	Confident	3 Å²	3	31.3 Å²	31.3	1%	0.014	17%	0.172	C	C	.	.	H	α-helix	trans	-60.9	-33.6	176.6	-170.1	69.2	33.2	0	0	112.7	A165 G173 D174 Y255 L258 L261 A266	A165-Q169 WeakPolarHBondContact O-CB 3.37Å; A165-Q169 PolarHBondContact O-N 2.9Å; Q169-G173 PolarHBondContact O-N 3.05Å; Q169-G173 PolarHBondContact OE1-O 3.1Å; Q169-D174 PolarHBondContact NE2-OD1 3.17Å; Q169-Y255 HydrophobicContact CB-CD2 4.29Å; Q169-Y255 HydrophobicContact CB-CE2 4.07Å; Q169-Y255 VanDerWaalsContact OE1-CE2 3.29Å; Q169-L258 HydrophobicContact CB-CB 4.4Å; Q169-L258 HydrophobicContact CB-CD1 4.21Å; Q169-L258 HydrophobicContact CG-CB 4.13Å; Q169-L258 PolarHBondContact NE2-O 3.33Å; Q169-L258 PolarHBondContact OE1-O 3.11Å; Q169-L261 HydrophobicContact CG-CB 4.12Å; Q169-L261 HydrophobicContact CG-CD2 4.46Å; Q169-L261 PolarHBondContact NE2-O 2.92Å; Q169-A266 HydrophobicContact CB-CB 4.06Å; Q169-A266 HydrophobicContact CG-CB 4.03Å
170	A	93.3	Very high	86	Confident	17 Å²	17	35.5 Å²	35.5	14%	0.14	20%	0.199	C	C	.	.	H	α-helix	trans	-76.6	-34.5	176.6	0	0	0	0	0	114.1	Y141 L166 V167 A168 A266 E267	Y141-A170 HydrophobicContact CE2-CB 4.1Å; L166-A170 WeakPolarHBondContact O-CB 3.31Å; L166-A170 PolarHBondContact O-N 3.18Å; L166-A170 VanDerWaalsContact O-N 3.08Å; V167-A170 PolarHBondContact O-N 2.87Å; A168-A170 VanDerWaalsContact C-N 3.27Å; A168-A170 PolarHBondContact O-N 3Å; A170-A266 HydrophobicContact CB-CB 4.23Å; A170-E267 HydrophobicContact CB-CG 4.24Å
171	E	89.9	Confident	83.3	Confident	16 Å²	16	43 Å²	43	8%	0.075	23%	0.232	C	C	.	.	H	α-helix	trans	-96.5	-27.8	-173	-63.8	-99	-172.7	0	0	113.8	Y141 R145 V167 A168 L237 S472 S473 F474	Y141-E171 WeakPolarHBondContact OH-CG 3.29Å; Y141-E171 PolarHBondContact OH-OE1 3.24Å; R145-E171 IonicContact CZ-OE1 3.94Å; R145-E171 IonicContact NH1-OE1 3.94Å; R145-E171 PolarHBondContact NH1-OE1 2.68Å; R145-E171 IonicContact NH1-OE2 3.03Å; V167-E171 HydrophobicContact CG1-CG 3.91Å; V167-E171 WeakPolarHBondContact O-CB 3.42Å; V167-E171 VanDerWaalsContact O-CG 3.25Å; V167-E171 WeakPolarHBondContact O-CG 3.34Å; V167-E171 PolarHBondContact O-N 3.48Å; A168-E171 PolarHBondContact O-N 2.86Å; E171-L237 HydrophobicContact CB-CD1 4.48Å; E171-L237 HydrophobicContact CB-CD2 4.14Å; E171-L237 HydrophobicContact CG-CD1 4.41Å; E171-L237 HydrophobicContact CG-CD2 4.32Å; E171-S472 WeakPolarHBondContact O-CB 3.3Å; E171-S472 PolarHBondContact O-OG 2.9Å; E171-S472 WeakPolarHBondContact OE2-CA 3.35Å; E171-S472 PolarHBondContact OE2-OG 3.03Å; E171-S473 VanDerWaalsContact CD-OG 3.32Å; E171-S473 WeakPolarHBondContact OE2-CB 3.45Å; E171-S473 PolarHBondContact OE2-N 3.03Å; E171-S473 PolarHBondContact OE2-OG 3.37Å; E171-F474 HydrophobicContact CB-CD2 4.29Å; E171-F474 HydrophobicContact CB-CE2 4.31Å
172	I	89.4	Confident	80.5	Confident	35 Å²	35	48.1 Å²	48.1	18%	0.179	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112	-38	-173.8	-54.9	172.1	0	0	0	111.8	A168 M233 L234 Y255 F474	A168-I172 HydrophobicContact CB-CD1 4.29Å; A168-I172 VanDerWaalsContact O-CB 3.28Å; A168-I172 WeakPolarHBondContact O-CB 3.41Å; A168-I172 PolarHBondContact O-N 3.5Å; I172-M233 HydrophobicContact CD1-CB 4.34Å; I172-M233 HydrophobicContact CD1-CE 4.34Å; I172-M233 HydrophobicContact CG2-CE 3.49Å; I172-M233 VanDerWaalsContact CG2-CE 3.49Å; I172-L234 HydrophobicContact CD1-CD2 3.88Å; I172-Y255 WeakPolarHBondContact CB-OH 3.5Å; I172-Y255 WeakPolarHBondContact CG2-OH 3.48Å; I172-F474 HydrophobicContact CD1-CE2 3.69Å; I172-F474 HydrophobicContact CD1-CZ 3.78Å; I172-F474 HydrophobicContact CG1-CD2 4.02Å; I172-F474 HydrophobicContact CG1-CE2 3.25Å; I172-F474 HydrophobicContact CG1-CZ 3.83Å
173	G	89.4	Confident	77.6	Confident	27 Å²	27	50.4 Å²	50.4	28%	0.278	28%	0.284	S	S	.	.			trans	100	-150.7	-168.3	0	0	0	0	0	111.8	Q169 Y255	Q169-G173 PolarHBondContact O-N 3.05Å; Q169-G173 PolarHBondContact OE1-O 3.1Å; G173-Y255 WeakPolarHBondContact O-CE2 3.39Å; G173-Y255 PolarHBondContact O-OH 3.44Å
174	D	90.9	Very high	74.5	Confident	78 Å²	78	58 Å²	58	42%	0.417	32%	0.324	S	S	.	.	S	Bend	trans	-69.1	137.9	-176.5	-81.7	-8	0	0	0	113.5	Q169 R259 G260	Q169-D174 PolarHBondContact NE2-OD1 3.17Å; D174-R259 HydrophobicContact CB-CG 4.15Å; D174-R259 WeakPolarHBondContact OD1-CA 3.47Å; D174-R259 WeakPolarHBondContact OD2-CG 3.46Å; D174-G260 PolarHBondContact OD1-N 3.08Å; D174-G260 PolarHBondContact OD2-N 2.9Å
175	A	87.8	Confident	71.8	Confident	3 Å²	3	63 Å²	63	3%	0.025	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-66.3	150.9	170.4	0	0	0	0	0	112	Y255 Q256	A175-Y255 HydrophobicContact CB-CD1 3.8Å; A175-Y255 HydrophobicContact CB-CD2 4.01Å; A175-Y255 HydrophobicContact CB-CE1 3.78Å; A175-Y255 HydrophobicContact CB-CE2 3.96Å; A175-Y255 HydrophobicContact CB-CG 3.9Å; A175-Q256 HydrophobicContact CB-CG 4.13Å
176	P	82.6	Confident	69	Low	9 Å²	9	70.2 Å²	70.2	6%	0.058	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-56.4	145.7	168.3	15	-24.1	0	0	0	112.4	T224 L225 C230	P176-T224 HydrophobicContact CB-CG2 4.37Å; P176-L225 VanDerWaalsContact CB-O 3.25Å; P176-L225 WeakPolarHBondContact CB-O 3.41Å; P176-L225 WeakPolarHBondContact CG-O 3.28Å; P176-C230 HydrophobicContact CG-CB 3.83Å
177	S	74.1	Confident	66.1	Low	72 Å²	72	76.1 Å²	76.1	50%	0.503	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-56.4	151.5	158.6	49.7	0	0	0	0	110.3
178	E	67.7	Low	63.3	Low	148 Å²	148	82.9 Å²	82.9	69%	0.692	47%	0.47	S	S	*	.	S	Bend	trans	-54	161.2	176.8	-68.6	-179.5	149.5	0	0	112.5	V180	E178-V180 PolarHBondContact O-N 3.49Å
179	H	52.8	Low	60.4	Low	129 Å²	129	91.4 Å²	91.4	60%	0.597	51%	0.509	S	S	*	.			trans	-46.5	114.5	-176	-74.3	-85.8	0	0	0	112	E181 Y227	H179-E181 PolarHBondContact O-N 2.9Å; H179-Y227 AromaticContact NE2-CD1 3.64Å; H179-Y227 AromaticContact NE2-CE1 4Å; H179-Y227 AromaticContact NE2-CG 3.87Å
180	V	41	Very low	57.5	Low	124 Å²	124	97.1 Å²	97.1	75%	0.752	55%	0.548	S	S	*	.			trans	-67.1	97.8	149.6	179.8	0	0	0	0	105.1	E178 T182	E178-V180 PolarHBondContact O-N 3.49Å; V180-T182 PolarHBondContact O-N 2.7Å
181	E	36.8	Very low	54.6	Low	171 Å²	171	102 Å²	102	80%	0.799	58%	0.576	S	S	*	*			trans	-55.5	106.2	161.2	-67.7	-176.8	169.8	0	0	106.7	H179 P183	H179-E181 PolarHBondContact O-N 2.9Å; E181-P183 WeakPolarHBondContact O-CD 3.44Å
182	T	33.3	Very low	51.9	Low	112 Å²	112	107 Å²	107	69%	0.687	61%	0.61	S	S	*	*			trans	-66.1	112.9	168.4	37.7	0	0	0	0	107.3	V180 N184	V180-T182 PolarHBondContact O-N 2.7Å; T182-N184 PolarHBondContact O-N 2.81Å
183	P	34.8	Very low	49.5	Very low	111 Å²	111	111.6 Å²	111.6	72%	0.721	64%	0.642	S	S	*	*			trans	-71.6	119.5	-179.6	-11.5	28.5	0	0	0	108.2	E181	E181-P183 WeakPolarHBondContact O-CD 3.44Å
184	N	32.2	Very low	46.8	Very low	160 Å²	160	118.6 Å²	118.6	86%	0.856	67%	0.673	S	S	*	*			trans	62.2	89.3	167.5	-46.6	-32.7	0	0	0	115.9	T182	T182-N184 PolarHBondContact O-N 2.81Å
185	S	38.2	Very low	43.9	Very low	106 Å²	106	124.4 Å²	124.4	74%	0.741	69%	0.69	S	S	*	*			trans	-131.9	138	139.5	60.6	0	0	0	0	109.1
186	D	36.4	Very low	41.3	Very low	152 Å²	152	130.5 Å²	130.5	81%	0.813	72%	0.722	S	S	*	*			trans	-69.1	152.1	-157.7	-66.1	-72.9	0	0	0	115.2	N188	D186-N188 PolarHBondContact O-N 3.02Å; D186-N188 VanDerWaalsContact O-N 3.1Å
187	V	34.9	Very low	38.9	Very low	125 Å²	125	132.9 Å²	132.9	76%	0.758	74%	0.739	S	S	*	*			trans	-53.1	112	175.7	-180	0	0	0	0	110.8
188	N	36.8	Very low	37.1	Very low	143 Å²	143	139.8 Å²	139.8	77%	0.765	75%	0.754	S	S	*	*			trans	-132.3	119.7	159.3	-86.8	-57.1	0	0	0	109.7	D186 C190	D186-N188 PolarHBondContact O-N 3.02Å; D186-N188 VanDerWaalsContact O-N 3.1Å; N188-C190 PolarHBondContact O-N 2.85Å; N188-C190 VanDerWaalsContact O-N 3.16Å
189	H	32.4	Very low	35.5	Very low	179 Å²	179	140.5 Å²	140.5	83%	0.829	76%	0.762	S	S	*	*			trans	-68.3	107.6	177.8	-70.9	-67.7	0	0	0	110.7
190	C	32.6	Very low	34.5	Very low	122 Å²	122	141.5 Å²	141.5	82%	0.824	77%	0.772	S	S	*	*			trans	-102.6	103.7	168.9	-77.3	0	0	0	0	111	N188	N188-C190 PolarHBondContact O-N 2.85Å; N188-C190 VanDerWaalsContact O-N 3.16Å
191	T	33.3	Very low	34.4	Very low	120 Å²	120	140.9 Å²	140.9	74%	0.736	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-54.2	149.6	159.3	42.9	0	0	0	0	111.4
192	P	33.1	Very low	34.5	Very low	120 Å²	120	139 Å²	139	78%	0.779	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-61.8	135.2	175.7	26.5	-33.8	0	0	0	110.7	L194	P192-L194 PolarHBondContact O-N 3.1Å
193	P	38.5	Very low	34.6	Very low	132 Å²	132	142.2 Å²	142.2	86%	0.857	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-70.3	127.9	-177.9	-14.3	28	0	0	0	111.4
194	L	32.7	Very low	34.7	Very low	175 Å²	175	142.6 Å²	142.6	92%	0.916	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-74	135.1	159.5	-77.8	168.2	0	0	0	108.9	P192	P192-L194 PolarHBondContact O-N 3.1Å
195	Y	30.8	Very low	34.8	Very low	199 Å²	199	141 Å²	141	78%	0.78	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-79.4	131.4	174.8	126.5	-79.6	0	0	0	109.8	S197	Y195-S197 WeakPolarHBondContact CE2-OG 3.36Å; Y195-S197 PolarHBondContact OH-OG 3.39Å
196	D	32.4	Very low	34.8	Very low	131 Å²	131	145.3 Å²	145.3	70%	0.701	79%	0.79	S	S	*	*			trans	-125.4	143.2	161	-171.2	8.2	0	0	0	108
197	S	32	Very low	34.6	Very low	59 Å²	59	143 Å²	143	41%	0.413	79%	0.786	S	S	.	*			trans	-110	115.7	-176.7	-38.6	0	0	0	0	109.8	Y195	Y195-S197 WeakPolarHBondContact CE2-OG 3.36Å; Y195-S197 PolarHBondContact OH-OG 3.39Å
198	R	36.4	Very low	34.7	Very low	217 Å²	217	143.7 Å²	143.7	82%	0.819	79%	0.79	S	S	*	*			trans	-162.2	143	157.6	-104.9	129.6	-172.4	169.5	1.3	113.8
199	L	34.7	Very low	34.8	Very low	164 Å²	164	143.7 Å²	143.7	86%	0.859	79%	0.79	S	S	*	*			trans	83	94.7	157.1	-67.4	156.5	0	0	0	118.1
200	D	31.4	Very low	35	Very low	150 Å²	150	144.1 Å²	144.1	80%	0.802	80%	0.795	S	S	*	*			trans	-56.2	153.6	149.4	-50.5	-83.8	0	0	0	112.5
201	S	38.2	Very low	35.1	Very low	110 Å²	110	142.6 Å²	142.6	77%	0.769	79%	0.785	S	S	*	*				141.8	151.9	120.7	-61.6	0	0	0	0	115.4
202	V	39.8	Very low	35.3	Very low	133 Å²	133	144.2 Å²	144.2	81%	0.806	79%	0.79	S	S	*	*			trans	81.4	74.5	160.5	-156.6	0	0	0	0	118.3
203	E	35.2	Very low	35.4	Very low	179 Å²	179	145 Å²	145	84%	0.836	79%	0.788	S	S	*	*				19.7	123.2	112.5	-171.5	169.2	-135.9	0	0	119.2
204	S	37.4	Very low	35.4	Very low	119 Å²	119	146.6 Å²	146.6	83%	0.832	79%	0.789	S	S	*	*			trans	-168.8	135.1	136.7	-82.2	0	0	0	0	113
205	T	33.7	Very low	35.2	Very low	127 Å²	127	146 Å²	146	78%	0.779	79%	0.787	S	S	*	*			trans	-62.6	152.3	175	46.5	0	0	0	0	115
206	E	37.5	Very low	35.4	Very low	196 Å²	196	141 Å²	141	92%	0.916	78%	0.779	S	S	*	*				-170.5	159.7	110.6	-105.8	177.1	-178.3	0	0	113.7
207	S	32	Very low	35.3	Very low	103 Å²	103	143 Å²	143	72%	0.72	79%	0.79	S	S	*	*			trans	-123.5	139.7	-168	56.8	0	0	0	0	112.1
208	T	37.2	Very low	35.3	Very low	139 Å²	139	147.8 Å²	147.8	85%	0.853	81%	0.806	S	S	*	*			trans	-160.2	134.3	144.4	8	0	0	0	0	115.3
209	N	39	Very low	35	Very low	144 Å²	144	142.7 Å²	142.7	77%	0.77	80%	0.803	S	S	*	*			trans	-21.7	145.9	159.9	-53.4	-35.8	0	0	0	118.4
210	M	37.9	Very low	34.8	Very low	187 Å²	187	143 Å²	143	92%	0.921	80%	0.803	S	S	*	*				-165.3	141.9	106.5	-97	-67.7	173.2	0	0	110.9
211	S	34	Very low	34.8	Very low	90 Å²	90	144.3 Å²	144.3	63%	0.629	81%	0.805	S	S	*	*			trans	-80.6	148.8	177.2	130.6	0	0	0	0	111
212	N	37.4	Very low	34.7	Very low	155 Å²	155	142 Å²	142	83%	0.829	80%	0.797	S	S	*	*				-163.8	148.8	129.3	-95.1	-25.4	0	0	0	112.8
213	N	34.3	Very low	35	Very low	137 Å²	137	142.5 Å²	142.5	73%	0.733	79%	0.791	S	S	*	*			trans	-66	154.9	-176	-49.7	-62.3	0	0	0	113
214	N	38.7	Very low	35.9	Very low	164 Å²	164	138.5 Å²	138.5	88%	0.877	78%	0.779	S	S	*	*				-168.1	148.1	127.2	-92	-27.8	0	0	0	111.3
215	D	30.3	Very low	37.2	Very low	164 Å²	164	134.3 Å²	134.3	88%	0.877	75%	0.747	S	S	*	*			trans	-57.2	139.8	174.8	-72.8	-59	0	0	0	112.7
216	C	33.7	Very low	39.1	Very low	93 Å²	93	132.7 Å²	132.7	63%	0.628	73%	0.734	S	S	*	*			trans	-155	110.1	151	-155.9	0	0	0	0	110.8	Q218	C216-Q218 VanDerWaalsContact C-N 3.3Å; C216-Q218 HydrophobicContact CB-CG 4.07Å; C216-Q218 PolarHBondContact O-N 3.11Å; C216-Q218 VanDerWaalsContact SG-CG 3.54Å
217	D	30	Very low	41.1	Very low	172 Å²	172	126.9 Å²	126.9	92%	0.92	70%	0.704	S	S	*	*			trans	-60.9	92.1	158.9	-88.2	-45.4	0	0	0	108.9
218	Q	33.3	Very low	43.5	Very low	161 Å²	161	126.4 Å²	126.4	75%	0.752	70%	0.697	S	S	*	*			trans	-98.1	100.8	170.8	-68.8	-163.8	-4.8	0	0	110.4	C216 I220	C216-Q218 VanDerWaalsContact C-N 3.3Å; C216-Q218 HydrophobicContact CB-CG 4.07Å; C216-Q218 PolarHBondContact O-N 3.11Å; C216-Q218 VanDerWaalsContact SG-CG 3.54Å; Q218-I220 PolarHBondContact O-N 3.1Å
219	C	29.4	Very low	45.6	Very low	110 Å²	110	120.4 Å²	120.4	74%	0.743	66%	0.662	S	S	*	*			trans	-49.7	131.6	161.7	-59.8	0	0	0	0	109.8	Q221	C219-Q221 PolarHBondContact O-N 3.36Å
220	I	30.2	Very low	47.8	Very low	171 Å²	171	113.6 Å²	113.6	88%	0.877	63%	0.625	S	S	*	*			trans	-67.7	85.7	170.6	-56.6	173.3	0	0	0	107.9	Q218 G222	Q218-I220 PolarHBondContact O-N 3.1Å; I220-G222 PolarHBondContact O-N 3.16Å
221	Q	31.6	Very low	50	Low	177 Å²	177	105.9 Å²	105.9	83%	0.827	59%	0.589	S	S	*	*			trans	-70.6	116.9	166.5	-70	-172.7	-8.1	0	0	107.4	C219 E223	C219-Q221 PolarHBondContact O-N 3.36Å; Q221-E223 PolarHBondContact O-N 3.46Å
222	G	36.2	Very low	52.4	Low	60 Å²	60	104.5 Å²	104.5	62%	0.619	57%	0.573	S	S	*	*			trans	-60.3	125.1	-176.9	0	0	0	0	0	111.5	I220 T224	I220-G222 PolarHBondContact O-N 3.16Å; G222-T224 PolarHBondContact O-N 3.15Å
223	E	46.4	Very low	54.5	Low	144 Å²	144	97.5 Å²	97.5	67%	0.673	54%	0.535	S	S	*	.			trans	-53.8	112.5	176.1	-67	-176.6	134.6	0	0	109.7	Q221 L225	Q221-E223 PolarHBondContact O-N 3.46Å; E223-L225 PolarHBondContact O-N 3.03Å
224	T	53.6	Low	57	Low	96 Å²	96	91 Å²	91	59%	0.589	50%	0.501	S	S	*	.			trans	-78.4	111.4	-178.5	-58	0	0	0	0	108.8	P176 G222 N226	P176-T224 HydrophobicContact CB-CG2 4.37Å; G222-T224 PolarHBondContact O-N 3.15Å; T224-N226 PolarHBondContact O-N 2.84Å
225	L	65	Low	59.1	Low	30 Å²	30	88.4 Å²	88.4	16%	0.157	48%	0.478	C	S	.	.			trans	-68.3	128.1	-175.7	-176.9	142.6	0	0	0	110.9	P176 E223 A229 C230 M233 Y481	P176-L225 VanDerWaalsContact CB-O 3.25Å; P176-L225 WeakPolarHBondContact CB-O 3.41Å; P176-L225 WeakPolarHBondContact CG-O 3.28Å; E223-L225 PolarHBondContact O-N 3.03Å; L225-A229 HydrophobicContact CD2-CB 3.73Å; L225-A229 HydrophobicContact CG-CB 4.08Å; L225-C230 HydrophobicContact CD2-CB 3.77Å; L225-C230 VanDerWaalsContact CD2-N 3.29Å; L225-M233 HydrophobicContact CD1-CE 3.49Å; L225-M233 VanDerWaalsContact CD1-CE 3.49Å; L225-M233 HydrophobicContact CD1-SD 4.05Å; L225-M233 HydrophobicContact CD2-CE 3.41Å; L225-M233 VanDerWaalsContact CD2-CE 3.41Å; L225-M233 HydrophobicContact CG-CE 4.08Å; L225-Y481 HydrophobicContact CD1-CD1 4.14Å; L225-Y481 HydrophobicContact CD1-CE1 3.63Å; L225-Y481 HydrophobicContact CD1-CE2 4.3Å
226	N	74.2	Confident	61.7	Low	94 Å²	94	85.6 Å²	85.6	50%	0.503	46%	0.459	S	S	.	.			trans	-66.7	156.8	-169	76.6	35.4	0	0	0	113.8	T224 T228 A229 C230	T224-N226 PolarHBondContact O-N 2.84Å; N226-T228 VanDerWaalsContact C-N 3.32Å; N226-T228 PolarHBondContact O-N 2.74Å; N226-T228 PolarHBondContact OD1-N 3.37Å; N226-A229 PolarHBondContact O-N 3.01Å; N226-A229 VanDerWaalsContact OD1-CB 3.26Å; N226-A229 WeakPolarHBondContact OD1-CB 3.17Å; N226-A229 PolarHBondContact OD1-N 2.89Å; N226-C230 PolarHBondContact O-N 2.74Å
227	Y	79.8	Confident	64	Low	74 Å²	74	81.6 Å²	81.6	29%	0.29	43%	0.431	S	S	.	.	H	α-helix	trans	-53.8	-45.1	-174.7	-174	-88.3	0	0	0	113.1	H179 C230 C231 M252	H179-Y227 AromaticContact NE2-CD1 3.64Å; H179-Y227 AromaticContact NE2-CE1 4Å; H179-Y227 AromaticContact NE2-CG 3.87Å; Y227-C230 WeakPolarHBondContact O-CB 3.42Å; Y227-C230 PolarHBondContact O-N 3.08Å; Y227-C231 WeakPolarHBondContact CE1-SG 3.38Å; Y227-C231 PolarHBondContact O-N 2.75Å; Y227-C231 PolarHBondContact O-SG 3.11Å; Y227-C231 VanDerWaalsContact O-SG 3.35Å; Y227-M252 HydrophobicContact CD2-CE 3.67Å; Y227-M252 HydrophobicContact CE2-CE 3.36Å; Y227-M252 HydrophobicContact CG-CE 4.48Å
228	T	81.5	Confident	66.5	Low	92 Å²	92	79.4 Å²	79.4	56%	0.564	41%	0.413	S	S	*	.	H	α-helix	trans	-62.6	-47.4	179.6	-48.4	0	0	0	0	112	N226 C230 C231 E232	N226-T228 VanDerWaalsContact C-N 3.32Å; N226-T228 PolarHBondContact O-N 2.74Å; N226-T228 PolarHBondContact OD1-N 3.37Å; T228-C230 VanDerWaalsContact C-N 3.26Å; T228-C230 PolarHBondContact O-N 3.25Å; T228-C231 PolarHBondContact O-N 2.9Å; T228-E232 WeakPolarHBondContact O-CG 3.18Å; T228-E232 PolarHBondContact O-N 3.04Å
229	A	81.5	Confident	69	Low	14 Å²	14	71.8 Å²	71.8	12%	0.116	38%	0.378	C	S	.	.	H	α-helix	trans	-63.3	-33.6	175.9	0	0	0	0	0	111.7	L225 N226 E232 M233	L225-A229 HydrophobicContact CD2-CB 3.73Å; L225-A229 HydrophobicContact CG-CB 4.08Å; N226-A229 PolarHBondContact O-N 3.01Å; N226-A229 VanDerWaalsContact OD1-CB 3.26Å; N226-A229 WeakPolarHBondContact OD1-CB 3.17Å; N226-A229 PolarHBondContact OD1-N 2.89Å; A229-E232 PolarHBondContact O-N 2.93Å; A229-M233 WeakPolarHBondContact O-CB 3.46Å; A229-M233 WeakPolarHBondContact O-CG 3.26Å; A229-M233 PolarHBondContact O-N 2.9Å
230	C	84.8	Confident	71.7	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.007	35%	0.345	C	S	.	.	H	α-helix	trans	-65	-46	174.9	-171.6	0	0	0	0	111.3	P176 L225 N226 Y227 T228 M233 L234 M252	P176-C230 HydrophobicContact CG-CB 3.83Å; L225-C230 HydrophobicContact CD2-CB 3.77Å; L225-C230 VanDerWaalsContact CD2-N 3.29Å; N226-C230 PolarHBondContact O-N 2.74Å; Y227-C230 WeakPolarHBondContact O-CB 3.42Å; Y227-C230 PolarHBondContact O-N 3.08Å; T228-C230 VanDerWaalsContact C-N 3.26Å; T228-C230 PolarHBondContact O-N 3.25Å; C230-M233 WeakPolarHBondContact O-CB 3.49Å; C230-M233 PolarHBondContact O-N 3.31Å; C230-L234 WeakPolarHBondContact O-CG 3.4Å; C230-L234 PolarHBondContact O-N 2.69Å; C230-M252 HydrophobicContact CB-CE 4.37Å
231	C	84.4	Confident	74.3	Confident	25 Å²	25	62.6 Å²	62.6	17%	0.169	32%	0.319	C	S	.	.	H	α-helix	trans	-61.8	-43.2	174	-64.9	0	0	0	0	112.3	Y227 T228 M233 L234 R235	Y227-C231 WeakPolarHBondContact CE1-SG 3.38Å; Y227-C231 PolarHBondContact O-N 2.75Å; Y227-C231 PolarHBondContact O-SG 3.11Å; Y227-C231 VanDerWaalsContact O-SG 3.35Å; T228-C231 PolarHBondContact O-N 2.9Å; C231-M233 VanDerWaalsContact C-N 3.3Å; C231-M233 PolarHBondContact O-N 2.7Å; C231-L234 PolarHBondContact O-N 3.41Å; C231-R235 PolarHBondContact O-N 2.67Å; C231-R235 VanDerWaalsContact O-N 3.11Å
232	E	83.8	Confident	76.7	Confident	61 Å²	61	59.8 Å²	59.8	29%	0.285	31%	0.31	S	S	.	.	H	α-helix	trans	-59.3	-40.4	173.2	-73.6	-52.7	119.3	0	0	112.4	T228 A229 R235 K236 L480	T228-E232 WeakPolarHBondContact O-CG 3.18Å; T228-E232 PolarHBondContact O-N 3.04Å; A229-E232 PolarHBondContact O-N 2.93Å; E232-R235 IonicContact OE1-CZ 3.2Å; E232-R235 IonicContact OE1-NH1 2.74Å; E232-R235 PolarHBondContact OE1-NH1 3.06Å; E232-R235 IonicContact OE1-NH2 2.75Å; E232-R235 PolarHBondContact OE1-NH2 2.92Å; E232-R235 IonicContact OE2-CZ 3.97Å; E232-R235 IonicContact OE2-NH1 2.93Å; E232-R235 PolarHBondContact OE2-NH1 2.99Å; E232-K236 VanDerWaalsContact O-CG 3.32Å; E232-K236 WeakPolarHBondContact O-CG 3.36Å; E232-K236 PolarHBondContact O-N 3.4Å; E232-K236 VanDerWaalsContact O-N 3.08Å; E232-L480 HydrophobicContact CB-CD1 4.22Å
233	M	82.1	Confident	79.2	Confident	7 Å²	7	58.4 Å²	58.4	3%	0.034	29%	0.287	C	S	.	.	H	α-helix	trans	-65.1	-49.2	175.8	-82	-160.5	-50.2	0	0	112	I172 L225 A229 C230 C231 R235 K236 L237 F474 L480	I172-M233 HydrophobicContact CD1-CB 4.34Å; I172-M233 HydrophobicContact CD1-CE 4.34Å; I172-M233 HydrophobicContact CG2-CE 3.49Å; I172-M233 VanDerWaalsContact CG2-CE 3.49Å; L225-M233 HydrophobicContact CD1-CE 3.49Å; L225-M233 VanDerWaalsContact CD1-CE 3.49Å; L225-M233 HydrophobicContact CD1-SD 4.05Å; L225-M233 HydrophobicContact CD2-CE 3.41Å; L225-M233 VanDerWaalsContact CD2-CE 3.41Å; L225-M233 HydrophobicContact CG-CE 4.08Å; A229-M233 WeakPolarHBondContact O-CB 3.46Å; A229-M233 WeakPolarHBondContact O-CG 3.26Å; A229-M233 PolarHBondContact O-N 2.9Å; C230-M233 WeakPolarHBondContact O-CB 3.49Å; C230-M233 PolarHBondContact O-N 3.31Å; C231-M233 VanDerWaalsContact C-N 3.3Å; C231-M233 PolarHBondContact O-N 2.7Å; M233-R235 PolarHBondContact O-N 2.98Å; M233-K236 PolarHBondContact O-N 3.08Å; M233-K236 VanDerWaalsContact O-N 3.15Å; M233-L237 WeakPolarHBondContact O-CB 3.45Å; M233-L237 PolarHBondContact O-N 3.31Å; M233-F474 HydrophobicContact CB-CE1 3.54Å; M233-F474 HydrophobicContact CB-CZ 3.61Å; M233-F474 HydrophobicContact CG-CD1 4.36Å; M233-F474 HydrophobicContact CG-CE1 3.68Å; M233-F474 HydrophobicContact CG-CZ 4.17Å; M233-F474 WeakPolarHBondContact O-CE1 3.45Å; M233-F474 VanDerWaalsContact O-CZ 3.22Å; M233-F474 WeakPolarHBondContact O-CZ 3.38Å; M233-F474 HydrophobicContact SD-CD1 4.32Å; M233-F474 HydrophobicContact SD-CE1 4.04Å; M233-F474 HydrophobicContact SD-CZ 4.38Å; M233-L480 HydrophobicContact CG-CD1 3.52Å
234	L	86.4	Confident	81.3	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-54.2	-43.1	177.1	-69.9	-173	0	0	0	111.9	A168 I172 C230 C231 L237 I239 Q243 I251 M252 Y255	A168-L234 HydrophobicContact CB-CD2 3.53Å; I172-L234 HydrophobicContact CD1-CD2 3.88Å; C230-L234 WeakPolarHBondContact O-CG 3.4Å; C230-L234 PolarHBondContact O-N 2.69Å; C231-L234 PolarHBondContact O-N 3.41Å; L234-L237 PolarHBondContact O-N 2.95Å; L234-I239 HydrophobicContact CD2-CD1 3.81Å; L234-Q243 PolarHBondContact O-NE2 3.04Å; L234-I251 HydrophobicContact CD1-CB 4.42Å; L234-I251 HydrophobicContact CD1-CG2 3.73Å; L234-I251 HydrophobicContact CD2-CG2 4.14Å; L234-M252 HydrophobicContact CD1-CG 3.58Å; L234-M252 HydrophobicContact CD1-SD 3.32Å; L234-M252 WeakPolarHBondContact CD1-SD 3Å; L234-M252 HydrophobicContact CG-SD 4.24Å; L234-Y255 HydrophobicContact CD2-CD1 4.41Å; L234-Y255 HydrophobicContact CD2-CE1 4.39Å
235	R	84.2	Confident	83	Confident	109 Å²	109	53.1 Å²	53.1	41%	0.411	27%	0.267	S	S	.	.	H	α-helix	trans	-65.2	-41.9	179	-168.2	161.1	-8.5	90.7	3.4	112.8	C231 E232 M233 E248	C231-R235 PolarHBondContact O-N 2.67Å; C231-R235 VanDerWaalsContact O-N 3.11Å; E232-R235 IonicContact OE1-CZ 3.2Å; E232-R235 IonicContact OE1-NH1 2.74Å; E232-R235 PolarHBondContact OE1-NH1 3.06Å; E232-R235 IonicContact OE1-NH2 2.75Å; E232-R235 PolarHBondContact OE1-NH2 2.92Å; E232-R235 IonicContact OE2-CZ 3.97Å; E232-R235 IonicContact OE2-NH1 2.93Å; E232-R235 PolarHBondContact OE2-NH1 2.99Å; M233-R235 PolarHBondContact O-N 2.98Å; R235-E248 VanDerWaalsContact CA-OE1 3.28Å; R235-E248 WeakPolarHBondContact CA-OE1 3.46Å; R235-E248 VanDerWaalsContact CB-OE1 3.23Å; R235-E248 WeakPolarHBondContact CB-OE1 3.27Å; R235-E248 WeakPolarHBondContact CG-OE1 3.4Å; R235-E248 IonicContact NE-OE1 3.89Å; R235-E248 IonicContact NE-OE2 3.14Å; R235-E248 PolarHBondContact NE-OE2 2.8Å; R235-E248 VanDerWaalsContact NE-OE2 3.14Å
236	K	83.1	Confident	84.2	Confident	106 Å²	106	57.4 Å²	57.4	46%	0.461	29%	0.286	S	S	.	.	H	α-helix	trans	-70.3	-29	175.7	-69.4	177.1	-171.2	-179.7	0	113.2	E232 M233 K238 V477 L480	E232-K236 VanDerWaalsContact O-CG 3.32Å; E232-K236 WeakPolarHBondContact O-CG 3.36Å; E232-K236 PolarHBondContact O-N 3.4Å; E232-K236 VanDerWaalsContact O-N 3.08Å; M233-K236 PolarHBondContact O-N 3.08Å; M233-K236 VanDerWaalsContact O-N 3.15Å; K236-K238 VanDerWaalsContact C-N 3.29Å; K236-K238 PolarHBondContact O-N 2.82Å; K236-V477 HydrophobicContact CB-CG1 4.47Å; K236-V477 HydrophobicContact CB-CG2 4.29Å; K236-V477 HydrophobicContact CD-CG1 3.52Å; K236-L480 HydrophobicContact CD-CD1 4.04Å
237	L	81.9	Confident	85	Confident	9 Å²	9	54 Å²	54	5%	0.047	27%	0.268	C	S	.	.	H	α-helix	trans	-66.3	-29.4	179	-176.1	56.9	0	0	0	113.1	R145 V167 E171 M233 L234 I239 S473 F474	R145-L237 PolarHBondContact NH2-O 2.97Å; V167-L237 HydrophobicContact CG1-CD2 4.25Å; E171-L237 HydrophobicContact CB-CD1 4.48Å; E171-L237 HydrophobicContact CB-CD2 4.14Å; E171-L237 HydrophobicContact CG-CD1 4.41Å; E171-L237 HydrophobicContact CG-CD2 4.32Å; M233-L237 WeakPolarHBondContact O-CB 3.45Å; M233-L237 PolarHBondContact O-N 3.31Å; L234-L237 PolarHBondContact O-N 2.95Å; L237-I239 HydrophobicContact CB-CG1 4.03Å; L237-I239 HydrophobicContact CD2-CD1 3.86Å; L237-I239 HydrophobicContact CD2-CG1 3.41Å; L237-I239 VanDerWaalsContact CD2-CG1 3.41Å; L237-I239 HydrophobicContact CG-CD1 4.48Å; L237-I239 HydrophobicContact CG-CG1 3.63Å; L237-S473 WeakPolarHBondContact CD1-OG 3.24Å; L237-F474 HydrophobicContact CB-CE1 4.34Å; L237-F474 HydrophobicContact CB-CE2 3.95Å; L237-F474 HydrophobicContact CB-CZ 3.6Å; L237-F474 HydrophobicContact CD1-CD2 4.03Å; L237-F474 HydrophobicContact CD1-CE2 3.67Å; L237-F474 HydrophobicContact CD1-CZ 4.17Å; L237-F474 HydrophobicContact CD2-CE2 3.72Å; L237-F474 HydrophobicContact CD2-CZ 4.14Å; L237-F474 HydrophobicContact CG-CE2 3.97Å; L237-F474 HydrophobicContact CG-CZ 4.17Å
238	K	83.7	Confident	85.6	Confident	126 Å²	126	51.5 Å²	51.5	55%	0.548	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	66.4	-176.2	-166.5	-178	179.1	176.2	0	111.6	T149 K236	T149-K238 HydrophobicContact CG2-CD 4.3Å; T149-K238 HydrophobicContact CG2-CG 4.26Å; T149-K238 WeakPolarHBondContact CG2-O 3.5Å; T149-K238 PolarHBondContact OG1-O 3.46Å; K236-K238 VanDerWaalsContact C-N 3.29Å; K236-K238 PolarHBondContact O-N 2.82Å
239	I	85.1	Confident	86	Confident	1 Å²	1	50 Å²	50	1%	0.005	26%	0.256	C	S	.	.			trans	-68.7	-44.3	-171	-57.6	162.5	0	0	0	111	L148 T149 V167 L234 L237 I251	L148-I239 WeakPolarHBondContact CB-O 3.49Å; T149-I239 PolarHBondContact N-O 2.88Å; T149-I239 PolarHBondContact OG1-O 3.48Å; V167-I239 HydrophobicContact CB-CG2 3.61Å; V167-I239 HydrophobicContact CG1-CG1 4.43Å; V167-I239 HydrophobicContact CG1-CG2 3.79Å; V167-I239 HydrophobicContact CG2-CG2 3.9Å; L234-I239 HydrophobicContact CD2-CD1 3.81Å; L237-I239 HydrophobicContact CB-CG1 4.03Å; L237-I239 HydrophobicContact CD2-CD1 3.86Å; L237-I239 HydrophobicContact CD2-CG1 3.41Å; L237-I239 VanDerWaalsContact CD2-CG1 3.41Å; L237-I239 HydrophobicContact CG-CD1 4.48Å; L237-I239 HydrophobicContact CG-CG1 3.63Å; I239-I251 HydrophobicContact CD1-CD1 4.12Å; I239-I251 HydrophobicContact CD1-CG2 4.27Å
240	I	87.1	Confident	86.5	Confident	12 Å²	12	53.3 Å²	53.3	6%	0.062	27%	0.269	C	S	.	.	S	Bend	trans	-127.3	145.4	-171.5	-52.3	-175.1	0	0	0	109.9	V160 N242 Q243 I251	V160-I240 HydrophobicContact CG2-CD1 3.52Å; V160-I240 HydrophobicContact CG2-CG2 4.11Å; V160-I240 VanDerWaalsContact O-CD1 3.25Å; V160-I240 WeakPolarHBondContact O-CD1 3.33Å; I240-N242 PolarHBondContact O-N 3.05Å; I240-Q243 WeakPolarHBondContact O-CB 3.33Å; I240-Q243 PolarHBondContact O-N 2.9Å; I240-I251 HydrophobicContact CD1-CD1 4.37Å
241	F	83.9	Confident	87	Confident	75 Å²	75	53.3 Å²	53.3	33%	0.329	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	127.4	169.7	-177.8	-89.1	0	0	0	111.4	L148	L148-F241 PolarHBondContact O-N 3.32Å
242	N	83.2	Confident	87.3	Confident	119 Å²	119	52.2 Å²	52.2	64%	0.636	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	48.7	-173.9	-162.5	73.5	0	0	0	113.4	I240 T244	I240-N242 PolarHBondContact O-N 3.05Å; N242-T244 WeakPolarHBondContact ND2-CG2 3.46Å; N242-T244 PolarHBondContact O-N 3.22Å; N242-T244 VanDerWaalsContact O-N 3.08Å
243	Q	87	Confident	87.7	Confident	31 Å²	31	55.7 Å²	55.7	15%	0.145	28%	0.276	C	S	.	.			trans	-64.6	99.7	166.4	-180	176.2	-39.7	0	0	109.9	L234 I240 E248	L234-Q243 PolarHBondContact O-NE2 3.04Å; I240-Q243 WeakPolarHBondContact O-CB 3.33Å; I240-Q243 PolarHBondContact O-N 2.9Å; Q243-E248 HydrophobicContact CG-CG 3.64Å; Q243-E248 PolarHBondContact NE2-OE1 3.08Å
244	T	90.6	Very high	88.3	Confident	38 Å²	38	57.7 Å²	57.7	23%	0.233	29%	0.285	C	S	.	.			trans	-93.2	165.5	173.3	70.7	0	0	0	0	110.5	N242 E246 V247 E248	N242-T244 WeakPolarHBondContact ND2-CG2 3.46Å; N242-T244 PolarHBondContact O-N 3.22Å; N242-T244 VanDerWaalsContact O-N 3.08Å; T244-E246 WeakPolarHBondContact CB-OE2 3.45Å; T244-E246 PolarHBondContact O-N 3.04Å; T244-E246 VanDerWaalsContact O-N 3.15Å; T244-E246 PolarHBondContact OG1-OE2 3.15Å; T244-V247 CarbonylContact O-C 3.58Å; T244-V247 WeakPolarHBondContact O-CA 3.38Å; T244-V247 WeakPolarHBondContact O-CB 3.43Å; T244-V247 PolarHBondContact O-N 3.5Å; T244-E248 PolarHBondContact O-N 3.48Å
245	P	89.5	Confident	88.7	Confident	91 Å²	91	57.6 Å²	57.6	59%	0.591	28%	0.284	S	S	*	.	H	α-helix	trans	-54.7	-32.5	176.9	-27.6	37.2	0	0	0	114	V247 E248 A249	P245-V247 VanDerWaalsContact C-N 3.34Å; P245-E248 PolarHBondContact O-N 3.46Å; P245-A249 WeakPolarHBondContact O-CB 3.28Å; P245-A249 PolarHBondContact O-N 2.94Å
246	E	90.4	Very high	89.1	Confident	120 Å²	120	54.8 Å²	54.8	56%	0.561	28%	0.276	S	S	*	.	H	α-helix	trans	-69.2	-33.3	175.9	-53.4	73.2	-157.9	0	0	112	T244 Q250	T244-E246 WeakPolarHBondContact CB-OE2 3.45Å; T244-E246 PolarHBondContact O-N 3.04Å; T244-E246 VanDerWaalsContact O-N 3.15Å; T244-E246 PolarHBondContact OG1-OE2 3.15Å; E246-Q250 VanDerWaalsContact O-CG 3.3Å; E246-Q250 WeakPolarHBondContact O-CG 3.47Å; E246-Q250 PolarHBondContact O-N 3.46Å; E246-Q250 PolarHBondContact O-NE2 3.23Å
247	V	91.3	Very high	89.6	Confident	21 Å²	21	55.9 Å²	55.9	13%	0.127	28%	0.281	C	S	.	.	H	α-helix	trans	-72.5	-39.9	171.7	176.1	0	0	0	0	110.1	V160 T244 P245 A249 Q250 I251	V160-V247 HydrophobicContact CG1-CG1 4.35Å; V160-V247 HydrophobicContact CG2-CG1 4.07Å; T244-V247 CarbonylContact O-C 3.58Å; T244-V247 WeakPolarHBondContact O-CA 3.38Å; T244-V247 WeakPolarHBondContact O-CB 3.43Å; T244-V247 PolarHBondContact O-N 3.5Å; P245-V247 VanDerWaalsContact C-N 3.34Å; V247-A249 PolarHBondContact O-N 2.95Å; V247-Q250 PolarHBondContact O-N 3.17Å; V247-I251 HydrophobicContact CG1-CD1 3.92Å; V247-I251 HydrophobicContact CG1-CG1 4.38Å; V247-I251 VanDerWaalsContact O-CG1 3.28Å; V247-I251 WeakPolarHBondContact O-CG1 3.34Å; V247-I251 PolarHBondContact O-N 2.86Å
248	E	91.5	Very high	90.2	Very high	23 Å²	23	57.2 Å²	57.2	11%	0.107	29%	0.288	C	S	.	.	H	α-helix	trans	-60.7	-42.7	175.4	-65.5	-174.6	165.3	0	0	111.9	R235 Q243 T244 P245 I251 M252	R235-E248 VanDerWaalsContact CA-OE1 3.28Å; R235-E248 WeakPolarHBondContact CA-OE1 3.46Å; R235-E248 VanDerWaalsContact CB-OE1 3.23Å; R235-E248 WeakPolarHBondContact CB-OE1 3.27Å; R235-E248 WeakPolarHBondContact CG-OE1 3.4Å; R235-E248 IonicContact NE-OE1 3.89Å; R235-E248 IonicContact NE-OE2 3.14Å; R235-E248 PolarHBondContact NE-OE2 2.8Å; R235-E248 VanDerWaalsContact NE-OE2 3.14Å; Q243-E248 HydrophobicContact CG-CG 3.64Å; Q243-E248 PolarHBondContact NE2-OE1 3.08Å; T244-E248 PolarHBondContact O-N 3.48Å; P245-E248 PolarHBondContact O-N 3.46Å; E248-I251 PolarHBondContact O-N 3.25Å; E248-M252 PolarHBondContact O-N 2.71Å
249	A	90.6	Very high	90.6	Very high	60 Å²	60	59 Å²	59	50%	0.496	29%	0.291	S	S	.	.	H	α-helix	trans	-63.6	-40.4	174.9	0	0	0	0	0	112.6	P245 V247 K253	P245-A249 WeakPolarHBondContact O-CB 3.28Å; P245-A249 PolarHBondContact O-N 2.94Å; V247-A249 PolarHBondContact O-N 2.95Å; A249-K253 WeakPolarHBondContact O-CB 3.14Å; A249-K253 PolarHBondContact O-N 3.2Å; A249-K253 VanDerWaalsContact O-N 3.08Å
250	Q	92.5	Very high	91	Very high	84 Å²	84	61.7 Å²	61.7	39%	0.393	32%	0.319	S	S	.	.	H	α-helix	trans	-64.7	-39.9	173.6	-73.5	170.7	51.9	0	0	112.1	E246 V247 E254	E246-Q250 VanDerWaalsContact O-CG 3.3Å; E246-Q250 WeakPolarHBondContact O-CG 3.47Å; E246-Q250 PolarHBondContact O-N 3.46Å; E246-Q250 PolarHBondContact O-NE2 3.23Å; V247-Q250 PolarHBondContact O-N 3.17Å; Q250-E254 PolarHBondContact O-N 3.01Å
251	I	93.9	Very high	91.3	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-63	-51.4	175.5	-69.8	171.4	0	0	0	110.1	L234 I239 I240 V247 E248 K253 E254 Y255	L234-I251 HydrophobicContact CD1-CB 4.42Å; L234-I251 HydrophobicContact CD1-CG2 3.73Å; L234-I251 HydrophobicContact CD2-CG2 4.14Å; I239-I251 HydrophobicContact CD1-CD1 4.12Å; I239-I251 HydrophobicContact CD1-CG2 4.27Å; I240-I251 HydrophobicContact CD1-CD1 4.37Å; V247-I251 HydrophobicContact CG1-CD1 3.92Å; V247-I251 HydrophobicContact CG1-CG1 4.38Å; V247-I251 VanDerWaalsContact O-CG1 3.28Å; V247-I251 WeakPolarHBondContact O-CG1 3.34Å; V247-I251 PolarHBondContact O-N 2.86Å; E248-I251 PolarHBondContact O-N 3.25Å; I251-K253 VanDerWaalsContact C-N 3.32Å; I251-K253 PolarHBondContact O-N 2.98Å; I251-E254 PolarHBondContact O-N 2.89Å; I251-Y255 WeakPolarHBondContact O-CB 3.47Å; I251-Y255 PolarHBondContact O-N 3.45Å
