A0A3Q0KLG3_SCHMA Loading...

Tyrosine-protein kinase

AlphaFold DB , UniProt , Accession A0A3Q0KLG3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,308 aa.

						>A0A3Q0KLG3_SCHMA|A0A3Q0KLG3
MGAQHTKERPRRTYHPKVDHELQINTSTSWIQNHNPPTNFKGSVAHTSQINQPSDQLLIALFDFTPPNTLENQSQVRVEKGDRLQLFGYSADGDWSDVECIRTNERGWIPTNYTGRIPVPPNDHSTTLNTGSASGSSLTFQHTSSHDVSCNGSQGSLARVGLESEKWYHGAIQRSYAEYLLNSGITGSFLIRESESHPGQLTISLRYEGQIWHYRIHRDDSNMYYVIESNKFTSVSDLVHHHEKHSDGLACTLLYPAPKRDRTSSELRMDPSFDIREIDRTEIVMKHKLGSGQYGVVYEAVWKPYNVLVAVKTLKENVTVRDEFLEEARLMKSLRHPNLVTLLGACTREPPYYIVTEFMCNGNLLDYLRTHPRTELTPSVLLHMATQVARGMAYLEQHNFIHRDLAARNCLVGTQHTIKVADFGLARCIERDLTYRAHEGAKFPIKWTAPEGLVYNLFSTKSDVWAFGILLWEIATYGKTPYPGVELQDVYVLLERGTRMLCPEGCPEPVYELMLQCWQWLPEQRPPFSDILNQLESMPTNSTMEEEEEQIDFDITSTTSSSSLLLNNNEIKVINSSESNRSIKHPPNIAYPRPPLPPRPPPPRRSTSCDYLIDENDDNQFDMIKEDSKSDLGSDIPVNAMNNNKNNVSHKSHRGIFTRSFKNPLSKQLHIGDLSTDEFGTAEKDLPFTNSGSLGRKRTAPRPPRRTTPVKPLNFLTDFNLLEDNNCVCPNPYRDDFDHAPLPPPPVHLDSSHHQIHQTRSQQHPRPAPQSNNGSLSNNSNSTPFSVPSVMSSSAIFPSSRQFSYVDPIPLDNSLTRSICPDRLISPLAPPTPSKHVQLSSKSPALSKSTVNSDLSNKTNPVVDDCHNKRSMDSNFLNESYSGNNVSSKPNVHPTNISSSVFQEELRDRLKQHSQQLKSSSQQKPITPKTVPNNSPCNVTNSVMCNQEKSDSKSSVSNSSPYFTIPRLRPPPRSANPPLISSNNTSGSSNNQMSTRGKVEPPHCSSELIRSLASTQIKNDNASNSTVTTTSKLPTNINSNNNNSPKPHFKRSENEISDKLSDIIQKRLSWTGPTDDNSAGNQKRSQRLYLPTILSTSSTALDETNGNNHCVPPTKYHLKKHLSNILKELERLIRMNDKKIPGNITSSPSSAAISSSSSTSNLEQLIELADQMEACRLSCSAYIDQATCSARAKFNFRDRFSCLQTFSSLLRSKRLDSICNNNTSNLSKYNKNNTNLLKDAENAIKEIINDLDKLTDNVNTTLTLETTLNNSNFPEHKPNSNLATSNQSNLTCTENLSITDNRSATVFT
					

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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	35.9	Very low	35.5	Very low	249 Å²	249	164.2 Å²	164.2	100%	1.227	84%	0.836	S	S	*	*				0	132.7	0	-54.2	-171.9	-70.6	0	0	107
2	G	37.5	Very low	35.2	Very low	71 Å²	71	170.4 Å²	170.4	73%	0.732	84%	0.842	S	S	*	*			cis	-159.9	144.4	-14.4	0	0	0	0	0	106.2
3	A	32.4	Very low	34.8	Very low	97 Å²	97	167.2 Å²	167.2	80%	0.802	84%	0.838	S	S	*	*			cis	81.2	132.4	45.2	0	0	0	0	0	114.1
4	Q	35.8	Very low	34.3	Very low	188 Å²	188	171.6 Å²	171.6	88%	0.879	84%	0.842	S	S	*	*			trans	75.8	127.7	176.8	-52.8	177.6	-2.6	0	0	115.4
5	H	36.6	Very low	34.1	Very low	165 Å²	165	171.8 Å²	171.8	76%	0.764	84%	0.84	S	S	*	*			cis	75.8	111	44.8	-93.8	-54.9	0	0	0	116.2
6	T	41.7	Very low	34.2	Very low	141 Å²	141	168.6 Å²	168.6	87%	0.865	84%	0.836	S	S	*	*			trans	-124.9	169.5	144.1	49.1	0	0	0	0	109.1
7	K	35.6	Very low	34.2	Very low	180 Å²	180	169.7 Å²	169.7	78%	0.783	84%	0.835	S	S	*	*			trans	-137.2	176.4	-168.9	-80.2	-178.3	174	177.1	0	111.4
8	E	32.8	Very low	34.2	Very low	150 Å²	150	168 Å²	168	70%	0.701	84%	0.835	S	S	*	*			trans	82.1	145.3	163.2	-55.4	-149.3	111.3	0	0	117.6
9	R	32.5	Very low	34.2	Very low	214 Å²	214	166.1 Å²	166.1	81%	0.808	83%	0.829	S	S	*	*			cis	-160.7	155.3	-27.1	-119.7	-176.9	167.3	144.1	-16.3	108.2
10	P	36.6	Very low	34.3	Very low	117 Å²	117	165.7 Å²	165.7	76%	0.76	82%	0.824	S	S	*	*			trans	-97.7	161.3	-170.6	37.6	-35.1	0	0	0	114.6
11	R	32.7	Very low	34.2	Very low	234 Å²	234	163.5 Å²	163.5	88%	0.883	81%	0.811	S	S	*	*			trans	-161.6	136.3	156.9	-120.1	175.1	-174.2	176.8	2.7	116.1
12	R	32.2	Very low	33.9	Very low	239 Å²	239	160 Å²	160	90%	0.902	80%	0.796	S	S	*	*			trans	72.6	140.8	157.3	-77.8	-177.4	168.3	165.7	-4.3	120.5
13	T	30.5	Very low	33.7	Very low	129 Å²	129	161.9 Å²	161.9	79%	0.791	79%	0.786	S	S	*	*			trans	-101.6	166.4	178.2	41.3	0	0	0	0	111.4
14	Y	28.1	Very low	33.8	Very low	229 Å²	229	165.7 Å²	165.7	90%	0.898	79%	0.791	S	S	*	*			trans	-142.6	148	162.4	-119.5	-96.3	0	0	0	109.7
15	H	30.5	Very low	33.5	Very low	174 Å²	174	161.5 Å²	161.5	81%	0.806	78%	0.775	S	S	*	*			trans	-113.7	137.9	176.7	-99	-91.2	0	0	0	109.9
16	P	36.6	Very low	33.3	Very low	120 Å²	120	160.8 Å²	160.8	78%	0.779	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-76.2	169.9	151.3	-9.9	28.3	0	0	0	111
17	K	33.5	Very low	32.6	Very low	188 Å²	188	158.4 Å²	158.4	82%	0.817	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-94	162.4	-173.3	-67.2	179.6	177.6	179.7	0	113.4
18	V	33.4	Very low	32.4	Very low	139 Å²	139	156.9 Å²	156.9	84%	0.842	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-95.9	142.8	157.7	176.4	0	0	0	0	107.7
19	D	34.7	Very low	32.1	Very low	132 Å²	132	154.5 Å²	154.5	71%	0.706	78%	0.777	S	S	*	*			trans	-138.8	160.5	160.1	-95.8	-56.4	0	0	0	111.1
20	H	36.4	Very low	32.1	Very low	158 Å²	158	155.4 Å²	155.4	73%	0.731	78%	0.781	S	S	*	*			trans	-69	168.1	-167.2	-76.1	-106.5	0	0	0	115.1
21	E	31.8	Very low	31.9	Very low	120 Å²	120	156.4 Å²	156.4	56%	0.561	78%	0.778	S	S	*	*			cis	175.9	135.7	-18.5	170.7	171.9	-155.9	0	0	108	Q23	E21-Q23 HydrophobicContact CG-CG 4.15Å; E21-Q23 PolarHBondContact OE1-NE2 2.63Å
22	L	30.9	Very low	31.8	Very low	174 Å²	174	153 Å²	153	91%	0.911	77%	0.772	S	S	*	*			trans	-152.9	83.3	163.7	-115.4	172	0	0	0	111.7
23	Q	32.8	Very low	31.7	Very low	112 Å²	112	148 Å²	148	52%	0.523	76%	0.764	S	S	.	*			trans	-75.1	137.6	179.5	-56.2	178.1	6.8	0	0	112	E21 N25	E21-Q23 HydrophobicContact CG-CG 4.15Å; E21-Q23 PolarHBondContact OE1-NE2 2.63Å; Q23-N25 PolarHBondContact OE1-ND2 3.33Å; Q23-N25 PolarHBondContact OE1-OD1 2.73Å
24	I	33.8	Very low	32	Very low	176 Å²	176	151.6 Å²	151.6	90%	0.903	77%	0.771	S	S	*	*			trans	-111.2	114.4	152.9	-62.8	-179	0	0	0	106.6
25	N	29.2	Very low	32.2	Very low	101 Å²	101	148.1 Å²	148.1	54%	0.54	77%	0.768	S	S	.	*			trans	-92.4	125	-162.2	-91.5	-51.3	0	0	0	114.6	Q23 S27	Q23-N25 PolarHBondContact OE1-ND2 3.33Å; Q23-N25 PolarHBondContact OE1-OD1 2.73Å; N25-S27 PolarHBondContact OD1-OG 3.33Å
26	T	32.5	Very low	32.3	Very low	149 Å²	149	145.3 Å²	145.3	91%	0.914	77%	0.765	S	S	*	*			trans	-140.1	88.8	147	48.6	0	0	0	0	109.1
27	S	27	Very low	32.2	Very low	91 Å²	91	145.6 Å²	145.6	64%	0.636	77%	0.767	S	S	*	*			trans	-102.8	130.4	-173.8	-12.9	0	0	0	0	111.9	N25	N25-S27 PolarHBondContact OD1-OG 3.33Å
28	T	31.9	Very low	32.1	Very low	149 Å²	149	142.3 Å²	142.3	91%	0.914	76%	0.763	S	S	*	*			trans	-156.6	108.7	145.9	8.6	0	0	0	0	111.3
29	S	27.6	Very low	32.1	Very low	99 Å²	99	141.8 Å²	141.8	69%	0.692	76%	0.756	S	S	*	*			trans	-150.1	114.8	167.4	50.7	0	0	0	0	110.5
30	W	30.7	Very low	31.9	Very low	233 Å²	233	145.7 Å²	145.7	88%	0.883	77%	0.767	S	S	*	*			trans	-144.5	102.7	164.8	-80.1	88.3	0	0	0	106
31	I	33.6	Very low	31.6	Very low	138 Å²	138	147.5 Å²	147.5	71%	0.708	77%	0.772	S	S	*	*				90.8	137.1	69.7	-75.3	165.8	0	0	0	111.4
32	Q	30.1	Very low	31.6	Very low	163 Å²	163	145.8 Å²	145.8	76%	0.762	79%	0.786	S	S	*	*			trans	-83.5	171.3	-167.6	-58.8	170	-61.3	0	0	113.9
33	N	30.7	Very low	31.5	Very low	135 Å²	135	142.9 Å²	142.9	72%	0.722	78%	0.781	S	S	*	*			trans	69.6	111	153.8	-58.7	-31.1	0	0	0	118.6
34	H	35.4	Very low	31.4	Very low	203 Å²	203	144.2 Å²	144.2	94%	0.94	80%	0.796	S	S	*	*				-154.7	145.4	127.8	-99.8	-68.9	0	0	0	110.7
35	N	32.3	Very low	31.2	Very low	156 Å²	156	139.7 Å²	139.7	83%	0.834	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-82.4	155.4	-178.1	-81.9	-35.3	0	0	0	113
36	P	32.8	Very low	31.4	Very low	115 Å²	115	143.8 Å²	143.8	75%	0.747	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-90.2	150.7	-173	35.3	-36.4	0	0	0	114.7
37	P	34.3	Very low	31.1	Very low	126 Å²	126	143.2 Å²	143.2	82%	0.818	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-97	166.8	158.3	36.6	-30.5	0	0	0	112.1
38	T	33	Very low	31.3	Very low	120 Å²	120	144 Å²	144	74%	0.736	80%	0.803	S	S	*	*			trans	-115.4	161.4	-170.4	59.1	0	0	0	0	114.3
39	N	31.9	Very low	31	Very low	128 Å²	128	145.7 Å²	145.7	68%	0.684	80%	0.8	S	S	*	*			trans	63.8	120.7	160.8	-64	-60.5	0	0	0	119
40	F	31.9	Very low	31.2	Very low	214 Å²	214	148.6 Å²	148.6	94%	0.939	81%	0.806	S	S	*	*				-154.6	159	102.6	-119.3	-85.5	0	0	0	110.9
41	K	30.4	Very low	31.1	Very low	196 Å²	196	144.7 Å²	144.7	85%	0.852	80%	0.803	S	S	*	*			trans	-99.7	143	-171.3	-64.5	177.7	179.1	177.3	0	112.9
42	G	30.5	Very low	30.9	Very low	83 Å²	83	147 Å²	147	86%	0.856	81%	0.811	S	S	*	*			trans	-164.8	126.2	164	0	0	0	0	0	109.9
43	S	28.8	Very low	31.4	Very low	114 Å²	114	143.3 Å²	143.3	80%	0.797	80%	0.801	S	S	*	*			trans	-118.1	128.5	-168	-178.5	0	0	0	0	113
44	V	31.9	Very low	31.9	Very low	139 Å²	139	140 Å²	140	84%	0.842	79%	0.789	S	S	*	*			trans	-141.6	135.3	142.7	-176.2	0	0	0	0	106.6
45	A	29.1	Very low	32.7	Very low	82 Å²	82	136.7 Å²	136.7	68%	0.678	78%	0.778	S	S	*	*			trans	-107.4	139.9	177.5	0	0	0	0	0	111
46	H	32.3	Very low	34.7	Very low	186 Å²	186	133.4 Å²	133.4	86%	0.861	76%	0.757	S	S	*	*			trans	-141.7	129.4	160.2	-108.2	-81.8	0	0	0	109.3
47	T	26.6	Very low	37.2	Very low	138 Å²	138	130.2 Å²	130.2	85%	0.847	73%	0.733	S	S	*	*			trans	-91.5	125.2	-176.7	-50.5	0	0	0	0	110.5
48	S	30.8	Very low	39.7	Very low	106 Å²	106	124.4 Å²	124.4	74%	0.741	70%	0.696	S	S	*	*			trans	-145	135	164.1	47.1	0	0	0	0	109.6
49	Q	25.8	Very low	42.3	Very low	186 Å²	186	120.3 Å²	120.3	87%	0.869	67%	0.669	S	S	*	*			trans	-77.2	145.4	-176.2	-66.3	159.7	-48.6	0	0	110.8
50	I	32.3	Very low	44.8	Very low	160 Å²	160	114.3 Å²	114.3	82%	0.821	64%	0.637	S	S	*	*			trans	-129.4	133.7	168.1	-60	-179.6	0	0	0	107.2
51	N	29.4	Very low	47	Very low	151 Å²	151	105.7 Å²	105.7	81%	0.807	60%	0.6	S	S	*	*			trans	-72.4	147.2	-167.6	-64.1	-30.5	0	0	0	113.1
52	Q	29.1	Very low	49.2	Very low	186 Å²	186	98.1 Å²	98.1	87%	0.869	57%	0.568	S	S	*	*			trans	-74.1	136	163.6	-71.3	-178.1	-27.8	0	0	110.1	S54	Q52-S54 PolarHBondContact O-N 2.79Å
53	P	39.2	Very low	51.7	Low	85 Å²	85	98.9 Å²	98.9	55%	0.552	55%	0.552	S	S	*	*			trans	-80.4	112.3	170.2	31.4	-31	0	0	0	110.2	D55	P53-D55 PolarHBondContact O-N 3.23Å
54	S	41.8	Very low	54.3	Low	67 Å²	67	94.6 Å²	94.6	47%	0.469	52%	0.519	S	S	.	.	G	3₁₀ helix	trans	-62.5	-18.4	177.6	41	0	0	0	0	114.7	Q52 Q56	Q52-S54 PolarHBondContact O-N 2.79Å; S54-Q56 VanDerWaalsContact C-N 3.29Å; S54-Q56 PolarHBondContact O-N 3.29Å
55	D	52.6	Low	56.8	Low	133 Å²	133	92 Å²	92	71%	0.711	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-86.6	4.3	-160	-56.9	-3.4	0	0	0	113.9	P53	P53-D55 PolarHBondContact O-N 3.23Å
56	Q	73.9	Confident	59	Low	86 Å²	86	89.2 Å²	89.2	40%	0.402	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-97.2	7.8	-177.4	-67.5	-175.9	-16.4	0	0	114.2	S54 L86	S54-Q56 VanDerWaalsContact C-N 3.29Å; S54-Q56 PolarHBondContact O-N 3.29Å; Q56-L86 PolarHBondContact O-N 2.99Å
57	L	85.1	Confident	60.8	Low	48 Å²	48	82.1 Å²	82.1	25%	0.251	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	122.4	-177.9	-128.8	73.7	0	0	0	113.3	I101 I117	L57-I101 HydrophobicContact CD1-CD1 3.87Å; L57-I101 HydrophobicContact CG-CD1 4.49Å; L57-I117 HydrophobicContact CB-CD1 4.34Å; L57-I117 HydrophobicContact CD2-CD1 3.96Å; L57-I117 HydrophobicContact CG-CD1 4.16Å; L57-I117 PolarHBondContact O-N 2.56Å
58	L	87.6	Confident	62.3	Low	5 Å²	5	83.8 Å²	83.8	3%	0.026	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	165.2	174.9	-57.6	178.3	0	0	0	110.9	R83 L84 L86 T114 G115 R116 I117	L58-R83 WeakPolarHBondContact O-CA 3.31Å; L58-L84 HydrophobicContact CB-CB 4.28Å; L58-L84 PolarHBondContact N-O 2.84Å; L58-L84 PolarHBondContact O-N 2.86Å; L58-L86 HydrophobicContact CD1-CB 3.93Å; L58-L86 HydrophobicContact CD1-CD1 3.96Å; L58-L86 HydrophobicContact CD1-CD2 4.22Å; L58-L86 HydrophobicContact CD1-CG 4.25Å; L58-L86 HydrophobicContact CG-CB 4.22Å; L58-T114 HydrophobicContact CD1-CG2 4.11Å; L58-G115 CarbonylContact C-O 3.47Å; L58-G115 VanDerWaalsContact CA-O 3.3Å; L58-G115 WeakPolarHBondContact CA-O 3.32Å; L58-R116 HydrophobicContact CD2-CG 3.81Å; L58-I117 VanDerWaalsContact O-CD1 3.23Å; L58-I117 WeakPolarHBondContact O-CD1 3.25Å
59	I	87.2	Confident	63.6	Low	34 Å²	34	79.9 Å²	79.9	17%	0.174	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	138.8	171.2	-168.5	169.1	0	0	0	110.7	L61 D82 T114 G115 I117	I59-L61 HydrophobicContact CG2-CD2 4.18Å; I59-L61 PolarHBondContact O-N 3.44Å; I59-D82 CarbonylContact C-O 3.56Å; I59-D82 WeakPolarHBondContact CA-O 3.24Å; I59-T114 WeakPolarHBondContact O-CA 3.28Å; I59-G115 PolarHBondContact N-O 3.4Å; I59-G115 PolarHBondContact O-N 2.94Å; I59-I117 HydrophobicContact CB-CD1 4.01Å; I59-I117 HydrophobicContact CB-CG1 3.77Å; I59-I117 HydrophobicContact CG2-CG1 4.13Å
60	A	85	Confident	64.9	Low	2 Å²	2	78.2 Å²	78.2	2%	0.017	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	116.1	171.8	0	0	0	0	0	110.4	V78 E79 G81 D82 L84	A60-V78 HydrophobicContact CB-CB 4.32Å; A60-V78 HydrophobicContact CB-CG2 4.24Å; A60-E79 WeakPolarHBondContact CB-O 3.29Å; A60-G81 PolarHBondContact O-N 3.27Å; A60-D82 HydrophobicContact CB-CB 4.12Å; A60-D82 PolarHBondContact N-O 2.92Å; A60-L84 HydrophobicContact CB-CD1 4.24Å
61	L	77	Confident	65.8	Low	32 Å²	32	76.1 Å²	76.1	17%	0.168	41%	0.408	C	S	.	.	S	Bend	trans	-83	-18.7	178.1	-62	179.5	0	0	0	112.6	I59 K80 Y113 T114	I59-L61 HydrophobicContact CG2-CD2 4.18Å; I59-L61 PolarHBondContact O-N 3.44Å; L61-K80 WeakPolarHBondContact O-CE 3.43Å; L61-K80 PolarHBondContact O-NZ 2.79Å; L61-Y113 PolarHBondContact N-O 3.22Å; L61-T114 WeakPolarHBondContact CD1-O 3.37Å
62	F	76.9	Confident	67.3	Low	37 Å²	37	69.7 Å²	69.7	16%	0.162	37%	0.374	C	S	.	.	S	Bend	trans	-145.7	162.1	-178.8	-52.7	-96.8	0	0	0	109.3	Y113 D261	F62-Y113 HydrophobicContact CB-CD1 3.67Å; F62-Y113 HydrophobicContact CB-CE1 3.92Å; F62-Y113 HydrophobicContact CB-CG 4.44Å; F62-Y113 HydrophobicContact CD2-CD1 4.5Å; F62-Y113 HydrophobicContact CD2-CG 4.5Å; F62-Y113 HydrophobicContact CG-CD1 4.45Å; F62-D261 WeakPolarHBondContact CE1-OD1 3.48Å
63	D	84.2	Confident	68.9	Low	100 Å²	100	68.6 Å²	68.6	54%	0.535	37%	0.368	S	S	.	.			trans	-73.6	139.1	170.4	-54.8	-57.8	0	0	0	109.8	E79 K80 Y113	D63-E79 WeakPolarHBondContact OD1-CA 3.24Å; D63-K80 PolarHBondContact OD1-N 2.87Å; D63-Y113 WeakPolarHBondContact O-CE1 3.47Å
64	F	82.3	Confident	70.8	Confident	24 Å²	24	67.5 Å²	67.5	11%	0.105	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-135.2	123.1	172.1	174.2	-100.2	0	0	0	109.5	P66 Q75 V76 R77 V78 W95 I109 P110 Y113	F64-P66 HydrophobicContact CE1-CB 4.34Å; F64-P66 HydrophobicContact CZ-CB 4.49Å; F64-Q75 HydrophobicContact CE1-CB 4.34Å; F64-V76 VanDerWaalsContact CD1-O 3.3Å; F64-V76 WeakPolarHBondContact CD1-O 3.39Å; F64-R77 WeakPolarHBondContact O-CA 3.28Å; F64-V78 HydrophobicContact CB-CG2 3.84Å; F64-V78 PolarHBondContact N-O 3.21Å; F64-V78 PolarHBondContact O-N 3.16Å; F64-W95 HydrophobicContact CZ-CH2 4.2Å; F64-W95 AromaticContact CZ-CZ3 3.94Å; F64-W95 HydrophobicContact CZ-CZ3 3.94Å; F64-I109 HydrophobicContact CD1-CB 4.1Å; F64-I109 HydrophobicContact CD1-CG2 3.66Å; F64-I109 HydrophobicContact CE1-CB 4.34Å; F64-I109 HydrophobicContact CE1-CG2 3.96Å; F64-P110 HydrophobicContact CD2-CG 4.17Å; F64-P110 HydrophobicContact CE2-CG 3.92Å; F64-P110 HydrophobicContact CZ-CG 4.47Å; F64-Y113 HydrophobicContact CB-CD1 3.84Å; F64-Y113 HydrophobicContact CB-CE1 4.19Å; F64-Y113 HydrophobicContact CD2-CE1 4.37Å
65	T	83.6	Confident	72.8	Confident	83 Å²	83	65.7 Å²	65.7	51%	0.509	35%	0.347	S	S	.	.			trans	-123.9	117.4	175.9	-64.7	0	0	0	0	108.1	R77	T65-R77 HydrophobicContact CG2-CG 4.46Å; T65-R77 PolarHBondContact OG1-NE 2.84Å
66	P	77.2	Confident	74.5	Confident	25 Å²	25	59.6 Å²	59.6	16%	0.162	31%	0.314	C	S	.	.			trans	-67.2	143.9	-175.6	26.5	-34.4	0	0	0	111.8	F64 Q75	F64-P66 HydrophobicContact CE1-CB 4.34Å; F64-P66 HydrophobicContact CZ-CB 4.49Å; P66-Q75 HydrophobicContact CB-CB 3.62Å; P66-Q75 HydrophobicContact CG-CB 4.27Å
67	P	68.3	Low	75.2	Confident	37 Å²	37	61 Å²	61	24%	0.24	32%	0.316	C	S	.	.			trans	-63.1	143.3	176.4	-20.1	28.3	0	0	0	113.1	T69 N72 M269 Y305	P67-T69 PolarHBondContact O-N 2.87Å; P67-N72 WeakPolarHBondContact CB-ND2 3.35Å; P67-N72 WeakPolarHBondContact CD-ND2 3.37Å; P67-N72 PolarHBondContact O-ND2 3.42Å; P67-M269 HydrophobicContact CG-CE 4.14Å; P67-Y305 HydrophobicContact CB-CD1 3.69Å; P67-Y305 HydrophobicContact CB-CE1 4.14Å; P67-Y305 HydrophobicContact CG-CD1 3.93Å; P67-Y305 HydrophobicContact CG-CE1 4.37Å
68	N	58.5	Low	75.4	Confident	172 Å²	172	58.7 Å²	58.7	92%	0.92	30%	0.304	S	S	*	.	S	Bend	trans	-72.4	45.4	-178.4	-72.8	-21.1	0	0	0	114.4
69	T	57.6	Low	75.4	Confident	25 Å²	25	61.5 Å²	61.5	15%	0.153	32%	0.317	C	S	.	.			trans	-104.5	144.8	173.8	46	0	0	0	0	110.9	P67 E71 N72 P304 Y305	P67-T69 PolarHBondContact O-N 2.87Å; T69-E71 PolarHBondContact O-N 3.44Å; T69-N72 PolarHBondContact O-N 2.91Å; T69-N72 PolarHBondContact OG1-ND2 2.73Å; T69-P304 HydrophobicContact CG2-CB 3.61Å; T69-P304 WeakPolarHBondContact CG2-O 3.26Å; T69-Y305 HydrophobicContact CG2-CD1 4.35Å; T69-Y305 HydrophobicContact CG2-CE1 3.88Å
70	L	53	Low	75.2	Confident	151 Å²	151	65.7 Å²	65.7	79%	0.791	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-58	-25.9	-175.6	-132.9	78.8	0	0	0	113.6	N72	L70-N72 VanDerWaalsContact C-N 3.33Å
71	E	53.1	Low	75.1	Confident	115 Å²	115	67.6 Å²	67.6	54%	0.537	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-70.4	-25.2	179.7	-58	175.7	149.7	0	0	112.7	T69 Q73 R276	T69-E71 PolarHBondContact O-N 3.44Å; E71-Q73 PolarHBondContact O-N 2.86Å; E71-R276 IonicContact OE2-CZ 2.63Å; E71-R276 IonicContact OE2-NH1 3.67Å; E71-R276 PolarHBondContact OE2-NH1 2.95Å; E71-R276 IonicContact OE2-NH2 3.59Å; E71-R276 PolarHBondContact OE2-NH2 3.13Å
72	N	60.7	Low	75.7	Confident	17 Å²	17	66.8 Å²	66.8	9%	0.091	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-92.4	13	-171.6	-71.1	-14.3	0	0	0	114.6	P67 T69 L70 S74 Q75	P67-N72 WeakPolarHBondContact CB-ND2 3.35Å; P67-N72 WeakPolarHBondContact CD-ND2 3.37Å; P67-N72 PolarHBondContact O-ND2 3.42Å; T69-N72 PolarHBondContact O-N 2.91Å; T69-N72 PolarHBondContact OG1-ND2 2.73Å; L70-N72 VanDerWaalsContact C-N 3.33Å; N72-S74 PolarHBondContact O-N 3.19Å; N72-Q75 PolarHBondContact O-N 3.07Å; N72-Q75 PolarHBondContact OD1-NE2 2.85Å
73	Q	61.3	Low	76.4	Confident	163 Å²	163	72 Å²	72	76%	0.762	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-9	179.4	-69.7	-177.7	8.4	0	0	114.4	E71	E71-Q73 PolarHBondContact O-N 2.86Å
74	S	79.8	Confident	76.7	Confident	62 Å²	62	67.2 Å²	67.2	43%	0.434	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-4.4	174.9	62.1	0	0	0	0	114.1	N72 G107 W108	N72-S74 PolarHBondContact O-N 3.19Å; S74-G107 CarbonylContact O-C 3.59Å; S74-G107 WeakPolarHBondContact O-CA 3.29Å; S74-W108 PolarHBondContact O-N 2.73Å
75	Q	84.7	Confident	77.2	Confident	28 Å²	28	69.4 Å²	69.4	13%	0.131	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-98.8	146.4	-178.6	-64.7	170.7	12.9	0	0	111.5	F64 P66 N72 W95 W108	F64-Q75 HydrophobicContact CE1-CB 4.34Å; P66-Q75 HydrophobicContact CB-CB 3.62Å; P66-Q75 HydrophobicContact CG-CB 4.27Å; N72-Q75 PolarHBondContact O-N 3.07Å; N72-Q75 PolarHBondContact OD1-NE2 2.85Å; Q75-W95 HydrophobicContact CG-CH2 4.4Å; Q75-W95 HydrophobicContact CG-CZ3 4.04Å; Q75-W108 VanDerWaalsContact CA-O 3.3Å; Q75-W108 WeakPolarHBondContact CA-O 3.34Å; Q75-W108 WeakPolarHBondContact CB-O 2.95Å; Q75-W108 HydrophobicContact CG-CB 4.37Å
76	V	86.7	Confident	77.6	Confident	5 Å²	5	66.5 Å²	66.5	3%	0.03	33%	0.334	C	S	.	.			trans	-111.6	146	-178.6	62.3	0	0	0	0	111.9	F64 V78 V98 C100 E105 G107 W108 I109	F64-V76 VanDerWaalsContact CD1-O 3.3Å; F64-V76 WeakPolarHBondContact CD1-O 3.39Å; V76-V78 HydrophobicContact CG1-CG1 4.42Å; V76-V98 HydrophobicContact CG1-CG2 3.96Å; V76-C100 HydrophobicContact CG2-CB 4.36Å; V76-E105 HydrophobicContact CG2-CB 3.63Å; V76-G107 WeakPolarHBondContact CG1-O 3.39Å; V76-W108 PolarHBondContact N-O 3Å; V76-I109 HydrophobicContact CG1-CG2 3.59Å; V76-I109 WeakPolarHBondContact O-CG2 3.47Å
77	R	89.5	Confident	78.2	Confident	116 Å²	116	69.4 Å²	69.4	44%	0.438	35%	0.345	S	S	.	.			trans	-84.6	128.1	175.5	-175.4	171.6	-175.7	-96.5	-9.9	110.5	F64 T65 E79	F64-R77 WeakPolarHBondContact O-CA 3.28Å; T65-R77 HydrophobicContact CG2-CG 4.46Å; T65-R77 PolarHBondContact OG1-NE 2.84Å; R77-E79 IonicContact CZ-OE1 2.73Å; R77-E79 IonicContact NH1-OE1 3.65Å; R77-E79 PolarHBondContact NH1-OE1 3.19Å; R77-E79 IonicContact NH2-OE1 3.58Å
78	V	88.3	Confident	78.9	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-129.6	147.1	176.2	-62.2	0	0	0	0	111.1	A60 F64 V76 L84 C100 I109	A60-V78 HydrophobicContact CB-CB 4.32Å; A60-V78 HydrophobicContact CB-CG2 4.24Å; F64-V78 HydrophobicContact CB-CG2 3.84Å; F64-V78 PolarHBondContact N-O 3.21Å; F64-V78 PolarHBondContact O-N 3.16Å; V76-V78 HydrophobicContact CG1-CG1 4.42Å; V78-L84 HydrophobicContact CB-CD2 4.3Å; V78-L84 HydrophobicContact CG1-CD2 3.59Å; V78-C100 HydrophobicContact CG1-CB 4.08Å; V78-I109 HydrophobicContact CG1-CG2 4.33Å; V78-I109 HydrophobicContact CG2-CD1 4.23Å; V78-I109 HydrophobicContact CG2-CG2 4.23Å
79	E	89.1	Confident	80.1	Confident	63 Å²	63	65.4 Å²	65.4	29%	0.294	32%	0.32	S	S	.	.			trans	-111.8	146.9	177	-73.5	160.1	-142.9	0	0	109.5	A60 D63 R77 G81 D82 R102	A60-E79 WeakPolarHBondContact CB-O 3.29Å; D63-E79 WeakPolarHBondContact OD1-CA 3.24Å; R77-E79 IonicContact CZ-OE1 2.73Å; R77-E79 IonicContact NH1-OE1 3.65Å; R77-E79 PolarHBondContact NH1-OE1 3.19Å; R77-E79 IonicContact NH2-OE1 3.58Å; E79-G81 PolarHBondContact O-N 2.68Å; E79-D82 PolarHBondContact N-OD2 2.94Å; E79-D82 WeakPolarHBondContact O-CB 3.43Å; E79-D82 PolarHBondContact O-N 2.84Å; E79-R102 IonicContact OE1-CZ 3.57Å; E79-R102 IonicContact OE1-NH1 2.73Å; E79-R102 PolarHBondContact OE1-NH1 2.98Å; E79-R102 IonicContact OE1-NH2 3.36Å; E79-R102 PolarHBondContact OE1-NH2 3.19Å; E79-R102 IonicContact OE2-CZ 3.5Å; E79-R102 IonicContact OE2-NH1 3.19Å; E79-R102 PolarHBondContact OE2-NH1 3.39Å; E79-R102 IonicContact OE2-NH2 3.32Å
80	K	83	Confident	80.9	Confident	122 Å²	122	65.2 Å²	65.2	53%	0.53	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	119.3	-174	-176.3	-178.7	-173.5	104.5	0	111.4	L61 D63	L61-K80 WeakPolarHBondContact O-CE 3.43Å; L61-K80 PolarHBondContact O-NZ 2.79Å; D63-K80 PolarHBondContact OD1-N 2.87Å
81	G	82.3	Confident	81.4	Confident	42 Å²	42	63.7 Å²	63.7	43%	0.433	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.9	-7	-174.1	0	0	0	0	0	114.6	A60 E79 R83	A60-G81 PolarHBondContact O-N 3.27Å; E79-G81 PolarHBondContact O-N 2.68Å; G81-R83 PolarHBondContact O-N 2.95Å
82	D	90	Very high	81.5	Confident	15 Å²	15	61.7 Å²	61.7	8%	0.08	32%	0.321	C	S	.	.			trans	-56.5	135.1	170.9	-85.1	-26.2	0	0	0	111	I59 A60 E79 L84 C100 R102	I59-D82 CarbonylContact C-O 3.56Å; I59-D82 WeakPolarHBondContact CA-O 3.24Å; A60-D82 HydrophobicContact CB-CB 4.12Å; A60-D82 PolarHBondContact N-O 2.92Å; E79-D82 PolarHBondContact N-OD2 2.94Å; E79-D82 WeakPolarHBondContact O-CB 3.43Å; E79-D82 PolarHBondContact O-N 2.84Å; D82-L84 HydrophobicContact CB-CD2 3.91Å; D82-C100 PolarHBondContact OD2-SG 2.87Å; D82-C100 VanDerWaalsContact OD2-SG 3.42Å; D82-R102 VanDerWaalsContact CG-NE 3.29Å; D82-R102 VanDerWaalsContact OD1-CB 3.29Å; D82-R102 WeakPolarHBondContact OD1-CB 3.48Å; D82-R102 VanDerWaalsContact OD1-CD 3.24Å; D82-R102 WeakPolarHBondContact OD1-CD 3.35Å; D82-R102 IonicContact OD1-CZ 2.63Å; D82-R102 IonicContact OD1-NE 3.38Å; D82-R102 PolarHBondContact OD1-NE 2.96Å; D82-R102 IonicContact OD1-NH2 2.79Å; D82-R102 IonicContact OD2-CZ 3.76Å; D82-R102 IonicContact OD2-NE 3.89Å; D82-R102 PolarHBondContact OD2-NE 3.33Å; D82-R102 VanDerWaalsContact OD2-NE 3.07Å; D82-R102 IonicContact OD2-NH2 3.72Å; D82-R102 PolarHBondContact OD2-NH2 3.27Å
83	R	91.5	Very high	81.8	Confident	147 Å²	147	62.5 Å²	62.5	56%	0.555	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	135.9	168.9	-61.1	-172.2	177.5	-156.5	-2.4	109.1	L58 G81 I101 I117	L58-R83 WeakPolarHBondContact O-CA 3.31Å; G81-R83 PolarHBondContact O-N 2.95Å; R83-I101 HydrophobicContact CB-CB 4.37Å; R83-I101 HydrophobicContact CB-CD1 3.94Å; R83-I101 VanDerWaalsContact O-CB 3.29Å; R83-I101 WeakPolarHBondContact O-CB 3.3Å; R83-I101 WeakPolarHBondContact O-CG1 3.46Å; R83-I101 PolarHBondContact O-N 3.43Å; R83-I117 HydrophobicContact CB-CD1 4.34Å; R83-I117 HydrophobicContact CG-CD1 3.93Å
84	L	90.9	Very high	81.9	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	137.2	-172.5	-43.2	174	0	0	0	109	L58 A60 V78 D82 V98 E99 C100 I109 T114	L58-L84 HydrophobicContact CB-CB 4.28Å; L58-L84 PolarHBondContact N-O 2.84Å; L58-L84 PolarHBondContact O-N 2.86Å; A60-L84 HydrophobicContact CB-CD1 4.24Å; V78-L84 HydrophobicContact CB-CD2 4.3Å; V78-L84 HydrophobicContact CG1-CD2 3.59Å; D82-L84 HydrophobicContact CB-CD2 3.91Å; L84-V98 HydrophobicContact CB-CB 4.16Å; L84-V98 HydrophobicContact CB-CG1 4.44Å; L84-V98 HydrophobicContact CB-CG2 4.48Å; L84-V98 HydrophobicContact CD1-CG2 4.37Å; L84-E99 CarbonylContact C-O 3.57Å; L84-E99 WeakPolarHBondContact CA-O 3.44Å; L84-C100 HydrophobicContact CD2-CB 4.08Å; L84-I109 HydrophobicContact CD1-CD1 3.51Å; L84-T114 HydrophobicContact CD1-CG2 3.86Å
85	Q	93.2	Very high	81.8	Confident	69 Å²	69	54.7 Å²	54.7	32%	0.322	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	121.5	170.5	-178.2	168.1	-9.2	0	0	109.7	F87 V98 E99	Q85-F87 HydrophobicContact CB-CE2 4.35Å; Q85-F87 HydrophobicContact CG-CE2 4.09Å; Q85-F87 HydrophobicContact CG-CZ 4.46Å; Q85-F87 WeakPolarHBondContact O-CD2 3.49Å; Q85-V98 CarbonylContact O-C 3.56Å; Q85-V98 VanDerWaalsContact O-CA 3.24Å; Q85-V98 WeakPolarHBondContact O-CA 3.44Å; Q85-E99 PolarHBondContact N-O 3.42Å; Q85-E99 PolarHBondContact O-N 2.82Å
86	L	91	Very high	81.8	Confident	23 Å²	23	53.4 Å²	53.4	12%	0.12	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	126.5	-178.7	179.4	68.8	0	0	0	111.6	Q56 L58 G88 Y89 V98	Q56-L86 PolarHBondContact O-N 2.99Å; L58-L86 HydrophobicContact CD1-CB 3.93Å; L58-L86 HydrophobicContact CD1-CD1 3.96Å; L58-L86 HydrophobicContact CD1-CD2 4.22Å; L58-L86 HydrophobicContact CD1-CG 4.25Å; L58-L86 HydrophobicContact CG-CB 4.22Å; L86-G88 VanDerWaalsContact CD1-O 3.29Å; L86-G88 WeakPolarHBondContact CD1-O 3.5Å; L86-Y89 HydrophobicContact CD1-CE1 4.1Å; L86-Y89 HydrophobicContact CD2-CE1 4.45Å; L86-Y89 HydrophobicContact CD2-CE2 3.95Å; L86-Y89 WeakPolarHBondContact CD2-OH 3.23Å; L86-V98 HydrophobicContact CD1-CG1 4.22Å
87	F	89.1	Confident	82	Confident	85 Å²	85	54.3 Å²	54.3	37%	0.373	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-27.1	173.8	-73.2	-92.2	0	0	0	113.5	Q85 D97 E99	Q85-F87 HydrophobicContact CB-CE2 4.35Å; Q85-F87 HydrophobicContact CG-CE2 4.09Å; Q85-F87 HydrophobicContact CG-CZ 4.46Å; Q85-F87 WeakPolarHBondContact O-CD2 3.49Å; F87-D97 HydrophobicContact CB-CB 4.41Å; F87-D97 PolarHBondContact N-O 2.82Å; F87-E99 HydrophobicContact CD2-CB 4.39Å; F87-E99 HydrophobicContact CE2-CB 3.62Å; F87-E99 HydrophobicContact CZ-CB 4.49Å; F87-E99 WeakPolarHBondContact CZ-OE2 3.14Å
88	G	84.1	Confident	82.1	Confident	23 Å²	23	48.8 Å²	48.8	24%	0.237	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.2	-172.6	179.9	0	0	0	0	0	113.7	L86 D97	L86-G88 VanDerWaalsContact CD1-O 3.29Å; L86-G88 WeakPolarHBondContact CD1-O 3.5Å; G88-D97 PolarHBondContact O-N 2.97Å
89	Y	82.8	Confident	82.3	Confident	102 Å²	102	51 Å²	51	40%	0.4	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	159.9	177.5	-63.2	-74.3	0	0	0	111.1	L86 W95 S96 T111	L86-Y89 HydrophobicContact CD1-CE1 4.1Å; L86-Y89 HydrophobicContact CD2-CE1 4.45Å; L86-Y89 HydrophobicContact CD2-CE2 3.95Å; L86-Y89 WeakPolarHBondContact CD2-OH 3.23Å; Y89-W95 CarbonylContact C-O 3.56Å; Y89-W95 VanDerWaalsContact CA-O 3.23Å; Y89-W95 WeakPolarHBondContact CA-O 3.3Å; Y89-S96 WeakPolarHBondContact CE1-OG 3.33Å; Y89-T111 HydrophobicContact CD1-CG2 4.25Å; Y89-T111 HydrophobicContact CE1-CG2 3.8Å
90	S	74.5	Confident	82.5	Confident	21 Å²	21	48 Å²	48	15%	0.147	27%	0.266	C	S	.	.			trans	-67.9	164.9	169.9	57.5	0	0	0	0	111.7	D92 G93 D94 W95	S90-D92 VanDerWaalsContact CB-OD1 3.28Å; S90-D92 WeakPolarHBondContact CB-OD1 3.39Å; S90-D92 PolarHBondContact O-N 3.3Å; S90-D92 VanDerWaalsContact O-N 3.17Å; S90-D92 PolarHBondContact OG-OD1 3.02Å; S90-G93 PolarHBondContact O-N 3.45Å; S90-G93 PolarHBondContact OG-N 2.86Å; S90-D94 PolarHBondContact OG-N 3.04Å; S90-W95 PolarHBondContact N-O 2.9Å; S90-W95 PolarHBondContact OG-N 2.76Å
91	A	64	Low	82.8	Confident	119 Å²	119	46.3 Å²	46.3	98%	0.983	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-21.4	-178	0	0	0	0	0	114.2
92	D	55.9	Low	83.2	Confident	73 Å²	73	49.6 Å²	49.6	39%	0.39	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-4.6	173.2	60.9	-10.1	0	0	0	113.7	S90 D94 P271	S90-D92 VanDerWaalsContact CB-OD1 3.28Å; S90-D92 WeakPolarHBondContact CB-OD1 3.39Å; S90-D92 PolarHBondContact O-N 3.3Å; S90-D92 VanDerWaalsContact O-N 3.17Å; S90-D92 PolarHBondContact OG-OD1 3.02Å; D92-D94 PolarHBondContact O-N 2.94Å; D92-D94 PolarHBondContact OD1-N 3.46Å; D92-P271 WeakPolarHBondContact OD2-CB 3.26Å; D92-P271 WeakPolarHBondContact OD2-CG 3.39Å
93	G	66.1	Low	83.1	Confident	34 Å²	34	51.4 Å²	51.4	35%	0.351	27%	0.272	S	S	.	.	S	Bend	trans	74.4	-2.4	-178.4	0	0	0	0	0	115.5	S90 W95 T111	S90-G93 PolarHBondContact O-N 3.45Å; S90-G93 PolarHBondContact OG-N 2.86Å; G93-W95 VanDerWaalsContact C-N 3.29Å; G93-W95 PolarHBondContact O-N 2.89Å; G93-T111 WeakPolarHBondContact O-CB 3.33Å; G93-T111 PolarHBondContact O-OG1 2.68Å
94	D	63.8	Low	83	Confident	46 Å²	46	50 Å²	50	25%	0.246	28%	0.276	C	S	.	.	S	Bend	trans	-75.6	-15.6	-173.7	-124.8	25.7	0	0	0	112.8	S90 D92 P110 T111 R268	S90-D94 PolarHBondContact OG-N 3.04Å; D92-D94 PolarHBondContact O-N 2.94Å; D92-D94 PolarHBondContact OD1-N 3.46Å; D94-P110 CarbonylContact O-C 3.55Å; D94-P110 WeakPolarHBondContact O-CA 3.3Å; D94-T111 VanDerWaalsContact C-OG1 3.28Å; D94-T111 PolarHBondContact O-N 2.82Å; D94-T111 PolarHBondContact O-OG1 2.73Å; D94-R268 IonicContact OD1-NH1 3.53Å; D94-R268 PolarHBondContact OD1-NH1 2.94Å; D94-R268 WeakPolarHBondContact OD2-CD 3.22Å; D94-R268 IonicContact OD2-CZ 3.66Å; D94-R268 IonicContact OD2-NE 2.78Å; D94-R268 IonicContact OD2-NH1 2.68Å; D94-R268 PolarHBondContact OD2-NH1 2.9Å
95	W	78.3	Confident	82.9	Confident	16 Å²	16	54.8 Å²	54.8	6%	0.061	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	144.1	176.3	-63	77.4	0	0	0	113.3	F64 Q75 Y89 S90 G93 W108 I109 P110 T111 R268	F64-W95 HydrophobicContact CZ-CH2 4.2Å; F64-W95 AromaticContact CZ-CZ3 3.94Å; F64-W95 HydrophobicContact CZ-CZ3 3.94Å; Q75-W95 HydrophobicContact CG-CH2 4.4Å; Q75-W95 HydrophobicContact CG-CZ3 4.04Å; Y89-W95 CarbonylContact C-O 3.56Å; Y89-W95 VanDerWaalsContact CA-O 3.23Å; Y89-W95 WeakPolarHBondContact CA-O 3.3Å; S90-W95 PolarHBondContact N-O 2.9Å; S90-W95 PolarHBondContact OG-N 2.76Å; G93-W95 VanDerWaalsContact C-N 3.29Å; G93-W95 PolarHBondContact O-N 2.89Å; W95-W108 HydrophobicContact CB-CE3 3.7Å; W95-W108 HydrophobicContact CB-CZ3 4.24Å; W95-W108 HydrophobicContact CE3-CB 3.8Å; W95-W108 HydrophobicContact CZ3-CB 4.34Å; W95-I109 CarbonylContact C-O 3.52Å; W95-I109 WeakPolarHBondContact CA-O 3.41Å; W95-P110 HydrophobicContact CE3-CG 4.28Å; W95-P110 HydrophobicContact CH2-CG 4.22Å; W95-P110 HydrophobicContact CZ3-CG 4.02Å; W95-T111 WeakPolarHBondContact CA-OG1 3.34Å; W95-T111 PolarHBondContact N-OG1 3.18Å; W95-T111 PolarHBondContact O-OG1 2.84Å; W95-R268 WeakPolarHBondContact CZ2-O 3.23Å
96	S	83.2	Confident	82.8	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	132.1	171.3	-62.5	0	0	0	0	110.5	Y89 W108 I109 T111	Y89-S96 WeakPolarHBondContact CE1-OG 3.33Å; S96-W108 VanDerWaalsContact C-CE3 3.42Å; S96-W108 WeakPolarHBondContact O-CA 3.29Å; S96-I109 PolarHBondContact N-O 2.8Å; S96-I109 PolarHBondContact O-N 2.87Å; S96-T111 PolarHBondContact N-OG1 3.03Å; S96-T111 PolarHBondContact OG-OG1 3.28Å
97	D	91.4	Very high	82.7	Confident	25 Å²	25	57 Å²	57	13%	0.134	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	112.6	166.3	175.2	3.9	0	0	0	107.9	F87 G88 R106 W108	F87-D97 HydrophobicContact CB-CB 4.41Å; F87-D97 PolarHBondContact N-O 2.82Å; G88-D97 PolarHBondContact O-N 2.97Å; D97-R106 IonicContact OD1-CZ 3.22Å; D97-R106 IonicContact OD1-NE 3.92Å; D97-R106 PolarHBondContact OD1-NE 3.29Å; D97-R106 IonicContact OD1-NH2 3.55Å; D97-R106 IonicContact OD2-CZ 3.58Å; D97-R106 IonicContact OD2-NE 2.68Å; D97-R106 IonicContact OD2-NH2 3.07Å; D97-R106 PolarHBondContact OD2-NH2 3.21Å; D97-W108 HydrophobicContact CB-CD2 4.19Å; D97-W108 HydrophobicContact CB-CE3 3.88Å; D97-W108 HydrophobicContact CB-CH2 3.77Å; D97-W108 HydrophobicContact CB-CZ2 4.06Å; D97-W108 HydrophobicContact CB-CZ3 3.67Å
98	V	91.3	Very high	82.7	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	147.7	-171.9	-56.1	0	0	0	0	113.1	V76 L84 Q85 L86 R106 G107 I109	V76-V98 HydrophobicContact CG1-CG2 3.96Å; L84-V98 HydrophobicContact CB-CB 4.16Å; L84-V98 HydrophobicContact CB-CG1 4.44Å; L84-V98 HydrophobicContact CB-CG2 4.48Å; L84-V98 HydrophobicContact CD1-CG2 4.37Å; Q85-V98 CarbonylContact O-C 3.56Å; Q85-V98 VanDerWaalsContact O-CA 3.24Å; Q85-V98 WeakPolarHBondContact O-CA 3.44Å; L86-V98 HydrophobicContact CD1-CG1 4.22Å; V98-R106 CarbonylContact O-C 3.56Å; V98-R106 VanDerWaalsContact O-CA 3.26Å; V98-R106 WeakPolarHBondContact O-CA 3.4Å; V98-R106 WeakPolarHBondContact O-CG 3.49Å; V98-G107 PolarHBondContact N-O 3Å; V98-G107 PolarHBondContact O-N 3.33Å; V98-G107 VanDerWaalsContact O-O 3.11Å; V98-I109 HydrophobicContact CG1-CD1 4.44Å; V98-I109 HydrophobicContact CG1-CG1 4.39Å; V98-I109 HydrophobicContact CG2-CD1 3.78Å; V98-I109 HydrophobicContact CG2-CG1 3.8Å; V98-I109 HydrophobicContact CG2-CG2 4.2Å
99	E	93.3	Very high	82.7	Confident	46 Å²	46	55.6 Å²	55.6	22%	0.215	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	123.2	164.2	-172.9	171.7	175.4	0	0	109.6	L84 Q85 F87 I101 N104 E105 R106	L84-E99 CarbonylContact C-O 3.57Å; L84-E99 WeakPolarHBondContact CA-O 3.44Å; Q85-E99 PolarHBondContact N-O 3.42Å; Q85-E99 PolarHBondContact O-N 2.82Å; F87-E99 HydrophobicContact CD2-CB 4.39Å; F87-E99 HydrophobicContact CE2-CB 3.62Å; F87-E99 HydrophobicContact CZ-CB 4.49Å; F87-E99 WeakPolarHBondContact CZ-OE2 3.14Å; E99-I101 PolarHBondContact O-N 3.33Å; E99-N104 PolarHBondContact OE1-ND2 2.73Å; E99-E105 CarbonylContact C-O 3.51Å; E99-E105 WeakPolarHBondContact CA-O 3.39Å; E99-R106 HydrophobicContact CB-CB 4.06Å; E99-R106 HydrophobicContact CB-CG 4.4Å; E99-R106 HydrophobicContact CG-CB 4.27Å
100	C	92.4	Very high	82.4	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	115.4	177.7	179.8	0	0	0	0	109.7	V76 V78 D82 L84 R102 T103 N104 E105	V76-C100 HydrophobicContact CG2-CB 4.36Å; V78-C100 HydrophobicContact CG1-CB 4.08Å; D82-C100 PolarHBondContact OD2-SG 2.87Å; D82-C100 VanDerWaalsContact OD2-SG 3.42Å; L84-C100 HydrophobicContact CD2-CB 4.08Å; C100-R102 PolarHBondContact O-N 2.79Å; C100-R102 VanDerWaalsContact O-N 3.13Å; C100-T103 PolarHBondContact O-N 3.01Å; C100-N104 VanDerWaalsContact O-CA 3.31Å; C100-N104 WeakPolarHBondContact O-CA 3.35Å; C100-N104 PolarHBondContact O-N 3.3Å; C100-E105 PolarHBondContact N-O 3.2Å
101	I	89.8	Confident	82.6	Confident	86 Å²	86	51.6 Å²	51.6	44%	0.441	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-18.5	-173.8	-60.1	176.8	0	0	0	111.9	L57 R83 E99	L57-I101 HydrophobicContact CD1-CD1 3.87Å; L57-I101 HydrophobicContact CG-CD1 4.49Å; R83-I101 HydrophobicContact CB-CB 4.37Å; R83-I101 HydrophobicContact CB-CD1 3.94Å; R83-I101 VanDerWaalsContact O-CB 3.29Å; R83-I101 WeakPolarHBondContact O-CB 3.3Å; R83-I101 WeakPolarHBondContact O-CG1 3.46Å; R83-I101 PolarHBondContact O-N 3.43Å; E99-I101 PolarHBondContact O-N 3.33Å
102	R	90.3	Very high	82.9	Confident	112 Å²	112	48.5 Å²	48.5	42%	0.423	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-41.7	174.7	179.5	-179.6	55.5	102	8	113.3	E79 D82 C100	E79-R102 IonicContact OE1-CZ 3.57Å; E79-R102 IonicContact OE1-NH1 2.73Å; E79-R102 PolarHBondContact OE1-NH1 2.98Å; E79-R102 IonicContact OE1-NH2 3.36Å; E79-R102 PolarHBondContact OE1-NH2 3.19Å; E79-R102 IonicContact OE2-CZ 3.5Å; E79-R102 IonicContact OE2-NH1 3.19Å; E79-R102 PolarHBondContact OE2-NH1 3.39Å; E79-R102 IonicContact OE2-NH2 3.32Å; D82-R102 VanDerWaalsContact CG-NE 3.29Å; D82-R102 VanDerWaalsContact OD1-CB 3.29Å; D82-R102 WeakPolarHBondContact OD1-CB 3.48Å; D82-R102 VanDerWaalsContact OD1-CD 3.24Å; D82-R102 WeakPolarHBondContact OD1-CD 3.35Å; D82-R102 IonicContact OD1-CZ 2.63Å; D82-R102 IonicContact OD1-NE 3.38Å; D82-R102 PolarHBondContact OD1-NE 2.96Å; D82-R102 IonicContact OD1-NH2 2.79Å; D82-R102 IonicContact OD2-CZ 3.76Å; D82-R102 IonicContact OD2-NE 3.89Å; D82-R102 PolarHBondContact OD2-NE 3.33Å; D82-R102 VanDerWaalsContact OD2-NE 3.07Å; D82-R102 IonicContact OD2-NH2 3.72Å; D82-R102 PolarHBondContact OD2-NH2 3.27Å; C100-R102 PolarHBondContact O-N 2.79Å; C100-R102 VanDerWaalsContact O-N 3.13Å
103	T	89	Confident	84.3	Confident	52 Å²	52	45.4 Å²	45.4	32%	0.319	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-17.1	-176.8	64.3	0	0	0	0	113.3	C100 E105	C100-T103 PolarHBondContact O-N 3.01Å; T103-E105 VanDerWaalsContact CB-OE2 3.28Å; T103-E105 WeakPolarHBondContact CB-OE2 3.33Å; T103-E105 PolarHBondContact O-N 3.17Å; T103-E105 WeakPolarHBondContact OG1-CB 3.48Å; T103-E105 PolarHBondContact OG1-N 3.1Å; T103-E105 PolarHBondContact OG1-OE2 2.83Å
104	N	89.1	Confident	85.1	Confident	117 Å²	117	44.7 Å²	44.7	63%	0.626	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.3	25.9	-168	-144.1	113.4	0	0	0	113.3	E99 C100	E99-N104 PolarHBondContact OE1-ND2 2.73Å; C100-N104 VanDerWaalsContact O-CA 3.31Å; C100-N104 WeakPolarHBondContact O-CA 3.35Å; C100-N104 PolarHBondContact O-N 3.3Å
105	E	89.5	Confident	85.7	Confident	102 Å²	102	42.6 Å²	42.6	48%	0.477	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	143.9	172.6	-62.1	167.9	140.9	0	0	109.7	V76 E99 C100 T103	V76-E105 HydrophobicContact CG2-CB 3.63Å; E99-E105 CarbonylContact C-O 3.51Å; E99-E105 WeakPolarHBondContact CA-O 3.39Å; C100-E105 PolarHBondContact N-O 3.2Å; T103-E105 VanDerWaalsContact CB-OE2 3.28Å; T103-E105 WeakPolarHBondContact CB-OE2 3.33Å; T103-E105 PolarHBondContact O-N 3.17Å; T103-E105 WeakPolarHBondContact OG1-CB 3.48Å; T103-E105 PolarHBondContact OG1-N 3.1Å; T103-E105 PolarHBondContact OG1-OE2 2.83Å
106	R	90.8	Very high	85.5	Confident	131 Å²	131	49.5 Å²	49.5	49%	0.494	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	138.3	175.9	176.8	171.6	168.3	-168.4	-6.6	111.4	D97 V98 E99	D97-R106 IonicContact OD1-CZ 3.22Å; D97-R106 IonicContact OD1-NE 3.92Å; D97-R106 PolarHBondContact OD1-NE 3.29Å; D97-R106 IonicContact OD1-NH2 3.55Å; D97-R106 IonicContact OD2-CZ 3.58Å; D97-R106 IonicContact OD2-NE 2.68Å; D97-R106 IonicContact OD2-NH2 3.07Å; D97-R106 PolarHBondContact OD2-NH2 3.21Å; V98-R106 CarbonylContact O-C 3.56Å; V98-R106 VanDerWaalsContact O-CA 3.26Å; V98-R106 WeakPolarHBondContact O-CA 3.4Å; V98-R106 WeakPolarHBondContact O-CG 3.49Å; E99-R106 HydrophobicContact CB-CB 4.06Å; E99-R106 HydrophobicContact CB-CG 4.4Å; E99-R106 HydrophobicContact CG-CB 4.27Å
107	G	88.6	Confident	84.7	Confident	6 Å²	6	51.2 Å²	51.2	6%	0.062	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.4	-175.4	176.1	0	0	0	0	0	112.6	S74 V76 V98	S74-G107 CarbonylContact O-C 3.59Å; S74-G107 WeakPolarHBondContact O-CA 3.29Å; V76-G107 WeakPolarHBondContact CG1-O 3.39Å; V98-G107 PolarHBondContact N-O 3Å; V98-G107 PolarHBondContact O-N 3.33Å; V98-G107 VanDerWaalsContact O-O 3.11Å
108	W	88	Confident	82.6	Confident	79 Å²	79	53.5 Å²	53.5	30%	0.299	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	137.4	178.9	-63.8	98.4	0	0	0	112.2	S74 Q75 V76 W95 S96 D97	S74-W108 PolarHBondContact O-N 2.73Å; Q75-W108 VanDerWaalsContact CA-O 3.3Å; Q75-W108 WeakPolarHBondContact CA-O 3.34Å; Q75-W108 WeakPolarHBondContact CB-O 2.95Å; Q75-W108 HydrophobicContact CG-CB 4.37Å; V76-W108 PolarHBondContact N-O 3Å; W95-W108 HydrophobicContact CB-CE3 3.7Å; W95-W108 HydrophobicContact CB-CZ3 4.24Å; W95-W108 HydrophobicContact CE3-CB 3.8Å; W95-W108 HydrophobicContact CZ3-CB 4.34Å; S96-W108 VanDerWaalsContact C-CE3 3.42Å; S96-W108 WeakPolarHBondContact O-CA 3.29Å; D97-W108 HydrophobicContact CB-CD2 4.19Å; D97-W108 HydrophobicContact CB-CE3 3.88Å; D97-W108 HydrophobicContact CB-CH2 3.77Å; D97-W108 HydrophobicContact CB-CZ2 4.06Å; D97-W108 HydrophobicContact CB-CZ3 3.67Å
109	I	84.9	Confident	80.1	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	157.3	163.8	66.6	172.8	0	0	0	109.6	F64 V76 V78 L84 W95 S96 V98 T111 T114	F64-I109 HydrophobicContact CD1-CB 4.1Å; F64-I109 HydrophobicContact CD1-CG2 3.66Å; F64-I109 HydrophobicContact CE1-CB 4.34Å; F64-I109 HydrophobicContact CE1-CG2 3.96Å; V76-I109 HydrophobicContact CG1-CG2 3.59Å; V76-I109 WeakPolarHBondContact O-CG2 3.47Å; V78-I109 HydrophobicContact CG1-CG2 4.33Å; V78-I109 HydrophobicContact CG2-CD1 4.23Å; V78-I109 HydrophobicContact CG2-CG2 4.23Å; L84-I109 HydrophobicContact CD1-CD1 3.51Å; W95-I109 CarbonylContact C-O 3.52Å; W95-I109 WeakPolarHBondContact CA-O 3.41Å; S96-I109 PolarHBondContact N-O 2.8Å; S96-I109 PolarHBondContact O-N 2.87Å; V98-I109 HydrophobicContact CG1-CD1 4.44Å; V98-I109 HydrophobicContact CG1-CG1 4.39Å; V98-I109 HydrophobicContact CG2-CD1 3.78Å; V98-I109 HydrophobicContact CG2-CG1 3.8Å; V98-I109 HydrophobicContact CG2-CG2 4.2Å; I109-T111 PolarHBondContact O-N 2.92Å; I109-T114 HydrophobicContact CD1-CG2 3.45Å; I109-T114 VanDerWaalsContact CD1-CG2 3.45Å; I109-T114 HydrophobicContact CG1-CG2 4.2Å
110	P	76.2	Confident	77.4	Confident	7 Å²	7	59.6 Å²	59.6	5%	0.045	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	134.7	178	-18.4	31.2	0	0	0	110.9	F64 D94 W95 N112 Y113	F64-P110 HydrophobicContact CD2-CG 4.17Å; F64-P110 HydrophobicContact CE2-CG 3.92Å; F64-P110 HydrophobicContact CZ-CG 4.47Å; D94-P110 CarbonylContact O-C 3.55Å; D94-P110 WeakPolarHBondContact O-CA 3.3Å; W95-P110 HydrophobicContact CE3-CG 4.28Å; W95-P110 HydrophobicContact CH2-CG 4.22Å; W95-P110 HydrophobicContact CZ3-CG 4.02Å; P110-N112 WeakPolarHBondContact CB-OD1 3.27Å; P110-N112 PolarHBondContact O-N 2.84Å; P110-N112 VanDerWaalsContact O-N 3.15Å; P110-Y113 HydrophobicContact CB-CD2 3.72Å; P110-Y113 HydrophobicContact CB-CE2 4.15Å; P110-Y113 HydrophobicContact CG-CD2 3.98Å; P110-Y113 HydrophobicContact CG-CE2 4.15Å; P110-Y113 WeakPolarHBondContact O-CB 3.41Å; P110-Y113 PolarHBondContact O-N 3.17Å
111	T	78.4	Confident	74.7	Confident	33 Å²	33	65.4 Å²	65.4	20%	0.202	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-56.4	-37.5	-174.5	-61.6	0	0	0	0	111.9	Y89 G93 D94 W95 S96 I109 Y113 T114	Y89-T111 HydrophobicContact CD1-CG2 4.25Å; Y89-T111 HydrophobicContact CE1-CG2 3.8Å; G93-T111 WeakPolarHBondContact O-CB 3.33Å; G93-T111 PolarHBondContact O-OG1 2.68Å; D94-T111 VanDerWaalsContact C-OG1 3.28Å; D94-T111 PolarHBondContact O-N 2.82Å; D94-T111 PolarHBondContact O-OG1 2.73Å; W95-T111 WeakPolarHBondContact CA-OG1 3.34Å; W95-T111 PolarHBondContact N-OG1 3.18Å; W95-T111 PolarHBondContact O-OG1 2.84Å; S96-T111 PolarHBondContact N-OG1 3.03Å; S96-T111 PolarHBondContact OG-OG1 3.28Å; I109-T111 PolarHBondContact O-N 2.92Å; T111-Y113 PolarHBondContact O-N 3.23Å; T111-T114 PolarHBondContact O-N 3.17Å; T111-T114 PolarHBondContact O-OG1 3.1Å
112	N	71.7	Confident	72.2	Confident	54 Å²	54	67.6 Å²	67.6	29%	0.289	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-72	-3.3	180	73.9	-66.6	0	0	0	114.7	P110 T114	P110-N112 WeakPolarHBondContact CB-OD1 3.27Å; P110-N112 PolarHBondContact O-N 2.84Å; P110-N112 VanDerWaalsContact O-N 3.15Å; N112-T114 VanDerWaalsContact C-N 3.28Å
113	Y	84.3	Confident	69.3	Low	8 Å²	8	69.7 Å²	69.7	3%	0.031	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-87.8	-1.1	170	-77.1	-123.2	0	0	0	111.6	L61 F62 D63 F64 P110 T111 S265	L61-Y113 PolarHBondContact N-O 3.22Å; F62-Y113 HydrophobicContact CB-CD1 3.67Å; F62-Y113 HydrophobicContact CB-CE1 3.92Å; F62-Y113 HydrophobicContact CB-CG 4.44Å; F62-Y113 HydrophobicContact CD2-CD1 4.5Å; F62-Y113 HydrophobicContact CD2-CG 4.5Å; F62-Y113 HydrophobicContact CG-CD1 4.45Å; D63-Y113 WeakPolarHBondContact O-CE1 3.47Å; F64-Y113 HydrophobicContact CB-CD1 3.84Å; F64-Y113 HydrophobicContact CB-CE1 4.19Å; F64-Y113 HydrophobicContact CD2-CE1 4.37Å; P110-Y113 HydrophobicContact CB-CD2 3.72Å; P110-Y113 HydrophobicContact CB-CE2 4.15Å; P110-Y113 HydrophobicContact CG-CD2 3.98Å; P110-Y113 HydrophobicContact CG-CE2 4.15Å; P110-Y113 WeakPolarHBondContact O-CB 3.41Å; P110-Y113 PolarHBondContact O-N 3.17Å; T111-Y113 PolarHBondContact O-N 3.23Å; Y113-S265 WeakPolarHBondContact CE2-OG 3.36Å; Y113-S265 PolarHBondContact OH-OG 2.94Å
114	T	82.6	Confident	66.8	Low	18 Å²	18	75.4 Å²	75.4	11%	0.11	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	149.7	-179	70	0	0	0	0	112.8	L58 I59 L61 L84 I109 T111 N112	L58-T114 HydrophobicContact CD1-CG2 4.11Å; I59-T114 WeakPolarHBondContact O-CA 3.28Å; L61-T114 WeakPolarHBondContact CD1-O 3.37Å; L84-T114 HydrophobicContact CD1-CG2 3.86Å; I109-T114 HydrophobicContact CD1-CG2 3.45Å; I109-T114 VanDerWaalsContact CD1-CG2 3.45Å; I109-T114 HydrophobicContact CG1-CG2 4.2Å; T111-T114 PolarHBondContact O-N 3.17Å; T111-T114 PolarHBondContact O-OG1 3.1Å; N112-T114 VanDerWaalsContact C-N 3.28Å
115	G	76.1	Confident	64	Low	3 Å²	3	75.5 Å²	75.5	3%	0.031	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	163.1	165.1	0	0	0	0	0	110.3	L58 I59 E163	L58-G115 CarbonylContact C-O 3.47Å; L58-G115 VanDerWaalsContact CA-O 3.3Å; L58-G115 WeakPolarHBondContact CA-O 3.32Å; I59-G115 PolarHBondContact N-O 3.4Å; I59-G115 PolarHBondContact O-N 2.94Å; G115-E163 VanDerWaalsContact CA-OE2 3.25Å; G115-E163 WeakPolarHBondContact CA-OE2 3.45Å
116	R	73.9	Confident	61.4	Low	160 Å²	160	76.9 Å²	76.9	60%	0.604	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	137.3	179.7	-67.2	-174.9	176.8	-149.7	-3.5	111.7	L58 P118 E163	L58-R116 HydrophobicContact CD2-CG 3.81Å; R116-P118 WeakPolarHBondContact O-CD 3.34Å; R116-E163 PolarHBondContact N-OE2 3.47Å
117	I	66.4	Low	58.7	Low	37 Å²	37	76 Å²	76	19%	0.19	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-85.4	123.2	174.4	-63.9	172.3	0	0	0	109.4	L57 L58 I59 R83 V119	L57-I117 HydrophobicContact CB-CD1 4.34Å; L57-I117 HydrophobicContact CD2-CD1 3.96Å; L57-I117 HydrophobicContact CG-CD1 4.16Å; L57-I117 PolarHBondContact O-N 2.56Å; L58-I117 VanDerWaalsContact O-CD1 3.23Å; L58-I117 WeakPolarHBondContact O-CD1 3.25Å; I59-I117 HydrophobicContact CB-CD1 4.01Å; I59-I117 HydrophobicContact CB-CG1 3.77Å; I59-I117 HydrophobicContact CG2-CG1 4.13Å; R83-I117 HydrophobicContact CB-CD1 4.34Å; R83-I117 HydrophobicContact CG-CD1 3.93Å; I117-V119 PolarHBondContact O-N 2.9Å
118	P	48.8	Very low	56	Low	73 Å²	73	82.6 Å²	82.6	47%	0.474	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-63.5	121.2	165.6	-23.1	35.8	0	0	0	110.8	R116	R116-P118 WeakPolarHBondContact O-CD 3.34Å
119	V	39	Very low	53.3	Low	81 Å²	81	84.9 Å²	84.9	49%	0.491	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-85.6	119.1	162.1	-177.7	0	0	0	0	106.9	I117	I117-V119 PolarHBondContact O-N 2.9Å
120	P	35.4	Very low	50.8	Low	92 Å²	92	91 Å²	91	60%	0.597	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-64	145	175.8	27.6	-34	0	0	0	109.7	N122	P120-N122 PolarHBondContact O-N 3.39Å; P120-N122 VanDerWaalsContact O-N 3.16Å
121	P	37.2	Very low	48.7	Very low	123 Å²	123	94 Å²	94	80%	0.799	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-62.1	119.8	174.5	26.7	-33.2	0	0	0	109.4	D123	P121-D123 PolarHBondContact O-N 3.02Å
122	N	35.3	Very low	46.5	Very low	131 Å²	131	98.2 Å²	98.2	70%	0.701	58%	0.575	S	S	*	*			trans	-67.8	115.6	179.4	-89.4	-27.4	0	0	0	110.7	P120 H124	P120-N122 PolarHBondContact O-N 3.39Å; P120-N122 VanDerWaalsContact O-N 3.16Å; N122-H124 PolarHBondContact O-N 3.17Å
123	D	30.3	Very low	44.6	Very low	157 Å²	157	100.1 Å²	100.1	84%	0.84	60%	0.598	S	S	*	*			trans	-65.3	95.9	172.9	-92.5	-42.7	0	0	0	111.4	P121	P121-D123 PolarHBondContact O-N 3.02Å
124	H	35.9	Very low	42.3	Very low	172 Å²	172	106 Å²	106	80%	0.796	64%	0.64	S	S	*	*			trans	-126.7	54.1	175.6	-81.4	8.7	0	0	0	111.9	N122	N122-H124 PolarHBondContact O-N 3.17Å
125	S	32	Very low	39.8	Very low	118 Å²	118	108 Å²	108	83%	0.825	66%	0.664	S	S	*	*			trans	-150.6	61.6	161.8	-156.5	0	0	0	0	114.1	T127	S125-T127 PolarHBondContact O-N 3.39Å
126	T	33.2	Very low	37.8	Very low	131 Å²	131	114 Å²	114	80%	0.804	71%	0.706	S	S	*	*			trans	-81.7	94.4	167.8	-44.2	0	0	0	0	110.5
127	T	34.2	Very low	35.7	Very low	114 Å²	114	110.8 Å²	110.8	70%	0.699	71%	0.708	S	S	*	*				179.9	136	126.9	29.9	0	0	0	0	115.5	S125	S125-T127 PolarHBondContact O-N 3.39Å
128	L	32.3	Very low	33.8	Very low	143 Å²	143	116.5 Å²	116.5	75%	0.749	74%	0.738	S	S	*	*			trans	69.8	106	140	-65	166.6	0	0	0	121.3
129	N	31.7	Very low	32.9	Very low	127 Å²	127	119.1 Å²	119.1	68%	0.679	75%	0.753	S	S	*	*				94.2	104.7	120.7	-81.9	23.6	0	0	0	122.2
130	T	33	Very low	32.4	Very low	130 Å²	130	124.6 Å²	124.6	80%	0.798	77%	0.77	S	S	*	*				55.2	116.5	124.2	63	0	0	0	0	120.1
131	G	30.8	Very low	32.2	Very low	70 Å²	70	129.6 Å²	129.6	72%	0.722	79%	0.786	S	S	*	*			trans	160.2	98.2	151.6	0	0	0	0	0	117.1
132	S	33	Very low	31.8	Very low	121 Å²	121	131.8 Å²	131.8	85%	0.846	79%	0.785	S	S	*	*			trans	49.4	92.5	136.3	-51.8	0	0	0	0	120.9
133	A	32	Very low	31.7	Very low	93 Å²	93	131.9 Å²	131.9	77%	0.769	79%	0.79	S	S	*	*				54	144.9	117.7	0	0	0	0	0	122.7
134	S	35.3	Very low	31.6	Very low	131 Å²	131	129.2 Å²	129.2	92%	0.916	78%	0.784	S	S	*	*			trans	67.5	147.2	175.5	76.3	0	0	0	0	115.6
135	G	30.7	Very low	31.5	Very low	60 Å²	60	126.7 Å²	126.7	62%	0.619	79%	0.786	S	S	*	*			cis	159.9	157.7	-5.2	0	0	0	0	0	111.6
136	S	34	Very low	31.5	Very low	129 Å²	129	129.5 Å²	129.5	90%	0.902	79%	0.786	S	S	*	*			trans	70.2	158.9	-175.5	78.5	0	0	0	0	116.9
137	S	29.1	Very low	31.3	Very low	93 Å²	93	131.1 Å²	131.1	65%	0.65	79%	0.789	S	S	*	*			cis	167.3	125.2	-49.5	174.3	0	0	0	0	109.6
138	L	27.1	Very low	31	Very low	157 Å²	157	131.4 Å²	131.4	82%	0.822	79%	0.791	S	S	*	*			trans	64.4	163.7	165.9	-56.3	161.4	0	0	0	115.7
139	T	30.1	Very low	30.9	Very low	129 Å²	129	129 Å²	129	79%	0.791	79%	0.786	S	S	*	*			cis	-148.5	164.2	1.4	-19.5	0	0	0	0	111.4
140	F	27.6	Very low	30.5	Very low	195 Å²	195	129 Å²	129	86%	0.855	79%	0.794	S	S	*	*			trans	-67.7	156	167.8	-97.3	-107.9	0	0	0	114.2
141	Q	30.9	Very low	30.2	Very low	198 Å²	198	129.9 Å²	129.9	93%	0.925	79%	0.794	S	S	*	*			trans	-156.7	171.3	139.3	-116.5	172.4	33.6	0	0	114.1
142	H	29.8	Very low	30	Very low	169 Å²	169	129.8 Å²	129.8	78%	0.782	79%	0.794	S	S	*	*			trans	-107.1	152.8	-155.4	-129.3	-109.2	0	0	0	114.1
143	T	32.2	Very low	29.8	Very low	132 Å²	132	129.6 Å²	129.6	81%	0.81	79%	0.792	S	S	*	*			trans	-178.4	94.8	148	18.3	0	0	0	0	108.9
144	S	28.6	Very low	29.6	Very low	101 Å²	101	135.2 Å²	135.2	71%	0.706	80%	0.802	S	S	*	*				63.2	85.6	84.3	75.3	0	0	0	0	116.2
145	S	33.9	Very low	29.2	Very low	119 Å²	119	132 Å²	132	83%	0.832	79%	0.79	S	S	*	*			trans	-144.1	154.9	148.7	56.4	0	0	0	0	109.5
146	H	31.6	Very low	29.2	Very low	178 Å²	178	133.1 Å²	133.1	82%	0.824	79%	0.788	S	S	*	*			trans	-85	132.4	-169.3	-72.6	-109.8	0	0	0	112.5
147	D	29.7	Very low	29.4	Very low	165 Å²	165	128.7 Å²	128.7	88%	0.882	75%	0.754	S	S	*	*				-157.6	144.4	121.4	-106.2	-32.5	0	0	0	110.6
148	V	28.4	Very low	29.7	Very low	119 Å²	119	129.2 Å²	129.2	72%	0.721	76%	0.764	S	S	*	*			trans	-100.4	93.5	-170	-177.6	0	0	0	0	110.8
149	S	28.8	Very low	30.4	Very low	94 Å²	94	132.1 Å²	132.1	66%	0.657	76%	0.764	S	S	*	*			trans	-114.2	112.7	167.8	-174.8	0	0	0	0	110	N151	S149-N151 PolarHBondContact O-N 3.28Å
150	C	24.2	Very low	31.5	Very low	125 Å²	125	128 Å²	128	85%	0.845	74%	0.739	S	S	*	*			trans	-83.5	48.3	-177.7	47.8	0	0	0	0	113.5	G152	C150-G152 PolarHBondContact O-N 3.27Å
151	N	27.3	Very low	33	Very low	149 Å²	149	119.6 Å²	119.6	80%	0.797	71%	0.708	S	S	*	*			trans	-85.4	82.9	172.6	-82	-8.1	0	0	0	111.2	S149 S153	S149-N151 PolarHBondContact O-N 3.28Å; N151-S153 PolarHBondContact O-N 3.45Å; N151-S153 VanDerWaalsContact O-N 3.13Å
152	G	26.2	Very low	35.1	Very low	69 Å²	69	110.6 Å²	110.6	71%	0.711	67%	0.666	S	S	*	*			trans	-73.4	95.2	176.1	0	0	0	0	0	113.5	C150 Q154	C150-G152 PolarHBondContact O-N 3.27Å; G152-Q154 PolarHBondContact O-N 2.72Å
153	S	28.8	Very low	37.1	Very low	116 Å²	116	106.7 Å²	106.7	81%	0.811	65%	0.648	S	S	*	*			trans	56.1	48.4	149.6	-53.4	0	0	0	0	119.1	N151 G155	N151-S153 PolarHBondContact O-N 3.45Å; N151-S153 VanDerWaalsContact O-N 3.13Å; S153-G155 PolarHBondContact O-N 3.44Å
154	Q	27.9	Very low	39	Very low	211 Å²	211	103.2 Å²	103.2	99%	0.986	63%	0.629	S	S	*	*			trans	-74.2	39.5	155.6	-74.1	-167	-25.2	0	0	112.4	G152	G152-Q154 PolarHBondContact O-N 2.72Å
155	G	26	Very low	41.5	Very low	63 Å²	63	101.2 Å²	101.2	65%	0.649	61%	0.609	S	S	*	*			trans	-106.8	119	-170.7	0	0	0	0	0	113.6	S153	S153-G155 PolarHBondContact O-N 3.44Å
156	S	30.8	Very low	43.9	Very low	85 Å²	85	103 Å²	103	59%	0.594	60%	0.601	S	S	*	*	S	Bend	trans	74.4	50.5	157.3	-164.3	0	0	0	0	119.8
157	L	38.9	Very low	46.6	Very low	35 Å²	35	95.1 Å²	95.1	18%	0.183	56%	0.564	C	S	.	*	S	Bend	trans	-108.4	-21.2	138.6	-110.7	-179.4	0	0	0	113.8	R159 V160 E193 L201	L157-R159 PolarHBondContact O-N 2.75Å; L157-V160 HydrophobicContact CD2-CG2 4.4Å; L157-V160 PolarHBondContact O-N 2.97Å; L157-V160 VanDerWaalsContact O-N 3.1Å; L157-E193 HydrophobicContact CD1-CG 3.85Å; L157-L201 HydrophobicContact CD1-CD2 4.02Å
158	A	35.1	Very low	49.6	Very low	105 Å²	105	88 Å²	88	87%	0.868	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	17.4	175	0	0	0	0	0	115.8
159	R	41.7	Very low	52.2	Low	217 Å²	217	83.7 Å²	83.7	82%	0.819	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-13.5	168	-78.5	-176	164.2	-171	-5	113.1	L157	L157-R159 PolarHBondContact O-N 2.75Å
160	V	52.7	Low	54.9	Low	43 Å²	43	79.7 Å²	79.7	26%	0.261	47%	0.471	S	S	.	.	S	Bend	trans	-113.1	102.2	175.7	-153.2	0	0	0	0	107.8	L157 L162	L157-V160 HydrophobicContact CD2-CG2 4.4Å; L157-V160 PolarHBondContact O-N 2.97Å; L157-V160 VanDerWaalsContact O-N 3.1Å; V160-L162 HydrophobicContact CB-CD1 4.42Å; V160-L162 HydrophobicContact CB-CG 4.1Å; V160-L162 HydrophobicContact CG1-CD1 4.08Å; V160-L162 HydrophobicContact CG1-CD2 3.7Å; V160-L162 HydrophobicContact CG1-CG 3.66Å; V160-L162 PolarHBondContact O-N 3.47Å
161	G	58.6	Low	57.7	Low	19 Å²	19	77.2 Å²	77.2	20%	0.196	46%	0.459	C	S	.	.			trans	-76.9	60.9	-178.1	0	0	0	0	0	112.7	E163 S164	G161-E163 PolarHBondContact O-N 2.82Å; G161-S164 PolarHBondContact O-OG 3.36Å
162	L	76	Confident	60.2	Low	8 Å²	8	71 Å²	71	4%	0.042	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-73.7	-6.7	175	-55.9	178.1	0	0	0	111.9	V160 S164 E165 W167 Y168 L201 V235	V160-L162 HydrophobicContact CB-CD1 4.42Å; V160-L162 HydrophobicContact CB-CG 4.1Å; V160-L162 HydrophobicContact CG1-CD1 4.08Å; V160-L162 HydrophobicContact CG1-CD2 3.7Å; V160-L162 HydrophobicContact CG1-CG 3.66Å; V160-L162 PolarHBondContact O-N 3.47Å; L162-S164 PolarHBondContact O-N 2.61Å; L162-S164 VanDerWaalsContact O-N 3.13Å; L162-E165 HydrophobicContact CD2-CG 4.41Å; L162-E165 VanDerWaalsContact O-CB 3.3Å; L162-E165 WeakPolarHBondContact O-CB 3.32Å; L162-E165 PolarHBondContact O-N 3.33Å; L162-W167 HydrophobicContact CD2-CH2 3.99Å; L162-W167 HydrophobicContact CD2-CZ3 4.47Å; L162-Y168 HydrophobicContact CB-CD1 3.52Å; L162-Y168 HydrophobicContact CB-CD2 3.71Å; L162-Y168 HydrophobicContact CB-CE1 3.92Å; L162-Y168 HydrophobicContact CB-CE2 4.09Å; L162-Y168 HydrophobicContact CB-CG 3.4Å; L162-Y168 VanDerWaalsContact CB-CG 3.4Å; L162-Y168 HydrophobicContact CD1-CD2 3.69Å; L162-Y168 HydrophobicContact CD1-CE2 3.68Å; L162-Y168 HydrophobicContact CD1-CG 4.3Å; L162-Y168 HydrophobicContact CG-CD2 4.35Å; L162-Y168 HydrophobicContact CG-CG 4.49Å; L162-Y168 VanDerWaalsContact O-CB 3.26Å; L162-Y168 WeakPolarHBondContact O-CB 3.34Å; L162-Y168 WeakPolarHBondContact O-CD1 3.46Å; L162-L201 HydrophobicContact CD1-CD1 3.87Å; L162-V235 HydrophobicContact CD1-CB 4.1Å; L162-V235 HydrophobicContact CD1-CG1 4.17Å; L162-V235 HydrophobicContact CD1-CG2 4.18Å; L162-V235 HydrophobicContact CD2-CB 4.3Å
163	E	71.3	Confident	62.7	Low	88 Å²	88	69.8 Å²	69.8	41%	0.411	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-53.9	-35	-178.6	-60.6	-176.7	141.6	0	0	113.2	G115 R116 G161 K259	G115-E163 VanDerWaalsContact CA-OE2 3.25Å; G115-E163 WeakPolarHBondContact CA-OE2 3.45Å; R116-E163 PolarHBondContact N-OE2 3.47Å; G161-E163 PolarHBondContact O-N 2.82Å; E163-K259 PolarHBondContact O-NZ 3.11Å
164	S	72.9	Confident	65.4	Low	59 Å²	59	66.2 Å²	66.2	41%	0.413	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-73.6	-22.1	175.2	51.6	0	0	0	0	114.4	G161 L162	G161-S164 PolarHBondContact O-OG 3.36Å; L162-S164 PolarHBondContact O-N 2.61Å; L162-S164 VanDerWaalsContact O-N 3.13Å