252	M	91.8	Very high	91.8	Very high	3 Å²	3	66.9 Å²	66.9	2%	0.015	34%	0.343	C	S	.	.	H	α-helix	trans	-55.7	-45.1	178.6	-79	-60.5	-69.1	0	0	112.5	Y227 C230 L234 E248 E254 Y255 Q256	Y227-M252 HydrophobicContact CD2-CE 3.67Å; Y227-M252 HydrophobicContact CE2-CE 3.36Å; Y227-M252 HydrophobicContact CG-CE 4.48Å; C230-M252 HydrophobicContact CB-CE 4.37Å; L234-M252 HydrophobicContact CD1-CG 3.58Å; L234-M252 HydrophobicContact CD1-SD 3.32Å; L234-M252 WeakPolarHBondContact CD1-SD 3Å; L234-M252 HydrophobicContact CG-SD 4.24Å; E248-M252 PolarHBondContact O-N 2.71Å; M252-E254 PolarHBondContact O-N 2.9Å; M252-Y255 PolarHBondContact O-N 2.89Å; M252-Y255 HydrophobicContact SD-CD1 4.1Å; M252-Q256 WeakPolarHBondContact O-CG 3.47Å; M252-Q256 PolarHBondContact O-N 2.79Å
253	K	92.4	Very high	92.2	Very high	134 Å²	134	62.9 Å²	62.9	58%	0.583	33%	0.326	S	S	*	.	H	α-helix	trans	-61.8	-39.1	-179.7	-178.8	178.8	179.4	178.4	0	113.3	A249 I251 K257	A249-K253 WeakPolarHBondContact O-CB 3.14Å; A249-K253 PolarHBondContact O-N 3.2Å; A249-K253 VanDerWaalsContact O-N 3.08Å; I251-K253 VanDerWaalsContact C-N 3.32Å; I251-K253 PolarHBondContact O-N 2.98Å; K253-K257 WeakPolarHBondContact O-CE 3.37Å
254	E	94.6	Very high	92.5	Very high	48 Å²	48	64.1 Å²	64.1	22%	0.224	34%	0.336	C	S	.	.	H	α-helix	trans	-79.5	-34	175.4	-63.2	-50.9	130.5	0	0	111.6	E162 A165 Q250 I251 M252 Q256 K257	E162-E254 HydrophobicContact CG-CG 4.3Å; A165-E254 HydrophobicContact CB-CB 3.69Å; Q250-E254 PolarHBondContact O-N 3.01Å; I251-E254 PolarHBondContact O-N 2.89Å; M252-E254 PolarHBondContact O-N 2.9Å; E254-Q256 PolarHBondContact O-N 2.71Å; E254-K257 WeakPolarHBondContact O-CB 3.49Å; E254-K257 PolarHBondContact O-N 2.89Å; E254-K257 VanDerWaalsContact O-N 3.12Å; E254-K257 IonicContact OE1-NZ 3.41Å; E254-K257 PolarHBondContact OE1-NZ 3.38Å; E254-K257 WeakPolarHBondContact OE2-CE 3.48Å; E254-K257 IonicContact OE2-NZ 2.69Å; E254-K257 PolarHBondContact OE2-NZ 3.43Å
255	Y	94.3	Very high	92.8	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-63.4	-41.9	-178.5	-179.4	-153.4	0	0	0	112.6	A168 Q169 I172 G173 A175 L234 I251 M252 K257 L258	A168-Y255 HydrophobicContact CB-CD1 3.86Å; A168-Y255 HydrophobicContact CB-CD2 3.93Å; A168-Y255 HydrophobicContact CB-CE1 3.81Å; A168-Y255 HydrophobicContact CB-CE2 3.91Å; A168-Y255 HydrophobicContact CB-CG 3.93Å; Q169-Y255 HydrophobicContact CB-CD2 4.29Å; Q169-Y255 HydrophobicContact CB-CE2 4.07Å; Q169-Y255 VanDerWaalsContact OE1-CE2 3.29Å; I172-Y255 WeakPolarHBondContact CB-OH 3.5Å; I172-Y255 WeakPolarHBondContact CG2-OH 3.48Å; G173-Y255 WeakPolarHBondContact O-CE2 3.39Å; G173-Y255 PolarHBondContact O-OH 3.44Å; A175-Y255 HydrophobicContact CB-CD1 3.8Å; A175-Y255 HydrophobicContact CB-CD2 4.01Å; A175-Y255 HydrophobicContact CB-CE1 3.78Å; A175-Y255 HydrophobicContact CB-CE2 3.96Å; A175-Y255 HydrophobicContact CB-CG 3.9Å; L234-Y255 HydrophobicContact CD2-CD1 4.41Å; L234-Y255 HydrophobicContact CD2-CE1 4.39Å; I251-Y255 WeakPolarHBondContact O-CB 3.47Å; I251-Y255 PolarHBondContact O-N 3.45Å; M252-Y255 PolarHBondContact O-N 2.89Å; M252-Y255 HydrophobicContact SD-CD1 4.1Å; Y255-K257 PolarHBondContact O-N 3.21Å; Y255-K257 VanDerWaalsContact O-N 3.15Å; Y255-L258 PolarHBondContact O-N 3.4Å
256	Q	92.3	Very high	93.1	Very high	49 Å²	49	61.3 Å²	61.3	23%	0.229	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-57.8	-28.2	174.2	-72.1	172.4	-50.7	0	0	113.4	A175 M252 E254 L258	A175-Q256 HydrophobicContact CB-CG 4.13Å; M252-Q256 WeakPolarHBondContact O-CG 3.47Å; M252-Q256 PolarHBondContact O-N 2.79Å; E254-Q256 PolarHBondContact O-N 2.71Å; Q256-L258 VanDerWaalsContact C-N 3.32Å
257	K	94.7	Very high	93.4	Very high	129 Å²	129	56 Å²	56	56%	0.561	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-78	-14.7	177.9	-50.8	178.4	-162.5	166.4	0	113.6	K253 E254 Y255	K253-K257 WeakPolarHBondContact O-CE 3.37Å; E254-K257 WeakPolarHBondContact O-CB 3.49Å; E254-K257 PolarHBondContact O-N 2.89Å; E254-K257 VanDerWaalsContact O-N 3.12Å; E254-K257 IonicContact OE1-NZ 3.41Å; E254-K257 PolarHBondContact OE1-NZ 3.38Å; E254-K257 WeakPolarHBondContact OE2-CE 3.48Å; E254-K257 IonicContact OE2-NZ 2.69Å; E254-K257 PolarHBondContact OE2-NZ 3.43Å; Y255-K257 PolarHBondContact O-N 3.21Å; Y255-K257 VanDerWaalsContact O-N 3.15Å
258	L	94.5	Very high	93.7	Very high	37 Å²	37	56.8 Å²	56.8	19%	0.194	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-91.6	3.8	-178.1	-57.5	-177.7	0	0	0	113.3	A165 L166 Q169 Y255 Q256 G260 L261	A165-L258 HydrophobicContact CB-CD1 3.81Å; L166-L258 HydrophobicContact CD2-CD1 3.93Å; L166-L258 HydrophobicContact CG-CD1 4.13Å; Q169-L258 HydrophobicContact CB-CB 4.4Å; Q169-L258 HydrophobicContact CB-CD1 4.21Å; Q169-L258 HydrophobicContact CG-CB 4.13Å; Q169-L258 PolarHBondContact NE2-O 3.33Å; Q169-L258 PolarHBondContact OE1-O 3.11Å; Y255-L258 PolarHBondContact O-N 3.4Å; Q256-L258 VanDerWaalsContact C-N 3.32Å; L258-G260 PolarHBondContact O-N 3.34Å; L258-L261 HydrophobicContact CB-CB 4.5Å; L258-L261 HydrophobicContact CB-CD2 4.43Å; L258-L261 HydrophobicContact CD2-CD2 4.26Å; L258-L261 WeakPolarHBondContact O-CB 3.31Å; L258-L261 PolarHBondContact O-N 2.97Å
259	R	91.9	Very high	94	Very high	165 Å²	165	57.8 Å²	57.8	62%	0.623	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	129.2	-179.3	-169	177.9	-175.3	-126.6	1	112.1	D174	D174-R259 HydrophobicContact CB-CG 4.15Å; D174-R259 WeakPolarHBondContact OD1-CA 3.47Å; D174-R259 WeakPolarHBondContact OD2-CG 3.46Å
260	G	92	Very high	94.3	Very high	57 Å²	57	55 Å²	55	59%	0.588	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.4	-7.6	-174.8	0	0	0	0	0	114.9	D174 L258 K262	D174-G260 PolarHBondContact OD1-N 3.08Å; D174-G260 PolarHBondContact OD2-N 2.9Å; L258-G260 PolarHBondContact O-N 3.34Å; G260-K262 PolarHBondContact O-N 3.36Å
261	L	94.3	Very high	94.5	Very high	54 Å²	54	51 Å²	51	28%	0.283	26%	0.258	S	S	.	.			trans	-73.6	124.8	174.6	-172.7	68.5	0	0	0	109.9	L166 Q169 L258 D265 A266	L166-L261 HydrophobicContact CD2-CD2 4.21Å; Q169-L261 HydrophobicContact CG-CB 4.12Å; Q169-L261 HydrophobicContact CG-CD2 4.46Å; Q169-L261 PolarHBondContact NE2-O 2.92Å; L258-L261 HydrophobicContact CB-CB 4.5Å; L258-L261 HydrophobicContact CB-CD2 4.43Å; L258-L261 HydrophobicContact CD2-CD2 4.26Å; L258-L261 WeakPolarHBondContact O-CB 3.31Å; L258-L261 PolarHBondContact O-N 2.97Å; L261-D265 HydrophobicContact CD1-CB 3.55Å; L261-D265 HydrophobicContact CG-CB 4.08Å; L261-A266 HydrophobicContact CD2-CB 3.89Å; L261-A266 HydrophobicContact CG-CB 4.35Å
262	K	93.8	Very high	94.7	Very high	142 Å²	142	56.8 Å²	56.8	62%	0.617	28%	0.279	S	S	*	.			trans	-69.8	149.6	-179.4	-56.2	170.8	-176.8	167.1	0	110.1	G260 V264 D265 A266	G260-K262 PolarHBondContact O-N 3.36Å; K262-V264 HydrophobicContact CB-CG1 4.16Å; K262-V264 PolarHBondContact O-N 3.13Å; K262-V264 VanDerWaalsContact O-N 3.13Å; K262-D265 WeakPolarHBondContact CB-OD2 3.41Å; K262-D265 WeakPolarHBondContact O-CA 3.46Å; K262-D265 WeakPolarHBondContact O-CB 3.33Å; K262-D265 PolarHBondContact O-N 3.43Å; K262-A266 PolarHBondContact O-N 3.21Å
263	A	91.9	Very high	94.9	Very high	34 Å²	34	59.6 Å²	59.6	28%	0.281	29%	0.29	S	S	.	.	H	α-helix	trans	-52	-39.8	178.2	0	0	0	0	0	113.2	D265 A266 E267	A263-D265 VanDerWaalsContact C-N 3.33Å; A263-D265 PolarHBondContact O-N 3.3Å; A263-A266 PolarHBondContact O-N 3.12Å; A263-E267 WeakPolarHBondContact O-CB 3.49Å; A263-E267 WeakPolarHBondContact O-CG 3.38Å; A263-E267 PolarHBondContact O-N 3.42Å
264	V	93.1	Very high	95.2	Very high	57 Å²	57	53.2 Å²	53.2	35%	0.345	26%	0.262	S	S	.	.	H	α-helix	trans	-65.9	-31.4	176.3	63.3	0	0	0	0	113.9	K262 T268	K262-V264 HydrophobicContact CB-CG1 4.16Å; K262-V264 PolarHBondContact O-N 3.13Å; K262-V264 VanDerWaalsContact O-N 3.13Å; V264-T268 WeakPolarHBondContact O-CB 3.48Å; V264-T268 PolarHBondContact O-N 3.18Å; V264-T268 PolarHBondContact O-OG1 2.85Å
265	D	96.6	Very high	95.3	Very high	70 Å²	70	51.8 Å²	51.8	37%	0.374	26%	0.257	S	S	.	.	H	α-helix	trans	-78.6	-38.1	178.3	-57.8	-39.1	0	0	0	109.6	L261 K262 A263 T268 E269	L261-D265 HydrophobicContact CD1-CB 3.55Å; L261-D265 HydrophobicContact CG-CB 4.08Å; K262-D265 WeakPolarHBondContact CB-OD2 3.41Å; K262-D265 WeakPolarHBondContact O-CA 3.46Å; K262-D265 WeakPolarHBondContact O-CB 3.33Å; K262-D265 PolarHBondContact O-N 3.43Å; A263-D265 VanDerWaalsContact C-N 3.33Å; A263-D265 PolarHBondContact O-N 3.3Å; D265-T268 PolarHBondContact O-N 3.13Å; D265-E269 VanDerWaalsContact O-CB 3.3Å; D265-E269 WeakPolarHBondContact O-CB 3.5Å; D265-E269 PolarHBondContact O-N 3.4Å
266	A	97	Very high	95.3	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63.5	-43.2	170.5	0	0	0	0	0	112.7	L166 Q169 A170 L261 K262 A263 T268 E269 L270	L166-A266 HydrophobicContact CD2-CB 4.27Å; Q169-A266 HydrophobicContact CB-CB 4.06Å; Q169-A266 HydrophobicContact CG-CB 4.03Å; A170-A266 HydrophobicContact CB-CB 4.23Å; L261-A266 HydrophobicContact CD2-CB 3.89Å; L261-A266 HydrophobicContact CG-CB 4.35Å; K262-A266 PolarHBondContact O-N 3.21Å; A263-A266 PolarHBondContact O-N 3.12Å; A266-T268 VanDerWaalsContact C-N 3.35Å; A266-T268 PolarHBondContact O-N 2.92Å; A266-E269 PolarHBondContact O-N 3.29Å; A266-L270 WeakPolarHBondContact O-CB 3.19Å; A266-L270 PolarHBondContact O-N 3.1Å
267	E	96.2	Very high	95.4	Very high	8 Å²	8	57.1 Å²	57.1	4%	0.037	28%	0.283	C	S	.	.	H	α-helix	trans	-55.3	-48.9	170.5	-76	164.1	-169.6	0	0	111.2	Y141 A170 A263 L270 L271 R470	Y141-E267 HydrophobicContact CD1-CG 4.12Å; Y141-E267 HydrophobicContact CD2-CB 4Å; Y141-E267 HydrophobicContact CD2-CG 3.73Å; Y141-E267 HydrophobicContact CE1-CG 4.34Å; Y141-E267 HydrophobicContact CE2-CG 3.95Å; Y141-E267 HydrophobicContact CG-CB 4.27Å; Y141-E267 HydrophobicContact CG-CG 3.83Å; A170-E267 HydrophobicContact CB-CG 4.24Å; A263-E267 WeakPolarHBondContact O-CB 3.49Å; A263-E267 WeakPolarHBondContact O-CG 3.38Å; A263-E267 PolarHBondContact O-N 3.42Å; E267-L270 PolarHBondContact O-N 3.27Å; E267-L271 VanDerWaalsContact O-CG 3.29Å; E267-L271 WeakPolarHBondContact O-CG 3.36Å; E267-L271 PolarHBondContact O-N 3.46Å; E267-R470 VanDerWaalsContact CD-NE 3.29Å; E267-R470 WeakPolarHBondContact OE1-CD 3.11Å; E267-R470 IonicContact OE1-CZ 3.68Å; E267-R470 IonicContact OE1-NE 2.71Å; E267-R470 PolarHBondContact OE1-NE 3.24Å; E267-R470 IonicContact OE1-NH2 3.13Å; E267-R470 IonicContact OE2-CZ 3.71Å; E267-R470 IonicContact OE2-NE 3.34Å; E267-R470 PolarHBondContact OE2-NE 2.98Å; E267-R470 VanDerWaalsContact OE2-NE 3.08Å; E267-R470 IonicContact OE2-NH2 2.75Å; E267-R470 PolarHBondContact OE2-NH2 3.36Å
268	T	96.9	Very high	95.2	Very high	39 Å²	39	54 Å²	54	24%	0.239	28%	0.275	C	S	.	.	H	α-helix	trans	-66.5	-41.6	-177.3	-59.7	0	0	0	0	111.6	V128 V264 D265 A266 L271 R272	V128-T268 HydrophobicContact CG1-CG2 3.86Å; V128-T268 HydrophobicContact CG2-CG2 3.93Å; V264-T268 WeakPolarHBondContact O-CB 3.48Å; V264-T268 PolarHBondContact O-N 3.18Å; V264-T268 PolarHBondContact O-OG1 2.85Å; D265-T268 PolarHBondContact O-N 3.13Å; A266-T268 VanDerWaalsContact C-N 3.35Å; A266-T268 PolarHBondContact O-N 2.92Å; T268-L271 WeakPolarHBondContact O-CB 3.47Å; T268-L271 PolarHBondContact O-N 3.29Å; T268-R272 WeakPolarHBondContact O-CB 3.5Å; T268-R272 PolarHBondContact O-N 3.08Å
269	E	97.5	Very high	95.1	Very high	44 Å²	44	52.9 Å²	52.9	21%	0.206	27%	0.27	C	S	.	.	H	α-helix	trans	-69	-37.4	177	177.4	62.4	-177.4	0	0	111.9	L166 D265 A266 R272 R273	L166-E269 HydrophobicContact CD1-CB 4.5Å; L166-E269 HydrophobicContact CD1-CG 3.85Å; L166-E269 HydrophobicContact CD2-CB 3.9Å; L166-E269 HydrophobicContact CD2-CG 3.65Å; L166-E269 HydrophobicContact CG-CG 4.43Å; D265-E269 VanDerWaalsContact O-CB 3.3Å; D265-E269 WeakPolarHBondContact O-CB 3.5Å; D265-E269 PolarHBondContact O-N 3.4Å; A266-E269 PolarHBondContact O-N 3.29Å; E269-R272 VanDerWaalsContact CD-NH2 3.3Å; E269-R272 PolarHBondContact O-N 2.98Å; E269-R272 IonicContact OE1-CZ 3.28Å; E269-R272 IonicContact OE1-NE 2.8Å; E269-R272 IonicContact OE1-NH2 3.13Å; E269-R272 PolarHBondContact OE1-NH2 3.09Å; E269-R272 IonicContact OE2-CZ 2.86Å; E269-R272 IonicContact OE2-NE 3.57Å; E269-R272 PolarHBondContact OE2-NE 3.1Å; E269-R272 IonicContact OE2-NH2 2.9Å; E269-R272 PolarHBondContact OE2-NH2 2.71Å; E269-R272 VanDerWaalsContact OE2-NH2 3.13Å; E269-R273 WeakPolarHBondContact O-CG 3.49Å; E269-R273 PolarHBondContact O-N 2.89Å; E269-R273 IonicContact OE1-CZ 2.67Å; E269-R273 IonicContact OE1-NE 3.9Å; E269-R273 PolarHBondContact OE1-NE 2.77Å; E269-R273 IonicContact OE1-NH2 2.65Å; E269-R273 PolarHBondContact OE1-NH2 3.5Å
270	L	97.3	Very high	95.3	Very high	1 Å²	1	46 Å²	46	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-46.6	171.5	-173.4	73.8	0	0	0	111	Y141 I144 L148 L163 L166 V167 A266 E267 R272 R273 A274	Y141-L270 HydrophobicContact CD2-CD2 3.73Å; Y141-L270 HydrophobicContact CE2-CD2 3.61Å; I144-L270 HydrophobicContact CG2-CD2 4.34Å; I144-L270 HydrophobicContact CG2-CG 4.49Å; L148-L270 HydrophobicContact CD1-CD1 4.34Å; L148-L270 HydrophobicContact CD1-CD2 4.47Å; L163-L270 HydrophobicContact CB-CD1 4.19Å; L163-L270 HydrophobicContact CD2-CD1 3.74Å; L166-L270 HydrophobicContact CB-CB 4.19Å; L166-L270 HydrophobicContact CB-CD1 4.06Å; L166-L270 HydrophobicContact CD1-CB 4.46Å; L166-L270 HydrophobicContact CD1-CD1 4.38Å; V167-L270 HydrophobicContact CG2-CD1 4.14Å; V167-L270 HydrophobicContact CG2-CD2 3.59Å; A266-L270 WeakPolarHBondContact O-CB 3.19Å; A266-L270 PolarHBondContact O-N 3.1Å; E267-L270 PolarHBondContact O-N 3.27Å; L270-R272 VanDerWaalsContact C-N 3.32Å; L270-R272 PolarHBondContact O-N 3.3Å; L270-R273 PolarHBondContact O-N 2.83Å; L270-A274 WeakPolarHBondContact O-CB 3.42Å; L270-A274 PolarHBondContact O-N 3.37Å
271	L	97.8	Very high	95.4	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-58.5	-42.9	176.3	-74.9	173.5	0	0	0	112	P127 R137 V140 I144 E267 T268 S275	P127-L271 HydrophobicContact CB-CB 4.27Å; P127-L271 HydrophobicContact CB-CD2 4.16Å; P127-L271 HydrophobicContact CG-CB 3.91Å; P127-L271 HydrophobicContact CG-CD2 4.33Å; R137-L271 HydrophobicContact CB-CD1 4.08Å; V140-L271 HydrophobicContact CB-CD2 4.1Å; V140-L271 HydrophobicContact CG1-CD2 3.65Å; I144-L271 HydrophobicContact CG1-CD2 4.31Å; E267-L271 VanDerWaalsContact O-CG 3.29Å; E267-L271 WeakPolarHBondContact O-CG 3.36Å; E267-L271 PolarHBondContact O-N 3.46Å; T268-L271 WeakPolarHBondContact O-CB 3.47Å; T268-L271 PolarHBondContact O-N 3.29Å; L271-S275 PolarHBondContact O-N 2.75Å; L271-S275 VanDerWaalsContact O-N 3.07Å
272	R	97.7	Very high	95.4	Very high	120 Å²	120	41.2 Å²	41.2	45%	0.453	21%	0.207	S	C	.	.	H	α-helix	trans	-64.6	-41.6	178	-168.4	-167.8	66.1	77.1	-0.8	112.6	V128 T268 E269 L270 S275	V128-R272 HydrophobicContact CG2-CB 4.18Å; T268-R272 WeakPolarHBondContact O-CB 3.5Å; T268-R272 PolarHBondContact O-N 3.08Å; E269-R272 VanDerWaalsContact CD-NH2 3.3Å; E269-R272 PolarHBondContact O-N 2.98Å; E269-R272 IonicContact OE1-CZ 3.28Å; E269-R272 IonicContact OE1-NE 2.8Å; E269-R272 IonicContact OE1-NH2 3.13Å; E269-R272 PolarHBondContact OE1-NH2 3.09Å; E269-R272 IonicContact OE2-CZ 2.86Å; E269-R272 IonicContact OE2-NE 3.57Å; E269-R272 PolarHBondContact OE2-NE 3.1Å; E269-R272 IonicContact OE2-NH2 2.9Å; E269-R272 PolarHBondContact OE2-NH2 2.71Å; E269-R272 VanDerWaalsContact OE2-NH2 3.13Å; L270-R272 VanDerWaalsContact C-N 3.32Å; L270-R272 PolarHBondContact O-N 3.3Å; R272-S275 PolarHBondContact O-OG 3.19Å; R272-S275 VanDerWaalsContact O-OG 3.12Å
273	R	96.9	Very high	95.2	Very high	62 Å²	62	36.1 Å²	36.1	23%	0.234	19%	0.186	C	C	.	.	H	α-helix	trans	-73.6	-42	176.6	-66.5	-173	-166.6	-151.4	7	111.6	E162 L163 E269 L270 S275 Q276	E162-R273 IonicContact OE1-NH1 2.71Å; E162-R273 PolarHBondContact OE1-NH1 2.8Å; E162-R273 IonicContact OE2-CZ 3.83Å; E162-R273 IonicContact OE2-NH1 3.63Å; E162-R273 PolarHBondContact OE2-NH1 3.4Å; L163-R273 HydrophobicContact CD2-CB 3.72Å; E269-R273 WeakPolarHBondContact O-CG 3.49Å; E269-R273 PolarHBondContact O-N 2.89Å; E269-R273 IonicContact OE1-CZ 2.67Å; E269-R273 IonicContact OE1-NE 3.9Å; E269-R273 PolarHBondContact OE1-NE 2.77Å; E269-R273 IonicContact OE1-NH2 2.65Å; E269-R273 PolarHBondContact OE1-NH2 3.5Å; L270-R273 PolarHBondContact O-N 2.83Å; R273-S275 PolarHBondContact O-N 2.78Å; R273-Q276 PolarHBondContact O-N 2.83Å
274	A	96.8	Very high	95.2	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.008	18%	0.183	C	C	.	.	H	α-helix	trans	-62.3	-38.4	-179.3	0	0	0	0	0	112.8	I144 L153 L270 Q276 L277 Y280	I144-A274 HydrophobicContact CD1-CB 4.42Å; I144-A274 HydrophobicContact CG1-CB 4.47Å; I144-A274 HydrophobicContact CG2-CB 3.69Å; L153-A274 HydrophobicContact CD2-CB 4.05Å; L270-A274 WeakPolarHBondContact O-CB 3.42Å; L270-A274 PolarHBondContact O-N 3.37Å; A274-Q276 PolarHBondContact O-N 3.2Å; A274-L277 WeakPolarHBondContact O-CB 3.36Å; A274-L277 PolarHBondContact O-N 2.84Å; A274-L277 VanDerWaalsContact O-N 3.09Å; A274-Y280 HydrophobicContact CB-CD2 4.37Å; A274-Y280 WeakPolarHBondContact O-CB 3.32Å; A274-Y280 VanDerWaalsContact O-CD2 3.27Å; A274-Y280 WeakPolarHBondContact O-CD2 3.26Å
275	S	96.7	Very high	95.2	Very high	17 Å²	17	34.1 Å²	34.1	12%	0.119	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-20.8	179.8	68.8	0	0	0	0	114.4	L271 R272 R273	L271-S275 PolarHBondContact O-N 2.75Å; L271-S275 VanDerWaalsContact O-N 3.07Å; R272-S275 PolarHBondContact O-OG 3.19Å; R272-S275 VanDerWaalsContact O-OG 3.12Å; R273-S275 PolarHBondContact O-N 2.78Å
276	Q	95.3	Very high	95	Very high	145 Å²	145	34.5 Å²	34.5	68%	0.678	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-7.5	177.9	-54.2	-52.9	-59	0	0	113.4	R273 A274	R273-Q276 PolarHBondContact O-N 2.83Å; A274-Q276 PolarHBondContact O-N 3.2Å
277	L	93.7	Very high	94.8	Very high	17 Å²	17	35 Å²	35	9%	0.089	18%	0.181	C	C	.	.	S	Bend	trans	-79.3	140.7	-174.9	-58.3	-176.7	0	0	0	112	L153 I159 L163 A274 T279 Y280	L153-L277 HydrophobicContact CD1-CB 3.89Å; L153-L277 HydrophobicContact CD1-CD1 3.87Å; L153-L277 HydrophobicContact CD1-CG 4.47Å; L153-L277 HydrophobicContact CD2-CD1 4.06Å; L153-L277 HydrophobicContact CG-CD1 3.81Å; I159-L277 HydrophobicContact CD1-CD2 3.56Å; L163-L277 HydrophobicContact CD1-CD1 4.08Å; A274-L277 WeakPolarHBondContact O-CB 3.36Å; A274-L277 PolarHBondContact O-N 2.84Å; A274-L277 VanDerWaalsContact O-N 3.09Å; L277-T279 PolarHBondContact O-N 3.1Å; L277-Y280 VanDerWaalsContact O-CB 3.31Å; L277-Y280 WeakPolarHBondContact O-CB 3.45Å; L277-Y280 PolarHBondContact O-N 3.18Å
278	P	90.7	Very high	94.8	Very high	62 Å²	62	38.1 Å²	38.1	40%	0.403	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-18.2	-177.7	-29.4	36.2	0	0	0	116.6	I282	P278-I282 WeakPolarHBondContact O-CD1 3.24Å
279	T	93.6	Very high	94.6	Very high	14 Å²	14	36.8 Å²	36.8	9%	0.086	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112	7.5	-177.6	46	0	0	0	0	113.6	L154 L277 G281 I282 F348	L154-T279 HydrophobicContact CB-CG2 4.17Å; L154-T279 HydrophobicContact CD1-CG2 3.89Å; L154-T279 HydrophobicContact CG-CG2 3.98Å; L154-T279 PolarHBondContact N-OG1 3.09Å; L277-T279 PolarHBondContact O-N 3.1Å; T279-G281 PolarHBondContact O-N 3.07Å; T279-I282 WeakPolarHBondContact O-CB 3.25Å; T279-I282 PolarHBondContact O-N 3.42Å; T279-I282 VanDerWaalsContact O-N 3.1Å; T279-F348 HydrophobicContact CG2-CE1 4.14Å; T279-F348 HydrophobicContact CG2-CZ 4.33Å
280	Y	96.1	Very high	94.2	Very high	22 Å²	22	38.4 Å²	38.4	9%	0.086	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	121.3	176.7	177.8	-104.5	0	0	0	112.1	Y123 P124 I144 A274 L277 I282	Y123-Y280 HydrophobicContact CD1-CE1 4.34Å; Y123-Y280 HydrophobicContact CD1-CE2 4.24Å; P124-Y280 VanDerWaalsContact O-CE1 3.29Å; P124-Y280 WeakPolarHBondContact O-CE1 3.41Å; P124-Y280 PolarHBondContact O-OH 3.28Å; P124-Y280 VanDerWaalsContact O-OH 3.07Å; I144-Y280 HydrophobicContact CD1-CD2 3.72Å; I144-Y280 HydrophobicContact CD1-CE2 3.55Å; I144-Y280 HydrophobicContact CG1-CE2 4.26Å; A274-Y280 HydrophobicContact CB-CD2 4.37Å; A274-Y280 WeakPolarHBondContact O-CB 3.32Å; A274-Y280 VanDerWaalsContact O-CD2 3.27Å; A274-Y280 WeakPolarHBondContact O-CD2 3.26Å; L277-Y280 VanDerWaalsContact O-CB 3.31Å; L277-Y280 WeakPolarHBondContact O-CB 3.45Å; L277-Y280 PolarHBondContact O-N 3.18Å; Y280-I282 PolarHBondContact O-N 2.82Å
281	G	94.4	Very high	93.7	Very high	4 Å²	4	41.1 Å²	41.1	4%	0.041	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	8.4	178.3	0	0	0	0	0	116.2	Y123 T279	Y123-G281 VanDerWaalsContact CD2-CA 3.48Å; T279-G281 PolarHBondContact O-N 3.07Å
282	I	93.6	Very high	92.9	Very high	6 Å²	6	47.3 Å²	47.3	3%	0.031	24%	0.241	C	C	.	.			trans	-83.6	125	179.7	-59.9	-167.6	0	0	0	110.1	R152 P278 T279 Y280 T341 V346 F348	R152-I282 WeakPolarHBondContact CD-O 3.45Å; R152-I282 WeakPolarHBondContact CG-O 3.49Å; R152-I282 PolarHBondContact NH1-O 3.32Å; P278-I282 WeakPolarHBondContact O-CD1 3.24Å; T279-I282 WeakPolarHBondContact O-CB 3.25Å; T279-I282 PolarHBondContact O-N 3.42Å; T279-I282 VanDerWaalsContact O-N 3.1Å; Y280-I282 PolarHBondContact O-N 2.82Å; I282-T341 HydrophobicContact CD1-CG2 4.29Å; I282-T341 HydrophobicContact CG1-CG2 4.44Å; I282-V346 HydrophobicContact CD1-CG2 3.68Å; I282-F348 HydrophobicContact CD1-CE2 3.55Å; I282-F348 HydrophobicContact CD1-CZ 3.53Å
283	D	90.4	Very high	92.1	Very high	34 Å²	34	41.9 Å²	41.9	18%	0.182	22%	0.222	C	C	.	.			trans	-103.4	102.4	164.2	-169.2	17.1	0	0	0	108.3	R95	R95-D283 IonicContact CZ-OD1 2.67Å; R95-D283 IonicContact CZ-OD2 2.82Å; R95-D283 IonicContact NE-OD2 3.4Å; R95-D283 IonicContact NH1-OD1 2.88Å; R95-D283 PolarHBondContact NH1-OD1 3.3Å; R95-D283 IonicContact NH1-OD2 3.83Å; R95-D283 PolarHBondContact NH1-OD2 2.92Å; R95-D283 IonicContact NH2-OD1 2.98Å; R95-D283 PolarHBondContact NH2-OD1 2.97Å; R95-D283 IonicContact NH2-OD2 3.17Å; R95-D283 PolarHBondContact NH2-OD2 3.42Å
284	P	90.8	Very high	91.2	Very high	34 Å²	34	43.7 Å²	43.7	22%	0.221	23%	0.229	C	C	.	.			trans	-72	131.2	-169.5	27.8	-33.9	0	0	0	111.6	Y337 L338	P284-Y337 HydrophobicContact CB-CD1 3.99Å; P284-Y337 HydrophobicContact CB-CG 4.16Å; P284-L338 WeakPolarHBondContact CA-O 3.29Å
285	V	92.4	Very high	90.3	Very high	15 Å²	15	45.5 Å²	45.5	9%	0.091	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	117.8	175	176.5	0	0	0	0	109.6	A287 Y337 L338 F408 W411	V285-A287 PolarHBondContact O-N 3.13Å; V285-Y337 CarbonylContact O-C 3.57Å; V285-Y337 WeakPolarHBondContact O-CA 3.29Å; V285-L338 PolarHBondContact N-O 3.31Å; V285-L338 PolarHBondContact O-N 3.34Å; V285-F408 HydrophobicContact CB-CD2 4.02Å; V285-F408 HydrophobicContact CB-CE2 4.24Å; V285-F408 HydrophobicContact CG1-CD2 4.43Å; V285-F408 HydrophobicContact CG2-CD2 3.6Å; V285-F408 HydrophobicContact CG2-CE2 3.99Å; V285-F408 HydrophobicContact CG2-CG 4.48Å; V285-W411 HydrophobicContact CG2-CE3 4.45Å; V285-W411 HydrophobicContact CG2-CH2 4.46Å; V285-W411 HydrophobicContact CG2-CZ3 3.7Å
286	P	93	Very high	89	Confident	79 Å²	79	46.4 Å²	46.4	51%	0.513	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	132.2	179.1	27.3	-34	0	0	0	111.1	F336 Y337	P286-F336 WeakPolarHBondContact CA-O 3.41Å; P286-Y337 HydrophobicContact CB-CD1 4.21Å; P286-Y337 HydrophobicContact CB-CE1 4.18Å
287	A	94.1	Very high	87.6	Confident	10 Å²	10	42.5 Å²	42.5	8%	0.083	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	153.5	179.3	0	0	0	0	0	111.8	V285 F336 L338 F397 R398	V285-A287 PolarHBondContact O-N 3.13Å; A287-F336 PolarHBondContact N-O 3Å; A287-F336 WeakPolarHBondContact O-CB 3.17Å; A287-F336 WeakPolarHBondContact O-CD1 3.44Å; A287-L338 HydrophobicContact CB-CD1 3.88Å; A287-L338 HydrophobicContact CB-CG 3.91Å; A287-F397 HydrophobicContact CB-CB 4.19Å; A287-R398 CarbonylContact C-O 3.51Å; A287-R398 VanDerWaalsContact CA-O 3.26Å; A287-R398 WeakPolarHBondContact CA-O 3.33Å
288	T	94.3	Very high	85.9	Confident	73 Å²	73	47 Å²	47	45%	0.448	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	124.3	170.8	-43.2	0	0	0	0	109.7	M290 F397 R398	T288-M290 HydrophobicContact CG2-CE 3.94Å; T288-F397 CarbonylContact O-C 3.57Å; T288-F397 WeakPolarHBondContact O-CA 3.33Å; T288-R398 PolarHBondContact N-O 2.71Å; T288-R398 PolarHBondContact O-N 2.71Å
289	P	93.6	Very high	83.7	Confident	12 Å²	12	49.9 Å²	49.9	8%	0.078	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	137.6	172.7	30.6	-34.2	0	0	0	110.2	Q291 V293 L330 F336 F397	P289-Q291 VanDerWaalsContact C-N 3.35Å; P289-V293 HydrophobicContact CB-CG1 3.7Å; P289-V293 HydrophobicContact CG-CG1 3.61Å; P289-L330 HydrophobicContact CG-CB 4.21Å; P289-L330 HydrophobicContact CG-CD2 4.14Å; P289-F336 HydrophobicContact CB-CE1 4.21Å; P289-F336 HydrophobicContact CB-CE2 4.43Å; P289-F336 HydrophobicContact CB-CZ 4.13Å; P289-F336 HydrophobicContact CG-CD1 4.35Å; P289-F336 HydrophobicContact CG-CD2 4.13Å; P289-F336 HydrophobicContact CG-CE1 4.43Å; P289-F336 HydrophobicContact CG-CE2 4.24Å; P289-F336 HydrophobicContact CG-CG 4.19Å; P289-F336 HydrophobicContact CG-CZ 4.36Å; P289-F397 HydrophobicContact CB-CD1 4.14Å; P289-F397 HydrophobicContact CB-CE1 4.24Å
290	M	89.8	Confident	81	Confident	77 Å²	77	53.9 Å²	53.9	38%	0.379	31%	0.308	S	S	.	.	S	Bend	trans	-92.2	-1.8	173.9	-52	-75.5	82.4	0	0	112.2	T288 L371 S396 R398	T288-M290 HydrophobicContact CG2-CE 3.94Å; M290-L371 HydrophobicContact CG-CD2 4.11Å; M290-L371 HydrophobicContact SD-CD2 4.06Å; M290-S396 WeakPolarHBondContact CB-O 3.29Å; M290-S396 VanDerWaalsContact CG-O 3.31Å; M290-S396 WeakPolarHBondContact CG-O 3.08Å; M290-S396 PolarHBondContact N-O 3.06Å; M290-R398 HydrophobicContact CE-CB 3.87Å; M290-R398 HydrophobicContact SD-CB 4.13Å
291	Q	86.1	Confident	78	Confident	59 Å²	59	57.4 Å²	57.4	28%	0.276	34%	0.341	S	S	.	.	S	Bend	trans	-112.3	163.7	172.5	-63.2	77.1	31.1	0	0	109.8	P289 L394 S396	P289-Q291 VanDerWaalsContact C-N 3.35Å; Q291-L394 PolarHBondContact NE2-O 3.02Å; Q291-S396 VanDerWaalsContact NE2-N 3.1Å; Q291-S396 PolarHBondContact OE1-O 3.22Å; Q291-S396 VanDerWaalsContact OE1-O 3.13Å
292	K	81.9	Confident	75.1	Confident	130 Å²	130	62.4 Å²	62.4	57%	0.565	37%	0.371	S	S	*	.			trans	-64.2	146.6	168.8	-63.6	-167.4	-179.1	-174.8	0	110.9	P327 V328	K292-P327 HydrophobicContact CB-CB 3.77Å; K292-P327 HydrophobicContact CB-CG 4.37Å; K292-P327 VanDerWaalsContact CD-O 3.24Å; K292-P327 WeakPolarHBondContact CD-O 3.42Å; K292-V328 CarbonylContact C-O 3.49Å; K292-V328 WeakPolarHBondContact CA-O 3.39Å; K292-V328 WeakPolarHBondContact CB-O 3.26Å
293	V	80.7	Confident	72.4	Confident	7 Å²	7	70.8 Å²	70.8	4%	0.042	41%	0.41	C	S	.	.	B	Isolated β-bridge	trans	-122.7	161.4	-176.4	-64.6	0	0	0	0	111.1	P289 L295 P327 V328 L330 F336	P289-V293 HydrophobicContact CB-CG1 3.7Å; P289-V293 HydrophobicContact CG-CG1 3.61Å; V293-L295 HydrophobicContact CG2-CD2 4.2Å; V293-P327 CarbonylContact O-C 3.51Å; V293-P327 VanDerWaalsContact O-CA 3.3Å; V293-P327 WeakPolarHBondContact O-CA 3.39Å; V293-V328 PolarHBondContact N-O 3.22Å; V293-V328 PolarHBondContact O-N 3.28Å; V293-L330 HydrophobicContact CG2-CB 4.15Å; V293-L330 HydrophobicContact CG2-CD1 4.19Å; V293-F336 HydrophobicContact CB-CE2 4.37Å; V293-F336 HydrophobicContact CG1-CD2 4.32Å; V293-F336 HydrophobicContact CG1-CE2 3.65Å; V293-F336 HydrophobicContact CG1-CZ 4.22Å
294	Y	78.2	Confident	70	Confident	100 Å²	100	75.9 Å²	75.9	39%	0.392	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-92.8	126.2	174.3	-61.8	-80	0	0	0	109.2	S324 P327 N354	Y294-S324 VanDerWaalsContact CD1-O 3.28Å; Y294-S324 WeakPolarHBondContact CD1-O 3.49Å; Y294-P327 HydrophobicContact CD1-CB 4.13Å; Y294-P327 HydrophobicContact CE1-CB 3.84Å; Y294-P327 HydrophobicContact CE1-CG 4.16Å; Y294-P327 HydrophobicContact CE2-CB 4.36Å; Y294-N354 PolarHBondContact N-OD1 2.87Å; Y294-N354 PolarHBondContact O-OD1 2.7Å; Y294-N354 VanDerWaalsContact O-OD1 3.06Å
295	L	76.3	Confident	67.4	Low	38 Å²	38	82.1 Å²	82.1	20%	0.199	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-91.4	146.6	179.9	-63.3	-179	0	0	0	110.8	V293 V297 L323 S324 V328 L330 P331 V349	V293-L295 HydrophobicContact CG2-CD2 4.2Å; L295-V297 PolarHBondContact O-N 3.37Å; L295-L323 CarbonylContact O-C 3.5Å; L295-L323 WeakPolarHBondContact O-CA 3.46Å; L295-S324 PolarHBondContact N-OG 2.79Å; L295-S324 PolarHBondContact O-N 2.96Å; L295-V328 HydrophobicContact CB-CG2 4.47Å; L295-V328 HydrophobicContact CD1-CG2 3.45Å; L295-V328 VanDerWaalsContact CD1-CG2 3.45Å; L295-V328 HydrophobicContact CD2-CG2 4.5Å; L295-V328 HydrophobicContact CG-CG2 3.5Å; L295-L330 HydrophobicContact CD2-CD1 4.41Å; L295-P331 HydrophobicContact CD1-CG 3.6Å; L295-P331 HydrophobicContact CD2-CG 4.35Å; L295-V349 HydrophobicContact CD2-CG1 3.95Å; L295-V349 HydrophobicContact CD2-CG2 4.4Å
296	P	69.7	Low	64.8	Low	37 Å²	37	86.5 Å²	86.5	24%	0.24	50%	0.501	C	S	.	.	B	Isolated β-bridge	trans	-62.6	126.2	167.7	-17.5	31.8	0	0	0	109.9	S298 V321 Q352	P296-S298 PolarHBondContact O-N 2.8Å; P296-V321 HydrophobicContact CB-CG1 4.04Å; P296-Q352 HydrophobicContact CB-CB 4.25Å; P296-Q352 HydrophobicContact CB-CG 4.06Å; P296-Q352 HydrophobicContact CG-CB 3.54Å; P296-Q352 HydrophobicContact CG-CG 3.8Å
297	V	66.9	Low	62.2	Low	62 Å²	62	88.6 Å²	88.6	38%	0.376	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-82.1	117.2	171.1	-177.3	0	0	0	0	108.1	L295 T299 T322	L295-V297 PolarHBondContact O-N 3.37Å; V297-T299 PolarHBondContact O-N 2.79Å; V297-T299 VanDerWaalsContact O-N 3.11Å; V297-T322 VanDerWaalsContact CB-O 3.26Å; V297-T322 WeakPolarHBondContact CB-O 3.3Å; V297-T322 WeakPolarHBondContact CG2-O 3.32Å; V297-T322 PolarHBondContact N-O 2.86Å
298	S	57	Low	59.7	Low	112 Å²	112	94.2 Å²	94.2	78%	0.783	55%	0.55	S	S	*	.			trans	-67.3	105.7	167.9	-57.7	0	0	0	0	109.2	P296 S300	P296-S298 PolarHBondContact O-N 2.8Å; S298-S300 VanDerWaalsContact C-N 3.31Å; S298-S300 PolarHBondContact O-N 2.88Å
299	T	44.5	Very low	57.1	Low	122 Å²	122	98.2 Å²	98.2	75%	0.748	57%	0.568	S	S	*	*			trans	-69.6	91.1	165.5	46.4	0	0	0	0	108.5	V297 A301	V297-T299 PolarHBondContact O-N 2.79Å; V297-T299 VanDerWaalsContact O-N 3.11Å; T299-A301 PolarHBondContact O-N 2.82Å
300	S	38.3	Very low	54.2	Low	99 Å²	99	107.2 Å²	107.2	69%	0.692	61%	0.609	S	S	*	*			trans	-61.2	119.4	168.6	49.7	0	0	0	0	108.8	S298 T302	S298-S300 VanDerWaalsContact C-N 3.31Å; S298-S300 PolarHBondContact O-N 2.88Å; S300-T302 PolarHBondContact O-N 2.85Å
301	A	32.6	Very low	51.9	Low	95 Å²	95	110.2 Å²	110.2	79%	0.785	63%	0.632	S	S	*	*			trans	-58	114.1	179.8	0	0	0	0	0	110.4	T299	T299-A301 PolarHBondContact O-N 2.82Å
302	T	33.6	Very low	49.4	Very low	110 Å²	110	116.7 Å²	116.7	68%	0.675	66%	0.659	S	S	*	*			trans	-126	56.9	162	-41.7	0	0	0	0	107.1	S300 N304	S300-T302 PolarHBondContact O-N 2.85Å; T302-N304 VanDerWaalsContact C-N 3.3Å; T302-N304 PolarHBondContact O-N 3.29Å
303	E	36.8	Very low	47	Very low	182 Å²	182	115.2 Å²	115.2	85%	0.85	67%	0.671	S	S	*	*			trans	-72.2	91	170	-73	-171.3	155.3	0	0	108.2	N305	E303-N305 PolarHBondContact O-N 3.39Å
304	N	39.5	Very low	44.7	Very low	141 Å²	141	121.4 Å²	121.4	75%	0.754	71%	0.709	S	S	*	*			trans	-65.5	123.9	164.3	-75.9	-32.6	0	0	0	108.3	T302 S306	T302-N304 VanDerWaalsContact C-N 3.3Å; T302-N304 PolarHBondContact O-N 3.29Å; N304-S306 PolarHBondContact O-N 2.81Å
305	N	35.7	Very low	42.5	Very low	164 Å²	164	124.9 Å²	124.9	88%	0.877	73%	0.734	S	S	*	*	S	Bend	trans	-49.1	117	-173.3	-63	-65.2	0	0	0	113.2	E303	E303-N305 PolarHBondContact O-N 3.39Å
306	S	38.5	Very low	40.2	Very low	108 Å²	108	126.9 Å²	126.9	76%	0.755	76%	0.764	S	S	*	*			trans	-157.6	128.7	161	-76.6	0	0	0	0	109	N304	N304-S306 PolarHBondContact O-N 2.81Å
307	P	38.8	Very low	38.4	Very low	122 Å²	122	134.9 Å²	134.9	79%	0.792	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-73.1	134.5	-176.5	29.4	-33.9	0	0	0	111	N309	P307-N309 PolarHBondContact O-N 2.79Å