165	E	81.5	Confident	67.8	Low	59 Å²	59	56.3 Å²	56.3	28%	0.276	33%	0.325	S	S	.	.	S	Bend	trans	-71.5	133.1	-176.7	-68.5	-76.2	-158.7	0	0	111.2	L162 W167 Y168 S236 K259	L162-E165 HydrophobicContact CD2-CG 4.41Å; L162-E165 VanDerWaalsContact O-CB 3.3Å; L162-E165 WeakPolarHBondContact O-CB 3.32Å; L162-E165 PolarHBondContact O-N 3.33Å; E165-W167 VanDerWaalsContact C-N 3.27Å; E165-W167 HydrophobicContact CB-CD2 3.96Å; E165-W167 HydrophobicContact CB-CE3 4.23Å; E165-W167 HydrophobicContact CB-CH2 4.06Å; E165-W167 HydrophobicContact CB-CZ2 3.76Å; E165-W167 HydrophobicContact CB-CZ3 4.28Å; E165-W167 HydrophobicContact CG-CH2 3.85Å; E165-W167 HydrophobicContact CG-CZ2 3.51Å; E165-W167 PolarHBondContact O-N 3.48Å; E165-Y168 PolarHBondContact O-N 3.15Å; E165-S236 PolarHBondContact OE1-OG 3.01Å; E165-K259 WeakPolarHBondContact O-CE 3.34Å; E165-K259 PolarHBondContact O-NZ 3.34Å
166	K	83	Confident	70.3	Confident	156 Å²	156	56.1 Å²	56.1	68%	0.678	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-36.4	-174.1	-65.6	177.4	-176.1	172.7	0	112.6	P256 K259	K166-P256 HydrophobicContact CB-CB 4.12Å; K166-K259 WeakPolarHBondContact O-CE 3.26Å
167	W	89.5	Confident	72.9	Confident	12 Å²	12	52.1 Å²	52.1	5%	0.045	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-14.1	-178.9	42.1	-100.9	0	0	0	113.9	L162 E165 H169 F189 L190 I191 V235 S236 V239 P256	L162-W167 HydrophobicContact CD2-CH2 3.99Å; L162-W167 HydrophobicContact CD2-CZ3 4.47Å; E165-W167 VanDerWaalsContact C-N 3.27Å; E165-W167 HydrophobicContact CB-CD2 3.96Å; E165-W167 HydrophobicContact CB-CE3 4.23Å; E165-W167 HydrophobicContact CB-CH2 4.06Å; E165-W167 HydrophobicContact CB-CZ2 3.76Å; E165-W167 HydrophobicContact CB-CZ3 4.28Å; E165-W167 HydrophobicContact CG-CH2 3.85Å; E165-W167 HydrophobicContact CG-CZ2 3.51Å; E165-W167 PolarHBondContact O-N 3.48Å; W167-H169 PolarHBondContact O-CD2 2.8Å; W167-F189 HydrophobicContact CB-CD2 4.16Å; W167-F189 HydrophobicContact CB-CE2 3.42Å; W167-F189 VanDerWaalsContact CB-CE2 3.42Å; W167-F189 HydrophobicContact CB-CZ 3.81Å; W167-F189 AromaticContact CG-CE2 3.84Å; W167-F189 HydrophobicContact CG-CE2 3.84Å; W167-F189 HydrophobicContact CG-CZ 4.1Å; W167-L190 CarbonylContact O-C 3.52Å; W167-L190 WeakPolarHBondContact O-CA 3.44Å; W167-I191 HydrophobicContact CE3-CB 4Å; W167-I191 HydrophobicContact CE3-CD1 3.8Å; W167-I191 HydrophobicContact CE3-CG1 4.11Å; W167-I191 HydrophobicContact CZ3-CB 4.29Å; W167-I191 HydrophobicContact CZ3-CD1 3.78Å; W167-I191 HydrophobicContact CZ3-CG1 4.45Å; W167-I191 PolarHBondContact O-N 2.76Å; W167-V235 HydrophobicContact CH2-CG1 4.01Å; W167-V235 HydrophobicContact CZ3-CG1 3.96Å; W167-S236 WeakPolarHBondContact CZ2-OG 3.43Å; W167-V239 HydrophobicContact CD2-CG1 4.37Å; W167-V239 HydrophobicContact CD2-CG2 4.13Å; W167-V239 HydrophobicContact CE3-CG2 4.14Å; W167-V239 HydrophobicContact CG-CG1 4.46Å; W167-V239 HydrophobicContact CH2-CG2 4Å; W167-V239 HydrophobicContact CZ2-CB 4.21Å; W167-V239 HydrophobicContact CZ2-CG1 4.43Å; W167-V239 HydrophobicContact CZ2-CG2 3.99Å; W167-V239 HydrophobicContact CZ3-CG2 4.08Å; W167-P256 HydrophobicContact CB-CB 3.97Å; W167-P256 HydrophobicContact CB-CG 4.31Å
168	Y	91	Very high	75.2	Confident	17 Å²	17	50.4 Å²	50.4	7%	0.067	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	115.8	179.7	-173.1	-104	0	0	0	111.8	L162 E165 G170 I191 E193 L201 K259	L162-Y168 HydrophobicContact CB-CD1 3.52Å; L162-Y168 HydrophobicContact CB-CD2 3.71Å; L162-Y168 HydrophobicContact CB-CE1 3.92Å; L162-Y168 HydrophobicContact CB-CE2 4.09Å; L162-Y168 HydrophobicContact CB-CG 3.4Å; L162-Y168 VanDerWaalsContact CB-CG 3.4Å; L162-Y168 HydrophobicContact CD1-CD2 3.69Å; L162-Y168 HydrophobicContact CD1-CE2 3.68Å; L162-Y168 HydrophobicContact CD1-CG 4.3Å; L162-Y168 HydrophobicContact CG-CD2 4.35Å; L162-Y168 HydrophobicContact CG-CG 4.49Å; L162-Y168 VanDerWaalsContact O-CB 3.26Å; L162-Y168 WeakPolarHBondContact O-CB 3.34Å; L162-Y168 WeakPolarHBondContact O-CD1 3.46Å; E165-Y168 PolarHBondContact O-N 3.15Å; Y168-G170 VanDerWaalsContact CE1-CA 3.44Å; Y168-I191 WeakPolarHBondContact CA-O 3.47Å; Y168-I191 HydrophobicContact CD2-CB 4.33Å; Y168-I191 HydrophobicContact CD2-CG2 3.97Å; Y168-I191 HydrophobicContact CE2-CG2 4.29Å; Y168-E193 WeakPolarHBondContact OH-CG 3.26Å; Y168-E193 PolarHBondContact OH-OE1 2.6Å; Y168-E193 VanDerWaalsContact OH-OE1 3.12Å; Y168-L201 HydrophobicContact CE2-CD1 4.29Å; Y168-L201 HydrophobicContact CE2-CD2 3.9Å; Y168-K259 WeakPolarHBondContact O-CE 3.2Å; Y168-K259 PolarHBondContact O-NZ 2.69Å
169	H	84.3	Confident	77.3	Confident	27 Å²	27	46 Å²	46	13%	0.125	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-1.5	-178.8	-73.1	-128.6	0	0	0	113.1	W167 I172 L180 I191 A257 P258	W167-H169 PolarHBondContact O-CD2 2.8Å; H169-I172 HydrophobicContact CB-CD1 3.5Å; H169-I172 HydrophobicContact CB-CG1 3.79Å; H169-I172 HydrophobicContact CB-CG2 4.36Å; H169-L180 VanDerWaalsContact ND1-CD1 3.34Å; H169-L180 WeakPolarHBondContact ND1-CD1 3.3Å; H169-I191 PolarHBondContact N-O 2.62Å; H169-A257 PolarHBondContact CE1-O 2.9Å; H169-A257 PolarHBondContact NE2-O 3.14Å; H169-P258 PolarHBondContact CE1-O 3.21Å
170	G	85.3	Confident	79.3	Confident	11 Å²	11	36 Å²	36	11%	0.113	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	71.9	-152	-179.8	0	0	0	0	0	113.2	Y168 I172 R192 E193	Y168-G170 VanDerWaalsContact CE1-CA 3.44Å; G170-I172 VanDerWaalsContact C-N 3.27Å; G170-I172 PolarHBondContact O-N 3.47Å; G170-R192 CarbonylContact O-C 3.49Å; G170-R192 WeakPolarHBondContact O-CA 3.32Å; G170-R192 WeakPolarHBondContact O-CB 3.31Å; G170-E193 PolarHBondContact O-N 2.86Å
171	A	83	Confident	80.8	Confident	73 Å²	73	33.9 Å²	33.9	60%	0.603	18%	0.179	S	C	*	.	S	Bend	trans	-65.4	81.8	171.3	0	0	0	0	0	112.3	E193	A171-E193 HydrophobicContact CB-CB 4.39Å; A171-E193 PolarHBondContact N-OE1 3.26Å
172	I	78.9	Confident	81.7	Confident	19 Å²	19	34.9 Å²	34.9	10%	0.097	18%	0.18	C	C	.	.			trans	-119.5	151	165.2	63.1	157.5	0	0	0	111.4	H169 G170 Y176 A177 L180 L190 R192	H169-I172 HydrophobicContact CB-CD1 3.5Å; H169-I172 HydrophobicContact CB-CG1 3.79Å; H169-I172 HydrophobicContact CB-CG2 4.36Å; G170-I172 VanDerWaalsContact C-N 3.27Å; G170-I172 PolarHBondContact O-N 3.47Å; I172-Y176 HydrophobicContact CB-CD1 4Å; I172-Y176 HydrophobicContact CD1-CD1 4.19Å; I172-Y176 HydrophobicContact CG2-CD1 3.95Å; I172-Y176 HydrophobicContact CG2-CE1 4.28Å; I172-A177 HydrophobicContact CD1-CB 4.14Å; I172-L180 HydrophobicContact CD1-CD1 3.7Å; I172-L190 HydrophobicContact CD1-CD1 3.95Å; I172-L190 HydrophobicContact CD1-CD2 3.94Å; I172-R192 HydrophobicContact CD1-CB 4.37Å; I172-R192 HydrophobicContact CG1-CB 3.54Å; I172-R192 HydrophobicContact CG1-CG 4.49Å; I172-R192 WeakPolarHBondContact O-CD 3.49Å; I172-R192 PolarHBondContact O-NH1 2.79Å
173	Q	79.9	Confident	81.5	Confident	42 Å²	42	38.3 Å²	38.3	20%	0.196	20%	0.204	C	C	.	.			trans	-83.6	160	-172	-72.2	161.2	0.5	0	0	113.7	S175 Y176 A177 E195 E536	Q173-S175 PolarHBondContact O-N 2.84Å; Q173-Y176 PolarHBondContact O-N 3.15Å; Q173-Y176 VanDerWaalsContact O-N 3.17Å; Q173-A177 WeakPolarHBondContact O-CB 3.34Å; Q173-A177 PolarHBondContact O-N 2.79Å; Q173-E195 WeakPolarHBondContact CA-OE1 3.32Å; Q173-E195 WeakPolarHBondContact CB-OE1 3.27Å; Q173-E195 HydrophobicContact CG-CG 4.32Å; Q173-E195 WeakPolarHBondContact CG-OE1 3.32Å; Q173-E536 PolarHBondContact NE2-OE1 3.46Å; Q173-E536 PolarHBondContact NE2-OE2 2.85Å; Q173-E536 VanDerWaalsContact NE2-OE2 3.12Å; Q173-E536 PolarHBondContact OE1-OE1 3.24Å
174	R	84.6	Confident	81.5	Confident	42 Å²	42	35 Å²	35	16%	0.158	19%	0.194	C	C	.	.	H	α-helix	trans	-53.3	-51.4	176.8	-170.4	-179.4	-177	135.9	5	111.3	Y176 A177 E178 E195 H213 T543 E545	R174-Y176 VanDerWaalsContact C-N 3.33Å; R174-Y176 PolarHBondContact O-N 3.13Å; R174-A177 PolarHBondContact O-N 2.71Å; R174-E178 IonicContact NE-OE1 3.18Å; R174-E178 PolarHBondContact NE-OE1 3.06Å; R174-E178 WeakPolarHBondContact O-CG 3.4Å; R174-E178 PolarHBondContact O-N 2.95Å; R174-E195 WeakPolarHBondContact CB-OE2 3.49Å; R174-E195 VanDerWaalsContact N-CD 3.25Å; R174-E195 PolarHBondContact N-OE1 2.89Å; R174-E195 PolarHBondContact N-OE2 3.06Å; R174-E195 VanDerWaalsContact N-OE2 3.12Å; R174-H213 VanDerWaalsContact CG-CE1 3.42Å; R174-H213 WeakPolarHBondContact CG-CE1 3.37Å; R174-H213 PolarHBondContact NH2-CD2 3.12Å; R174-T543 PolarHBondContact NH2-OG1 2.86Å; R174-E545 IonicContact CZ-OE1 2.66Å; R174-E545 IonicContact NH1-OE1 3.99Å; R174-E545 PolarHBondContact NH1-OE1 3.18Å; R174-E545 VanDerWaalsContact NH1-OE1 3.07Å
175	S	78.1	Confident	81.9	Confident	3 Å²	3	37 Å²	37	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-63.8	-34	180	57.6	0	0	0	0	113.1	Q173 Y179	Q173-S175 PolarHBondContact O-N 2.84Å; S175-Y179 PolarHBondContact O-N 3.25Å
176	Y	79.4	Confident	82.1	Confident	59 Å²	59	37.1 Å²	37.1	23%	0.231	20%	0.204	C	C	.	.	H	α-helix	trans	-75	-41.9	174	-169.3	-122.2	0	0	0	111.9	I172 Q173 R174 E178 Y179 L180 H383	I172-Y176 HydrophobicContact CB-CD1 4Å; I172-Y176 HydrophobicContact CD1-CD1 4.19Å; I172-Y176 HydrophobicContact CG2-CD1 3.95Å; I172-Y176 HydrophobicContact CG2-CE1 4.28Å; Q173-Y176 PolarHBondContact O-N 3.15Å; Q173-Y176 VanDerWaalsContact O-N 3.17Å; R174-Y176 VanDerWaalsContact C-N 3.33Å; R174-Y176 PolarHBondContact O-N 3.13Å; Y176-E178 VanDerWaalsContact C-N 3.26Å; Y176-E178 PolarHBondContact O-N 2.93Å; Y176-Y179 AromaticContact CD2-CD1 3.81Å; Y176-Y179 HydrophobicContact CD2-CD1 3.81Å; Y176-Y179 AromaticContact CE2-CD1 3.63Å; Y176-Y179 HydrophobicContact CE2-CD1 3.63Å; Y176-Y179 HydrophobicContact CE2-CE1 4.13Å; Y176-Y179 CarbonylContact O-C 3.58Å; Y176-Y179 WeakPolarHBondContact O-CA 3Å; Y176-Y179 WeakPolarHBondContact O-CB 3.1Å; Y176-Y179 PolarHBondContact O-N 3.15Å; Y176-L180 HydrophobicContact CD1-CD1 4.03Å; Y176-L180 HydrophobicContact CD1-CG 4.23Å; Y176-L180 HydrophobicContact CE1-CD1 3.87Å; Y176-L180 HydrophobicContact CE1-CD2 4.04Å; Y176-L180 HydrophobicContact CE1-CG 4.09Å; Y176-L180 HydrophobicContact CE2-CD2 4.23Å; Y176-L180 WeakPolarHBondContact O-CG 3.41Å; Y176-L180 PolarHBondContact O-N 3.04Å; Y176-H383 AromaticContact CD2-CE1 3.22Å; Y176-H383 WeakPolarHBondContact CD2-CE1 3.45Å; Y176-H383 AromaticContact CD2-ND1 3.61Å; Y176-H383 AromaticContact CD2-NE2 3.7Å; Y176-H383 AromaticContact CE2-CE1 3.34Å; Y176-H383 WeakPolarHBondContact CE2-CE1 3.45Å; Y176-H383 AromaticContact CE2-NE2 3.48Å; Y176-H383 WeakPolarHBondContact CE2-NE2 3.48Å
177	A	85.8	Confident	82.2	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-58.4	-40.5	173.6	0	0	0	0	0	111.6	I172 Q173 R174 L180 L181 L190	I172-A177 HydrophobicContact CD1-CB 4.14Å; Q173-A177 WeakPolarHBondContact O-CB 3.34Å; Q173-A177 PolarHBondContact O-N 2.79Å; R174-A177 PolarHBondContact O-N 2.71Å; A177-L180 PolarHBondContact O-N 3.01Å; A177-L181 WeakPolarHBondContact O-CB 3.45Å; A177-L181 WeakPolarHBondContact O-CG 3.39Å; A177-L181 PolarHBondContact O-N 3.48Å; A177-L190 HydrophobicContact CB-CD1 3.96Å; A177-L190 HydrophobicContact CB-CD2 4.2Å
178	E	86.5	Confident	82.2	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-64.6	-40.6	172.2	-73.6	-178	-143.4	0	0	112.1	R174 Y176 L180 L181 N182 I211 H213 T540 N541	R174-E178 IonicContact NE-OE1 3.18Å; R174-E178 PolarHBondContact NE-OE1 3.06Å; R174-E178 WeakPolarHBondContact O-CG 3.4Å; R174-E178 PolarHBondContact O-N 2.95Å; Y176-E178 VanDerWaalsContact C-N 3.26Å; Y176-E178 PolarHBondContact O-N 2.93Å; E178-L180 PolarHBondContact O-N 3.17Å; E178-L181 PolarHBondContact O-N 2.68Å; E178-N182 VanDerWaalsContact O-CB 3.22Å; E178-N182 WeakPolarHBondContact O-CB 3.36Å; E178-N182 VanDerWaalsContact O-CG 3.26Å; E178-N182 PolarHBondContact O-N 2.71Å; E178-N182 PolarHBondContact O-ND2 3.39Å; E178-I211 HydrophobicContact CB-CD1 3.92Å; E178-I211 HydrophobicContact CG-CB 4.02Å; E178-I211 HydrophobicContact CG-CD1 4Å; E178-I211 HydrophobicContact CG-CG2 3.83Å; E178-I211 WeakPolarHBondContact O-CD1 3.35Å; E178-H213 WeakPolarHBondContact CG-NE2 3.35Å; E178-H213 IonicContact OE1-CD2 3.6Å; E178-H213 IonicContact OE1-CE1 2.67Å; E178-H213 IonicContact OE1-NE2 3.2Å; E178-H213 PolarHBondContact OE1-NE2 2.85Å; E178-T540 WeakPolarHBondContact OE2-CB 3.33Å; E178-T540 PolarHBondContact OE2-OG1 2.92Å; E178-N541 PolarHBondContact OE2-ND2 2.96Å
179	Y	80.1	Confident	82.4	Confident	12 Å²	12	28.8 Å²	28.8	5%	0.047	17%	0.169	C	C	.	.	H	α-helix	trans	-60.3	-41.6	171.3	168.1	-110	0	0	0	113.3	S175 Y176 R260 S379 V380 H383 Q415 H416	S175-Y179 PolarHBondContact O-N 3.25Å; Y176-Y179 AromaticContact CD2-CD1 3.81Å; Y176-Y179 HydrophobicContact CD2-CD1 3.81Å; Y176-Y179 AromaticContact CE2-CD1 3.63Å; Y176-Y179 HydrophobicContact CE2-CD1 3.63Å; Y176-Y179 HydrophobicContact CE2-CE1 4.13Å; Y176-Y179 CarbonylContact O-C 3.58Å; Y176-Y179 WeakPolarHBondContact O-CA 3Å; Y176-Y179 WeakPolarHBondContact O-CB 3.1Å; Y176-Y179 PolarHBondContact O-N 3.15Å; Y179-R260 VanDerWaalsContact CE1-NH1 3.35Å; Y179-R260 VanDerWaalsContact CZ-NH1 3.28Å; Y179-R260 PolarHBondContact O-NH1 2.9Å; Y179-R260 PolarHBondContact OH-NH1 2.83Å; Y179-S379 PolarHBondContact N-OG 2.93Å; Y179-V380 HydrophobicContact CD2-CG2 3.63Å; Y179-V380 HydrophobicContact CE2-CG2 3.85Å; Y179-H383 AromaticContact CD1-CD2 3.49Å; Y179-H383 VanDerWaalsContact CD1-CD2 3.49Å; Y179-H383 WeakPolarHBondContact CD1-CD2 3.16Å; Y179-H383 AromaticContact CD1-NE2 3.69Å; Y179-H383 AromaticContact CE1-CD2 3.86Å; Y179-H383 AromaticContact CE1-NE2 3.9Å; Y179-H383 HydrophobicContact CG-CB 4.45Å; Y179-H383 AromaticContact CG-CD2 3.63Å; Y179-Q415 VanDerWaalsContact OH-C 3.24Å; Y179-Q415 PolarHBondContact OH-O 3.45Å; Y179-H416 HydrophobicContact CE2-CB 4.32Å; Y179-H416 AromaticContact CE2-ND1 3.36Å; Y179-H416 WeakPolarHBondContact CE2-ND1 3.47Å; Y179-H416 AromaticContact CZ-ND1 3.9Å
180	L	81.9	Confident	82.8	Confident	6 Å²	6	27.5 Å²	27.5	3%	0.031	16%	0.163	C	C	.	.	H	α-helix	trans	-63.2	-43.1	177.5	-65.4	-177.4	0	0	0	111.7	H169 I172 Y176 A177 E178 S183 L190 R260	H169-L180 VanDerWaalsContact ND1-CD1 3.34Å; H169-L180 WeakPolarHBondContact ND1-CD1 3.3Å; I172-L180 HydrophobicContact CD1-CD1 3.7Å; Y176-L180 HydrophobicContact CD1-CD1 4.03Å; Y176-L180 HydrophobicContact CD1-CG 4.23Å; Y176-L180 HydrophobicContact CE1-CD1 3.87Å; Y176-L180 HydrophobicContact CE1-CD2 4.04Å; Y176-L180 HydrophobicContact CE1-CG 4.09Å; Y176-L180 HydrophobicContact CE2-CD2 4.23Å; Y176-L180 WeakPolarHBondContact O-CG 3.41Å; Y176-L180 PolarHBondContact O-N 3.04Å; A177-L180 PolarHBondContact O-N 3.01Å; E178-L180 PolarHBondContact O-N 3.17Å; L180-S183 PolarHBondContact O-OG 3.24Å; L180-L190 HydrophobicContact CB-CD2 4.03Å; L180-L190 HydrophobicContact CD1-CD2 3.7Å; L180-L190 HydrophobicContact CG-CD2 4.5Å; L180-R260 HydrophobicContact CD2-CB 3.73Å; L180-R260 HydrophobicContact CD2-CG 3.59Å
181	L	85.8	Confident	83.3	Confident	0 Å²	0	27 Å²	27	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-82.1	-19	-177.9	-66.8	172.4	0	0	0	113.7	A177 E178 S183 G184 S188 L190 S204 R206 I211 A257	A177-L181 WeakPolarHBondContact O-CB 3.45Å; A177-L181 WeakPolarHBondContact O-CG 3.39Å; A177-L181 PolarHBondContact O-N 3.48Å; E178-L181 PolarHBondContact O-N 2.68Å; L181-S183 PolarHBondContact O-N 3.29Å; L181-S183 VanDerWaalsContact O-N 3.13Å; L181-G184 PolarHBondContact O-N 2.78Å; L181-S188 WeakPolarHBondContact CD2-O 3.39Å; L181-L190 HydrophobicContact CD1-CG 4.42Å; L181-L190 HydrophobicContact CG-CD2 4.36Å; L181-S204 WeakPolarHBondContact CD1-O 3.32Å; L181-R206 VanDerWaalsContact O-CD 3.29Å; L181-R206 WeakPolarHBondContact O-CD 3.39Å; L181-R206 PolarHBondContact O-NH1 2.74Å; L181-I211 HydrophobicContact CB-CD1 3.93Å; L181-I211 HydrophobicContact CB-CG1 4.37Å; L181-I211 HydrophobicContact CB-CG2 4.32Å; L181-I211 HydrophobicContact CD1-CG2 3.72Å; L181-A257 HydrophobicContact CD2-CB 3.9Å
182	N	77.9	Confident	83.7	Confident	40 Å²	40	23.8 Å²	23.8	21%	0.214	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-18.1	178.3	-97.5	-49.5	0	0	0	114.5	E178 R206 S379	E178-N182 VanDerWaalsContact O-CB 3.22Å; E178-N182 WeakPolarHBondContact O-CB 3.36Å; E178-N182 VanDerWaalsContact O-CG 3.26Å; E178-N182 PolarHBondContact O-N 2.71Å; E178-N182 PolarHBondContact O-ND2 3.39Å; N182-R206 PolarHBondContact O-NH1 3.21Å; N182-S379 VanDerWaalsContact ND2-CB 3.27Å; N182-S379 WeakPolarHBondContact ND2-CB 3.49Å; N182-S379 PolarHBondContact ND2-OG 2.94Å; N182-S379 VanDerWaalsContact ND2-OG 3.14Å
183	S	70	Confident	84.1	Confident	79 Å²	79	25.6 Å²	25.6	55%	0.552	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.7	-1.4	169.8	60.8	0	0	0	0	114.8	L180 L181 R260	L180-S183 PolarHBondContact O-OG 3.24Å; L181-S183 PolarHBondContact O-N 3.29Å; L181-S183 VanDerWaalsContact O-N 3.13Å; S183-R260 PolarHBondContact OG-NH2 2.81Å
184	G	73.2	Confident	84	Confident	20 Å²	20	24.1 Å²	24.1	21%	0.206	13%	0.132	C	C	.	.	S	Bend	trans	-79.9	-179.9	179.8	0	0	0	0	0	113.5	L181 R206	L181-G184 PolarHBondContact O-N 2.78Å; G184-R206 PolarHBondContact O-NE 3.02Å; G184-R206 PolarHBondContact O-NH1 3.06Å; G184-R206 VanDerWaalsContact O-NH1 3.11Å
185	I	79.7	Confident	83.3	Confident	101 Å²	101	26.1 Å²	26.1	52%	0.518	14%	0.144	S	C	.	.			trans	-105	171.7	169.5	56.5	176.2	0	0	0	110.8	G187 S188 Y255	I185-G187 PolarHBondContact O-N 3.29Å; I185-S188 PolarHBondContact N-OG 2.75Å; I185-S188 WeakPolarHBondContact O-CB 3.25Å; I185-S188 PolarHBondContact O-N 2.94Å; I185-S188 PolarHBondContact O-OG 3.36Å; I185-Y255 HydrophobicContact CD1-CD2 3.67Å; I185-Y255 HydrophobicContact CD1-CE1 4.37Å; I185-Y255 HydrophobicContact CD1-CE2 3.4Å; I185-Y255 VanDerWaalsContact CD1-CE2 3.4Å; I185-Y255 HydrophobicContact CD1-CG 4.27Å; I185-Y255 HydrophobicContact CG1-CD2 3.62Å; I185-Y255 HydrophobicContact CG1-CE2 3.79Å; I185-Y255 HydrophobicContact CG1-CG 4.35Å
186	T	86.4	Confident	82.9	Confident	61 Å²	61	30.3 Å²	30.3	37%	0.374	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	135.7	171	-64.1	0	0	0	0	110.8	S188 Y207 E208 Y255	T186-S188 VanDerWaalsContact C-N 3.32Å; T186-Y207 HydrophobicContact CG2-CD2 3.56Å; T186-Y207 HydrophobicContact CG2-CE2 3.9Å; T186-Y207 HydrophobicContact CG2-CG 4.48Å; T186-E208 PolarHBondContact OG1-N 2.85Å; T186-Y255 WeakPolarHBondContact O-CE2 3.4Å
187	G	84.6	Confident	82.4	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.9	3	-172.4	0	0	0	0	0	114.4	I185 R206 L254 Y255	I185-G187 PolarHBondContact O-N 3.29Å; G187-R206 PolarHBondContact N-O 3.23Å; G187-L254 PolarHBondContact O-N 2.89Å; G187-Y255 PolarHBondContact O-N 3.4Å
188	S	89	Confident	81.5	Confident	9 Å²	9	36.7 Å²	36.7	6%	0.063	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	133.3	171.5	-54.1	0	0	0	0	110.6	L181 I185 T186 R206 Y255	L181-S188 WeakPolarHBondContact CD2-O 3.39Å; I185-S188 PolarHBondContact N-OG 2.75Å; I185-S188 WeakPolarHBondContact O-CB 3.25Å; I185-S188 PolarHBondContact O-N 2.94Å; I185-S188 PolarHBondContact O-OG 3.36Å; T186-S188 VanDerWaalsContact C-N 3.32Å; S188-R206 PolarHBondContact O-N 2.75Å; S188-Y255 CarbonylContact C-O 3.59Å; S188-Y255 VanDerWaalsContact CA-O 3.24Å; S188-Y255 WeakPolarHBondContact CA-O 3.34Å
189	F	95.8	Very high	80.7	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	161.9	-172.2	78.8	-79.7	0	0	0	114.1	W167 S204 L205 V239 L253 Y255 P256 A257	W167-F189 HydrophobicContact CB-CD2 4.16Å; W167-F189 HydrophobicContact CB-CE2 3.42Å; W167-F189 VanDerWaalsContact CB-CE2 3.42Å; W167-F189 HydrophobicContact CB-CZ 3.81Å; W167-F189 AromaticContact CG-CE2 3.84Å; W167-F189 HydrophobicContact CG-CE2 3.84Å; W167-F189 HydrophobicContact CG-CZ 4.1Å; F189-S204 CarbonylContact C-O 3.52Å; F189-S204 WeakPolarHBondContact CA-O 3.12Å; F189-L205 HydrophobicContact CB-CD1 3.91Å; F189-V239 HydrophobicContact CE2-CG1 3.99Å; F189-V239 HydrophobicContact CZ-CG1 4Å; F189-L253 HydrophobicContact CB-CD2 3.78Å; F189-L253 HydrophobicContact CD1-CB 3.66Å; F189-L253 HydrophobicContact CD1-CD2 4.38Å; F189-L253 HydrophobicContact CD2-CB 4.01Å; F189-L253 HydrophobicContact CD2-CD1 3.97Å; F189-L253 HydrophobicContact CD2-CD2 3.96Å; F189-L253 HydrophobicContact CD2-CG 4.19Å; F189-L253 HydrophobicContact CE1-CB 3.62Å; F189-L253 WeakPolarHBondContact CE1-O 3.36Å; F189-L253 HydrophobicContact CE2-CB 3.97Å; F189-L253 HydrophobicContact CE2-CD1 3.94Å; F189-L253 HydrophobicContact CE2-CG 4.4Å; F189-L253 HydrophobicContact CG-CB 3.86Å; F189-L253 HydrophobicContact CG-CD2 3.8Å; F189-L253 HydrophobicContact CG-CG 4.25Å; F189-L253 HydrophobicContact CZ-CB 3.77Å; F189-L253 HydrophobicContact CZ-CD1 4.48Å; F189-Y255 PolarHBondContact N-O 3.3Å; F189-P256 HydrophobicContact CE1-CB 4.46Å; F189-P256 HydrophobicContact CE1-CG 3.79Å; F189-P256 HydrophobicContact CZ-CG 3.89Å; F189-P256 CarbonylContact O-C 3.29Å; F189-P256 WeakPolarHBondContact O-CA 3.32Å; F189-A257 WeakPolarHBondContact O-CB 3.49Å; F189-A257 PolarHBondContact O-N 3.06Å
190	L	94	Very high	80.8	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	165.1	165.7	60.8	81	0	0	0	110.6	W167 I172 A177 L180 L181 R192 I203 S204 A257	W167-L190 CarbonylContact O-C 3.52Å; W167-L190 WeakPolarHBondContact O-CA 3.44Å; I172-L190 HydrophobicContact CD1-CD1 3.95Å; I172-L190 HydrophobicContact CD1-CD2 3.94Å; A177-L190 HydrophobicContact CB-CD1 3.96Å; A177-L190 HydrophobicContact CB-CD2 4.2Å; L180-L190 HydrophobicContact CB-CD2 4.03Å; L180-L190 HydrophobicContact CD1-CD2 3.7Å; L180-L190 HydrophobicContact CG-CD2 4.5Å; L181-L190 HydrophobicContact CD1-CG 4.42Å; L181-L190 HydrophobicContact CG-CD2 4.36Å; L190-R192 HydrophobicContact CD1-CB 4.1Å; L190-R192 HydrophobicContact CD1-CG 4.27Å; L190-I203 CarbonylContact O-C 3.56Å; L190-I203 WeakPolarHBondContact O-CA 3.26Å; L190-S204 PolarHBondContact N-O 3.22Å; L190-S204 PolarHBondContact O-N 3.27Å; L190-A257 HydrophobicContact CB-CB 4.13Å; L190-A257 HydrophobicContact CD2-CB 4.06Å
191	I	94.4	Very high	81.3	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	136.8	168.1	-65.4	179.8	0	0	0	109	W167 Y168 H169 L201 T202 I203 I216 V235 V239	W167-I191 HydrophobicContact CE3-CB 4Å; W167-I191 HydrophobicContact CE3-CD1 3.8Å; W167-I191 HydrophobicContact CE3-CG1 4.11Å; W167-I191 HydrophobicContact CZ3-CB 4.29Å; W167-I191 HydrophobicContact CZ3-CD1 3.78Å; W167-I191 HydrophobicContact CZ3-CG1 4.45Å; W167-I191 PolarHBondContact O-N 2.76Å; Y168-I191 WeakPolarHBondContact CA-O 3.47Å; Y168-I191 HydrophobicContact CD2-CB 4.33Å; Y168-I191 HydrophobicContact CD2-CG2 3.97Å; Y168-I191 HydrophobicContact CE2-CG2 4.29Å; H169-I191 PolarHBondContact N-O 2.62Å; I191-L201 HydrophobicContact CG2-CB 4.07Å; I191-L201 HydrophobicContact CG2-CD1 4.11Å; I191-T202 WeakPolarHBondContact CA-O 3.39Å; I191-I203 HydrophobicContact CD1-CG1 4.18Å; I191-I203 HydrophobicContact CG1-CB 4.44Å; I191-I203 HydrophobicContact CG1-CG1 4.04Å; I191-I216 HydrophobicContact CD1-CD1 3.83Å; I191-I216 HydrophobicContact CG1-CD1 4.43Å; I191-I216 HydrophobicContact CG2-CD1 4.18Å; I191-V235 HydrophobicContact CD1-CG1 3.91Å; I191-V239 HydrophobicContact CD1-CG2 3.35Å
192	R	92	Very high	81.7	Confident	7 Å²	7	41.7 Å²	41.7	3%	0.026	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	165.6	-179.4	64.1	-164.6	-176.7	83.5	-4.8	110.6	G170 I172 L190 E195 L201 T202 S204 H213	G170-R192 CarbonylContact O-C 3.49Å; G170-R192 WeakPolarHBondContact O-CA 3.32Å; G170-R192 WeakPolarHBondContact O-CB 3.31Å; I172-R192 HydrophobicContact CD1-CB 4.37Å; I172-R192 HydrophobicContact CG1-CB 3.54Å; I172-R192 HydrophobicContact CG1-CG 4.49Å; I172-R192 WeakPolarHBondContact O-CD 3.49Å; I172-R192 PolarHBondContact O-NH1 2.79Å; L190-R192 HydrophobicContact CD1-CB 4.1Å; L190-R192 HydrophobicContact CD1-CG 4.27Å; R192-E195 IonicContact CZ-OE2 3.81Å; R192-E195 IonicContact NH1-OE2 3.64Å; R192-E195 PolarHBondContact NH1-OE2 3.02Å; R192-E195 IonicContact NH2-OE2 2.67Å; R192-L201 CarbonylContact O-C 3.56Å; R192-L201 VanDerWaalsContact O-CA 3.32Å; R192-L201 WeakPolarHBondContact O-CA 3.41Å; R192-T202 PolarHBondContact N-O 2.83Å; R192-T202 PolarHBondContact O-N 3.24Å; R192-S204 PolarHBondContact NE-OG 3.01Å; R192-H213 PolarHBondContact NH2-ND1 2.82Å
193	E	87.8	Confident	82.5	Confident	57 Å²	57	39.8 Å²	39.8	27%	0.266	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	147	167.8	-61.6	173.1	-133.6	0	0	110.1	L157 Y168 G170 A171 L201	L157-E193 HydrophobicContact CD1-CG 3.85Å; Y168-E193 WeakPolarHBondContact OH-CG 3.26Å; Y168-E193 PolarHBondContact OH-OE1 2.6Å; Y168-E193 VanDerWaalsContact OH-OE1 3.12Å; G170-E193 PolarHBondContact O-N 2.86Å; A171-E193 HydrophobicContact CB-CB 4.39Å; A171-E193 PolarHBondContact N-OE1 3.26Å; E193-L201 HydrophobicContact CB-CD2 4.42Å; E193-L201 HydrophobicContact CG-CD2 3.8Å
194	S	77	Confident	83.7	Confident	10 Å²	10	36 Å²	36	7%	0.07	22%	0.215	C	C	.	.			trans	-82	123	-176.7	-169.8	0	0	0	0	111.2	H197 Q200 T202	S194-H197 CarbonylContact O-C 3.58Å; S194-H197 VanDerWaalsContact O-C 3.29Å; S194-H197 PolarHBondContact O-N 3.49Å; S194-Q200 PolarHBondContact N-O 3.02Å; S194-T202 WeakPolarHBondContact CB-OG1 3.35Å
195	E	70.9	Confident	84.7	Confident	84 Å²	84	35 Å²	35	39%	0.393	21%	0.205	S	C	.	.	S	Bend	trans	-66	-39.8	178.8	-64.1	139.8	121.5	0	0	112.4	Q173 R174 R192 H197	Q173-E195 WeakPolarHBondContact CA-OE1 3.32Å; Q173-E195 WeakPolarHBondContact CB-OE1 3.27Å; Q173-E195 HydrophobicContact CG-CG 4.32Å; Q173-E195 WeakPolarHBondContact CG-OE1 3.32Å; R174-E195 WeakPolarHBondContact CB-OE2 3.49Å; R174-E195 VanDerWaalsContact N-CD 3.25Å; R174-E195 PolarHBondContact N-OE1 2.89Å; R174-E195 PolarHBondContact N-OE2 3.06Å; R174-E195 VanDerWaalsContact N-OE2 3.12Å; R192-E195 IonicContact CZ-OE2 3.81Å; R192-E195 IonicContact NH1-OE2 3.64Å; R192-E195 PolarHBondContact NH1-OE2 3.02Å; R192-E195 IonicContact NH2-OE2 2.67Å; E195-H197 VanDerWaalsContact C-N 3.32Å
196	S	68.1	Low	85.2	Confident	92 Å²	92	32.5 Å²	32.5	64%	0.643	19%	0.189	S	C	*	.	S	Bend	trans	-76	-21.9	180	56.6	0	0	0	0	112.7
197	H	68.8	Low	85.5	Confident	76 Å²	76	33 Å²	33	35%	0.352	19%	0.185	S	C	.	.	S	Bend	trans	-139.6	77.2	-176.3	-63.7	87.3	0	0	0	111.8	S194 E195 G199 Q200 R215	S194-H197 CarbonylContact O-C 3.58Å; S194-H197 VanDerWaalsContact O-C 3.29Å; S194-H197 PolarHBondContact O-N 3.49Å; E195-H197 VanDerWaalsContact C-N 3.32Å; H197-G199 PolarHBondContact O-N 2.97Å; H197-Q200 HydrophobicContact CB-CB 4.28Å; H197-Q200 HydrophobicContact CB-CG 4.43Å; H197-Q200 WeakPolarHBondContact O-CB 3.46Å; H197-Q200 PolarHBondContact O-N 3.33Å; H197-R215 PolarHBondContact CD2-NH2 2.86Å; H197-R215 PolarHBondContact CE1-NH1 3.22Å; H197-R215 VanDerWaalsContact CE1-NH1 3.28Å; H197-R215 PolarHBondContact CE1-NH2 3.42Å; H197-R215 PolarHBondContact ND1-NH2 3.06Å; H197-R215 PolarHBondContact NE2-NH2 2.98Å; H197-R215 VanDerWaalsContact NE2-NH2 3.13Å
198	P	67.4	Low	85.5	Confident	116 Å²	116	39.8 Å²	39.8	75%	0.753	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.9	131	177.3	-28.5	36	0	0	0	112.5
199	G	69.5	Low	84.7	Confident	46 Å²	46	41.2 Å²	41.2	47%	0.474	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.2	-10.4	-173.4	0	0	0	0	0	115	H197	H197-G199 PolarHBondContact O-N 2.97Å
200	Q	82.8	Confident	84.1	Confident	63 Å²	63	46.8 Å²	46.8	29%	0.294	26%	0.258	S	S	.	.			trans	-103	164.3	168.2	-62.9	-168.9	-5.7	0	0	111.5	S194 H197 R215	S194-Q200 PolarHBondContact N-O 3.02Å; H197-Q200 HydrophobicContact CB-CB 4.28Å; H197-Q200 HydrophobicContact CB-CG 4.43Å; H197-Q200 WeakPolarHBondContact O-CB 3.46Å; H197-Q200 PolarHBondContact O-N 3.33Å; Q200-R215 VanDerWaalsContact OE1-CZ 3.25Å
201	L	92.2	Very high	83.9	Confident	5 Å²	5	46.8 Å²	46.8	3%	0.026	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	163.4	-177.8	-59.5	-176.7	0	0	0	111.7	L157 L162 Y168 I191 R192 E193 I216 V235	L157-L201 HydrophobicContact CD1-CD2 4.02Å; L162-L201 HydrophobicContact CD1-CD1 3.87Å; Y168-L201 HydrophobicContact CE2-CD1 4.29Å; Y168-L201 HydrophobicContact CE2-CD2 3.9Å; I191-L201 HydrophobicContact CG2-CB 4.07Å; I191-L201 HydrophobicContact CG2-CD1 4.11Å; R192-L201 CarbonylContact O-C 3.56Å; R192-L201 VanDerWaalsContact O-CA 3.32Å; R192-L201 WeakPolarHBondContact O-CA 3.41Å; E193-L201 HydrophobicContact CB-CD2 4.42Å; E193-L201 HydrophobicContact CG-CD2 3.8Å; L201-I216 HydrophobicContact CB-CB 4.12Å; L201-I216 HydrophobicContact CB-CD1 3.98Å; L201-I216 HydrophobicContact CB-CG1 4.34Å; L201-I216 PolarHBondContact O-N 3.31Å; L201-V235 HydrophobicContact CD1-CG1 4.09Å; L201-V235 HydrophobicContact CD1-CG2 3.83Å