308	P	41.4	Very low	37	Very low	128 Å²	128	140.1 Å²	140.1	83%	0.831	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-81.1	119.6	177.9	30.4	-31	0	0	0	111.2
309	N	39.7	Very low	36.2	Very low	157 Å²	157	141.4 Å²	141.4	84%	0.84	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-65.7	151.4	166.9	-83.7	-31.6	0	0	0	111.3	P307 V311	P307-N309 PolarHBondContact O-N 2.79Å; N309-V311 PolarHBondContact O-N 2.93Å
310	E	32.9	Very low	36.1	Very low	201 Å²	201	140.4 Å²	140.4	94%	0.939	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-53.7	125.6	-176	-63.8	178.5	107.1	0	0	113.9
311	V	39.9	Very low	36.9	Very low	141 Å²	141	138.7 Å²	138.7	86%	0.855	80%	0.797	S	S	*	*			trans	-130.3	127.2	160.7	-177.9	0	0	0	0	109.1	N309	N309-V311 PolarHBondContact O-N 2.93Å
312	K	35.2	Very low	38.2	Very low	195 Å²	195	138.1 Å²	138.1	85%	0.848	78%	0.784	S	S	*	*			trans	-57.8	140.4	-172.3	-72.3	172.3	175.1	173.2	0	113	T314	K312-T314 PolarHBondContact O-N 3.29Å
313	A	30.7	Very low	40	Very low	99 Å²	99	135.7 Å²	135.7	82%	0.818	77%	0.766	S	S	*	*			trans	-57.5	126.1	176.3	0	0	0	0	0	112.1
314	T	33.1	Very low	41.6	Very low	136 Å²	136	127.9 Å²	127.9	83%	0.834	73%	0.732	S	S	*	*			trans	-119.4	118.2	163.1	42.6	0	0	0	0	108.3	K312	K312-T314 PolarHBondContact O-N 3.29Å
315	N	31	Very low	43	Very low	173 Å²	173	127.3 Å²	127.3	93%	0.925	74%	0.736	S	S	*	*			trans	-67.2	142.8	-175.4	-81.7	-31.6	0	0	0	111.8
316	G	27.9	Very low	44.8	Very low	80 Å²	80	126.5 Å²	126.5	83%	0.825	73%	0.727	S	S	*	*			trans	108.5	48.2	160.9	0	0	0	0	0	117.3
317	K	32.3	Very low	46.7	Very low	206 Å²	206	123.6 Å²	123.6	90%	0.896	71%	0.705	S	S	*	*			trans	-115	115.9	155.2	-97.9	177.5	177.3	173	0	110.3
318	Q	38.8	Very low	48.6	Very low	172 Å²	172	120.4 Å²	120.4	80%	0.804	68%	0.683	S	S	*	*			trans	-56.4	151	167.9	-64.2	174	-4	0	0	109.5	S320	Q318-S320 PolarHBondContact O-N 2.93Å
319	N	38.7	Very low	50.5	Low	138 Å²	138	120 Å²	120	74%	0.738	67%	0.674	S	S	*	*			trans	-61.2	85.2	174.5	-75.7	-14.7	0	0	0	110.8	V321	N319-V321 VanDerWaalsContact C-N 3.33Å; N319-V321 PolarHBondContact O-N 2.6Å
320	S	42.4	Very low	52.6	Low	102 Å²	102	114.3 Å²	114.3	71%	0.713	64%	0.644	S	S	*	*			trans	-81.9	78.8	-177.9	-174.1	0	0	0	0	109.2	Q318 T322	Q318-S320 PolarHBondContact O-N 2.93Å; S320-T322 PolarHBondContact O-N 2.87Å; S320-T322 VanDerWaalsContact O-N 3.15Å
321	V	55.6	Low	54.8	Low	63 Å²	63	107.7 Å²	107.7	38%	0.382	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-57.4	120.3	160.9	178	0	0	0	0	106.4	P296 N319 L323	P296-V321 HydrophobicContact CB-CG1 4.04Å; N319-V321 VanDerWaalsContact C-N 3.33Å; N319-V321 PolarHBondContact O-N 2.6Å; V321-L323 PolarHBondContact O-N 3.25Å; V321-L323 VanDerWaalsContact O-N 3.17Å
322	T	60.6	Low	56.5	Low	83 Å²	83	110.1 Å²	110.1	51%	0.509	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-68.2	118.3	-174.5	-64.3	0	0	0	0	108.8	V297 S320	V297-T322 VanDerWaalsContact CB-O 3.26Å; V297-T322 WeakPolarHBondContact CB-O 3.3Å; V297-T322 WeakPolarHBondContact CG2-O 3.32Å; V297-T322 PolarHBondContact N-O 2.86Å; S320-T322 PolarHBondContact O-N 2.87Å; S320-T322 VanDerWaalsContact O-N 3.15Å
323	L	71.7	Confident	58.5	Low	59 Å²	59	104.6 Å²	104.6	31%	0.309	62%	0.619	S	S	.	*	B	Isolated β-bridge	trans	-75	155.9	172.3	-69.5	177	0	0	0	110.3	L295 V321	L295-L323 CarbonylContact O-C 3.5Å; L295-L323 WeakPolarHBondContact O-CA 3.46Å; V321-L323 PolarHBondContact O-N 3.25Å; V321-L323 VanDerWaalsContact O-N 3.17Å
324	S	70	Confident	61.1	Low	18 Å²	18	101.7 Å²	101.7	13%	0.126	59%	0.594	C	S	.	*	P	Polyproline II helix	trans	-57.1	138.8	179.4	62.3	0	0	0	0	110.9	Y294 L295 Q326	Y294-S324 VanDerWaalsContact CD1-O 3.28Å; Y294-S324 WeakPolarHBondContact CD1-O 3.49Å; L295-S324 PolarHBondContact N-OG 2.79Å; L295-S324 PolarHBondContact O-N 2.96Å; S324-Q326 PolarHBondContact O-N 2.75Å; S324-Q326 VanDerWaalsContact O-N 3.15Å; S324-Q326 PolarHBondContact OG-O 3.33Å
325	P	67.7	Low	63.6	Low	129 Å²	129	97.3 Å²	97.3	84%	0.838	57%	0.568	S	S	*	*	S	Bend	trans	-68.9	-15.6	-176.2	27.8	-35.9	0	0	0	113.2
326	Q	74.2	Confident	66.6	Low	146 Å²	146	89.5 Å²	89.5	68%	0.682	53%	0.525	S	S	*	.	S	Bend	trans	-128.7	148.9	173.7	-63	-172.8	13	0	0	110	S324	S324-Q326 PolarHBondContact O-N 2.75Å; S324-Q326 VanDerWaalsContact O-N 3.15Å; S324-Q326 PolarHBondContact OG-O 3.33Å
327	P	77.4	Confident	69.7	Low	47 Å²	47	87.2 Å²	87.2	31%	0.305	49%	0.492	S	S	.	.			trans	-76.8	135.4	173.4	33.4	-34.4	0	0	0	109.7	K292 V293 Y294	K292-P327 HydrophobicContact CB-CB 3.77Å; K292-P327 HydrophobicContact CB-CG 4.37Å; K292-P327 VanDerWaalsContact CD-O 3.24Å; K292-P327 WeakPolarHBondContact CD-O 3.42Å; V293-P327 CarbonylContact O-C 3.51Å; V293-P327 VanDerWaalsContact O-CA 3.3Å; V293-P327 WeakPolarHBondContact O-CA 3.39Å; Y294-P327 HydrophobicContact CD1-CB 4.13Å; Y294-P327 HydrophobicContact CE1-CB 3.84Å; Y294-P327 HydrophobicContact CE1-CG 4.16Å; Y294-P327 HydrophobicContact CE2-CB 4.36Å
328	V	79.5	Confident	72.8	Confident	55 Å²	55	77.4 Å²	77.4	33%	0.333	45%	0.449	S	S	.	.	B	Isolated β-bridge	trans	-122.2	168	-177.4	-64.1	0	0	0	0	110.8	K292 V293 L295	K292-V328 CarbonylContact C-O 3.49Å; K292-V328 WeakPolarHBondContact CA-O 3.39Å; K292-V328 WeakPolarHBondContact CB-O 3.26Å; V293-V328 PolarHBondContact N-O 3.22Å; V293-V328 PolarHBondContact O-N 3.28Å; L295-V328 HydrophobicContact CB-CG2 4.47Å; L295-V328 HydrophobicContact CD1-CG2 3.45Å; L295-V328 VanDerWaalsContact CD1-CG2 3.45Å; L295-V328 HydrophobicContact CD2-CG2 4.5Å; L295-V328 HydrophobicContact CG-CG2 3.5Å
329	N	81.5	Confident	75.5	Confident	119 Å²	119	69.2 Å²	69.2	64%	0.636	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-66.5	144.8	168.8	-65.3	-23.2	0	0	0	108.8	P331	N329-P331 WeakPolarHBondContact O-CD 3.47Å
330	L	83.3	Confident	78.2	Confident	39 Å²	39	63.2 Å²	63.2	20%	0.204	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-59.6	125.2	171.9	-175.6	68.7	0	0	0	108.5	P289 V293 L295 A334 F336 V349	P289-L330 HydrophobicContact CG-CB 4.21Å; P289-L330 HydrophobicContact CG-CD2 4.14Å; V293-L330 HydrophobicContact CG2-CB 4.15Å; V293-L330 HydrophobicContact CG2-CD1 4.19Å; L295-L330 HydrophobicContact CD2-CD1 4.41Å; L330-A334 HydrophobicContact CD1-CB 3.77Å; L330-A334 HydrophobicContact CG-CB 4.07Å; L330-F336 HydrophobicContact CD1-CB 4.38Å; L330-F336 HydrophobicContact CD1-CD2 4.44Å; L330-F336 HydrophobicContact CD2-CB 3.7Å; L330-F336 HydrophobicContact CD2-CG 4.47Å; L330-V349 HydrophobicContact CD1-CG1 4.3Å; L330-V349 HydrophobicContact CD1-CG2 4.4Å
331	P	79.6	Confident	80.8	Confident	61 Å²	61	59.3 Å²	59.3	40%	0.396	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-59.4	149.7	178.5	-25	34.3	0	0	0	111.7	L295 N329 G333 A334	L295-P331 HydrophobicContact CD1-CG 3.6Å; L295-P331 HydrophobicContact CD2-CG 4.35Å; N329-P331 WeakPolarHBondContact O-CD 3.47Å; P331-G333 PolarHBondContact O-N 3.04Å; P331-A334 HydrophobicContact CB-CB 4.19Å; P331-A334 HydrophobicContact CG-CB 4.44Å; P331-A334 WeakPolarHBondContact O-CB 3.31Å; P331-A334 PolarHBondContact O-N 3.18Å
332	E	76.2	Confident	82.7	Confident	193 Å²	193	57.7 Å²	57.7	90%	0.902	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	135.5	172.9	-169.7	163.1	-162.3	0	0	110.3	A334	E332-A334 VanDerWaalsContact C-N 3.27Å; E332-A334 PolarHBondContact O-N 3.33Å
333	G	77.4	Confident	84.4	Confident	79 Å²	79	56.9 Å²	56.9	81%	0.814	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	79	-12.2	-172.9	0	0	0	0	0	116.1	P331 T335	P331-G333 PolarHBondContact O-N 3.04Å; G333-T335 PolarHBondContact O-N 3.44Å
334	A	83.6	Confident	85.6	Confident	37 Å²	37	54 Å²	54	31%	0.306	32%	0.323	S	S	.	.			trans	-73.7	129.7	177.2	0	0	0	0	0	111.6	L330 P331 E332	L330-A334 HydrophobicContact CD1-CB 3.77Å; L330-A334 HydrophobicContact CG-CB 4.07Å; P331-A334 HydrophobicContact CB-CB 4.19Å; P331-A334 HydrophobicContact CG-CB 4.44Å; P331-A334 WeakPolarHBondContact O-CB 3.31Å; P331-A334 PolarHBondContact O-N 3.18Å; E332-A334 VanDerWaalsContact C-N 3.27Å; E332-A334 PolarHBondContact O-N 3.33Å
335	T	86.4	Confident	86.9	Confident	45 Å²	45	53.2 Å²	53.2	28%	0.276	32%	0.317	S	S	.	.			trans	-82.4	140.6	178.6	55.4	0	0	0	0	111.8	G333 Y337 G350 D536	G333-T335 PolarHBondContact O-N 3.44Å; T335-Y337 VanDerWaalsContact CB-OH 3.28Å; T335-Y337 WeakPolarHBondContact CB-OH 3.4Å; T335-Y337 PolarHBondContact OG1-OH 3.49Å; T335-G350 PolarHBondContact O-N 3.03Å; T335-D536 HydrophobicContact CG2-CB 4.22Å
336	F	93.2	Very high	88.2	Confident	8 Å²	8	47.1 Å²	47.1	4%	0.035	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	134.6	179.3	-175.2	-82.2	0	0	0	110.6	P286 A287 P289 V293 L330 L338 T347 F348 V349 F397	P286-F336 WeakPolarHBondContact CA-O 3.41Å; A287-F336 PolarHBondContact N-O 3Å; A287-F336 WeakPolarHBondContact O-CB 3.17Å; A287-F336 WeakPolarHBondContact O-CD1 3.44Å; P289-F336 HydrophobicContact CB-CE1 4.21Å; P289-F336 HydrophobicContact CB-CE2 4.43Å; P289-F336 HydrophobicContact CB-CZ 4.13Å; P289-F336 HydrophobicContact CG-CD1 4.35Å; P289-F336 HydrophobicContact CG-CD2 4.13Å; P289-F336 HydrophobicContact CG-CE1 4.43Å; P289-F336 HydrophobicContact CG-CE2 4.24Å; P289-F336 HydrophobicContact CG-CG 4.19Å; P289-F336 HydrophobicContact CG-CZ 4.36Å; V293-F336 HydrophobicContact CB-CE2 4.37Å; V293-F336 HydrophobicContact CG1-CD2 4.32Å; V293-F336 HydrophobicContact CG1-CE2 3.65Å; V293-F336 HydrophobicContact CG1-CZ 4.22Å; L330-F336 HydrophobicContact CD1-CB 4.38Å; L330-F336 HydrophobicContact CD1-CD2 4.44Å; L330-F336 HydrophobicContact CD2-CB 3.7Å; L330-F336 HydrophobicContact CD2-CG 4.47Å; F336-L338 HydrophobicContact CE1-CD2 3.92Å; F336-T347 HydrophobicContact CE1-CG2 4.23Å; F336-T347 HydrophobicContact CZ-CG2 3.9Å; F336-F348 VanDerWaalsContact CA-O 3.3Å; F336-F348 WeakPolarHBondContact CA-O 3.46Å; F336-F348 WeakPolarHBondContact CD2-O 3.39Å; F336-F348 WeakPolarHBondContact CG-O 3.34Å; F336-V349 HydrophobicContact CD2-CG2 3.78Å; F336-V349 HydrophobicContact CE2-CG2 4.11Å; F336-F397 AromaticContact CE1-CD1 3.77Å; F336-F397 HydrophobicContact CE1-CD1 3.77Å; F336-F397 AromaticContact CE1-CE1 3.83Å; F336-F397 HydrophobicContact CE1-CE1 3.83Å; F336-F397 HydrophobicContact CZ-CD1 4.31Å; F336-F397 AromaticContact CZ-CE1 3.91Å; F336-F397 HydrophobicContact CZ-CE1 3.91Å
337	Y	94.5	Very high	89.2	Confident	32 Å²	32	40.1 Å²	40.1	13%	0.125	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	145.2	-173.9	-52.5	-84.4	0	0	0	112	P284 V285 P286 T335 T347 F348 D536	P284-Y337 HydrophobicContact CB-CD1 3.99Å; P284-Y337 HydrophobicContact CB-CG 4.16Å; V285-Y337 CarbonylContact O-C 3.57Å; V285-Y337 WeakPolarHBondContact O-CA 3.29Å; P286-Y337 HydrophobicContact CB-CD1 4.21Å; P286-Y337 HydrophobicContact CB-CE1 4.18Å; T335-Y337 VanDerWaalsContact CB-OH 3.28Å; T335-Y337 WeakPolarHBondContact CB-OH 3.4Å; T335-Y337 PolarHBondContact OG1-OH 3.49Å; Y337-T347 CarbonylContact O-C 3.59Å; Y337-T347 VanDerWaalsContact O-CA 3.29Å; Y337-T347 WeakPolarHBondContact O-CA 3.29Å; Y337-F348 HydrophobicContact CD2-CB 4.42Å; Y337-F348 PolarHBondContact N-O 2.86Å; Y337-F348 PolarHBondContact O-N 3.49Å; Y337-D536 PolarHBondContact OH-O 3.44Å
338	L	95.9	Very high	89.9	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	145.1	164.3	-53	177.9	0	0	0	109.4	P284 V285 A287 F336 T347 F372 F397 F408	P284-L338 WeakPolarHBondContact CA-O 3.29Å; V285-L338 PolarHBondContact N-O 3.31Å; V285-L338 PolarHBondContact O-N 3.34Å; A287-L338 HydrophobicContact CB-CD1 3.88Å; A287-L338 HydrophobicContact CB-CG 3.91Å; F336-L338 HydrophobicContact CE1-CD2 3.92Å; L338-T347 HydrophobicContact CD2-CG2 3.84Å; L338-F372 HydrophobicContact CD1-CD1 4Å; L338-F397 HydrophobicContact CD1-CB 3.83Å; L338-F397 HydrophobicContact CD1-CG 4.19Å; L338-F397 HydrophobicContact CD2-CB 4.17Å; L338-F397 HydrophobicContact CD2-CD1 3.68Å; L338-F397 HydrophobicContact CD2-CD2 4.15Å; L338-F397 HydrophobicContact CD2-CE1 4.06Å; L338-F397 HydrophobicContact CD2-CG 3.72Å; L338-F397 HydrophobicContact CD2-CZ 4.45Å; L338-F397 HydrophobicContact CG-CB 4.5Å; L338-F408 HydrophobicContact CB-CE1 3.76Å; L338-F408 HydrophobicContact CB-CE2 4.05Å; L338-F408 HydrophobicContact CB-CZ 3.43Å; L338-F408 VanDerWaalsContact CB-CZ 3.43Å; L338-F408 HydrophobicContact CD1-CD1 3.93Å; L338-F408 HydrophobicContact CD1-CE1 3.59Å; L338-F408 HydrophobicContact CD1-CZ 4.18Å; L338-F408 HydrophobicContact CG-CE1 4.29Å; L338-F408 HydrophobicContact CG-CZ 4.44Å
339	G	95.7	Very high	90.4	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	168.6	173.8	0	0	0	0	0	111.5	V346	G339-V346 VanDerWaalsContact C-CG2 3.48Å; G339-V346 PolarHBondContact N-O 2.77Å; G339-V346 PolarHBondContact O-N 3.36Å
340	I	96.8	Very high	90.6	Very high	12 Å²	12	32 Å²	32	6%	0.062	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	121.4	-177.9	-29.2	172.6	0	0	0	109.3	W359 F408 W411 V412 R415	I340-W359 HydrophobicContact CG2-CH2 3.79Å; I340-W359 HydrophobicContact CG2-CZ2 4.26Å; I340-F408 HydrophobicContact CD1-CD2 4.21Å; I340-F408 HydrophobicContact CD1-CE2 3.72Å; I340-F408 HydrophobicContact CD1-CZ 4.2Å; I340-F408 HydrophobicContact CG1-CE2 3.56Å; I340-F408 HydrophobicContact CG1-CZ 3.78Å; I340-W411 HydrophobicContact CD1-CB 3.61Å; I340-W411 HydrophobicContact CD1-CE3 4.46Å; I340-V412 HydrophobicContact CD1-CB 4.35Å; I340-V412 HydrophobicContact CD1-CG2 3.53Å; I340-V412 HydrophobicContact CG1-CG2 3.85Å; I340-V412 HydrophobicContact CG2-CG2 4.25Å; I340-R415 HydrophobicContact CG2-CB 3.98Å; I340-R415 HydrophobicContact CG2-CG 3.68Å; I340-R415 PolarHBondContact O-NH1 2.93Å
341	T	95.6	Very high	90.4	Very high	20 Å²	20	35.6 Å²	35.6	12%	0.123	21%	0.213	C	C	.	.			trans	-101.9	-170.7	179.1	57.3	0	0	0	0	110.3	I282 T343 G344 V346 R415	I282-T341 HydrophobicContact CD1-CG2 4.29Å; I282-T341 HydrophobicContact CG1-CG2 4.44Å; T341-T343 VanDerWaalsContact C-N 3.32Å; T341-T343 PolarHBondContact OG1-N 3.12Å; T341-T343 PolarHBondContact OG1-OG1 3.42Å; T341-G344 PolarHBondContact N-O 3.46Å; T341-G344 PolarHBondContact OG1-N 3.41Å; T341-G344 PolarHBondContact OG1-O 2.91Å; T341-V346 HydrophobicContact CG2-CG1 3.86Å; T341-V346 HydrophobicContact CG2-CG2 3.86Å; T341-R415 WeakPolarHBondContact O-CG 3.27Å
342	S	95.5	Very high	90.6	Very high	30 Å²	30	36.6 Å²	36.6	21%	0.21	21%	0.213	C	C	.	.	S	Bend	trans	-75.2	-21.9	164	50.1	0	0	0	0	112.7	W359	S342-W359 PolarHBondContact O-NE1 3.48Å
343	T	96	Very high	91.1	Very high	65 Å²	65	32 Å²	32	40%	0.399	19%	0.187	S	C	.	.	S	Bend	trans	-93.9	-27.4	-175.6	49.5	0	0	0	0	114.5	T341 E356 T358 W359	T341-T343 VanDerWaalsContact C-N 3.32Å; T341-T343 PolarHBondContact OG1-N 3.12Å; T341-T343 PolarHBondContact OG1-OG1 3.42Å; T343-E356 WeakPolarHBondContact CB-OE1 3.1Å; T343-E356 PolarHBondContact OG1-OE1 3.03Å; T343-T358 WeakPolarHBondContact O-CA 3.38Å; T343-W359 VanDerWaalsContact C-NE1 3.34Å; T343-W359 PolarHBondContact O-N 2.97Å; T343-W359 PolarHBondContact O-NE1 3.23Å
344	G	96.8	Very high	91.6	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174	-158.5	-172.4	0	0	0	0	0	116	T341 Y357	T341-G344 PolarHBondContact N-O 3.46Å; T341-G344 PolarHBondContact OG1-N 3.41Å; T341-G344 PolarHBondContact OG1-O 2.91Å; G344-Y357 CarbonylContact C-O 3.6Å; G344-Y357 WeakPolarHBondContact CA-O 3.45Å
345	V	97.4	Very high	92	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	127.6	169.8	-178.7	0	0	0	0	108.5	Y357 W359 I362 F372 I374 V412	V345-Y357 HydrophobicContact CB-CD2 4.42Å; V345-Y357 PolarHBondContact N-O 3.43Å; V345-Y357 PolarHBondContact O-N 2.9Å; V345-W359 HydrophobicContact CG2-CH2 4.37Å; V345-W359 HydrophobicContact CG2-CZ3 4.07Å; V345-I362 HydrophobicContact CG2-CD1 4.1Å; V345-F372 HydrophobicContact CG1-CE1 4.41Å; V345-I374 HydrophobicContact CB-CD1 4.17Å; V345-I374 HydrophobicContact CG1-CD1 3.94Å; V345-V412 HydrophobicContact CG2-CB 4.47Å; V345-V412 HydrophobicContact CG2-CG1 3.39Å; V345-V412 HydrophobicContact CG2-CG2 4.12Å
346	V	95.9	Very high	92.4	Very high	1 Å²	1	29 Å²	29	1%	0.006	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	157.2	-179.4	-72.5	0	0	0	0	110.9	I282 G339 T341 F348 A355 E356	I282-V346 HydrophobicContact CD1-CG2 3.68Å; G339-V346 VanDerWaalsContact C-CG2 3.48Å; G339-V346 PolarHBondContact N-O 2.77Å; G339-V346 PolarHBondContact O-N 3.36Å; T341-V346 HydrophobicContact CG2-CG1 3.86Å; T341-V346 HydrophobicContact CG2-CG2 3.86Å; V346-F348 HydrophobicContact CB-CE2 4.06Å; V346-F348 HydrophobicContact CG2-CE2 3.75Å; V346-A355 CarbonylContact C-O 3.52Å; V346-A355 WeakPolarHBondContact CA-O 3.45Å; V346-E356 HydrophobicContact CG1-CB 3.89Å; V346-E356 HydrophobicContact CG1-CG 3.59Å
347	T	95.1	Very high	92.5	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	145.2	180	60.7	0	0	0	0	110.8	F336 Y337 L338 N354 A355 Y357 F397	F336-T347 HydrophobicContact CE1-CG2 4.23Å; F336-T347 HydrophobicContact CZ-CG2 3.9Å; Y337-T347 CarbonylContact O-C 3.59Å; Y337-T347 VanDerWaalsContact O-CA 3.29Å; Y337-T347 WeakPolarHBondContact O-CA 3.29Å; L338-T347 HydrophobicContact CD2-CG2 3.84Å; T347-N354 PolarHBondContact O-N 3.07Å; T347-N354 PolarHBondContact OG1-ND2 3.44Å; T347-A355 PolarHBondContact N-O 3.38Å; T347-A355 PolarHBondContact O-N 3.18Å; T347-A355 WeakPolarHBondContact OG1-CB 3.49Å; T347-A355 PolarHBondContact OG1-N 2.99Å; T347-A355 VanDerWaalsContact OG1-N 3.07Å; T347-A355 PolarHBondContact OG1-O 3.05Å; T347-A355 VanDerWaalsContact OG1-O 3.04Å; T347-Y357 HydrophobicContact CG2-CE2 3.87Å; T347-F397 HydrophobicContact CG2-CE1 4.17Å; T347-F397 HydrophobicContact CG2-CZ 4.18Å
348	F	91.7	Very high	92.6	Very high	9 Å²	9	29.8 Å²	29.8	4%	0.039	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	143.5	-178.4	-65.9	-102.2	0	0	0	111.1	T279 I282 F336 Y337 V346 Q352 R353	T279-F348 HydrophobicContact CG2-CE1 4.14Å; T279-F348 HydrophobicContact CG2-CZ 4.33Å; I282-F348 HydrophobicContact CD1-CE2 3.55Å; I282-F348 HydrophobicContact CD1-CZ 3.53Å; F336-F348 VanDerWaalsContact CA-O 3.3Å; F336-F348 WeakPolarHBondContact CA-O 3.46Å; F336-F348 WeakPolarHBondContact CD2-O 3.39Å; F336-F348 WeakPolarHBondContact CG-O 3.34Å; Y337-F348 HydrophobicContact CD2-CB 4.42Å; Y337-F348 PolarHBondContact N-O 2.86Å; Y337-F348 PolarHBondContact O-N 3.49Å; V346-F348 HydrophobicContact CB-CE2 4.06Å; V346-F348 HydrophobicContact CG2-CE2 3.75Å; F348-Q352 CarbonylContact C-O 3.52Å; F348-Q352 WeakPolarHBondContact CA-O 3.18Å; F348-Q352 WeakPolarHBondContact CB-O 3.38Å; F348-R353 HydrophobicContact CD1-CB 4.16Å; F348-R353 HydrophobicContact CE1-CB 3.82Å; F348-R353 HydrophobicContact CE1-CG 4.03Å; F348-R353 HydrophobicContact CZ-CB 4.33Å; F348-R353 HydrophobicContact CZ-CG 4.02Å
349	V	90	Very high	92.7	Very high	15 Å²	15	30.9 Å²	30.9	9%	0.091	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	112	165.5	175.4	0	0	0	0	106.2	L295 L330 F336 R351 Q352 N354	L295-V349 HydrophobicContact CD2-CG1 3.95Å; L295-V349 HydrophobicContact CD2-CG2 4.4Å; L330-V349 HydrophobicContact CD1-CG1 4.3Å; L330-V349 HydrophobicContact CD1-CG2 4.4Å; F336-V349 HydrophobicContact CD2-CG2 3.78Å; F336-V349 HydrophobicContact CE2-CG2 4.11Å; V349-R351 PolarHBondContact O-N 3.11Å; V349-Q352 PolarHBondContact N-O 2.96Å; V349-Q352 PolarHBondContact O-N 3.26Å; V349-N354 HydrophobicContact CG2-CB 3.97Å
350	G	85	Confident	92.6	Very high	25 Å²	25	35.7 Å²	35.7	26%	0.258	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	-121.7	-165.8	0	0	0	0	0	111.3	T335	T335-G350 PolarHBondContact O-N 3.03Å
351	R	80.4	Confident	92.5	Very high	116 Å²	116	39.1 Å²	39.1	44%	0.438	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-5.7	178.9	-68.5	-176.7	175	-160.3	-7.3	114.9	L154 V349 I534	L154-R351 HydrophobicContact CD1-CB 3.78Å; L154-R351 HydrophobicContact CD1-CG 3.86Å; V349-R351 PolarHBondContact O-N 3.11Å; R351-I534 VanDerWaalsContact NH2-CG2 3.34Å
352	Q	83.1	Confident	92.4	Very high	82 Å²	82	38.3 Å²	38.3	38%	0.383	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	138.5	-171	-65.3	-62.7	-16.1	0	0	112.2	P296 F348 V349 N354	P296-Q352 HydrophobicContact CB-CB 4.25Å; P296-Q352 HydrophobicContact CB-CG 4.06Å; P296-Q352 HydrophobicContact CG-CB 3.54Å; P296-Q352 HydrophobicContact CG-CG 3.8Å; F348-Q352 CarbonylContact C-O 3.52Å; F348-Q352 WeakPolarHBondContact CA-O 3.18Å; F348-Q352 WeakPolarHBondContact CB-O 3.38Å; V349-Q352 PolarHBondContact N-O 2.96Å; V349-Q352 PolarHBondContact O-N 3.26Å; Q352-N354 PolarHBondContact O-N 3.5Å
353	R	87.5	Confident	92.2	Very high	95 Å²	95	41 Å²	41	36%	0.358	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	122.3	178.9	-158.7	-164.8	-47.4	-161.2	8.4	109.5	F348 E356	F348-R353 HydrophobicContact CD1-CB 4.16Å; F348-R353 HydrophobicContact CE1-CB 3.82Å; F348-R353 HydrophobicContact CE1-CG 4.03Å; F348-R353 HydrophobicContact CZ-CB 4.33Å; F348-R353 HydrophobicContact CZ-CG 4.02Å; R353-E356 IonicContact NH1-OE2 3.73Å; R353-E356 PolarHBondContact NH1-OE2 3.33Å
354	N	88.3	Confident	92	Very high	14 Å²	14	42.1 Å²	42.1	8%	0.075	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-46.6	-179.5	156.8	82.2	0	0	0	112.3	Y294 T347 V349 Q352	Y294-N354 PolarHBondContact N-OD1 2.87Å; Y294-N354 PolarHBondContact O-OD1 2.7Å; Y294-N354 VanDerWaalsContact O-OD1 3.06Å; T347-N354 PolarHBondContact O-N 3.07Å; T347-N354 PolarHBondContact OG1-ND2 3.44Å; V349-N354 HydrophobicContact CG2-CB 3.97Å; Q352-N354 PolarHBondContact O-N 3.5Å
355	A	91.8	Very high	91.8	Very high	25 Å²	25	42.7 Å²	42.7	21%	0.207	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	155.4	-179.2	0	0	0	0	0	112	V346 T347 Y357	V346-A355 CarbonylContact C-O 3.52Å; V346-A355 WeakPolarHBondContact CA-O 3.45Å; T347-A355 PolarHBondContact N-O 3.38Å; T347-A355 PolarHBondContact O-N 3.18Å; T347-A355 WeakPolarHBondContact OG1-CB 3.49Å; T347-A355 PolarHBondContact OG1-N 2.99Å; T347-A355 VanDerWaalsContact OG1-N 3.07Å; T347-A355 PolarHBondContact OG1-O 3.05Å; T347-A355 VanDerWaalsContact OG1-O 3.04Å; A355-Y357 HydrophobicContact CB-CE1 4.41Å
356	E	94.3	Very high	91.5	Very high	59 Å²	59	42.8 Å²	42.8	28%	0.276	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	132.2	174.9	-177.4	160.8	168.4	0	0	109.3	T343 V346 R353 T358	T343-E356 WeakPolarHBondContact CB-OE1 3.1Å; T343-E356 PolarHBondContact OG1-OE1 3.03Å; V346-E356 HydrophobicContact CG1-CB 3.89Å; V346-E356 HydrophobicContact CG1-CG 3.59Å; R353-E356 IonicContact NH1-OE2 3.73Å; R353-E356 PolarHBondContact NH1-OE2 3.33Å; E356-T358 HydrophobicContact CG-CG2 4.47Å
357	Y	95.5	Very high	91.3	Very high	24 Å²	24	43.2 Å²	43.2	9%	0.094	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	102.6	177.8	-52.3	-61.5	0	0	0	108.4	G344 V345 T347 A355 I362 I374 L376 H395 F397	G344-Y357 CarbonylContact C-O 3.6Å; G344-Y357 WeakPolarHBondContact CA-O 3.45Å; V345-Y357 HydrophobicContact CB-CD2 4.42Å; V345-Y357 PolarHBondContact N-O 3.43Å; V345-Y357 PolarHBondContact O-N 2.9Å; T347-Y357 HydrophobicContact CG2-CE2 3.87Å; A355-Y357 HydrophobicContact CB-CE1 4.41Å; Y357-I362 WeakPolarHBondContact O-CD1 3.12Å; Y357-I374 HydrophobicContact CD2-CD1 3.55Å; Y357-I374 HydrophobicContact CE2-CD1 3.98Å; Y357-I374 HydrophobicContact CG-CD1 4.32Å; Y357-L376 HydrophobicContact CD1-CD1 3.83Å; Y357-L376 HydrophobicContact CD1-CD2 4.02Å; Y357-L376 HydrophobicContact CE1-CD1 4Å; Y357-L376 HydrophobicContact CG-CD2 4.28Å; Y357-H395 AromaticContact CE1-CE1 3.71Å; Y357-H395 AromaticContact CE1-ND1 3.34Å; Y357-H395 VanDerWaalsContact CE1-ND1 3.34Å; Y357-H395 WeakPolarHBondContact CE1-ND1 3.48Å; Y357-H395 AromaticContact CZ-CE1 3.99Å; Y357-H395 AromaticContact CZ-ND1 3.28Å; Y357-H395 VanDerWaalsContact CZ-ND1 3.28Å; Y357-H395 PolarHBondContact OH-ND1 2.95Å; Y357-F397 HydrophobicContact CE2-CE2 4.41Å; Y357-F397 AromaticContact CE2-CZ 3.95Å; Y357-F397 HydrophobicContact CE2-CZ 3.95Å
358	T	97	Very high	91	Very high	33 Å²	33	46.9 Å²	46.9	20%	0.202	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	157.1	-173.8	59.9	0	0	0	0	111.9	T343 E356 D360 Q361 I362	T343-T358 WeakPolarHBondContact O-CA 3.38Å; E356-T358 HydrophobicContact CG-CG2 4.47Å; T358-D360 WeakPolarHBondContact CB-OD1 3.42Å; T358-D360 PolarHBondContact O-N 3.28Å; T358-D360 VanDerWaalsContact O-N 3.14Å; T358-D360 PolarHBondContact OG1-OD1 2.92Å; T358-Q361 PolarHBondContact O-N 3Å; T358-Q361 VanDerWaalsContact O-N 3.09Å; T358-Q361 VanDerWaalsContact OG1-CG 3.25Å; T358-Q361 WeakPolarHBondContact OG1-CG 3.04Å; T358-I362 WeakPolarHBondContact O-CG1 3.35Å; T358-I362 PolarHBondContact O-N 3.47Å; T358-I362 VanDerWaalsContact O-N 3.13Å
359	W	96.6	Very high	91	Very high	24 Å²	24	48.1 Å²	48.1	9%	0.091	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-28.3	-174.7	-61.1	131.5	0	0	0	114.9	I340 S342 T343 V345 I362 V412 R415 K416 T420	I340-W359 HydrophobicContact CG2-CH2 3.79Å; I340-W359 HydrophobicContact CG2-CZ2 4.26Å; S342-W359 PolarHBondContact O-NE1 3.48Å; T343-W359 VanDerWaalsContact C-NE1 3.34Å; T343-W359 PolarHBondContact O-N 2.97Å; T343-W359 PolarHBondContact O-NE1 3.23Å; V345-W359 HydrophobicContact CG2-CH2 4.37Å; V345-W359 HydrophobicContact CG2-CZ3 4.07Å; W359-I362 HydrophobicContact CE3-CD1 3.94Å; W359-I362 HydrophobicContact CZ3-CD1 4.14Å; W359-V412 HydrophobicContact CH2-CG1 3.97Å; W359-V412 HydrophobicContact CZ3-CG1 3.79Å; W359-R415 HydrophobicContact CH2-CG 4.47Å; W359-R415 HydrophobicContact CZ2-CG 4.05Å; W359-K416 HydrophobicContact CD2-CB 4.13Å; W359-K416 HydrophobicContact CD2-CD 4.29Å; W359-K416 HydrophobicContact CD2-CG 3.95Å; W359-K416 HydrophobicContact CE3-CB 3.8Å; W359-K416 HydrophobicContact CE3-CD 3.68Å; W359-K416 HydrophobicContact CE3-CG 3.74Å; W359-K416 HydrophobicContact CG-CG 4.39Å; W359-K416 HydrophobicContact CH2-CB 4.04Å; W359-K416 HydrophobicContact CZ2-CB 4.35Å; W359-K416 HydrophobicContact CZ3-CB 3.76Å; W359-K416 HydrophobicContact CZ3-CD 4.22Å; W359-K416 HydrophobicContact CZ3-CG 4.21Å; W359-K416 PolarHBondContact O-NZ 2.99Å; W359-T420 HydrophobicContact CB-CG2 3.67Å; W359-T420 VanDerWaalsContact CD1-CG2 3.47Å; W359-T420 HydrophobicContact CD2-CG2 4.45Å; W359-T420 HydrophobicContact CG-CG2 3.59Å
360	D	94.5	Very high	91.2	Very high	101 Å²	101	52.7 Å²	52.7	54%	0.54	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-35.7	176.3	63.1	-71.5	0	0	0	112.5	T358 K377	T358-D360 WeakPolarHBondContact CB-OD1 3.42Å; T358-D360 PolarHBondContact O-N 3.28Å; T358-D360 VanDerWaalsContact O-N 3.14Å; T358-D360 PolarHBondContact OG1-OD1 2.92Å; D360-K377 WeakPolarHBondContact O-CD 3.33Å; D360-K377 WeakPolarHBondContact O-CE 3.33Å; D360-K377 PolarHBondContact O-NZ 3.22Å
361	Q	94.1	Very high	91.7	Very high	83 Å²	83	54 Å²	54	39%	0.388	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-35.8	173.7	-67.9	169.5	-4.3	0	0	111.6	T358 H363 L376 K377	T358-Q361 PolarHBondContact O-N 3Å; T358-Q361 VanDerWaalsContact O-N 3.09Å; T358-Q361 VanDerWaalsContact OG1-CG 3.25Å; T358-Q361 WeakPolarHBondContact OG1-CG 3.04Å; Q361-H363 PolarHBondContact O-N 2.87Å; Q361-H363 VanDerWaalsContact O-N 3.17Å; Q361-L376 HydrophobicContact CB-CD2 4.29Å; Q361-L376 WeakPolarHBondContact O-CA 3.36Å; Q361-K377 PolarHBondContact O-N 3.12Å
362	I	94.5	Very high	92.4	Very high	3 Å²	3	48.4 Å²	48.4	2%	0.015	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	104.5	-178.5	-61.9	167.6	0	0	0	110.8	V345 Y357 T358 W359 L365 I374 L376 K416	V345-I362 HydrophobicContact CG2-CD1 4.1Å; Y357-I362 WeakPolarHBondContact O-CD1 3.12Å; T358-I362 WeakPolarHBondContact O-CG1 3.35Å; T358-I362 PolarHBondContact O-N 3.47Å; T358-I362 VanDerWaalsContact O-N 3.13Å; W359-I362 HydrophobicContact CE3-CD1 3.94Å; W359-I362 HydrophobicContact CZ3-CD1 4.14Å; I362-L365 HydrophobicContact CG2-CD2 3.76Å; I362-L365 HydrophobicContact CG2-CG 3.85Å; I362-I374 HydrophobicContact CD1-CG2 4.32Å; I362-I374 HydrophobicContact CG1-CG2 3.83Å; I362-I374 HydrophobicContact CG2-CG2 4.25Å; I362-L376 HydrophobicContact CG1-CD2 3.98Å; I362-K416 PolarHBondContact O-NZ 2.84Å
363	H	90.9	Very high	93	Very high	86 Å²	86	45.1 Å²	45.1	40%	0.398	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	-51.1	170.7	173.6	69.7	0	0	0	111.9	Q361 Y375 K377 Y392	Q361-H363 PolarHBondContact O-N 2.87Å; Q361-H363 VanDerWaalsContact O-N 3.17Å; H363-Y375 WeakPolarHBondContact CA-O 3.29Å; H363-Y375 WeakPolarHBondContact CB-O 3.28Å; H363-Y375 PolarHBondContact N-O 3.07Å; H363-K377 HydrophobicContact CB-CG 4Å; H363-Y392 HydrophobicContact CB-CD1 3.79Å; H363-Y392 HydrophobicContact CB-CE1 3.85Å; H363-Y392 AromaticContact CD2-CD1 3.72Å; H363-Y392 AromaticContact CD2-CE1 3.34Å; H363-Y392 WeakPolarHBondContact CD2-CE1 3.3Å; H363-Y392 AromaticContact CD2-CE2 3.67Å; H363-Y392 AromaticContact CD2-CZ 3.33Å; H363-Y392 AromaticContact CE1-CE1 3.84Å; H363-Y392 AromaticContact CE1-CZ 3.63Å; H363-Y392 PolarHBondContact CE1-OH 3.18Å; H363-Y392 VanDerWaalsContact CE1-OH 3.32Å; H363-Y392 AromaticContact CG-CD1 3.67Å; H363-Y392 AromaticContact CG-CE1 3.27Å; H363-Y392 AromaticContact CG-CZ 3.73Å; H363-Y392 AromaticContact ND1-CE1 3.59Å; H363-Y392 AromaticContact ND1-CZ 3.89Å; H363-Y392 AromaticContact NE2-CE1 3.72Å; H363-Y392 AromaticContact NE2-CE2 3.72Å; H363-Y392 AromaticContact NE2-CZ 3.28Å; H363-Y392 VanDerWaalsContact NE2-CZ 3.28Å; H363-Y392 PolarHBondContact NE2-OH 3.01Å
364	R	90.9	Very high	93.3	Very high	89 Å²	89	40.6 Å²	40.6	34%	0.336	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	151.8	-179	178.6	173.5	178.6	-167.5	0.6	111.3	Y375 K431 T433	R364-Y375 HydrophobicContact CB-CD2 4.18Å; R364-Y375 HydrophobicContact CB-CG 4.41Å; R364-Y375 HydrophobicContact CG-CD2 4.31Å; R364-Y375 PolarHBondContact N-O 3.26Å; R364-Y375 WeakPolarHBondContact O-CB 3.5Å; R364-Y375 PolarHBondContact O-N 3.41Å; R364-K431 PolarHBondContact NH2-O 3.12Å; R364-T433 PolarHBondContact NH2-O 3.47Å
365	L	93.6	Very high	93.5	Very high	13 Å²	13	41.8 Å²	41.8	7%	0.068	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	143.2	168.3	-62	165.1	0	0	0	109.6	I362 F372 L373 I374 W409 V412 V413 K416	I362-L365 HydrophobicContact CG2-CD2 3.76Å; I362-L365 HydrophobicContact CG2-CG 3.85Å; L365-F372 HydrophobicContact CD2-CE2 4.37Å; L365-F372 HydrophobicContact CD2-CZ 3.88Å; L365-L373 WeakPolarHBondContact CA-O 3.47Å; L365-I374 HydrophobicContact CD2-CG1 4.24Å; L365-I374 HydrophobicContact CD2-CG2 4.35Å; L365-W409 PolarHBondContact O-NE1 3.35Å; L365-V412 HydrophobicContact CD1-CB 4.24Å; L365-V412 HydrophobicContact CD1-CG1 3.44Å; L365-V412 VanDerWaalsContact CD1-CG1 3.44Å; L365-V412 HydrophobicContact CD2-CG1 4.15Å; L365-V412 HydrophobicContact CG-CG1 4.43Å; L365-V413 HydrophobicContact CB-CG2 4.39Å; L365-V413 HydrophobicContact CD1-CG2 3.96Å; L365-K416 HydrophobicContact CD1-CD 4.5Å
366	G	91.5	Very high	93.6	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	166.3	176.5	0	0	0	0	0	112.6	L373 W409 P432	G366-L373 PolarHBondContact N-O 2.97Å; G366-L373 PolarHBondContact O-N 3.47Å; G366-W409 VanDerWaalsContact C-CD1 3.43Å; G366-P432 VanDerWaalsContact CA-O 3.28Å; G366-P432 WeakPolarHBondContact CA-O 3.37Å
367	C	90.4	Very high	93.4	Very high	10 Å²	10	44 Å²	44	7%	0.068	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	129.5	171.8	-174.8	0	0	0	0	108.6	L371 A405 W409 P432	C367-L371 WeakPolarHBondContact CA-O 3.45Å; C367-A405 VanDerWaalsContact SG-C 3.56Å; C367-W409 HydrophobicContact CB-CB 3.93Å; C367-W409 HydrophobicContact CB-CG 3.93Å; C367-P432 HydrophobicContact CB-CB 4.15Å; C367-P432 PolarHBondContact N-O 3Å
368	D	90.4	Very high	92.8	Very high	77 Å²	77	47.2 Å²	47.2	41%	0.412	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	123.2	175.9	-170	16.1	0	0	0	111	K370 L371 L373	D368-K370 PolarHBondContact O-N 3.36Å; D368-K370 VanDerWaalsContact O-N 3.16Å; D368-L371 PolarHBondContact N-O 3.02Å; D368-L371 WeakPolarHBondContact O-CA 3.42Å; D368-L371 VanDerWaalsContact O-CB 3.31Å; D368-L371 WeakPolarHBondContact O-CB 3.44Å; D368-L371 PolarHBondContact O-N 3.38Å; D368-L373 HydrophobicContact CB-CD1 4.2Å
369	G	90.5	Very high	91.3	Very high	35 Å²	35	52.6 Å²	52.6	36%	0.361	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	-119.7	-172	0	0	0	0	0	112.6	K402	G369-K402 WeakPolarHBondContact O-CA 3.39Å; G369-K402 WeakPolarHBondContact O-CB 3.26Å; G369-K402 WeakPolarHBondContact O-CG 3.42Å
370	K	94.2	Very high	89.6	Confident	111 Å²	111	60.1 Å²	60.1	48%	0.483	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	3.3	174.2	-59.8	-166.8	179.3	-164.8	0	113.7	D368 R398 C399 K400	D368-K370 PolarHBondContact O-N 3.36Å; D368-K370 VanDerWaalsContact O-N 3.16Å; K370-R398 HydrophobicContact CB-CG 4.39Å; K370-R398 WeakPolarHBondContact O-CA 3.24Å; K370-C399 PolarHBondContact O-N 2.69Å; K370-K400 PolarHBondContact NZ-O 3.06Å
371	L	95.1	Very high	87.6	Confident	52 Å²	52	61.9 Å²	61.9	27%	0.272	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	125.4	-175.6	-56.8	177.7	0	0	0	111.4	M290 C367 D368 L373 F397 R398	M290-L371 HydrophobicContact CG-CD2 4.11Å; M290-L371 HydrophobicContact SD-CD2 4.06Å; C367-L371 WeakPolarHBondContact CA-O 3.45Å; D368-L371 PolarHBondContact N-O 3.02Å; D368-L371 WeakPolarHBondContact O-CA 3.42Å; D368-L371 VanDerWaalsContact O-CB 3.31Å; D368-L371 WeakPolarHBondContact O-CB 3.44Å; D368-L371 PolarHBondContact O-N 3.38Å; L371-L373 HydrophobicContact CB-CD2 3.94Å; L371-F397 CarbonylContact C-O 3.58Å; L371-F397 WeakPolarHBondContact CA-O 3.45Å; L371-R398 HydrophobicContact CD2-CB 3.84Å; L371-R398 HydrophobicContact CD2-CG 4.25Å
372	F	95.6	Very high	85.6	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	134.2	160.6	175.3	-111.7	0	0	0	109.4	L338 V345 L365 I374 S396 F397 F408 W409 V412	L338-F372 HydrophobicContact CD1-CD1 4Å; V345-F372 HydrophobicContact CG1-CE1 4.41Å; L365-F372 HydrophobicContact CD2-CE2 4.37Å; L365-F372 HydrophobicContact CD2-CZ 3.88Å; F372-I374 HydrophobicContact CD1-CG1 4.23Å; F372-I374 HydrophobicContact CE1-CD1 3.81Å; F372-I374 HydrophobicContact CE1-CG1 3.56Å; F372-I374 HydrophobicContact CZ-CG1 4.08Å; F372-S396 WeakPolarHBondContact O-CA 3.43Å; F372-F397 HydrophobicContact CD1-CD2 4.04Å; F372-F397 PolarHBondContact N-O 3.28Å; F372-F397 PolarHBondContact O-N 3.45Å; F372-F408 AromaticContact CD1-CD1 3.9Å; F372-F408 HydrophobicContact CD1-CD1 3.9Å; F372-F408 AromaticContact CD1-CE1 3.84Å; F372-F408 HydrophobicContact CD1-CE1 3.84Å; F372-F408 HydrophobicContact CD2-CD1 4.03Å; F372-F408 AromaticContact CE1-CD1 3.98Å; F372-F408 HydrophobicContact CE1-CD1 3.98Å; F372-F408 AromaticContact CE1-CE1 3.59Å; F372-F408 HydrophobicContact CE1-CE1 3.59Å; F372-F408 HydrophobicContact CE2-CD1 4.11Å; F372-F408 HydrophobicContact CE2-CE1 4.39Å; F372-F408 AromaticContact CG-CD1 3.92Å; F372-F408 HydrophobicContact CG-CD1 3.92Å; F372-F408 HydrophobicContact CG-CE1 4.33Å; F372-F408 HydrophobicContact CZ-CD1 4.08Å; F372-F408 AromaticContact CZ-CE1 3.89Å; F372-F408 HydrophobicContact CZ-CE1 3.89Å; F372-W409 HydrophobicContact CD2-CB 4.01Å; F372-W409 HydrophobicContact CE2-CB 4.13Å; F372-V412 HydrophobicContact CE2-CG2 4.31Å; F372-V412 HydrophobicContact CZ-CB 4.29Å; F372-V412 HydrophobicContact CZ-CG1 4.32Å; F372-V412 HydrophobicContact CZ-CG2 3.9Å
373	L	94.9	Very high	83.2	Confident	12 Å²	12	70.4 Å²	70.4	6%	0.063	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	126	-168.8	-56.1	178.9	0	0	0	111.3	L365 G366 D368 L371 Y375 L394 S396	L365-L373 WeakPolarHBondContact CA-O 3.47Å; G366-L373 PolarHBondContact N-O 2.97Å; G366-L373 PolarHBondContact O-N 3.47Å; D368-L373 HydrophobicContact CB-CD1 4.2Å; L371-L373 HydrophobicContact CB-CD2 3.94Å; L373-Y375 HydrophobicContact CB-CE2 3.94Å; L373-Y375 HydrophobicContact CD1-CE2 4.47Å; L373-L394 HydrophobicContact CB-CD1 4.04Å; L373-L394 HydrophobicContact CD2-CD1 4.31Å; L373-S396 WeakPolarHBondContact CD2-OG 3.32Å
374	I	94.8	Very high	80.9	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	117.1	174.1	-49.3	-178.4	0	0	0	109	V345 Y357 I362 L365 F372 L376 H395 F397	V345-I374 HydrophobicContact CB-CD1 4.17Å; V345-I374 HydrophobicContact CG1-CD1 3.94Å; Y357-I374 HydrophobicContact CD2-CD1 3.55Å; Y357-I374 HydrophobicContact CE2-CD1 3.98Å; Y357-I374 HydrophobicContact CG-CD1 4.32Å; I362-I374 HydrophobicContact CD1-CG2 4.32Å; I362-I374 HydrophobicContact CG1-CG2 3.83Å; I362-I374 HydrophobicContact CG2-CG2 4.25Å; L365-I374 HydrophobicContact CD2-CG1 4.24Å; L365-I374 HydrophobicContact CD2-CG2 4.35Å; F372-I374 HydrophobicContact CD1-CG1 4.23Å; F372-I374 HydrophobicContact CE1-CD1 3.81Å; F372-I374 HydrophobicContact CE1-CG1 3.56Å; F372-I374 HydrophobicContact CZ-CG1 4.08Å; I374-L376 HydrophobicContact CG2-CD2 3.69Å; I374-L376 HydrophobicContact CG2-CG 4.16Å; I374-H395 HydrophobicContact CB-CB 4.46Å; I374-H395 PolarHBondContact N-O 2.81Å; I374-H395 PolarHBondContact O-N 2.96Å; I374-F397 HydrophobicContact CD1-CD2 4.47Å; I374-F397 HydrophobicContact CD1-CE2 3.74Å; I374-F397 HydrophobicContact CG1-CE2 4.12Å
375	Y	93.2	Very high	79	Confident	40 Å²	40	75.4 Å²	75.4	16%	0.157	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	107.9	173.2	-61.2	-99	0	0	0	108.7	H363 R364 L373 I393 L394 T434	H363-Y375 WeakPolarHBondContact CA-O 3.29Å; H363-Y375 WeakPolarHBondContact CB-O 3.28Å; H363-Y375 PolarHBondContact N-O 3.07Å; R364-Y375 HydrophobicContact CB-CD2 4.18Å; R364-Y375 HydrophobicContact CB-CG 4.41Å; R364-Y375 HydrophobicContact CG-CD2 4.31Å; R364-Y375 PolarHBondContact N-O 3.26Å; R364-Y375 WeakPolarHBondContact O-CB 3.5Å; R364-Y375 PolarHBondContact O-N 3.41Å; L373-Y375 HydrophobicContact CB-CE2 3.94Å; L373-Y375 HydrophobicContact CD1-CE2 4.47Å; Y375-I393 CarbonylContact C-O 3.52Å; Y375-I393 WeakPolarHBondContact CA-O 3.18Å; Y375-L394 HydrophobicContact CD1-CD1 3.99Å; Y375-L394 HydrophobicContact CD2-CD1 4.24Å; Y375-L394 HydrophobicContact CE1-CD1 3.79Å; Y375-L394 HydrophobicContact CE1-CD2 4.34Å; Y375-L394 HydrophobicContact CE1-CG 4.49Å; Y375-L394 HydrophobicContact CE2-CD1 4.05Å; Y375-L394 HydrophobicContact CG-CD1 4.21Å; Y375-T434 WeakPolarHBondContact OH-CG2 3.47Å
376	L	93	Very high	76.6	Confident	16 Å²	16	85 Å²	85	8%	0.084	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	144.1	178.3	-57.2	172.5	0	0	0	110.6	Y357 Q361 I362 I374 Y392 I393	Y357-L376 HydrophobicContact CD1-CD1 3.83Å; Y357-L376 HydrophobicContact CD1-CD2 4.02Å; Y357-L376 HydrophobicContact CE1-CD1 4Å; Y357-L376 HydrophobicContact CG-CD2 4.28Å; Q361-L376 HydrophobicContact CB-CD2 4.29Å; Q361-L376 WeakPolarHBondContact O-CA 3.36Å; I362-L376 HydrophobicContact CG1-CD2 3.98Å; I374-L376 HydrophobicContact CG2-CD2 3.69Å; I374-L376 HydrophobicContact CG2-CG 4.16Å; L376-Y392 CarbonylContact O-C 3.54Å; L376-Y392 WeakPolarHBondContact O-CA 3.38Å; L376-Y392 VanDerWaalsContact O-CB 3.28Å; L376-Y392 WeakPolarHBondContact O-CB 3.47Å; L376-I393 HydrophobicContact CB-CB 4.31Å; L376-I393 PolarHBondContact N-O 3.3Å; L376-I393 PolarHBondContact O-N 3.39Å
377	K	90.9	Very high	74.5	Confident	115 Å²	115	91.4 Å²	91.4	50%	0.5	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	151.1	168.6	-63.8	173.1	-175.5	167.4	0	109.9	D360 Q361 H363	D360-K377 WeakPolarHBondContact O-CD 3.33Å; D360-K377 WeakPolarHBondContact O-CE 3.33Å; D360-K377 PolarHBondContact O-NZ 3.22Å; Q361-K377 PolarHBondContact O-N 3.12Å; H363-K377 HydrophobicContact CB-CG 4Å
378	R	82.3	Confident	72.5	Confident	90 Å²	90	99.3 Å²	99.3	34%	0.34	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-99.1	134.8	167.3	-77.1	-168	-176.4	115.5	-3.4	110	R389 T390 Y392 I393	R378-R389 PolarHBondContact NH1-O 3.39Å; R378-R389 PolarHBondContact NH2-O 3.11Å; R378-T390 PolarHBondContact NH1-O 3.18Å; R378-Y392 VanDerWaalsContact CZ-O 3.24Å; R378-Y392 PolarHBondContact NH1-O 2.94Å; R378-Y392 PolarHBondContact NH2-O 2.78Å; R378-Y392 VanDerWaalsContact NH2-O 3.13Å; R378-I393 HydrophobicContact CG-CD1 4.09Å; R378-I393 HydrophobicContact CG-CG1 3.61Å
379	D	66	Low	70.8	Confident	147 Å²	147	106 Å²	106	79%	0.786	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-69.2	130.3	166.4	-65.1	-36.7	0	0	0	109.8	N381	D379-N381 PolarHBondContact O-N 2.95Å
380	H	60.2	Low	69.2	Low	181 Å²	181	109.5 Å²	109.5	84%	0.838	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	6	-175	-75.6	-68.5	0	0	0	113.9	H382	H380-H382 VanDerWaalsContact C-N 3.31Å; H380-H382 PolarHBondContact O-N 3.46Å
381	N	53.4	Low	68.4	Low	139 Å²	139	112 Å²	112	74%	0.743	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	1.2	-167.8	-65.4	-7.3	0	0	0	115	D379	D379-N381 PolarHBondContact O-N 2.95Å
382	H	51.7	Low	67.9	Low	173 Å²	173	112.8 Å²	112.8	80%	0.801	53%	0.528	S	S	*	.	S	Bend	trans	-116.3	85.2	175.9	-67.8	-45.9	0	0	0	113.1	H380	H380-H382 VanDerWaalsContact C-N 3.31Å; H380-H382 PolarHBondContact O-N 3.46Å
383	T	44.5	Very low	67.5	Low	91 Å²	91	116.2 Å²	116.2	56%	0.558	55%	0.545	S	S	*	.			trans	33.6	106.7	138.4	52.1	0	0	0	0	119.6	Y688	T383-Y688 HydrophobicContact CG2-CD2 4.4Å; T383-Y688 HydrophobicContact CG2-CE1 4.09Å; T383-Y688 HydrophobicContact CG2-CE2 3.92Å
384	G	42.1	Very low	67.3	Low	41 Å²	41	119 Å²	119	42%	0.423	56%	0.56	S	S	.	*				98.7	7.1	114	0	0	0	0	0	121
385	R	49.9	Very low	67.3	Low	239 Å²	239	121 Å²	121	90%	0.902	57%	0.569	S	S	*	*			trans	-134.1	100	171.1	-71.4	-171.3	177.3	166.9	1	114.3	L387	R385-L387 PolarHBondContact O-N 2.87Å; R385-L387 VanDerWaalsContact O-N 3.1Å
386	K	44.2	Very low	67.3	Low	214 Å²	214	119.8 Å²	119.8	93%	0.93	57%	0.566	S	S	*	*			trans	-70	91.8	166.8	-72.6	-178	176.4	-179.7	0	110.2
387	L	47.3	Very low	67.4	Low	137 Å²	137	119.2 Å²	119.2	72%	0.717	56%	0.563	S	S	*	*	S	Bend	trans	-153.8	98.5	168.2	-147.2	72.7	0	0	0	111.3	R385 R389	R385-L387 PolarHBondContact O-N 2.87Å; R385-L387 VanDerWaalsContact O-N 3.1Å; L387-R389 VanDerWaalsContact C-N 3.25Å; L387-R389 WeakPolarHBondContact O-CB 3.38Å; L387-R389 PolarHBondContact O-N 3.43Å
388	F	48.2	Very low	67.7	Low	175 Å²	175	120.1 Å²	120.1	77%	0.768	56%	0.563	S	S	*	*			trans	48.1	12.3	159.7	-73	-82.2	0	0	0	121.2	T390 D636	F388-T390 PolarHBondContact O-N 3.4Å; F388-D636 VanDerWaalsContact CE1-OD2 3.29Å; F388-D636 WeakPolarHBondContact CE1-OD2 3.48Å
389	R	54.1	Low	68.2	Low	217 Å²	217	116 Å²	116	82%	0.819	55%	0.549	S	S	*	.			trans	-85.5	30.5	-157	-129.3	177.2	-172.6	-166.5	0.9	119	R378 L387	R378-R389 PolarHBondContact NH1-O 3.39Å; R378-R389 PolarHBondContact NH2-O 3.11Å; L387-R389 VanDerWaalsContact C-N 3.25Å; L387-R389 WeakPolarHBondContact O-CB 3.38Å; L387-R389 PolarHBondContact O-N 3.43Å
390	T	57.7	Low	69.5	Low	110 Å²	110	116.8 Å²	116.8	68%	0.675	55%	0.545	S	S	*	.			trans	62.6	162.4	-173.6	-34.9	0	0	0	0	112.5	R378 F388	R378-T390 PolarHBondContact NH1-O 3.18Å; F388-T390 PolarHBondContact O-N 3.4Å
391	K	77.3	Confident	71.1	Confident	163 Å²	163	109.4 Å²	109.4	71%	0.709	51%	0.514	S	S	*	.	S	Bend	trans	-92.7	-7.5	174.7	-70.6	-178.6	-179	176.7	0	114.4
392	Y	83.8	Confident	72.9	Confident	69 Å²	69	109.5 Å²	109.5	27%	0.271	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	154.6	-167.1	-49.1	-63.4	0	0	0	112	H363 L376 R378	H363-Y392 HydrophobicContact CB-CD1 3.79Å; H363-Y392 HydrophobicContact CB-CE1 3.85Å; H363-Y392 AromaticContact CD2-CD1 3.72Å; H363-Y392 AromaticContact CD2-CE1 3.34Å; H363-Y392 WeakPolarHBondContact CD2-CE1 3.3Å; H363-Y392 AromaticContact CD2-CE2 3.67Å; H363-Y392 AromaticContact CD2-CZ 3.33Å; H363-Y392 AromaticContact CE1-CE1 3.84Å; H363-Y392 AromaticContact CE1-CZ 3.63Å; H363-Y392 PolarHBondContact CE1-OH 3.18Å; H363-Y392 VanDerWaalsContact CE1-OH 3.32Å; H363-Y392 AromaticContact CG-CD1 3.67Å; H363-Y392 AromaticContact CG-CE1 3.27Å; H363-Y392 AromaticContact CG-CZ 3.73Å; H363-Y392 AromaticContact ND1-CE1 3.59Å; H363-Y392 AromaticContact ND1-CZ 3.89Å; H363-Y392 AromaticContact NE2-CE1 3.72Å; H363-Y392 AromaticContact NE2-CE2 3.72Å; H363-Y392 AromaticContact NE2-CZ 3.28Å; H363-Y392 VanDerWaalsContact NE2-CZ 3.28Å; H363-Y392 PolarHBondContact NE2-OH 3.01Å; L376-Y392 CarbonylContact O-C 3.54Å; L376-Y392 WeakPolarHBondContact O-CA 3.38Å; L376-Y392 VanDerWaalsContact O-CB 3.28Å; L376-Y392 WeakPolarHBondContact O-CB 3.47Å; R378-Y392 VanDerWaalsContact CZ-O 3.24Å; R378-Y392 PolarHBondContact NH1-O 2.94Å; R378-Y392 PolarHBondContact NH2-O 2.78Å; R378-Y392 VanDerWaalsContact NH2-O 3.13Å
393	I	88.5	Confident	74.9	Confident	71 Å²	71	103.3 Å²	103.3	36%	0.364	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	132	164.3	-54	175.4	0	0	0	107.2	Y375 L376 R378	Y375-I393 CarbonylContact C-O 3.52Å; Y375-I393 WeakPolarHBondContact CA-O 3.18Å; L376-I393 HydrophobicContact CB-CB 4.31Å; L376-I393 PolarHBondContact N-O 3.3Å; L376-I393 PolarHBondContact O-N 3.39Å; R378-I393 HydrophobicContact CG-CD1 4.09Å; R378-I393 HydrophobicContact CG-CG1 3.61Å
394	L	90.9	Very high	77.2	Confident	72 Å²	72	99.5 Å²	99.5	38%	0.377	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	116.2	179.6	175.9	58.9	0	0	0	110.1	Q291 L373 Y375	Q291-L394 PolarHBondContact NE2-O 3.02Å; L373-L394 HydrophobicContact CB-CD1 4.04Å; L373-L394 HydrophobicContact CD2-CD1 4.31Å; Y375-L394 HydrophobicContact CD1-CD1 3.99Å; Y375-L394 HydrophobicContact CD2-CD1 4.24Å; Y375-L394 HydrophobicContact CE1-CD1 3.79Å; Y375-L394 HydrophobicContact CE1-CD2 4.34Å; Y375-L394 HydrophobicContact CE1-CG 4.49Å; Y375-L394 HydrophobicContact CE2-CD1 4.05Å; Y375-L394 HydrophobicContact CG-CD1 4.21Å
395	H	93.4	Very high	79.7	Confident	42 Å²	42	97.6 Å²	97.6	19%	0.194	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	143.7	166.1	-66.5	-175.7	0	0	0	109.5	Y357 I374 F397	Y357-H395 AromaticContact CE1-CE1 3.71Å; Y357-H395 AromaticContact CE1-ND1 3.34Å; Y357-H395 VanDerWaalsContact CE1-ND1 3.34Å; Y357-H395 WeakPolarHBondContact CE1-ND1 3.48Å; Y357-H395 AromaticContact CZ-CE1 3.99Å; Y357-H395 AromaticContact CZ-ND1 3.28Å; Y357-H395 VanDerWaalsContact CZ-ND1 3.28Å; Y357-H395 PolarHBondContact OH-ND1 2.95Å; I374-H395 HydrophobicContact CB-CB 4.46Å; I374-H395 PolarHBondContact N-O 2.81Å; I374-H395 PolarHBondContact O-N 2.96Å; H395-F397 HydrophobicContact CB-CE2 3.96Å; H395-F397 HydrophobicContact CB-CZ 4.11Å
396	S	93.9	Very high	81.8	Confident	14 Å²	14	89 Å²	89	10%	0.098	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	131.8	-167.8	-48.3	0	0	0	0	110.6	M290 Q291 F372 L373	M290-S396 WeakPolarHBondContact CB-O 3.29Å; M290-S396 VanDerWaalsContact CG-O 3.31Å; M290-S396 WeakPolarHBondContact CG-O 3.08Å; M290-S396 PolarHBondContact N-O 3.06Å; Q291-S396 VanDerWaalsContact NE2-N 3.1Å; Q291-S396 PolarHBondContact OE1-O 3.22Å; Q291-S396 VanDerWaalsContact OE1-O 3.13Å; F372-S396 WeakPolarHBondContact O-CA 3.43Å; L373-S396 WeakPolarHBondContact CD2-OG 3.32Å
397	F	95.8	Very high	84.1	Confident	4 Å²	4	78.9 Å²	78.9	2%	0.018	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	127.5	-173.5	-53.6	-85.5	0	0	0	109.6	A287 T288 P289 F336 L338 T347 Y357 L371 F372 I374 H395	A287-F397 HydrophobicContact CB-CB 4.19Å; T288-F397 CarbonylContact O-C 3.57Å; T288-F397 WeakPolarHBondContact O-CA 3.33Å; P289-F397 HydrophobicContact CB-CD1 4.14Å; P289-F397 HydrophobicContact CB-CE1 4.24Å; F336-F397 AromaticContact CE1-CD1 3.77Å; F336-F397 HydrophobicContact CE1-CD1 3.77Å; F336-F397 AromaticContact CE1-CE1 3.83Å; F336-F397 HydrophobicContact CE1-CE1 3.83Å; F336-F397 HydrophobicContact CZ-CD1 4.31Å; F336-F397 AromaticContact CZ-CE1 3.91Å; F336-F397 HydrophobicContact CZ-CE1 3.91Å; L338-F397 HydrophobicContact CD1-CB 3.83Å; L338-F397 HydrophobicContact CD1-CG 4.19Å; L338-F397 HydrophobicContact CD2-CB 4.17Å; L338-F397 HydrophobicContact CD2-CD1 3.68Å; L338-F397 HydrophobicContact CD2-CD2 4.15Å; L338-F397 HydrophobicContact CD2-CE1 4.06Å; L338-F397 HydrophobicContact CD2-CG 3.72Å; L338-F397 HydrophobicContact CD2-CZ 4.45Å; L338-F397 HydrophobicContact CG-CB 4.5Å; T347-F397 HydrophobicContact CG2-CE1 4.17Å; T347-F397 HydrophobicContact CG2-CZ 4.18Å; Y357-F397 HydrophobicContact CE2-CE2 4.41Å; Y357-F397 AromaticContact CE2-CZ 3.95Å; Y357-F397 HydrophobicContact CE2-CZ 3.95Å; L371-F397 CarbonylContact C-O 3.58Å; L371-F397 WeakPolarHBondContact CA-O 3.45Å; F372-F397 HydrophobicContact CD1-CD2 4.04Å; F372-F397 PolarHBondContact N-O 3.28Å; F372-F397 PolarHBondContact O-N 3.45Å; I374-F397 HydrophobicContact CD1-CD2 4.47Å; I374-F397 HydrophobicContact CD1-CE2 3.74Å; I374-F397 HydrophobicContact CG1-CE2 4.12Å; H395-F397 HydrophobicContact CB-CE2 3.96Å; H395-F397 HydrophobicContact CB-CZ 4.11Å
398	R	95.8	Very high	86.4	Confident	133 Å²	133	72.4 Å²	72.4	50%	0.502	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	113.5	-178.2	-175.4	-175.6	-63.1	-154.9	0	110.2	A287 T288 M290 K370 L371	A287-R398 CarbonylContact C-O 3.51Å; A287-R398 VanDerWaalsContact CA-O 3.26Å; A287-R398 WeakPolarHBondContact CA-O 3.33Å; T288-R398 PolarHBondContact N-O 2.71Å; T288-R398 PolarHBondContact O-N 2.71Å; M290-R398 HydrophobicContact CE-CB 3.87Å; M290-R398 HydrophobicContact SD-CB 4.13Å; K370-R398 HydrophobicContact CB-CG 4.39Å; K370-R398 WeakPolarHBondContact O-CA 3.24Å; L371-R398 HydrophobicContact CD2-CB 3.84Å; L371-R398 HydrophobicContact CD2-CG 4.25Å
399	C	94.3	Very high	88.7	Confident	5 Å²	5	64 Å²	64	3%	0.034	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	165.7	175	-53.5	0	0	0	0	111.6	K370 S401 A404 A405	K370-C399 PolarHBondContact O-N 2.69Å; C399-S401 VanDerWaalsContact C-N 3.32Å; C399-S401 PolarHBondContact O-N 2.85Å; C399-A404 HydrophobicContact CB-CB 4.17Å; C399-A405 HydrophobicContact CB-CB 3.98Å
400	K	92.7	Very high	90.6	Very high	162 Å²	162	54.9 Å²	54.9	70%	0.704	26%	0.261	S	S	*	.	S	Bend	trans	-50.8	-46.4	178.4	-172.8	178	-178.9	-179.1	0	113	K370	K370-K400 PolarHBondContact NZ-O 3.06Å
401	S	93	Very high	92.4	Very high	27 Å²	27	51 Å²	51	19%	0.189	23%	0.234	C	C	.	.	S	Bend	trans	-137.9	167.4	-178	72.8	0	0	0	0	112.4	C399 T403 A404 A405	C399-S401 VanDerWaalsContact C-N 3.32Å; C399-S401 PolarHBondContact O-N 2.85Å; S401-T403 VanDerWaalsContact C-N 3.32Å; S401-T403 PolarHBondContact OG-N 3.01Å; S401-A404 PolarHBondContact O-N 3.25Å; S401-A404 WeakPolarHBondContact OG-CB 3.24Å; S401-A404 PolarHBondContact OG-N 2.79Å; S401-A405 PolarHBondContact O-N 3.27Å
402	K	92.6	Very high	93.3	Very high	141 Å²	141	43.2 Å²	43.2	61%	0.613	20%	0.201	S	C	*	.	H	α-helix	trans	-63.2	-40.1	171	174.5	175.2	178.6	-175.8	0	111.1	G369 A404 A405 F406	G369-K402 WeakPolarHBondContact O-CA 3.39Å; G369-K402 WeakPolarHBondContact O-CB 3.26Å; G369-K402 WeakPolarHBondContact O-CG 3.42Å; K402-A404 VanDerWaalsContact C-N 3.33Å; K402-A404 PolarHBondContact O-N 3.36Å; K402-A405 PolarHBondContact O-N 2.79Å; K402-F406 VanDerWaalsContact O-CB 3.29Å; K402-F406 WeakPolarHBondContact O-CB 3.44Å; K402-F406 PolarHBondContact O-N 2.67Å
403	T	92.4	Very high	93.8	Very high	43 Å²	43	40.2 Å²	40.2	26%	0.264	19%	0.189	S	C	.	.	H	α-helix	trans	-57.3	-45.7	174.3	-43.2	0	0	0	0	110.9	D90 D92 I94 S401 F406 A407	D90-T403 WeakPolarHBondContact OD2-CG2 3.3Å; D92-T403 WeakPolarHBondContact OD2-CB 3.42Å; D92-T403 PolarHBondContact OD2-OG1 2.58Å; I94-T403 HydrophobicContact CB-CG2 4.36Å; I94-T403 HydrophobicContact CG1-CG2 4.35Å; I94-T403 HydrophobicContact CG2-CG2 4.48Å; S401-T403 VanDerWaalsContact C-N 3.32Å; S401-T403 PolarHBondContact OG-N 3.01Å; T403-F406 PolarHBondContact O-N 2.63Å; T403-A407 VanDerWaalsContact O-CB 3.27Å; T403-A407 WeakPolarHBondContact O-CB 3.15Å; T403-A407 PolarHBondContact O-N 3.46Å
404	A	94.1	Very high	94.1	Very high	11 Å²	11	37.6 Å²	37.6	9%	0.091	18%	0.176	C	C	.	.	H	α-helix	trans	-66	-44.5	177.8	0	0	0	0	0	113.4	I94 C399 S401 K402 F406 F408	I94-A404 HydrophobicContact CD1-CB 3.99Å; I94-A404 HydrophobicContact CG1-CB 4.48Å; C399-A404 HydrophobicContact CB-CB 4.17Å; S401-A404 PolarHBondContact O-N 3.25Å; S401-A404 WeakPolarHBondContact OG-CB 3.24Å; S401-A404 PolarHBondContact OG-N 2.79Å; K402-A404 VanDerWaalsContact C-N 3.33Å; K402-A404 PolarHBondContact O-N 3.36Å; A404-F406 VanDerWaalsContact C-N 3.32Å; A404-F406 PolarHBondContact O-N 2.82Å; A404-F408 WeakPolarHBondContact O-CB 3.43Å; A404-F408 PolarHBondContact O-N 2.67Å
405	A	94.4	Very high	94.4	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62	-41	176.3	0	0	0	0	0	111.9	C367 C399 S401 K402 W409	C367-A405 VanDerWaalsContact SG-C 3.56Å; C399-A405 HydrophobicContact CB-CB 3.98Å; S401-A405 PolarHBondContact O-N 3.27Å; K402-A405 PolarHBondContact O-N 2.79Å; A405-W409 WeakPolarHBondContact O-CB 3.38Å; A405-W409 PolarHBondContact O-N 2.86Å
406	F	92.8	Very high	94.5	Very high	58 Å²	58	35.4 Å²	35.4	25%	0.254	16%	0.162	S	C	.	.	H	α-helix	trans	-71.9	-40.5	179.8	-175.4	-119.3	0	0	0	112.8	K402 T403 A404 W409 H410 P432 H441	K402-F406 VanDerWaalsContact O-CB 3.29Å; K402-F406 WeakPolarHBondContact O-CB 3.44Å; K402-F406 PolarHBondContact O-N 2.67Å; T403-F406 PolarHBondContact O-N 2.63Å; A404-F406 VanDerWaalsContact C-N 3.32Å; A404-F406 PolarHBondContact O-N 2.82Å; F406-W409 HydrophobicContact CD2-CE3 4.14Å; F406-W409 AromaticContact CE2-CE3 3.87Å; F406-W409 HydrophobicContact CE2-CE3 3.87Å; F406-W409 HydrophobicContact CE2-CZ3 4Å; F406-W409 PolarHBondContact O-N 3.37Å; F406-H410 AromaticContact CE1-CD2 3.67Å; F406-H410 AromaticContact CE1-NE2 3.63Å; F406-H410 AromaticContact CE2-CD2 3.52Å; F406-H410 AromaticContact CE2-NE2 3.63Å; F406-H410 AromaticContact CZ-CD2 3.32Å; F406-H410 WeakPolarHBondContact CZ-CD2 3.39Å; F406-H410 AromaticContact CZ-NE2 3.08Å; F406-H410 WeakPolarHBondContact CZ-NE2 3.37Å; F406-H410 PolarHBondContact O-N 3.35Å; F406-P432 HydrophobicContact CD2-CB 4.2Å; F406-P432 HydrophobicContact CD2-CG 4.39Å; F406-P432 HydrophobicContact CE2-CB 3.92Å; F406-P432 HydrophobicContact CE2-CG 3.75Å; F406-H441 HydrophobicContact CZ-CB 4.3Å
407	A	93.7	Very high	94.6	Very high	2 Å²	2	35.2 Å²	35.2	2%	0.017	16%	0.161	C	C	.	.	H	α-helix	trans	-60	-50.2	172.6	0	0	0	0	0	111	I94 T403 W409 H410 W411	I94-A407 HydrophobicContact CG2-CB 4.18Å; T403-A407 VanDerWaalsContact O-CB 3.27Å; T403-A407 WeakPolarHBondContact O-CB 3.15Å; T403-A407 PolarHBondContact O-N 3.46Å; A407-W409 VanDerWaalsContact C-N 3.35Å; A407-W409 PolarHBondContact O-N 3.27Å; A407-H410 WeakPolarHBondContact O-CA 3.32Å; A407-H410 VanDerWaalsContact O-CB 3.29Å; A407-H410 WeakPolarHBondContact O-CB 3.33Å; A407-H410 PolarHBondContact O-N 3.21Å; A407-H410 VanDerWaalsContact O-N 3.11Å; A407-W411 PolarHBondContact O-N 2.71Å; A407-W411 PolarHBondContact O-NE1 3.15Å
408	F	95.6	Very high	94.7	Very high	1 Å²	1	35.1 Å²	35.1	0%	0.004	16%	0.161	C	C	.	.	H	α-helix	trans	-60.6	-42.8	177.3	-171	-107.4	0	0	0	112.1	V285 L338 I340 F372 A404 H410 W411 V412	V285-F408 HydrophobicContact CB-CD2 4.02Å; V285-F408 HydrophobicContact CB-CE2 4.24Å; V285-F408 HydrophobicContact CG1-CD2 4.43Å; V285-F408 HydrophobicContact CG2-CD2 3.6Å; V285-F408 HydrophobicContact CG2-CE2 3.99Å; V285-F408 HydrophobicContact CG2-CG 4.48Å; L338-F408 HydrophobicContact CB-CE1 3.76Å; L338-F408 HydrophobicContact CB-CE2 4.05Å; L338-F408 HydrophobicContact CB-CZ 3.43Å; L338-F408 VanDerWaalsContact CB-CZ 3.43Å; L338-F408 HydrophobicContact CD1-CD1 3.93Å; L338-F408 HydrophobicContact CD1-CE1 3.59Å; L338-F408 HydrophobicContact CD1-CZ 4.18Å; L338-F408 HydrophobicContact CG-CE1 4.29Å; L338-F408 HydrophobicContact CG-CZ 4.44Å; I340-F408 HydrophobicContact CD1-CD2 4.21Å; I340-F408 HydrophobicContact CD1-CE2 3.72Å; I340-F408 HydrophobicContact CD1-CZ 4.2Å; I340-F408 HydrophobicContact CG1-CE2 3.56Å; I340-F408 HydrophobicContact CG1-CZ 3.78Å; F372-F408 AromaticContact CD1-CD1 3.9Å; F372-F408 HydrophobicContact CD1-CD1 3.9Å; F372-F408 AromaticContact CD1-CE1 3.84Å; F372-F408 HydrophobicContact CD1-CE1 3.84Å; F372-F408 HydrophobicContact CD2-CD1 4.03Å; F372-F408 AromaticContact CE1-CD1 3.98Å; F372-F408 HydrophobicContact CE1-CD1 3.98Å; F372-F408 AromaticContact CE1-CE1 3.59Å; F372-F408 HydrophobicContact CE1-CE1 3.59Å; F372-F408 HydrophobicContact CE2-CD1 4.11Å; F372-F408 HydrophobicContact CE2-CE1 4.39Å; F372-F408 AromaticContact CG-CD1 3.92Å; F372-F408 HydrophobicContact CG-CD1 3.92Å; F372-F408 HydrophobicContact CG-CE1 4.33Å; F372-F408 HydrophobicContact CZ-CD1 4.08Å; F372-F408 AromaticContact CZ-CE1 3.89Å; F372-F408 HydrophobicContact CZ-CE1 3.89Å; A404-F408 WeakPolarHBondContact O-CB 3.43Å; A404-F408 PolarHBondContact O-N 2.67Å; F408-H410 VanDerWaalsContact C-N 3.33Å; F408-H410 PolarHBondContact O-N 2.78Å; F408-W411 AromaticContact CD2-CE3 3.93Å; F408-W411 HydrophobicContact CD2-CE3 3.93Å; F408-W411 HydrophobicContact CD2-CZ3 4.38Å; F408-W411 PolarHBondContact O-N 3.39Å; F408-V412 HydrophobicContact CD1-CG2 3.98Å; F408-V412 HydrophobicContact CE1-CG2 3.59Å; F408-V412 HydrophobicContact CE2-CG2 4.25Å; F408-V412 HydrophobicContact CG-CG2 4.45Å; F408-V412 HydrophobicContact CZ-CG2 3.74Å; F408-V412 WeakPolarHBondContact O-CG2 3.02Å; F408-V412 PolarHBondContact O-N 3.38Å
409	W	95.7	Very high	94.7	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-57.3	-45.2	173.2	176	88.7	0	0	0	112.2	L365 G366 C367 F372 A405 F406 A407 W411 V412 V413 I430 P432	L365-W409 PolarHBondContact O-NE1 3.35Å; G366-W409 VanDerWaalsContact C-CD1 3.43Å; C367-W409 HydrophobicContact CB-CB 3.93Å; C367-W409 HydrophobicContact CB-CG 3.93Å; F372-W409 HydrophobicContact CD2-CB 4.01Å; F372-W409 HydrophobicContact CE2-CB 4.13Å; A405-W409 WeakPolarHBondContact O-CB 3.38Å; A405-W409 PolarHBondContact O-N 2.86Å; F406-W409 HydrophobicContact CD2-CE3 4.14Å; F406-W409 AromaticContact CE2-CE3 3.87Å; F406-W409 HydrophobicContact CE2-CE3 3.87Å; F406-W409 HydrophobicContact CE2-CZ3 4Å; F406-W409 PolarHBondContact O-N 3.37Å; A407-W409 VanDerWaalsContact C-N 3.35Å; A407-W409 PolarHBondContact O-N 3.27Å; W409-W411 VanDerWaalsContact C-N 3.35Å; W409-W411 PolarHBondContact O-N 3.18Å; W409-V412 PolarHBondContact O-N 3.37Å; W409-V413 HydrophobicContact CD2-CG2 4.11Å; W409-V413 HydrophobicContact CH2-CG2 4.38Å; W409-V413 HydrophobicContact CZ2-CG2 3.82Å; W409-V413 VanDerWaalsContact O-CG2 3.3Å; W409-V413 WeakPolarHBondContact O-CG2 3.46Å; W409-V413 PolarHBondContact O-N 2.86Å; W409-I430 HydrophobicContact CH2-CG2 4.21Å; W409-I430 HydrophobicContact CZ2-CG2 3.81Å; W409-P432 HydrophobicContact CD2-CB 3.93Å; W409-P432 HydrophobicContact CE3-CB 3.94Å; W409-P432 HydrophobicContact CH2-CB 3.94Å; W409-P432 HydrophobicContact CH2-CG 4.41Å; W409-P432 HydrophobicContact CZ2-CB 3.89Å; W409-P432 HydrophobicContact CZ3-CB 3.96Å; W409-P432 HydrophobicContact CZ3-CG 4.42Å
410	H	93.7	Very high	94.8	Very high	24 Å²	24	32.1 Å²	32.1	11%	0.111	16%	0.155	C	C	.	.	H	α-helix	trans	-56.7	-47.6	174.2	-103.4	-97.9	0	0	0	111.4	F406 A407 F408 V413 D414 Y443	F406-H410 AromaticContact CE1-CD2 3.67Å; F406-H410 AromaticContact CE1-NE2 3.63Å; F406-H410 AromaticContact CE2-CD2 3.52Å; F406-H410 AromaticContact CE2-NE2 3.63Å; F406-H410 AromaticContact CZ-CD2 3.32Å; F406-H410 WeakPolarHBondContact CZ-CD2 3.39Å; F406-H410 AromaticContact CZ-NE2 3.08Å; F406-H410 WeakPolarHBondContact CZ-NE2 3.37Å; F406-H410 PolarHBondContact O-N 3.35Å; A407-H410 WeakPolarHBondContact O-CA 3.32Å; A407-H410 VanDerWaalsContact O-CB 3.29Å; A407-H410 WeakPolarHBondContact O-CB 3.33Å; A407-H410 PolarHBondContact O-N 3.21Å; A407-H410 VanDerWaalsContact O-N 3.11Å; F408-H410 VanDerWaalsContact C-N 3.33Å; F408-H410 PolarHBondContact O-N 2.78Å; H410-V413 PolarHBondContact O-N 3.04Å; H410-D414 WeakPolarHBondContact O-CB 3.32Å; H410-D414 PolarHBondContact O-N 3.06Å; H410-Y443 AromaticContact CE1-CD2 3.82Å; H410-Y443 AromaticContact ND1-CD2 3.45Å; H410-Y443 WeakPolarHBondContact ND1-CD2 3.36Å
411	W	95.5	Very high	94.9	Very high	29 Å²	29	25.6 Å²	25.6	11%	0.11	13%	0.128	C	C	.	.	H	α-helix	trans	-63.6	-42	-179.6	-55.6	-6.3	0	0	0	112.6	R95 W97 V285 I340 A407 F408 W409 R415	R95-W411 HydrophobicContact CB-CH2 4.3Å; R95-W411 HydrophobicContact CB-CZ2 4.2Å; R95-W411 VanDerWaalsContact O-CZ2 3.31Å; R95-W411 WeakPolarHBondContact O-CZ2 3.44Å; W97-W411 AromaticContact CD1-CD1 3.5Å; W97-W411 VanDerWaalsContact CD1-CD1 3.5Å; W97-W411 AromaticContact CD1-NE1 3.52Å; V285-W411 HydrophobicContact CG2-CE3 4.45Å; V285-W411 HydrophobicContact CG2-CH2 4.46Å; V285-W411 HydrophobicContact CG2-CZ3 3.7Å; I340-W411 HydrophobicContact CD1-CB 3.61Å; I340-W411 HydrophobicContact CD1-CE3 4.46Å; A407-W411 PolarHBondContact O-N 2.71Å; A407-W411 PolarHBondContact O-NE1 3.15Å; F408-W411 AromaticContact CD2-CE3 3.93Å; F408-W411 HydrophobicContact CD2-CE3 3.93Å; F408-W411 HydrophobicContact CD2-CZ3 4.38Å; F408-W411 PolarHBondContact O-N 3.39Å; W409-W411 VanDerWaalsContact C-N 3.35Å; W409-W411 PolarHBondContact O-N 3.18Å; W411-R415 WeakPolarHBondContact O-CB 3.36Å; W411-R415 PolarHBondContact O-N 3.03Å
412	V	96.8	Very high	94.9	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-67.4	-42.4	179.1	-179.8	0	0	0	0	110.7	I340 V345 W359 L365 F372 F408 W409 K416	I340-V412 HydrophobicContact CD1-CB 4.35Å; I340-V412 HydrophobicContact CD1-CG2 3.53Å; I340-V412 HydrophobicContact CG1-CG2 3.85Å; I340-V412 HydrophobicContact CG2-CG2 4.25Å; V345-V412 HydrophobicContact CG2-CB 4.47Å; V345-V412 HydrophobicContact CG2-CG1 3.39Å; V345-V412 HydrophobicContact CG2-CG2 4.12Å; W359-V412 HydrophobicContact CH2-CG1 3.97Å; W359-V412 HydrophobicContact CZ3-CG1 3.79Å; L365-V412 HydrophobicContact CD1-CB 4.24Å; L365-V412 HydrophobicContact CD1-CG1 3.44Å; L365-V412 VanDerWaalsContact CD1-CG1 3.44Å; L365-V412 HydrophobicContact CD2-CG1 4.15Å; L365-V412 HydrophobicContact CG-CG1 4.43Å; F372-V412 HydrophobicContact CE2-CG2 4.31Å; F372-V412 HydrophobicContact CZ-CB 4.29Å; F372-V412 HydrophobicContact CZ-CG1 4.32Å; F372-V412 HydrophobicContact CZ-CG2 3.9Å; F408-V412 HydrophobicContact CD1-CG2 3.98Å; F408-V412 HydrophobicContact CE1-CG2 3.59Å; F408-V412 HydrophobicContact CE2-CG2 4.25Å; F408-V412 HydrophobicContact CG-CG2 4.45Å; F408-V412 HydrophobicContact CZ-CG2 3.74Å; F408-V412 WeakPolarHBondContact O-CG2 3.02Å; F408-V412 PolarHBondContact O-N 3.38Å; W409-V412 PolarHBondContact O-N 3.37Å; V412-K416 VanDerWaalsContact O-CB 3.29Å; V412-K416 WeakPolarHBondContact O-CB 3.47Å; V412-K416 PolarHBondContact O-N 3.17Å
413	V	94.9	Very high	94.9	Very high	5 Å²	5	29.1 Å²	29.1	3%	0.03	14%	0.142	C	C	.	.	H	α-helix	trans	-65	-44.2	177.8	174.8	0	0	0	0	111	L365 W409 H410 K416 C417 I430 Y443	L365-V413 HydrophobicContact CB-CG2 4.39Å; L365-V413 HydrophobicContact CD1-CG2 3.96Å; W409-V413 HydrophobicContact CD2-CG2 4.11Å; W409-V413 HydrophobicContact CH2-CG2 4.38Å; W409-V413 HydrophobicContact CZ2-CG2 3.82Å; W409-V413 VanDerWaalsContact O-CG2 3.3Å; W409-V413 WeakPolarHBondContact O-CG2 3.46Å; W409-V413 PolarHBondContact O-N 2.86Å; H410-V413 PolarHBondContact O-N 3.04Å; V413-K416 PolarHBondContact O-N 2.86Å; V413-C417 PolarHBondContact O-N 2.71Å; V413-C417 PolarHBondContact O-SG 3.48Å; V413-I430 HydrophobicContact CG1-CB 4.22Å; V413-I430 HydrophobicContact CG1-CD1 3.48Å; V413-I430 VanDerWaalsContact CG1-CD1 3.48Å; V413-I430 HydrophobicContact CG1-CG1 4.4Å; V413-I430 HydrophobicContact CG1-CG2 4.26Å; V413-Y443 HydrophobicContact CB-CD1 4.34Å; V413-Y443 HydrophobicContact CG1-CD1 3.4Å; V413-Y443 HydrophobicContact CG1-CE1 3.84Å; V413-Y443 HydrophobicContact CG1-CG 4.11Å
414	D	95.2	Very high	94.9	Very high	16 Å²	16	28.3 Å²	28.3	9%	0.086	14%	0.139	C	C	.	.	H	α-helix	trans	-60.8	-47.7	177	176.9	93	0	0	0	112.2	K121 H122 H410 C417 F418 Y443	K121-D414 WeakPolarHBondContact CE-OD2 3.39Å; K121-D414 IonicContact NZ-OD1 3.35Å; K121-D414 PolarHBondContact NZ-OD1 2.77Å; K121-D414 IonicContact NZ-OD2 3.08Å; K121-D414 PolarHBondContact NZ-OD2 2.78Å; H122-D414 IonicContact CE1-OD2 3.04Å; H122-D414 PolarHBondContact CE1-OD2 3.12Å; H122-D414 IonicContact NE2-OD2 2.79Å; H122-D414 PolarHBondContact NE2-OD2 3.39Å; H410-D414 WeakPolarHBondContact O-CB 3.32Å; H410-D414 PolarHBondContact O-N 3.06Å; D414-C417 PolarHBondContact O-N 2.81Å; D414-F418 PolarHBondContact O-N 3.32Å; D414-Y443 VanDerWaalsContact CA-OH 3.24Å; D414-Y443 WeakPolarHBondContact CA-OH 3.37Å; D414-Y443 HydrophobicContact CB-CE1 4.42Å; D414-Y443 HydrophobicContact CB-CE2 3.83Å; D414-Y443 VanDerWaalsContact CB-OH 3.24Å; D414-Y443 WeakPolarHBondContact CB-OH 3.44Å; D414-Y443 VanDerWaalsContact CG-OH 3.24Å; D414-Y443 PolarHBondContact OD1-OH 3.01Å