202	T	94.3	Very high	83.8	Confident	9 Å²	9	51.6 Å²	51.6	6%	0.055	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	130.1	179.8	-57.5	0	0	0	0	109.5	I191 R192 S194 H213 Y214	I191-T202 WeakPolarHBondContact CA-O 3.39Å; R192-T202 PolarHBondContact N-O 2.83Å; R192-T202 PolarHBondContact O-N 3.24Å; S194-T202 WeakPolarHBondContact CB-OG1 3.35Å; T202-H213 HydrophobicContact CG2-CB 4.08Å; T202-Y214 CarbonylContact C-O 3.59Å; T202-Y214 VanDerWaalsContact CA-O 3.32Å; T202-Y214 WeakPolarHBondContact CA-O 3.39Å
203	I	95.7	Very high	83.8	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	127.6	168.7	-48.5	174.1	0	0	0	107.4	L190 I191 H213 Y214 I216 V226 L238 L249 L253	L190-I203 CarbonylContact O-C 3.56Å; L190-I203 WeakPolarHBondContact O-CA 3.26Å; I191-I203 HydrophobicContact CD1-CG1 4.18Å; I191-I203 HydrophobicContact CG1-CB 4.44Å; I191-I203 HydrophobicContact CG1-CG1 4.04Å; I203-H213 CarbonylContact O-C 3.59Å; I203-H213 VanDerWaalsContact O-CA 3.26Å; I203-H213 WeakPolarHBondContact O-CA 3.34Å; I203-Y214 PolarHBondContact N-O 3.27Å; I203-Y214 PolarHBondContact O-N 2.94Å; I203-I216 HydrophobicContact CD1-CD1 4.36Å; I203-I216 HydrophobicContact CD1-CG1 4.3Å; I203-I216 HydrophobicContact CG1-CD1 3.77Å; I203-I216 HydrophobicContact CG1-CG1 3.83Å; I203-V226 HydrophobicContact CD1-CG2 3.81Å; I203-L238 HydrophobicContact CD1-CD2 4.13Å; I203-L249 HydrophobicContact CD1-CD1 4.46Å; I203-L249 HydrophobicContact CD1-CD2 4.24Å; I203-L253 HydrophobicContact CG2-CD2 3.91Å
204	S	94.4	Very high	84.1	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	127.3	165.1	-60.9	0	0	0	0	108.5	L181 F189 L190 R192 W212 H213	L181-S204 WeakPolarHBondContact CD1-O 3.32Å; F189-S204 CarbonylContact C-O 3.52Å; F189-S204 WeakPolarHBondContact CA-O 3.12Å; L190-S204 PolarHBondContact N-O 3.22Å; L190-S204 PolarHBondContact O-N 3.27Å; R192-S204 PolarHBondContact NE-OG 3.01Å; S204-W212 CarbonylContact C-O 3.55Å; S204-W212 WeakPolarHBondContact CA-O 3.4Å; S204-H213 PolarHBondContact OG-CE1 2.67Å; S204-H213 VanDerWaalsContact OG-CE1 3.25Å; S204-H213 PolarHBondContact OG-ND1 2.87Å
205	L	95.1	Very high	84.8	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	128.2	-169	174	61.8	0	0	0	111.5	F189 I211 W212 Y214 L249 C251 L253	F189-L205 HydrophobicContact CB-CD1 3.91Å; L205-I211 CarbonylContact O-C 3.59Å; L205-I211 WeakPolarHBondContact O-CA 3.38Å; L205-W212 PolarHBondContact N-O 3.03Å; L205-W212 PolarHBondContact O-N 3.11Å; L205-Y214 HydrophobicContact CB-CE2 4.28Å; L205-Y214 HydrophobicContact CD2-CE2 4.06Å; L205-L249 HydrophobicContact CD2-CB 4.04Å; L205-C251 WeakPolarHBondContact CD2-O 3.41Å; L205-L253 HydrophobicContact CD1-CD2 3.9Å; L205-L253 HydrophobicContact CD2-CD2 4.2Å; L205-L253 HydrophobicContact CG-CD2 4.48Å
206	R	89.7	Confident	85.9	Confident	47 Å²	47	51 Å²	51	18%	0.177	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	124.5	173.1	178.5	170.1	179.3	145.6	-1.1	111.8	L181 N182 G184 G187 S188 Q210	L181-R206 VanDerWaalsContact O-CD 3.29Å; L181-R206 WeakPolarHBondContact O-CD 3.39Å; L181-R206 PolarHBondContact O-NH1 2.74Å; N182-R206 PolarHBondContact O-NH1 3.21Å; G184-R206 PolarHBondContact O-NE 3.02Å; G184-R206 PolarHBondContact O-NH1 3.06Å; G184-R206 VanDerWaalsContact O-NH1 3.11Å; G187-R206 PolarHBondContact N-O 3.23Å; S188-R206 PolarHBondContact O-N 2.75Å; R206-Q210 WeakPolarHBondContact CA-O 3.48Å
207	Y	91.7	Very high	86.9	Confident	72 Å²	72	49.2 Å²	49.2	28%	0.282	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	129	169.6	-174.3	-100.2	0	0	0	110.6	T186 G209 Q210 A250 C251	T186-Y207 HydrophobicContact CG2-CD2 3.56Å; T186-Y207 HydrophobicContact CG2-CE2 3.9Å; T186-Y207 HydrophobicContact CG2-CG 4.48Å; Y207-G209 PolarHBondContact O-N 3.48Å; Y207-Q210 PolarHBondContact N-O 2.83Å; Y207-Q210 WeakPolarHBondContact O-CA 3.47Å; Y207-Q210 PolarHBondContact O-N 3.29Å; Y207-Q210 VanDerWaalsContact O-O 3.12Å; Y207-A250 HydrophobicContact CD1-CB 4.37Å; Y207-A250 HydrophobicContact CG-CB 4.1Å; Y207-C251 HydrophobicContact CD2-CB 3.5Å; Y207-C251 VanDerWaalsContact CD2-CB 3.5Å; Y207-C251 VanDerWaalsContact CD2-SG 3.59Å; Y207-C251 HydrophobicContact CE2-CB 3.87Å; Y207-C251 HydrophobicContact CG-CB 4.5Å
208	E	85.3	Confident	87.9	Confident	143 Å²	143	51.1 Å²	51.1	67%	0.668	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	28.3	178.3	-72	179	-173.2	0	0	115.6	T186 Q210	T186-E208 PolarHBondContact OG1-N 2.85Å; E208-Q210 VanDerWaalsContact C-N 3.32Å
209	G	71.3	Confident	88.8	Confident	38 Å²	38	47.3 Å²	47.3	39%	0.392	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.9	-11.8	-178.7	0	0	0	0	0	114.7	Y207	Y207-G209 PolarHBondContact O-N 3.48Å
210	Q	84.1	Confident	89.7	Confident	117 Å²	117	53 Å²	53	55%	0.547	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	163.4	166.5	-58.4	-173	12.4	0	0	110.7	R206 Y207 E208	R206-Q210 WeakPolarHBondContact CA-O 3.48Å; Y207-Q210 PolarHBondContact N-O 2.83Å; Y207-Q210 WeakPolarHBondContact O-CA 3.47Å; Y207-Q210 PolarHBondContact O-N 3.29Å; Y207-Q210 VanDerWaalsContact O-O 3.12Å; E208-Q210 VanDerWaalsContact C-N 3.32Å
211	I	88.8	Confident	89.8	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	112.3	-177.5	-53	170.8	0	0	0	108.9	E178 L181 L205	E178-I211 HydrophobicContact CB-CD1 3.92Å; E178-I211 HydrophobicContact CG-CB 4.02Å; E178-I211 HydrophobicContact CG-CD1 4Å; E178-I211 HydrophobicContact CG-CG2 3.83Å; E178-I211 WeakPolarHBondContact O-CD1 3.35Å; L181-I211 HydrophobicContact CB-CD1 3.93Å; L181-I211 HydrophobicContact CB-CG1 4.37Å; L181-I211 HydrophobicContact CB-CG2 4.32Å; L181-I211 HydrophobicContact CD1-CG2 3.72Å; L205-I211 CarbonylContact O-C 3.59Å; L205-I211 WeakPolarHBondContact O-CA 3.38Å
212	W	92.8	Very high	89.5	Confident	101 Å²	101	58.3 Å²	58.3	38%	0.383	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	150.5	-178.2	-61.9	78.1	0	0	0	110	S204 L205 Y214 A250	S204-W212 CarbonylContact C-O 3.55Å; S204-W212 WeakPolarHBondContact CA-O 3.4Å; L205-W212 PolarHBondContact N-O 3.03Å; L205-W212 PolarHBondContact O-N 3.11Å; W212-Y214 HydrophobicContact CB-CD2 4.31Å; W212-Y214 HydrophobicContact CB-CE2 3.43Å; W212-Y214 VanDerWaalsContact CB-CE2 3.43Å; W212-Y214 HydrophobicContact CG-CE2 4.34Å; W212-A250 HydrophobicContact CD2-CB 4.18Å; W212-A250 HydrophobicContact CG-CB 4.2Å
213	H	92.3	Very high	89.3	Confident	19 Å²	19	60.4 Å²	60.4	9%	0.088	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	122.7	176.6	-60.5	-101.8	0	0	0	109.1	R174 E178 R192 T202 I203 S204	R174-H213 VanDerWaalsContact CG-CE1 3.42Å; R174-H213 WeakPolarHBondContact CG-CE1 3.37Å; R174-H213 PolarHBondContact NH2-CD2 3.12Å; E178-H213 WeakPolarHBondContact CG-NE2 3.35Å; E178-H213 IonicContact OE1-CD2 3.6Å; E178-H213 IonicContact OE1-CE1 2.67Å; E178-H213 IonicContact OE1-NE2 3.2Å; E178-H213 PolarHBondContact OE1-NE2 2.85Å; R192-H213 PolarHBondContact NH2-ND1 2.82Å; T202-H213 HydrophobicContact CG2-CB 4.08Å; I203-H213 CarbonylContact O-C 3.59Å; I203-H213 VanDerWaalsContact O-CA 3.26Å; I203-H213 WeakPolarHBondContact O-CA 3.34Å; S204-H213 PolarHBondContact OG-CE1 2.67Å; S204-H213 VanDerWaalsContact OG-CE1 3.25Å; S204-H213 PolarHBondContact OG-ND1 2.87Å
214	Y	94.2	Very high	89.1	Confident	37 Å²	37	61.4 Å²	61.4	15%	0.145	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	124.8	-178	-58.1	-87.3	0	0	0	109.7	T202 I203 L205 W212 V226 L249 A250	T202-Y214 CarbonylContact C-O 3.59Å; T202-Y214 VanDerWaalsContact CA-O 3.32Å; T202-Y214 WeakPolarHBondContact CA-O 3.39Å; I203-Y214 PolarHBondContact N-O 3.27Å; I203-Y214 PolarHBondContact O-N 2.94Å; L205-Y214 HydrophobicContact CB-CE2 4.28Å; L205-Y214 HydrophobicContact CD2-CE2 4.06Å; W212-Y214 HydrophobicContact CB-CD2 4.31Å; W212-Y214 HydrophobicContact CB-CE2 3.43Å; W212-Y214 VanDerWaalsContact CB-CE2 3.43Å; W212-Y214 HydrophobicContact CG-CE2 4.34Å; Y214-V226 HydrophobicContact CD1-CG1 4.48Å; Y214-L249 HydrophobicContact CD1-CD2 3.77Å; Y214-L249 HydrophobicContact CD2-CD2 3.45Å; Y214-L249 VanDerWaalsContact CD2-CD2 3.45Å; Y214-L249 HydrophobicContact CE1-CD2 4.14Å; Y214-L249 HydrophobicContact CE2-CB 4.4Å; Y214-L249 HydrophobicContact CE2-CD2 3.82Å; Y214-L249 HydrophobicContact CG-CD2 3.41Å; Y214-L249 VanDerWaalsContact CG-CD2 3.41Å; Y214-A250 VanDerWaalsContact OH-CB 3.3Å; Y214-A250 WeakPolarHBondContact OH-CB 3.47Å; Y214-A250 PolarHBondContact OH-N 2.62Å
215	R	91.5	Very high	89	Confident	84 Å²	84	63.2 Å²	63.2	32%	0.317	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	136.5	176.1	-171.9	172	-177.8	167.9	1.6	109.8	H197 Q200 H217	H197-R215 PolarHBondContact CD2-NH2 2.86Å; H197-R215 PolarHBondContact CE1-NH1 3.22Å; H197-R215 VanDerWaalsContact CE1-NH1 3.28Å; H197-R215 PolarHBondContact CE1-NH2 3.42Å; H197-R215 PolarHBondContact ND1-NH2 3.06Å; H197-R215 PolarHBondContact NE2-NH2 2.98Å; H197-R215 VanDerWaalsContact NE2-NH2 3.13Å; Q200-R215 VanDerWaalsContact OE1-CZ 3.25Å; R215-H217 PolarHBondContact O-CD2 3.22Å
216	I	93.3	Very high	88.9	Confident	4 Å²	4	64.3 Å²	64.3	2%	0.021	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	107.7	168.9	-56.9	-178.6	0	0	0	107	I191 L201 I203 Y224 V235 L238	I191-I216 HydrophobicContact CD1-CD1 3.83Å; I191-I216 HydrophobicContact CG1-CD1 4.43Å; I191-I216 HydrophobicContact CG2-CD1 4.18Å; L201-I216 HydrophobicContact CB-CB 4.12Å; L201-I216 HydrophobicContact CB-CD1 3.98Å; L201-I216 HydrophobicContact CB-CG1 4.34Å; L201-I216 PolarHBondContact O-N 3.31Å; I203-I216 HydrophobicContact CD1-CD1 4.36Å; I203-I216 HydrophobicContact CD1-CG1 4.3Å; I203-I216 HydrophobicContact CG1-CD1 3.77Å; I203-I216 HydrophobicContact CG1-CG1 3.83Å; I216-Y224 HydrophobicContact CG2-CD1 4.04Å; I216-V235 HydrophobicContact CD1-CG1 4.22Å; I216-L238 HydrophobicContact CD1-CD2 4.24Å; I216-L238 HydrophobicContact CG2-CD1 3.91Å
217	H	90.5	Very high	88.9	Confident	56 Å²	56	64.2 Å²	64.2	26%	0.259	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	161.8	177	-67.2	-114.4	0	0	0	110.2	R215 Y224 Y225	R215-H217 PolarHBondContact O-CD2 3.22Å; H217-Y224 WeakPolarHBondContact O-CA 3.5Å; H217-Y225 HydrophobicContact CB-CD1 4.03Å; H217-Y225 HydrophobicContact CB-CD2 3.96Å; H217-Y225 HydrophobicContact CB-CE1 3.62Å; H217-Y225 HydrophobicContact CB-CE2 3.58Å; H217-Y225 HydrophobicContact CB-CG 4.18Å; H217-Y225 PolarHBondContact N-O 2.84Å; H217-Y225 PolarHBondContact O-N 2.79Å
218	R	88.7	Confident	88.7	Confident	116 Å²	116	66.5 Å²	66.5	44%	0.438	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	129	175.7	-160.3	-176.1	-163.3	-162.2	2.8	109.6	N222 M223 Y224	R218-N222 PolarHBondContact NE-O 2.86Å; R218-N222 PolarHBondContact NH1-OD1 3.22Å; R218-N222 PolarHBondContact NH2-O 2.86Å; R218-N222 PolarHBondContact NH2-OD1 3.45Å; R218-M223 VanDerWaalsContact CA-O 3.27Å; R218-M223 WeakPolarHBondContact CA-O 3.38Å; R218-M223 WeakPolarHBondContact CG-O 3.25Å; R218-Y224 HydrophobicContact CB-CD1 4.48Å; R218-Y224 HydrophobicContact CG-CD1 4.19Å; R218-Y224 HydrophobicContact CG-CE1 4.21Å; R218-Y224 VanDerWaalsContact CZ-OH 3.29Å; R218-Y224 PolarHBondContact NE-OH 3.25Å; R218-Y224 PolarHBondContact NH2-OH 2.86Å
219	D	87.1	Confident	88.8	Confident	35 Å²	35	64.1 Å²	64.1	19%	0.187	33%	0.327	C	S	.	.			trans	-91.7	177.9	-179.4	72.9	6.8	0	0	0	113.4	S221 N222 M223 Y225 K231	D219-S221 PolarHBondContact O-N 3.37Å; D219-S221 WeakPolarHBondContact OD1-CA 3.29Å; D219-S221 VanDerWaalsContact OD1-CB 3.32Å; D219-S221 WeakPolarHBondContact OD1-CB 3.36Å; D219-S221 PolarHBondContact OD1-N 3.29Å; D219-N222 VanDerWaalsContact O-CA 3.31Å; D219-N222 WeakPolarHBondContact O-CA 3.47Å; D219-N222 PolarHBondContact O-N 2.77Å; D219-N222 PolarHBondContact OD1-N 2.88Å; D219-M223 PolarHBondContact N-O 3.2Å; D219-M223 VanDerWaalsContact N-O 3.11Å; D219-M223 WeakPolarHBondContact OD1-CB 3.41Å; D219-M223 PolarHBondContact OD1-N 3.39Å; D219-Y225 HydrophobicContact CB-CE1 4.08Å; D219-K231 WeakPolarHBondContact OD2-CD 3.4Å; D219-K231 WeakPolarHBondContact OD2-CE 3.47Å; D219-K231 IonicContact OD2-NZ 3.39Å; D219-K231 PolarHBondContact OD2-NZ 3.27Å
220	D	87.4	Confident	89.6	Confident	167 Å²	167	63.9 Å²	63.9	89%	0.893	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-27.8	177.9	-63.9	-36.4	0	0	0	112.8	N222	D220-N222 PolarHBondContact O-N 3.39Å; D220-N222 PolarHBondContact O-ND2 2.79Å
221	S	86.2	Confident	90	Very high	94 Å²	94	61.3 Å²	61.3	66%	0.657	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	5.6	173.4	-59	0	0	0	0	112.7	D219 M223	D219-S221 PolarHBondContact O-N 3.37Å; D219-S221 WeakPolarHBondContact OD1-CA 3.29Å; D219-S221 VanDerWaalsContact OD1-CB 3.32Å; D219-S221 WeakPolarHBondContact OD1-CB 3.36Å; D219-S221 PolarHBondContact OD1-N 3.29Å; S221-M223 PolarHBondContact O-N 3.05Å
222	N	84.5	Confident	90.2	Very high	85 Å²	85	62.9 Å²	62.9	46%	0.455	31%	0.31	S	S	.	.			trans	63.8	14.8	-177.4	-79.1	-105.8	0	0	0	114.4	R218 D219 D220	R218-N222 PolarHBondContact NE-O 2.86Å; R218-N222 PolarHBondContact NH1-OD1 3.22Å; R218-N222 PolarHBondContact NH2-O 2.86Å; R218-N222 PolarHBondContact NH2-OD1 3.45Å; D219-N222 VanDerWaalsContact O-CA 3.31Å; D219-N222 WeakPolarHBondContact O-CA 3.47Å; D219-N222 PolarHBondContact O-N 2.77Å; D219-N222 PolarHBondContact OD1-N 2.88Å; D220-N222 PolarHBondContact O-N 3.39Å; D220-N222 PolarHBondContact O-ND2 2.79Å
223	M	90.2	Very high	90.1	Very high	52 Å²	52	63 Å²	63	26%	0.256	32%	0.322	S	S	.	.			trans	-81.1	140.3	179.7	-60.5	-73.9	-76.8	0	0	110.7	R218 D219 S221 K231 F232 T233	R218-M223 VanDerWaalsContact CA-O 3.27Å; R218-M223 WeakPolarHBondContact CA-O 3.38Å; R218-M223 WeakPolarHBondContact CG-O 3.25Å; D219-M223 PolarHBondContact N-O 3.2Å; D219-M223 VanDerWaalsContact N-O 3.11Å; D219-M223 WeakPolarHBondContact OD1-CB 3.41Å; D219-M223 PolarHBondContact OD1-N 3.39Å; S221-M223 PolarHBondContact O-N 3.05Å; M223-K231 HydrophobicContact CB-CB 4.07Å; M223-K231 HydrophobicContact CE-CB 4.37Å; M223-F232 CarbonylContact C-O 3.57Å; M223-F232 WeakPolarHBondContact CA-O 3.27Å; M223-T233 HydrophobicContact CE-CG2 4.15Å; M223-T233 HydrophobicContact SD-CG2 3.89Å
224	Y	91.9	Very high	89.9	Confident	22 Å²	22	63.9 Å²	63.9	9%	0.086	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	141	-179.1	-61.3	-87	0	0	0	111.4	I216 H217 R218 F232 V235	I216-Y224 HydrophobicContact CG2-CD1 4.04Å; H217-Y224 WeakPolarHBondContact O-CA 3.5Å; R218-Y224 HydrophobicContact CB-CD1 4.48Å; R218-Y224 HydrophobicContact CG-CD1 4.19Å; R218-Y224 HydrophobicContact CG-CE1 4.21Å; R218-Y224 VanDerWaalsContact CZ-OH 3.29Å; R218-Y224 PolarHBondContact NE-OH 3.25Å; R218-Y224 PolarHBondContact NH2-OH 2.86Å; Y224-F232 PolarHBondContact N-O 3.16Å; Y224-F232 PolarHBondContact O-N 3.37Å; Y224-V235 HydrophobicContact CD1-CG2 3.86Å; Y224-V235 HydrophobicContact CD2-CG2 4.22Å; Y224-V235 HydrophobicContact CE1-CG2 3.84Å; Y224-V235 HydrophobicContact CE2-CG2 4.21Å; Y224-V235 HydrophobicContact CG-CG2 4.04Å
225	Y	92.9	Very high	89.8	Confident	37 Å²	37	62.1 Å²	62.1	15%	0.145	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	163.6	177.4	64.4	-81.9	0	0	0	113.2	H217 D219 E228 N230 K231	H217-Y225 HydrophobicContact CB-CD1 4.03Å; H217-Y225 HydrophobicContact CB-CD2 3.96Å; H217-Y225 HydrophobicContact CB-CE1 3.62Å; H217-Y225 HydrophobicContact CB-CE2 3.58Å; H217-Y225 HydrophobicContact CB-CG 4.18Å; H217-Y225 PolarHBondContact N-O 2.84Å; H217-Y225 PolarHBondContact O-N 2.79Å; D219-Y225 HydrophobicContact CB-CE1 4.08Å; Y225-E228 HydrophobicContact CD2-CB 4.39Å; Y225-E228 HydrophobicContact CE2-CB 4.12Å; Y225-N230 VanDerWaalsContact CB-O 3.32Å; Y225-N230 WeakPolarHBondContact CB-O 3.49Å; Y225-K231 HydrophobicContact CD1-CD 4.37Å; Y225-K231 HydrophobicContact CD1-CG 4.3Å; Y225-K231 HydrophobicContact CG-CG 4.31Å
226	V	91.8	Very high	89.7	Confident	24 Å²	24	59.9 Å²	59.9	15%	0.145	32%	0.321	C	S	.	.	S	Bend	trans	-108	-51.5	163.9	-178.8	0	0	0	0	109.2	I203 Y214 L238 L249	I203-V226 HydrophobicContact CD1-CG2 3.81Å; Y214-V226 HydrophobicContact CD1-CG1 4.48Å; V226-L238 HydrophobicContact CG2-CD1 4.47Å; V226-L238 HydrophobicContact CG2-CD2 4.41Å; V226-L249 HydrophobicContact CG1-CD2 4.07Å
227	I	90.9	Very high	89.7	Confident	44 Å²	44	63 Å²	63	23%	0.226	34%	0.337	C	S	.	.	S	Bend	trans	-104.8	140.9	169.1	62	170.7	0	0	0	110.5	S229 N230 D247	I227-S229 WeakPolarHBondContact CD1-OG 3.47Å; I227-S229 PolarHBondContact O-N 2.83Å; I227-S229 VanDerWaalsContact O-N 3.14Å; I227-N230 HydrophobicContact CD1-CB 4.49Å; I227-N230 HydrophobicContact CG1-CB 4.05Å; I227-N230 PolarHBondContact O-N 3.01Å; I227-N230 VanDerWaalsContact O-N 3.09Å; I227-D247 HydrophobicContact CD1-CB 4.21Å; I227-D247 VanDerWaalsContact CD1-O 3.3Å; I227-D247 WeakPolarHBondContact CD1-O 3.24Å
228	E	86.7	Confident	89.8	Confident	121 Å²	121	60.3 Å²	60.3	57%	0.565	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-23.6	-170.1	-179.7	154.4	-139.4	0	0	114.1	Y225 N230 K231	Y225-E228 HydrophobicContact CD2-CB 4.39Å; Y225-E228 HydrophobicContact CE2-CB 4.12Å; E228-N230 VanDerWaalsContact C-N 3.27Å; E228-N230 PolarHBondContact O-N 2.94Å; E228-K231 VanDerWaalsContact O-CE 3.29Å; E228-K231 WeakPolarHBondContact O-CE 3.41Å; E228-K231 WeakPolarHBondContact O-CG 3.4Å; E228-K231 IonicContact OE1-NZ 3.67Å; E228-K231 PolarHBondContact OE1-NZ 3.45Å
229	S	88.1	Confident	90	Very high	93 Å²	93	54.9 Å²	54.9	65%	0.65	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-26.6	175.8	62	0	0	0	0	113.9	I227	I227-S229 WeakPolarHBondContact CD1-OG 3.47Å; I227-S229 PolarHBondContact O-N 2.83Å; I227-S229 VanDerWaalsContact O-N 3.14Å
230	N	88	Confident	90.3	Very high	32 Å²	32	57.9 Å²	57.9	17%	0.171	32%	0.317	C	S	.	.	S	Bend	trans	-118.5	86.8	-169	-65.5	19.5	0	0	0	109.4	Y225 I227 E228 F232 H241 D247	Y225-N230 VanDerWaalsContact CB-O 3.32Å; Y225-N230 WeakPolarHBondContact CB-O 3.49Å; I227-N230 HydrophobicContact CD1-CB 4.49Å; I227-N230 HydrophobicContact CG1-CB 4.05Å; I227-N230 PolarHBondContact O-N 3.01Å; I227-N230 VanDerWaalsContact O-N 3.09Å; E228-N230 VanDerWaalsContact C-N 3.27Å; E228-N230 PolarHBondContact O-N 2.94Å; N230-F232 HydrophobicContact CB-CE2 3.87Å; N230-F232 HydrophobicContact CB-CZ 4Å; N230-F232 WeakPolarHBondContact O-CD2 3.35Å; N230-F232 WeakPolarHBondContact O-CE2 3.28Å; N230-H241 PolarHBondContact ND2-CE1 3.31Å; N230-H241 PolarHBondContact ND2-NE2 3.35Å; N230-D247 PolarHBondContact ND2-OD2 2.86Å
231	K	92	Very high	90.5	Very high	64 Å²	64	51.5 Å²	51.5	28%	0.278	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	137.6	-178	-55.6	-166.1	174.6	-179.3	0	112.5	D219 M223 Y225 E228	D219-K231 WeakPolarHBondContact OD2-CD 3.4Å; D219-K231 WeakPolarHBondContact OD2-CE 3.47Å; D219-K231 IonicContact OD2-NZ 3.39Å; D219-K231 PolarHBondContact OD2-NZ 3.27Å; M223-K231 HydrophobicContact CB-CB 4.07Å; M223-K231 HydrophobicContact CE-CB 4.37Å; Y225-K231 HydrophobicContact CD1-CD 4.37Å; Y225-K231 HydrophobicContact CD1-CG 4.3Å; Y225-K231 HydrophobicContact CG-CG 4.31Å; E228-K231 VanDerWaalsContact O-CE 3.29Å; E228-K231 WeakPolarHBondContact O-CE 3.41Å; E228-K231 WeakPolarHBondContact O-CG 3.4Å; E228-K231 IonicContact OE1-NZ 3.67Å; E228-K231 PolarHBondContact OE1-NZ 3.45Å
232	F	92.9	Very high	90.9	Very high	34 Å²	34	47 Å²	47	15%	0.149	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	146.6	-170	-59.7	-78.3	0	0	0	113.2	M223 Y224 N230 D237 L238 H241	M223-F232 CarbonylContact C-O 3.57Å; M223-F232 WeakPolarHBondContact CA-O 3.27Å; Y224-F232 PolarHBondContact N-O 3.16Å; Y224-F232 PolarHBondContact O-N 3.37Å; N230-F232 HydrophobicContact CB-CE2 3.87Å; N230-F232 HydrophobicContact CB-CZ 4Å; N230-F232 WeakPolarHBondContact O-CD2 3.35Å; N230-F232 WeakPolarHBondContact O-CE2 3.28Å; F232-D237 HydrophobicContact CB-CB 4.07Å; F232-D237 HydrophobicContact CD1-CB 4.18Å; F232-D237 HydrophobicContact CG-CB 4.47Å; F232-L238 HydrophobicContact CB-CB 3.99Å; F232-L238 HydrophobicContact CD2-CB 3.68Å; F232-L238 HydrophobicContact CD2-CD1 4.09Å; F232-L238 HydrophobicContact CD2-CG 3.87Å; F232-L238 HydrophobicContact CE2-CB 4.45Å; F232-L238 HydrophobicContact CE2-CG 4.37Å; F232-L238 HydrophobicContact CG-CB 3.92Å; F232-H241 HydrophobicContact CE1-CB 3.61Å; F232-H241 AromaticContact CE1-CG 3.85Å; F232-H241 HydrophobicContact CE2-CB 4.32Å; F232-H241 AromaticContact CE2-CD2 3.8Å; F232-H241 HydrophobicContact CZ-CB 3.51Å; F232-H241 AromaticContact CZ-CD2 3.34Å; F232-H241 WeakPolarHBondContact CZ-CD2 3.5Å; F232-H241 AromaticContact CZ-CG 3.29Å; F232-H241 AromaticContact CZ-ND1 3.86Å; F232-H241 AromaticContact CZ-NE2 3.92Å
233	T	90.3	Very high	91.3	Very high	103 Å²	103	46.4 Å²	46.4	63%	0.632	25%	0.245	S	C	*	.	S	Bend	trans	-67.5	-32.1	178.8	31.1	0	0	0	0	113.7	M223 D237	M223-T233 HydrophobicContact CE-CG2 4.15Å; M223-T233 HydrophobicContact SD-CG2 3.89Å; T233-D237 PolarHBondContact OG1-OD2 2.93Å
234	S	89.1	Confident	91.3	Very high	37 Å²	37	49.3 Å²	49.3	26%	0.259	26%	0.256	S	S	.	.	S	Bend	trans	-139.5	163.8	178	76.8	0	0	0	0	112.2	S236 D237 L238	S234-S236 VanDerWaalsContact C-N 3.29Å; S234-S236 PolarHBondContact O-N 3.2Å; S234-S236 PolarHBondContact OG-N 2.92Å; S234-D237 VanDerWaalsContact CB-OD2 3.32Å; S234-D237 WeakPolarHBondContact CB-OD2 3.43Å; S234-D237 PolarHBondContact N-OD2 2.87Å; S234-D237 PolarHBondContact O-N 2.78Å; S234-D237 PolarHBondContact OG-N 3.12Å; S234-D237 VanDerWaalsContact OG-N 3.11Å; S234-D237 PolarHBondContact OG-OD2 2.87Å; S234-L238 PolarHBondContact O-N 2.9Å; S234-L238 VanDerWaalsContact O-N 3.15Å
235	V	91.5	Very high	91.3	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.006	28%	0.275	C	S	.	.	H	α-helix	trans	-66	-33	174.7	-174.8	0	0	0	0	111.2	L162 W167 I191 L201 I216 Y224 L238 V239	L162-V235 HydrophobicContact CD1-CB 4.1Å; L162-V235 HydrophobicContact CD1-CG1 4.17Å; L162-V235 HydrophobicContact CD1-CG2 4.18Å; L162-V235 HydrophobicContact CD2-CB 4.3Å; W167-V235 HydrophobicContact CH2-CG1 4.01Å; W167-V235 HydrophobicContact CZ3-CG1 3.96Å; I191-V235 HydrophobicContact CD1-CG1 3.91Å; L201-V235 HydrophobicContact CD1-CG1 4.09Å; L201-V235 HydrophobicContact CD1-CG2 3.83Å; I216-V235 HydrophobicContact CD1-CG1 4.22Å; Y224-V235 HydrophobicContact CD1-CG2 3.86Å; Y224-V235 HydrophobicContact CD2-CG2 4.22Å; Y224-V235 HydrophobicContact CE1-CG2 3.84Å; Y224-V235 HydrophobicContact CE2-CG2 4.21Å; Y224-V235 HydrophobicContact CG-CG2 4.04Å; V235-L238 PolarHBondContact O-N 3.49Å; V235-V239 WeakPolarHBondContact O-CG2 3.46Å; V235-V239 PolarHBondContact O-N 2.66Å
236	S	90.6	Very high	91.1	Very high	36 Å²	36	53.8 Å²	53.8	25%	0.252	29%	0.285	S	S	.	.	H	α-helix	trans	-70	-34.4	176	-56.1	0	0	0	0	111.9	E165 W167 S234 V239 H240	E165-S236 PolarHBondContact OE1-OG 3.01Å; W167-S236 WeakPolarHBondContact CZ2-OG 3.43Å; S234-S236 VanDerWaalsContact C-N 3.29Å; S234-S236 PolarHBondContact O-N 3.2Å; S234-S236 PolarHBondContact OG-N 2.92Å; S236-V239 PolarHBondContact O-N 2.91Å; S236-H240 WeakPolarHBondContact O-CB 3.3Å; S236-H240 PolarHBondContact O-N 3.49Å
237	D	91.9	Very high	91	Very high	70 Å²	70	55.4 Å²	55.4	37%	0.374	29%	0.292	S	S	.	.	H	α-helix	trans	-63.9	-44.4	172.1	-60	-50	0	0	0	111.1	F232 T233 S234 H240 H241	F232-D237 HydrophobicContact CB-CB 4.07Å; F232-D237 HydrophobicContact CD1-CB 4.18Å; F232-D237 HydrophobicContact CG-CB 4.47Å; T233-D237 PolarHBondContact OG1-OD2 2.93Å; S234-D237 VanDerWaalsContact CB-OD2 3.32Å; S234-D237 WeakPolarHBondContact CB-OD2 3.43Å; S234-D237 PolarHBondContact N-OD2 2.87Å; S234-D237 PolarHBondContact O-N 2.78Å; S234-D237 PolarHBondContact OG-N 3.12Å; S234-D237 VanDerWaalsContact OG-N 3.11Å; S234-D237 PolarHBondContact OG-OD2 2.87Å; D237-H240 PolarHBondContact O-N 2.93Å; D237-H241 PolarHBondContact O-N 2.9Å
238	L	94	Very high	90.8	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-60	-45.9	176.5	-179.6	154.1	0	0	0	111.5	I203 I216 V226 F232 S234 V235 H241 H242	I203-L238 HydrophobicContact CD1-CD2 4.13Å; I216-L238 HydrophobicContact CD1-CD2 4.24Å; I216-L238 HydrophobicContact CG2-CD1 3.91Å; V226-L238 HydrophobicContact CG2-CD1 4.47Å; V226-L238 HydrophobicContact CG2-CD2 4.41Å; F232-L238 HydrophobicContact CB-CB 3.99Å; F232-L238 HydrophobicContact CD2-CB 3.68Å; F232-L238 HydrophobicContact CD2-CD1 4.09Å; F232-L238 HydrophobicContact CD2-CG 3.87Å; F232-L238 HydrophobicContact CE2-CB 4.45Å; F232-L238 HydrophobicContact CE2-CG 4.37Å; F232-L238 HydrophobicContact CG-CB 3.92Å; S234-L238 PolarHBondContact O-N 2.9Å; S234-L238 VanDerWaalsContact O-N 3.15Å; V235-L238 PolarHBondContact O-N 3.49Å; L238-H241 PolarHBondContact O-N 2.79Å; L238-H242 PolarHBondContact O-CD2 2.72Å; L238-H242 PolarHBondContact O-N 3.18Å
239	V	92.9	Very high	91.1	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.006	28%	0.282	C	S	.	.	H	α-helix	trans	-61.3	-47.2	173.9	171.3	0	0	0	0	110.7	W167 F189 I191 V235 S236 H241 H242 E243 L253	W167-V239 HydrophobicContact CD2-CG1 4.37Å; W167-V239 HydrophobicContact CD2-CG2 4.13Å; W167-V239 HydrophobicContact CE3-CG2 4.14Å; W167-V239 HydrophobicContact CG-CG1 4.46Å; W167-V239 HydrophobicContact CH2-CG2 4Å; W167-V239 HydrophobicContact CZ2-CB 4.21Å; W167-V239 HydrophobicContact CZ2-CG1 4.43Å; W167-V239 HydrophobicContact CZ2-CG2 3.99Å; W167-V239 HydrophobicContact CZ3-CG2 4.08Å; F189-V239 HydrophobicContact CE2-CG1 3.99Å; F189-V239 HydrophobicContact CZ-CG1 4Å; I191-V239 HydrophobicContact CD1-CG2 3.35Å; V235-V239 WeakPolarHBondContact O-CG2 3.46Å; V235-V239 PolarHBondContact O-N 2.66Å; S236-V239 PolarHBondContact O-N 2.91Å; V239-H241 PolarHBondContact O-N 3.26Å; V239-H242 CarbonylContact O-C 3.54Å; V239-H242 PolarHBondContact O-N 2.67Å; V239-E243 HydrophobicContact CG1-CG 4.22Å; V239-E243 WeakPolarHBondContact O-CG 3.18Å; V239-E243 PolarHBondContact O-N 2.94Å; V239-L253 HydrophobicContact CG1-CD1 4.33Å; V239-L253 HydrophobicContact CG2-CD1 4.43Å
240	H	91.8	Very high	91.2	Very high	99 Å²	99	47.7 Å²	47.7	46%	0.458	27%	0.265	S	S	.	.	H	α-helix	trans	-70.3	-16.5	-176.9	-168.4	51.9	0	0	0	114.6	S236 D237 E243 K244	S236-H240 WeakPolarHBondContact O-CB 3.3Å; S236-H240 PolarHBondContact O-N 3.49Å; D237-H240 PolarHBondContact O-N 2.93Å; H240-E243 IonicContact CE1-OE2 2.85Å; H240-E243 IonicContact CG-OE2 2.84Å; H240-E243 IonicContact ND1-OE2 3Å; H240-E243 PolarHBondContact ND1-OE2 3.37Å; H240-K244 PolarHBondContact CD2-NZ 2.96Å; H240-K244 PolarHBondContact CE1-NZ 2.85Å; H240-K244 VanDerWaalsContact CE1-NZ 3.3Å; H240-K244 PolarHBondContact NE2-NZ 2.87Å; H240-K244 WeakPolarHBondContact O-CE 3.46Å; H240-K244 PolarHBondContact O-NZ 2.94Å; H240-K244 VanDerWaalsContact O-NZ 3.1Å
241	H	93.1	Very high	91.4	Very high	32 Å²	32	47 Å²	47	15%	0.148	26%	0.262	C	S	.	.	H	α-helix	trans	-75.5	-52.5	163	166.2	77.5	0	0	0	110.9	N230 F232 D237 L238 V239 E243 K244 H245 D247	N230-H241 PolarHBondContact ND2-CE1 3.31Å; N230-H241 PolarHBondContact ND2-NE2 3.35Å; F232-H241 HydrophobicContact CE1-CB 3.61Å; F232-H241 AromaticContact CE1-CG 3.85Å; F232-H241 HydrophobicContact CE2-CB 4.32Å; F232-H241 AromaticContact CE2-CD2 3.8Å; F232-H241 HydrophobicContact CZ-CB 3.51Å; F232-H241 AromaticContact CZ-CD2 3.34Å; F232-H241 WeakPolarHBondContact CZ-CD2 3.5Å; F232-H241 AromaticContact CZ-CG 3.29Å; F232-H241 AromaticContact CZ-ND1 3.86Å; F232-H241 AromaticContact CZ-NE2 3.92Å; D237-H241 PolarHBondContact O-N 2.9Å; L238-H241 PolarHBondContact O-N 2.79Å; V239-H241 PolarHBondContact O-N 3.26Å; H241-E243 VanDerWaalsContact C-N 3.27Å; H241-E243 PolarHBondContact O-N 2.85Å; H241-K244 PolarHBondContact O-N 3.04Å; H241-H245 PolarHBondContact O-N 3.09Å; H241-D247 IonicContact CE1-OD2 2.98Å; H241-D247 PolarHBondContact CE1-OD2 3.36Å; H241-D247 WeakPolarHBondContact NE2-CB 3.39Å; H241-D247 IonicContact NE2-OD2 3.52Å; H241-D247 PolarHBondContact NE2-OD2 3.14Å
242	H	94.4	Very high	91.4	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-71.5	-14.6	-177.3	-70.6	-63.1	0	0	0	115.1	L238 V239 K244 H245 S246 D247 L249 T252 L253	L238-H242 PolarHBondContact O-CD2 2.72Å; L238-H242 PolarHBondContact O-N 3.18Å; V239-H242 CarbonylContact O-C 3.54Å; V239-H242 PolarHBondContact O-N 2.67Å; H242-K244 PolarHBondContact O-N 2.82Å; H242-H245 VanDerWaalsContact CA-O 3.29Å; H242-H245 WeakPolarHBondContact CA-O 3.41Å; H242-H245 PolarHBondContact ND1-O 2.59Å; H242-S246 PolarHBondContact ND1-O 2.98Å; H242-D247 PolarHBondContact CE1-O 2.82Å; H242-L249 HydrophobicContact CB-CD1 3.7Å; H242-T252 CarbonylContact O-C 3.5Å; H242-T252 VanDerWaalsContact O-CA 3.28Å; H242-T252 WeakPolarHBondContact O-CA 3.22Å; H242-T252 WeakPolarHBondContact O-CB 3.35Å; H242-L253 HydrophobicContact CB-CD1 3.58Å; H242-L253 HydrophobicContact CB-CG 3.75Å; H242-L253 PolarHBondContact O-N 2.84Å