415	R	96.2	Very high	94.6	Very high	22 Å²	22	32.1 Å²	32.1	8%	0.083	17%	0.165	C	C	.	.	H	α-helix	trans	-62.4	-43	174.3	-174.5	65.9	72.7	101.4	-0.6	112.3	K121 H122 I340 T341 W359 W411 F418 F419	K121-R415 PolarHBondContact O-NE 3.24Å; K121-R415 PolarHBondContact O-NH2 2.8Å; H122-R415 WeakPolarHBondContact ND1-CD 3.3Å; H122-R415 PolarHBondContact ND1-NE 3.23Å; I340-R415 HydrophobicContact CG2-CB 3.98Å; I340-R415 HydrophobicContact CG2-CG 3.68Å; I340-R415 PolarHBondContact O-NH1 2.93Å; T341-R415 WeakPolarHBondContact O-CG 3.27Å; W359-R415 HydrophobicContact CH2-CG 4.47Å; W359-R415 HydrophobicContact CZ2-CG 4.05Å; W411-R415 WeakPolarHBondContact O-CB 3.36Å; W411-R415 PolarHBondContact O-N 3.03Å; R415-F418 PolarHBondContact O-N 3.32Å; R415-F419 VanDerWaalsContact CD-CD2 3.46Å; R415-F419 HydrophobicContact CG-CD2 4.1Å; R415-F419 HydrophobicContact CG-CE2 4.41Å; R415-F419 WeakPolarHBondContact O-CD2 3.2Å; R415-F419 PolarHBondContact O-N 3.25Å
416	K	96.1	Very high	94.4	Very high	46 Å²	46	36.6 Å²	36.6	20%	0.2	19%	0.186	C	C	.	.	H	α-helix	trans	-60.9	-45.3	175.3	-178.6	167.6	177.7	154.2	0	110.9	W359 I362 L365 V412 V413 F419 T420	W359-K416 HydrophobicContact CD2-CB 4.13Å; W359-K416 HydrophobicContact CD2-CD 4.29Å; W359-K416 HydrophobicContact CD2-CG 3.95Å; W359-K416 HydrophobicContact CE3-CB 3.8Å; W359-K416 HydrophobicContact CE3-CD 3.68Å; W359-K416 HydrophobicContact CE3-CG 3.74Å; W359-K416 HydrophobicContact CG-CG 4.39Å; W359-K416 HydrophobicContact CH2-CB 4.04Å; W359-K416 HydrophobicContact CZ2-CB 4.35Å; W359-K416 HydrophobicContact CZ3-CB 3.76Å; W359-K416 HydrophobicContact CZ3-CD 4.22Å; W359-K416 HydrophobicContact CZ3-CG 4.21Å; W359-K416 PolarHBondContact O-NZ 2.99Å; I362-K416 PolarHBondContact O-NZ 2.84Å; L365-K416 HydrophobicContact CD1-CD 4.5Å; V412-K416 VanDerWaalsContact O-CB 3.29Å; V412-K416 WeakPolarHBondContact O-CB 3.47Å; V412-K416 PolarHBondContact O-N 3.17Å; V413-K416 PolarHBondContact O-N 2.86Å; K416-F419 PolarHBondContact O-N 2.89Å; K416-T420 HydrophobicContact CG-CG2 4.15Å; K416-T420 WeakPolarHBondContact O-CB 3.46Å; K416-T420 WeakPolarHBondContact O-CG2 3.24Å; K416-T420 PolarHBondContact O-N 3.04Å; K416-T420 PolarHBondContact O-OG1 3.07Å
417	C	96.1	Very high	94.1	Very high	11 Å²	11	34.8 Å²	34.8	7%	0.074	18%	0.182	C	C	.	.	H	α-helix	trans	-60.5	-47.1	177.6	-76.8	0	0	0	0	112	V413 D414 F419 L421 F445	V413-C417 PolarHBondContact O-N 2.71Å; V413-C417 PolarHBondContact O-SG 3.48Å; D414-C417 PolarHBondContact O-N 2.81Å; C417-F419 PolarHBondContact O-N 3.49Å; C417-L421 HydrophobicContact CB-CD1 3.81Å; C417-L421 HydrophobicContact CB-CG 4.38Å; C417-L421 WeakPolarHBondContact O-CB 3.28Å; C417-L421 VanDerWaalsContact O-CG 3.22Å; C417-L421 WeakPolarHBondContact O-CG 3.37Å; C417-L421 PolarHBondContact O-N 2.83Å; C417-F445 HydrophobicContact CB-CB 4.02Å; C417-F445 HydrophobicContact CB-CD1 4.5Å; C417-F445 HydrophobicContact CB-CD2 3.34Å; C417-F445 HydrophobicContact CB-CE2 3.9Å; C417-F445 HydrophobicContact CB-CG 3.7Å
418	F	97.1	Very high	93.7	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.009	22%	0.217	C	C	.	.	H	α-helix	trans	-58.1	-44.3	179.1	-176.6	-94.7	0	0	0	113.2	D82 Y83 H122 D414 R415 F445 R448 Q450 L453	D82-F418 HydrophobicContact CB-CE2 4.03Å; Y83-F418 AromaticContact CD1-CE1 3.95Å; Y83-F418 HydrophobicContact CD1-CE1 3.95Å; Y83-F418 AromaticContact CD1-CZ 3.61Å; Y83-F418 HydrophobicContact CD1-CZ 3.61Å; Y83-F418 AromaticContact CE1-CE1 3.74Å; Y83-F418 HydrophobicContact CE1-CE1 3.74Å; Y83-F418 AromaticContact CE1-CZ 3.55Å; Y83-F418 HydrophobicContact CE1-CZ 3.55Å; Y83-F418 HydrophobicContact CG-CZ 4.28Å; H122-F418 HydrophobicContact CB-CD1 3.75Å; H122-F418 HydrophobicContact CB-CE1 3.66Å; H122-F418 HydrophobicContact CB-CG 4.21Å; H122-F418 HydrophobicContact CB-CZ 4.07Å; H122-F418 AromaticContact CD2-CD1 3.93Å; H122-F418 AromaticContact CD2-CD2 3.38Å; H122-F418 WeakPolarHBondContact CD2-CD2 3.2Å; H122-F418 AromaticContact CD2-CE2 3.78Å; H122-F418 AromaticContact CD2-CG 3.45Å; H122-F418 VanDerWaalsContact CD2-CG 3.45Å; H122-F418 WeakPolarHBondContact CD2-CG 3.25Å; H122-F418 AromaticContact CG-CD1 3.7Å; H122-F418 AromaticContact CG-CG 3.66Å; H122-F418 AromaticContact NE2-CD2 3.84Å; H122-F418 AromaticContact NE2-CG 3.81Å; D414-F418 PolarHBondContact O-N 3.32Å; R415-F418 PolarHBondContact O-N 3.32Å; F418-F445 HydrophobicContact CB-CE2 3.94Å; F418-F445 HydrophobicContact CB-CZ 4.21Å; F418-F445 HydrophobicContact CD2-CZ 4.22Å; F418-R448 WeakPolarHBondContact CD2-O 3.31Å; F418-R448 WeakPolarHBondContact CE2-O 3.35Å; F418-Q450 HydrophobicContact CD1-CB 4.13Å; F418-Q450 HydrophobicContact CE1-CB 3.71Å; F418-Q450 HydrophobicContact CE1-CG 3.96Å; F418-Q450 HydrophobicContact CZ-CB 4.12Å; F418-Q450 HydrophobicContact CZ-CG 4.34Å; F418-Q450 PolarHBondContact O-N 3.41Å; F418-L453 HydrophobicContact CE2-CD1 3.81Å; F418-L453 HydrophobicContact CZ-CD1 3.67Å
419	F	96.8	Very high	93.1	Very high	18 Å²	18	50.3 Å²	50.3	8%	0.079	25%	0.249	C	C	.	.	H	α-helix	trans	-87.5	-18.4	-174.3	-79.5	-71	0	0	0	115.2	H122 Y123 P125 R415 K416 C417 Q450	H122-F419 HydrophobicContact CB-CE2 4.09Å; H122-F419 HydrophobicContact CB-CZ 4.35Å; Y123-F419 WeakPolarHBondContact O-CZ 3.38Å; P125-F419 HydrophobicContact CG-CE1 4.02Å; R415-F419 VanDerWaalsContact CD-CD2 3.46Å; R415-F419 HydrophobicContact CG-CD2 4.1Å; R415-F419 HydrophobicContact CG-CE2 4.41Å; R415-F419 WeakPolarHBondContact O-CD2 3.2Å; R415-F419 PolarHBondContact O-N 3.25Å; K416-F419 PolarHBondContact O-N 2.89Å; C417-F419 PolarHBondContact O-N 3.49Å; F419-Q450 HydrophobicContact CD1-CB 4.39Å; F419-Q450 VanDerWaalsContact CD1-OE1 3.23Å; F419-Q450 HydrophobicContact CE1-CB 4.5Å; F419-Q450 HydrophobicContact CE1-CG 4.3Å; F419-Q450 VanDerWaalsContact CE1-OE1 3.28Å
420	T	95.6	Very high	92.5	Very high	56 Å²	56	53 Å²	53	34%	0.344	26%	0.263	S	S	.	.	H	α-helix	trans	-115	-18	-172.5	66.5	0	0	0	0	115.8	W359 K416	W359-T420 HydrophobicContact CB-CG2 3.67Å; W359-T420 VanDerWaalsContact CD1-CG2 3.47Å; W359-T420 HydrophobicContact CD2-CG2 4.45Å; W359-T420 HydrophobicContact CG-CG2 3.59Å; K416-T420 HydrophobicContact CG-CG2 4.15Å; K416-T420 WeakPolarHBondContact O-CB 3.46Å; K416-T420 WeakPolarHBondContact O-CG2 3.24Å; K416-T420 PolarHBondContact O-N 3.04Å; K416-T420 PolarHBondContact O-OG1 3.07Å
421	L	95	Very high	91.9	Very high	25 Å²	25	58.4 Å²	58.4	13%	0.131	29%	0.286	C	S	.	.			trans	-78.3	140.6	178.4	-64.6	175.1	0	0	0	111.3	C417 E426 A427 F445 S449	C417-L421 HydrophobicContact CB-CD1 3.81Å; C417-L421 HydrophobicContact CB-CG 4.38Å; C417-L421 WeakPolarHBondContact O-CB 3.28Å; C417-L421 VanDerWaalsContact O-CG 3.22Å; C417-L421 WeakPolarHBondContact O-CG 3.37Å; C417-L421 PolarHBondContact O-N 2.83Å; L421-E426 HydrophobicContact CD2-CB 4.16Å; L421-A427 HydrophobicContact CD1-CB 3.68Å; L421-F445 HydrophobicContact CD1-CD1 4.04Å; L421-F445 HydrophobicContact CD1-CE1 4.44Å; L421-F445 HydrophobicContact CD1-CG 4.39Å; L421-S449 VanDerWaalsContact O-CB 3.25Å; L421-S449 WeakPolarHBondContact O-CB 3.19Å; L421-S449 PolarHBondContact O-OG 2.98Å
422	K	93.5	Very high	90.8	Very high	139 Å²	139	57.2 Å²	57.2	60%	0.604	28%	0.282	S	S	*	.	S	Bend	trans	-73.3	-37.8	171.5	-58.7	-175.1	174.3	-176	0	110.7	E426 S449	K422-E426 WeakPolarHBondContact CB-OE2 3.44Å; K422-E426 PolarHBondContact N-OE2 2.87Å; K422-S449 PolarHBondContact O-OG 2.93Å
423	Q	92.4	Very high	89.3	Confident	104 Å²	104	58.4 Å²	58.4	49%	0.486	29%	0.289	S	S	.	.	S	Bend	trans	-141	147.3	174.6	-64.7	-180	7.5	0	0	111.1	S425 E426 E452	Q423-S425 VanDerWaalsContact CB-OG 3.3Å; Q423-S425 WeakPolarHBondContact CB-OG 3.32Å; Q423-S425 PolarHBondContact O-N 2.91Å; Q423-S425 VanDerWaalsContact O-N 3.15Å; Q423-S425 PolarHBondContact OE1-OG 3.45Å; Q423-E426 HydrophobicContact CB-CG 4.39Å; Q423-E426 PolarHBondContact N-OE2 2.83Å; Q423-E426 WeakPolarHBondContact O-CB 3.42Å; Q423-E426 PolarHBondContact O-N 2.68Å; Q423-E426 VanDerWaalsContact O-N 3.07Å; Q423-E452 VanDerWaalsContact CA-CD 3.46Å; Q423-E452 WeakPolarHBondContact CA-OE1 3.2Å; Q423-E452 HydrophobicContact CB-CG 4.36Å; Q423-E452 WeakPolarHBondContact CB-OE1 3.39Å; Q423-E452 HydrophobicContact CG-CG 4.18Å
424	A	90.7	Very high	87.5	Confident	26 Å²	26	61.1 Å²	61.1	22%	0.215	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-59	-26	175.2	0	0	0	0	0	113.3	E426 A427 F445 G447 E452	A424-E426 PolarHBondContact O-N 3.49Å; A424-A427 WeakPolarHBondContact O-CB 3.31Å; A424-A427 PolarHBondContact O-N 2.84Å; A424-F445 HydrophobicContact CB-CD1 3.93Å; A424-F445 HydrophobicContact CB-CE1 3.74Å; A424-G447 WeakPolarHBondContact CB-O 3.35Å; A424-E452 WeakPolarHBondContact CB-OE2 3.39Å; A424-E452 VanDerWaalsContact N-CD 3.29Å; A424-E452 PolarHBondContact N-OE1 3.28Å; A424-E452 PolarHBondContact N-OE2 2.94Å
425	S	89.6	Confident	85.4	Confident	91 Å²	91	64.9 Å²	64.9	64%	0.636	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-60.7	-27.5	175.2	60.3	0	0	0	0	113.6	Q423 A427	Q423-S425 VanDerWaalsContact CB-OG 3.3Å; Q423-S425 WeakPolarHBondContact CB-OG 3.32Å; Q423-S425 PolarHBondContact O-N 2.91Å; Q423-S425 VanDerWaalsContact O-N 3.15Å; Q423-S425 PolarHBondContact OE1-OG 3.45Å; S425-A427 PolarHBondContact O-N 2.93Å
426	E	89.3	Confident	83.2	Confident	94 Å²	94	69 Å²	69	44%	0.439	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-74.5	-12	178.8	-59.6	177.8	147.6	0	0	112.7	L421 K422 Q423 A424 K428	L421-E426 HydrophobicContact CD2-CB 4.16Å; K422-E426 WeakPolarHBondContact CB-OE2 3.44Å; K422-E426 PolarHBondContact N-OE2 2.87Å; Q423-E426 HydrophobicContact CB-CG 4.39Å; Q423-E426 PolarHBondContact N-OE2 2.83Å; Q423-E426 WeakPolarHBondContact O-CB 3.42Å; Q423-E426 PolarHBondContact O-N 2.68Å; Q423-E426 VanDerWaalsContact O-N 3.07Å; A424-E426 PolarHBondContact O-N 3.49Å; E426-K428 PolarHBondContact O-N 2.8Å; E426-K428 VanDerWaalsContact O-N 3.14Å
427	A	87.6	Confident	80.8	Confident	19 Å²	19	72.8 Å²	72.8	16%	0.157	37%	0.365	C	S	.	.			trans	-68.7	108.4	-174.4	0	0	0	0	0	113.2	L421 A424 S425 F445	L421-A427 HydrophobicContact CD1-CB 3.68Å; A424-A427 WeakPolarHBondContact O-CB 3.31Å; A424-A427 PolarHBondContact O-N 2.84Å; S425-A427 PolarHBondContact O-N 2.93Å; A427-F445 HydrophobicContact CB-CB 3.61Å; A427-F445 HydrophobicContact CB-CD1 4.25Å; A427-F445 HydrophobicContact CB-CG 4.34Å
428	K	84.9	Confident	78.7	Confident	173 Å²	173	75.1 Å²	75.1	75%	0.752	38%	0.382	S	S	*	.			trans	-73.9	154.7	170.9	-61.2	-178.2	-177.2	179.6	0	110.7	E426 I430	E426-K428 PolarHBondContact O-N 2.8Å; E426-K428 VanDerWaalsContact O-N 3.14Å; K428-I430 WeakPolarHBondContact O-CG1 3.43Å; K428-I430 PolarHBondContact O-N 3.16Å
429	K	82.2	Confident	76.6	Confident	156 Å²	156	87 Å²	87	68%	0.678	43%	0.426	S	S	*	.			trans	-70.5	124.7	169.1	-69.6	-177.3	179.4	178.8	0	109.3	A442 Y443	K429-A442 HydrophobicContact CB-CB 4.39Å; K429-Y443 WeakPolarHBondContact CA-O 3.29Å
430	I	84.1	Confident	74.7	Confident	58 Å²	58	88 Å²	88	30%	0.297	44%	0.435	S	S	.	.	B	Isolated β-bridge	trans	-109	134.6	-173.8	-57.8	171.1	0	0	0	109.2	W409 V413 K428 A442 Y443	W409-I430 HydrophobicContact CH2-CG2 4.21Å; W409-I430 HydrophobicContact CZ2-CG2 3.81Å; V413-I430 HydrophobicContact CG1-CB 4.22Å; V413-I430 HydrophobicContact CG1-CD1 3.48Å; V413-I430 VanDerWaalsContact CG1-CD1 3.48Å; V413-I430 HydrophobicContact CG1-CG1 4.4Å; V413-I430 HydrophobicContact CG1-CG2 4.26Å; K428-I430 WeakPolarHBondContact O-CG1 3.43Å; K428-I430 PolarHBondContact O-N 3.16Å; I430-A442 CarbonylContact O-C 3.59Å; I430-A442 VanDerWaalsContact O-CA 3.27Å; I430-A442 WeakPolarHBondContact O-CA 3.28Å; I430-Y443 PolarHBondContact N-O 2.93Å; I430-Y443 PolarHBondContact O-N 3.42Å
431	K	81.3	Confident	73.3	Confident	137 Å²	137	90.8 Å²	90.8	60%	0.596	44%	0.444	S	S	*	.			trans	-107.5	141	177.9	-69.5	-176.4	179.2	-178.3	0	111.7	R364 A442	R364-K431 PolarHBondContact NH2-O 3.12Å; K431-A442 HydrophobicContact CG-CB 4Å
432	P	70.4	Confident	72.5	Confident	3 Å²	3	91.5 Å²	91.5	2%	0.019	45%	0.454	C	S	.	.	S	Bend	trans	-70.7	-36	-176.7	28.5	-37.6	0	0	0	114.2	G366 C367 F406 W409 H441	G366-P432 VanDerWaalsContact CA-O 3.28Å; G366-P432 WeakPolarHBondContact CA-O 3.37Å; C367-P432 HydrophobicContact CB-CB 4.15Å; C367-P432 PolarHBondContact N-O 3Å; F406-P432 HydrophobicContact CD2-CB 4.2Å; F406-P432 HydrophobicContact CD2-CG 4.39Å; F406-P432 HydrophobicContact CE2-CB 3.92Å; F406-P432 HydrophobicContact CE2-CG 3.75Å; W409-P432 HydrophobicContact CD2-CB 3.93Å; W409-P432 HydrophobicContact CE3-CB 3.94Å; W409-P432 HydrophobicContact CH2-CB 3.94Å; W409-P432 HydrophobicContact CH2-CG 4.41Å; W409-P432 HydrophobicContact CZ2-CB 3.89Å; W409-P432 HydrophobicContact CZ3-CB 3.96Å; W409-P432 HydrophobicContact CZ3-CG 4.42Å; P432-H441 WeakPolarHBondContact CD-O 3.46Å
433	T	65.4	Low	72.2	Confident	25 Å²	25	85.7 Å²	85.7	15%	0.153	43%	0.429	C	S	.	.			trans	-89.3	148.6	-167.9	56.1	0	0	0	0	113.5	R364 N435	R364-T433 PolarHBondContact NH2-O 3.47Å; T433-N435 VanDerWaalsContact C-N 3.35Å; T433-N435 WeakPolarHBondContact CB-O 3.45Å; T433-N435 PolarHBondContact OG1-O 3.21Å
434	T	57.2	Low	71.9	Confident	62 Å²	62	88 Å²	88	38%	0.38	43%	0.433	S	S	.	.	S	Bend	trans	-73.3	-31.1	155.1	43.2	0	0	0	0	111.4	Y375	Y375-T434 WeakPolarHBondContact OH-CG2 3.47Å
435	N	52	Low	72	Confident	95 Å²	95	87.2 Å²	87.2	51%	0.508	43%	0.425	S	S	.	.			trans	-80.7	124.6	-176.5	-63.3	-13.1	0	0	0	111.9	T433 F437	T433-N435 VanDerWaalsContact C-N 3.35Å; T433-N435 WeakPolarHBondContact CB-O 3.45Å; T433-N435 PolarHBondContact OG1-O 3.21Å; N435-F437 VanDerWaalsContact C-N 3.33Å; N435-F437 PolarHBondContact O-N 3.23Å
436	I	49.8	Very low	72	Confident	109 Å²	109	85.3 Å²	85.3	56%	0.559	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-17.2	-173.2	53.5	174.7	0	0	0	115.4	T741	I436-T741 HydrophobicContact CD1-CG2 3.27Å
437	F	46.6	Very low	72.1	Confident	126 Å²	126	82.6 Å²	82.6	55%	0.553	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	1.5	-173.3	-66.1	-60.6	0	0	0	115.4	N435 L738 T741 V745	N435-F437 VanDerWaalsContact C-N 3.33Å; N435-F437 PolarHBondContact O-N 3.23Å; F437-L738 HydrophobicContact CE1-CD1 4.43Å; F437-T741 WeakPolarHBondContact CZ-OG1 3.48Å; F437-V745 HydrophobicContact CE2-CG2 4.21Å
438	S	51.4	Low	72.4	Confident	60 Å²	60	84.3 Å²	84.3	42%	0.42	41%	0.411	S	S	.	.			trans	-81.6	128	172.8	-164.8	0	0	0	0	110.9	S440	S438-S440 WeakPolarHBondContact CB-OG 3.32Å; S438-S440 PolarHBondContact O-N 3Å; S438-S440 PolarHBondContact OG-OG 2.75Å
439	R	52.2	Low	73	Confident	250 Å²	250	76.1 Å²	76.1	94%	0.943	38%	0.375	S	S	*	.			trans	-72.5	41	170.2	-157.6	-177.8	-169.7	179	4.3	111.8
440	S	57.2	Low	73.6	Confident	39 Å²	39	69 Å²	69	27%	0.273	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-68.2	140.1	-177.6	-66.4	0	0	0	0	111.2	S438 A442	S438-S440 WeakPolarHBondContact CB-OG 3.32Å; S438-S440 PolarHBondContact O-N 3Å; S438-S440 PolarHBondContact OG-OG 2.75Å; S440-A442 PolarHBondContact O-N 2.96Å
441	H	66.8	Low	74.1	Confident	115 Å²	115	70.3 Å²	70.3	53%	0.532	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-58.6	132	171.2	-73.9	-84	0	0	0	109.9	F406 P432	F406-H441 HydrophobicContact CZ-CB 4.3Å; P432-H441 WeakPolarHBondContact CD-O 3.46Å
442	A	78.8	Confident	74.8	Confident	41 Å²	41	65.9 Å²	65.9	34%	0.339	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-85.5	130.5	168.6	0	0	0	0	0	108.5	K429 I430 K431 S440	K429-A442 HydrophobicContact CB-CB 4.39Å; I430-A442 CarbonylContact O-C 3.59Å; I430-A442 VanDerWaalsContact O-CA 3.27Å; I430-A442 WeakPolarHBondContact O-CA 3.28Å; K431-A442 HydrophobicContact CG-CB 4Å; S440-A442 PolarHBondContact O-N 2.96Å
443	Y	85.9	Confident	75.9	Confident	16 Å²	16	65.9 Å²	65.9	6%	0.063	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-71.3	143.3	171.3	174.5	-97.6	0	0	0	110.6	H410 V413 D414 K429 I430 F445	H410-Y443 AromaticContact CE1-CD2 3.82Å; H410-Y443 AromaticContact ND1-CD2 3.45Å; H410-Y443 WeakPolarHBondContact ND1-CD2 3.36Å; V413-Y443 HydrophobicContact CB-CD1 4.34Å; V413-Y443 HydrophobicContact CG1-CD1 3.4Å; V413-Y443 HydrophobicContact CG1-CE1 3.84Å; V413-Y443 HydrophobicContact CG1-CG 4.11Å; D414-Y443 VanDerWaalsContact CA-OH 3.24Å; D414-Y443 WeakPolarHBondContact CA-OH 3.37Å; D414-Y443 HydrophobicContact CB-CE1 4.42Å; D414-Y443 HydrophobicContact CB-CE2 3.83Å; D414-Y443 VanDerWaalsContact CB-OH 3.24Å; D414-Y443 WeakPolarHBondContact CB-OH 3.44Å; D414-Y443 VanDerWaalsContact CG-OH 3.24Å; D414-Y443 PolarHBondContact OD1-OH 3.01Å; K429-Y443 WeakPolarHBondContact CA-O 3.29Å; I430-Y443 PolarHBondContact N-O 2.93Å; I430-Y443 PolarHBondContact O-N 3.42Å; Y443-F445 HydrophobicContact CE1-CB 4.09Å; Y443-F445 WeakPolarHBondContact OH-CA 3.41Å; Y443-F445 WeakPolarHBondContact OH-CD2 3.22Å
444	R	87.6	Confident	77.2	Confident	153 Å²	153	70.3 Å²	70.3	58%	0.577	35%	0.345	S	S	*	.			trans	-132.4	126.5	172.4	171.5	175.8	171.4	84.7	-5	107.9
445	F	92	Very high	78.9	Confident	10 Å²	10	71.5 Å²	71.5	4%	0.044	36%	0.36	C	S	.	.			trans	-66.4	145.3	173	-175	-109.7	0	0	0	111.3	C417 F418 L421 A424 A427 Y443	C417-F445 HydrophobicContact CB-CB 4.02Å; C417-F445 HydrophobicContact CB-CD1 4.5Å; C417-F445 HydrophobicContact CB-CD2 3.34Å; C417-F445 HydrophobicContact CB-CE2 3.9Å; C417-F445 HydrophobicContact CB-CG 3.7Å; F418-F445 HydrophobicContact CB-CE2 3.94Å; F418-F445 HydrophobicContact CB-CZ 4.21Å; F418-F445 HydrophobicContact CD2-CZ 4.22Å; L421-F445 HydrophobicContact CD1-CD1 4.04Å; L421-F445 HydrophobicContact CD1-CE1 4.44Å; L421-F445 HydrophobicContact CD1-CG 4.39Å; A424-F445 HydrophobicContact CB-CD1 3.93Å; A424-F445 HydrophobicContact CB-CE1 3.74Å; A427-F445 HydrophobicContact CB-CB 3.61Å; A427-F445 HydrophobicContact CB-CD1 4.25Å; A427-F445 HydrophobicContact CB-CG 4.34Å; Y443-F445 HydrophobicContact CE1-CB 4.09Å; Y443-F445 WeakPolarHBondContact OH-CA 3.41Å; Y443-F445 WeakPolarHBondContact OH-CD2 3.22Å
446	S	89.8	Confident	80.7	Confident	51 Å²	51	69.5 Å²	69.5	36%	0.357	35%	0.353	S	S	.	.			trans	-145.7	137.3	-179.1	63.3	0	0	0	0	110.3
447	G	91.3	Very high	82.6	Confident	37 Å²	37	66 Å²	66	38%	0.381	34%	0.337	S	S	.	.	S	Bend	trans	105.1	-171.7	-170.5	0	0	0	0	0	111.4	D82 A424	D82-G447 WeakPolarHBondContact OD1-CA 3.44Å; A424-G447 WeakPolarHBondContact CB-O 3.35Å
448	R	94.7	Very high	84.5	Confident	55 Å²	55	62.3 Å²	62.3	21%	0.208	34%	0.335	C	S	.	.			trans	-89.8	149.9	171.9	-71.2	171.9	-68.5	-175.3	-1.7	110.8	V79 D82 F418 E452 L453	V79-R448 PolarHBondContact O-NH2 3.38Å; D82-R448 PolarHBondContact OD1-N 2.92Å; D82-R448 IonicContact OD2-CZ 2.68Å; D82-R448 IonicContact OD2-NE 3.07Å; D82-R448 PolarHBondContact OD2-NE 3.49Å; D82-R448 IonicContact OD2-NH2 2.75Å; D82-R448 PolarHBondContact OD2-NH2 3Å; F418-R448 WeakPolarHBondContact CD2-O 3.31Å; F418-R448 WeakPolarHBondContact CE2-O 3.35Å; R448-E452 WeakPolarHBondContact CA-OE2 3.25Å; R448-E452 HydrophobicContact CB-CB 4.02Å; R448-E452 HydrophobicContact CG-CB 4.32Å; R448-L453 HydrophobicContact CB-CD2 4.3Å; R448-L453 HydrophobicContact CB-CG 4.18Å; R448-L453 VanDerWaalsContact CZ-CD2 3.4Å
449	S	96	Very high	86.4	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.343	C	S	.	.			trans	-74.4	164.5	166	87.1	0	0	0	0	111.2	L421 K422 Q451 E452 L453	L421-S449 VanDerWaalsContact O-CB 3.25Å; L421-S449 WeakPolarHBondContact O-CB 3.19Å; L421-S449 PolarHBondContact O-OG 2.98Å; K422-S449 PolarHBondContact O-OG 2.93Å; S449-Q451 PolarHBondContact O-N 3.09Å; S449-Q451 PolarHBondContact OG-N 3.07Å; S449-E452 PolarHBondContact N-OE2 3.46Å; S449-E452 PolarHBondContact O-N 3.4Å; S449-E452 PolarHBondContact OG-N 3.17Å; S449-L453 PolarHBondContact O-N 3.04Å; S449-L453 VanDerWaalsContact O-N 3.08Å
450	Q	95.8	Very high	88.1	Confident	8 Å²	8	52 Å²	52	4%	0.037	30%	0.3	C	S	.	.	H	α-helix	trans	-60.4	-30.5	174.2	-156.5	-162.3	11.1	0	0	112.2	Y83 D130 F418 F419 L453 R454	Y83-Q450 HydrophobicContact CE1-CG 4.44Å; D130-Q450 VanDerWaalsContact CG-NE2 3.35Å; D130-Q450 PolarHBondContact OD2-NE2 3.17Å; D130-Q450 VanDerWaalsContact OD2-NE2 3.09Å; F418-Q450 HydrophobicContact CD1-CB 4.13Å; F418-Q450 HydrophobicContact CE1-CB 3.71Å; F418-Q450 HydrophobicContact CE1-CG 3.96Å; F418-Q450 HydrophobicContact CZ-CB 4.12Å; F418-Q450 HydrophobicContact CZ-CG 4.34Å; F418-Q450 PolarHBondContact O-N 3.41Å; F419-Q450 HydrophobicContact CD1-CB 4.39Å; F419-Q450 VanDerWaalsContact CD1-OE1 3.23Å; F419-Q450 HydrophobicContact CE1-CB 4.5Å; F419-Q450 HydrophobicContact CE1-CG 4.3Å; F419-Q450 VanDerWaalsContact CE1-OE1 3.28Å; Q450-L453 PolarHBondContact O-N 2.89Å; Q450-R454 WeakPolarHBondContact O-CB 3.27Å; Q450-R454 WeakPolarHBondContact O-CG 3.39Å; Q450-R454 PolarHBondContact O-N 3.4Å
451	Q	94.6	Very high	89.5	Confident	84 Å²	84	52.2 Å²	52.2	39%	0.393	30%	0.304	S	S	.	.	H	α-helix	trans	-71.5	-36.6	178.9	-60.9	-171.2	22.5	0	0	111.7	S449 A455	S449-Q451 PolarHBondContact O-N 3.09Å; S449-Q451 PolarHBondContact OG-N 3.07Å; Q451-A455 VanDerWaalsContact O-CB 3.32Å; Q451-A455 WeakPolarHBondContact O-CB 3.22Å; Q451-A455 PolarHBondContact O-N 2.68Å
452	E	95.2	Very high	90.5	Very high	45 Å²	45	53.4 Å²	53.4	21%	0.21	32%	0.315	C	S	.	.	H	α-helix	trans	-65.9	-40.7	171.7	-71.1	170.9	133.2	0	0	111.7	Q423 A424 R448 S449 A455 C456	Q423-E452 VanDerWaalsContact CA-CD 3.46Å; Q423-E452 WeakPolarHBondContact CA-OE1 3.2Å; Q423-E452 HydrophobicContact CB-CG 4.36Å; Q423-E452 WeakPolarHBondContact CB-OE1 3.39Å; Q423-E452 HydrophobicContact CG-CG 4.18Å; A424-E452 WeakPolarHBondContact CB-OE2 3.39Å; A424-E452 VanDerWaalsContact N-CD 3.29Å; A424-E452 PolarHBondContact N-OE1 3.28Å; A424-E452 PolarHBondContact N-OE2 2.94Å; R448-E452 WeakPolarHBondContact CA-OE2 3.25Å; R448-E452 HydrophobicContact CB-CB 4.02Å; R448-E452 HydrophobicContact CG-CB 4.32Å; S449-E452 PolarHBondContact N-OE2 3.46Å; S449-E452 PolarHBondContact O-N 3.4Å; S449-E452 PolarHBondContact OG-N 3.17Å; E452-A455 PolarHBondContact O-N 2.75Å; E452-C456 PolarHBondContact O-N 2.62Å; E452-C456 VanDerWaalsContact O-N 3.17Å
453	L	94.3	Very high	90.9	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.01	32%	0.318	C	S	.	.	H	α-helix	trans	-62.1	-48.9	174.6	-67.9	168.4	0	0	0	111.4	D82 Y83 F418 R448 S449 Q450 A455 C456 T457	D82-L453 HydrophobicContact CB-CD1 4.09Å; Y83-L453 HydrophobicContact CD2-CD1 4.13Å; Y83-L453 HydrophobicContact CE2-CD1 3.68Å; F418-L453 HydrophobicContact CE2-CD1 3.81Å; F418-L453 HydrophobicContact CZ-CD1 3.67Å; R448-L453 HydrophobicContact CB-CD2 4.3Å; R448-L453 HydrophobicContact CB-CG 4.18Å; R448-L453 VanDerWaalsContact CZ-CD2 3.4Å; S449-L453 PolarHBondContact O-N 3.04Å; S449-L453 VanDerWaalsContact O-N 3.08Å; Q450-L453 PolarHBondContact O-N 2.89Å; L453-A455 VanDerWaalsContact C-N 3.35Å; L453-A455 PolarHBondContact O-N 3.05Å; L453-C456 CarbonylContact O-C 3.46Å; L453-C456 PolarHBondContact O-N 2.91Å; L453-C456 VanDerWaalsContact O-N 3.09Å; L453-T457 PolarHBondContact O-N 3.2Å; L453-T457 PolarHBondContact O-OG1 2.95Å; L453-T457 VanDerWaalsContact O-OG1 3.1Å
454	R	92.5	Very high	90.7	Very high	119 Å²	119	60.3 Å²	60.3	45%	0.449	35%	0.353	S	S	.	.	H	α-helix	trans	-59.9	-40.9	176.6	-77.4	177.4	171.8	172.7	-2.2	112.6	D130 Q450 C456 T457	D130-R454 VanDerWaalsContact CG-NH2 3.28Å; D130-R454 IonicContact OD1-CZ 3.12Å; D130-R454 IonicContact OD1-NE 2.9Å; D130-R454 PolarHBondContact OD1-NE 3.32Å; D130-R454 IonicContact OD1-NH2 2.71Å; D130-R454 PolarHBondContact OD1-NH2 2.89Å; D130-R454 IonicContact OD2-NH2 3.88Å; D130-R454 PolarHBondContact OD2-NH2 3.42Å; D130-R454 VanDerWaalsContact OD2-NH2 3.07Å; Q450-R454 WeakPolarHBondContact O-CB 3.27Å; Q450-R454 WeakPolarHBondContact O-CG 3.39Å; Q450-R454 PolarHBondContact O-N 3.4Å; R454-C456 PolarHBondContact O-N 2.79Å; R454-T457 WeakPolarHBondContact CA-OG1 3.32Å; R454-T457 WeakPolarHBondContact O-CB 3.42Å; R454-T457 PolarHBondContact O-N 3.32Å; R454-T457 PolarHBondContact O-OG1 2.95Å
455	A	92.5	Very high	90.2	Very high	86 Å²	86	56.6 Å²	56.6	71%	0.711	34%	0.343	S	S	*	.	H	α-helix	trans	-63.3	-29.6	175.8	0	0	0	0	0	112.9	Q451 E452 L453	Q451-A455 VanDerWaalsContact O-CB 3.32Å; Q451-A455 WeakPolarHBondContact O-CB 3.22Å; Q451-A455 PolarHBondContact O-N 2.68Å; E452-A455 PolarHBondContact O-N 2.75Å; L453-A455 VanDerWaalsContact C-N 3.35Å; L453-A455 PolarHBondContact O-N 3.05Å
456	C	90.3	Very high	89.3	Confident	54 Å²	54	60.4 Å²	60.4	37%	0.365	36%	0.36	S	S	.	.	H	α-helix	trans	-97.4	-0.9	177.2	-66.2	0	0	0	0	114.4	E452 L453 R454 G458 S459 I460	E452-C456 PolarHBondContact O-N 2.62Å; E452-C456 VanDerWaalsContact O-N 3.17Å; L453-C456 CarbonylContact O-C 3.46Å; L453-C456 PolarHBondContact O-N 2.91Å; L453-C456 VanDerWaalsContact O-N 3.09Å; R454-C456 PolarHBondContact O-N 2.79Å; C456-G458 VanDerWaalsContact C-N 3.31Å; C456-G458 PolarHBondContact O-N 3.08Å; C456-S459 WeakPolarHBondContact O-CA 3.4Å; C456-S459 WeakPolarHBondContact O-CB 3.24Å; C456-S459 PolarHBondContact O-N 3.45Å; C456-I460 HydrophobicContact CB-CD1 3.91Å; C456-I460 HydrophobicContact CB-CG1 4.21Å; C456-I460 WeakPolarHBondContact O-CG1 3.34Å; C456-I460 PolarHBondContact O-N 3.17Å
457	T	89.6	Confident	88.6	Confident	36 Å²	36	63.8 Å²	63.8	22%	0.221	38%	0.384	C	S	.	.	H	α-helix	trans	-52.4	-44	-173.5	-69	0	0	0	0	113	A132 L453 R454 S459 I460 A461	A132-T457 HydrophobicContact CB-CG2 4.21Å; L453-T457 PolarHBondContact O-N 3.2Å; L453-T457 PolarHBondContact O-OG1 2.95Å; L453-T457 VanDerWaalsContact O-OG1 3.1Å; R454-T457 WeakPolarHBondContact CA-OG1 3.32Å; R454-T457 WeakPolarHBondContact O-CB 3.42Å; R454-T457 PolarHBondContact O-N 3.32Å; R454-T457 PolarHBondContact O-OG1 2.95Å; T457-S459 PolarHBondContact O-N 3.1Å; T457-I460 PolarHBondContact O-N 3.26Å; T457-A461 WeakPolarHBondContact O-CB 3.25Å; T457-A461 PolarHBondContact O-N 3.2Å
458	G	86.7	Confident	88.1	Confident	48 Å²	48	64.2 Å²	64.2	50%	0.495	38%	0.375	S	S	.	.	H	α-helix	trans	-63.2	-39.2	176.8	0	0	0	0	0	113.4	C456 N462	C456-G458 VanDerWaalsContact C-N 3.31Å; C456-G458 PolarHBondContact O-N 3.08Å; G458-N462 PolarHBondContact O-N 3.33Å; G458-N462 PolarHBondContact O-ND2 2.88Å
459	S	89.9	Confident	87.2	Confident	86 Å²	86	63.6 Å²	63.6	60%	0.601	38%	0.38	S	S	*	.	H	α-helix	trans	-68.9	-39.6	174.4	-54.2	0	0	0	0	112	C456 T457 N462 L463	C456-S459 WeakPolarHBondContact O-CA 3.4Å; C456-S459 WeakPolarHBondContact O-CB 3.24Å; C456-S459 PolarHBondContact O-N 3.45Å; T457-S459 PolarHBondContact O-N 3.1Å; S459-N462 PolarHBondContact O-N 3.09Å; S459-L463 PolarHBondContact O-N 2.8Å
460	I	88.3	Confident	86.6	Confident	6 Å²	6	68 Å²	68	3%	0.031	40%	0.396	C	S	.	.	H	α-helix	trans	-67.9	-39	179.2	-63.8	166.8	0	0	0	110.9	V79 E80 A132 Q133 C456 T457 N462 L463	V79-I460 HydrophobicContact CB-CG2 4.25Å; V79-I460 HydrophobicContact CG1-CG1 4.08Å; V79-I460 HydrophobicContact CG1-CG2 3.92Å; E80-I460 HydrophobicContact CG-CG2 3.86Å; A132-I460 HydrophobicContact CB-CB 4.08Å; A132-I460 HydrophobicContact CB-CG2 3.74Å; Q133-I460 HydrophobicContact CG-CG2 3.8Å; C456-I460 HydrophobicContact CB-CD1 3.91Å; C456-I460 HydrophobicContact CB-CG1 4.21Å; C456-I460 WeakPolarHBondContact O-CG1 3.34Å; C456-I460 PolarHBondContact O-N 3.17Å; T457-I460 PolarHBondContact O-N 3.26Å; I460-N462 VanDerWaalsContact C-N 3.27Å; I460-N462 PolarHBondContact O-N 3.44Å; I460-L463 WeakPolarHBondContact O-CB 3.39Å; I460-L463 PolarHBondContact O-N 2.81Å
461	A	87.3	Confident	85.2	Confident	44 Å²	44	69 Å²	69	36%	0.364	40%	0.402	S	S	.	.	H	α-helix	trans	-61.5	-35.7	176.5	0	0	0	0	0	112.4	A132 T457 L463	A132-A461 HydrophobicContact CB-CB 4.13Å; T457-A461 WeakPolarHBondContact O-CB 3.25Å; T457-A461 PolarHBondContact O-N 3.2Å; A461-L463 VanDerWaalsContact C-N 3.34Å
462	N	88.3	Confident	83.8	Confident	141 Å²	141	66.6 Å²	66.6	75%	0.754	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-5.5	179.1	-69.1	-24	0	0	0	114.4	G458 S459 I460	G458-N462 PolarHBondContact O-N 3.33Å; G458-N462 PolarHBondContact O-ND2 2.88Å; S459-N462 PolarHBondContact O-N 3.09Å; I460-N462 VanDerWaalsContact C-N 3.27Å; I460-N462 PolarHBondContact O-N 3.44Å
463	L	87.2	Confident	82.1	Confident	78 Å²	78	65.4 Å²	65.4	41%	0.408	39%	0.392	S	S	.	.	S	Bend	trans	-71.5	142.6	175.3	-71.1	172	0	0	0	110.7	V79 S459 I460 A461 Q465	V79-L463 HydrophobicContact CB-CD1 4.45Å; V79-L463 HydrophobicContact CG1-CD1 3.91Å; V79-L463 HydrophobicContact CG2-CD1 3.83Å; S459-L463 PolarHBondContact O-N 2.8Å; I460-L463 WeakPolarHBondContact O-CB 3.39Å; I460-L463 PolarHBondContact O-N 2.81Å; A461-L463 VanDerWaalsContact C-N 3.34Å; L463-Q465 PolarHBondContact O-N 2.78Å; L463-Q465 VanDerWaalsContact O-N 3.1Å
464	P	80.6	Confident	80.4	Confident	123 Å²	123	66.5 Å²	66.5	80%	0.799	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-54.3	118.3	173.1	-25.2	34.2	0	0	0	111.1
465	Q	77.5	Confident	78.5	Confident	76 Å²	76	66.4 Å²	66.4	36%	0.355	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-88.9	120.2	176.6	-59.9	-173.5	24.9	0	0	108.3	S134 L463 S467	S134-Q465 PolarHBondContact OG-OE1 3.37Å; L463-Q465 PolarHBondContact O-N 2.78Å; L463-Q465 VanDerWaalsContact O-N 3.1Å; Q465-S467 PolarHBondContact O-N 2.9Å
466	Q	72	Confident	76.2	Confident	90 Å²	90	71.2 Å²	71.2	42%	0.421	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-63.7	135.2	171	-67.6	-179.8	13.2	0	0	108.9	D77 F468	D77-Q466 PolarHBondContact OD2-NE2 3.47Å; Q466-F468 PolarHBondContact O-N 2.9Å
467	S	75.4	Confident	74.2	Confident	121 Å²	121	70.5 Å²	70.5	85%	0.846	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-66.7	125.4	172	47.5	0	0	0	0	109.3	Q465	Q465-S467 PolarHBondContact O-N 2.9Å
468	F	82.4	Confident	72	Confident	47 Å²	47	75.3 Å²	75.3	21%	0.206	41%	0.413	C	S	.	.			trans	-113.4	144.4	174.2	63.4	-85.8	0	0	0	109.3	I135 Y138 Q466 R470	I135-F468 VanDerWaalsContact CA-CE1 3.46Å; I135-F468 HydrophobicContact CB-CD1 3.79Å; I135-F468 HydrophobicContact CB-CE1 3.71Å; I135-F468 HydrophobicContact CB-CG 4.5Å; I135-F468 HydrophobicContact CB-CZ 4.36Å; I135-F468 HydrophobicContact CD1-CB 4.17Å; I135-F468 HydrophobicContact CD1-CD1 3.89Å; I135-F468 HydrophobicContact CD1-CD2 3.9Å; I135-F468 HydrophobicContact CD1-CE1 4.25Å; I135-F468 HydrophobicContact CD1-CE2 4.26Å; I135-F468 HydrophobicContact CD1-CG 3.71Å; I135-F468 HydrophobicContact CD1-CZ 4.42Å; I135-F468 HydrophobicContact CG1-CD1 4.33Å; Y138-F468 AromaticContact CD1-CD2 3.82Å; Y138-F468 HydrophobicContact CD1-CD2 3.82Å; Y138-F468 AromaticContact CD1-CE2 3.38Å; Y138-F468 HydrophobicContact CD1-CE2 3.38Å; Y138-F468 HydrophobicContact CD1-CZ 4.33Å; Y138-F468 HydrophobicContact CD2-CE2 4.3Å; Y138-F468 HydrophobicContact CE1-CD2 4.24Å; Y138-F468 HydrophobicContact CE1-CE2 4.1Å; Y138-F468 HydrophobicContact CG-CD2 4.38Å; Y138-F468 AromaticContact CG-CE2 3.5Å; Y138-F468 HydrophobicContact CG-CE2 3.5Å; Y138-F468 HydrophobicContact CG-CZ 4.16Å; Q466-F468 PolarHBondContact O-N 2.9Å; F468-R470 HydrophobicContact CE2-CG 4.2Å
469	S	75.2	Confident	70	Confident	42 Å²	42	75.9 Å²	75.9	29%	0.294	42%	0.419	S	S	.	.			trans	-75.6	127.9	171.3	52.8	0	0	0	0	109.8	V471 T494	S469-V471 PolarHBondContact O-N 2.88Å; S469-T494 WeakPolarHBondContact OG-CB 3.41Å; S469-T494 PolarHBondContact OG-O 3.42Å; S469-T494 PolarHBondContact OG-OG1 2.77Å
470	R	82.7	Confident	67.8	Low	92 Å²	92	73.3 Å²	73.3	35%	0.347	40%	0.398	S	S	.	.			trans	-66.9	128	159.4	-70	171.2	165.1	74	5.8	108.2	Y138 E267 F468 R475	Y138-R470 HydrophobicContact CD2-CG 4.08Å; Y138-R470 HydrophobicContact CE2-CB 4.19Å; Y138-R470 HydrophobicContact CE2-CG 3.8Å; E267-R470 VanDerWaalsContact CD-NE 3.29Å; E267-R470 WeakPolarHBondContact OE1-CD 3.11Å; E267-R470 IonicContact OE1-CZ 3.68Å; E267-R470 IonicContact OE1-NE 2.71Å; E267-R470 PolarHBondContact OE1-NE 3.24Å; E267-R470 IonicContact OE1-NH2 3.13Å; E267-R470 IonicContact OE2-CZ 3.71Å; E267-R470 IonicContact OE2-NE 3.34Å; E267-R470 PolarHBondContact OE2-NE 2.98Å; E267-R470 VanDerWaalsContact OE2-NE 3.08Å; E267-R470 IonicContact OE2-NH2 2.75Å; E267-R470 PolarHBondContact OE2-NH2 3.36Å; F468-R470 HydrophobicContact CE2-CG 4.2Å; R470-R475 PolarHBondContact O-NH2 2.59Å