243	E	92.5	Very high	91.5	Very high	72 Å²	72	43.9 Å²	43.9	34%	0.336	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-25.6	163.8	-79.2	177.4	165.2	0	0	112.3	V239 H240 H241 L253	V239-E243 HydrophobicContact CG1-CG 4.22Å; V239-E243 WeakPolarHBondContact O-CG 3.18Å; V239-E243 PolarHBondContact O-N 2.94Å; H240-E243 IonicContact CE1-OE2 2.85Å; H240-E243 IonicContact CG-OE2 2.84Å; H240-E243 IonicContact ND1-OE2 3Å; H240-E243 PolarHBondContact ND1-OE2 3.37Å; H241-E243 VanDerWaalsContact C-N 3.27Å; H241-E243 PolarHBondContact O-N 2.85Å; E243-L253 HydrophobicContact CG-CB 4.48Å; E243-L253 WeakPolarHBondContact CG-O 3.43Å
244	K	91	Very high	91.3	Very high	113 Å²	113	42.9 Å²	42.9	49%	0.491	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-35.8	-172	-59.5	168.2	-167.5	144.5	0	113.8	H240 H241 H242	H240-K244 PolarHBondContact CD2-NZ 2.96Å; H240-K244 PolarHBondContact CE1-NZ 2.85Å; H240-K244 VanDerWaalsContact CE1-NZ 3.3Å; H240-K244 PolarHBondContact NE2-NZ 2.87Å; H240-K244 WeakPolarHBondContact O-CE 3.46Å; H240-K244 PolarHBondContact O-NZ 2.94Å; H240-K244 VanDerWaalsContact O-NZ 3.1Å; H241-K244 PolarHBondContact O-N 3.04Å; H242-K244 PolarHBondContact O-N 2.82Å
245	H	90.5	Very high	91.3	Very high	102 Å²	102	46.3 Å²	46.3	47%	0.472	25%	0.25	S	S	.	.			trans	-132.8	132.5	-174.9	-53.8	-72.4	0	0	0	109.6	H241 H242 D247	H241-H245 PolarHBondContact O-N 3.09Å; H242-H245 VanDerWaalsContact CA-O 3.29Å; H242-H245 WeakPolarHBondContact CA-O 3.41Å; H242-H245 PolarHBondContact ND1-O 2.59Å; H245-D247 WeakPolarHBondContact CB-OD1 3.08Å
246	S	89.2	Confident	91.1	Very high	50 Å²	50	48.7 Å²	48.7	35%	0.35	27%	0.265	S	S	.	.			trans	-72.3	-39	-174.8	56.5	0	0	0	0	112	H242 G248 L249	H242-S246 PolarHBondContact ND1-O 2.98Å; S246-G248 PolarHBondContact O-N 2.84Å; S246-G248 VanDerWaalsContact O-N 3.16Å; S246-L249 WeakPolarHBondContact CB-O 3.2Å; S246-L249 VanDerWaalsContact O-CB 3.26Å; S246-L249 WeakPolarHBondContact O-CB 3.5Å; S246-L249 VanDerWaalsContact O-CG 3.32Å; S246-L249 WeakPolarHBondContact O-CG 3.32Å; S246-L249 PolarHBondContact O-N 2.79Å
247	D	90.4	Very high	90.7	Very high	58 Å²	58	47.2 Å²	47.2	31%	0.31	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	39.4	57.2	166.2	-71.5	27.9	0	0	0	114.3	I227 N230 H241 H242 H245	I227-D247 HydrophobicContact CD1-CB 4.21Å; I227-D247 VanDerWaalsContact CD1-O 3.3Å; I227-D247 WeakPolarHBondContact CD1-O 3.24Å; N230-D247 PolarHBondContact ND2-OD2 2.86Å; H241-D247 IonicContact CE1-OD2 2.98Å; H241-D247 PolarHBondContact CE1-OD2 3.36Å; H241-D247 WeakPolarHBondContact NE2-CB 3.39Å; H241-D247 IonicContact NE2-OD2 3.52Å; H241-D247 PolarHBondContact NE2-OD2 3.14Å; H242-D247 PolarHBondContact CE1-O 2.82Å; H245-D247 WeakPolarHBondContact CB-OD1 3.08Å
248	G	86.7	Confident	89.9	Confident	51 Å²	51	48.9 Å²	48.9	53%	0.526	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.8	-20.8	-178.9	0	0	0	0	0	114.7	S246	S246-G248 PolarHBondContact O-N 2.84Å; S246-G248 VanDerWaalsContact O-N 3.16Å
249	L	93.2	Very high	88.7	Confident	10 Å²	10	51.9 Å²	51.9	5%	0.052	28%	0.283	C	S	.	.	S	Bend	trans	-82.9	154.6	173.4	-51.6	179.6	0	0	0	111.7	I203 L205 Y214 V226 H242 S246 C251 L253	I203-L249 HydrophobicContact CD1-CD1 4.46Å; I203-L249 HydrophobicContact CD1-CD2 4.24Å; L205-L249 HydrophobicContact CD2-CB 4.04Å; Y214-L249 HydrophobicContact CD1-CD2 3.77Å; Y214-L249 HydrophobicContact CD2-CD2 3.45Å; Y214-L249 VanDerWaalsContact CD2-CD2 3.45Å; Y214-L249 HydrophobicContact CE1-CD2 4.14Å; Y214-L249 HydrophobicContact CE2-CB 4.4Å; Y214-L249 HydrophobicContact CE2-CD2 3.82Å; Y214-L249 HydrophobicContact CG-CD2 3.41Å; Y214-L249 VanDerWaalsContact CG-CD2 3.41Å; V226-L249 HydrophobicContact CG1-CD2 4.07Å; H242-L249 HydrophobicContact CB-CD1 3.7Å; S246-L249 WeakPolarHBondContact CB-O 3.2Å; S246-L249 VanDerWaalsContact O-CB 3.26Å; S246-L249 WeakPolarHBondContact O-CB 3.5Å; S246-L249 VanDerWaalsContact O-CG 3.32Å; S246-L249 WeakPolarHBondContact O-CG 3.32Å; S246-L249 PolarHBondContact O-N 2.79Å; L249-C251 WeakPolarHBondContact CB-O 3.29Å; L249-C251 PolarHBondContact O-N 2.69Å; L249-L253 HydrophobicContact CD1-CD1 4.37Å; L249-L253 HydrophobicContact CD1-CD2 3.77Å; L249-L253 HydrophobicContact CD1-CG 3.96Å
250	A	90.1	Very high	87.1	Confident	35 Å²	35	54.5 Å²	54.5	29%	0.289	29%	0.293	S	S	.	.	S	Bend	trans	-61.5	-28.3	175.8	0	0	0	0	0	113.4	Y207 W212 Y214	Y207-A250 HydrophobicContact CD1-CB 4.37Å; Y207-A250 HydrophobicContact CG-CB 4.1Å; W212-A250 HydrophobicContact CD2-CB 4.18Å; W212-A250 HydrophobicContact CG-CB 4.2Å; Y214-A250 VanDerWaalsContact OH-CB 3.3Å; Y214-A250 WeakPolarHBondContact OH-CB 3.47Å; Y214-A250 PolarHBondContact OH-N 2.62Å
251	C	91.1	Very high	85.2	Confident	17 Å²	17	52.9 Å²	52.9	12%	0.115	29%	0.288	C	S	.	.	S	Bend	trans	-158	178.6	169.3	64.4	0	0	0	0	110.8	L205 Y207 L249	L205-C251 WeakPolarHBondContact CD2-O 3.41Å; Y207-C251 HydrophobicContact CD2-CB 3.5Å; Y207-C251 VanDerWaalsContact CD2-CB 3.5Å; Y207-C251 VanDerWaalsContact CD2-SG 3.59Å; Y207-C251 HydrophobicContact CE2-CB 3.87Å; Y207-C251 HydrophobicContact CG-CB 4.5Å; L249-C251 WeakPolarHBondContact CB-O 3.29Å; L249-C251 PolarHBondContact O-N 2.69Å
252	T	93.2	Very high	83.1	Confident	32 Å²	32	60.3 Å²	60.3	20%	0.196	32%	0.315	C	S	.	.			trans	-71.9	154.5	174.3	45.5	0	0	0	0	112.9	H242 L254	H242-T252 CarbonylContact O-C 3.5Å; H242-T252 VanDerWaalsContact O-CA 3.28Å; H242-T252 WeakPolarHBondContact O-CA 3.22Å; H242-T252 WeakPolarHBondContact O-CB 3.35Å; T252-L254 PolarHBondContact O-N 3.16Å; T252-L254 VanDerWaalsContact O-N 3.12Å; T252-L254 WeakPolarHBondContact OG1-CD2 3.3Å
253	L	93.4	Very high	80.4	Confident	2 Å²	2	62.3 Å²	62.3	1%	0.01	33%	0.327	C	S	.	.			trans	-80.3	85.5	178.3	-57.3	-174.6	0	0	0	110.1	F189 I203 L205 V239 H242 E243 L249	F189-L253 HydrophobicContact CB-CD2 3.78Å; F189-L253 HydrophobicContact CD1-CB 3.66Å; F189-L253 HydrophobicContact CD1-CD2 4.38Å; F189-L253 HydrophobicContact CD2-CB 4.01Å; F189-L253 HydrophobicContact CD2-CD1 3.97Å; F189-L253 HydrophobicContact CD2-CD2 3.96Å; F189-L253 HydrophobicContact CD2-CG 4.19Å; F189-L253 HydrophobicContact CE1-CB 3.62Å; F189-L253 WeakPolarHBondContact CE1-O 3.36Å; F189-L253 HydrophobicContact CE2-CB 3.97Å; F189-L253 HydrophobicContact CE2-CD1 3.94Å; F189-L253 HydrophobicContact CE2-CG 4.4Å; F189-L253 HydrophobicContact CG-CB 3.86Å; F189-L253 HydrophobicContact CG-CD2 3.8Å; F189-L253 HydrophobicContact CG-CG 4.25Å; F189-L253 HydrophobicContact CZ-CB 3.77Å; F189-L253 HydrophobicContact CZ-CD1 4.48Å; I203-L253 HydrophobicContact CG2-CD2 3.91Å; L205-L253 HydrophobicContact CD1-CD2 3.9Å; L205-L253 HydrophobicContact CD2-CD2 4.2Å; L205-L253 HydrophobicContact CG-CD2 4.48Å; V239-L253 HydrophobicContact CG1-CD1 4.33Å; V239-L253 HydrophobicContact CG2-CD1 4.43Å; H242-L253 HydrophobicContact CB-CD1 3.58Å; H242-L253 HydrophobicContact CB-CG 3.75Å; H242-L253 PolarHBondContact O-N 2.84Å; E243-L253 HydrophobicContact CG-CB 4.48Å; E243-L253 WeakPolarHBondContact CG-O 3.43Å; L249-L253 HydrophobicContact CD1-CD1 4.37Å; L249-L253 HydrophobicContact CD1-CD2 3.77Å; L249-L253 HydrophobicContact CD1-CG 3.96Å
254	L	87.1	Confident	77.8	Confident	82 Å²	82	61 Å²	61	43%	0.429	33%	0.326	S	S	.	.			trans	-90.7	-38.5	-170.6	-63.8	178	0	0	0	114.4	G187 T252	G187-L254 PolarHBondContact O-N 2.89Å; T252-L254 PolarHBondContact O-N 3.16Å; T252-L254 VanDerWaalsContact O-N 3.12Å; T252-L254 WeakPolarHBondContact OG1-CD2 3.3Å
255	Y	88.8	Confident	75.3	Confident	109 Å²	109	56 Å²	56	43%	0.427	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	102.1	-168.3	-47.9	-71	0	0	0	112	I185 T186 G187 S188 F189 A257	I185-Y255 HydrophobicContact CD1-CD2 3.67Å; I185-Y255 HydrophobicContact CD1-CE1 4.37Å; I185-Y255 HydrophobicContact CD1-CE2 3.4Å; I185-Y255 VanDerWaalsContact CD1-CE2 3.4Å; I185-Y255 HydrophobicContact CD1-CG 4.27Å; I185-Y255 HydrophobicContact CG1-CD2 3.62Å; I185-Y255 HydrophobicContact CG1-CE2 3.79Å; I185-Y255 HydrophobicContact CG1-CG 4.35Å; T186-Y255 WeakPolarHBondContact O-CE2 3.4Å; G187-Y255 PolarHBondContact O-N 3.4Å; S188-Y255 CarbonylContact C-O 3.59Å; S188-Y255 VanDerWaalsContact CA-O 3.24Å; S188-Y255 WeakPolarHBondContact CA-O 3.34Å; F189-Y255 PolarHBondContact N-O 3.3Å; Y255-A257 PolarHBondContact O-N 2.89Å
256	P	87.9	Confident	73	Confident	50 Å²	50	57.4 Å²	57.4	33%	0.325	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	122	172.6	-28.7	37.1	0	0	0	111.6	K166 W167 F189	K166-P256 HydrophobicContact CB-CB 4.12Å; W167-P256 HydrophobicContact CB-CB 3.97Å; W167-P256 HydrophobicContact CB-CG 4.31Å; F189-P256 HydrophobicContact CE1-CB 4.46Å; F189-P256 HydrophobicContact CE1-CG 3.79Å; F189-P256 HydrophobicContact CZ-CG 3.89Å; F189-P256 CarbonylContact O-C 3.29Å; F189-P256 WeakPolarHBondContact O-CA 3.32Å
257	A	81.2	Confident	70.9	Confident	6 Å²	6	57.2 Å²	57.2	5%	0.05	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-59.7	130.5	177.9	0	0	0	0	0	109.5	H169 L181 F189 L190 Y255 K259	H169-A257 PolarHBondContact CE1-O 2.9Å; H169-A257 PolarHBondContact NE2-O 3.14Å; L181-A257 HydrophobicContact CD2-CB 3.9Å; F189-A257 WeakPolarHBondContact O-CB 3.49Å; F189-A257 PolarHBondContact O-N 3.06Å; L190-A257 HydrophobicContact CB-CB 4.13Å; L190-A257 HydrophobicContact CD2-CB 4.06Å; Y255-A257 PolarHBondContact O-N 2.89Å; A257-K259 PolarHBondContact O-N 2.86Å
258	P	74.5	Confident	68.9	Low	104 Å²	104	59.5 Å²	59.5	68%	0.675	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-56.3	129.7	177.6	-25.1	34.1	0	0	0	110.7	H169 R260	H169-P258 PolarHBondContact CE1-O 3.21Å; P258-R260 VanDerWaalsContact C-N 3.35Å; P258-R260 PolarHBondContact O-N 2.9Å
259	K	69	Low	67	Low	63 Å²	63	59.1 Å²	59.1	27%	0.274	30%	0.295	S	S	.	.			trans	-61.4	99	169.7	-59.3	-164.2	-167.6	-161	0	107.7	E163 E165 K166 Y168 A257	E163-K259 PolarHBondContact O-NZ 3.11Å; E165-K259 WeakPolarHBondContact O-CE 3.34Å; E165-K259 PolarHBondContact O-NZ 3.34Å; K166-K259 WeakPolarHBondContact O-CE 3.26Å; Y168-K259 WeakPolarHBondContact O-CE 3.2Å; Y168-K259 PolarHBondContact O-NZ 2.69Å; A257-K259 PolarHBondContact O-N 2.86Å
260	R	60.8	Low	64.6	Low	57 Å²	57	62.1 Å²	62.1	22%	0.215	31%	0.312	C	S	.	.			trans	-66.9	136.1	176.1	-76.4	-162.4	170.2	123	12.1	108.8	Y179 L180 S183 P258 Q415	Y179-R260 VanDerWaalsContact CE1-NH1 3.35Å; Y179-R260 VanDerWaalsContact CZ-NH1 3.28Å; Y179-R260 PolarHBondContact O-NH1 2.9Å; Y179-R260 PolarHBondContact OH-NH1 2.83Å; L180-R260 HydrophobicContact CD2-CB 3.73Å; L180-R260 HydrophobicContact CD2-CG 3.59Å; S183-R260 PolarHBondContact OG-NH2 2.81Å; P258-R260 VanDerWaalsContact C-N 3.35Å; P258-R260 PolarHBondContact O-N 2.9Å; R260-Q415 VanDerWaalsContact CB-OE1 3.3Å
261	D	51	Low	62.2	Low	65 Å²	65	62.9 Å²	62.9	35%	0.348	31%	0.314	S	S	.	.			trans	-86.2	149.1	-148.5	-145.3	-33.7	0	0	0	112.6	F62 T263	F62-D261 WeakPolarHBondContact CE1-OD1 3.48Å; D261-T263 HydrophobicContact CB-CG2 3.85Å; D261-T263 PolarHBondContact O-N 2.82Å
262	R	48.5	Very low	59.8	Low	188 Å²	188	66.3 Å²	66.3	71%	0.709	34%	0.338	S	S	*	.			trans	-87.6	22.9	173.8	-70.4	-173.9	174.1	-176.8	-0.5	111.5	S264 S265	R262-S264 PolarHBondContact O-N 2.92Å; R262-S265 PolarHBondContact O-N 3.26Å; R262-S265 PolarHBondContact O-OG 2.92Å
263	T	37.7	Very low	57.3	Low	43 Å²	43	69.8 Å²	69.8	26%	0.264	35%	0.35	S	S	.	.			trans	-61.2	14.1	-173.5	42.3	0	0	0	0	117.3	D261 S265 E266	D261-T263 HydrophobicContact CB-CG2 3.85Å; D261-T263 PolarHBondContact O-N 2.82Å; T263-S265 PolarHBondContact O-N 3.13Å; T263-E266 HydrophobicContact CG2-CG 3.84Å; T263-E266 PolarHBondContact O-N 2.96Å
264	S	38.5	Very low	55.2	Low	45 Å²	45	75.4 Å²	75.4	32%	0.315	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	7	149.4	-64.2	0	0	0	0	113.1	R262 K419	R262-S264 PolarHBondContact O-N 2.92Å; S264-K419 PolarHBondContact OG-NZ 3.03Å
265	S	38.8	Very low	53.7	Low	6 Å²	6	74.1 Å²	74.1	4%	0.042	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-26.7	170.4	46.9	0	0	0	0	114.9	Y113 R262 T263 L267 R268	Y113-S265 WeakPolarHBondContact CE2-OG 3.36Å; Y113-S265 PolarHBondContact OH-OG 2.94Å; R262-S265 PolarHBondContact O-N 3.26Å; R262-S265 PolarHBondContact O-OG 2.92Å; T263-S265 PolarHBondContact O-N 3.13Å; S265-L267 PolarHBondContact O-N 2.7Å; S265-R268 PolarHBondContact O-N 2.78Å
266	E	41.8	Very low	52.9	Low	133 Å²	133	71.1 Å²	71.1	62%	0.621	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-15.8	-168.4	-68.2	-173.6	147.5	0	0	114.7	T263	T263-E266 HydrophobicContact CG2-CG 3.84Å; T263-E266 PolarHBondContact O-N 2.96Å
267	L	46.3	Very low	52.9	Low	45 Å²	45	70.7 Å²	70.7	24%	0.236	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	20.6	176.5	-81.1	167.7	0	0	0	114.4	S265 M269 V307 L343	S265-L267 PolarHBondContact O-N 2.7Å; L267-M269 PolarHBondContact O-N 3.09Å; L267-V307 HydrophobicContact CD1-CB 3.99Å; L267-V307 HydrophobicContact CD1-CG1 4.07Å; L267-V307 HydrophobicContact CD1-CG2 3.86Å; L267-V307 HydrophobicContact CD2-CB 4.26Å; L267-V307 HydrophobicContact CD2-CG1 3.86Å; L267-V307 HydrophobicContact CD2-CG2 3.71Å; L267-V307 HydrophobicContact CG-CG1 4.2Å; L267-V307 HydrophobicContact CG-CG2 4.39Å; L267-L343 HydrophobicContact CB-CD2 4.12Å; L267-L343 HydrophobicContact CD1-CD1 4.18Å
268	R	48	Very low	53.1	Low	106 Å²	106	70.5 Å²	70.5	40%	0.4	35%	0.353	S	S	.	.			trans	-74.7	77.5	168	-68.6	-174	-176.7	-165.1	3.2	110.3	D94 W95 S265 D270	D94-R268 IonicContact OD1-NH1 3.53Å; D94-R268 PolarHBondContact OD1-NH1 2.94Å; D94-R268 WeakPolarHBondContact OD2-CD 3.22Å; D94-R268 IonicContact OD2-CZ 3.66Å; D94-R268 IonicContact OD2-NE 2.78Å; D94-R268 IonicContact OD2-NH1 2.68Å; D94-R268 PolarHBondContact OD2-NH1 2.9Å; W95-R268 WeakPolarHBondContact CZ2-O 3.23Å; S265-R268 PolarHBondContact O-N 2.78Å; R268-D270 PolarHBondContact O-N 3.23Å
269	M	45.5	Very low	53.7	Low	43 Å²	43	69.1 Å²	69.1	21%	0.212	34%	0.34	C	S	.	.			trans	-78.9	116.7	172.8	-67.8	-64.9	105.1	0	0	110.5	P67 L267 Y305	P67-M269 HydrophobicContact CG-CE 4.14Å; L267-M269 PolarHBondContact O-N 3.09Å; M269-Y305 HydrophobicContact CG-CE1 4.13Å; M269-Y305 HydrophobicContact SD-CD1 3.93Å; M269-Y305 HydrophobicContact SD-CE1 3.4Å; M269-Y305 WeakPolarHBondContact SD-CE1 3.47Å
270	D	43.7	Very low	54.7	Low	74 Å²	74	68.5 Å²	68.5	40%	0.396	34%	0.336	S	S	.	.			trans	51.4	119.5	164.8	-161.1	-49	0	0	0	118.7	R268 S272 F273	R268-D270 PolarHBondContact O-N 3.23Å; D270-S272 PolarHBondContact O-N 2.73Å; D270-S272 VanDerWaalsContact O-N 3.14Å; D270-S272 VanDerWaalsContact OD1-CB 3.27Å; D270-S272 WeakPolarHBondContact OD1-CB 3.29Å; D270-S272 PolarHBondContact OD1-N 3.41Å; D270-S272 PolarHBondContact OD1-OG 3.24Å; D270-F273 HydrophobicContact CB-CD2 3.72Å; D270-F273 HydrophobicContact CB-CE2 3.85Å
271	P	40	Very low	56.1	Low	50 Å²	50	70.5 Å²	70.5	33%	0.325	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-23.7	175.4	-30.3	38.7	0	0	0	117.4	D92	D92-P271 WeakPolarHBondContact OD2-CB 3.26Å; D92-P271 WeakPolarHBondContact OD2-CG 3.39Å
272	S	41.1	Very low	57.9	Low	89 Å²	89	69.5 Å²	69.5	62%	0.622	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-4.7	-161.1	65.1	0	0	0	0	116.2	D270	D270-S272 PolarHBondContact O-N 2.73Å; D270-S272 VanDerWaalsContact O-N 3.14Å; D270-S272 VanDerWaalsContact OD1-CB 3.27Å; D270-S272 WeakPolarHBondContact OD1-CB 3.29Å; D270-S272 PolarHBondContact OD1-N 3.41Å; D270-S272 PolarHBondContact OD1-OG 3.24Å
273	F	39.6	Very low	59.9	Low	106 Å²	106	61.2 Å²	61.2	47%	0.465	32%	0.317	S	S	.	.			trans	-95.6	127.6	-163.7	-78.7	-86.8	0	0	0	116	D270	D270-F273 HydrophobicContact CB-CD2 3.72Å; D270-F273 HydrophobicContact CB-CE2 3.85Å
274	D	49.7	Very low	62.5	Low	120 Å²	120	62.4 Å²	62.4	64%	0.642	32%	0.324	S	S	*	.	S	Bend	trans	-50.3	169.5	145.4	-90.1	-40.9	0	0	0	111.2	R276 K332	D274-R276 PolarHBondContact O-N 3.31Å; D274-K332 WeakPolarHBondContact OD1-CE 3.38Å; D274-K332 IonicContact OD1-NZ 3.66Å; D274-K332 PolarHBondContact OD1-NZ 2.88Å
275	I	56.4	Low	65	Low	54 Å²	54	63 Å²	63	28%	0.277	32%	0.323	S	S	.	.	S	Bend	trans	-46.7	112.9	-178.9	-59.2	174.1	0	0	0	109.2	E277 K332 L342 A345	I275-E277 PolarHBondContact O-N 2.88Å; I275-K332 HydrophobicContact CD1-CB 4.19Å; I275-K332 HydrophobicContact CD1-CD 4.14Å; I275-K332 HydrophobicContact CD1-CG 4.31Å; I275-K332 HydrophobicContact CG1-CB 3.94Å; I275-K332 HydrophobicContact CG1-CD 3.63Å; I275-K332 HydrophobicContact CG1-CG 3.61Å; I275-L342 HydrophobicContact CG1-CD2 4.49Å; I275-L342 HydrophobicContact CG2-CD2 4.33Å; I275-A345 HydrophobicContact CG2-CB 3.86Å
276	R	71.8	Confident	67.3	Low	47 Å²	47	67 Å²	67	18%	0.177	34%	0.34	C	S	.	.			trans	-61.7	107.8	-178.4	-175.6	170.7	171.5	135.7	-3.8	107.5	E71 D274 I278 Y305 G344 A345	E71-R276 IonicContact OE2-CZ 2.63Å; E71-R276 IonicContact OE2-NH1 3.67Å; E71-R276 PolarHBondContact OE2-NH1 2.95Å; E71-R276 IonicContact OE2-NH2 3.59Å; E71-R276 PolarHBondContact OE2-NH2 3.13Å; D274-R276 PolarHBondContact O-N 3.31Å; R276-I278 VanDerWaalsContact C-N 3.28Å; R276-I278 HydrophobicContact CG-CG1 4.07Å; R276-I278 PolarHBondContact O-N 2.87Å; R276-Y305 PolarHBondContact NH1-OH 2.66Å; R276-Y305 VanDerWaalsContact NH1-OH 3.15Å; R276-G344 CarbonylContact O-C 3.57Å; R276-G344 VanDerWaalsContact O-CA 3.25Å; R276-G344 WeakPolarHBondContact O-CA 3.37Å; R276-A345 PolarHBondContact O-N 2.91Å
277	E	86.9	Confident	69.4	Low	41 Å²	41	66 Å²	66	19%	0.192	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-77.2	87.7	174.7	178.8	58.4	-156.7	0	0	107	I275 A345 T347 R348	I275-E277 PolarHBondContact O-N 2.88Å; E277-A345 CarbonylContact C-O 3.49Å; E277-A345 WeakPolarHBondContact CA-O 3.33Å; E277-T347 PolarHBondContact OE1-N 2.86Å; E277-T347 WeakPolarHBondContact OE2-CB 3.29Å; E277-T347 PolarHBondContact OE2-N 3.44Å; E277-T347 PolarHBondContact OE2-OG1 3.06Å; E277-R348 HydrophobicContact CG-CG 3.72Å; E277-R348 VanDerWaalsContact CG-NE 3.26Å; E277-R348 WeakPolarHBondContact OE1-CB 3.49Å; E277-R348 VanDerWaalsContact OE1-CG 3.27Å; E277-R348 WeakPolarHBondContact OE1-CG 3.36Å; E277-R348 PolarHBondContact OE1-N 2.98Å
278	I	86.1	Confident	71.6	Confident	2 Å²	2	69.1 Å²	69.1	1%	0.01	35%	0.346	C	S	.	.			trans	-68.5	130.4	-177	-66.6	168.3	0	0	0	108.3	R276 R280 E282 I283 W302 A345 C346 V355	R276-I278 VanDerWaalsContact C-N 3.28Å; R276-I278 HydrophobicContact CG-CG1 4.07Å; R276-I278 PolarHBondContact O-N 2.87Å; I278-R280 PolarHBondContact O-N 3.11Å; I278-E282 HydrophobicContact CG2-CB 4.21Å; I278-I283 HydrophobicContact CG2-CD1 4.05Å; I278-I283 HydrophobicContact CG2-CG1 3.85Å; I278-W302 HydrophobicContact CD1-CD2 4.42Å; I278-W302 HydrophobicContact CD1-CH2 4.04Å; I278-W302 HydrophobicContact CD1-CZ2 3.68Å; I278-W302 HydrophobicContact CG1-CH2 4.41Å; I278-W302 HydrophobicContact CG1-CZ2 3.73Å; I278-A345 PolarHBondContact N-O 3.24Å; I278-C346 PolarHBondContact O-SG 3.17Å; I278-V355 HydrophobicContact CD1-CB 3.99Å; I278-V355 HydrophobicContact CD1-CG1 4.17Å; I278-V355 HydrophobicContact CD1-CG2 4.02Å
279	D	87.2	Confident	73.3	Confident	75 Å²	75	67.6 Å²	67.6	40%	0.401	35%	0.346	S	S	.	.			trans	-64.3	123.1	169.6	-173.8	-52.4	0	0	0	108.6	T281 E282	D279-T281 PolarHBondContact O-N 3.05Å; D279-T281 WeakPolarHBondContact OD1-CA 3.24Å; D279-T281 VanDerWaalsContact OD1-CB 3.25Å; D279-T281 WeakPolarHBondContact OD1-CB 3.33Å; D279-T281 WeakPolarHBondContact OD1-CG2 3.1Å; D279-T281 PolarHBondContact OD1-N 3.34Å; D279-T281 PolarHBondContact OD1-OG1 2.98Å; D279-E282 HydrophobicContact CB-CG 4.21Å; D279-E282 VanDerWaalsContact O-CB 3.26Å; D279-E282 WeakPolarHBondContact O-CB 3.25Å; D279-E282 PolarHBondContact O-N 2.92Å
280	R	89.5	Confident	75.1	Confident	50 Å²	50	66.8 Å²	66.8	19%	0.189	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-52.9	-31.5	-178	-177.2	179.9	-59.8	124.6	12.2	112.4	I278 E282 I283 E349 P350 P351 Y353	I278-R280 PolarHBondContact O-N 3.11Å; R280-E282 PolarHBondContact O-N 3.4Å; R280-I283 PolarHBondContact O-N 3.45Å; R280-E349 IonicContact CZ-OE1 3.46Å; R280-E349 IonicContact NH1-OE1 3.59Å; R280-E349 PolarHBondContact NH1-OE1 3.2Å; R280-E349 PolarHBondContact NH2-O 3.27Å; R280-E349 IonicContact NH2-OE1 3.55Å; R280-P350 PolarHBondContact NH1-O 3.41Å; R280-P350 PolarHBondContact NH2-O 3Å; R280-P350 VanDerWaalsContact NH2-O 3.13Å; R280-P351 PolarHBondContact NE-O 3.21Å; R280-P351 PolarHBondContact NH2-O 3.13Å; R280-Y353 HydrophobicContact CG-CD2 4.4Å; R280-Y353 HydrophobicContact CG-CE2 3.74Å
281	T	89.7	Confident	76.7	Confident	99 Å²	99	66.5 Å²	66.5	61%	0.607	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-67.3	-16.7	179	70.1	0	0	0	0	113.1	D279 I283 K303	D279-T281 PolarHBondContact O-N 3.05Å; D279-T281 WeakPolarHBondContact OD1-CA 3.24Å; D279-T281 VanDerWaalsContact OD1-CB 3.25Å; D279-T281 WeakPolarHBondContact OD1-CB 3.33Å; D279-T281 WeakPolarHBondContact OD1-CG2 3.1Å; D279-T281 PolarHBondContact OD1-N 3.34Å; D279-T281 PolarHBondContact OD1-OG1 2.98Å; T281-I283 VanDerWaalsContact C-N 3.32Å; T281-K303 WeakPolarHBondContact O-CE 3.4Å; T281-K303 PolarHBondContact O-NZ 3.08Å
282	E	89.8	Confident	78.1	Confident	44 Å²	44	66.2 Å²	66.2	21%	0.206	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-72.1	-24.2	170.6	-64.7	178.6	-173.8	0	0	112.8	I278 D279 R280 W302 K303 P304	I278-E282 HydrophobicContact CG2-CB 4.21Å; D279-E282 HydrophobicContact CB-CG 4.21Å; D279-E282 VanDerWaalsContact O-CB 3.26Å; D279-E282 WeakPolarHBondContact O-CB 3.25Å; D279-E282 PolarHBondContact O-N 2.92Å; R280-E282 PolarHBondContact O-N 3.4Å; E282-W302 PolarHBondContact OE2-NE1 2.87Å; E282-K303 WeakPolarHBondContact O-CB 3.19Å; E282-K303 WeakPolarHBondContact O-CE 3.5Å; E282-K303 WeakPolarHBondContact O-CG 3.44Å; E282-K303 PolarHBondContact O-N 2.96Å; E282-P304 HydrophobicContact CB-CG 4.16Å; E282-P304 HydrophobicContact CG-CG 3.85Å
283	I	90.7	Very high	79.3	Confident	13 Å²	13	68.3 Å²	68.3	7%	0.067	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	113.4	-173.2	-60.4	-64	0	0	0	110.9	I278 R280 T281 M285 A300 W302 V309 V311 Y353 V355	I278-I283 HydrophobicContact CG2-CD1 4.05Å; I278-I283 HydrophobicContact CG2-CG1 3.85Å; R280-I283 PolarHBondContact O-N 3.45Å; T281-I283 VanDerWaalsContact C-N 3.32Å; I283-M285 HydrophobicContact CG2-CG 4.45Å; I283-M285 HydrophobicContact CG2-SD 3.79Å; I283-A300 HydrophobicContact CG2-CB 3.78Å; I283-W302 HydrophobicContact CD1-CB 3.95Å; I283-W302 HydrophobicContact CD1-CG 3.82Å; I283-V309 HydrophobicContact CD1-CG2 4.28Å; I283-V311 HydrophobicContact CG2-CG2 3.93Å; I283-Y353 HydrophobicContact CG2-CE2 4.35Å; I283-V355 HydrophobicContact CD1-CG1 4.28Å; I283-V355 HydrophobicContact CD1-CG2 4.35Å
284	V	90.5	Very high	80.5	Confident	68 Å²	68	64 Å²	64	41%	0.412	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	99.4	173	177.7	0	0	0	0	109.5	K286 A300 V301 K303	V284-K286 PolarHBondContact O-N 3.45Å; V284-A300 CarbonylContact O-C 3.57Å; V284-A300 WeakPolarHBondContact O-CA 3.47Å; V284-A300 VanDerWaalsContact O-CB 3.3Å; V284-A300 WeakPolarHBondContact O-CB 3.42Å; V284-V301 HydrophobicContact CB-CB 4.49Å; V284-V301 PolarHBondContact N-O 2.91Å; V284-V301 PolarHBondContact O-N 3.48Å; V284-K303 HydrophobicContact CG2-CD 3.57Å; V284-K303 HydrophobicContact CG2-CG 3.73Å
285	M	91.1	Very high	81.7	Confident	57 Å²	57	58.3 Å²	58.3	28%	0.281	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	130.3	176.5	-57.8	-66.2	-86.8	0	0	111	I283 Y298 A300 V311 T313 Y353	I283-M285 HydrophobicContact CG2-CG 4.45Å; I283-M285 HydrophobicContact CG2-SD 3.79Å; M285-Y298 HydrophobicContact CE-CD1 4.25Å; M285-Y298 HydrophobicContact CE-CD2 3.37Å; M285-Y298 HydrophobicContact CE-CE2 3.98Å; M285-Y298 HydrophobicContact CE-CG 3.53Å; M285-A300 HydrophobicContact SD-CB 4.07Å; M285-V311 HydrophobicContact CE-CB 4.09Å; M285-V311 HydrophobicContact CE-CG1 3.88Å; M285-V311 HydrophobicContact SD-CB 3.91Å; M285-V311 HydrophobicContact SD-CG1 3.82Å; M285-V311 HydrophobicContact SD-CG2 4.08Å; M285-T313 HydrophobicContact CE-CG2 3.64Å; M285-Y353 HydrophobicContact SD-CE2 4.12Å
286	K	89	Confident	83.1	Confident	92 Å²	92	57 Å²	57	40%	0.4	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-136	174.4	-66	172.7	156	175.3	0	109.9	V284 E299 V301	V284-K286 PolarHBondContact O-N 3.45Å; K286-E299 WeakPolarHBondContact CA-O 3.35Å; K286-E299 HydrophobicContact CB-CB 4.24Å; K286-E299 HydrophobicContact CB-CG 4.45Å; K286-E299 WeakPolarHBondContact CB-O 3.32Å; K286-E299 HydrophobicContact CD-CG 3.97Å; K286-E299 WeakPolarHBondContact CD-OE1 3.45Å; K286-E299 WeakPolarHBondContact CD-OE2 3.27Å; K286-E299 WeakPolarHBondContact CE-OE1 3.43Å; K286-E299 PolarHBondContact N-O 3.2Å; K286-E299 IonicContact NZ-OE1 3.59Å; K286-E299 PolarHBondContact NZ-OE1 3.36Å; K286-V301 HydrophobicContact CD-CG2 4.18Å; K286-V301 VanDerWaalsContact CE-CG2 3.48Å
287	H	85.8	Confident	84	Confident	111 Å²	111	56.6 Å²	56.6	51%	0.514	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	155.4	-174.5	83.1	-83.8	0	0	0	112.3	L289 Y298 E299	H287-L289 PolarHBondContact O-N 3.15Å; H287-Y298 WeakPolarHBondContact O-CA 3.33Å; H287-E299 IonicContact CE1-OE2 2.73Å; H287-E299 PolarHBondContact CE1-OE2 3.27Å; H287-E299 IonicContact CG-OE2 3.82Å; H287-E299 IonicContact ND1-OE2 3.51Å; H287-E299 PolarHBondContact ND1-OE2 3.44Å; H287-E299 PolarHBondContact O-N 2.9Å
288	K	90.6	Very high	84.2	Confident	110 Å²	110	58 Å²	58	48%	0.478	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	120.1	176.4	173.9	-173.8	168.1	-178.6	0	109.9	G290 S291 V296 Y298	K288-G290 VanDerWaalsContact CE-C 3.44Å; K288-G290 WeakPolarHBondContact CE-O 3.19Å; K288-S291 WeakPolarHBondContact CE-OG 3.4Å; K288-S291 PolarHBondContact NZ-OG 3.46Å; K288-V296 HydrophobicContact CD-CG1 3.76Å; K288-V296 HydrophobicContact CG-CG1 3.76Å; K288-Y298 HydrophobicContact CB-CD1 4.15Å; K288-Y298 HydrophobicContact CB-CE1 4.17Å
289	L	85.3	Confident	84.5	Confident	75 Å²	75	59 Å²	59	39%	0.393	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	-39.2	172.5	-63.7	169.4	0	0	0	111.8	H287 V297 E299 A310 F358	H287-L289 PolarHBondContact O-N 3.15Å; L289-V297 HydrophobicContact CB-CG1 4.42Å; L289-V297 HydrophobicContact CD1-CG1 4.34Å; L289-V297 PolarHBondContact N-O 3.45Å; L289-E299 HydrophobicContact CD1-CB 4.16Å; L289-E299 HydrophobicContact CD2-CB 4.26Å; L289-E299 HydrophobicContact CG-CB 4.14Å; L289-A310 HydrophobicContact CD1-CB 4.44Å; L289-F358 HydrophobicContact CD1-CD2 3.93Å; L289-F358 HydrophobicContact CD1-CE2 3.65Å; L289-F358 HydrophobicContact CD2-CE2 3.84Å; L289-F358 HydrophobicContact CD2-CZ 4.47Å; L289-F358 HydrophobicContact CG-CE2 4.4Å
290	G	82	Confident	84.7	Confident	25 Å²	25	55.4 Å²	55.4	26%	0.258	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.9	177.2	-173.6	0	0	0	0	0	114.6	K288 V296 V297	K288-G290 VanDerWaalsContact CE-C 3.44Å; K288-G290 WeakPolarHBondContact CE-O 3.19Å; G290-V296 WeakPolarHBondContact O-CG1 3.43Å; G290-V297 PolarHBondContact N-O 2.67Å; G290-V297 PolarHBondContact O-N 3.03Å
291	S	78.6	Confident	84.6	Confident	69 Å²	69	54.1 Å²	54.1	48%	0.483	29%	0.293	S	S	.	.			trans	-154.2	102.5	170.3	52	0	0	0	0	111.2	K288	K288-S291 WeakPolarHBondContact CE-OG 3.4Å; K288-S291 PolarHBondContact NZ-OG 3.46Å
292	G	69.6	Low	84.5	Confident	44 Å²	44	49.6 Å²	49.6	45%	0.454	27%	0.265	S	S	.	.			trans	-87.5	-158.1	175.6	0	0	0	0	0	113.1	G295 K315	G292-G295 PolarHBondContact N-O 3.27Å; G292-K315 PolarHBondContact O-NZ 3.33Å
293	Q	65.4	Low	84.2	Confident	132 Å²	132	52.8 Å²	52.8	62%	0.617	28%	0.278	S	S	*	.	S	Bend	trans	-62.6	-59.9	178.2	-178.7	162.1	-77.3	0	0	111.3	G295 K315	Q293-G295 PolarHBondContact O-N 2.98Å; Q293-K315 PolarHBondContact O-NZ 2.99Å
294	Y	64.8	Low	83.7	Confident	15 Å²	15	54.3 Å²	54.3	6%	0.059	29%	0.289	C	S	.	.	S	Bend	trans	-65.6	-35.3	-171.9	-51.9	-70	0	0	0	114.2	V320 G424 L425	Y294-V320 HydrophobicContact CD1-CG1 3.9Å; Y294-G424 PolarHBondContact OH-O 2.82Å; Y294-G424 VanDerWaalsContact OH-O 3.09Å; Y294-L425 VanDerWaalsContact OH-CD2 3.26Å; Y294-L425 WeakPolarHBondContact OH-CD2 3.41Å; Y294-L425 WeakPolarHBondContact OH-CG 3.48Å