471	V	66.5	Low	65.7	Low	28 Å²	28	78.4 Å²	78.4	17%	0.17	42%	0.418	C	S	.	.			trans	-102.9	103.9	178.1	-173.5	0	0	0	0	106.6	D48 Y138 S469 S473	D48-V471 VanDerWaalsContact OD2-CG1 3.25Å; D48-V471 WeakPolarHBondContact OD2-CG1 3.49Å; Y138-V471 PolarHBondContact OH-N 3.36Å; Y138-V471 PolarHBondContact OH-O 3.13Å; S469-V471 PolarHBondContact O-N 2.88Å; V471-S473 PolarHBondContact O-N 2.96Å
472	S	64.6	Low	63.4	Low	34 Å²	34	81.7 Å²	81.7	24%	0.238	44%	0.435	C	S	.	.			trans	-66.6	129.9	165.7	176.8	0	0	0	0	108.5	E171 F474 R475	E171-S472 WeakPolarHBondContact O-CB 3.3Å; E171-S472 PolarHBondContact O-OG 2.9Å; E171-S472 WeakPolarHBondContact OE2-CA 3.35Å; E171-S472 PolarHBondContact OE2-OG 3.03Å; S472-F474 PolarHBondContact O-N 3.09Å; S472-F474 VanDerWaalsContact O-N 3.17Å; S472-F474 PolarHBondContact OG-N 2.89Å; S472-R475 WeakPolarHBondContact O-CG 3.46Å; S472-R475 PolarHBondContact O-N 2.79Å
473	S	61.2	Low	61.2	Low	20 Å²	20	80.8 Å²	80.8	14%	0.14	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-62.1	-15.5	175.4	58.5	0	0	0	0	113.2	R145 E171 L237 V471 R475	R145-S473 VanDerWaalsContact NH1-CB 3.32Å; R145-S473 PolarHBondContact NH1-OG 3.01Å; E171-S473 VanDerWaalsContact CD-OG 3.32Å; E171-S473 WeakPolarHBondContact OE2-CB 3.45Å; E171-S473 PolarHBondContact OE2-N 3.03Å; E171-S473 PolarHBondContact OE2-OG 3.37Å; L237-S473 WeakPolarHBondContact CD1-OG 3.24Å; V471-S473 PolarHBondContact O-N 2.96Å; S473-R475 PolarHBondContact O-N 3.44Å; S473-R475 VanDerWaalsContact O-N 3.14Å
474	F	57.7	Low	58.9	Low	25 Å²	25	79.7 Å²	79.7	11%	0.11	43%	0.429	C	S	.	.	G	3₁₀ helix	trans	-65.4	-5.9	173.2	-83.7	-79.1	0	0	0	115.2	E171 I172 M233 L237 S472 R476 V477	E171-F474 HydrophobicContact CB-CD2 4.29Å; E171-F474 HydrophobicContact CB-CE2 4.31Å; I172-F474 HydrophobicContact CD1-CE2 3.69Å; I172-F474 HydrophobicContact CD1-CZ 3.78Å; I172-F474 HydrophobicContact CG1-CD2 4.02Å; I172-F474 HydrophobicContact CG1-CE2 3.25Å; I172-F474 HydrophobicContact CG1-CZ 3.83Å; M233-F474 HydrophobicContact CB-CE1 3.54Å; M233-F474 HydrophobicContact CB-CZ 3.61Å; M233-F474 HydrophobicContact CG-CD1 4.36Å; M233-F474 HydrophobicContact CG-CE1 3.68Å; M233-F474 HydrophobicContact CG-CZ 4.17Å; M233-F474 WeakPolarHBondContact O-CE1 3.45Å; M233-F474 VanDerWaalsContact O-CZ 3.22Å; M233-F474 WeakPolarHBondContact O-CZ 3.38Å; M233-F474 HydrophobicContact SD-CD1 4.32Å; M233-F474 HydrophobicContact SD-CE1 4.04Å; M233-F474 HydrophobicContact SD-CZ 4.38Å; L237-F474 HydrophobicContact CB-CE1 4.34Å; L237-F474 HydrophobicContact CB-CE2 3.95Å; L237-F474 HydrophobicContact CB-CZ 3.6Å; L237-F474 HydrophobicContact CD1-CD2 4.03Å; L237-F474 HydrophobicContact CD1-CE2 3.67Å; L237-F474 HydrophobicContact CD1-CZ 4.17Å; L237-F474 HydrophobicContact CD2-CE2 3.72Å; L237-F474 HydrophobicContact CD2-CZ 4.14Å; L237-F474 HydrophobicContact CG-CE2 3.97Å; L237-F474 HydrophobicContact CG-CZ 4.17Å; S472-F474 PolarHBondContact O-N 3.09Å; S472-F474 VanDerWaalsContact O-N 3.17Å; S472-F474 PolarHBondContact OG-N 2.89Å; F474-R476 PolarHBondContact O-N 2.95Å; F474-V477 HydrophobicContact CD1-CB 3.91Å; F474-V477 HydrophobicContact CD1-CG1 4.47Å; F474-V477 HydrophobicContact CD1-CG2 3.83Å; F474-V477 HydrophobicContact CE1-CG2 4.42Å; F474-V477 PolarHBondContact O-N 2.73Å
475	R	52.3	Low	56.6	Low	118 Å²	118	81.7 Å²	81.7	45%	0.445	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-58.1	-11.4	-178.1	-75.6	178.7	-165.2	-121.1	10.1	115.7	R470 S472 S473	R470-R475 PolarHBondContact O-NH2 2.59Å; S472-R475 WeakPolarHBondContact O-CG 3.46Å; S472-R475 PolarHBondContact O-N 2.79Å; S473-R475 PolarHBondContact O-N 3.44Å; S473-R475 VanDerWaalsContact O-N 3.14Å
476	R	45.4	Very low	54.7	Low	187 Å²	187	82.7 Å²	82.7	71%	0.706	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-96.8	-10.8	168.9	-64	-164.9	-151.6	162.9	3.8	115.1	F474 I478	F474-R476 PolarHBondContact O-N 2.95Å; R476-I478 PolarHBondContact O-N 2.91Å
477	V	48.2	Very low	52.7	Low	39 Å²	39	83.1 Å²	83.1	24%	0.236	48%	0.477	C	S	.	.			trans	-93.8	53.5	178.8	-165	0	0	0	0	109.8	K236 F474 L480	K236-V477 HydrophobicContact CB-CG1 4.47Å; K236-V477 HydrophobicContact CB-CG2 4.29Å; K236-V477 HydrophobicContact CD-CG1 3.52Å; F474-V477 HydrophobicContact CD1-CB 3.91Å; F474-V477 HydrophobicContact CD1-CG1 4.47Å; F474-V477 HydrophobicContact CD1-CG2 3.83Å; F474-V477 HydrophobicContact CE1-CG2 4.42Å; F474-V477 PolarHBondContact O-N 2.73Å; V477-L480 HydrophobicContact CG1-CD1 3.74Å; V477-L480 HydrophobicContact CG1-CG 4.2Å
478	I	41.8	Very low	50.6	Low	137 Å²	137	79.3 Å²	79.3	70%	0.703	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	129.5	172.4	-61.3	172.6	0	0	0	107	R476	R476-I478 PolarHBondContact O-N 2.91Å
479	G	45.3	Very low	48.1	Very low	60 Å²	60	80.9 Å²	80.9	62%	0.619	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	119.2	13.2	-176	0	0	0	0	0	116.5
480	L	44.1	Very low	46	Very low	32 Å²	32	88 Å²	88	17%	0.168	50%	0.504	C	S	.	.			trans	-112	-2.1	172.1	-73.6	-177.8	0	0	0	114.7	E232 M233 K236 V477	E232-L480 HydrophobicContact CB-CD1 4.22Å; M233-L480 HydrophobicContact CG-CD1 3.52Å; K236-L480 HydrophobicContact CD-CD1 4.04Å; V477-L480 HydrophobicContact CG1-CD1 3.74Å; V477-L480 HydrophobicContact CG1-CG 4.2Å
481	Y	44.6	Very low	43.7	Very low	113 Å²	113	89.5 Å²	89.5	44%	0.443	53%	0.529	S	S	.	.	S	Bend	trans	-94.7	120.4	167.5	-74.9	-87.6	0	0	0	108.5	L225 N483 S484	L225-Y481 HydrophobicContact CD1-CD1 4.14Å; L225-Y481 HydrophobicContact CD1-CE1 3.63Å; L225-Y481 HydrophobicContact CD1-CE2 4.3Å; Y481-N483 PolarHBondContact O-N 3.46Å; Y481-S484 PolarHBondContact O-N 3.19Å
482	P	37.8	Very low	42.1	Very low	112 Å²	112	97.1 Å²	97.1	73%	0.727	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-6.2	-171.5	-27.4	36	0	0	0	117.4
483	N	41.9	Very low	40.6	Very low	122 Å²	122	99.9 Å²	99.9	65%	0.652	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.5	12.8	-173.4	-69.4	-41.4	0	0	0	114.4	Y481 D485	Y481-N483 PolarHBondContact O-N 3.46Å; N483-D485 PolarHBondContact O-N 3.41Å
484	S	39.6	Very low	39.4	Very low	55 Å²	55	102.3 Å²	102.3	39%	0.385	59%	0.588	S	S	.	*			trans	-81.5	15.5	-176.1	66.7	0	0	0	0	115.4	Y481 S486	Y481-S484 PolarHBondContact O-N 3.19Å; S484-S486 PolarHBondContact O-N 3.02Å
485	D	33.1	Very low	38.2	Very low	165 Å²	165	104 Å²	104	88%	0.882	60%	0.598	S	S	*	*			trans	-79.2	64.8	178.3	-75.4	-19.7	0	0	0	112.1	N483	N483-D485 PolarHBondContact O-N 3.41Å
486	S	36.9	Very low	37.3	Very low	98 Å²	98	102.4 Å²	102.4	69%	0.685	60%	0.603	S	S	*	*	S	Bend	trans	-138.6	113.4	162.1	41.3	0	0	0	0	109	S484 G488	S484-S486 PolarHBondContact O-N 3.02Å; S486-G488 PolarHBondContact O-N 3.3Å
487	G	30.8	Very low	36.7	Very low	99 Å²	99	96.9 Å²	96.9	100%	1.021	61%	0.605	S	S	*	*			trans	-69.3	62.1	-167.7	0	0	0	0	0	115.6
488	G	30	Very low	36	Very low	40 Å²	40	106.1 Å²	106.1	41%	0.412	64%	0.635	S	S	.	*			trans	-113.9	82.7	-170.6	0	0	0	0	0	115.2	S486 F490	S486-G488 PolarHBondContact O-N 3.3Å; G488-F490 VanDerWaalsContact C-N 3.34Å; G488-F490 WeakPolarHBondContact O-CD2 3.49Å; G488-F490 PolarHBondContact O-N 2.91Å
489	A	29.5	Very low	35.6	Very low	81 Å²	81	106 Å²	106	67%	0.669	64%	0.635	S	S	*	*			trans	52.8	17.2	142.7	0	0	0	0	0	121.8	S491	A489-S491 PolarHBondContact O-N 2.87Å
490	F	32.4	Very low	34.9	Very low	190 Å²	190	112.9 Å²	112.9	83%	0.833	64%	0.642	S	S	*	*			trans	-72.3	-2.3	179.7	-72.6	-69	0	0	0	116.2	G488 R492	G488-F490 VanDerWaalsContact C-N 3.34Å; G488-F490 WeakPolarHBondContact O-CD2 3.49Å; G488-F490 PolarHBondContact O-N 2.91Å; F490-R492 PolarHBondContact O-N 2.88Å
491	S	33.8	Very low	34.2	Very low	124 Å²	124	116.9 Å²	116.9	87%	0.867	67%	0.67	S	S	*	*			trans	-69.9	19.7	174.6	-55.1	0	0	0	0	115.3	A489 S493	A489-S491 PolarHBondContact O-N 2.87Å; S491-S493 PolarHBondContact O-N 3.02Å
492	R	32.6	Very low	33.6	Very low	189 Å²	189	116.6 Å²	116.6	71%	0.713	69%	0.685	S	S	*	*			trans	-80.8	100.6	177.9	-72.2	-169.4	179.6	-158	1.4	111.3	F490 T494	F490-R492 PolarHBondContact O-N 2.88Å; R492-T494 PolarHBondContact O-N 2.79Å; R492-T494 VanDerWaalsContact O-N 3.17Å
493	S	33.4	Very low	33.4	Very low	92 Å²	92	118.9 Å²	118.9	64%	0.643	69%	0.691	S	S	*	*			trans	-48	115.1	163.1	57.2	0	0	0	0	110.9	S491 L495	S491-S493 PolarHBondContact O-N 3.02Å; S493-L495 PolarHBondContact O-N 3.47Å
494	T	35.5	Very low	33.1	Very low	70 Å²	70	119.1 Å²	119.1	43%	0.429	69%	0.692	S	S	.	*			trans	-98.6	72.9	-175.8	23.2	0	0	0	0	111	S469 R492	S469-T494 WeakPolarHBondContact OG-CB 3.41Å; S469-T494 PolarHBondContact OG-O 3.42Å; S469-T494 PolarHBondContact OG-OG1 2.77Å; R492-T494 PolarHBondContact O-N 2.79Å; R492-T494 VanDerWaalsContact O-N 3.17Å
495	L	32.4	Very low	32.8	Very low	60 Å²	60	125.7 Å²	125.7	31%	0.314	71%	0.71	S	S	.	*	S	Bend	trans	-104.4	148.7	147.4	-71.1	178.6	0	0	0	108.5	I54 S74 S493 G497	I54-L495 HydrophobicContact CD1-CD1 3.45Å; I54-L495 VanDerWaalsContact CD1-CD1 3.45Å; I54-L495 HydrophobicContact CG1-CD1 4.17Å; S74-L495 WeakPolarHBondContact O-CD2 3.34Å; S493-L495 PolarHBondContact O-N 3.47Å; L495-G497 PolarHBondContact O-N 3.01Å
496	P	34.8	Very low	32.8	Very low	85 Å²	85	127.1 Å²	127.1	55%	0.552	71%	0.709	S	S	*	*			trans	-53.1	133	177.7	-25.6	34.7	0	0	0	111	R498	P496-R498 PolarHBondContact O-N 3.47Å
497	G	32	Very low	32.6	Very low	72 Å²	72	125.6 Å²	125.6	74%	0.742	71%	0.708	S	S	*	*	S	Bend	trans	-71	39.6	-162.5	0	0	0	0	0	117.3	L495	L495-G497 PolarHBondContact O-N 3.01Å
498	R	34.4	Very low	32.5	Very low	233 Å²	233	129.1 Å²	129.1	88%	0.879	70%	0.704	S	S	*	*			trans	-90.9	-0.4	-173.4	-151.6	170.7	-169.1	153	7.1	114.9	P496	P496-R498 PolarHBondContact O-N 3.47Å
499	L	31.8	Very low	32.5	Very low	133 Å²	133	138.1 Å²	138.1	70%	0.696	73%	0.725	S	S	*	*			trans	-134.4	62.8	175.8	-68.1	174.5	0	0	0	111.2
500	R	31	Very low	32.5	Very low	205 Å²	205	139.4 Å²	139.4	77%	0.774	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-98	120.3	152.3	-92.9	-171.6	167.8	85.2	4.1	108
501	P	31	Very low	32.5	Very low	116 Å²	116	139.1 Å²	139.1	75%	0.753	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-61.9	135.6	160.6	-16.4	30.6	0	0	0	108.9	N503	P501-N503 PolarHBondContact O-N 3Å
502	S	30.8	Very low	32.2	Very low	108 Å²	108	142.3 Å²	142.3	76%	0.755	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-65.4	116.8	166.3	-65.9	0	0	0	0	108.4
503	N	34.7	Very low	32	Very low	159 Å²	159	138.2 Å²	138.2	85%	0.85	73%	0.73	S	S	*	*			trans	-105.4	78.6	174.9	-156.4	66.4	0	0	0	108.4	P501	P501-N503 PolarHBondContact O-N 3Å
504	D	33.9	Very low	32	Very low	128 Å²	128	143 Å²	143	68%	0.684	74%	0.739	S	S	*	*			trans	-85.3	143.2	173.8	-69	-48.9	0	0	0	110.7
505	Y	33.8	Very low	31.6	Very low	192 Å²	192	145 Å²	145	75%	0.753	75%	0.751	S	S	*	*			trans	79.2	127.6	165	-78.4	-78.2	0	0	0	121.7
506	F	34.2	Very low	31.6	Very low	195 Å²	195	150.4 Å²	150.4	86%	0.855	78%	0.78	S	S	*	*			trans	64.5	137.6	167.9	-55.8	-73.1	0	0	0	117.7
507	G	32.6	Very low	31.4	Very low	66 Å²	66	152.1 Å²	152.1	68%	0.68	78%	0.784	S	S	*	*			cis	172.1	137.5	-4	0	0	0	0	0	110.1	R509	G507-R509 PolarHBondContact O-N 3.4Å
508	N	27.3	Very low	31.4	Very low	173 Å²	173	157.8 Å²	157.8	93%	0.925	79%	0.791	S	S	*	*			trans	-63.4	126.3	-173.8	-71.1	-26.9	0	0	0	112.8
509	R	31.3	Very low	31.3	Very low	229 Å²	229	153.4 Å²	153.4	86%	0.864	79%	0.79	S	S	*	*			trans	-150.1	127.3	143.9	-127.8	176.9	-171.1	-133	2.2	112.4	G507	G507-R509 PolarHBondContact O-N 3.4Å
510	S	29.3	Very low	31.2	Very low	109 Å²	109	152.3 Å²	152.3	76%	0.762	79%	0.793	S	S	*	*			trans	-81.7	138.1	171.7	172.8	0	0	0	0	109.7
511	E	32.3	Very low	31.5	Very low	183 Å²	183	148.2 Å²	148.2	86%	0.855	79%	0.793	S	S	*	*			trans	-150.5	141.4	153.1	-120.9	160.1	-141.2	0	0	110.6
512	K	27.1	Very low	31.3	Very low	191 Å²	191	151.2 Å²	151.2	83%	0.83	80%	0.802	S	S	*	*			trans	-129.1	132.9	-163.8	-152.1	-172.4	-167.5	-175.2	0	108.1
513	S	28.9	Very low	31.1	Very low	103 Å²	103	154.2 Å²	154.2	72%	0.72	81%	0.806	S	S	*	*			trans	140.2	146.5	169.1	-76.1	0	0	0	0	110.3
514	K	33.3	Very low	30.8	Very low	192 Å²	192	152.2 Å²	152.2	84%	0.835	81%	0.805	S	S	*	*			cis	-153.1	162.8	-0.7	-111.4	157.1	-167.4	178.2	0	109.4
515	T	27.2	Very low	30.7	Very low	113 Å²	113	149.9 Å²	149.9	69%	0.693	80%	0.803	S	S	*	*			trans	-74.7	161.4	178.2	46.4	0	0	0	0	113.4
516	L	31.5	Very low	30.5	Very low	174 Å²	174	150.1 Å²	150.1	91%	0.911	81%	0.808	S	S	*	*			trans	-151.7	125.7	149.8	-134.7	154.9	0	0	0	108.1
517	D	30.5	Very low	30.3	Very low	121 Å²	121	146.1 Å²	146.1	65%	0.647	81%	0.805	S	S	*	*			trans	-99.5	-175.6	-166.2	-62.7	-73.9	0	0	0	113.1
518	E	33.5	Very low	30.4	Very low	191 Å²	191	150.3 Å²	150.3	89%	0.893	81%	0.812	S	S	*	*			trans	74	133.3	176.3	-49	-173.2	122.2	0	0	114.7
519	V	31.4	Very low	30.3	Very low	141 Å²	141	149.5 Å²	149.5	86%	0.855	81%	0.806	S	S	*	*			cis	-141	147.2	29.7	-168.7	0	0	0	0	111.6
520	S	29.3	Very low	30.1	Very low	109 Å²	109	144 Å²	144	76%	0.762	80%	0.799	S	S	*	*			trans	-107.3	-162.7	176.8	-61	0	0	0	0	112.1
521	P	37.3	Very low	30	Very low	119 Å²	119	146.3 Å²	146.3	77%	0.773	80%	0.802	S	S	*	*				-123.5	168.5	-83.6	38.4	-24.2	0	0	0	113.8
522	L	26.3	Very low	29.9	Very low	179 Å²	179	147.3 Å²	147.3	94%	0.937	80%	0.803	S	S	*	*			trans	-130.4	108.7	162.6	-89.1	173.1	0	0	0	111.9
523	M	27.4	Very low	29.9	Very low	172 Å²	172	148 Å²	148	85%	0.847	80%	0.8	S	S	*	*			trans	-103	161.4	162.5	-100.3	-87.5	-167.1	0	0	109
524	S	29	Very low	29.8	Very low	117 Å²	117	147 Å²	147	82%	0.818	79%	0.787	S	S	*	*			trans	54.5	94.7	167.2	60.4	0	0	0	0	118.1
525	A	30.5	Very low	29.6	Very low	79 Å²	79	142 Å²	142	65%	0.653	77%	0.774	S	S	*	*			trans	-154.9	148.1	142.9	0	0	0	0	0	111.7
526	F	30.8	Very low	29.8	Very low	196 Å²	196	140.6 Å²	140.6	86%	0.86	76%	0.762	S	S	*	*			trans	70	75.8	166.6	-47	-60.7	0	0	0	118.2	D528	F526-D528 PolarHBondContact O-N 2.86Å
527	S	30.4	Very low	29.6	Very low	112 Å²	112	137.1 Å²	137.1	78%	0.783	75%	0.748	S	S	*	*				-45	121.9	124.1	-47.7	0	0	0	0	110.1
528	D	33.3	Very low	29.7	Very low	154 Å²	154	133.6 Å²	133.6	82%	0.824	73%	0.731	S	S	*	*			trans	176.6	133.5	137.2	-88.7	-22	0	0	0	110	F526	F526-D528 PolarHBondContact O-N 2.86Å
529	I	26.2	Very low	29.9	Very low	155 Å²	155	129.5 Å²	129.5	80%	0.795	72%	0.719	S	S	*	*			trans	-90.3	136.8	-169.9	-63	165.5	0	0	0	110.1
530	P	26.3	Very low	30.2	Very low	113 Å²	113	124.7 Å²	124.7	73%	0.734	69%	0.687	S	S	*	*				-119	142.7	124.8	-3.9	23.3	0	0	0	111.7	K532	P530-K532 PolarHBondContact O-N 3.35Å
531	I	26.5	Very low	30.2	Very low	158 Å²	158	128 Å²	128	81%	0.81	69%	0.69	S	S	*	*			trans	-52.2	105	-179.4	-62.6	163.6	0	0	0	110.1	R533	I531-R533 PolarHBondContact O-N 2.84Å; I531-R533 VanDerWaalsContact O-N 3.08Å
532	K	31.4	Very low	29.9	Very low	204 Å²	204	126.6 Å²	126.6	89%	0.887	68%	0.681	S	S	*	*			trans	-66.8	109.8	178.4	-103	178.4	177.6	171.5	0	109.5	P530	P530-K532 PolarHBondContact O-N 3.35Å
533	R	26.3	Very low	30.3	Very low	205 Å²	205	121 Å²	121	77%	0.774	66%	0.656	S	S	*	*			trans	-56.3	141.6	168.9	-69.3	-176.9	-179	175.6	0.8	109.4	I531	I531-R533 PolarHBondContact O-N 2.84Å; I531-R533 VanDerWaalsContact O-N 3.08Å
534	I	26.8	Very low	30.7	Very low	84 Å²	84	120.1 Å²	120.1	43%	0.431	65%	0.65	S	S	.	*			trans	-51.6	132.5	178.3	-68.2	152.8	0	0	0	110	R351 D536	R351-I534 VanDerWaalsContact NH2-CG2 3.34Å; I534-D536 PolarHBondContact O-N 2.92Å; I534-D536 VanDerWaalsContact O-N 3.1Å
535	P	29.2	Very low	31.2	Very low	87 Å²	87	120.7 Å²	120.7	57%	0.565	64%	0.64	S	S	*	*			trans	-66.5	107.7	165.5	-15.8	29.9	0	0	0	108.9	T537	P535-T537 PolarHBondContact O-N 2.92Å
536	D	30.8	Very low	31.6	Very low	83 Å²	83	119.7 Å²	119.7	44%	0.444	62%	0.624	S	S	.	*	S	Bend	trans	-74.9	34.9	178.2	-78.6	-33	0	0	0	112.5	T335 Y337 I534	T335-D536 HydrophobicContact CG2-CB 4.22Å; Y337-D536 PolarHBondContact OH-O 3.44Å; I534-D536 PolarHBondContact O-N 2.92Å; I534-D536 VanDerWaalsContact O-N 3.1Å
537	T	28.8	Very low	32	Very low	100 Å²	100	115.8 Å²	115.8	61%	0.613	61%	0.611	S	S	*	*			trans	-141.3	86.9	178.3	42.9	0	0	0	0	110.4	P535 V539	P535-T537 PolarHBondContact O-N 2.92Å; T537-V539 PolarHBondContact O-N 3.2Å
538	V	32.7	Very low	32.2	Very low	48 Å²	48	116.3 Å²	116.3	29%	0.291	60%	0.604	S	S	.	*			trans	-74.8	65.9	162.2	-172.7	0	0	0	0	108.9	Q150 R152	Q150-V538 WeakPolarHBondContact O-CG1 3.38Å; R152-V538 HydrophobicContact CB-CG1 4.07Å
539	V	37.1	Very low	32.4	Very low	105 Å²	105	115 Å²	115	64%	0.636	60%	0.597	S	S	*	*			trans	-88.2	132.2	157.3	-178.6	0	0	0	0	105.4	T537 Q541	T537-V539 PolarHBondContact O-N 3.2Å; V539-Q541 PolarHBondContact O-N 3.38Å
540	E	37.4	Very low	32.9	Very low	39 Å²	39	112.1 Å²	112.1	18%	0.182	59%	0.591	C	S	.	*			trans	-60.9	114.4	171.4	-69.4	179.6	98.7	0	0	108.8	R87 R95 R146 Q150	R87-E540 IonicContact CZ-OE1 2.95Å; R87-E540 IonicContact CZ-OE2 3.02Å; R87-E540 IonicContact NH1-OE1 2.67Å; R87-E540 IonicContact NH1-OE2 2.7Å; R87-E540 PolarHBondContact NH1-OE2 3.21Å; R87-E540 IonicContact NH2-OE1 3.18Å; R87-E540 PolarHBondContact NH2-OE1 2.61Å; R87-E540 IonicContact NH2-OE2 3.13Å; R87-E540 PolarHBondContact NH2-OE2 2.81Å; R95-E540 IonicContact NH1-OE2 3.11Å; R146-E540 IonicContact CZ-OE1 3.33Å; R146-E540 VanDerWaalsContact CZ-OE1 3.28Å; R146-E540 IonicContact NE-OE1 2.8Å; R146-E540 PolarHBondContact NE-OE1 2.99Å; R146-E540 IonicContact NH2-OE1 2.98Å; R146-E540 PolarHBondContact NH2-OE1 3.46Å; Q150-E540 PolarHBondContact NE2-OE1 2.81Å; Q150-E540 PolarHBondContact OE1-OE1 3.24Å
541	Q	30.3	Very low	33.4	Very low	179 Å²	179	112.6 Å²	112.6	84%	0.836	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-57.6	133.8	171.2	-67.8	-178.3	-86.6	0	0	108.4	V539 C543	V539-Q541 PolarHBondContact O-N 3.38Å; Q541-C543 PolarHBondContact O-N 3.38Å
542	P	29.6	Very low	33.8	Very low	90 Å²	90	114.1 Å²	114.1	58%	0.584	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-54	140.1	165.9	-22.3	33.2	0	0	0	109.6	D546	P542-D546 HydrophobicContact CB-CB 4.33Å
543	C	35.2	Very low	33.8	Very low	61 Å²	61	108.7 Å²	108.7	41%	0.412	59%	0.586	S	S	.	*	P	Polyproline II helix	trans	-62.7	149	172.1	-68.2	0	0	0	0	109.6	Q541 E545 D546	Q541-C543 PolarHBondContact O-N 3.38Å; C543-E545 PolarHBondContact O-N 2.96Å; C543-D546 WeakPolarHBondContact O-CB 3.4Å; C543-D546 PolarHBondContact O-N 2.81Å
544	E	35.2	Very low	33.9	Very low	154 Å²	154	104.6 Å²	104.6	72%	0.72	59%	0.589	S	S	*	*	H	α-helix	trans	-57.6	-26.8	-178	-62.6	179.3	153.5	0	0	112.9	D546 L547 L548	E544-D546 VanDerWaalsContact C-N 3.26Å; E544-D546 PolarHBondContact O-N 2.9Å; E544-L547 WeakPolarHBondContact O-CA 3.49Å; E544-L547 WeakPolarHBondContact O-CB 3.19Å; E544-L547 PolarHBondContact O-N 2.92Å; E544-L548 HydrophobicContact CB-CD1 4.41Å; E544-L548 VanDerWaalsContact O-CD1 3.25Å; E544-L548 WeakPolarHBondContact O-CD1 3.44Å; E544-L548 PolarHBondContact O-N 3.15Å
545	E	40.9	Very low	34.2	Very low	128 Å²	128	106.1 Å²	106.1	60%	0.598	60%	0.604	S	S	*	*	H	α-helix	trans	-58.1	-32.5	171.3	-63.6	-175.6	156.7	0	0	114	C543 L547 N549	C543-E545 PolarHBondContact O-N 2.96Å; E545-L547 VanDerWaalsContact C-N 3.26Å; E545-L547 PolarHBondContact O-N 3.33Å; E545-N549 PolarHBondContact O-N 2.85Å; E545-N549 PolarHBondContact O-ND2 3.46Å; E545-N549 VanDerWaalsContact O-ND2 3.1Å
546	D	38.1	Very low	34.5	Very low	59 Å²	59	108.7 Å²	108.7	32%	0.316	62%	0.619	S	S	.	*	H	α-helix	trans	-76.9	-16.1	177.6	-62.5	-33.1	0	0	0	111.4	R45 P542 C543 E544	R45-D546 IonicContact CZ-OD1 2.97Å; R45-D546 IonicContact CZ-OD2 3.18Å; R45-D546 IonicContact NH1-OD1 2.7Å; R45-D546 IonicContact NH1-OD2 2.75Å; R45-D546 PolarHBondContact NH1-OD2 3.44Å; R45-D546 IonicContact NH2-OD1 3.96Å; R45-D546 PolarHBondContact NH2-OD1 3.34Å; R45-D546 IonicContact NH2-OD2 2.74Å; R45-D546 PolarHBondContact NH2-OD2 3.21Å; P542-D546 HydrophobicContact CB-CB 4.33Å; C543-D546 WeakPolarHBondContact O-CB 3.4Å; C543-D546 PolarHBondContact O-N 2.81Å; E544-D546 VanDerWaalsContact C-N 3.26Å; E544-D546 PolarHBondContact O-N 2.9Å
547	L	38.8	Very low	34.5	Very low	114 Å²	114	111.3 Å²	111.3	60%	0.597	63%	0.631	S	S	*	*	H	α-helix	trans	-89.1	-45.6	170.8	-67.5	169	0	0	0	111.6	E544 E545 N549 S550	E544-L547 WeakPolarHBondContact O-CA 3.49Å; E544-L547 WeakPolarHBondContact O-CB 3.19Å; E544-L547 PolarHBondContact O-N 2.92Å; E545-L547 VanDerWaalsContact C-N 3.26Å; E545-L547 PolarHBondContact O-N 3.33Å; L547-N549 VanDerWaalsContact C-N 3.27Å; L547-N549 PolarHBondContact O-N 2.91Å; L547-S550 WeakPolarHBondContact O-CB 3.5Å; L547-S550 PolarHBondContact O-N 2.6Å; L547-S550 VanDerWaalsContact O-N 3.09Å
548	L	36.3	Very low	34.8	Very low	123 Å²	123	113.6 Å²	113.6	64%	0.644	64%	0.64	S	S	*	*	H	α-helix	trans	-63.4	-28	-178.3	-91.9	80.3	0	0	0	113.9	E544 S550 T551	E544-L548 HydrophobicContact CB-CD1 4.41Å; E544-L548 VanDerWaalsContact O-CD1 3.25Å; E544-L548 WeakPolarHBondContact O-CD1 3.44Å; E544-L548 PolarHBondContact O-N 3.15Å; L548-S550 PolarHBondContact O-N 2.9Å; L548-T551 PolarHBondContact O-N 3.39Å
549	N	35.7	Very low	34.8	Very low	125 Å²	125	117.8 Å²	117.8	67%	0.668	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-74.6	-8.7	176.8	-78.7	-41.7	0	0	0	114.1	E545 L547 T551	E545-N549 PolarHBondContact O-N 2.85Å; E545-N549 PolarHBondContact O-ND2 3.46Å; E545-N549 VanDerWaalsContact O-ND2 3.1Å; L547-N549 VanDerWaalsContact C-N 3.27Å; L547-N549 PolarHBondContact O-N 2.91Å; N549-T551 VanDerWaalsContact C-N 3.34Å
550	S	38.1	Very low	34.9	Very low	95 Å²	95	122.5 Å²	122.5	66%	0.664	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-79.6	-15.5	175.3	-64.8	0	0	0	0	113.2	L547 L548	L547-S550 WeakPolarHBondContact O-CB 3.5Å; L547-S550 PolarHBondContact O-N 2.6Å; L547-S550 VanDerWaalsContact O-N 3.09Å; L548-S550 PolarHBondContact O-N 2.9Å
551	T	35.6	Very low	34.7	Very low	123 Å²	123	129.2 Å²	129.2	76%	0.755	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-98.2	8.1	-172.8	-24.1	0	0	0	0	114.1	L548 N549	L548-T551 PolarHBondContact O-N 3.39Å; N549-T551 VanDerWaalsContact C-N 3.34Å
552	K	35	Very low	35	Very low	190 Å²	190	128.6 Å²	128.6	83%	0.826	70%	0.702	S	S	*	*			trans	-125.8	58.9	-180	-73.5	-172.6	176.6	178.5	0	113.2
553	A	31.6	Very low	35.2	Very low	91 Å²	91	129.9 Å²	129.9	75%	0.752	70%	0.704	S	S	*	*			trans	-148.4	73.2	168.1	0	0	0	0	0	111.7
554	S	27.9	Very low	35.1	Very low	118 Å²	118	133.9 Å²	133.9	83%	0.825	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-85.3	131.5	162.7	-72.8	0	0	0	0	109.6
555	P	34.8	Very low	35.3	Very low	117 Å²	117	130.8 Å²	130.8	76%	0.76	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-83.7	127.2	-179.3	31.9	-32.5	0	0	0	111.7	I557	P555-I557 PolarHBondContact O-N 2.87Å
556	T	34.1	Very low	35	Very low	141 Å²	141	132.7 Å²	132.7	87%	0.865	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-76.9	122.2	172	-44.8	0	0	0	0	110.4
557	I	31.3	Very low	34.8	Very low	138 Å²	138	132.8 Å²	132.8	71%	0.708	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-77.1	142.5	177.2	-64.8	167.6	0	0	0	110.2	P555	P555-I557 PolarHBondContact O-N 2.87Å
558	N	35.5	Very low	34.8	Very low	148 Å²	148	135.1 Å²	135.1	79%	0.791	77%	0.765	S	S	*	*			trans	-160	99.5	153.5	-95.1	-30.9	0	0	0	111.8
559	D	33	Very low	34.7	Very low	135 Å²	135	138.2 Å²	138.2	72%	0.722	78%	0.776	S	S	*	*			trans	33.1	121.9	147.5	-58.7	-22.6	0	0	0	123
560	K	39	Very low	34.7	Very low	204 Å²	204	141.3 Å²	141.3	89%	0.887	78%	0.783	S	S	*	*				-171.7	82.7	116.6	-99.4	159.3	-171.8	174.6	0	115
561	K	33.7	Very low	34.5	Very low	181 Å²	181	143.6 Å²	143.6	79%	0.787	79%	0.788	S	S	*	*			trans	23	112.4	132	-163.8	176.5	-169	174.3	0	119.5
562	L	36	Very low	34.3	Very low	166 Å²	166	144.7 Å²	144.7	87%	0.869	79%	0.789	S	S	*	*				-165.2	113	124.9	-130	84.5	0	0	0	113.9
563	N	34	Very low	33.9	Very low	117 Å²	117	141.5 Å²	141.5	63%	0.626	79%	0.785	S	S	*	*			trans	-2.7	153.4	143.4	-53.7	15.8	0	0	0	119.1
564	N	33	Very low	33.9	Very low	145 Å²	145	145.2 Å²	145.2	78%	0.775	79%	0.79	S	S	*	*			cis	-169.4	169.2	0.3	-108.9	9.2	0	0	0	111
565	A	38.6	Very low	34	Very low	88 Å²	88	147.7 Å²	147.7	73%	0.727	79%	0.789	S	S	*	*			trans	71.7	141.3	160	0	0	0	0	0	118.1
566	D	35.4	Very low	33.6	Very low	169 Å²	169	146.6 Å²	146.6	90%	0.904	79%	0.789	S	S	*	*			cis	-161.6	161.9	-12.6	-126.1	-27.3	0	0	0	109.7
567	G	34.2	Very low	33.3	Very low	61 Å²	61	144.9 Å²	144.9	63%	0.629	79%	0.789	S	S	*	*			trans	107.7	110.9	157	0	0	0	0	0	120.2
568	D	37.7	Very low	33.2	Very low	163 Å²	163	144.4 Å²	144.4	87%	0.872	79%	0.792	S	S	*	*			trans	75.1	70.8	136	-53.6	-10.6	0	0	0	122
569	E	33.7	Very low	32.9	Very low	188 Å²	188	144.6 Å²	144.6	88%	0.879	79%	0.789	S	S	*	*				12.8	115.6	126.2	-170.1	172.8	-159.6	0	0	120.4
570	K	37.4	Very low	32.6	Very low	189 Å²	189	143.2 Å²	143.2	82%	0.822	79%	0.79	S	S	*	*			trans	-170.1	115.5	132.9	-109.9	166.5	-173.8	173.1	0	115.1
571	D	32.6	Very low	31.9	Very low	143 Å²	143	145.5 Å²	145.5	77%	0.765	79%	0.793	S	S	*	*			trans	54.1	141	139.4	-74.1	-39.3	0	0	0	125
572	L	31.1	Very low	31.7	Very low	147 Å²	147	144.3 Å²	144.3	77%	0.77	79%	0.793	S	S	*	*			trans	79.1	87.4	150.6	-69.6	160.5	0	0	0	120.8
573	V	28.2	Very low	31.4	Very low	123 Å²	123	144.5 Å²	144.5	75%	0.745	79%	0.79	S	S	*	*				14.9	114.2	118.3	-173.5	0	0	0	0	116.6
574	I	30.4	Very low	31.1	Very low	169 Å²	169	144.4 Å²	144.4	87%	0.867	80%	0.796	S	S	*	*			trans	-130.9	127	152.9	-64.9	-174.8	0	0	0	109.8
575	Q	29.7	Very low	31	Very low	170 Å²	170	143.9 Å²	143.9	79%	0.794	80%	0.798	S	S	*	*			trans	-71.2	164.9	-177.6	-73.2	161.1	-62.2	0	0	113.5	A577	Q575-A577 PolarHBondContact O-N 3.03Å
576	A	27.2	Very low	30.5	Very low	93 Å²	93	147.6 Å²	147.6	77%	0.769	80%	0.8	S	S	*	*			trans	-53	128.5	167.3	0	0	0	0	0	111.5	V578	A576-V578 VanDerWaalsContact C-N 3.32Å; A576-V578 PolarHBondContact O-N 3.13Å
577	A	28	Very low	30.2	Very low	105 Å²	105	146.6 Å²	146.6	87%	0.868	79%	0.793	S	S	*	*			trans	-73.4	83.1	178.5	0	0	0	0	0	111.5	Q575	Q575-A577 PolarHBondContact O-N 3.03Å
578	V	28.3	Very low	29.9	Very low	128 Å²	128	148.9 Å²	148.9	78%	0.776	80%	0.795	S	S	*	*			trans	-65.3	136	150.5	174.3	0	0	0	0	107.3	A576 S580	A576-V578 VanDerWaalsContact C-N 3.32Å; A576-V578 PolarHBondContact O-N 3.13Å; V578-S580 PolarHBondContact O-N 2.98Å
579	E	29	Very low	29.3	Very low	152 Å²	152	150.2 Å²	150.2	71%	0.71	80%	0.796	S	S	*	*			trans	-59.9	113.2	178.8	-70.5	-178.9	130.2	0	0	109.9	W581	E579-W581 PolarHBondContact O-N 3.14Å
580	S	27	Very low	29.1	Very low	107 Å²	107	150.1 Å²	150.1	75%	0.748	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-65.3	122.8	177.3	48.5	0	0	0	0	109.9	V578 I582	V578-S580 PolarHBondContact O-N 2.98Å; S580-I582 PolarHBondContact O-N 3.09Å
581	W	24.4	Very low	28.8	Very low	252 Å²	252	147.8 Å²	147.8	96%	0.955	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-65.8	129.8	172.5	-71	33.4	0	0	0	108.5	E579	E579-W581 PolarHBondContact O-N 3.14Å
582	I	29.8	Very low	28.5	Very low	155 Å²	155	147.5 Å²	147.5	80%	0.795	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-100.1	119	170.4	-62	176.1	0	0	0	107	S580	S580-I582 PolarHBondContact O-N 3.09Å
583	E	29.4	Very low	28.5	Very low	171 Å²	171	146.3 Å²	146.3	80%	0.799	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-66.4	144.6	176.4	-66.6	-171	128.6	0	0	111.9	T585	E583-T585 PolarHBondContact O-N 2.85Å
584	P	28.1	Very low	28.4	Very low	115 Å²	115	145.1 Å²	145.1	75%	0.747	81%	0.808	S	S	*	*			trans	-85	103.4	173.9	32.5	-31.5	0	0	0	111.4
585	T	30.6	Very low	28.5	Very low	133 Å²	133	146.4 Å²	146.4	82%	0.816	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-58	136.3	173.4	-47.3	0	0	0	0	111.8	E583	E583-T585 PolarHBondContact O-N 2.85Å
586	Q	29	Very low	28.4	Very low	166 Å²	166	147.3 Å²	147.3	78%	0.776	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-70.3	135.2	-179.4	-62.5	178.4	-2.9	0	0	112.1
587	I	28.2	Very low	28.5	Very low	148 Å²	148	151.1 Å²	151.1	76%	0.759	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-96.9	118.4	161.9	-62.6	177.2	0	0	0	107.8
588	V	28.4	Very low	28.4	Very low	110 Å²	110	152.1 Å²	152.1	67%	0.667	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-77.8	130.4	175.9	172.8	0	0	0	0	109.9	Q590	V588-Q590 HydrophobicContact CG1-CG 4.4Å
589	Q	24.3	Very low	28.5	Very low	190 Å²	190	154 Å²	154	89%	0.888	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-79.7	128.2	164.5	-67.1	170.8	-71.2	0	0	109.1
590	Q	30.7	Very low	28.5	Very low	186 Å²	186	154.7 Å²	154.7	87%	0.869	82%	0.815	S	S	*	*			trans	-134.6	130.7	159.8	-94.3	-173	-14.1	0	0	111.4	V588	V588-Q590 HydrophobicContact CG1-CG 4.4Å
591	T	30.5	Very low	28.9	Very low	141 Å²	141	154.6 Å²	154.6	87%	0.865	81%	0.811	S	S	*	*			trans	-90.9	139.8	179.9	38.9	0	0	0	0	112
592	V	25.4	Very low	29.1	Very low	136 Å²	136	149.8 Å²	149.8	82%	0.824	81%	0.81	S	S	*	*			trans	-18.2	128.6	165.8	-174.9	0	0	0	0	117.1
593	S	31.2	Very low	29	Very low	123 Å²	123	146.6 Å²	146.6	86%	0.86	81%	0.807	S	S	*	*				-163.2	149.9	127.7	-81.4	0	0	0	0	110.8
594	A	27.1	Very low	28.9	Very low	98 Å²	98	145.8 Å²	145.8	81%	0.81	81%	0.807	S	S	*	*			trans	-104.5	155.6	-172.7	0	0	0	0	0	112
595	E	32.5	Very low	29	Very low	196 Å²	196	149.3 Å²	149.3	92%	0.916	81%	0.813	S	S	*	*				-167.5	164.9	121	-163.2	143.9	-160.5	0	0	111.6
596	K	26.5	Very low	28.8	Very low	189 Å²	189	152.1 Å²	152.1	82%	0.822	81%	0.814	S	S	*	*			trans	-75.9	157.7	-176.9	-73.1	169	167.6	173.1	0	113.4
597	I	31	Very low	28.7	Very low	172 Å²	172	150.2 Å²	150.2	88%	0.882	82%	0.818	S	S	*	*				-161.9	151.9	112.4	-96	150.9	0	0	0	110
598	N	24.4	Very low	28.9	Very low	126 Å²	126	148.5 Å²	148.5	67%	0.674	82%	0.819	S	S	*	*			trans	-109.1	148.8	-170.5	168.4	42.9	0	0	0	110.7
599	I	30.8	Very low	29	Very low	167 Å²	167	151.9 Å²	151.9	86%	0.856	83%	0.828	S	S	*	*			trans	-168	151.1	143	-95.2	145.2	0	0	0	109.2
600	Q	29	Very low	29.5	Very low	167 Å²	167	148 Å²	148	78%	0.78	82%	0.819	S	S	*	*			trans	-125.7	-172	-162.3	-125.5	-162.6	64.2	0	0	111.7
601	P	35.2	Very low	29.4	Very low	105 Å²	105	146.1 Å²	146.1	68%	0.682	82%	0.815	S	S	*	*			trans	-119	177.9	-132.2	42.4	-26.3	0	0	0	115.7
602	V	29.4	Very low	29.2	Very low	152 Å²	152	148 Å²	148	92%	0.921	82%	0.816	S	S	*	*			trans	-138.1	156.7	165.5	-178.2	0	0	0	0	109.9
603	A	27.2	Very low	29.4	Very low	88 Å²	88	147.2 Å²	147.2	73%	0.727	81%	0.811	S	S	*	*			trans	-124	-175.5	-164	0	0	0	0	0	114.3
604	L	27.3	Very low	29.1	Very low	154 Å²	154	147.2 Å²	147.2	81%	0.806	81%	0.806	S	S	*	*			trans	92	117.1	151.3	-150.3	79.6	0	0	0	118.4
605	E	30.9	Very low	29.1	Very low	188 Å²	188	154.6 Å²	154.6	88%	0.879	81%	0.813	S	S	*	*				-171.2	169	112.5	-103.8	-170.8	159	0	0	114
606	K	26.6	Very low	28.7	Very low	192 Å²	192	154.9 Å²	154.9	84%	0.835	81%	0.811	S	S	*	*			trans	-122.9	152.5	-165.8	-73.4	177.6	173.5	177.4	0	113.8
607	C	26.6	Very low	28.8	Very low	126 Å²	126	157.2 Å²	157.2	85%	0.851	82%	0.815	S	S	*	*			trans	-155.6	177.4	147.9	-90.5	0	0	0	0	109.1
608	S	32.8	Very low	28.9	Very low	112 Å²	112	155.1 Å²	155.1	78%	0.783	81%	0.81	S	S	*	*				-159.4	151.6	-66	-86.7	0	0	0	0	108.9
609	E	29.9	Very low	29.1	Very low	182 Å²	182	157.1 Å²	157.1	85%	0.85	82%	0.815	S	S	*	*			trans	-100.8	171	170.7	-59.1	-173.2	141.7	0	0	111.3
610	P	34.8	Very low	29.1	Very low	109 Å²	109	157 Å²	157	71%	0.708	82%	0.816	S	S	*	*				-151.7	150.3	94.2	36.2	-17.3	0	0	0	118.7
611	N	29	Very low	29.4	Very low	145 Å²	145	152.5 Å²	152.5	78%	0.775	82%	0.815	S	S	*	*			trans	59.4	120.7	138.9	-64.4	-32.8	0	0	0	123
612	M	26.4	Very low	29.3	Very low	180 Å²	180	154.2 Å²	154.2	89%	0.887	82%	0.823	S	S	*	*				-167.9	102	111.2	-104.7	-167.8	74.2	0	0	116.3
613	V	30	Very low	30.1	Very low	121 Å²	121	151.9 Å²	151.9	73%	0.733	81%	0.805	S	S	*	*			trans	39.1	100.2	137	-166.6	0	0	0	0	122.6
614	V	23.8	Very low	31.1	Very low	123 Å²	123	150.9 Å²	150.9	75%	0.745	79%	0.79	S	S	*	*				41	120.9	123.8	-172.9	0	0	0	0	121.9
615	R	26.2	Very low	31.9	Very low	253 Å²	253	148.2 Å²	148.2	96%	0.955	78%	0.784	S	S	*	*				-140.4	119.1	124.3	-94.4	-169.7	175.3	110	-0.8	111
616	K	25.8	Very low	33.3	Very low	201 Å²	201	143.6 Å²	143.6	87%	0.874	77%	0.769	S	S	*	*			trans	-73.1	142.7	175.1	-81.4	-175.7	171.5	-174.6	0	111.7