295	G	75.3	Confident	83	Confident	2 Å²	2	52.1 Å²	52.1	2%	0.021	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	-168.4	-163.3	0	0	0	0	0	116.1	G292 Q293 T313 K315	G292-G295 PolarHBondContact N-O 3.27Å; Q293-G295 PolarHBondContact O-N 2.98Å; G295-T313 WeakPolarHBondContact CA-O 3.34Å; G295-K315 VanDerWaalsContact C-CE 3.45Å; G295-K315 WeakPolarHBondContact O-CE 3.46Å; G295-K315 PolarHBondContact O-NZ 2.95Å; G295-K315 VanDerWaalsContact O-NZ 3.14Å
296	V	85.3	Confident	82.4	Confident	25 Å²	25	55.6 Å²	55.6	15%	0.152	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	138.5	164.5	-176.1	0	0	0	0	106.8	K288 G290 Y298 T313	K288-V296 HydrophobicContact CD-CG1 3.76Å; K288-V296 HydrophobicContact CG-CG1 3.76Å; G290-V296 WeakPolarHBondContact O-CG1 3.43Å; V296-Y298 HydrophobicContact CB-CD2 4.42Å; V296-Y298 HydrophobicContact CB-CE2 3.65Å; V296-Y298 HydrophobicContact CG1-CD2 4.02Å; V296-Y298 HydrophobicContact CG1-CE1 4.37Å; V296-Y298 HydrophobicContact CG1-CE2 3.35Å; V296-T313 PolarHBondContact N-O 3.03Å; V296-T313 PolarHBondContact O-N 3.21Å; V296-T313 PolarHBondContact O-OG1 2.81Å
297	V	90	Very high	81.9	Confident	40 Å²	40	52.9 Å²	52.9	24%	0.242	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	130.5	179.7	-173.9	0	0	0	0	108.6	L289 G290 A310 V311 K312	L289-V297 HydrophobicContact CB-CG1 4.42Å; L289-V297 HydrophobicContact CD1-CG1 4.34Å; L289-V297 PolarHBondContact N-O 3.45Å; G290-V297 PolarHBondContact N-O 2.67Å; G290-V297 PolarHBondContact O-N 3.03Å; V297-A310 HydrophobicContact CG1-CB 4.45Å; V297-V311 WeakPolarHBondContact CA-O 3.41Å; V297-K312 HydrophobicContact CG2-CB 4.29Å; V297-K312 HydrophobicContact CG2-CG 4.12Å
298	Y	91.8	Very high	81.9	Confident	70 Å²	70	51 Å²	51	28%	0.275	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	151	-179.5	-61.9	-101.9	0	0	0	110.5	M285 H287 K288 V296 A310 V311 T313	M285-Y298 HydrophobicContact CE-CD1 4.25Å; M285-Y298 HydrophobicContact CE-CD2 3.37Å; M285-Y298 HydrophobicContact CE-CE2 3.98Å; M285-Y298 HydrophobicContact CE-CG 3.53Å; H287-Y298 WeakPolarHBondContact O-CA 3.33Å; K288-Y298 HydrophobicContact CB-CD1 4.15Å; K288-Y298 HydrophobicContact CB-CE1 4.17Å; V296-Y298 HydrophobicContact CB-CD2 4.42Å; V296-Y298 HydrophobicContact CB-CE2 3.65Å; V296-Y298 HydrophobicContact CG1-CD2 4.02Å; V296-Y298 HydrophobicContact CG1-CE1 4.37Å; V296-Y298 HydrophobicContact CG1-CE2 3.35Å; Y298-A310 WeakPolarHBondContact O-CA 3.32Å; Y298-V311 PolarHBondContact N-O 2.79Å; Y298-V311 PolarHBondContact O-N 3.25Å; Y298-T313 HydrophobicContact CD2-CG2 3.93Å; Y298-T313 HydrophobicContact CE2-CG2 3.94Å
299	E	91.8	Very high	81.9	Confident	23 Å²	23	45.7 Å²	45.7	11%	0.107	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	142.2	154.9	-172.2	-154.1	166.7	0	0	107.2	K286 H287 L289 L308 F358	K286-E299 WeakPolarHBondContact CA-O 3.35Å; K286-E299 HydrophobicContact CB-CB 4.24Å; K286-E299 HydrophobicContact CB-CG 4.45Å; K286-E299 WeakPolarHBondContact CB-O 3.32Å; K286-E299 HydrophobicContact CD-CG 3.97Å; K286-E299 WeakPolarHBondContact CD-OE1 3.45Å; K286-E299 WeakPolarHBondContact CD-OE2 3.27Å; K286-E299 WeakPolarHBondContact CE-OE1 3.43Å; K286-E299 PolarHBondContact N-O 3.2Å; K286-E299 IonicContact NZ-OE1 3.59Å; K286-E299 PolarHBondContact NZ-OE1 3.36Å; H287-E299 IonicContact CE1-OE2 2.73Å; H287-E299 PolarHBondContact CE1-OE2 3.27Å; H287-E299 IonicContact CG-OE2 3.82Å; H287-E299 IonicContact ND1-OE2 3.51Å; H287-E299 PolarHBondContact ND1-OE2 3.44Å; H287-E299 PolarHBondContact O-N 2.9Å; L289-E299 HydrophobicContact CD1-CB 4.16Å; L289-E299 HydrophobicContact CD2-CB 4.26Å; L289-E299 HydrophobicContact CG-CB 4.14Å; E299-L308 WeakPolarHBondContact OE1-CD2 3.47Å; E299-F358 HydrophobicContact CG-CE2 4.34Å; E299-F358 HydrophobicContact CG-CZ 4.49Å
300	A	92	Very high	82.3	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	166.1	169.2	0	0	0	0	0	110.9	I283 V284 M285 L308 V309 V311	I283-A300 HydrophobicContact CG2-CB 3.78Å; V284-A300 CarbonylContact O-C 3.57Å; V284-A300 WeakPolarHBondContact O-CA 3.47Å; V284-A300 VanDerWaalsContact O-CB 3.3Å; V284-A300 WeakPolarHBondContact O-CB 3.42Å; M285-A300 HydrophobicContact SD-CB 4.07Å; A300-L308 WeakPolarHBondContact O-CA 3.48Å; A300-V309 HydrophobicContact CB-CG2 3.96Å; A300-V309 PolarHBondContact N-O 3.14Å; A300-V309 PolarHBondContact O-N 3.43Å; A300-V311 HydrophobicContact CB-CG2 3.54Å
301	V	87.1	Confident	82.8	Confident	22 Å²	22	41.5 Å²	41.5	13%	0.133	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	129.2	166.7	173.6	0	0	0	0	109	V284 K286 K303 V307 L308	V284-V301 HydrophobicContact CB-CB 4.49Å; V284-V301 PolarHBondContact N-O 2.91Å; V284-V301 PolarHBondContact O-N 3.48Å; K286-V301 HydrophobicContact CD-CG2 4.18Å; K286-V301 VanDerWaalsContact CE-CG2 3.48Å; V301-K303 PolarHBondContact O-N 2.99Å; V301-V307 WeakPolarHBondContact CA-O 3.32Å; V301-L308 HydrophobicContact CG2-CD2 3.94Å
302	W	87.9	Confident	83.3	Confident	4 Å²	4	39.3 Å²	39.3	2%	0.015	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	99.9	170.5	-170.5	15.6	0	0	0	109	I278 E282 I283 Y305 N306 V307 V309 L343	I278-W302 HydrophobicContact CD1-CD2 4.42Å; I278-W302 HydrophobicContact CD1-CH2 4.04Å; I278-W302 HydrophobicContact CD1-CZ2 3.68Å; I278-W302 HydrophobicContact CG1-CH2 4.41Å; I278-W302 HydrophobicContact CG1-CZ2 3.73Å; E282-W302 PolarHBondContact OE2-NE1 2.87Å; I283-W302 HydrophobicContact CD1-CB 3.95Å; I283-W302 HydrophobicContact CD1-CG 3.82Å; W302-Y305 AromaticContact CD2-CD2 3.75Å; W302-Y305 HydrophobicContact CD2-CD2 3.75Å; W302-Y305 HydrophobicContact CD2-CE2 4.3Å; W302-Y305 AromaticContact CE2-CD2 3.79Å; W302-Y305 AromaticContact CE2-CE2 3.87Å; W302-Y305 AromaticContact CE3-CD2 3.83Å; W302-Y305 HydrophobicContact CE3-CD2 3.83Å; W302-Y305 HydrophobicContact CE3-CE2 4.42Å; W302-Y305 HydrophobicContact CG-CD2 4.38Å; W302-Y305 HydrophobicContact CH2-CD2 4.01Å; W302-Y305 AromaticContact CH2-CE2 3.76Å; W302-Y305 HydrophobicContact CH2-CE2 3.76Å; W302-Y305 AromaticContact CZ2-CD2 3.93Å; W302-Y305 HydrophobicContact CZ2-CD2 3.93Å; W302-Y305 AromaticContact CZ2-CE2 3.6Å; W302-Y305 HydrophobicContact CZ2-CE2 3.6Å; W302-Y305 AromaticContact CZ3-CD2 3.95Å; W302-Y305 HydrophobicContact CZ3-CD2 3.95Å; W302-Y305 HydrophobicContact CZ3-CE2 4.17Å; W302-Y305 PolarHBondContact O-N 2.82Å; W302-N306 PolarHBondContact O-N 3.42Å; W302-V307 HydrophobicContact CB-CG2 4.13Å; W302-V307 HydrophobicContact CE3-CG2 4.37Å; W302-V307 PolarHBondContact N-O 3.16Å; W302-V309 HydrophobicContact CB-CG1 3.95Å; W302-V309 HydrophobicContact CB-CG2 4.23Å; W302-V309 HydrophobicContact CE3-CG1 4.35Å; W302-L343 HydrophobicContact CZ3-CB 4.15Å
303	K	84.6	Confident	84.2	Confident	112 Å²	112	38 Å²	38	49%	0.487	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-43	-164.1	-75.2	-178.1	-69.5	173.1	0	116.4	T281 E282 V284 V301 Y305 N306	T281-K303 WeakPolarHBondContact O-CE 3.4Å; T281-K303 PolarHBondContact O-NZ 3.08Å; E282-K303 WeakPolarHBondContact O-CB 3.19Å; E282-K303 WeakPolarHBondContact O-CE 3.5Å; E282-K303 WeakPolarHBondContact O-CG 3.44Å; E282-K303 PolarHBondContact O-N 2.96Å; V284-K303 HydrophobicContact CG2-CD 3.57Å; V284-K303 HydrophobicContact CG2-CG 3.73Å; V301-K303 PolarHBondContact O-N 2.99Å; K303-Y305 PolarHBondContact O-N 3.27Å; K303-N306 PolarHBondContact O-N 3.12Å
304	P	78.8	Confident	84.9	Confident	44 Å²	44	32.4 Å²	32.4	29%	0.286	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-31.3	-176.3	-23.4	34.3	0	0	0	113	T69 E282	T69-P304 HydrophobicContact CG2-CB 3.61Å; T69-P304 WeakPolarHBondContact CG2-O 3.26Å; E282-P304 HydrophobicContact CB-CG 4.16Å; E282-P304 HydrophobicContact CG-CG 3.85Å
305	Y	76.5	Confident	85.1	Confident	23 Å²	23	35.6 Å²	35.6	9%	0.09	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106	-6.7	-179.3	-54.8	-70	0	0	0	113.1	P67 T69 M269 R276 W302 K303 V307	P67-Y305 HydrophobicContact CB-CD1 3.69Å; P67-Y305 HydrophobicContact CB-CE1 4.14Å; P67-Y305 HydrophobicContact CG-CD1 3.93Å; P67-Y305 HydrophobicContact CG-CE1 4.37Å; T69-Y305 HydrophobicContact CG2-CD1 4.35Å; T69-Y305 HydrophobicContact CG2-CE1 3.88Å; M269-Y305 HydrophobicContact CG-CE1 4.13Å; M269-Y305 HydrophobicContact SD-CD1 3.93Å; M269-Y305 HydrophobicContact SD-CE1 3.4Å; M269-Y305 WeakPolarHBondContact SD-CE1 3.47Å; R276-Y305 PolarHBondContact NH1-OH 2.66Å; R276-Y305 VanDerWaalsContact NH1-OH 3.15Å; W302-Y305 AromaticContact CD2-CD2 3.75Å; W302-Y305 HydrophobicContact CD2-CD2 3.75Å; W302-Y305 HydrophobicContact CD2-CE2 4.3Å; W302-Y305 AromaticContact CE2-CD2 3.79Å; W302-Y305 AromaticContact CE2-CE2 3.87Å; W302-Y305 AromaticContact CE3-CD2 3.83Å; W302-Y305 HydrophobicContact CE3-CD2 3.83Å; W302-Y305 HydrophobicContact CE3-CE2 4.42Å; W302-Y305 HydrophobicContact CG-CD2 4.38Å; W302-Y305 HydrophobicContact CH2-CD2 4.01Å; W302-Y305 AromaticContact CH2-CE2 3.76Å; W302-Y305 HydrophobicContact CH2-CE2 3.76Å; W302-Y305 AromaticContact CZ2-CD2 3.93Å; W302-Y305 HydrophobicContact CZ2-CD2 3.93Å; W302-Y305 AromaticContact CZ2-CE2 3.6Å; W302-Y305 HydrophobicContact CZ2-CE2 3.6Å; W302-Y305 AromaticContact CZ3-CD2 3.95Å; W302-Y305 HydrophobicContact CZ3-CD2 3.95Å; W302-Y305 HydrophobicContact CZ3-CE2 4.17Å; W302-Y305 PolarHBondContact O-N 2.82Å; K303-Y305 PolarHBondContact O-N 3.27Å; Y305-V307 WeakPolarHBondContact O-CG1 3.48Å; Y305-V307 PolarHBondContact O-N 3.17Å; Y305-V307 VanDerWaalsContact O-N 3.17Å
306	N	77.4	Confident	84.6	Confident	130 Å²	130	44 Å²	44	70%	0.695	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	27.7	-176.5	-166.1	46.3	0	0	0	115.1	W302 K303	W302-N306 PolarHBondContact O-N 3.42Å; K303-N306 PolarHBondContact O-N 3.12Å
307	V	78.5	Confident	83.3	Confident	35 Å²	35	49.7 Å²	49.7	21%	0.212	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	156.9	-178	-65.4	0	0	0	0	113.3	L267 V301 W302 Y305 V309	L267-V307 HydrophobicContact CD1-CB 3.99Å; L267-V307 HydrophobicContact CD1-CG1 4.07Å; L267-V307 HydrophobicContact CD1-CG2 3.86Å; L267-V307 HydrophobicContact CD2-CB 4.26Å; L267-V307 HydrophobicContact CD2-CG1 3.86Å; L267-V307 HydrophobicContact CD2-CG2 3.71Å; L267-V307 HydrophobicContact CG-CG1 4.2Å; L267-V307 HydrophobicContact CG-CG2 4.39Å; V301-V307 WeakPolarHBondContact CA-O 3.32Å; W302-V307 HydrophobicContact CB-CG2 4.13Å; W302-V307 HydrophobicContact CE3-CG2 4.37Å; W302-V307 PolarHBondContact N-O 3.16Å; Y305-V307 WeakPolarHBondContact O-CG1 3.48Å; Y305-V307 PolarHBondContact O-N 3.17Å; Y305-V307 VanDerWaalsContact O-N 3.17Å; V307-V309 HydrophobicContact CG2-CG1 3.99Å
308	L	86	Confident	81.6	Confident	70 Å²	70	52.4 Å²	52.4	37%	0.366	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	131.6	168.5	-57.5	-175.1	0	0	0	110.6	E299 A300 V301 F358	E299-L308 WeakPolarHBondContact OE1-CD2 3.47Å; A300-L308 WeakPolarHBondContact O-CA 3.48Å; V301-L308 HydrophobicContact CG2-CD2 3.94Å; L308-F358 HydrophobicContact CB-CB 3.9Å; L308-F358 HydrophobicContact CB-CD1 3.71Å; L308-F358 HydrophobicContact CB-CG 4.05Å; L308-F358 HydrophobicContact CD1-CD1 3.72Å; L308-F358 HydrophobicContact CD1-CE1 3.88Å; L308-F358 HydrophobicContact CG-CD1 4.37Å; L308-F358 WeakPolarHBondContact O-CB 3.38Å
309	V	91.7	Very high	79.9	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	151.7	176.7	-60	0	0	0	0	110.2	I283 A300 W302 V307 V311 L343 V355 T356	I283-V309 HydrophobicContact CD1-CG2 4.28Å; A300-V309 HydrophobicContact CB-CG2 3.96Å; A300-V309 PolarHBondContact N-O 3.14Å; A300-V309 PolarHBondContact O-N 3.43Å; W302-V309 HydrophobicContact CB-CG1 3.95Å; W302-V309 HydrophobicContact CB-CG2 4.23Å; W302-V309 HydrophobicContact CE3-CG1 4.35Å; V307-V309 HydrophobicContact CG2-CG1 3.99Å; V309-V311 HydrophobicContact CG2-CG2 3.98Å; V309-L343 HydrophobicContact CB-CD1 4.48Å; V309-L343 HydrophobicContact CG1-CD1 3.65Å; V309-V355 HydrophobicContact CB-CG1 3.75Å; V309-V355 HydrophobicContact CG1-CG1 4.12Å; V309-V355 HydrophobicContact CG2-CG1 3.76Å; V309-T356 WeakPolarHBondContact CA-O 3.45Å; V309-T356 WeakPolarHBondContact CB-O 3.49Å
310	A	93.3	Very high	78.8	Confident	12 Å²	12	55.8 Å²	55.8	10%	0.099	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	131.1	169.6	0	0	0	0	0	109.5	L289 V297 Y298 T356	L289-A310 HydrophobicContact CD1-CB 4.44Å; V297-A310 HydrophobicContact CG1-CB 4.45Å; Y298-A310 WeakPolarHBondContact O-CA 3.32Å; A310-T356 PolarHBondContact N-O 3.28Å; A310-T356 PolarHBondContact O-N 2.84Å
311	V	92.3	Very high	77.9	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	110.5	-175.2	-175	0	0	0	0	110.1	I283 M285 V297 Y298 A300 V309 T313 Y353 I354 V355	I283-V311 HydrophobicContact CG2-CG2 3.93Å; M285-V311 HydrophobicContact CE-CB 4.09Å; M285-V311 HydrophobicContact CE-CG1 3.88Å; M285-V311 HydrophobicContact SD-CB 3.91Å; M285-V311 HydrophobicContact SD-CG1 3.82Å; M285-V311 HydrophobicContact SD-CG2 4.08Å; V297-V311 WeakPolarHBondContact CA-O 3.41Å; Y298-V311 PolarHBondContact N-O 2.79Å; Y298-V311 PolarHBondContact O-N 3.25Å; A300-V311 HydrophobicContact CB-CG2 3.54Å; V309-V311 HydrophobicContact CG2-CG2 3.98Å; V311-T313 HydrophobicContact CG1-CG2 4.12Å; V311-Y353 HydrophobicContact CG1-CD1 4.14Å; V311-Y353 HydrophobicContact CG1-CD2 3.7Å; V311-Y353 HydrophobicContact CG1-CE2 4.25Å; V311-Y353 HydrophobicContact CG1-CG 3.63Å; V311-I354 WeakPolarHBondContact CA-O 3.35Å; V311-V355 HydrophobicContact CG2-CG2 4.46Å
312	K	90.3	Very high	77.2	Confident	22 Å²	22	64.2 Å²	64.2	10%	0.096	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	116.7	175.3	-171.4	-177.8	-163.9	-177.8	0	108.4	V297 F324 E327 Y353 I354 D422	V297-K312 HydrophobicContact CG2-CB 4.29Å; V297-K312 HydrophobicContact CG2-CG 4.12Å; K312-F324 HydrophobicContact CG-CE2 4.31Å; K312-F324 WeakPolarHBondContact O-CZ 3.42Å; K312-E327 IonicContact NZ-OE1 3.22Å; K312-E327 PolarHBondContact NZ-OE1 2.8Å; K312-E327 IonicContact NZ-OE2 3.21Å; K312-E327 PolarHBondContact NZ-OE2 2.93Å; K312-Y353 WeakPolarHBondContact O-CA 3.35Å; K312-I354 HydrophobicContact CB-CB 4.29Å; K312-I354 PolarHBondContact N-O 3.42Å; K312-I354 PolarHBondContact O-N 3.44Å; K312-D422 IonicContact NZ-OD1 3.79Å; K312-D422 PolarHBondContact NZ-OD1 3.39Å
313	T	88	Confident	76.4	Confident	18 Å²	18	68 Å²	68	11%	0.11	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	135.3	-176.2	70.6	0	0	0	0	111.9	M285 G295 V296 Y298 V311 Y353	M285-T313 HydrophobicContact CE-CG2 3.64Å; G295-T313 WeakPolarHBondContact CA-O 3.34Å; V296-T313 PolarHBondContact N-O 3.03Å; V296-T313 PolarHBondContact O-N 3.21Å; V296-T313 PolarHBondContact O-OG1 2.81Å; Y298-T313 HydrophobicContact CD2-CG2 3.93Å; Y298-T313 HydrophobicContact CE2-CG2 3.94Å; V311-T313 HydrophobicContact CG1-CG2 4.12Å; T313-Y353 HydrophobicContact CG2-CD1 3.61Å; T313-Y353 HydrophobicContact CG2-CE1 3.54Å
314	L	79	Confident	75.9	Confident	14 Å²	14	62.6 Å²	62.6	7%	0.073	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	135.5	174.1	-175.1	66.5	0	0	0	111.1	V320 R321 F324 Y352	L314-V320 HydrophobicContact CD1-CB 4.22Å; L314-V320 HydrophobicContact CD1-CG1 4.46Å; L314-R321 HydrophobicContact CD2-CB 4.04Å; L314-R321 HydrophobicContact CD2-CG 4.49Å; L314-F324 HydrophobicContact CB-CD1 4.3Å; L314-F324 HydrophobicContact CB-CD2 4.05Å; L314-F324 HydrophobicContact CB-CE1 4.27Å; L314-F324 HydrophobicContact CB-CE2 3.99Å; L314-F324 HydrophobicContact CB-CG 4.19Å; L314-F324 HydrophobicContact CB-CZ 4.1Å; L314-F324 HydrophobicContact CD1-CB 3.96Å; L314-F324 HydrophobicContact CD1-CD2 3.97Å; L314-F324 HydrophobicContact CD1-CG 4.04Å; L314-F324 HydrophobicContact CG-CG 4.49Å; L314-Y352 HydrophobicContact CD2-CD2 3.81Å; L314-Y352 PolarHBondContact N-O 3.13Å
315	K	68.8	Low	75.9	Confident	82 Å²	82	63.1 Å²	63.1	36%	0.357	33%	0.327	S	S	.	.			trans	-75.5	137.5	172.7	-66.1	160.8	-170.4	152.1	0	110.6	G292 Q293 G295 N317	G292-K315 PolarHBondContact O-NZ 3.33Å; Q293-K315 PolarHBondContact O-NZ 2.99Å; G295-K315 VanDerWaalsContact C-CE 3.45Å; G295-K315 WeakPolarHBondContact O-CE 3.46Å; G295-K315 PolarHBondContact O-NZ 2.95Å; G295-K315 VanDerWaalsContact O-NZ 3.14Å; K315-N317 PolarHBondContact O-N 2.85Å
316	E	65.2	Low	75.9	Confident	178 Å²	178	64.4 Å²	64.4	83%	0.832	33%	0.334	S	S	*	.	S	Bend	trans	-61.4	-5.2	-171	-59.8	173.8	155.1	0	0	116.5	V318	E316-V318 WeakPolarHBondContact O-CG2 3.43Å; E316-V318 PolarHBondContact O-N 3.33Å
317	N	58.6	Low	75.8	Confident	144 Å²	144	58.5 Å²	58.5	77%	0.77	30%	0.302	S	S	*	.	S	Bend	trans	-82.8	81.8	175.5	-70.5	-57.4	0	0	0	110.2	K315 T319	K315-N317 PolarHBondContact O-N 2.85Å; N317-T319 PolarHBondContact O-N 3.13Å
318	V	53.8	Low	75.9	Confident	98 Å²	98	57 Å²	57	59%	0.594	29%	0.294	S	S	*	.			trans	-71	86.1	-168.5	-170.6	0	0	0	0	113.5	E316 R321	E316-V318 WeakPolarHBondContact O-CG2 3.43Å; E316-V318 PolarHBondContact O-N 3.33Å; V318-R321 HydrophobicContact CG1-CB 3.93Å
319	T	56.9	Low	75.6	Confident	129 Å²	129	60.1 Å²	60.1	79%	0.791	30%	0.3	S	S	*	.	S	Bend	trans	-126.1	6.3	151	67.9	0	0	0	0	112.4	N317	N317-T319 PolarHBondContact O-N 3.13Å
320	V	67.9	Low	74.9	Confident	35 Å²	35	60.3 Å²	60.3	21%	0.212	30%	0.302	C	S	.	.	S	Bend	trans	-124.4	3.2	-167.6	-165.3	0	0	0	0	111.5	Y294 L314 D322 E323 F324	Y294-V320 HydrophobicContact CD1-CG1 3.9Å; L314-V320 HydrophobicContact CD1-CB 4.22Å; L314-V320 HydrophobicContact CD1-CG1 4.46Å; V320-D322 VanDerWaalsContact C-N 3.32Å; V320-D322 PolarHBondContact O-N 3.18Å; V320-E323 HydrophobicContact CG1-CB 4.21Å; V320-E323 PolarHBondContact O-N 3.48Å; V320-F324 WeakPolarHBondContact O-CB 3.42Å; V320-F324 PolarHBondContact O-N 2.91Å
321	R	72.8	Confident	74.3	Confident	100 Å²	100	60.2 Å²	60.2	38%	0.377	30%	0.299	S	S	.	.	H	α-helix	trans	-57	-46.7	178.2	-179.5	-163.8	69.8	169.2	1.4	111.2	L314 V318 E323 F324 L325 Y352	L314-R321 HydrophobicContact CD2-CB 4.04Å; L314-R321 HydrophobicContact CD2-CG 4.49Å; V318-R321 HydrophobicContact CG1-CB 3.93Å; R321-E323 VanDerWaalsContact C-N 3.32Å; R321-E323 PolarHBondContact O-N 3.26Å; R321-F324 WeakPolarHBondContact O-CB 3.37Å; R321-F324 PolarHBondContact O-N 3.3Å; R321-F324 VanDerWaalsContact O-N 3.14Å; R321-L325 HydrophobicContact CG-CD1 3.77Å; R321-L325 HydrophobicContact CG-CG 4.15Å; R321-L325 WeakPolarHBondContact O-CG 3.27Å; R321-L325 PolarHBondContact O-N 2.84Å; R321-Y352 HydrophobicContact CG-CD2 4.11Å; R321-Y352 HydrophobicContact CG-CE2 3.71Å
322	D	73	Confident	73.7	Confident	99 Å²	99	64.4 Å²	64.4	53%	0.529	32%	0.317	S	S	.	.	H	α-helix	trans	-73.2	-29.7	-171.7	-49.2	-33.4	0	0	0	111	V320 E326	V320-D322 VanDerWaalsContact C-N 3.32Å; V320-D322 PolarHBondContact O-N 3.18Å; D322-E326 WeakPolarHBondContact O-CB 3.5Å; D322-E326 PolarHBondContact O-N 3.05Å
323	E	71	Confident	73	Confident	82 Å²	82	66.7 Å²	66.7	38%	0.383	34%	0.336	S	S	.	.	H	α-helix	trans	-68.5	-37.8	168.6	-62.3	-170.8	150.3	0	0	112.3	V320 R321 E327	V320-E323 HydrophobicContact CG1-CB 4.21Å; V320-E323 PolarHBondContact O-N 3.48Å; R321-E323 VanDerWaalsContact C-N 3.32Å; R321-E323 PolarHBondContact O-N 3.26Å; E323-E327 PolarHBondContact O-N 2.99Å
324	F	74.8	Confident	72.8	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-72.4	-40.1	179.1	-179.6	-86.8	0	0	0	112.7	K312 L314 V320 R321 E327 A328 Y352 I354	K312-F324 HydrophobicContact CG-CE2 4.31Å; K312-F324 WeakPolarHBondContact O-CZ 3.42Å; L314-F324 HydrophobicContact CB-CD1 4.3Å; L314-F324 HydrophobicContact CB-CD2 4.05Å; L314-F324 HydrophobicContact CB-CE1 4.27Å; L314-F324 HydrophobicContact CB-CE2 3.99Å; L314-F324 HydrophobicContact CB-CG 4.19Å; L314-F324 HydrophobicContact CB-CZ 4.1Å; L314-F324 HydrophobicContact CD1-CB 3.96Å; L314-F324 HydrophobicContact CD1-CD2 3.97Å; L314-F324 HydrophobicContact CD1-CG 4.04Å; L314-F324 HydrophobicContact CG-CG 4.49Å; V320-F324 WeakPolarHBondContact O-CB 3.42Å; V320-F324 PolarHBondContact O-N 2.91Å; R321-F324 WeakPolarHBondContact O-CB 3.37Å; R321-F324 PolarHBondContact O-N 3.3Å; R321-F324 VanDerWaalsContact O-N 3.14Å; F324-E327 WeakPolarHBondContact O-CB 3.26Å; F324-E327 PolarHBondContact O-N 2.85Å; F324-A328 PolarHBondContact O-N 3.06Å; F324-A328 VanDerWaalsContact O-N 3.16Å; F324-Y352 WeakPolarHBondContact CZ-O 3.28Å; F324-I354 HydrophobicContact CD1-CD1 4.25Å; F324-I354 HydrophobicContact CD1-CG1 4.46Å; F324-I354 HydrophobicContact CD2-CD1 4.13Å; F324-I354 HydrophobicContact CE1-CD1 4.03Å; F324-I354 HydrophobicContact CE1-CG1 3.81Å; F324-I354 HydrophobicContact CE2-CD1 3.92Å; F324-I354 HydrophobicContact CE2-CG1 4.22Å; F324-I354 HydrophobicContact CG-CD1 4.3Å; F324-I354 HydrophobicContact CZ-CB 4.33Å; F324-I354 HydrophobicContact CZ-CD1 3.87Å; F324-I354 HydrophobicContact CZ-CG1 3.69Å
325	L	78.7	Confident	73	Confident	54 Å²	54	73 Å²	73	28%	0.283	36%	0.358	S	S	.	.	H	α-helix	trans	-70.3	-34.3	173.1	-66.2	177.5	0	0	0	111.5	R321 A328 R329 T347	R321-L325 HydrophobicContact CG-CD1 3.77Å; R321-L325 HydrophobicContact CG-CG 4.15Å; R321-L325 WeakPolarHBondContact O-CG 3.27Å; R321-L325 PolarHBondContact O-N 2.84Å; L325-A328 PolarHBondContact O-N 3.47Å; L325-R329 WeakPolarHBondContact O-CB 3.5Å; L325-R329 PolarHBondContact O-N 3.05Å; L325-T347 HydrophobicContact CD2-CG2 3.71Å
326	E	75.4	Confident	74	Confident	50 Å²	50	70.9 Å²	70.9	23%	0.234	35%	0.349	C	S	.	.	H	α-helix	trans	-64.9	-39.3	171.1	178.5	63	-177.6	0	0	111.8	D322 A328 R329 L330	D322-E326 WeakPolarHBondContact O-CB 3.5Å; D322-E326 PolarHBondContact O-N 3.05Å; E326-A328 PolarHBondContact O-N 2.87Å; E326-R329 VanDerWaalsContact CD-NH2 3.33Å; E326-R329 PolarHBondContact O-N 2.98Å; E326-R329 IonicContact OE1-CZ 2.85Å; E326-R329 IonicContact OE1-NE 3.39Å; E326-R329 IonicContact OE1-NH2 3.94Å; E326-R329 PolarHBondContact OE1-NH2 2.84Å; E326-R329 IonicContact OE2-CZ 2.7Å; E326-R329 IonicContact OE2-NE 3.71Å; E326-R329 PolarHBondContact OE2-NE 3.5Å; E326-R329 IonicContact OE2-NH2 3.15Å; E326-R329 PolarHBondContact OE2-NH2 3.37Å; E326-R329 VanDerWaalsContact OE2-NH2 3.14Å; E326-L330 HydrophobicContact CG-CD1 3.9Å; E326-L330 HydrophobicContact CG-CG 4.25Å; E326-L330 WeakPolarHBondContact O-CB 3.36Å; E326-L330 WeakPolarHBondContact O-CG 3.34Å; E326-L330 PolarHBondContact O-N 3.38Å
327	E	76.4	Confident	75.1	Confident	7 Å²	7	65.7 Å²	65.7	3%	0.033	33%	0.331	C	S	.	.	H	α-helix	trans	-57.4	-48.7	171.8	-175.7	-179.2	168.1	0	0	111.2	K312 E323 F324 R329 L330 M331 I354 F423 G424	K312-E327 IonicContact NZ-OE1 3.22Å; K312-E327 PolarHBondContact NZ-OE1 2.8Å; K312-E327 IonicContact NZ-OE2 3.21Å; K312-E327 PolarHBondContact NZ-OE2 2.93Å; E323-E327 PolarHBondContact O-N 2.99Å; F324-E327 WeakPolarHBondContact O-CB 3.26Å; F324-E327 PolarHBondContact O-N 2.85Å; E327-R329 PolarHBondContact O-N 3.13Å; E327-L330 PolarHBondContact O-N 2.93Å; E327-M331 HydrophobicContact CG-SD 4.36Å; E327-M331 WeakPolarHBondContact O-CG 3.22Å; E327-M331 PolarHBondContact O-N 2.95Å; E327-I354 HydrophobicContact CB-CD1 4.32Å; E327-I354 HydrophobicContact CG-CD1 4.29Å; E327-F423 HydrophobicContact CG-CB 4.44Å; E327-G424 VanDerWaalsContact CD-CA 3.48Å; E327-G424 VanDerWaalsContact CD-N 3.34Å; E327-G424 PolarHBondContact OE1-N 3.31Å; E327-G424 VanDerWaalsContact OE2-CA 3.27Å; E327-G424 WeakPolarHBondContact OE2-CA 3.49Å
328	A	79.8	Confident	76.9	Confident	3 Å²	3	59.4 Å²	59.4	3%	0.025	30%	0.297	C	S	.	.	H	α-helix	trans	-60.4	-42.4	176.2	0	0	0	0	0	112.5	F324 L325 E326 M331 K332 I354	F324-A328 PolarHBondContact O-N 3.06Å; F324-A328 VanDerWaalsContact O-N 3.16Å; L325-A328 PolarHBondContact O-N 3.47Å; E326-A328 PolarHBondContact O-N 2.87Å; A328-M331 PolarHBondContact O-N 2.81Å; A328-K332 PolarHBondContact O-N 3.06Å; A328-K332 VanDerWaalsContact O-N 3.14Å; A328-I354 HydrophobicContact CB-CD1 4.05Å; A328-I354 HydrophobicContact CB-CG1 4Å
329	R	79.4	Confident	78.8	Confident	135 Å²	135	54.9 Å²	54.9	51%	0.509	27%	0.269	S	S	.	.	H	α-helix	trans	-65	-40.4	178	-167	-167.9	69.5	83.9	2	112.2	L325 E326 E327 K332	L325-R329 WeakPolarHBondContact O-CB 3.5Å; L325-R329 PolarHBondContact O-N 3.05Å; E326-R329 VanDerWaalsContact CD-NH2 3.33Å; E326-R329 PolarHBondContact O-N 2.98Å; E326-R329 IonicContact OE1-CZ 2.85Å; E326-R329 IonicContact OE1-NE 3.39Å; E326-R329 IonicContact OE1-NH2 3.94Å; E326-R329 PolarHBondContact OE1-NH2 2.84Å; E326-R329 IonicContact OE2-CZ 2.7Å; E326-R329 IonicContact OE2-NE 3.71Å; E326-R329 PolarHBondContact OE2-NE 3.5Å; E326-R329 IonicContact OE2-NH2 3.15Å; E326-R329 PolarHBondContact OE2-NH2 3.37Å; E326-R329 VanDerWaalsContact OE2-NH2 3.14Å; E327-R329 PolarHBondContact O-N 3.13Å; R329-K332 WeakPolarHBondContact O-CB 3.48Å
330	L	77.6	Confident	80.4	Confident	5 Å²	5	49.2 Å²	49.2	3%	0.026	23%	0.234	C	C	.	.	H	α-helix	trans	-68.1	-40.6	177	-72.9	172.4	0	0	0	111.5	E326 E327 K332 S333 L334 F400 A426 C428	E326-L330 HydrophobicContact CG-CD1 3.9Å; E326-L330 HydrophobicContact CG-CG 4.25Å; E326-L330 WeakPolarHBondContact O-CB 3.36Å; E326-L330 WeakPolarHBondContact O-CG 3.34Å; E326-L330 PolarHBondContact O-N 3.38Å; E327-L330 PolarHBondContact O-N 2.93Å; L330-K332 VanDerWaalsContact C-N 3.33Å; L330-K332 PolarHBondContact O-N 2.88Å; L330-S333 PolarHBondContact O-OG 3.36Å; L330-L334 WeakPolarHBondContact O-CG 3.48Å; L330-F400 HydrophobicContact CB-CE1 4.09Å; L330-F400 HydrophobicContact CD2-CE1 3.69Å; L330-F400 HydrophobicContact CD2-CZ 4.15Å; L330-F400 HydrophobicContact CG-CE1 4.41Å; L330-A426 HydrophobicContact CD1-CB 4.48Å; L330-C428 HydrophobicContact CD2-CB 3.96Å
331	M	80.2	Confident	81.4	Confident	9 Å²	9	49.7 Å²	49.7	4%	0.044	24%	0.238	C	C	.	.	H	α-helix	trans	-66.7	-30.9	177	-69.8	-175.3	70.8	0	0	113.3	E327 A328 S333 L334 V340 L342 T356 F423	E327-M331 HydrophobicContact CG-SD 4.36Å; E327-M331 WeakPolarHBondContact O-CG 3.22Å; E327-M331 PolarHBondContact O-N 2.95Å; A328-M331 PolarHBondContact O-N 2.81Å; M331-S333 PolarHBondContact O-N 2.96Å; M331-S333 VanDerWaalsContact O-N 3.15Å; M331-L334 PolarHBondContact O-N 3.27Å; M331-V340 VanDerWaalsContact CE-O 3.27Å; M331-V340 WeakPolarHBondContact CE-O 3.49Å; M331-L342 HydrophobicContact CB-CB 4.02Å; M331-L342 HydrophobicContact CB-CD2 4.23Å; M331-L342 HydrophobicContact CE-CB 4.32Å; M331-T356 HydrophobicContact CE-CG2 3.73Å; M331-F423 HydrophobicContact CE-CD2 3.81Å; M331-F423 HydrophobicContact CE-CE2 3.99Å; M331-F423 HydrophobicContact CG-CB 4.22Å; M331-F423 HydrophobicContact CG-CD2 3.66Å; M331-F423 HydrophobicContact CG-CE2 4.43Å; M331-F423 HydrophobicContact CG-CG 4.25Å; M331-F423 HydrophobicContact SD-CD2 3.8Å
332	K	80.1	Confident	82.2	Confident	89 Å²	89	46.2 Å²	46.2	39%	0.387	23%	0.226	S	C	.	.	H	α-helix	trans	-49.9	-40.7	179.6	-173.4	-162	-175.6	-174.6	0	113.6	D274 I275 A328 R329 L330 L342	D274-K332 WeakPolarHBondContact OD1-CE 3.38Å; D274-K332 IonicContact OD1-NZ 3.66Å; D274-K332 PolarHBondContact OD1-NZ 2.88Å; I275-K332 HydrophobicContact CD1-CB 4.19Å; I275-K332 HydrophobicContact CD1-CD 4.14Å; I275-K332 HydrophobicContact CD1-CG 4.31Å; I275-K332 HydrophobicContact CG1-CB 3.94Å; I275-K332 HydrophobicContact CG1-CD 3.63Å; I275-K332 HydrophobicContact CG1-CG 3.61Å; A328-K332 PolarHBondContact O-N 3.06Å; A328-K332 VanDerWaalsContact O-N 3.14Å; R329-K332 WeakPolarHBondContact O-CB 3.48Å; L330-K332 VanDerWaalsContact C-N 3.33Å; L330-K332 PolarHBondContact O-N 2.88Å; K332-L342 HydrophobicContact CB-CD2 4.38Å
333	S	76.4	Confident	82.8	Confident	70 Å²	70	42.7 Å²	42.7	49%	0.49	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-5.5	-177.2	46.8	0	0	0	0	114.6	L330 M331	L330-S333 PolarHBondContact O-OG 3.36Å; M331-S333 PolarHBondContact O-N 2.96Å; M331-S333 VanDerWaalsContact O-N 3.15Å
334	L	82.3	Confident	83.6	Confident	9 Å²	9	38.9 Å²	38.9	5%	0.047	19%	0.19	C	C	.	.			trans	-99.5	107.3	-174.5	-62.9	174.6	0	0	0	110.3	L330 M331 L339 Y394 L395 F400	L330-L334 WeakPolarHBondContact O-CG 3.48Å; M331-L334 PolarHBondContact O-N 3.27Å; L334-L339 HydrophobicContact CB-CD1 4.35Å; L334-Y394 HydrophobicContact CB-CE1 4.43Å; L334-Y394 HydrophobicContact CD2-CE1 3.83Å; L334-L395 HydrophobicContact CD1-CD2 3.94Å; L334-L395 HydrophobicContact CD2-CD2 3.89Å; L334-F400 HydrophobicContact CD1-CD1 4.07Å; L334-F400 HydrophobicContact CD1-CE1 3.88Å; L334-F400 HydrophobicContact CD1-CZ 4.39Å; L334-F400 HydrophobicContact CD2-CD1 4.34Å; L334-F400 HydrophobicContact CD2-CD2 4.02Å; L334-F400 HydrophobicContact CD2-CE1 4.13Å; L334-F400 HydrophobicContact CD2-CE2 3.84Å; L334-F400 HydrophobicContact CD2-CG 4.28Å; L334-F400 HydrophobicContact CD2-CZ 3.9Å; L334-F400 HydrophobicContact CG-CE1 4.22Å; L334-F400 HydrophobicContact CG-CZ 4.22Å