617	R	28.6	Very low	34.7	Very low	239 Å²	239	137.5 Å²	137.5	90%	0.902	75%	0.746	S	S	*	*			trans	-143.7	101.3	147.9	-117.6	-179.9	-178.2	129.6	0.1	110.9
618	T	32.4	Very low	35.6	Very low	127 Å²	127	137.8 Å²	137.8	78%	0.779	73%	0.73	S	S	*	*			trans	41.6	130.9	146.7	-29.4	0	0	0	0	121.1
619	E	27.7	Very low	36.7	Very low	168 Å²	168	136.1 Å²	136.1	79%	0.785	72%	0.715	S	S	*	*			trans	-64.3	154.3	175.5	-59.6	127	171.2	0	0	113.8
620	N	30.9	Very low	38.1	Very low	166 Å²	166	133.7 Å²	133.7	89%	0.888	70%	0.703	S	S	*	*				179.7	129.2	124.4	-91.7	-27.8	0	0	0	113.5
621	G	36.7	Very low	39.1	Very low	72 Å²	72	131.3 Å²	131.3	74%	0.742	69%	0.693	S	S	*	*			trans	78.8	75.5	151	0	0	0	0	0	118.8	L623	G621-L623 PolarHBondContact O-N 3.21Å
622	T	33.2	Very low	40.3	Very low	140 Å²	140	129.1 Å²	129.1	86%	0.859	69%	0.685	S	S	*	*			trans	-69.3	108.6	162.6	-25.4	0	0	0	0	109.8	T624	T622-T624 PolarHBondContact O-N 2.78Å
623	L	45.6	Very low	42	Very low	103 Å²	103	124.6 Å²	124.6	54%	0.539	66%	0.663	S	S	.	*			trans	-58.6	126.7	177.1	-127.2	80.3	0	0	0	110.5	G621 D627 Y628	G621-L623 PolarHBondContact O-N 3.21Å; L623-D627 HydrophobicContact CD2-CB 4.17Å; L623-D627 HydrophobicContact CG-CB 3.84Å; L623-Y628 HydrophobicContact CB-CE2 4.01Å; L623-Y628 HydrophobicContact CD2-CD2 4.14Å; L623-Y628 HydrophobicContact CD2-CE1 4.46Å; L623-Y628 HydrophobicContact CD2-CE2 3.92Å
624	T	48.4	Very low	43.5	Very low	67 Å²	67	121.4 Å²	121.4	41%	0.411	65%	0.649	S	S	.	*			trans	-82.1	160.3	178.8	73	0	0	0	0	111.2	T622 T626 D627 Y628	T622-T624 PolarHBondContact O-N 2.78Å; T624-T626 PolarHBondContact O-N 3.05Å; T624-T626 VanDerWaalsContact O-N 3.12Å; T624-T626 WeakPolarHBondContact OG1-CB 3.3Å; T624-T626 PolarHBondContact OG1-N 3.02Å; T624-D627 WeakPolarHBondContact CA-OD2 3.4Å; T624-D627 WeakPolarHBondContact CB-OD2 3.4Å; T624-D627 PolarHBondContact N-OD2 3.38Å; T624-D627 WeakPolarHBondContact O-CB 3.4Å; T624-D627 PolarHBondContact O-N 3.45Å; T624-D627 PolarHBondContact OG1-N 3.14Å; T624-D627 PolarHBondContact OG1-OD2 2.94Å; T624-Y628 PolarHBondContact O-N 3.37Å
625	S	43.4	Very low	44.8	Very low	98 Å²	98	120.7 Å²	120.7	69%	0.685	64%	0.641	S	S	*	*	H	α-helix	trans	-56.5	-26.9	171.7	-172.9	0	0	0	0	112.6	T629	S625-T629 PolarHBondContact O-N 3.15Å; S625-T629 VanDerWaalsContact O-N 3.15Å; S625-T629 PolarHBondContact O-OG1 3.45Å
626	T	60.1	Low	46.1	Very low	92 Å²	92	111.6 Å²	111.6	56%	0.564	61%	0.611	S	S	*	*	H	α-helix	trans	-66.6	-41.4	174.8	-41.4	0	0	0	0	111.8	T624 T629 Q630	T624-T626 PolarHBondContact O-N 3.05Å; T624-T626 VanDerWaalsContact O-N 3.12Å; T624-T626 WeakPolarHBondContact OG1-CB 3.3Å; T624-T626 PolarHBondContact OG1-N 3.02Å; T626-T629 WeakPolarHBondContact O-CB 3.2Å; T626-T629 PolarHBondContact O-N 3.39Å; T626-T629 VanDerWaalsContact O-N 3.16Å; T626-Q630 PolarHBondContact O-N 2.83Å
627	D	56	Low	47.9	Very low	64 Å²	64	109 Å²	109	34%	0.342	60%	0.6	S	S	.	*	H	α-helix	trans	-69	-42.5	-177.9	-55.2	-46.4	0	0	0	111.1	L623 T624 T629 Q630 A631	L623-D627 HydrophobicContact CD2-CB 4.17Å; L623-D627 HydrophobicContact CG-CB 3.84Å; T624-D627 WeakPolarHBondContact CA-OD2 3.4Å; T624-D627 WeakPolarHBondContact CB-OD2 3.4Å; T624-D627 PolarHBondContact N-OD2 3.38Å; T624-D627 WeakPolarHBondContact O-CB 3.4Å; T624-D627 PolarHBondContact O-N 3.45Å; T624-D627 PolarHBondContact OG1-N 3.14Å; T624-D627 PolarHBondContact OG1-OD2 2.94Å; D627-T629 VanDerWaalsContact C-N 3.27Å; D627-T629 PolarHBondContact O-N 3.37Å; D627-Q630 PolarHBondContact O-N 3.19Å; D627-A631 WeakPolarHBondContact O-CB 3.33Å; D627-A631 PolarHBondContact O-N 3.36Å
628	Y	46.3	Very low	49.1	Very low	132 Å²	132	101.2 Å²	101.2	52%	0.518	58%	0.579	S	S	.	*	H	α-helix	trans	-56.6	-42.3	169.2	-81.4	-77.8	0	0	0	111.9	L623 T624 A631 V632	L623-Y628 HydrophobicContact CB-CE2 4.01Å; L623-Y628 HydrophobicContact CD2-CD2 4.14Å; L623-Y628 HydrophobicContact CD2-CE1 4.46Å; L623-Y628 HydrophobicContact CD2-CE2 3.92Å; T624-Y628 PolarHBondContact O-N 3.37Å; Y628-A631 PolarHBondContact O-N 3.15Å; Y628-V632 WeakPolarHBondContact O-CG2 3.48Å; Y628-V632 PolarHBondContact O-N 3.07Å
629	T	55.6	Low	49.9	Very low	77 Å²	77	99.8 Å²	99.8	47%	0.472	57%	0.566	S	S	.	*	H	α-helix	trans	-67.3	-40.5	179.4	-55	0	0	0	0	111.6	S625 T626 D627 I633	S625-T629 PolarHBondContact O-N 3.15Å; S625-T629 VanDerWaalsContact O-N 3.15Å; S625-T629 PolarHBondContact O-OG1 3.45Å; T626-T629 WeakPolarHBondContact O-CB 3.2Å; T626-T629 PolarHBondContact O-N 3.39Å; T626-T629 VanDerWaalsContact O-N 3.16Å; D627-T629 VanDerWaalsContact C-N 3.27Å; D627-T629 PolarHBondContact O-N 3.37Å; T629-I633 HydrophobicContact CG2-CD1 4.06Å; T629-I633 VanDerWaalsContact O-CG1 3.31Å; T629-I633 WeakPolarHBondContact O-CG1 3.28Å; T629-I633 PolarHBondContact O-N 3.18Å; T629-I633 VanDerWaalsContact O-N 3.1Å
630	Q	60.2	Low	50.9	Low	130 Å²	130	96.9 Å²	96.9	61%	0.607	56%	0.556	S	S	*	*	H	α-helix	trans	-64.6	-43.2	173.9	-77.6	-167.5	-8.4	0	0	112.3	T626 D627 V632 I633 A634	T626-Q630 PolarHBondContact O-N 2.83Å; D627-Q630 PolarHBondContact O-N 3.19Å; Q630-V632 VanDerWaalsContact C-N 3.34Å; Q630-V632 PolarHBondContact O-N 3.23Å; Q630-I633 PolarHBondContact O-N 3.25Å; Q630-A634 WeakPolarHBondContact O-CB 3.41Å; Q630-A634 PolarHBondContact O-N 3.04Å
631	A	54	Low	52.1	Low	60 Å²	60	94.7 Å²	94.7	50%	0.496	54%	0.54	S	S	.	.	H	α-helix	trans	-60.8	-41.8	178.1	0	0	0	0	0	112.2	D627 Y628 A634 L635	D627-A631 WeakPolarHBondContact O-CB 3.33Å; D627-A631 PolarHBondContact O-N 3.36Å; Y628-A631 PolarHBondContact O-N 3.15Å; A631-A634 PolarHBondContact O-N 2.81Å; A631-L635 WeakPolarHBondContact O-CB 3.49Å; A631-L635 PolarHBondContact O-N 2.93Å
632	V	55.2	Low	52.6	Low	98 Å²	98	97.4 Å²	97.4	59%	0.594	53%	0.533	S	S	*	.	H	α-helix	trans	-63.9	-44.4	174.7	171.9	0	0	0	0	111.4	Y628 Q630 A634 L635 D636	Y628-V632 WeakPolarHBondContact O-CG2 3.48Å; Y628-V632 PolarHBondContact O-N 3.07Å; Q630-V632 VanDerWaalsContact C-N 3.34Å; Q630-V632 PolarHBondContact O-N 3.23Å; V632-A634 VanDerWaalsContact C-N 3.34Å; V632-A634 PolarHBondContact O-N 2.94Å; V632-L635 PolarHBondContact O-N 3.15Å; V632-D636 WeakPolarHBondContact O-CB 3.44Å; V632-D636 PolarHBondContact O-N 3.35Å
633	I	62	Low	53.1	Low	86 Å²	86	94.1 Å²	94.1	44%	0.441	52%	0.516	S	S	.	.	H	α-helix	trans	-65	-37.4	177.8	-69.1	166.6	0	0	0	111.7	T629 Q630 K637	T629-I633 HydrophobicContact CG2-CD1 4.06Å; T629-I633 VanDerWaalsContact O-CG1 3.31Å; T629-I633 WeakPolarHBondContact O-CG1 3.28Å; T629-I633 PolarHBondContact O-N 3.18Å; T629-I633 VanDerWaalsContact O-N 3.1Å; Q630-I633 PolarHBondContact O-N 3.25Å; I633-K637 HydrophobicContact CG2-CD 4.47Å; I633-K637 WeakPolarHBondContact O-CG 3.48Å; I633-K637 PolarHBondContact O-N 2.71Å; I633-K637 VanDerWaalsContact O-N 3.11Å
634	A	61.1	Low	53.1	Low	53 Å²	53	92.9 Å²	92.9	44%	0.438	52%	0.516	S	S	.	.	H	α-helix	trans	-64.3	-46.3	175.6	0	0	0	0	0	111.1	Q630 A631 V632 D636 K637 T638	Q630-A634 WeakPolarHBondContact O-CB 3.41Å; Q630-A634 PolarHBondContact O-N 3.04Å; A631-A634 PolarHBondContact O-N 2.81Å; V632-A634 VanDerWaalsContact C-N 3.34Å; V632-A634 PolarHBondContact O-N 2.94Å; A634-D636 PolarHBondContact O-N 3.37Å; A634-K637 PolarHBondContact O-N 2.82Å; A634-T638 PolarHBondContact O-N 2.89Å; A634-T638 PolarHBondContact O-OG1 2.69Å; A634-T638 VanDerWaalsContact O-OG1 3.1Å
635	L	51.8	Low	52.7	Low	108 Å²	108	95 Å²	95	57%	0.565	53%	0.525	S	S	*	.	H	α-helix	trans	-62	-42.5	178	-175.5	64.7	0	0	0	112.5	A631 V632 T638 L639	A631-L635 WeakPolarHBondContact O-CB 3.49Å; A631-L635 PolarHBondContact O-N 2.93Å; V632-L635 PolarHBondContact O-N 3.15Å; L635-T638 PolarHBondContact O-N 3Å; L635-L639 HydrophobicContact CG-CD1 4.2Å; L635-L639 WeakPolarHBondContact O-CB 3.1Å; L635-L639 PolarHBondContact O-N 3.34Å
636	D	53.7	Low	52.3	Low	63 Å²	63	94.8 Å²	94.8	34%	0.337	52%	0.523	S	S	.	.	H	α-helix	trans	-61.8	-44.9	177.6	-151.8	46.4	0	0	0	110.7	F388 V632 A634 T638 L639 D640	F388-D636 VanDerWaalsContact CE1-OD2 3.29Å; F388-D636 WeakPolarHBondContact CE1-OD2 3.48Å; V632-D636 WeakPolarHBondContact O-CB 3.44Å; V632-D636 PolarHBondContact O-N 3.35Å; A634-D636 PolarHBondContact O-N 3.37Å; D636-T638 PolarHBondContact O-N 3.23Å; D636-L639 PolarHBondContact O-N 2.98Å; D636-D640 PolarHBondContact O-N 3.05Å
637	K	62.7	Low	51.1	Low	146 Å²	146	98 Å²	98	64%	0.635	53%	0.531	S	S	*	.	H	α-helix	trans	-60.8	-40.9	172.8	-75	178	177.7	-176.5	0	113.2	I633 A634 H641	I633-K637 HydrophobicContact CG2-CD 4.47Å; I633-K637 WeakPolarHBondContact O-CG 3.48Å; I633-K637 PolarHBondContact O-N 2.71Å; I633-K637 VanDerWaalsContact O-N 3.11Å; A634-K637 PolarHBondContact O-N 2.82Å; K637-H641 WeakPolarHBondContact O-CB 3.4Å; K637-H641 PolarHBondContact O-N 3.22Å
638	T	53.5	Low	49.9	Very low	75 Å²	75	101 Å²	101	46%	0.46	55%	0.554	S	S	.	*	H	α-helix	trans	-67.2	-37.9	177.5	-58.8	0	0	0	0	111.6	A634 L635 D636 H641 H642	A634-T638 PolarHBondContact O-N 2.89Å; A634-T638 PolarHBondContact O-OG1 2.69Å; A634-T638 VanDerWaalsContact O-OG1 3.1Å; L635-T638 PolarHBondContact O-N 3Å; D636-T638 PolarHBondContact O-N 3.23Å; T638-H641 PolarHBondContact O-N 3.17Å; T638-H642 PolarHBondContact O-CD2 3.3Å; T638-H642 PolarHBondContact O-N 3.5Å
639	L	50.1	Low	49.4	Very low	98 Å²	98	102.2 Å²	102.2	51%	0.513	57%	0.57	S	S	.	*	H	α-helix	trans	-66.7	-42.8	174.5	-88	159.9	0	0	0	112.7	L635 D636 S643	L635-L639 HydrophobicContact CG-CD1 4.2Å; L635-L639 WeakPolarHBondContact O-CB 3.1Å; L635-L639 PolarHBondContact O-N 3.34Å; D636-L639 PolarHBondContact O-N 2.98Å; L639-S643 VanDerWaalsContact O-CB 3.29Å; L639-S643 WeakPolarHBondContact O-CB 3.35Å; L639-S643 PolarHBondContact O-N 3.2Å; L639-S643 PolarHBondContact O-OG 3.12Å
640	D	49.3	Very low	48.1	Very low	107 Å²	107	107.4 Å²	107.4	57%	0.572	59%	0.589	S	S	*	*	H	α-helix	trans	-62.8	-42.8	173.2	-86.3	-14.6	0	0	0	111.2	D636 S643 S644	D636-D640 PolarHBondContact O-N 3.05Å; D640-S643 PolarHBondContact O-N 3.28Å; D640-S644 PolarHBondContact O-N 2.83Å; D640-S644 PolarHBondContact O-OG 3.25Å
641	H	55.7	Low	46.7	Very low	120 Å²	120	109 Å²	109	56%	0.556	60%	0.6	S	S	*	*	H	α-helix	trans	-62.5	-49.4	177.5	-160.8	61.5	0	0	0	111.4	K637 T638 S643 S644 L645	K637-H641 WeakPolarHBondContact O-CB 3.4Å; K637-H641 PolarHBondContact O-N 3.22Å; T638-H641 PolarHBondContact O-N 3.17Å; H641-S643 VanDerWaalsContact C-N 3.28Å; H641-S643 PolarHBondContact O-N 3.32Å; H641-S644 PolarHBondContact O-N 3.06Å; H641-S644 VanDerWaalsContact O-N 3.13Å; H641-S644 PolarHBondContact O-OG 2.93Å; H641-L645 PolarHBondContact O-N 2.95Å
642	H	47.6	Very low	45.6	Very low	129 Å²	129	111.9 Å²	111.9	60%	0.597	61%	0.612	S	S	*	*	H	α-helix	trans	-63.7	-31	175.2	-89.9	-72.5	0	0	0	113.6	T638	T638-H642 PolarHBondContact O-CD2 3.3Å; T638-H642 PolarHBondContact O-N 3.5Å
643	S	44	Very low	44.2	Very low	71 Å²	71	117 Å²	117	50%	0.497	63%	0.626	S	S	.	*	H	α-helix	trans	-70.1	-38	173.3	-61.3	0	0	0	0	111.4	L639 D640 H641 L645 S646	L639-S643 VanDerWaalsContact O-CB 3.29Å; L639-S643 WeakPolarHBondContact O-CB 3.35Å; L639-S643 PolarHBondContact O-N 3.2Å; L639-S643 PolarHBondContact O-OG 3.12Å; D640-S643 PolarHBondContact O-N 3.28Å; H641-S643 VanDerWaalsContact C-N 3.28Å; H641-S643 PolarHBondContact O-N 3.32Å; S643-L645 VanDerWaalsContact C-N 3.34Å; S643-S646 PolarHBondContact O-N 3.1Å; S643-S646 PolarHBondContact O-OG 3.37Å
644	S	44	Very low	42.6	Very low	77 Å²	77	118.6 Å²	118.6	54%	0.538	65%	0.645	S	S	.	*	H	α-helix	trans	-68.7	-30.2	174.7	72.4	0	0	0	0	113.4	D640 H641 S646	D640-S644 PolarHBondContact O-N 2.83Å; D640-S644 PolarHBondContact O-OG 3.25Å; H641-S644 PolarHBondContact O-N 3.06Å; H641-S644 VanDerWaalsContact O-N 3.13Å; H641-S644 PolarHBondContact O-OG 2.93Å; S644-S646 PolarHBondContact O-N 3.49Å
645	L	41.2	Very low	41	Very low	112 Å²	112	124.8 Å²	124.8	59%	0.586	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	3.6	174.9	-88.6	149.4	0	0	0	114.5	H641 S643	H641-L645 PolarHBondContact O-N 2.95Å; S643-L645 VanDerWaalsContact C-N 3.34Å
646	S	34.9	Very low	39.7	Very low	92 Å²	92	126.4 Å²	126.4	64%	0.643	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	10.3	-177	71.7	0	0	0	0	115.3	S643 S644	S643-S646 PolarHBondContact O-N 3.1Å; S643-S646 PolarHBondContact O-OG 3.37Å; S644-S646 PolarHBondContact O-N 3.49Å
647	Q	33.4	Very low	38.3	Very low	161 Å²	161	130.7 Å²	130.7	75%	0.752	69%	0.688	S	S	*	*			trans	-89.6	127.1	168.5	-66.1	-168.9	-2.8	0	0	111.1	D649	Q647-D649 PolarHBondContact O-N 3.36Å
648	P	31.1	Very low	36.4	Very low	125 Å²	125	129.7 Å²	129.7	81%	0.812	69%	0.694	S	S	*	*			trans	-92.5	94.5	-179.8	34.8	-30.7	0	0	0	111.2
649	D	35.4	Very low	35.1	Very low	159 Å²	159	136 Å²	136	85%	0.85	71%	0.711	S	S	*	*			trans	-91.6	132.6	165.9	-90.7	-24.3	0	0	0	111.2	Q647	Q647-D649 PolarHBondContact O-N 3.36Å
650	E	28.9	Very low	33.9	Very low	186 Å²	186	138.1 Å²	138.1	87%	0.869	72%	0.721	S	S	*	*			trans	-73.7	125.6	178.6	-61.9	-178.4	111.1	0	0	111.2
651	L	31.5	Very low	32.7	Very low	162 Å²	162	141.9 Å²	141.9	85%	0.848	74%	0.735	S	S	*	*			trans	-151.7	103.7	143	-142.8	59.2	0	0	0	114.7
652	T	30.7	Very low	31.4	Very low	121 Å²	121	141.1 Å²	141.1	74%	0.742	74%	0.738	S	S	*	*			trans	61.8	108.6	138.5	-49.8	0	0	0	0	120	S654	T652-S654 PolarHBondContact O-N 2.74Å
653	K	26.2	Very low	30.5	Very low	206 Å²	206	139.3 Å²	139.3	90%	0.896	74%	0.74	S	S	*	*			trans	-48	125.9	158.4	-62.2	164.9	178.6	167.9	0	112.2
654	S	28.9	Very low	29.7	Very low	119 Å²	119	143.8 Å²	143.8	83%	0.832	76%	0.759	S	S	*	*			trans	-153	152.6	135.5	73.3	0	0	0	0	113.5	T652	T652-S654 PolarHBondContact O-N 2.74Å
655	K	27.1	Very low	29	Very low	184 Å²	184	143.4 Å²	143.4	80%	0.8	77%	0.767	S	S	*	*			trans	-29.7	137.6	179.7	-68.9	167.1	175.8	176.1	0	118.5
656	I	24	Very low	28.3	Very low	142 Å²	142	147.2 Å²	147.2	73%	0.728	78%	0.782	S	S	*	*				38.5	117.6	110.7	-48.3	162.9	0	0	0	113.8
657	Q	24.7	Very low	27.8	Very low	152 Å²	152	147.3 Å²	147.3	71%	0.71	79%	0.788	S	S	*	*				-168.3	139	76.2	-160.3	123.8	-6.8	0	0	112.7	Y659	Q657-Y659 HydrophobicContact CG-CD2 4.3Å; Q657-Y659 HydrophobicContact CG-CE2 4.28Å
658	T	22.6	Very low	27.5	Very low	126 Å²	126	145.1 Å²	145.1	77%	0.773	79%	0.786	S	S	*	*			trans	-69.5	131.4	165.1	-43.2	0	0	0	0	110.4
659	Y	25.2	Very low	27.3	Very low	207 Å²	207	149.1 Å²	149.1	81%	0.812	79%	0.785	S	S	*	*			trans	-153.7	136.9	144.4	-89.7	-63.5	0	0	0	112	Q657	Q657-Y659 HydrophobicContact CG-CD2 4.3Å; Q657-Y659 HydrophobicContact CG-CE2 4.28Å
660	I	25	Very low	27	Very low	143 Å²	143	148.4 Å²	148.4	73%	0.733	78%	0.779	S	S	*	*			trans	-93.1	132.3	164.4	-62.6	166.9	0	0	0	106.5	V662	I660-V662 HydrophobicContact CG2-CG2 4.45Å
661	H	25.2	Very low	27	Very low	185 Å²	185	148.8 Å²	148.8	86%	0.856	77%	0.773	S	S	*	*			trans	-149.1	150.1	151.6	-140.5	-89.1	0	0	0	111.8
662	V	28.6	Very low	27	Very low	104 Å²	104	147.6 Å²	147.6	63%	0.63	77%	0.767	S	S	*	*			trans	-114.7	157.8	-169	-169.6	0	0	0	0	109.8	I660	I660-V662 HydrophobicContact CG2-CG2 4.45Å
663	S	27.2	Very low	26.8	Very low	91 Å²	91	148.1 Å²	148.1	64%	0.636	77%	0.766	S	S	*	*			trans	71.6	123.1	152.4	40.8	0	0	0	0	120.5
664	N	28.9	Very low	27	Very low	165 Å²	165	148.6 Å²	148.6	88%	0.882	77%	0.768	S	S	*	*			trans	92.8	125.7	146	-52.4	-14.8	0	0	0	119.4
665	G	28.1	Very low	26.9	Very low	70 Å²	70	151.4 Å²	151.4	72%	0.722	77%	0.765	S	S	*	*			trans	117.3	94.1	148.1	0	0	0	0	0	117.8
666	E	26.2	Very low	26.9	Very low	191 Å²	191	148.2 Å²	148.2	89%	0.893	76%	0.761	S	S	*	*			trans	50	114.5	135.6	-59.6	-175.5	140.8	0	0	120
667	A	25.7	Very low	27.1	Very low	94 Å²	94	146.8 Å²	146.8	78%	0.777	76%	0.763	S	S	*	*				82.5	141.7	91.2	0	0	0	0	0	114
668	V	26.8	Very low	27.2	Very low	115 Å²	115	143.4 Å²	143.4	70%	0.697	76%	0.76	S	S	*	*			cis	-166.1	144.5	10.4	106.3	0	0	0	0	112.4
669	R	26.4	Very low	27.6	Very low	209 Å²	209	145.4 Å²	145.4	79%	0.789	77%	0.766	S	S	*	*			trans	54.7	164	154.7	-60.5	171.8	-174	175.4	3.1	118.9
670	I	30	Very low	27.6	Very low	144 Å²	144	139 Å²	139	74%	0.738	76%	0.764	S	S	*	*			cis	-143.9	127	30.6	-70.6	172.4	0	0	0	107.5
671	R	27.2	Very low	28.2	Very low	194 Å²	194	137.9 Å²	137.9	73%	0.732	77%	0.765	S	S	*	*				63.3	142.1	95.6	-110.4	-170.1	-132.4	166.9	-3.7	113.7
672	D	32.2	Very low	28.3	Very low	138 Å²	138	135 Å²	135	74%	0.738	76%	0.761	S	S	*	*			cis	-136	166.4	32.7	-77.4	-51.7	0	0	0	116.1
673	D	27.1	Very low	28.2	Very low	131 Å²	131	135.6 Å²	135.6	70%	0.701	76%	0.761	S	S	*	*			trans	-81.9	166.4	-175.8	-53.4	-77.7	0	0	0	114.5
674	F	29.4	Very low	28.2	Very low	216 Å²	216	139.7 Å²	139.7	95%	0.947	77%	0.767	S	S	*	*				-164.7	153.4	110.6	-105.5	-72.9	0	0	0	113.4
675	K	27.8	Very low	28.2	Very low	178 Å²	178	141.4 Å²	141.4	77%	0.774	77%	0.767	S	S	*	*			trans	-103.1	161.4	-163.9	-157.3	177.1	-179.2	177.4	0	108.4
676	V	27.6	Very low	28	Very low	118 Å²	118	145.5 Å²	145.5	72%	0.715	77%	0.765	S	S	*	*				175.2	142.4	79.7	167.2	0	0	0	0	110.3
677	C	27	Very low	28.2	Very low	112 Å²	112	144.4 Å²	144.4	76%	0.757	77%	0.765	S	S	*	*			trans	-1.5	165.4	144.6	-50.8	0	0	0	0	121
678	A	27.5	Very low	28.1	Very low	80 Å²	80	147.5 Å²	147.5	66%	0.661	76%	0.758	S	S	*	*			cis	-177.7	-172.3	-16.4	0	0	0	0	0	108.9
679	N	30.6	Very low	28.2	Very low	168 Å²	168	150.5 Å²	150.5	90%	0.898	76%	0.764	S	S	*	*			trans	93.4	136.2	165.3	-52.4	-27.3	0	0	0	117.8
680	G	25.5	Very low	28	Very low	74 Å²	74	148.3 Å²	148.3	76%	0.763	77%	0.767	S	S	*	*			trans	-104.3	-123	-174.6	0	0	0	0	0	114.8
681	P	37	Very low	28.1	Very low	118 Å²	118	148.4 Å²	148.4	77%	0.766	77%	0.768	S	S	*	*				-117.7	173.6	-102	36.6	-29.2	0	0	0	114.2
682	T	28.2	Very low	28.1	Very low	125 Å²	125	144.8 Å²	144.8	77%	0.767	77%	0.768	S	S	*	*				161.1	143.7	124.3	43.4	0	0	0	0	116.9
683	N	26.6	Very low	28.1	Very low	117 Å²	117	142.8 Å²	142.8	63%	0.626	77%	0.765	S	S	*	*			trans	57.2	123.3	140.6	-77.1	-54.4	0	0	0	125.5
684	K	26.1	Very low	28.4	Very low	177 Å²	177	144.5 Å²	144.5	77%	0.77	77%	0.774	S	S	*	*				60.5	126.5	129.4	-59.8	167.2	-179.1	170.6	0	118.4
685	K	29.3	Very low	28.5	Very low	201 Å²	201	138 Å²	138	87%	0.874	77%	0.767	S	S	*	*				-162.6	158.7	66.6	-86.7	177.6	176.9	172	0	112.5
686	F	24.8	Very low	28.5	Very low	155 Å²	155	138.2 Å²	138.2	68%	0.68	77%	0.771	S	S	*	*			trans	-77.6	153.8	165.1	-78.5	-104.6	0	0	0	111.3
687	N	29	Very low	28.8	Very low	169 Å²	169	139.4 Å²	139.4	90%	0.904	78%	0.779	S	S	*	*			trans	-156.5	137.1	134.3	-103.7	-22.3	0	0	0	111
688	Y	23.2	Very low	28.9	Very low	158 Å²	158	139.5 Å²	139.5	62%	0.62	78%	0.781	S	S	*	*			trans	-93.9	149.1	164	-81.8	-92.6	0	0	0	108.2	T383	T383-Y688 HydrophobicContact CG2-CD2 4.4Å; T383-Y688 HydrophobicContact CG2-CE1 4.09Å; T383-Y688 HydrophobicContact CG2-CE2 3.92Å
689	Q	29.3	Very low	29.1	Very low	178 Å²	178	141.5 Å²	141.5	83%	0.832	79%	0.787	S	S	*	*			trans	-132.9	119.3	164.7	-146.3	168.9	12.3	0	0	108.8	I691	Q689-I691 HydrophobicContact CG-CD1 4.47Å; Q689-I691 HydrophobicContact CG-CG1 4.42Å
690	L	23.3	Very low	29.1	Very low	163 Å²	163	140 Å²	140	85%	0.853	78%	0.784	S	S	*	*			trans	-112.4	123.8	171.8	-157.6	93	0	0	0	105.7
691	I	30.9	Very low	29.1	Very low	146 Å²	146	141.3 Å²	141.3	75%	0.749	78%	0.781	S	S	*	*			trans	-129.6	124.9	171.8	-60.9	-178.4	0	0	0	108	Q689	Q689-I691 HydrophobicContact CG-CD1 4.47Å; Q689-I691 HydrophobicContact CG-CG1 4.42Å
692	T	27.5	Very low	28.7	Very low	119 Å²	119	142 Å²	142	73%	0.73	78%	0.782	S	S	*	*			trans	-97.4	140	178.9	47.9	0	0	0	0	110.8
693	S	33	Very low	28.6	Very low	96 Å²	96	144 Å²	144	67%	0.671	78%	0.783	S	S	*	*			trans	-175.3	121.4	139.4	54.6	0	0	0	0	113
694	N	33.6	Very low	28.7	Very low	167 Å²	167	143.5 Å²	143.5	89%	0.893	79%	0.789	S	S	*	*			trans	59.7	141.9	133.3	-47.5	-8	0	0	0	120.9
695	G	31.7	Very low	28.9	Very low	78 Å²	78	145.5 Å²	145.5	80%	0.804	79%	0.793	S	S	*	*			trans	137.8	98.4	156.8	0	0	0	0	0	115
696	E	27.1	Very low	28.7	Very low	183 Å²	183	142.1 Å²	142.1	86%	0.855	79%	0.789	S	S	*	*			trans	-57.6	144.9	176.8	-58.2	155	131.8	0	0	114.3
697	T	33.7	Very low	28.9	Very low	143 Å²	143	142.8 Å²	142.8	88%	0.877	80%	0.799	S	S	*	*				165.6	155.8	121	37.6	0	0	0	0	111.4
698	S	28.2	Very low	28.8	Very low	115 Å²	115	144 Å²	144	80%	0.804	80%	0.796	S	S	*	*			trans	-107.6	-167	-173.4	-51.2	0	0	0	0	112.4
699	P	33	Very low	29.3	Very low	122 Å²	122	145.4 Å²	145.4	79%	0.792	81%	0.808	S	S	*	*				-120.1	152.6	-103.1	35.1	-18.1	0	0	0	114
700	V	29.5	Very low	29.3	Very low	137 Å²	137	144.2 Å²	144.2	83%	0.83	81%	0.808	S	S	*	*			trans	-134.7	132.6	173.1	-178.4	0	0	0	0	111.8
701	S	25.3	Very low	29.6	Very low	100 Å²	100	142.4 Å²	142.4	70%	0.699	81%	0.807	S	S	*	*			trans	-75.8	142.8	174.6	56.6	0	0	0	0	112.7
702	V	29.6	Very low	29.6	Very low	132 Å²	132	144 Å²	144	80%	0.8	81%	0.811	S	S	*	*			trans	-128.8	116.4	161.6	-177.4	0	0	0	0	109.5
703	H	25.1	Very low	29.7	Very low	168 Å²	168	146.8 Å²	146.8	78%	0.778	82%	0.816	S	S	*	*			trans	-90.5	143.6	161.4	-87.2	65.4	0	0	0	108.9
704	S	29.9	Very low	29.7	Very low	107 Å²	107	151 Å²	151	75%	0.748	83%	0.825	S	S	*	*			trans	-140.5	97.4	162.7	47.3	0	0	0	0	112.8
705	Y	29.3	Very low	29.5	Very low	218 Å²	218	150.6 Å²	150.6	86%	0.855	82%	0.823	S	S	*	*			trans	31.6	137.4	143.1	-52.1	-74.5	0	0	0	123.5
706	T	26	Very low	29.7	Very low	130 Å²	130	155.7 Å²	155.7	80%	0.798	83%	0.826	S	S	*	*			trans	-76.7	156.7	173.5	48.1	0	0	0	0	114.8
707	L	28.8	Very low	30	Very low	170 Å²	170	155.7 Å²	155.7	89%	0.89	83%	0.826	S	S	*	*			trans	-135	128.6	144.3	-109.8	163.9	0	0	0	110
708	K	27.6	Very low	30	Very low	193 Å²	193	156.4 Å²	156.4	84%	0.839	82%	0.819	S	S	*	*			trans	-99.2	139.2	167.8	-85.3	-179.1	173.6	177.7	0	107.6
709	E	33.5	Very low	30.2	Very low	188 Å²	188	159.8 Å²	159.8	88%	0.879	82%	0.82	S	S	*	*			trans	-147.1	161.4	152.9	-127.6	167.4	-158.3	0	0	112.1
710	N	28.5	Very low	30.1	Very low	153 Å²	153	162 Å²	162	82%	0.818	82%	0.819	S	S	*	*			trans	-88.3	143.7	-153.9	-65.8	-58.5	0	0	0	114.4
711	C	30	Very low	30.1	Very low	125 Å²	125	164.9 Å²	164.9	85%	0.845	82%	0.817	S	S	*	*			trans	-149.6	92.4	140.4	-162.1	0	0	0	0	111.6
712	H	30.1	Very low	30.6	Very low	179 Å²	179	164.2 Å²	164.2	83%	0.829	81%	0.808	S	S	*	*			trans	-88.2	105	161.9	-86.8	-36.9	0	0	0	108.9
713	Q	30.6	Very low	31	Very low	179 Å²	179	164.5 Å²	164.5	84%	0.836	80%	0.801	S	S	*	*			trans	165.5	94.5	147.2	-93.6	164.1	27.8	0	0	110.5
714	Q	32.7	Very low	31.5	Very low	185 Å²	185	162.5 Å²	162.5	86%	0.864	80%	0.796	S	S	*	*			trans	-178.2	-12.7	156.8	-108.3	169	24.5	0	0	113.7	Q716	Q714-Q716 VanDerWaalsContact C-N 3.32Å; Q714-Q716 PolarHBondContact O-N 3.13Å
715	N	29.5	Very low	31.9	Very low	157 Å²	157	162.6 Å²	162.6	84%	0.84	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	75.8	174.8	-84.9	-43.4	0	0	0	113.4
716	Q	35.9	Very low	32.3	Very low	186 Å²	186	159.1 Å²	159.1	87%	0.869	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-155.8	-18.7	157.2	-115.7	161.9	34.8	0	0	116.5	Q714	Q714-Q716 VanDerWaalsContact C-N 3.32Å; Q714-Q716 PolarHBondContact O-N 3.13Å
717	Q	33.2	Very low	33	Very low	182 Å²	182	159.1 Å²	159.1	85%	0.85	77%	0.77	S	S	*	*	S	Bend	trans	-100.6	-9.3	179.5	-74	-177.5	-6.2	0	0	115.4
718	Q	33.1	Very low	33.6	Very low	158 Å²	158	159.5 Å²	159.5	74%	0.738	76%	0.76	S	S	*	*	S	Bend	trans	-93.5	-3.5	-175.1	-132.5	169.8	17.8	0	0	114.7
719	K	33.6	Very low	35	Very low	187 Å²	187	153.3 Å²	153.3	81%	0.813	74%	0.741	S	S	*	*	S	Bend	trans	-87.3	-7.9	-176.3	-102.6	-178.1	176.6	179.5	0	115.5
720	E	31.2	Very low	36.1	Very low	169 Å²	169	147.2 Å²	147.2	79%	0.79	72%	0.719	S	S	*	*	S	Bend	trans	-104.8	-15.2	-175.5	-156.6	163.1	-158.6	0	0	113.2
721	Y	29.7	Very low	37.9	Very low	196 Å²	196	145.2 Å²	145.2	77%	0.769	71%	0.707	S	S	*	*	S	Bend	trans	-92.6	-17.3	179.2	-98.3	-91.4	0	0	0	115
722	T	34.8	Very low	39.3	Very low	86 Å²	86	145 Å²	145	53%	0.528	69%	0.694	S	S	.	*	S	Bend	trans	-80.7	-31.7	-177.2	43.6	0	0	0	0	113.6	N724 N725	T722-N724 VanDerWaalsContact C-N 3.26Å; T722-N724 PolarHBondContact O-N 3.39Å; T722-N725 PolarHBondContact O-N 2.79Å
723	H	37.3	Very low	40.9	Very low	139 Å²	139	140.5 Å²	140.5	64%	0.644	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-18.4	-172.8	-160	-70.8	0	0	0	114.6
724	N	36.7	Very low	42.5	Very low	125 Å²	125	139.7 Å²	139.7	67%	0.668	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	-17.1	-178.5	-76.7	-28.1	0	0	0	114.6	T722	T722-N724 VanDerWaalsContact C-N 3.26Å; T722-N724 PolarHBondContact O-N 3.39Å
725	N	37.6	Very low	44	Very low	110 Å²	110	133.2 Å²	133.2	59%	0.588	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-34.6	-178.9	-81.6	-24.2	0	0	0	113.4	T722 H727 R728 S729	T722-N725 PolarHBondContact O-N 2.79Å; N725-H727 PolarHBondContact O-N 2.64Å; N725-R728 PolarHBondContact O-N 3.48Å; N725-R728 VanDerWaalsContact O-N 3.11Å; N725-S729 PolarHBondContact O-N 2.94Å
726	E	38.1	Very low	45.9	Very low	145 Å²	145	131.1 Å²	131.1	68%	0.678	64%	0.635	S	S	*	*	H	α-helix	trans	-60.2	-35.4	175.3	-67.9	-171.5	133.3	0	0	112.3	R728 S729 S730	E726-R728 VanDerWaalsContact C-N 3.31Å; E726-R728 PolarHBondContact O-N 2.67Å; E726-S729 PolarHBondContact O-OG 2.75Å; E726-S730 PolarHBondContact O-N 3.5Å
727	H	40.2	Very low	47.4	Very low	129 Å²	129	125.8 Å²	125.8	60%	0.597	62%	0.615	S	S	*	*	H	α-helix	trans	-72.4	-24.8	178.9	-128.5	-59.2	0	0	0	113.2	N725 S730 I731	N725-H727 PolarHBondContact O-N 2.64Å; H727-S730 PolarHBondContact O-OG 3.02Å; H727-I731 WeakPolarHBondContact O-CD1 3.35Å; H727-I731 WeakPolarHBondContact O-CG1 3.45Å
728	R	42.3	Very low	49.3	Very low	178 Å²	178	121 Å²	121	67%	0.672	60%	0.595	S	S	*	*	H	α-helix	trans	-85.2	-35.7	-179.1	-161.8	173.5	-173	174.5	1.7	112.4	N725 E726 Q732	N725-R728 PolarHBondContact O-N 3.48Å; N725-R728 VanDerWaalsContact O-N 3.11Å; E726-R728 VanDerWaalsContact C-N 3.31Å; E726-R728 PolarHBondContact O-N 2.67Å; R728-Q732 PolarHBondContact O-N 3.44Å
729	S	55.8	Low	51	Low	63 Å²	63	117.9 Å²	117.9	44%	0.441	59%	0.587	S	S	.	*	H	α-helix	trans	-67.6	-41.6	175.5	71.8	0	0	0	0	111.7	N725 E726 I731 Q732 T733	N725-S729 PolarHBondContact O-N 2.94Å; E726-S729 PolarHBondContact O-OG 2.75Å; S729-I731 VanDerWaalsContact C-N 3.3Å; S729-I731 PolarHBondContact O-N 2.91Å; S729-Q732 PolarHBondContact O-N 3.2Å; S729-Q732 VanDerWaalsContact O-N 3.14Å; S729-T733 PolarHBondContact O-N 3.46Å; S729-T733 PolarHBondContact O-OG1 2.81Å
730	S	57.5	Low	52.9	Low	61 Å²	61	111.5 Å²	111.5	43%	0.427	57%	0.569	S	S	.	*	H	α-helix	trans	-61.2	-35.7	179.8	73.1	0	0	0	0	113.4	E726 H727 Y734	E726-S730 PolarHBondContact O-N 3.5Å; H727-S730 PolarHBondContact O-OG 3.02Å; S730-Y734 VanDerWaalsContact O-CB 3.24Å; S730-Y734 WeakPolarHBondContact O-CB 3.45Å; S730-Y734 PolarHBondContact O-N 3.02Å
731	I	65.3	Low	54.8	Low	110 Å²	110	104.9 Å²	104.9	56%	0.564	54%	0.541	S	S	*	.	H	α-helix	trans	-68	-43.1	175.9	-64.9	170.3	0	0	0	110.7	H727 S729 Y734 A735	H727-I731 WeakPolarHBondContact O-CD1 3.35Å; H727-I731 WeakPolarHBondContact O-CG1 3.45Å; S729-I731 VanDerWaalsContact C-N 3.3Å; S729-I731 PolarHBondContact O-N 2.91Å; I731-Y734 PolarHBondContact O-N 3.35Å; I731-A735 WeakPolarHBondContact O-CB 3.44Å; I731-A735 PolarHBondContact O-N 3.37Å
732	Q	60	Low	56.8	Low	122 Å²	122	98.2 Å²	98.2	57%	0.57	53%	0.526	S	S	*	.	H	α-helix	trans	-65.1	-45.4	175.8	-72.7	-179.2	-46.1	0	0	111.7	R728 S729 Y734 A735 I736	R728-Q732 PolarHBondContact O-N 3.44Å; S729-Q732 PolarHBondContact O-N 3.2Å; S729-Q732 VanDerWaalsContact O-N 3.14Å; Q732-Y734 VanDerWaalsContact C-N 3.32Å; Q732-Y734 PolarHBondContact O-N 2.94Å; Q732-A735 PolarHBondContact O-N 3.06Å; Q732-I736 VanDerWaalsContact O-CG1 3.3Å; Q732-I736 WeakPolarHBondContact O-CG1 3.49Å; Q732-I736 PolarHBondContact O-N 3.4Å
733	T	63.9	Low	58.8	Low	84 Å²	84	98.8 Å²	98.8	52%	0.515	52%	0.521	S	S	.	.	H	α-helix	trans	-60.6	-41.4	175.3	-52.6	0	0	0	0	111.5	S729 T737	S729-T733 PolarHBondContact O-N 3.46Å; S729-T733 PolarHBondContact O-OG1 2.81Å; T733-T737 WeakPolarHBondContact O-CB 3.48Å; T733-T737 PolarHBondContact O-N 2.92Å; T733-T737 PolarHBondContact O-OG1 3.5Å
734	Y	63.3	Low	60.6	Low	161 Å²	161	97 Å²	97	63%	0.631	52%	0.52	S	S	*	.	H	α-helix	trans	-64.4	-44.5	175.8	-171.3	-93.9	0	0	0	111.7	S730 I731 Q732 T737 L738	S730-Y734 VanDerWaalsContact O-CB 3.24Å; S730-Y734 WeakPolarHBondContact O-CB 3.45Å; S730-Y734 PolarHBondContact O-N 3.02Å; I731-Y734 PolarHBondContact O-N 3.35Å; Q732-Y734 VanDerWaalsContact C-N 3.32Å; Q732-Y734 PolarHBondContact O-N 2.94Å; Y734-T737 PolarHBondContact O-N 3Å; Y734-L738 VanDerWaalsContact O-CB 3.29Å; Y734-L738 WeakPolarHBondContact O-CB 3.34Å; Y734-L738 PolarHBondContact O-N 2.93Å
735	A	64.7	Low	62.3	Low	49 Å²	49	95 Å²	95	41%	0.405	51%	0.512	S	S	.	.	H	α-helix	trans	-61.6	-46.7	177.3	0	0	0	0	0	112.3	I731 Q732 L738 T739	I731-A735 WeakPolarHBondContact O-CB 3.44Å; I731-A735 PolarHBondContact O-N 3.37Å; Q732-A735 PolarHBondContact O-N 3.06Å; A735-L738 PolarHBondContact O-N 3.24Å; A735-T739 WeakPolarHBondContact O-CG2 3.37Å; A735-T739 PolarHBondContact O-N 3.26Å; A735-T739 PolarHBondContact O-OG1 3.36Å
736	I	70.6	Confident	63.9	Low	114 Å²	114	92 Å²	92	59%	0.585	50%	0.496	S	S	*	.	H	α-helix	trans	-63.1	-41.9	176.8	-66.5	164.5	0	0	0	111.1	Q732 L738 T739 A740	Q732-I736 VanDerWaalsContact O-CG1 3.3Å; Q732-I736 WeakPolarHBondContact O-CG1 3.49Å; Q732-I736 PolarHBondContact O-N 3.4Å; I736-L738 VanDerWaalsContact C-N 3.33Å; I736-L738 PolarHBondContact O-N 2.65Å; I736-T739 PolarHBondContact O-N 2.87Å; I736-T739 PolarHBondContact O-OG1 2.93Å; I736-T739 VanDerWaalsContact O-OG1 3.09Å; I736-A740 VanDerWaalsContact O-CB 3.3Å; I736-A740 WeakPolarHBondContact O-CB 3.44Å; I736-A740 PolarHBondContact O-N 2.69Å
737	T	66.9	Low	65.6	Low	73 Å²	73	88.2 Å²	88.2	45%	0.448	48%	0.482	S	S	.	.	H	α-helix	trans	-63.6	-41.8	176.5	-54.9	0	0	0	0	110.8	T733 Y734 T741	T733-T737 WeakPolarHBondContact O-CB 3.48Å; T733-T737 PolarHBondContact O-N 2.92Å; T733-T737 PolarHBondContact O-OG1 3.5Å; Y734-T737 PolarHBondContact O-N 3Å; T737-T741 HydrophobicContact CG2-CG2 4.48Å; T737-T741 WeakPolarHBondContact O-CB 3.47Å; T737-T741 VanDerWaalsContact O-CG2 3.23Å; T737-T741 WeakPolarHBondContact O-CG2 3.34Å; T737-T741 PolarHBondContact O-N 3.25Å; T737-T741 PolarHBondContact O-OG1 2.88Å
738	L	71.8	Confident	67.2	Low	81 Å²	81	84.1 Å²	84.1	42%	0.424	47%	0.474	S	S	.	.	H	α-helix	trans	-66.3	-43.6	179.4	-165.5	79.4	0	0	0	111.9	F437 Y734 A735 I736 T741 A742	F437-L738 HydrophobicContact CE1-CD1 4.43Å; Y734-L738 VanDerWaalsContact O-CB 3.29Å; Y734-L738 WeakPolarHBondContact O-CB 3.34Å; Y734-L738 PolarHBondContact O-N 2.93Å; A735-L738 PolarHBondContact O-N 3.24Å; I736-L738 VanDerWaalsContact C-N 3.33Å; I736-L738 PolarHBondContact O-N 2.65Å; L738-T741 PolarHBondContact O-OG1 3.48Å; L738-A742 VanDerWaalsContact O-CB 3.29Å; L738-A742 WeakPolarHBondContact O-CB 3.41Å; L738-A742 PolarHBondContact O-N 3.42Å
739	T	70.6	Confident	68.6	Low	93 Å²	93	78.4 Å²	78.4	57%	0.571	46%	0.459	S	S	*	.	H	α-helix	trans	-68.9	-44.4	178.5	52.7	0	0	0	0	112	A735 I736 T741 A742 F743	A735-T739 WeakPolarHBondContact O-CG2 3.37Å; A735-T739 PolarHBondContact O-N 3.26Å; A735-T739 PolarHBondContact O-OG1 3.36Å; I736-T739 PolarHBondContact O-N 2.87Å; I736-T739 PolarHBondContact O-OG1 2.93Å; I736-T739 VanDerWaalsContact O-OG1 3.09Å; T739-T741 VanDerWaalsContact C-N 3.29Å; T739-T741 PolarHBondContact O-N 2.91Å; T739-A742 PolarHBondContact O-N 3.41Å; T739-F743 WeakPolarHBondContact O-CB 3.33Å; T739-F743 PolarHBondContact O-N 3.28Å
740	A	72.8	Confident	69.3	Low	53 Å²	53	76.4 Å²	76.4	44%	0.438	44%	0.444	S	S	.	.	H	α-helix	trans	-59.5	-41.2	176.3	0	0	0	0	0	111.8	I736 F743 V744	I736-A740 VanDerWaalsContact O-CB 3.3Å; I736-A740 WeakPolarHBondContact O-CB 3.44Å; I736-A740 PolarHBondContact O-N 2.69Å; A740-F743 PolarHBondContact O-N 3.32Å; A740-V744 WeakPolarHBondContact O-CG2 3.37Å; A740-V744 PolarHBondContact O-N 3.33Å
741	T	71.5	Confident	70	Confident	31 Å²	31	75.6 Å²	75.6	19%	0.19	44%	0.44	C	S	.	.	H	α-helix	trans	-78.9	-31.5	-177.9	53.9	0	0	0	0	113.1	I436 F437 T737 L738 T739 F743 V745	I436-T741 HydrophobicContact CD1-CG2 3.27Å; F437-T741 WeakPolarHBondContact CZ-OG1 3.48Å; T737-T741 HydrophobicContact CG2-CG2 4.48Å; T737-T741 WeakPolarHBondContact O-CB 3.47Å; T737-T741 VanDerWaalsContact O-CG2 3.23Å; T737-T741 WeakPolarHBondContact O-CG2 3.34Å; T737-T741 PolarHBondContact O-N 3.25Å; T737-T741 PolarHBondContact O-OG1 2.88Å; L738-T741 PolarHBondContact O-OG1 3.48Å; T739-T741 VanDerWaalsContact C-N 3.29Å; T739-T741 PolarHBondContact O-N 2.91Å; T741-F743 VanDerWaalsContact C-N 3.34Å; T741-V745 WeakPolarHBondContact O-CG2 3.41Å; T741-V745 PolarHBondContact O-N 2.76Å; T741-V745 VanDerWaalsContact O-N 3.1Å
742	A	71.7	Confident	70.2	Confident	55 Å²	55	75 Å²	75	46%	0.455	44%	0.438	S	S	.	.	H	α-helix	trans	-60.4	-43.6	165.4	0	0	0	0	0	111.4	L738 T739 V745 L746	L738-A742 VanDerWaalsContact O-CB 3.29Å; L738-A742 WeakPolarHBondContact O-CB 3.41Å; L738-A742 PolarHBondContact O-N 3.42Å; T739-A742 PolarHBondContact O-N 3.41Å; A742-V745 PolarHBondContact O-N 3.19Å; A742-L746 VanDerWaalsContact O-CB 3.24Å; A742-L746 WeakPolarHBondContact O-CB 3.07Å; A742-L746 PolarHBondContact O-N 3.31Å
743	F	75.7	Confident	70.5	Confident	98 Å²	98	71.1 Å²	71.1	43%	0.43	42%	0.421	S	S	.	.	H	α-helix	trans	-63.6	-43.7	178.4	-161.6	-94	0	0	0	112.3	T739 A740 T741 V745 L746 V747 I793	T739-F743 WeakPolarHBondContact O-CB 3.33Å; T739-F743 PolarHBondContact O-N 3.28Å; A740-F743 PolarHBondContact O-N 3.32Å; T741-F743 VanDerWaalsContact C-N 3.34Å; F743-V745 PolarHBondContact O-N 3.01Å; F743-L746 PolarHBondContact O-N 2.78Å; F743-V747 HydrophobicContact CD1-CG2 3.97Å; F743-V747 HydrophobicContact CE1-CG2 3.77Å; F743-V747 HydrophobicContact CZ-CG2 4.4Å; F743-V747 WeakPolarHBondContact O-CG2 3.24Å; F743-V747 PolarHBondContact O-N 3.15Å; F743-I793 HydrophobicContact CE2-CD1 4.42Å; F743-I793 HydrophobicContact CE2-CG1 4.27Å; F743-I793 HydrophobicContact CZ-CD1 4.44Å; F743-I793 HydrophobicContact CZ-CG1 4.29Å
744	V	75.1	Confident	70.7	Confident	103 Å²	103	71.6 Å²	71.6	62%	0.624	42%	0.417	S	S	*	.	H	α-helix	trans	-62	-42.8	175.7	170.8	0	0	0	0	112.1	A740 L746 G748	A740-V744 WeakPolarHBondContact O-CG2 3.37Å; A740-V744 PolarHBondContact O-N 3.33Å; V744-L746 VanDerWaalsContact C-N 3.34Å; V744-G748 PolarHBondContact O-N 2.8Å
745	V	72.2	Confident	70.8	Confident	81 Å²	81	66.9 Å²	66.9	49%	0.491	41%	0.405	S	S	.	.	H	α-helix	trans	-62.7	-43	175.3	170.3	0	0	0	0	110.8	F437 T741 A742 F743 G748 V749	F437-V745 HydrophobicContact CE2-CG2 4.21Å; T741-V745 WeakPolarHBondContact O-CG2 3.41Å; T741-V745 PolarHBondContact O-N 2.76Å; T741-V745 VanDerWaalsContact O-N 3.1Å; A742-V745 PolarHBondContact O-N 3.19Å; F743-V745 PolarHBondContact O-N 3.01Å; V745-G748 PolarHBondContact O-N 3.12Å; V745-V749 WeakPolarHBondContact O-CG2 3.45Å; V745-V749 PolarHBondContact O-N 3.29Å
746	L	72.7	Confident	70.4	Confident	48 Å²	48	69.7 Å²	69.7	25%	0.251	42%	0.418	S	S	.	.	H	α-helix	trans	-65.4	-43.3	-178.3	-167.4	59.3	0	0	0	112.3	A742 F743 V744 G748 V749 I750 L789	A742-L746 VanDerWaalsContact O-CB 3.24Å; A742-L746 WeakPolarHBondContact O-CB 3.07Å; A742-L746 PolarHBondContact O-N 3.31Å; F743-L746 PolarHBondContact O-N 2.78Å; V744-L746 VanDerWaalsContact C-N 3.34Å; L746-G748 VanDerWaalsContact C-N 3.33Å; L746-G748 PolarHBondContact O-N 3.25Å; L746-V749 PolarHBondContact O-N 3.42Å; L746-I750 WeakPolarHBondContact O-CG1 3.29Å; L746-I750 PolarHBondContact O-N 3.02Å; L746-L789 HydrophobicContact CD1-CD2 3.89Å; L746-L789 HydrophobicContact CD2-CD1 3.86Å; L746-L789 HydrophobicContact CD2-CD2 3.45Å; L746-L789 VanDerWaalsContact CD2-CD2 3.45Å; L746-L789 HydrophobicContact CD2-CG 4.24Å; L746-L789 HydrophobicContact CG-CD2 3.61Å
747	V	73.9	Confident	69.5	Low	66 Å²	66	67 Å²	67	40%	0.4	41%	0.407	S	S	.	.	H	α-helix	trans	-62.8	-39.2	171.9	172.2	0	0	0	0	111.3	F743 V749 I750 A751	F743-V747 HydrophobicContact CD1-CG2 3.97Å; F743-V747 HydrophobicContact CE1-CG2 3.77Å; F743-V747 HydrophobicContact CZ-CG2 4.4Å; F743-V747 WeakPolarHBondContact O-CG2 3.24Å; F743-V747 PolarHBondContact O-N 3.15Å; V747-V749 PolarHBondContact O-N 3.07Å; V747-I750 PolarHBondContact O-N 3.09Å; V747-A751 WeakPolarHBondContact O-CB 3.32Å; V747-A751 PolarHBondContact O-N 3.48Å
748	G	73.2	Confident	68.8	Low	42 Å²	42	69.5 Å²	69.5	43%	0.433	42%	0.423	S	S	.	.	H	α-helix	trans	-62.3	-40	174.6	0	0	0	0	0	113.5	V744 V745 L746 L752	V744-G748 PolarHBondContact O-N 2.8Å; V745-G748 PolarHBondContact O-N 3.12Å; L746-G748 VanDerWaalsContact C-N 3.33Å; L746-G748 PolarHBondContact O-N 3.25Å; G748-L752 WeakPolarHBondContact O-CB 3.49Å; G748-L752 PolarHBondContact O-N 3.1Å
749	V	71.3	Confident	67.6	Low	58 Å²	58	72.5 Å²	72.5	35%	0.352	44%	0.444	S	S	.	.	H	α-helix	trans	-67.4	-42.7	174.5	172.3	0	0	0	0	111.3	V745 L746 V747 A751 L752 L753	V745-V749 WeakPolarHBondContact O-CG2 3.45Å; V745-V749 PolarHBondContact O-N 3.29Å; L746-V749 PolarHBondContact O-N 3.42Å; V747-V749 PolarHBondContact O-N 3.07Å; V749-A751 PolarHBondContact O-N 2.98Å; V749-L752 PolarHBondContact O-N 3.19Å; V749-L753 HydrophobicContact CG1-CD1 3.93Å; V749-L753 HydrophobicContact CG1-CG 4.43Å; V749-L753 WeakPolarHBondContact O-CG 3.29Å; V749-L753 PolarHBondContact O-N 2.9Å
750	I	70	Confident	66.5	Low	22 Å²	22	70.8 Å²	70.8	11%	0.113	44%	0.437	C	S	.	.	H	α-helix	trans	-58.2	-48.5	175.2	-71.6	164.4	0	0	0	110.6	L746 V747 L752 L753 E754 Y786 L789 I793	L746-I750 WeakPolarHBondContact O-CG1 3.29Å; L746-I750 PolarHBondContact O-N 3.02Å; V747-I750 PolarHBondContact O-N 3.09Å; I750-L752 VanDerWaalsContact C-N 3.31Å; I750-L752 PolarHBondContact O-N 3.46Å; I750-L753 PolarHBondContact O-N 3.32Å; I750-L753 VanDerWaalsContact O-N 3.15Å; I750-E754 HydrophobicContact CG2-CG 4.41Å; I750-E754 WeakPolarHBondContact O-CB 3.23Å; I750-E754 WeakPolarHBondContact O-CG 3.34Å; I750-E754 PolarHBondContact O-N 3.48Å; I750-Y786 HydrophobicContact CB-CE2 4.46Å; I750-Y786 HydrophobicContact CG1-CD2 4.13Å; I750-Y786 HydrophobicContact CG1-CE2 4.11Å; I750-Y786 HydrophobicContact CG2-CE2 4.11Å; I750-L789 HydrophobicContact CD1-CD2 3.95Å; I750-I793 HydrophobicContact CD1-CD1 3.95Å
751	A	73.1	Confident	65.2	Low	43 Å²	43	76.6 Å²	76.6	36%	0.355	46%	0.46	S	S	.	.	H	α-helix	trans	-62.2	-36.3	177.9	0	0	0	0	0	112.7	V747 V749 T755	V747-A751 WeakPolarHBondContact O-CB 3.32Å; V747-A751 PolarHBondContact O-N 3.48Å; V749-A751 PolarHBondContact O-N 2.98Å; A751-T755 WeakPolarHBondContact O-CB 3.24Å; A751-T755 WeakPolarHBondContact O-CG2 3.44Å; A751-T755 PolarHBondContact O-N 3.49Å; A751-T755 PolarHBondContact O-OG1 3.19Å
752	L	69.5	Low	64.1	Low	97 Å²	97	81.1 Å²	81.1	51%	0.508	48%	0.479	S	S	.	.	H	α-helix	trans	-68.1	-33.8	175.2	-166.1	75.8	0	0	0	112.7	G748 V749 I750 T755	G748-L752 WeakPolarHBondContact O-CB 3.49Å; G748-L752 PolarHBondContact O-N 3.1Å; V749-L752 PolarHBondContact O-N 3.19Å; I750-L752 VanDerWaalsContact C-N 3.31Å; I750-L752 PolarHBondContact O-N 3.46Å; L752-T755 PolarHBondContact O-OG1 3.09Å
753	L	66.2	Low	63	Low	42 Å²	42	88.2 Å²	88.2	22%	0.22	50%	0.495	C	S	.	.	H	α-helix	trans	-78.5	-33.8	177.9	-68.4	170.7	0	0	0	112.7	V749 I750 V778 F781 Y786	V749-L753 HydrophobicContact CG1-CD1 3.93Å; V749-L753 HydrophobicContact CG1-CG 4.43Å; V749-L753 WeakPolarHBondContact O-CG 3.29Å; V749-L753 PolarHBondContact O-N 2.9Å; I750-L753 PolarHBondContact O-N 3.32Å; I750-L753 VanDerWaalsContact O-N 3.15Å; L753-V778 HydrophobicContact CD2-CG1 4.21Å; L753-F781 HydrophobicContact CD1-CD1 4.34Å; L753-F781 HydrophobicContact CD1-CE1 4.08Å; L753-Y786 HydrophobicContact CD1-CD2 4.46Å
754	E	68.2	Low	62	Low	94 Å²	94	89.8 Å²	89.8	44%	0.439	51%	0.508	S	S	.	.	H	α-helix	trans	-80.2	-24.5	178.4	-71.2	-175.4	168.7	0	0	113.6	I750 T756 Y786 K790	I750-E754 HydrophobicContact CG2-CG 4.41Å; I750-E754 WeakPolarHBondContact O-CB 3.23Å; I750-E754 WeakPolarHBondContact O-CG 3.34Å; I750-E754 PolarHBondContact O-N 3.48Å; E754-T756 PolarHBondContact O-N 2.92Å; E754-Y786 WeakPolarHBondContact CG-OH 3.39Å; E754-Y786 PolarHBondContact OE1-OH 2.89Å; E754-K790 IonicContact OE1-NZ 2.67Å; E754-K790 PolarHBondContact OE1-NZ 2.85Å
755	T	64.8	Low	61	Low	62 Å²	62	90 Å²	90	38%	0.38	50%	0.503	S	S	.	.			trans	-74.7	110	177.2	39.8	0	0	0	0	111.3	A751 L752	A751-T755 WeakPolarHBondContact O-CB 3.24Å; A751-T755 WeakPolarHBondContact O-CG2 3.44Å; A751-T755 PolarHBondContact O-N 3.49Å; A751-T755 PolarHBondContact O-OG1 3.19Å; L752-T755 PolarHBondContact O-OG1 3.09Å
756	T	57.3	Low	60.3	Low	108 Å²	108	90 Å²	90	66%	0.663	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-70.6	131.4	164.9	45.9	0	0	0	0	109.3	E754 T758	E754-T756 PolarHBondContact O-N 2.92Å; T756-T758 PolarHBondContact O-N 3.01Å
757	P	52	Low	59.7	Low	57 Å²	57	91.3 Å²	91.3	37%	0.37	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-63.6	126.1	174.8	25.6	-32.5	0	0	0	109.2	Y769	P757-Y769 HydrophobicContact CB-CD2 4.1Å; P757-Y769 HydrophobicContact CB-CE2 4.28Å; P757-Y769 HydrophobicContact CB-CG 4.45Å; P757-Y769 HydrophobicContact CG-CD2 4.41Å; P757-Y769 HydrophobicContact CG-CG 4.34Å
758	T	52.3	Low	59.1	Low	126 Å²	126	94.6 Å²	94.6	77%	0.773	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-64.8	142.3	168.2	45.8	0	0	0	0	109.1	T756 S760	T756-T758 PolarHBondContact O-N 3.01Å; T758-S760 PolarHBondContact O-N 2.85Å
759	T	46	Very low	58.4	Low	143 Å²	143	96.7 Å²	96.7	88%	0.877	51%	0.514	S	S	*	.			trans	-59.7	101.2	-178.5	48.6	0	0	0	0	110.8
760	S	47.5	Very low	57.7	Low	58 Å²	58	99.7 Å²	99.7	41%	0.406	52%	0.524	S	S	.	.			trans	-125.7	142.2	168.2	77.6	0	0	0	0	109.2	T758 H762	T758-S760 PolarHBondContact O-N 2.85Å; S760-H762 PolarHBondContact O-N 3.14Å
761	N	44.2	Very low	57.3	Low	174 Å²	174	102.8 Å²	102.8	93%	0.93	54%	0.544	S	S	*	.	S	Bend	trans	-76.4	22.5	-165	-68.4	-13.5	0	0	0	114.8	Y763	N761-Y763 PolarHBondContact O-N 3.34Å
762	H	48.8	Very low	56.7	Low	127 Å²	127	103.3 Å²	103.3	59%	0.588	54%	0.543	S	S	*	.			trans	-91.4	100.6	174.4	-99.8	-74.2	0	0	0	111.4	S760 D764 Q765	S760-H762 PolarHBondContact O-N 3.14Å; H762-D764 VanDerWaalsContact C-N 3.28Å; H762-D764 PolarHBondContact O-N 3.33Å; H762-Q765 HydrophobicContact CB-CB 4.49Å; H762-Q765 HydrophobicContact CB-CG 4.38Å; H762-Q765 PolarHBondContact O-N 3.11Å; H762-Q765 VanDerWaalsContact O-N 3.12Å
763	Y	49.5	Very low	56.2	Low	204 Å²	204	104.3 Å²	104.3	80%	0.8	54%	0.54	S	S	*	.	H	α-helix	trans	-51.2	-44.2	179.8	-143.6	-94.1	0	0	0	112.5	N761 Q765 N766 V767	N761-Y763 PolarHBondContact O-N 3.34Å; Y763-Q765 VanDerWaalsContact C-N 3.34Å; Y763-Q765 PolarHBondContact O-N 3.3Å; Y763-N766 PolarHBondContact O-N 3.42Å; Y763-V767 HydrophobicContact CD1-CG2 4.38Å; Y763-V767 PolarHBondContact O-N 3.17Å
764	D	55.3	Low	55.8	Low	130 Å²	130	108.6 Å²	108.6	70%	0.695	56%	0.559	S	S	*	*	H	α-helix	trans	-60.1	-35.1	179.6	-75.9	-28.8	0	0	0	114.6	H762 F768	H762-D764 VanDerWaalsContact C-N 3.28Å; H762-D764 PolarHBondContact O-N 3.33Å; D764-F768 PolarHBondContact O-N 3.45Å
765	Q	53.4	Low	55.4	Low	109 Å²	109	107.8 Å²	107.8	51%	0.509	56%	0.557	S	S	.	*	H	α-helix	trans	-70.1	-41.1	179.2	-75.1	-173.6	-19.6	0	0	110.8	H762 Y763 V767 F768 Y769	H762-Q765 HydrophobicContact CB-CB 4.49Å; H762-Q765 HydrophobicContact CB-CG 4.38Å; H762-Q765 PolarHBondContact O-N 3.11Å; H762-Q765 VanDerWaalsContact O-N 3.12Å; Y763-Q765 VanDerWaalsContact C-N 3.34Å; Y763-Q765 PolarHBondContact O-N 3.3Å; Q765-V767 VanDerWaalsContact C-N 3.34Å; Q765-V767 PolarHBondContact O-N 3.18Å; Q765-F768 PolarHBondContact O-N 3.37Å; Q765-Y769 WeakPolarHBondContact O-CD2 3.46Å; Q765-Y769 PolarHBondContact O-N 3.16Å; Q765-Y769 VanDerWaalsContact O-N 3.09Å
766	N	56.2	Low	54.8	Low	79 Å²	79	112.4 Å²	112.4	42%	0.422	57%	0.573	S	S	.	*	H	α-helix	trans	-63.5	-38.8	178.5	-108.4	-24	0	0	0	112.4	Y763 F768 Y769 Q770	Y763-N766 PolarHBondContact O-N 3.42Å; N766-F768 PolarHBondContact O-N 2.88Å; N766-Y769 PolarHBondContact O-N 3.39Å; N766-Q770 PolarHBondContact O-N 2.9Å
767	V	60.1	Low	54.6	Low	77 Å²	77	113.7 Å²	113.7	47%	0.467	57%	0.574	S	S	.	*	H	α-helix	trans	-61.8	-43.3	176	176.1	0	0	0	0	111.2	Y763 Q765 T771	Y763-V767 HydrophobicContact CD1-CG2 4.38Å; Y763-V767 PolarHBondContact O-N 3.17Å; Q765-V767 VanDerWaalsContact C-N 3.34Å; Q765-V767 PolarHBondContact O-N 3.18Å; V767-T771 VanDerWaalsContact O-CB 3.28Å; V767-T771 WeakPolarHBondContact O-CB 3.5Å; V767-T771 PolarHBondContact O-N 2.65Å; V767-T771 PolarHBondContact O-OG1 3.36Å
768	F	61.4	Low	54.8	Low	134 Å²	134	112.3 Å²	112.3	59%	0.588	57%	0.565	S	S	*	*	H	α-helix	trans	-62	-48.5	176	-178.7	-97.1	0	0	0	112.1	D764 Q765 N766 Q770 T771 V772	D764-F768 PolarHBondContact O-N 3.45Å; Q765-F768 PolarHBondContact O-N 3.37Å; N766-F768 PolarHBondContact O-N 2.88Å; F768-Q770 PolarHBondContact O-N 3.28Å; F768-T771 PolarHBondContact O-N 3.38Å; F768-V772 HydrophobicContact CD1-CG2 4.42Å; F768-V772 HydrophobicContact CE1-CG2 4Å; F768-V772 HydrophobicContact CE2-CG2 4.14Å; F768-V772 HydrophobicContact CZ-CG2 3.85Å; F768-V772 WeakPolarHBondContact O-CG2 3.36Å; F768-V772 PolarHBondContact O-N 3.1Å
769	Y	58.5	Low	54.8	Low	86 Å²	86	110.5 Å²	110.5	34%	0.337	55%	0.55	S	S	.	*	H	α-helix	trans	-60.7	-42.8	178.9	-80.4	-71.2	0	0	0	112.6	P757 Q765 N766 R773	P757-Y769 HydrophobicContact CB-CD2 4.1Å; P757-Y769 HydrophobicContact CB-CE2 4.28Å; P757-Y769 HydrophobicContact CB-CG 4.45Å; P757-Y769 HydrophobicContact CG-CD2 4.41Å; P757-Y769 HydrophobicContact CG-CG 4.34Å; Q765-Y769 WeakPolarHBondContact O-CD2 3.46Å; Q765-Y769 PolarHBondContact O-N 3.16Å; Q765-Y769 VanDerWaalsContact O-N 3.09Å; N766-Y769 PolarHBondContact O-N 3.39Å; Y769-R773 VanDerWaalsContact O-CB 3.24Å; Y769-R773 WeakPolarHBondContact O-CB 3.45Å; Y769-R773 PolarHBondContact O-N 3.1Å
770	Q	58.3	Low	55.5	Low	121 Å²	121	106.6 Å²	106.6	57%	0.565	52%	0.524	S	S	*	.	H	α-helix	trans	-69.1	-39.6	176.4	-71.1	-162.6	0.8	0	0	112.7	N766 F768 V772 R773 H774	N766-Q770 PolarHBondContact O-N 2.9Å; F768-Q770 PolarHBondContact O-N 3.28Å; Q770-V772 VanDerWaalsContact C-N 3.32Å; Q770-V772 PolarHBondContact O-N 3.01Å; Q770-R773 PolarHBondContact O-N 3.34Å; Q770-H774 PolarHBondContact O-N 3.42Å
771	T	60.9	Low	56.3	Low	87 Å²	87	106.9 Å²	106.9	53%	0.534	52%	0.519	S	S	.	.	H	α-helix	trans	-64.5	-36.2	179.3	-56	0	0	0	0	112.1	V767 F768	V767-T771 VanDerWaalsContact O-CB 3.28Å; V767-T771 WeakPolarHBondContact O-CB 3.5Å; V767-T771 PolarHBondContact O-N 2.65Å; V767-T771 PolarHBondContact O-OG1 3.36Å; F768-T771 PolarHBondContact O-N 3.38Å
772	V	59.7	Low	57	Low	55 Å²	55	103.7 Å²	103.7	33%	0.333	50%	0.498	S	S	.	.	H	α-helix	trans	-71.1	-44.5	172.3	174.7	0	0	0	0	110.7	F768 Q770 H774 N775 V778	F768-V772 HydrophobicContact CD1-CG2 4.42Å; F768-V772 HydrophobicContact CE1-CG2 4Å; F768-V772 HydrophobicContact CE2-CG2 4.14Å; F768-V772 HydrophobicContact CZ-CG2 3.85Å; F768-V772 WeakPolarHBondContact O-CG2 3.36Å; F768-V772 PolarHBondContact O-N 3.1Å; Q770-V772 VanDerWaalsContact C-N 3.32Å; Q770-V772 PolarHBondContact O-N 3.01Å; V772-H774 PolarHBondContact O-N 2.86Å; V772-N775 PolarHBondContact O-N 3.47Å; V772-V778 WeakPolarHBondContact O-CG2 3.41Å
773	R	59.1	Low	57.9	Low	118 Å²	118	104 Å²	104	45%	0.445	50%	0.5	S	S	.	.	H	α-helix	trans	-69.8	-29.1	-174.6	-164	177.5	-169.5	105.3	3.5	114.3	Y769 Q770	Y769-R773 VanDerWaalsContact O-CB 3.24Å; Y769-R773 WeakPolarHBondContact O-CB 3.45Å; Y769-R773 PolarHBondContact O-N 3.1Å; Q770-R773 PolarHBondContact O-N 3.34Å
774	H	58.4	Low	58.4	Low	132 Å²	132	102.4 Å²	102.4	61%	0.611	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	20.9	179.3	-66.1	-38.7	0	0	0	113.7	Q770 V772	Q770-H774 PolarHBondContact O-N 3.42Å; V772-H774 PolarHBondContact O-N 2.86Å
775	N	60.7	Low	58.8	Low	77 Å²	77	99.3 Å²	99.3	41%	0.412	48%	0.479	S	S	.	.			trans	-74.3	132.8	169.7	-158.8	-59.6	0	0	0	109.3	V772 L777 V778	V772-N775 PolarHBondContact O-N 3.47Å; N775-L777 PolarHBondContact O-N 3.44Å; N775-L777 PolarHBondContact OD1-N 2.98Å; N775-V778 HydrophobicContact CB-CG2 4.27Å; N775-V778 WeakPolarHBondContact O-CA 3.19Å; N775-V778 WeakPolarHBondContact O-CB 3.39Å; N775-V778 PolarHBondContact O-N 3.23Å
776	F	51.9	Low	59.4	Low	159 Å²	159	95.5 Å²	95.5	70%	0.697	46%	0.46	S	S	*	.	H	α-helix	trans	-54.9	-27.1	-178.8	-179.9	-100	0	0	0	113.8	V778 N780	F776-V778 VanDerWaalsContact C-N 3.32Å; F776-N780 WeakPolarHBondContact CE1-ND2 3.38Å; F776-N780 WeakPolarHBondContact CZ-ND2 3.44Å; F776-N780 PolarHBondContact O-ND2 3.48Å
777	L	52.8	Low	60	Low	134 Å²	134	95.3 Å²	95.3	70%	0.702	46%	0.462	S	S	*	.	H	α-helix	trans	-67.5	-29.1	172.8	-75.3	169	0	0	0	113.3	N775 F781	N775-L777 PolarHBondContact O-N 3.44Å; N775-L777 PolarHBondContact OD1-N 2.98Å; L777-F781 WeakPolarHBondContact O-CB 3.44Å; L777-F781 PolarHBondContact O-N 3.24Å
778	V	56.5	Low	60.7	Low	28 Å²	28	95 Å²	95	17%	0.17	46%	0.461	C	S	.	.	H	α-helix	trans	-81.9	-38	-176.1	174.7	0	0	0	0	112.2	L753 V772 N775 F776 F781 Q782	L753-V778 HydrophobicContact CD2-CG1 4.21Å; V772-V778 WeakPolarHBondContact O-CG2 3.41Å; N775-V778 HydrophobicContact CB-CG2 4.27Å; N775-V778 WeakPolarHBondContact O-CA 3.19Å; N775-V778 WeakPolarHBondContact O-CB 3.39Å; N775-V778 PolarHBondContact O-N 3.23Å; F776-V778 VanDerWaalsContact C-N 3.32Å; V778-F781 WeakPolarHBondContact O-CB 3.46Å; V778-F781 PolarHBondContact O-N 2.85Å; V778-Q782 WeakPolarHBondContact O-CB 3.3Å; V778-Q782 PolarHBondContact O-N 3.36Å
779	D	52.7	Low	60.9	Low	88 Å²	88	91 Å²	91	47%	0.471	45%	0.446	S	S	.	.	H	α-helix	trans	-61.2	-47.6	173.9	-69.8	-39.5	0	0	0	111	F781 Q782 E783	D779-F781 VanDerWaalsContact C-N 3.34Å; D779-F781 PolarHBondContact O-N 3.27Å; D779-Q782 WeakPolarHBondContact O-CB 3.31Å; D779-Q782 PolarHBondContact O-N 2.92Å; D779-Q782 VanDerWaalsContact O-N 3.15Å; D779-E783 PolarHBondContact O-N 3.33Å
780	N	59.9	Low	61.5	Low	62 Å²	62	90.7 Å²	90.7	33%	0.332	45%	0.446	S	S	.	.	H	α-helix	trans	-64.4	-36.4	174.1	-71.7	-72.6	0	0	0	112.4	F776 Q782 Y784	F776-N780 WeakPolarHBondContact CE1-ND2 3.38Å; F776-N780 WeakPolarHBondContact CZ-ND2 3.44Å; F776-N780 PolarHBondContact O-ND2 3.48Å; N780-Q782 VanDerWaalsContact C-N 3.28Å; N780-Q782 PolarHBondContact O-N 3.44Å; N780-Y784 WeakPolarHBondContact O-CB 3.3Å; N780-Y784 WeakPolarHBondContact O-CD2 3.33Å; N780-Y784 PolarHBondContact O-N 2.9Å
781	F	63.8	Low	62.2	Low	64 Å²	64	89.7 Å²	89.7	28%	0.281	44%	0.443	S	S	.	.	H	α-helix	trans	-63.8	-35.4	173.8	-175.6	-92.1	0	0	0	111.7	L753 L777 V778 D779 V785 Y786	L753-F781 HydrophobicContact CD1-CD1 4.34Å; L753-F781 HydrophobicContact CD1-CE1 4.08Å; L777-F781 WeakPolarHBondContact O-CB 3.44Å; L777-F781 PolarHBondContact O-N 3.24Å; V778-F781 WeakPolarHBondContact O-CB 3.46Å; V778-F781 PolarHBondContact O-N 2.85Å; D779-F781 VanDerWaalsContact C-N 3.34Å; D779-F781 PolarHBondContact O-N 3.27Å; F781-V785 HydrophobicContact CD2-CB 3.77Å; F781-V785 HydrophobicContact CD2-CG1 4.06Å; F781-V785 HydrophobicContact CD2-CG2 3.97Å; F781-V785 HydrophobicContact CE2-CB 3.82Å; F781-V785 HydrophobicContact CE2-CG1 3.56Å; F781-V785 HydrophobicContact CE2-CG2 4.29Å; F781-V785 HydrophobicContact CG-CB 4.2Å; F781-V785 HydrophobicContact CZ-CB 4.29Å; F781-V785 HydrophobicContact CZ-CG1 3.9Å; F781-V785 WeakPolarHBondContact O-CB 3.45Å; F781-V785 PolarHBondContact O-N 3.36Å; F781-Y786 PolarHBondContact O-N 2.86Å
782	Q	60.4	Low	62.7	Low	106 Å²	106	89.3 Å²	89.3	50%	0.495	44%	0.444	S	S	.	.	I	π-helix	trans	-65.1	-43.8	-178	-163.2	172.1	-52.2	0	0	111.8	V778 D779 N780 Y786 T787	V778-Q782 WeakPolarHBondContact O-CB 3.3Å; V778-Q782 PolarHBondContact O-N 3.36Å; D779-Q782 WeakPolarHBondContact O-CB 3.31Å; D779-Q782 PolarHBondContact O-N 2.92Å; D779-Q782 VanDerWaalsContact O-N 3.15Å; N780-Q782 VanDerWaalsContact C-N 3.28Å; N780-Q782 PolarHBondContact O-N 3.44Å; Q782-Y786 HydrophobicContact CG-CD1 4.11Å; Q782-T787 WeakPolarHBondContact O-CB 3.47Å; Q782-T787 PolarHBondContact O-N 3.46Å; Q782-T787 VanDerWaalsContact O-N 3.12Å; Q782-T787 PolarHBondContact O-OG1 2.87Å
783	E	65.7	Low	63.2	Low	135 Å²	135	88.4 Å²	88.4	63%	0.631	44%	0.437	S	S	*	.	I	π-helix	trans	-77.4	-52.4	179.3	-169.7	167.7	-161.7	0	0	112.5	D779 P788	D779-E783 PolarHBondContact O-N 3.33Å; E783-P788 WeakPolarHBondContact O-CD 3.44Å
784	Y	60.3	Low	63.8	Low	169 Å²	169	86.4 Å²	86.4	66%	0.663	44%	0.438	S	S	*	.	I	π-helix	trans	-86.2	-22.4	-169.7	-68.5	-74.3	0	0	0	115.4	N780	N780-Y784 WeakPolarHBondContact O-CB 3.3Å; N780-Y784 WeakPolarHBondContact O-CD2 3.33Å; N780-Y784 PolarHBondContact O-N 2.9Å
785	V	64.7	Low	64.6	Low	65 Å²	65	84.7 Å²	84.7	39%	0.394	43%	0.433	S	S	.	.	I	π-helix	trans	-120.2	-55.3	-174	-174	0	0	0	0	111.9	F781 L789	F781-V785 HydrophobicContact CD2-CB 3.77Å; F781-V785 HydrophobicContact CD2-CG1 4.06Å; F781-V785 HydrophobicContact CD2-CG2 3.97Å; F781-V785 HydrophobicContact CE2-CB 3.82Å; F781-V785 HydrophobicContact CE2-CG1 3.56Å; F781-V785 HydrophobicContact CE2-CG2 4.29Å; F781-V785 HydrophobicContact CG-CB 4.2Å; F781-V785 HydrophobicContact CZ-CB 4.29Å; F781-V785 HydrophobicContact CZ-CG1 3.9Å; F781-V785 WeakPolarHBondContact O-CB 3.45Å; F781-V785 PolarHBondContact O-N 3.36Å; V785-L789 WeakPolarHBondContact O-CB 3.29Å; V785-L789 PolarHBondContact O-N 2.94Å
786	Y	64.7	Low	65.2	Low	30 Å²	30	82.6 Å²	82.6	12%	0.118	43%	0.429	C	S	.	.	I	π-helix	trans	-65.7	-47.5	-174.4	171.3	-90.7	0	0	0	112.2	I750 L753 E754 F781 Q782 L789 K790	I750-Y786 HydrophobicContact CB-CE2 4.46Å; I750-Y786 HydrophobicContact CG1-CD2 4.13Å; I750-Y786 HydrophobicContact CG1-CE2 4.11Å; I750-Y786 HydrophobicContact CG2-CE2 4.11Å; L753-Y786 HydrophobicContact CD1-CD2 4.46Å; E754-Y786 WeakPolarHBondContact CG-OH 3.39Å; E754-Y786 PolarHBondContact OE1-OH 2.89Å; F781-Y786 PolarHBondContact O-N 2.86Å; Q782-Y786 HydrophobicContact CG-CD1 4.11Å; Y786-L789 PolarHBondContact O-N 2.77Å; Y786-K790 HydrophobicContact CE1-CD 3.89Å; Y786-K790 WeakPolarHBondContact O-CB 3.49Å; Y786-K790 PolarHBondContact O-N 3.46Å; Y786-K790 WeakPolarHBondContact OH-CD 3.3Å; Y786-K790 PolarHBondContact OH-NZ 2.85Å; Y786-K790 VanDerWaalsContact OH-NZ 3.09Å
787	T	70.7	Confident	66	Low	74 Å²	74	81 Å²	81	45%	0.454	42%	0.422	S	S	.	.	H	α-helix	trans	-65.1	-48.7	-175.8	-58.8	0	0	0	0	113.1	Q782 L789 K790 M791	Q782-T787 WeakPolarHBondContact O-CB 3.47Å; Q782-T787 PolarHBondContact O-N 3.46Å; Q782-T787 VanDerWaalsContact O-N 3.12Å; Q782-T787 PolarHBondContact O-OG1 2.87Å; T787-L789 PolarHBondContact O-N 2.88Å; T787-K790 PolarHBondContact O-N 3.35Å; T787-M791 PolarHBondContact O-N 3.11Å
788	P	72.9	Confident	66.7	Low	70 Å²	70	78.5 Å²	78.5	46%	0.455	42%	0.416	S	S	.	.	H	α-helix	trans	-63.1	-39.5	175.6	-22.8	34.1	0	0	0	113.2	E783 S792	E783-P788 WeakPolarHBondContact O-CD 3.44Å; P788-S792 PolarHBondContact O-N 3.44Å; P788-S792 PolarHBondContact O-OG 3.32Å
789	L	66.4	Low	67.2	Low	50 Å²	50	83.5 Å²	83.5	26%	0.262	44%	0.436	S	S	.	.	H	α-helix	trans	-70.5	-41	-179.5	-173.2	98	0	0	0	111.7	L746 I750 V785 Y786 T787 M791 S792 I793	L746-L789 HydrophobicContact CD1-CD2 3.89Å; L746-L789 HydrophobicContact CD2-CD1 3.86Å; L746-L789 HydrophobicContact CD2-CD2 3.45Å; L746-L789 VanDerWaalsContact CD2-CD2 3.45Å; L746-L789 HydrophobicContact CD2-CG 4.24Å; L746-L789 HydrophobicContact CG-CD2 3.61Å; I750-L789 HydrophobicContact CD1-CD2 3.95Å; V785-L789 WeakPolarHBondContact O-CB 3.29Å; V785-L789 PolarHBondContact O-N 2.94Å; Y786-L789 PolarHBondContact O-N 2.77Å; T787-L789 PolarHBondContact O-N 2.88Å; L789-M791 VanDerWaalsContact C-N 3.34Å; L789-M791 PolarHBondContact O-N 3.34Å; L789-S792 WeakPolarHBondContact O-CB 3.46Å; L789-S792 PolarHBondContact O-N 2.82Å; L789-S792 VanDerWaalsContact O-N 3.1Å; L789-I793 HydrophobicContact CD2-CD1 3.93Å; L789-I793 WeakPolarHBondContact O-CG1 3.41Å; L789-I793 HydrophobicContact CG-CD1 4.05Å; L789-I793 PolarHBondContact O-N 3.1Å
790	K	70.4	Confident	67.3	Low	81 Å²	81	84 Å²	84	35%	0.352	44%	0.438	S	S	.	.	H	α-helix	trans	-58.5	-46.2	175	177	163	176.8	162.3	0	110.9	E754 Y786 T787 S792 I793 V794	E754-K790 IonicContact OE1-NZ 2.67Å; E754-K790 PolarHBondContact OE1-NZ 2.85Å; Y786-K790 HydrophobicContact CE1-CD 3.89Å; Y786-K790 WeakPolarHBondContact O-CB 3.49Å; Y786-K790 PolarHBondContact O-N 3.46Å; Y786-K790 WeakPolarHBondContact OH-CD 3.3Å; Y786-K790 PolarHBondContact OH-NZ 2.85Å; Y786-K790 VanDerWaalsContact OH-NZ 3.09Å; T787-K790 PolarHBondContact O-N 3.35Å; K790-S792 VanDerWaalsContact C-N 3.34Å; K790-S792 PolarHBondContact O-N 3.45Å; K790-I793 PolarHBondContact O-N 3.26Å; K790-V794 HydrophobicContact CG-CG2 4.48Å; K790-V794 WeakPolarHBondContact O-CB 3.49Å; K790-V794 VanDerWaalsContact O-CG2 3.3Å; K790-V794 WeakPolarHBondContact O-CG2 3.29Å; K790-V794 PolarHBondContact O-N 2.67Å
791	M	73.7	Confident	67.2	Low	99 Å²	99	86 Å²	86	49%	0.488	45%	0.446	S	S	.	.	H	α-helix	trans	-63.8	-38.1	173.7	-71.1	-52.4	-57.3	0	0	112.5	T787 L789 I793 V794 N795	T787-M791 PolarHBondContact O-N 3.11Å; L789-M791 VanDerWaalsContact C-N 3.34Å; L789-M791 PolarHBondContact O-N 3.34Å; M791-I793 PolarHBondContact O-N 2.97Å; M791-V794 PolarHBondContact O-N 3.31Å; M791-N795 PolarHBondContact O-ND2 2.91Å; M791-N795 PolarHBondContact O-OD1 3.48Å; M791-N795 PolarHBondContact O-N 3.48Å; M791-N795 WeakPolarHBondContact O-CB 3.37Å; M791-N795 VanDerWaalsContact O-CB 3.23Å
792	S	72.1	Confident	67.3	Low	79 Å²	79	86.2 Å²	86.2	55%	0.552	46%	0.456	S	S	*	.	H	α-helix	trans	-63.5	-40.2	175.3	-58.2	0	0	0	0	112.6	P788 L789 K790 G796	P788-S792 PolarHBondContact O-N 3.44Å; P788-S792 PolarHBondContact O-OG 3.32Å; L789-S792 WeakPolarHBondContact O-CB 3.46Å; L789-S792 PolarHBondContact O-N 2.82Å; L789-S792 VanDerWaalsContact O-N 3.1Å; K790-S792 VanDerWaalsContact C-N 3.34Å; K790-S792 PolarHBondContact O-N 3.45Å; S792-G796 PolarHBondContact O-N 2.95Å
793	I	68.8	Low	66.9	Low	37 Å²	37	89.7 Å²	89.7	19%	0.19	47%	0.466	C	S	.	.	H	α-helix	trans	-68.9	-45.5	176.9	-68	168.2	0	0	0	110.6	F743 I750 L789 K790 M791 G796 F797	F743-I793 HydrophobicContact CE2-CD1 4.42Å; F743-I793 HydrophobicContact CE2-CG1 4.27Å; F743-I793 HydrophobicContact CZ-CD1 4.44Å; F743-I793 HydrophobicContact CZ-CG1 4.29Å; I750-I793 HydrophobicContact CD1-CD1 3.95Å; L789-I793 HydrophobicContact CD2-CD1 3.93Å; L789-I793 WeakPolarHBondContact O-CG1 3.41Å; L789-I793 HydrophobicContact CG-CD1 4.05Å; L789-I793 PolarHBondContact O-N 3.1Å; K790-I793 PolarHBondContact O-N 3.26Å; M791-I793 PolarHBondContact O-N 2.97Å; I793-G796 PolarHBondContact O-N 3.45Å; I793-F797 HydrophobicContact CG2-CD2 4.03Å; I793-F797 HydrophobicContact CG2-CE2 4.41Å; I793-F797 WeakPolarHBondContact O-CB 3.25Å; I793-F797 PolarHBondContact O-N 2.7Å
794	V	73.3	Confident	66.3	Low	76 Å²	76	88.6 Å²	88.6	46%	0.461	46%	0.463	S	S	.	.	H	α-helix	trans	-62.2	-45.3	177.4	170.1	0	0	0	0	111.1	K790 M791 F797 S798	K790-V794 HydrophobicContact CG-CG2 4.48Å; K790-V794 WeakPolarHBondContact O-CB 3.49Å; K790-V794 VanDerWaalsContact O-CG2 3.3Å; K790-V794 WeakPolarHBondContact O-CG2 3.29Å; K790-V794 PolarHBondContact O-N 2.67Å; M791-V794 PolarHBondContact O-N 3.31Å; V794-F797 PolarHBondContact O-N 2.92Å; V794-S798 WeakPolarHBondContact O-CB 3.23Å; V794-S798 PolarHBondContact O-N 2.97Å
795	N	74.7	Confident	65.4	Low	96 Å²	96	86.2 Å²	86.2	51%	0.513	46%	0.462	S	S	.	.	H	α-helix	trans	-64.2	-41.3	176.4	-68.3	-10.7	0	0	0	111.5	M791 S798 F799	M791-N795 PolarHBondContact O-ND2 2.91Å; M791-N795 PolarHBondContact O-OD1 3.48Å; M791-N795 PolarHBondContact O-N 3.48Å; M791-N795 WeakPolarHBondContact O-CB 3.37Å; M791-N795 VanDerWaalsContact O-CB 3.23Å; N795-S798 PolarHBondContact O-N 2.98Å; N795-F799 WeakPolarHBondContact O-CB 3.5Å; N795-F799 PolarHBondContact O-N 3.33Å
796	G	71.8	Confident	64.2	Low	33 Å²	33	92.1 Å²	92.1	34%	0.34	50%	0.502	S	S	.	.	H	α-helix	trans	-63.1	-41.5	175.4	0	0	0	0	0	113.2	S792 I793 F799 L800	S792-G796 PolarHBondContact O-N 2.95Å; I793-G796 PolarHBondContact O-N 3.45Å; G796-F799 PolarHBondContact O-N 3.23Å; G796-L800 PolarHBondContact O-N 3.25Å; G796-L800 WeakPolarHBondContact O-CB 3.39Å
797	F	69.1	Low	64.2	Low	125 Å²	125	95.2 Å²	95.2	55%	0.548	52%	0.521	S	S	.	.	H	α-helix	trans	-67.2	-41.2	173	-101.3	-80.6	0	0	0	112.3	I793 V794 F799 L800 M801	I793-F797 HydrophobicContact CG2-CD2 4.03Å; I793-F797 HydrophobicContact CG2-CE2 4.41Å; I793-F797 WeakPolarHBondContact O-CB 3.25Å; I793-F797 PolarHBondContact O-N 2.7Å; V794-F797 PolarHBondContact O-N 2.92Å; F797-F799 VanDerWaalsContact C-N 3.3Å; F797-F799 PolarHBondContact O-N 3.49Å; F797-L800 PolarHBondContact O-N 3.13Å; F797-M801 PolarHBondContact O-N 2.86Å; F797-M801 WeakPolarHBondContact O-CG 3.4Å; F797-M801 VanDerWaalsContact O-CG 3.25Å; F797-M801 WeakPolarHBondContact O-CB 3.35Å
798	S	68	Low	63.8	Low	82 Å²	82	96.3 Å²	96.3	57%	0.573	52%	0.524	S	S	*	.	H	α-helix	trans	-62.6	-39	176.1	-165.3	0	0	0	0	111.6	V794 N795 S802	V794-S798 WeakPolarHBondContact O-CB 3.23Å; V794-S798 PolarHBondContact O-N 2.97Å; N795-S798 PolarHBondContact O-N 2.98Å; S798-S802 PolarHBondContact O-N 3.24Å
799	F	67.6	Low	63.3	Low	133 Å²	133	97.8 Å²	97.8	58%	0.583	53%	0.528	S	S	*	.	H	α-helix	trans	-65.3	-47.3	174.1	-175.9	-98.4	0	0	0	111.8	N795 G796 F797 M801 S802 Y803	N795-F799 WeakPolarHBondContact O-CB 3.5Å; N795-F799 PolarHBondContact O-N 3.33Å; G796-F799 PolarHBondContact O-N 3.23Å; F797-F799 VanDerWaalsContact C-N 3.3Å; F797-F799 PolarHBondContact O-N 3.49Å; F799-M801 PolarHBondContact O-N 3.05Å; F799-S802 PolarHBondContact O-N 2.92Å; F799-S802 PolarHBondContact O-OG 2.69Å; F799-Y803 HydrophobicContact CE1-CE2 4Å; F799-Y803 PolarHBondContact O-N 3.44Å; F799-Y803 HydrophobicContact CZ-CE2 3.69Å; F799-Y803 AromaticContact CZ-CE2 3.69Å; F799-Y803 HydrophobicContact CZ-CD2 4.28Å; F799-Y803 HydrophobicContact CE2-CE2 4.22Å; F799-Y803 HydrophobicContact CE1-CD2 4.22Å
800	L	53.9	Low	63.2	Low	99 Å²	99	100.6 Å²	100.6	52%	0.518	54%	0.544	S	S	.	.	H	α-helix	trans	-60.1	-41.9	174.6	-93.3	160.3	0	0	0	112.8	G796 F797 S802 Y803 I804	G796-L800 PolarHBondContact O-N 3.25Å; G796-L800 WeakPolarHBondContact O-CB 3.39Å; F797-L800 PolarHBondContact O-N 3.13Å; L800-S802 VanDerWaalsContact C-N 3.32Å; L800-S802 PolarHBondContact O-N 3.26Å; L800-Y803 PolarHBondContact O-N 3.4Å; L800-Y803 VanDerWaalsContact O-N 3.11Å; L800-I804 WeakPolarHBondContact O-CG1 3.4Å; L800-I804 PolarHBondContact O-N 3.11Å
801	M	57.2	Low	62.7	Low	102 Å²	102	101.8 Å²	101.8	50%	0.502	56%	0.556	S	S	.	*	H	α-helix	trans	-66.6	-33.7	178	-70.8	-66.7	-77.5	0	0	112	F797 F799 Y803 I804 N805	F797-M801 PolarHBondContact O-N 2.86Å; F797-M801 WeakPolarHBondContact O-CG 3.4Å; F797-M801 VanDerWaalsContact O-CG 3.25Å; F797-M801 WeakPolarHBondContact O-CB 3.35Å; F799-M801 PolarHBondContact O-N 3.05Å; M801-Y803 PolarHBondContact O-N 3.46Å; M801-I804 PolarHBondContact O-N 3.39Å; M801-N805 PolarHBondContact O-N 3.05Å
802	S	66.5	Low	62	Low	70 Å²	70	102 Å²	102	49%	0.49	56%	0.56	S	S	.	*	H	α-helix	trans	-67.1	-14.4	172.7	73.1	0	0	0	0	114.5	S798 F799 L800	S798-S802 PolarHBondContact O-N 3.24Å; F799-S802 PolarHBondContact O-N 2.92Å; F799-S802 PolarHBondContact O-OG 2.69Å; L800-S802 VanDerWaalsContact C-N 3.32Å; L800-S802 PolarHBondContact O-N 3.26Å
803	Y	51.3	Low	61.2	Low	179 Å²	179	103.6 Å²	103.6	70%	0.702	56%	0.561	S	S	*	*	H	α-helix	trans	-94.3	-16.5	169.7	-94.4	-87	0	0	0	113.7	F799 L800 M801	F799-Y803 HydrophobicContact CE1-CE2 4Å; F799-Y803 PolarHBondContact O-N 3.44Å; F799-Y803 HydrophobicContact CZ-CE2 3.69Å; F799-Y803 AromaticContact CZ-CE2 3.69Å; F799-Y803 HydrophobicContact CZ-CD2 4.28Å; F799-Y803 HydrophobicContact CE2-CE2 4.22Å; F799-Y803 HydrophobicContact CE1-CD2 4.22Å; L800-Y803 PolarHBondContact O-N 3.4Å; L800-Y803 VanDerWaalsContact O-N 3.11Å; M801-Y803 PolarHBondContact O-N 3.46Å
804	I	53.2	Low	60.7	Low	111 Å²	111	108.8 Å²	108.8	57%	0.569	59%	0.59	S	S	*	*	H	α-helix	trans	-99.4	-26.3	-177.2	-65.8	168.7	0	0	0	111.5	L800 M801	L800-I804 WeakPolarHBondContact O-CG1 3.4Å; L800-I804 PolarHBondContact O-N 3.11Å; M801-I804 PolarHBondContact O-N 3.39Å
805	N	42.5	Very low	59.6	Low	119 Å²	119	111.5 Å²	111.5	64%	0.636	60%	0.6	S	S	*	*			trans	-126.6	108.5	163.9	-81.9	-37.6	0	0	0	108.7	M801	M801-N805 PolarHBondContact O-N 3.05Å
806	P	39.5	Very low	58.2	Low	189 Å²	189	112.9 Å²	112.9	100%	1.227	61%	0.608	S	S	*	*			trans	-74.2	0	171.4	33.1	-35.5	0	0	0	112.8

Retrieved 806 of 806 residues in 290.7 ms (Link to these results)

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