335	R	84	Confident	84.4	Confident	155 Å²	155	38.9 Å²	38.9	59%	0.585	19%	0.19	S	C	*	.			trans	-126	98.8	178.6	-67.3	-173.9	177.9	-167.6	0.5	110	Y394	R335-Y394 PolarHBondContact N-OH 2.94Å; R335-Y394 WeakPolarHBondContact O-CE2 3.48Å; R335-Y394 PolarHBondContact O-OH 3.28Å
336	H	89.3	Confident	84.9	Confident	38 Å²	38	36.4 Å²	36.4	18%	0.176	18%	0.177	C	C	.	.			trans	-151.6	137.9	179.6	-178.4	-93.8	0	0	0	110.9	N338 L339 R390 Y394	H336-N338 PolarHBondContact ND1-N 2.86Å; H336-N338 VanDerWaalsContact ND1-N 3.12Å; H336-N338 PolarHBondContact O-N 3.24Å; H336-N338 VanDerWaalsContact O-N 3.08Å; H336-L339 HydrophobicContact CB-CB 4.31Å; H336-L339 HydrophobicContact CB-CD1 4Å; H336-L339 HydrophobicContact CB-CG 3.97Å; H336-L339 PolarHBondContact O-N 2.87Å; H336-R390 VanDerWaalsContact CE1-C 3.5Å; H336-Y394 HydrophobicContact CB-CD1 3.78Å; H336-Y394 HydrophobicContact CB-CD2 3.87Å; H336-Y394 HydrophobicContact CB-CE1 3.99Å; H336-Y394 HydrophobicContact CB-CE2 4.08Å; H336-Y394 HydrophobicContact CB-CG 3.71Å; H336-Y394 AromaticContact CD2-CD2 3.67Å; H336-Y394 AromaticContact CD2-CG 3.77Å; H336-Y394 AromaticContact CG-CD2 4Å; H336-Y394 AromaticContact CG-CG 3.78Å
337	P	89.5	Confident	85.5	Confident	69 Å²	69	36.6 Å²	36.6	45%	0.448	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-25.2	-174.7	22	-35.3	0	0	0	115	K419	P337-K419 WeakPolarHBondContact O-CE 3.19Å; P337-K419 WeakPolarHBondContact O-CG 3.47Å
338	N	95.4	Very high	85.9	Confident	12 Å²	12	45.3 Å²	45.3	6%	0.064	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	21.4	176.3	-55.4	111.8	0	0	0	114.3	H336 Q387 I418 K419 V420	H336-N338 PolarHBondContact ND1-N 2.86Å; H336-N338 VanDerWaalsContact ND1-N 3.12Å; H336-N338 PolarHBondContact O-N 3.24Å; H336-N338 VanDerWaalsContact O-N 3.08Å; N338-Q387 WeakPolarHBondContact CB-O 3.27Å; N338-Q387 WeakPolarHBondContact ND2-CB 3.42Å; N338-Q387 WeakPolarHBondContact ND2-CG 3.3Å; N338-Q387 PolarHBondContact ND2-OE1 2.94Å; N338-Q387 VanDerWaalsContact ND2-OE1 3.13Å; N338-I418 WeakPolarHBondContact CA-O 3.45Å; N338-I418 WeakPolarHBondContact CB-O 3.42Å; N338-I418 PolarHBondContact ND2-O 3.15Å; N338-K419 WeakPolarHBondContact O-CA 3.27Å; N338-V420 PolarHBondContact O-N 3.16Å
339	L	93.4	Very high	86.2	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.01	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-120.5	145.6	167.4	-62.7	-175.7	0	0	0	109.3	L334 H336 T341 Y394 L395 V420 F423	L334-L339 HydrophobicContact CB-CD1 4.35Å; H336-L339 HydrophobicContact CB-CB 4.31Å; H336-L339 HydrophobicContact CB-CD1 4Å; H336-L339 HydrophobicContact CB-CG 3.97Å; H336-L339 PolarHBondContact O-N 2.87Å; L339-T341 PolarHBondContact O-N 3.14Å; L339-Y394 HydrophobicContact CD1-CD1 3.57Å; L339-Y394 HydrophobicContact CD1-CE1 3.91Å; L339-L395 HydrophobicContact CD1-CD2 3.76Å; L339-L395 HydrophobicContact CD1-CG 4.02Å; L339-L395 HydrophobicContact CD2-CD1 4.04Å; L339-L395 HydrophobicContact CD2-CG 4.16Å; L339-V420 HydrophobicContact CD2-CB 3.84Å; L339-V420 HydrophobicContact CD2-CG2 4.29Å; L339-F423 HydrophobicContact CB-CZ 4.15Å; L339-F423 HydrophobicContact CD2-CE1 4.28Å; L339-F423 HydrophobicContact CD2-CZ 4.05Å; L339-F423 HydrophobicContact CG-CZ 4.48Å
340	V	92.1	Very high	86.4	Confident	10 Å²	10	48.1 Å²	48.1	6%	0.061	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-70.1	120.7	177.9	171.1	0	0	0	0	110.6	M331 T356 E357 M359 L411 K419 V420 A421	M331-V340 VanDerWaalsContact CE-O 3.27Å; M331-V340 WeakPolarHBondContact CE-O 3.49Å; V340-T356 HydrophobicContact CG1-CG2 3.98Å; V340-E357 HydrophobicContact CG1-CG 4.13Å; V340-M359 HydrophobicContact CG2-CG 4.47Å; V340-L411 HydrophobicContact CG2-CD1 4.08Å; V340-K419 HydrophobicContact CG2-CB 3.71Å; V340-V420 PolarHBondContact N-O 3.22Å; V340-A421 HydrophobicContact CB-CB 4.31Å; V340-A421 HydrophobicContact CG2-CB 3.68Å
341	T	88.5	Confident	86.8	Confident	45 Å²	45	50.4 Å²	50.4	28%	0.276	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-79.1	133.4	-173.4	-43	0	0	0	0	111.8	L339 T356 E357	L339-T341 PolarHBondContact O-N 3.14Å; T341-T356 VanDerWaalsContact O-CA 3.29Å; T341-T356 WeakPolarHBondContact O-CA 3.43Å; T341-T356 VanDerWaalsContact O-CB 3.25Å; T341-T356 WeakPolarHBondContact O-CB 3.15Å; T341-E357 VanDerWaalsContact CB-OE1 3.24Å; T341-E357 WeakPolarHBondContact CB-OE1 3.37Å; T341-E357 PolarHBondContact N-OE1 3.5Å; T341-E357 PolarHBondContact O-N 2.85Å; T341-E357 PolarHBondContact OG1-OE1 2.97Å
342	L	88.6	Confident	87.2	Confident	27 Å²	27	51.7 Å²	51.7	14%	0.141	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	121.8	165.9	-176.7	70.6	0	0	0	109.5	I275 M331 K332 G344 I354	I275-L342 HydrophobicContact CG1-CD2 4.49Å; I275-L342 HydrophobicContact CG2-CD2 4.33Å; M331-L342 HydrophobicContact CB-CB 4.02Å; M331-L342 HydrophobicContact CB-CD2 4.23Å; M331-L342 HydrophobicContact CE-CB 4.32Å; K332-L342 HydrophobicContact CB-CD2 4.38Å; L342-G344 WeakPolarHBondContact CD1-O 3.35Å; L342-I354 HydrophobicContact CD1-CG2 3.69Å
343	L	87	Confident	87.7	Confident	26 Å²	26	48.6 Å²	48.6	14%	0.136	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-27.6	173.5	-59.1	179.9	0	0	0	111.8	L267 W302 V309 V355	L267-L343 HydrophobicContact CB-CD2 4.12Å; L267-L343 HydrophobicContact CD1-CD1 4.18Å; W302-L343 HydrophobicContact CZ3-CB 4.15Å; V309-L343 HydrophobicContact CB-CD1 4.48Å; V309-L343 HydrophobicContact CG1-CD1 3.65Å; L343-V355 HydrophobicContact CB-CG1 4.48Å; L343-V355 PolarHBondContact N-O 2.77Å
344	G	87.8	Confident	88.3	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.6	-169.9	176	0	0	0	0	0	112	R276 L342 V355	R276-G344 CarbonylContact O-C 3.57Å; R276-G344 VanDerWaalsContact O-CA 3.25Å; R276-G344 WeakPolarHBondContact O-CA 3.37Å; L342-G344 WeakPolarHBondContact CD1-O 3.35Å; G344-V355 PolarHBondContact N-O 3.28Å; G344-V355 PolarHBondContact O-N 3.32Å
345	A	89.7	Confident	88.7	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	165.6	178.3	0	0	0	0	0	111.1	I275 R276 E277 I278 T347 Y353	I275-A345 HydrophobicContact CG2-CB 3.86Å; R276-A345 PolarHBondContact O-N 2.91Å; E277-A345 CarbonylContact C-O 3.49Å; E277-A345 WeakPolarHBondContact CA-O 3.33Å; I278-A345 PolarHBondContact N-O 3.24Å; A345-T347 HydrophobicContact CB-CG2 3.7Å; A345-Y353 CarbonylContact C-O 3.53Å; A345-Y353 VanDerWaalsContact CA-O 3.29Å; A345-Y353 WeakPolarHBondContact CA-O 3.5Å; A345-Y353 WeakPolarHBondContact CB-O 2.94Å
346	C	90.4	Very high	89	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.014	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	102.6	165.6	-50.2	0	0	0	0	106.9	I278 Y352 Y353	I278-C346 PolarHBondContact O-SG 3.17Å; C346-Y352 VanDerWaalsContact O-CA 3.26Å; C346-Y352 WeakPolarHBondContact O-CA 3.42Å; C346-Y353 HydrophobicContact CB-CD2 4.38Å; C346-Y353 HydrophobicContact CB-CG 4.31Å; C346-Y353 PolarHBondContact N-O 3.46Å; C346-Y353 PolarHBondContact O-N 2.77Å
347	T	87.1	Confident	89	Confident	54 Å²	54	38.2 Å²	38.2	33%	0.331	20%	0.197	S	C	.	.			trans	-122.1	-15.9	-171.4	69.8	0	0	0	0	114	E277 L325 A345 E349 Y352	E277-T347 PolarHBondContact OE1-N 2.86Å; E277-T347 WeakPolarHBondContact OE2-CB 3.29Å; E277-T347 PolarHBondContact OE2-N 3.44Å; E277-T347 PolarHBondContact OE2-OG1 3.06Å; L325-T347 HydrophobicContact CD2-CG2 3.71Å; A345-T347 HydrophobicContact CB-CG2 3.7Å; T347-E349 VanDerWaalsContact C-N 3.29Å; T347-E349 PolarHBondContact O-N 2.85Å; T347-Y352 WeakPolarHBondContact O-CE1 3.39Å
348	R	85.9	Confident	89	Confident	190 Å²	190	37.3 Å²	37.3	72%	0.717	19%	0.186	S	C	*	.	S	Bend	trans	-55.8	-39	177.9	-78.6	167.5	-176.1	166	11.8	113.6	E277	E277-R348 HydrophobicContact CG-CG 3.72Å; E277-R348 VanDerWaalsContact CG-NE 3.26Å; E277-R348 WeakPolarHBondContact OE1-CB 3.49Å; E277-R348 VanDerWaalsContact OE1-CG 3.27Å; E277-R348 WeakPolarHBondContact OE1-CG 3.36Å; E277-R348 PolarHBondContact OE1-N 2.98Å
349	E	85	Confident	88.9	Confident	114 Å²	114	37.4 Å²	37.4	53%	0.533	19%	0.187	S	C	.	.	S	Bend	trans	-150.8	157.1	-176.8	49.8	161	-140.2	0	0	111.4	R280 T347 Y352	R280-E349 IonicContact CZ-OE1 3.46Å; R280-E349 IonicContact NH1-OE1 3.59Å; R280-E349 PolarHBondContact NH1-OE1 3.2Å; R280-E349 PolarHBondContact NH2-O 3.27Å; R280-E349 IonicContact NH2-OE1 3.55Å; T347-E349 VanDerWaalsContact C-N 3.29Å; T347-E349 PolarHBondContact O-N 2.85Å; E349-Y352 VanDerWaalsContact O-CD1 3.27Å; E349-Y352 WeakPolarHBondContact O-CD1 3.22Å; E349-Y352 WeakPolarHBondContact O-CE1 3.29Å
350	P	84.7	Confident	88.6	Confident	84 Å²	84	40.1 Å²	40.1	55%	0.545	21%	0.205	S	C	.	.	S	Bend	trans	-66.8	158.9	170.3	-19.9	33.3	0	0	0	113.3	R280 Y352	R280-P350 PolarHBondContact NH1-O 3.41Å; R280-P350 PolarHBondContact NH2-O 3Å; R280-P350 VanDerWaalsContact NH2-O 3.13Å; P350-Y352 HydrophobicContact CG-CE1 4.21Å; P350-Y352 HydrophobicContact CG-CE2 4.27Å
351	P	85.3	Confident	88.5	Confident	52 Å²	52	42.6 Å²	42.6	34%	0.338	22%	0.218	S	C	.	.	S	Bend	cis	-68.2	133	-14.1	29	-36	0	0	0	111.8	R280 Y353	R280-P351 PolarHBondContact NE-O 3.21Å; R280-P351 PolarHBondContact NH2-O 3.13Å; P351-Y353 HydrophobicContact CB-CE1 4.05Å; P351-Y353 HydrophobicContact CG-CE1 3.79Å; P351-Y353 WeakPolarHBondContact O-CD1 3.35Å
352	Y	87.8	Confident	88.7	Confident	36 Å²	36	42.1 Å²	42.1	14%	0.141	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-75.8	135	-179	-53.4	-56.6	0	0	0	111.5	L314 R321 F324 C346 T347 E349 P350	L314-Y352 HydrophobicContact CD2-CD2 3.81Å; L314-Y352 PolarHBondContact N-O 3.13Å; R321-Y352 HydrophobicContact CG-CD2 4.11Å; R321-Y352 HydrophobicContact CG-CE2 3.71Å; F324-Y352 WeakPolarHBondContact CZ-O 3.28Å; C346-Y352 VanDerWaalsContact O-CA 3.26Å; C346-Y352 WeakPolarHBondContact O-CA 3.42Å; T347-Y352 WeakPolarHBondContact O-CE1 3.39Å; E349-Y352 VanDerWaalsContact O-CD1 3.27Å; E349-Y352 WeakPolarHBondContact O-CD1 3.22Å; E349-Y352 WeakPolarHBondContact O-CE1 3.29Å; P350-Y352 HydrophobicContact CG-CE1 4.21Å; P350-Y352 HydrophobicContact CG-CE2 4.27Å
353	Y	90.6	Very high	88.9	Confident	25 Å²	25	42.5 Å²	42.5	10%	0.098	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	140.5	-178.8	-65.5	-7.1	0	0	0	110.5	R280 I283 M285 V311 K312 T313 A345 C346 P351	R280-Y353 HydrophobicContact CG-CD2 4.4Å; R280-Y353 HydrophobicContact CG-CE2 3.74Å; I283-Y353 HydrophobicContact CG2-CE2 4.35Å; M285-Y353 HydrophobicContact SD-CE2 4.12Å; V311-Y353 HydrophobicContact CG1-CD1 4.14Å; V311-Y353 HydrophobicContact CG1-CD2 3.7Å; V311-Y353 HydrophobicContact CG1-CE2 4.25Å; V311-Y353 HydrophobicContact CG1-CG 3.63Å; K312-Y353 WeakPolarHBondContact O-CA 3.35Å; T313-Y353 HydrophobicContact CG2-CD1 3.61Å; T313-Y353 HydrophobicContact CG2-CE1 3.54Å; A345-Y353 CarbonylContact C-O 3.53Å; A345-Y353 VanDerWaalsContact CA-O 3.29Å; A345-Y353 WeakPolarHBondContact CA-O 3.5Å; A345-Y353 WeakPolarHBondContact CB-O 2.94Å; C346-Y353 HydrophobicContact CB-CD2 4.38Å; C346-Y353 HydrophobicContact CB-CG 4.31Å; C346-Y353 PolarHBondContact N-O 3.46Å; C346-Y353 PolarHBondContact O-N 2.77Å; P351-Y353 HydrophobicContact CB-CE1 4.05Å; P351-Y353 HydrophobicContact CG-CE1 3.79Å; P351-Y353 WeakPolarHBondContact O-CD1 3.35Å
354	I	89.5	Confident	89.4	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.01	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	128.8	158.5	-68.5	168.3	0	0	0	106.6	V311 K312 F324 E327 A328 L342 T356	V311-I354 WeakPolarHBondContact CA-O 3.35Å; K312-I354 HydrophobicContact CB-CB 4.29Å; K312-I354 PolarHBondContact N-O 3.42Å; K312-I354 PolarHBondContact O-N 3.44Å; F324-I354 HydrophobicContact CD1-CD1 4.25Å; F324-I354 HydrophobicContact CD1-CG1 4.46Å; F324-I354 HydrophobicContact CD2-CD1 4.13Å; F324-I354 HydrophobicContact CE1-CD1 4.03Å; F324-I354 HydrophobicContact CE1-CG1 3.81Å; F324-I354 HydrophobicContact CE2-CD1 3.92Å; F324-I354 HydrophobicContact CE2-CG1 4.22Å; F324-I354 HydrophobicContact CG-CD1 4.3Å; F324-I354 HydrophobicContact CZ-CB 4.33Å; F324-I354 HydrophobicContact CZ-CD1 3.87Å; F324-I354 HydrophobicContact CZ-CG1 3.69Å; E327-I354 HydrophobicContact CB-CD1 4.32Å; E327-I354 HydrophobicContact CG-CD1 4.29Å; A328-I354 HydrophobicContact CB-CD1 4.05Å; A328-I354 HydrophobicContact CB-CG1 4Å; L342-I354 HydrophobicContact CD1-CG2 3.69Å; I354-T356 HydrophobicContact CG2-CG2 4.14Å
355	V	90.6	Very high	89.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	119.1	-176.5	-172.9	0	0	0	0	109	I278 I283 V309 V311 L343 G344	I278-V355 HydrophobicContact CD1-CB 3.99Å; I278-V355 HydrophobicContact CD1-CG1 4.17Å; I278-V355 HydrophobicContact CD1-CG2 4.02Å; I283-V355 HydrophobicContact CD1-CG1 4.28Å; I283-V355 HydrophobicContact CD1-CG2 4.35Å; V309-V355 HydrophobicContact CB-CG1 3.75Å; V309-V355 HydrophobicContact CG1-CG1 4.12Å; V309-V355 HydrophobicContact CG2-CG1 3.76Å; V311-V355 HydrophobicContact CG2-CG2 4.46Å; L343-V355 HydrophobicContact CB-CG1 4.48Å; L343-V355 PolarHBondContact N-O 2.77Å; G344-V355 PolarHBondContact N-O 3.28Å; G344-V355 PolarHBondContact O-N 3.32Å
356	T	91.6	Very high	90.2	Very high	21 Å²	21	45.9 Å²	45.9	13%	0.129	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	169.2	179.3	64.8	0	0	0	0	110.7	V309 A310 M331 V340 T341 I354	V309-T356 WeakPolarHBondContact CA-O 3.45Å; V309-T356 WeakPolarHBondContact CB-O 3.49Å; A310-T356 PolarHBondContact N-O 3.28Å; A310-T356 PolarHBondContact O-N 2.84Å; M331-T356 HydrophobicContact CE-CG2 3.73Å; V340-T356 HydrophobicContact CG1-CG2 3.98Å; T341-T356 VanDerWaalsContact O-CA 3.29Å; T341-T356 WeakPolarHBondContact O-CA 3.43Å; T341-T356 VanDerWaalsContact O-CB 3.25Å; T341-T356 WeakPolarHBondContact O-CB 3.15Å; I354-T356 HydrophobicContact CG2-CG2 4.14Å
357	E	88.1	Confident	90.5	Very high	30 Å²	30	46.2 Å²	46.2	14%	0.14	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.3	149.3	165	60.3	-177.8	128.9	0	0	112.2	V340 T341 K419	V340-E357 HydrophobicContact CG1-CG 4.13Å; T341-E357 VanDerWaalsContact CB-OE1 3.24Å; T341-E357 WeakPolarHBondContact CB-OE1 3.37Å; T341-E357 PolarHBondContact N-OE1 3.5Å; T341-E357 PolarHBondContact O-N 2.85Å; T341-E357 PolarHBondContact OG1-OE1 2.97Å; E357-K419 WeakPolarHBondContact OE1-CD 3.14Å; E357-K419 IonicContact OE1-NZ 3.72Å; E357-K419 PolarHBondContact OE1-NZ 3.48Å; E357-K419 WeakPolarHBondContact OE2-CE 3.33Å; E357-K419 IonicContact OE2-NZ 2.73Å; E357-K419 PolarHBondContact OE2-NZ 3.22Å
358	F	90.3	Very high	90.9	Very high	50 Å²	50	43.8 Å²	43.8	22%	0.219	23%	0.228	C	C	.	.			trans	-96	120.5	177.4	174.5	-112.6	0	0	0	111.4	L289 E299 L308 C360	L289-F358 HydrophobicContact CD1-CD2 3.93Å; L289-F358 HydrophobicContact CD1-CE2 3.65Å; L289-F358 HydrophobicContact CD2-CE2 3.84Å; L289-F358 HydrophobicContact CD2-CZ 4.47Å; L289-F358 HydrophobicContact CG-CE2 4.4Å; E299-F358 HydrophobicContact CG-CE2 4.34Å; E299-F358 HydrophobicContact CG-CZ 4.49Å; L308-F358 HydrophobicContact CB-CB 3.9Å; L308-F358 HydrophobicContact CB-CD1 3.71Å; L308-F358 HydrophobicContact CB-CG 4.05Å; L308-F358 HydrophobicContact CD1-CD1 3.72Å; L308-F358 HydrophobicContact CD1-CE1 3.88Å; L308-F358 HydrophobicContact CG-CD1 4.37Å; L308-F358 WeakPolarHBondContact O-CB 3.38Å; F358-C360 HydrophobicContact CE1-CB 4.1Å
359	M	92.4	Very high	91.4	Very high	14 Å²	14	40.5 Å²	40.5	7%	0.069	22%	0.216	C	C	.	.			trans	-95	100.4	-179.2	-64.1	-65.8	-73.2	0	0	110	V340 N361 G362 L411 V412 G413 K419	V340-M359 HydrophobicContact CG2-CG 4.47Å; M359-N361 VanDerWaalsContact C-N 3.27Å; M359-N361 PolarHBondContact O-N 3.32Å; M359-N361 VanDerWaalsContact O-N 3.14Å; M359-G362 PolarHBondContact O-N 3.45Å; M359-L411 HydrophobicContact CB-CB 3.66Å; M359-L411 HydrophobicContact CB-CD1 4.01Å; M359-L411 HydrophobicContact CB-CG 4.45Å; M359-L411 HydrophobicContact CE-CB 4.11Å; M359-L411 WeakPolarHBondContact CE-O 3.44Å; M359-L411 HydrophobicContact CG-CB 3.67Å; M359-L411 HydrophobicContact CG-CD1 3.88Å; M359-L411 HydrophobicContact CG-CG 4.44Å; M359-V412 CarbonylContact C-O 3.55Å; M359-G413 VanDerWaalsContact CE-N 3.31Å; M359-K419 HydrophobicContact CE-CB 3.82Å; M359-K419 HydrophobicContact CE-CD 3.98Å; M359-K419 HydrophobicContact CE-CG 3.6Å; M359-K419 HydrophobicContact SD-CB 4.47Å; M359-K419 HydrophobicContact SD-CD 3.85Å; M359-K419 HydrophobicContact SD-CG 4.17Å
360	C	87.5	Confident	91.8	Very high	59 Å²	59	40.1 Å²	40.1	40%	0.399	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-27.3	-163.3	66.1	0	0	0	0	115.7	F358	F358-C360 HydrophobicContact CE1-CB 4.1Å
361	N	90.3	Very high	92.1	Very high	62 Å²	62	38.9 Å²	38.9	33%	0.332	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	13.6	-174.1	-66.6	-24.2	0	0	0	112.9	M359 Y367 V412 G413	M359-N361 VanDerWaalsContact C-N 3.27Å; M359-N361 PolarHBondContact O-N 3.32Å; M359-N361 VanDerWaalsContact O-N 3.14Å; N361-Y367 HydrophobicContact CB-CD2 3.81Å; N361-Y367 HydrophobicContact CB-CE2 3.64Å; N361-V412 WeakPolarHBondContact CA-O 3.14Å; N361-V412 HydrophobicContact CB-CB 3.83Å; N361-V412 HydrophobicContact CB-CG1 3.91Å; N361-V412 WeakPolarHBondContact CB-O 3.38Å; N361-V412 PolarHBondContact N-O 3.17Å; N361-G413 PolarHBondContact ND2-O 3.13Å
362	G	91.5	Very high	92.1	Very high	35 Å²	35	39 Å²	39	36%	0.361	21%	0.209	S	C	.	.			trans	74.2	-142.7	173.1	0	0	0	0	0	113.3	M359 L411 V412	M359-G362 PolarHBondContact O-N 3.45Å; G362-L411 CarbonylContact O-C 3.53Å; G362-L411 VanDerWaalsContact O-CA 3.27Å; G362-L411 WeakPolarHBondContact O-CA 3.44Å; G362-V412 PolarHBondContact O-N 3.04Å
363	N	94.9	Very high	92.2	Very high	35 Å²	35	44.3 Å²	44.3	19%	0.187	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-99.5	149	-178.9	76.2	85.6	0	0	0	112.2	L365 D366 Y367 R408 C410 L411	N363-L365 VanDerWaalsContact C-N 3.29Å; N363-L365 PolarHBondContact O-N 3.43Å; N363-L365 WeakPolarHBondContact OD1-CB 3.44Å; N363-L365 PolarHBondContact OD1-N 2.76Å; N363-D366 PolarHBondContact ND2-OD2 2.68Å; N363-D366 PolarHBondContact O-N 3.14Å; N363-D366 PolarHBondContact OD1-N 3.24Å; N363-D366 VanDerWaalsContact OD1-N 3.09Å; N363-Y367 WeakPolarHBondContact O-CB 3.27Å; N363-Y367 PolarHBondContact O-N 2.72Å; N363-R408 WeakPolarHBondContact CB-O 3.46Å; N363-C410 CarbonylContact C-O 3.53Å; N363-C410 WeakPolarHBondContact CA-O 3.42Å; N363-L411 HydrophobicContact CB-CD2 3.96Å
364	L	97.6	Very high	91.9	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.4	-32.2	-173.8	-179.7	61.1	0	0	0	112.8	Y367 L368 M384 A407 C410 V412 I418 L470 I474	L364-Y367 PolarHBondContact O-N 3.03Å; L364-L368 HydrophobicContact CD1-CD1 4.08Å; L364-L368 HydrophobicContact CD1-CD2 4.3Å; L364-L368 HydrophobicContact CD1-CG 3.83Å; L364-L368 HydrophobicContact CG-CD1 3.88Å; L364-L368 HydrophobicContact CG-CG 4.16Å; L364-L368 WeakPolarHBondContact O-CB 3.39Å; L364-L368 WeakPolarHBondContact O-CD1 3.1Å; L364-L368 WeakPolarHBondContact O-CG 3.25Å; L364-L368 PolarHBondContact O-N 2.86Å; L364-M384 HydrophobicContact CD1-SD 3.74Å; L364-A407 HydrophobicContact CB-CB 4.48Å; L364-A407 WeakPolarHBondContact CB-O 3.4Å; L364-A407 HydrophobicContact CG-CB 4.47Å; L364-A407 PolarHBondContact N-O 3.18Å; L364-C410 HydrophobicContact CB-CB 3.9Å; L364-C410 HydrophobicContact CD2-CB 3.99Å; L364-C410 PolarHBondContact N-O 3.11Å; L364-V412 HydrophobicContact CB-CG2 3.96Å; L364-V412 HydrophobicContact CD1-CG2 3.99Å; L364-I418 HydrophobicContact CD1-CD1 4.02Å; L364-L470 HydrophobicContact CD2-CD1 4.45Å; L364-I474 HydrophobicContact CD2-CD1 4.24Å; L364-I474 HydrophobicContact CD2-CG1 4.2Å
365	L	97.2	Very high	91.8	Very high	20 Å²	20	53.6 Å²	53.6	11%	0.105	28%	0.281	C	S	.	.	H	α-helix	trans	-63.8	-43.2	178.7	-178.2	58.4	0	0	0	112.2	N363 R369 A407 R408	N363-L365 VanDerWaalsContact C-N 3.29Å; N363-L365 PolarHBondContact O-N 3.43Å; N363-L365 WeakPolarHBondContact OD1-CB 3.44Å; N363-L365 PolarHBondContact OD1-N 2.76Å; L365-R369 VanDerWaalsContact O-CD 3.26Å; L365-R369 WeakPolarHBondContact O-CD 3.49Å; L365-R369 VanDerWaalsContact O-CG 3.25Å; L365-R369 WeakPolarHBondContact O-CG 3.35Å; L365-A407 HydrophobicContact CB-CB 3.73Å; L365-A407 HydrophobicContact CD1-CB 4.23Å; L365-A407 PolarHBondContact N-O 2.94Å; L365-A407 VanDerWaalsContact N-O 3.1Å; L365-R408 HydrophobicContact CD2-CB 4.29Å
366	D	95.4	Very high	91.8	Very high	78 Å²	78	53.6 Å²	53.6	42%	0.417	28%	0.281	S	S	.	.	H	α-helix	trans	-78.9	-32.1	176.5	-64.6	-36.6	0	0	0	111.6	N363 R369 T370	N363-D366 PolarHBondContact ND2-OD2 2.68Å; N363-D366 PolarHBondContact O-N 3.14Å; N363-D366 PolarHBondContact OD1-N 3.24Å; N363-D366 VanDerWaalsContact OD1-N 3.09Å; D366-R369 PolarHBondContact O-N 3.31Å; D366-R369 IonicContact OD1-NH1 2.69Å; D366-T370 WeakPolarHBondContact O-CB 3.45Å; D366-T370 WeakPolarHBondContact O-CG2 3.38Å; D366-T370 PolarHBondContact O-N 3.39Å; D366-T370 VanDerWaalsContact O-N 3.11Å; D366-T370 PolarHBondContact O-OG1 2.78Å
367	Y	96.5	Very high	91.6	Very high	10 Å²	10	54.1 Å²	54.1	4%	0.039	29%	0.285	C	S	.	.	H	α-helix	trans	-56.7	-53.3	173.3	-165	-96.6	0	0	0	111.8	N361 N363 L364 R369 T370 H371 L376 M384 V412 H416	N361-Y367 HydrophobicContact CB-CD2 3.81Å; N361-Y367 HydrophobicContact CB-CE2 3.64Å; N363-Y367 WeakPolarHBondContact O-CB 3.27Å; N363-Y367 PolarHBondContact O-N 2.72Å; L364-Y367 PolarHBondContact O-N 3.03Å; Y367-R369 PolarHBondContact O-N 2.87Å; Y367-R369 VanDerWaalsContact O-N 3.13Å; Y367-T370 PolarHBondContact O-N 3.12Å; Y367-T370 PolarHBondContact O-OG1 3.29Å; Y367-H371 AromaticContact CD2-CE1 3.27Å; Y367-H371 WeakPolarHBondContact CD2-CE1 3.36Å; Y367-H371 AromaticContact CD2-ND1 3.46Å; Y367-H371 WeakPolarHBondContact CD2-ND1 3.33Å; Y367-H371 AromaticContact CD2-NE2 3.8Å; Y367-H371 HydrophobicContact CE1-CB 4.41Å; Y367-H371 AromaticContact CE1-CG 3.99Å; Y367-H371 AromaticContact CE2-CD2 3.57Å; Y367-H371 AromaticContact CE2-CE1 3.14Å; Y367-H371 WeakPolarHBondContact CE2-CE1 3.5Å; Y367-H371 AromaticContact CE2-CG 3.79Å; Y367-H371 AromaticContact CE2-ND1 3.53Å; Y367-H371 AromaticContact CE2-NE2 3.15Å; Y367-H371 WeakPolarHBondContact CE2-NE2 3.02Å; Y367-H371 AromaticContact CG-ND1 3.77Å; Y367-H371 AromaticContact CZ-CD2 3.5Å; Y367-H371 AromaticContact CZ-CE1 3.87Å; Y367-H371 AromaticContact CZ-CG 3.71Å; Y367-H371 AromaticContact CZ-ND1 3.92Å; Y367-H371 AromaticContact CZ-NE2 3.61Å; Y367-H371 PolarHBondContact O-N 3.01Å; Y367-H371 PolarHBondContact O-ND1 2.78Å; Y367-H371 VanDerWaalsContact O-ND1 3.14Å; Y367-H371 PolarHBondContact OH-CD2 3.35Å; Y367-L376 HydrophobicContact CD1-CD2 4.3Å; Y367-L376 HydrophobicContact CE1-CD2 3.91Å; Y367-M384 HydrophobicContact CD1-CE 4.05Å; Y367-M384 HydrophobicContact CE1-CE 3.68Å; Y367-V412 HydrophobicContact CD1-CG1 4.22Å; Y367-V412 HydrophobicContact CD1-CG2 4.25Å; Y367-V412 HydrophobicContact CD2-CB 4.1Å; Y367-V412 HydrophobicContact CD2-CG1 3.94Å; Y367-V412 HydrophobicContact CD2-CG2 4.18Å; Y367-V412 HydrophobicContact CE1-CG1 4.16Å; Y367-V412 HydrophobicContact CE2-CB 4.5Å; Y367-V412 HydrophobicContact CE2-CG1 3.89Å; Y367-V412 HydrophobicContact CG-CB 4.25Å; Y367-V412 HydrophobicContact CG-CG1 4.13Å; Y367-V412 HydrophobicContact CG-CG2 3.83Å; Y367-H416 PolarHBondContact OH-CD2 3.08Å; Y367-H416 VanDerWaalsContact OH-CD2 3.24Å; Y367-H416 PolarHBondContact OH-NE2 3.3Å
368	L	97.1	Very high	91.7	Very high	3 Å²	3	56.6 Å²	56.6	2%	0.016	30%	0.304	C	S	.	.	H	α-helix	trans	-58.7	-24.9	178.2	-73.4	167.2	0	0	0	113.9	L364 L376 L381 I474	L364-L368 HydrophobicContact CD1-CD1 4.08Å; L364-L368 HydrophobicContact CD1-CD2 4.3Å; L364-L368 HydrophobicContact CD1-CG 3.83Å; L364-L368 HydrophobicContact CG-CD1 3.88Å; L364-L368 HydrophobicContact CG-CG 4.16Å; L364-L368 WeakPolarHBondContact O-CB 3.39Å; L364-L368 WeakPolarHBondContact O-CD1 3.1Å; L364-L368 WeakPolarHBondContact O-CG 3.25Å; L364-L368 PolarHBondContact O-N 2.86Å; L368-L376 HydrophobicContact CD2-CD1 4.36Å; L368-L381 HydrophobicContact CD2-CD2 3.55Å; L368-I474 HydrophobicContact CD1-CG1 4.19Å
369	R	96.5	Very high	91.6	Very high	120 Å²	120	54.3 Å²	54.3	45%	0.453	29%	0.294	S	S	.	.	H	α-helix	trans	-90.7	-23.4	-178.8	-71.7	169.8	174.6	166.7	-1.6	114.1	L365 D366 Y367 G478	L365-R369 VanDerWaalsContact O-CD 3.26Å; L365-R369 WeakPolarHBondContact O-CD 3.49Å; L365-R369 VanDerWaalsContact O-CG 3.25Å; L365-R369 WeakPolarHBondContact O-CG 3.35Å; D366-R369 PolarHBondContact O-N 3.31Å; D366-R369 IonicContact OD1-NH1 2.69Å; Y367-R369 PolarHBondContact O-N 2.87Å; Y367-R369 VanDerWaalsContact O-N 3.13Å; R369-G478 VanDerWaalsContact CZ-O 3.3Å; R369-G478 PolarHBondContact NE-O 3.07Å; R369-G478 PolarHBondContact NH2-O 3.12Å
370	T	93.2	Very high	91.5	Very high	106 Å²	106	53.9 Å²	53.9	65%	0.65	29%	0.292	S	S	*	.	H	α-helix	trans	-106.3	-29.5	-171.5	51.1	0	0	0	0	113.3	D366 Y367	D366-T370 WeakPolarHBondContact O-CB 3.45Å; D366-T370 WeakPolarHBondContact O-CG2 3.38Å; D366-T370 PolarHBondContact O-N 3.39Å; D366-T370 VanDerWaalsContact O-N 3.11Å; D366-T370 PolarHBondContact O-OG1 2.78Å; Y367-T370 PolarHBondContact O-N 3.12Å; Y367-T370 PolarHBondContact O-OG1 3.29Å
371	H	90	Very high	91.9	Very high	58 Å²	58	51.8 Å²	51.8	27%	0.269	28%	0.277	S	S	.	.	S	Bend	trans	-82.6	147.2	-177.3	-71.5	66.1	0	0	0	112	Y367 L376	Y367-H371 AromaticContact CD2-CE1 3.27Å; Y367-H371 WeakPolarHBondContact CD2-CE1 3.36Å; Y367-H371 AromaticContact CD2-ND1 3.46Å; Y367-H371 WeakPolarHBondContact CD2-ND1 3.33Å; Y367-H371 AromaticContact CD2-NE2 3.8Å; Y367-H371 HydrophobicContact CE1-CB 4.41Å; Y367-H371 AromaticContact CE1-CG 3.99Å; Y367-H371 AromaticContact CE2-CD2 3.57Å; Y367-H371 AromaticContact CE2-CE1 3.14Å; Y367-H371 WeakPolarHBondContact CE2-CE1 3.5Å; Y367-H371 AromaticContact CE2-CG 3.79Å; Y367-H371 AromaticContact CE2-ND1 3.53Å; Y367-H371 AromaticContact CE2-NE2 3.15Å; Y367-H371 WeakPolarHBondContact CE2-NE2 3.02Å; Y367-H371 AromaticContact CG-ND1 3.77Å; Y367-H371 AromaticContact CZ-CD2 3.5Å; Y367-H371 AromaticContact CZ-CE1 3.87Å; Y367-H371 AromaticContact CZ-CG 3.71Å; Y367-H371 AromaticContact CZ-ND1 3.92Å; Y367-H371 AromaticContact CZ-NE2 3.61Å; Y367-H371 PolarHBondContact O-N 3.01Å; Y367-H371 PolarHBondContact O-ND1 2.78Å; Y367-H371 VanDerWaalsContact O-ND1 3.14Å; Y367-H371 PolarHBondContact OH-CD2 3.35Å; H371-L376 HydrophobicContact CB-CD1 3.95Å; H371-L376 HydrophobicContact CB-CG 4.13Å
372	P	86.8	Confident	92.1	Very high	56 Å²	56	49.7 Å²	49.7	36%	0.364	27%	0.265	S	S	.	.			trans	-70.6	140.8	-174.1	30.1	-35.6	0	0	0	111.5	T374 E375 L376	P372-T374 PolarHBondContact O-N 3.46Å; P372-T374 VanDerWaalsContact O-N 3.07Å; P372-E375 HydrophobicContact CG-CB 4.15Å; P372-E375 HydrophobicContact CG-CG 3.85Å; P372-E375 WeakPolarHBondContact CG-OE1 3.25Å; P372-E375 PolarHBondContact O-N 3.01Å; P372-L376 PolarHBondContact O-N 3.33Å; P372-L376 VanDerWaalsContact O-N 3.1Å
373	R	87.9	Confident	92.2	Very high	147 Å²	147	48.4 Å²	48.4	56%	0.555	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-18.1	-179.3	-66.6	178.5	170.4	-88.8	-13.1	114	Y477	R373-Y477 HydrophobicContact CB-CE1 4.26Å; R373-Y477 HydrophobicContact CG-CD1 4.05Å; R373-Y477 HydrophobicContact CG-CE1 3.78Å
374	T	86	Confident	92.2	Very high	120 Å²	120	46.8 Å²	46.8	74%	0.736	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-26.4	173.8	46.8	0	0	0	0	113.2	P372	P372-T374 PolarHBondContact O-N 3.46Å; P372-T374 VanDerWaalsContact O-N 3.07Å
375	E	85.9	Confident	92.2	Very high	101 Å²	101	46.9 Å²	46.9	47%	0.472	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-37	173.3	-68.7	167.3	-159.6	0	0	111	P372 T377 V380	P372-E375 HydrophobicContact CG-CB 4.15Å; P372-E375 HydrophobicContact CG-CG 3.85Å; P372-E375 WeakPolarHBondContact CG-OE1 3.25Å; P372-E375 PolarHBondContact O-N 3.01Å; E375-T377 PolarHBondContact O-N 2.84Å; E375-V380 WeakPolarHBondContact O-CG2 3.33Å
376	L	90.4	Very high	92.2	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.237	C	C	.	.	S	Bend	trans	-80.4	57.5	174.8	-63.6	-179.2	0	0	0	112.3	Y367 L368 H371 P372 V380 L381 M384 Y477	Y367-L376 HydrophobicContact CD1-CD2 4.3Å; Y367-L376 HydrophobicContact CE1-CD2 3.91Å; L368-L376 HydrophobicContact CD2-CD1 4.36Å; H371-L376 HydrophobicContact CB-CD1 3.95Å; H371-L376 HydrophobicContact CB-CG 4.13Å; P372-L376 PolarHBondContact O-N 3.33Å; P372-L376 VanDerWaalsContact O-N 3.1Å; L376-V380 HydrophobicContact CD2-CG1 4.06Å; L376-L381 HydrophobicContact CB-CD2 4.37Å; L376-M384 HydrophobicContact CD2-CE 3.86Å; L376-Y477 HydrophobicContact CB-CD1 4.34Å; L376-Y477 HydrophobicContact CB-CE1 3.87Å; L376-Y477 HydrophobicContact CD1-CD1 4.1Å; L376-Y477 HydrophobicContact CD1-CE1 4.45Å; L376-Y477 PolarHBondContact O-OH 2.74Å
377	T	89.3	Confident	92.3	Very high	33 Å²	33	42.7 Å²	42.7	20%	0.202	22%	0.219	C	C	.	.			trans	-64.4	161.3	177.4	72.8	0	0	0	0	112.2	E375 S379 V380 L381	E375-T377 PolarHBondContact O-N 2.84Å; T377-S379 PolarHBondContact O-N 3.39Å; T377-V380 WeakPolarHBondContact O-CA 3.15Å; T377-V380 WeakPolarHBondContact O-CB 3.21Å; T377-V380 PolarHBondContact O-N 3.2Å; T377-V380 PolarHBondContact OG1-N 3.16Å; T377-L381 PolarHBondContact O-N 3.39Å
378	P	89	Confident	92.4	Very high	82 Å²	82	42.2 Å²	42.2	53%	0.532	22%	0.218	S	C	.	.	H	α-helix	trans	-54.7	-37.4	176.4	-28	36.5	0	0	0	113.9	L381 L382	P378-L381 PolarHBondContact O-N 3.36Å; P378-L382 PolarHBondContact O-N 3Å
379	S	87.8	Confident	92.4	Very high	2 Å²	2	42 Å²	42	1%	0.014	22%	0.217	C	C	.	.	H	α-helix	trans	-61.5	-41.8	172.5	172.4	0	0	0	0	112.5	Y179 N182 T377 H383	Y179-S379 PolarHBondContact N-OG 2.93Å; N182-S379 VanDerWaalsContact ND2-CB 3.27Å; N182-S379 WeakPolarHBondContact ND2-CB 3.49Å; N182-S379 PolarHBondContact ND2-OG 2.94Å; N182-S379 VanDerWaalsContact ND2-OG 3.14Å; T377-S379 PolarHBondContact O-N 3.39Å; S379-H383 VanDerWaalsContact O-CB 3.31Å; S379-H383 WeakPolarHBondContact O-CB 3.44Å; S379-H383 PolarHBondContact O-N 3.24Å
380	V	91.4	Very high	92.5	Very high	4 Å²	4	38.9 Å²	38.9	2%	0.024	21%	0.205	C	C	.	.	H	α-helix	trans	-64.1	-44.5	173.8	164.9	0	0	0	0	111.5	Y179 E375 L376 T377 H383 M384 H416	Y179-V380 HydrophobicContact CD2-CG2 3.63Å; Y179-V380 HydrophobicContact CE2-CG2 3.85Å; E375-V380 WeakPolarHBondContact O-CG2 3.33Å; L376-V380 HydrophobicContact CD2-CG1 4.06Å; T377-V380 WeakPolarHBondContact O-CA 3.15Å; T377-V380 WeakPolarHBondContact O-CB 3.21Å; T377-V380 PolarHBondContact O-N 3.2Å; T377-V380 PolarHBondContact OG1-N 3.16Å; V380-H383 PolarHBondContact O-N 3.49Å; V380-M384 HydrophobicContact CG1-CE 3.68Å; V380-M384 HydrophobicContact CG1-SD 4.27Å; V380-M384 WeakPolarHBondContact O-CG 3.48Å; V380-M384 PolarHBondContact O-N 3.39Å; V380-H416 VanDerWaalsContact CG1-ND1 3.28Å; V380-H416 WeakPolarHBondContact CG1-ND1 3.37Å
381	L	94.9	Very high	92.6	Very high	16 Å²	16	33.8 Å²	33.8	8%	0.084	17%	0.174	C	C	.	.	H	α-helix	trans	-64.4	-41.8	179.4	-65.3	178.8	0	0	0	112	L368 L376 T377 P378 M384 A385 I474 Y477	L368-L381 HydrophobicContact CD2-CD2 3.55Å; L376-L381 HydrophobicContact CB-CD2 4.37Å; T377-L381 PolarHBondContact O-N 3.39Å; P378-L381 PolarHBondContact O-N 3.36Å; L381-M384 PolarHBondContact O-N 2.89Å; L381-A385 PolarHBondContact O-N 3.39Å; L381-A385 VanDerWaalsContact O-N 3.07Å; L381-I474 HydrophobicContact CB-CG2 3.87Å; L381-I474 HydrophobicContact CD2-CG2 4Å; L381-I474 HydrophobicContact CG-CG2 4.44Å; L381-Y477 HydrophobicContact CD1-CD2 4.49Å; L381-Y477 HydrophobicContact CD1-CE1 4.08Å; L381-Y477 HydrophobicContact CD1-CE2 3.83Å
382	L	94.4	Very high	92.9	Very high	18 Å²	18	31.1 Å²	31.1	9%	0.094	16%	0.161	C	C	.	.	H	α-helix	trans	-62.7	-48.1	172.5	-167.3	77.1	0	0	0	110.3	P378 M384 A385 T386 V510 L535 M538 T540	P378-L382 PolarHBondContact O-N 3Å; L382-M384 VanDerWaalsContact C-N 3.26Å; L382-M384 PolarHBondContact O-N 2.77Å; L382-A385 WeakPolarHBondContact O-CA 3.49Å; L382-A385 WeakPolarHBondContact O-CB 3.49Å; L382-A385 PolarHBondContact O-N 3.07Å; L382-T386 PolarHBondContact O-N 3.38Å; L382-T386 PolarHBondContact O-OG1 2.82Å; L382-V510 HydrophobicContact CD1-CG2 4.2Å; L382-L535 HydrophobicContact CD1-CD2 3.67Å; L382-M538 HydrophobicContact CD1-SD 4.18Å; L382-M538 HydrophobicContact CD2-CB 4.06Å; L382-T540 HydrophobicContact CB-CG2 4.15Å; L382-T540 HydrophobicContact CD2-CG2 3.37Å; L382-T540 HydrophobicContact CG-CG2 4.38Å
383	H	93.2	Very high	93.4	Very high	8 Å²	8	29.4 Å²	29.4	4%	0.037	15%	0.152	C	C	.	.	H	α-helix	trans	-57.1	-36.9	178.6	178.5	48.1	0	0	0	113.2	Y176 Y179 S379 V380 Q387	Y176-H383 AromaticContact CD2-CE1 3.22Å; Y176-H383 WeakPolarHBondContact CD2-CE1 3.45Å; Y176-H383 AromaticContact CD2-ND1 3.61Å; Y176-H383 AromaticContact CD2-NE2 3.7Å; Y176-H383 AromaticContact CE2-CE1 3.34Å; Y176-H383 WeakPolarHBondContact CE2-CE1 3.45Å; Y176-H383 AromaticContact CE2-NE2 3.48Å; Y176-H383 WeakPolarHBondContact CE2-NE2 3.48Å; Y179-H383 AromaticContact CD1-CD2 3.49Å; Y179-H383 VanDerWaalsContact CD1-CD2 3.49Å; Y179-H383 WeakPolarHBondContact CD1-CD2 3.16Å; Y179-H383 AromaticContact CD1-NE2 3.69Å; Y179-H383 AromaticContact CE1-CD2 3.86Å; Y179-H383 AromaticContact CE1-NE2 3.9Å; Y179-H383 HydrophobicContact CG-CB 4.45Å; Y179-H383 AromaticContact CG-CD2 3.63Å; S379-H383 VanDerWaalsContact O-CB 3.31Å; S379-H383 WeakPolarHBondContact O-CB 3.44Å; S379-H383 PolarHBondContact O-N 3.24Å; V380-H383 PolarHBondContact O-N 3.49Å; H383-Q387 PolarHBondContact CE1-NE2 2.69Å; H383-Q387 PolarHBondContact NE2-NE2 3.45Å; H383-Q387 VanDerWaalsContact NE2-NE2 3.18Å; H383-Q387 VanDerWaalsContact O-CG 3.31Å; H383-Q387 WeakPolarHBondContact O-CG 3.39Å; H383-Q387 PolarHBondContact O-N 3.14Å; H383-Q387 PolarHBondContact O-NE2 3.39Å
384	M	96.2	Very high	93.7	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-66	-44.2	172	-69.9	177	176.5	0	0	112.3	L364 Y367 L376 V380 L381 L382 Q387 V388 H416 I418	L364-M384 HydrophobicContact CD1-SD 3.74Å; Y367-M384 HydrophobicContact CD1-CE 4.05Å; Y367-M384 HydrophobicContact CE1-CE 3.68Å; L376-M384 HydrophobicContact CD2-CE 3.86Å; V380-M384 HydrophobicContact CG1-CE 3.68Å; V380-M384 HydrophobicContact CG1-SD 4.27Å; V380-M384 WeakPolarHBondContact O-CG 3.48Å; V380-M384 PolarHBondContact O-N 3.39Å; L381-M384 PolarHBondContact O-N 2.89Å; L382-M384 VanDerWaalsContact C-N 3.26Å; L382-M384 PolarHBondContact O-N 2.77Å; M384-Q387 PolarHBondContact O-N 3.02Å; M384-V388 PolarHBondContact O-N 3.14Å; M384-H416 HydrophobicContact CE-CB 3.82Å; M384-I418 HydrophobicContact CB-CD1 4.34Å; M384-I418 HydrophobicContact CB-CG1 3.89Å; M384-I418 HydrophobicContact CG-CD1 3.92Å; M384-I418 HydrophobicContact CG-CG1 3.83Å; M384-I418 HydrophobicContact SD-CD1 4.39Å
385	A	97.7	Very high	94.1	Very high	3 Å²	3	18.4 Å²	18.4	3%	0.025	10%	0.097	C	C	.	.	H	α-helix	trans	-63	-46.1	177.8	0	0	0	0	0	112.4	L381 L382 Q387 V388 A389 L471 I474	L381-A385 PolarHBondContact O-N 3.39Å; L381-A385 VanDerWaalsContact O-N 3.07Å; L382-A385 WeakPolarHBondContact O-CA 3.49Å; L382-A385 WeakPolarHBondContact O-CB 3.49Å; L382-A385 PolarHBondContact O-N 3.07Å; A385-Q387 VanDerWaalsContact C-N 3.33Å; A385-Q387 PolarHBondContact O-N 3.45Å; A385-V388 PolarHBondContact O-N 2.61Å; A385-A389 PolarHBondContact O-N 3.24Å; A385-L471 HydrophobicContact CB-CD2 3.63Å; A385-I474 HydrophobicContact CB-CD1 4.03Å
386	T	97.2	Very high	94.4	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-63.1	-37.8	179	-42.9	0	0	0	0	111.6	L382 V388 A389 R390 L532 L535 E536	L382-T386 PolarHBondContact O-N 3.38Å; L382-T386 PolarHBondContact O-OG1 2.82Å; T386-V388 PolarHBondContact O-N 2.96Å; T386-A389 WeakPolarHBondContact O-CB 3.38Å; T386-A389 PolarHBondContact O-N 3.38Å; T386-R390 VanDerWaalsContact CG2-NH2 3.31Å; T386-R390 WeakPolarHBondContact O-CG 3.31Å; T386-R390 PolarHBondContact O-N 3.45Å; T386-L532 HydrophobicContact CG2-CD1 3.7Å; T386-L535 HydrophobicContact CG2-CB 4.09Å; T386-E536 HydrophobicContact CG2-CG 3.46Å; T386-E536 VanDerWaalsContact CG2-CG 3.46Å
387	Q	97.1	Very high	94.4	Very high	9 Å²	9	22.5 Å²	22.5	4%	0.042	12%	0.116	C	C	.	.	H	α-helix	trans	-60.7	-43	173	-80	-178.8	89.2	0	0	113	N338 H383 M384 A385 R390 G391 H416 I418	N338-Q387 WeakPolarHBondContact CB-O 3.27Å; N338-Q387 WeakPolarHBondContact ND2-CB 3.42Å; N338-Q387 WeakPolarHBondContact ND2-CG 3.3Å; N338-Q387 PolarHBondContact ND2-OE1 2.94Å; N338-Q387 VanDerWaalsContact ND2-OE1 3.13Å; H383-Q387 PolarHBondContact CE1-NE2 2.69Å; H383-Q387 PolarHBondContact NE2-NE2 3.45Å; H383-Q387 VanDerWaalsContact NE2-NE2 3.18Å; H383-Q387 VanDerWaalsContact O-CG 3.31Å; H383-Q387 WeakPolarHBondContact O-CG 3.39Å; H383-Q387 PolarHBondContact O-N 3.14Å; H383-Q387 PolarHBondContact O-NE2 3.39Å; M384-Q387 PolarHBondContact O-N 3.02Å; A385-Q387 VanDerWaalsContact C-N 3.33Å; A385-Q387 PolarHBondContact O-N 3.45Å; Q387-R390 PolarHBondContact O-N 2.86Å; Q387-G391 PolarHBondContact O-N 3.25Å; Q387-H416 PolarHBondContact NE2-O 2.87Å; Q387-I418 HydrophobicContact CB-CB 4.05Å; Q387-I418 HydrophobicContact CB-CG1 4.48Å
388	V	98.1	Very high	94.3	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-65.5	-40.7	174.5	178	0	0	0	0	111	M384 A385 T386 R390 G391 M392 L405 I418 V420 F467 L470	M384-V388 PolarHBondContact O-N 3.14Å; A385-V388 PolarHBondContact O-N 2.61Å; T386-V388 PolarHBondContact O-N 2.96Å; V388-R390 VanDerWaalsContact C-N 3.31Å; V388-R390 PolarHBondContact O-N 2.93Å; V388-G391 PolarHBondContact O-N 3.46Å; V388-G391 VanDerWaalsContact O-N 3.16Å; V388-M392 HydrophobicContact CG1-CG 4.16Å; V388-M392 WeakPolarHBondContact O-CG 3.31Å; V388-M392 PolarHBondContact O-N 3.19Å; V388-L405 HydrophobicContact CG1-CD1 4.13Å; V388-I418 HydrophobicContact CG2-CB 4.44Å; V388-I418 HydrophobicContact CG2-CG2 3.52Å; V388-V420 HydrophobicContact CG1-CG2 3.89Å; V388-F467 HydrophobicContact CB-CE2 4.07Å; V388-F467 HydrophobicContact CG1-CD2 4.02Å; V388-F467 HydrophobicContact CG1-CE2 3.87Å; V388-L470 HydrophobicContact CB-CD2 4.37Å; V388-L470 HydrophobicContact CG1-CD2 3.69Å; V388-L470 HydrophobicContact CG2-CD2 4.35Å
389	A	98.3	Very high	94.1	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-58.1	-40.5	176.4	0	0	0	0	0	112.2	A385 T386 M392 A393 F467 I531 L532 L535	A385-A389 PolarHBondContact O-N 3.24Å; T386-A389 WeakPolarHBondContact O-CB 3.38Å; T386-A389 PolarHBondContact O-N 3.38Å; A389-M392 PolarHBondContact O-N 3.42Å; A389-A393 WeakPolarHBondContact O-CB 3.35Å; A389-A393 PolarHBondContact O-N 3.42Å; A389-F467 HydrophobicContact CB-CE2 4.21Å; A389-F467 HydrophobicContact CB-CZ 3.91Å; A389-I531 HydrophobicContact CB-CG2 4.35Å; A389-L532 HydrophobicContact CB-CB 4.33Å; A389-L532 HydrophobicContact CB-CD1 4.02Å; A389-L535 HydrophobicContact CB-CD1 3.77Å
390	R	97.1	Very high	94.1	Very high	53 Å²	53	24.3 Å²	24.3	20%	0.2	12%	0.117	C	C	.	.	H	α-helix	trans	-61.5	-47.1	173.2	-66.2	-179.1	-167.4	118.2	6.4	112.5	H336 T386 Q387 V388 M392 A393 Y394 L532 E536	H336-R390 VanDerWaalsContact CE1-C 3.5Å; T386-R390 VanDerWaalsContact CG2-NH2 3.31Å; T386-R390 WeakPolarHBondContact O-CG 3.31Å; T386-R390 PolarHBondContact O-N 3.45Å; Q387-R390 PolarHBondContact O-N 2.86Å; V388-R390 VanDerWaalsContact C-N 3.31Å; V388-R390 PolarHBondContact O-N 2.93Å; R390-M392 VanDerWaalsContact C-N 3.29Å; R390-M392 PolarHBondContact O-N 2.8Å; R390-A393 PolarHBondContact O-N 3.18Å; R390-Y394 PolarHBondContact O-N 3.22Å; R390-L532 HydrophobicContact CB-CD1 4.48Å; R390-L532 HydrophobicContact CG-CD1 3.39Å; R390-L532 HydrophobicContact CG-CD2 3.8Å; R390-L532 HydrophobicContact CG-CG 4.25Å; R390-E536 IonicContact CZ-OE1 3.94Å; R390-E536 IonicContact NE-OE1 3.36Å; R390-E536 PolarHBondContact NE-OE1 3.1Å; R390-E536 IonicContact NH2-OE1 2.66Å; R390-E536 PolarHBondContact NH2-OE1 3.21Å
391	G	96.1	Very high	94	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-57.1	-43.1	175.7	0	0	0	0	0	112.4	Q387 V388 L395	Q387-G391 PolarHBondContact O-N 3.25Å; V388-G391 PolarHBondContact O-N 3.46Å; V388-G391 VanDerWaalsContact O-N 3.16Å; G391-L395 WeakPolarHBondContact O-CG 3.27Å; G391-L395 PolarHBondContact O-N 2.93Å
392	M	97.2	Very high	93.8	Very high	2 Å²	2	23.4 Å²	23.4	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-74.1	-34.3	178.6	-67	-55.6	-50.1	0	0	113.8	V388 A389 R390 Y394 L395 E396 H402 L405 V420 D463 F528	V388-M392 HydrophobicContact CG1-CG 4.16Å; V388-M392 WeakPolarHBondContact O-CG 3.31Å; V388-M392 PolarHBondContact O-N 3.19Å; A389-M392 PolarHBondContact O-N 3.42Å; R390-M392 VanDerWaalsContact C-N 3.29Å; R390-M392 PolarHBondContact O-N 2.8Å; M392-Y394 VanDerWaalsContact C-N 3.35Å; M392-L395 HydrophobicContact CE-CD1 4.13Å; M392-L395 PolarHBondContact O-N 2.58Å; M392-L395 HydrophobicContact SD-CD1 3.83Å; M392-E396 PolarHBondContact O-N 2.77Å; M392-H402 HydrophobicContact CE-CB 4.02Å; M392-H402 HydrophobicContact SD-CB 4.41Å; M392-L405 HydrophobicContact CE-CD2 4.12Å; M392-L405 HydrophobicContact CG-CD1 4.38Å; M392-L405 HydrophobicContact CG-CD2 3.83Å; M392-L405 HydrophobicContact SD-CD1 3.89Å; M392-L405 HydrophobicContact SD-CD2 3.78Å; M392-L405 HydrophobicContact SD-CG 4.38Å; M392-V420 HydrophobicContact SD-CG1 4.45Å; M392-D463 HydrophobicContact CE-CB 3.76Å; M392-F528 HydrophobicContact CB-CB 4.49Å; M392-F528 HydrophobicContact CB-CD1 3.43Å; M392-F528 VanDerWaalsContact CB-CD1 3.43Å; M392-F528 HydrophobicContact CB-CD2 3.92Å; M392-F528 HydrophobicContact CB-CE1 3.4Å; M392-F528 HydrophobicContact CB-CE2 3.89Å; M392-F528 HydrophobicContact CB-CG 3.69Å; M392-F528 HydrophobicContact CB-CZ 3.63Å; M392-F528 HydrophobicContact CE-CE2 3.76Å; M392-F528 HydrophobicContact CE-CZ 3.81Å; M392-F528 HydrophobicContact CG-CD1 4.36Å; M392-F528 HydrophobicContact CG-CE1 3.85Å; M392-F528 HydrophobicContact CG-CZ 3.93Å
393	A	96.6	Very high	93.6	Very high	20 Å²	20	23.3 Å²	23.3	17%	0.165	11%	0.111	C	C	.	.	H	α-helix	trans	-63.2	-41.3	173.4	0	0	0	0	0	111.5	A389 R390 E396 Q397 F528 L532	A389-A393 WeakPolarHBondContact O-CB 3.35Å; A389-A393 PolarHBondContact O-N 3.42Å; R390-A393 PolarHBondContact O-N 3.18Å; A393-E396 PolarHBondContact O-N 3.05Å; A393-Q397 WeakPolarHBondContact O-CB 3.34Å; A393-Q397 PolarHBondContact O-N 2.81Å; A393-F528 HydrophobicContact CB-CB 3.91Å; A393-L532 HydrophobicContact CB-CD2 4.43Å
394	Y	94.6	Very high	93.5	Very high	34 Å²	34	24.1 Å²	24.1	13%	0.133	12%	0.115	C	C	.	.	H	α-helix	trans	-61.1	-43.3	172	178.3	-86.7	0	0	0	111.8	L334 R335 H336 L339 R390 M392 Q397 H398	L334-Y394 HydrophobicContact CB-CE1 4.43Å; L334-Y394 HydrophobicContact CD2-CE1 3.83Å; R335-Y394 PolarHBondContact N-OH 2.94Å; R335-Y394 WeakPolarHBondContact O-CE2 3.48Å; R335-Y394 PolarHBondContact O-OH 3.28Å; H336-Y394 HydrophobicContact CB-CD1 3.78Å; H336-Y394 HydrophobicContact CB-CD2 3.87Å; H336-Y394 HydrophobicContact CB-CE1 3.99Å; H336-Y394 HydrophobicContact CB-CE2 4.08Å; H336-Y394 HydrophobicContact CB-CG 3.71Å; H336-Y394 AromaticContact CD2-CD2 3.67Å; H336-Y394 AromaticContact CD2-CG 3.77Å; H336-Y394 AromaticContact CG-CD2 4Å; H336-Y394 AromaticContact CG-CG 3.78Å; L339-Y394 HydrophobicContact CD1-CD1 3.57Å; L339-Y394 HydrophobicContact CD1-CE1 3.91Å; R390-Y394 PolarHBondContact O-N 3.22Å; M392-Y394 VanDerWaalsContact C-N 3.35Å; Y394-Q397 PolarHBondContact O-N 3.31Å; Y394-H398 AromaticContact CD1-ND1 3.94Å; Y394-H398 AromaticContact CD2-CE1 3.61Å; Y394-H398 AromaticContact CD2-ND1 3.91Å; Y394-H398 AromaticContact CE1-ND1 3.87Å; Y394-H398 AromaticContact CE2-CE1 3.25Å; Y394-H398 WeakPolarHBondContact CE2-CE1 3.36Å; Y394-H398 AromaticContact CE2-ND1 3.83Å; Y394-H398 AromaticContact CE2-NE2 3.94Å; Y394-H398 AromaticContact CG-ND1 3.98Å; Y394-H398 AromaticContact CZ-CE1 3.47Å; Y394-H398 VanDerWaalsContact CZ-CE1 3.47Å; Y394-H398 AromaticContact CZ-ND1 3.8Å; Y394-H398 AromaticContact CZ-NE2 3.89Å; Y394-H398 PolarHBondContact O-N 2.92Å; Y394-H398 VanDerWaalsContact O-N 3.16Å; Y394-H398 PolarHBondContact O-ND1 2.88Å
395	L	92.7	Very high	93.5	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-63.5	-42.9	176	-69.2	174.5	0	0	0	112.5	L334 L339 G391 M392 H398 N399 F400 F423	L334-L395 HydrophobicContact CD1-CD2 3.94Å; L334-L395 HydrophobicContact CD2-CD2 3.89Å; L339-L395 HydrophobicContact CD1-CD2 3.76Å; L339-L395 HydrophobicContact CD1-CG 4.02Å; L339-L395 HydrophobicContact CD2-CD1 4.04Å; L339-L395 HydrophobicContact CD2-CG 4.16Å; G391-L395 WeakPolarHBondContact O-CG 3.27Å; G391-L395 PolarHBondContact O-N 2.93Å; M392-L395 HydrophobicContact CE-CD1 4.13Å; M392-L395 PolarHBondContact O-N 2.58Å; M392-L395 HydrophobicContact SD-CD1 3.83Å; L395-H398 CarbonylContact O-C 3.59Å; L395-H398 PolarHBondContact O-N 2.95Å; L395-N399 PolarHBondContact O-N 3.14Å; L395-F400 HydrophobicContact CB-CB 4.11Å; L395-F400 HydrophobicContact CD2-CB 3.85Å; L395-F400 HydrophobicContact CD2-CG 4.25Å; L395-F400 PolarHBondContact O-N 2.74Å; L395-F423 HydrophobicContact CD1-CE1 4.26Å; L395-F423 HydrophobicContact CD2-CE1 4.42Å
396	E	92.9	Very high	93.4	Very high	37 Å²	37	24 Å²	24	17%	0.173	11%	0.114	C	C	.	.	H	α-helix	trans	-61.9	-44.3	176	175.6	159.5	-112.3	0	0	111.5	M392 A393 H398 N399 T460 P527 F528	M392-E396 PolarHBondContact O-N 2.77Å; A393-E396 PolarHBondContact O-N 3.05Å; E396-H398 PolarHBondContact O-N 3.35Å; E396-N399 PolarHBondContact O-N 2.81Å; E396-T460 HydrophobicContact CB-CG2 4.09Å; E396-T460 HydrophobicContact CG-CG2 3.97Å; E396-T460 WeakPolarHBondContact OE1-CB 3.41Å; E396-T460 PolarHBondContact OE1-OG1 2.97Å; E396-P527 WeakPolarHBondContact OE2-CA 3.34Å; E396-P527 WeakPolarHBondContact OE2-CB 3.43Å; E396-F528 HydrophobicContact CB-CD2 4.28Å; E396-F528 PolarHBondContact OE2-N 2.68Å
397	Q	91.1	Very high	93.5	Very high	149 Å²	149	24 Å²	24	70%	0.696	11%	0.114	S	C	*	.	H	α-helix	trans	-58.1	-33.8	175.5	-174.1	-178.9	9.3	0	0	112.9	A393 Y394	A393-Q397 WeakPolarHBondContact O-CB 3.34Å; A393-Q397 PolarHBondContact O-N 2.81Å; Y394-Q397 PolarHBondContact O-N 3.31Å
398	H	87.1	Confident	93.3	Very high	71 Å²	71	26.8 Å²	26.8	33%	0.329	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	7.5	179.2	-66.2	77.8	0	0	0	113.5	Y394 L395 E396 F400	Y394-H398 AromaticContact CD1-ND1 3.94Å; Y394-H398 AromaticContact CD2-CE1 3.61Å; Y394-H398 AromaticContact CD2-ND1 3.91Å; Y394-H398 AromaticContact CE1-ND1 3.87Å; Y394-H398 AromaticContact CE2-CE1 3.25Å; Y394-H398 WeakPolarHBondContact CE2-CE1 3.36Å; Y394-H398 AromaticContact CE2-ND1 3.83Å; Y394-H398 AromaticContact CE2-NE2 3.94Å; Y394-H398 AromaticContact CG-ND1 3.98Å; Y394-H398 AromaticContact CZ-CE1 3.47Å; Y394-H398 VanDerWaalsContact CZ-CE1 3.47Å; Y394-H398 AromaticContact CZ-ND1 3.8Å; Y394-H398 AromaticContact CZ-NE2 3.89Å; Y394-H398 PolarHBondContact O-N 2.92Å; Y394-H398 VanDerWaalsContact O-N 3.16Å; Y394-H398 PolarHBondContact O-ND1 2.88Å; L395-H398 CarbonylContact O-C 3.59Å; L395-H398 PolarHBondContact O-N 2.95Å; E396-H398 PolarHBondContact O-N 3.35Å; H398-F400 VanDerWaalsContact C-N 3.34Å; H398-F400 HydrophobicContact CB-CD2 3.75Å; H398-F400 HydrophobicContact CB-CE2 4.06Å; H398-F400 VanDerWaalsContact O-CD2 3.27Å; H398-F400 WeakPolarHBondContact O-CD2 3.45Å; H398-F400 PolarHBondContact O-N 3.14Å
399	N	85.5	Confident	93.2	Very high	72 Å²	72	27.5 Å²	27.5	39%	0.385	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	33.9	-177.6	-56.3	-85.7	0	0	0	114.5	L395 E396 I429	L395-N399 PolarHBondContact O-N 3.14Å; E396-N399 PolarHBondContact O-N 2.81Å; N399-I429 HydrophobicContact CB-CB 4.37Å; N399-I429 PolarHBondContact O-N 2.9Å
400	F	86.9	Confident	93.1	Very high	13 Å²	13	27.5 Å²	27.5	6%	0.057	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	136.8	173	-78.6	-109.7	0	0	0	111.6	L330 L334 L395 H398 C428	L330-F400 HydrophobicContact CB-CE1 4.09Å; L330-F400 HydrophobicContact CD2-CE1 3.69Å; L330-F400 HydrophobicContact CD2-CZ 4.15Å; L330-F400 HydrophobicContact CG-CE1 4.41Å; L334-F400 HydrophobicContact CD1-CD1 4.07Å; L334-F400 HydrophobicContact CD1-CE1 3.88Å; L334-F400 HydrophobicContact CD1-CZ 4.39Å; L334-F400 HydrophobicContact CD2-CD1 4.34Å; L334-F400 HydrophobicContact CD2-CD2 4.02Å; L334-F400 HydrophobicContact CD2-CE1 4.13Å; L334-F400 HydrophobicContact CD2-CE2 3.84Å; L334-F400 HydrophobicContact CD2-CG 4.28Å; L334-F400 HydrophobicContact CD2-CZ 3.9Å; L334-F400 HydrophobicContact CG-CE1 4.22Å; L334-F400 HydrophobicContact CG-CZ 4.22Å; L395-F400 HydrophobicContact CB-CB 4.11Å; L395-F400 HydrophobicContact CD2-CB 3.85Å; L395-F400 HydrophobicContact CD2-CG 4.25Å; L395-F400 PolarHBondContact O-N 2.74Å; H398-F400 VanDerWaalsContact C-N 3.34Å; H398-F400 HydrophobicContact CB-CD2 3.75Å; H398-F400 HydrophobicContact CB-CE2 4.06Å; H398-F400 VanDerWaalsContact O-CD2 3.27Å; H398-F400 WeakPolarHBondContact O-CD2 3.45Å; H398-F400 PolarHBondContact O-N 3.14Å; F400-C428 HydrophobicContact CD1-CB 4.45Å; F400-C428 HydrophobicContact CD2-CB 4.5Å; F400-C428 HydrophobicContact CE1-CB 4.15Å; F400-C428 HydrophobicContact CE2-CB 4.17Å; F400-C428 HydrophobicContact CZ-CB 4Å
401	I	89.1	Confident	93.1	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	132.3	165.6	-42.6	165.3	0	0	0	108.3	R403 A426 R427 I429 F458 D463	I401-R403 HydrophobicContact CB-CG 4.11Å; I401-R403 HydrophobicContact CG2-CG 3.49Å; I401-R403 VanDerWaalsContact CG2-CG 3.49Å; I401-A426 VanDerWaalsContact O-CA 3.23Å; I401-A426 WeakPolarHBondContact O-CA 3.19Å; I401-R427 PolarHBondContact N-O 3.38Å; I401-R427 PolarHBondContact O-N 2.89Å; I401-R427 VanDerWaalsContact O-N 3.1Å; I401-I429 HydrophobicContact CD1-CD1 3.66Å; I401-I429 HydrophobicContact CD1-CG1 3.89Å; I401-I429 HydrophobicContact CG1-CD1 3.67Å; I401-I429 HydrophobicContact CG1-CG1 3.95Å; I401-F458 HydrophobicContact CD1-CB 4.45Å; I401-F458 WeakPolarHBondContact CD1-O 3.43Å; I401-F458 HydrophobicContact CG2-CB 4.28Å; I401-D463 WeakPolarHBondContact CA-OD2 3.1Å; I401-D463 WeakPolarHBondContact CG2-OD2 3.46Å
402	H	91	Very high	93.1	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.131	C	C	.	.			trans	-82.6	-39.8	178	-165.4	-91.1	0	0	0	112.9	M392 D404 L405 V420 A421 F423 L425 D463	M392-H402 HydrophobicContact CE-CB 4.02Å; M392-H402 HydrophobicContact SD-CB 4.41Å; H402-D404 VanDerWaalsContact ND1-C 3.33Å; H402-D404 PolarHBondContact O-N 3.4Å; H402-L405 PolarHBondContact ND1-N 3.27Å; H402-V420 WeakPolarHBondContact NE2-CG1 3.27Å; H402-A421 PolarHBondContact CE1-O 2.95Å; H402-A421 PolarHBondContact NE2-O 3.42Å; H402-F423 AromaticContact CD2-CD1 3.91Å; H402-F423 AromaticContact CD2-CE1 3.96Å; H402-L425 CarbonylContact O-C 3.54Å; H402-D463 PolarHBondContact N-OD2 3.39Å
403	R	89.7	Confident	92.7	Very high	17 Å²	17	27.5 Å²	27.5	6%	0.064	13%	0.133	C	C	.	.	S	Bend	trans	63	-16.5	178.9	-57.2	-167.9	-69.2	140.1	-1.6	117.6	I401 L425 F458 D463	I401-R403 HydrophobicContact CB-CG 4.11Å; I401-R403 HydrophobicContact CG2-CG 3.49Å; I401-R403 VanDerWaalsContact CG2-CG 3.49Å; R403-L425 HydrophobicContact CB-CB 4.35Å; R403-L425 PolarHBondContact NE-O 3.37Å; R403-L425 PolarHBondContact NH2-O 2.9Å; R403-F458 HydrophobicContact CB-CD1 4.07Å; R403-F458 HydrophobicContact CB-CE1 4.48Å; R403-F458 HydrophobicContact CG-CB 3.88Å; R403-F458 HydrophobicContact CG-CD1 3.83Å; R403-F458 HydrophobicContact CG-CG 3.94Å; R403-D463 WeakPolarHBondContact CA-OD1 3.45Å; R403-D463 PolarHBondContact N-OD1 2.95Å
404	D	91.3	Very high	92.1	Very high	25 Å²	25	30.6 Å²	30.6	13%	0.134	15%	0.15	C	C	.	.			trans	-133.5	44.4	176.5	-164.8	22.6	0	0	0	112.5	H402 A406 R408 N409 L425 P444	H402-D404 VanDerWaalsContact ND1-C 3.33Å; H402-D404 PolarHBondContact O-N 3.4Å; D404-A406 PolarHBondContact O-N 3.3Å; D404-R408 IonicContact OD1-CZ 2.85Å; D404-R408 IonicContact OD1-NE 2.81Å; D404-R408 IonicContact OD1-NH2 2.87Å; D404-R408 PolarHBondContact OD1-NH2 3Å; D404-N409 PolarHBondContact O-ND2 2.8Å; D404-N409 PolarHBondContact OD2-ND2 2.75Å; D404-L425 HydrophobicContact CB-CB 4.47Å; D404-L425 HydrophobicContact CB-CD1 3.82Å; D404-P444 VanDerWaalsContact OD1-CG 3.31Å; D404-P444 WeakPolarHBondContact OD1-CG 3.19Å
405	L	96	Very high	91.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.166	C	C	.	.			trans	-72.4	122.3	177	-178.1	63.6	0	0	0	111	V388 M392 H402 V420 A466 F467 L470 F528	V388-L405 HydrophobicContact CG1-CD1 4.13Å; M392-L405 HydrophobicContact CE-CD2 4.12Å; M392-L405 HydrophobicContact CG-CD1 4.38Å; M392-L405 HydrophobicContact CG-CD2 3.83Å; M392-L405 HydrophobicContact SD-CD1 3.89Å; M392-L405 HydrophobicContact SD-CD2 3.78Å; M392-L405 HydrophobicContact SD-CG 4.38Å; H402-L405 PolarHBondContact ND1-N 3.27Å; L405-V420 HydrophobicContact CD1-CG1 3.96Å; L405-A466 HydrophobicContact CB-CB 4.03Å; L405-F467 HydrophobicContact CD2-CB 3.81Å; L405-F467 HydrophobicContact CD2-CD2 4.22Å; L405-L470 HydrophobicContact CD1-CD2 4.12Å; L405-L470 HydrophobicContact CG-CD2 4.25Å; L405-F528 HydrophobicContact CD2-CZ 4.41Å
406	A	96.7	Very high	91.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.17	C	C	.	.	S	Bend	trans	-168.8	165.9	-179.5	0	0	0	0	0	110.8	D404 R408 N409 C410 W447	D404-A406 PolarHBondContact O-N 3.3Å; A406-R408 HydrophobicContact CB-CG 3.76Å; A406-R408 VanDerWaalsContact CB-NH1 3.3Å; A406-R408 PolarHBondContact O-N 3.29Å; A406-N409 CarbonylContact O-C 3.51Å; A406-N409 PolarHBondContact O-N 3.1Å; A406-C410 PolarHBondContact O-N 3.29Å; A406-C410 PolarHBondContact O-SG 3.14Å; A406-W447 HydrophobicContact CB-CD2 4.33Å; A406-W447 HydrophobicContact CB-CG 4.18Å
407	A	97.6	Very high	91.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-64.3	-27.8	-177.5	0	0	0	0	0	113.1	L364 L365 N409 C410 L470 E473	L364-A407 HydrophobicContact CB-CB 4.48Å; L364-A407 WeakPolarHBondContact CB-O 3.4Å; L364-A407 HydrophobicContact CG-CB 4.47Å; L364-A407 PolarHBondContact N-O 3.18Å; L365-A407 HydrophobicContact CB-CB 3.73Å; L365-A407 HydrophobicContact CD1-CB 4.23Å; L365-A407 PolarHBondContact N-O 2.94Å; L365-A407 VanDerWaalsContact N-O 3.1Å; A407-N409 PolarHBondContact O-N 2.87Å; A407-C410 PolarHBondContact O-N 3.22Å; A407-L470 HydrophobicContact CB-CD1 3.66Å; A407-E473 HydrophobicContact CB-CB 4.1Å; A407-E473 HydrophobicContact CB-CG 4.47Å; A407-E473 PolarHBondContact N-OE2 2.95Å
408	R	94.8	Very high	91.4	Very high	67 Å²	67	27.7 Å²	27.7	25%	0.253	14%	0.141	S	C	.	.	G	3₁₀ helix	trans	-62.2	-24.4	171.9	54.3	162.7	179.4	-67.6	-10.3	114.3	N363 L365 D404 A406	N363-R408 WeakPolarHBondContact CB-O 3.46Å; L365-R408 HydrophobicContact CD2-CB 4.29Å; D404-R408 IonicContact OD1-CZ 2.85Å; D404-R408 IonicContact OD1-NE 2.81Å; D404-R408 IonicContact OD1-NH2 2.87Å; D404-R408 PolarHBondContact OD1-NH2 3Å; A406-R408 HydrophobicContact CB-CG 3.76Å; A406-R408 VanDerWaalsContact CB-NH1 3.3Å; A406-R408 PolarHBondContact O-N 3.29Å
409	N	95	Very high	91.8	Very high	16 Å²	16	24.4 Å²	24.4	9%	0.086	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-112.6	8.8	-174.1	-64.9	-3.6	0	0	0	111.4	D404 A406 A407 A421	D404-N409 PolarHBondContact O-ND2 2.8Å; D404-N409 PolarHBondContact OD2-ND2 2.75Å; A406-N409 CarbonylContact O-C 3.51Å; A406-N409 PolarHBondContact O-N 3.1Å; A407-N409 PolarHBondContact O-N 2.87Å; N409-A421 PolarHBondContact O-N 3.24Å
410	C	97	Very high	92.3	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	131.5	163	-58.4	0	0	0	0	107.2	N363 L364 A406 A407 I418	N363-C410 CarbonylContact C-O 3.53Å; N363-C410 WeakPolarHBondContact CA-O 3.42Å; L364-C410 HydrophobicContact CB-CB 3.9Å; L364-C410 HydrophobicContact CD2-CB 3.99Å; L364-C410 PolarHBondContact N-O 3.11Å; A406-C410 PolarHBondContact O-N 3.29Å; A406-C410 PolarHBondContact O-SG 3.14Å; A407-C410 PolarHBondContact O-N 3.22Å; C410-I418 HydrophobicContact CB-CG2 4.01Å
411	L	96	Very high	92.5	Very high	47 Å²	47	20.9 Å²	20.9	25%	0.246	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	148	178.9	-59.1	-174.2	0	0	0	111.3	V340 M359 G362 N363 I418 K419 A421	V340-L411 HydrophobicContact CG2-CD1 4.08Å; M359-L411 HydrophobicContact CB-CB 3.66Å; M359-L411 HydrophobicContact CB-CD1 4.01Å; M359-L411 HydrophobicContact CB-CG 4.45Å; M359-L411 HydrophobicContact CE-CB 4.11Å; M359-L411 WeakPolarHBondContact CE-O 3.44Å; M359-L411 HydrophobicContact CG-CB 3.67Å; M359-L411 HydrophobicContact CG-CD1 3.88Å; M359-L411 HydrophobicContact CG-CG 4.44Å; G362-L411 CarbonylContact O-C 3.53Å; G362-L411 VanDerWaalsContact O-CA 3.27Å; G362-L411 WeakPolarHBondContact O-CA 3.44Å; N363-L411 HydrophobicContact CB-CD2 3.96Å; L411-I418 WeakPolarHBondContact O-CA 3.43Å; L411-K419 PolarHBondContact N-O 3.18Å; L411-K419 PolarHBondContact O-N 3.24Å; L411-A421 HydrophobicContact CD1-CB 3.92Å; L411-A421 HydrophobicContact CG-CB 3.83Å
412	V	95.7	Very high	92	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	126.1	-176.5	-167.4	0	0	0	0	109.7	M359 N361 G362 L364 Y367 T417 I418	M359-V412 CarbonylContact C-O 3.55Å; N361-V412 WeakPolarHBondContact CA-O 3.14Å; N361-V412 HydrophobicContact CB-CB 3.83Å; N361-V412 HydrophobicContact CB-CG1 3.91Å; N361-V412 WeakPolarHBondContact CB-O 3.38Å; N361-V412 PolarHBondContact N-O 3.17Å; G362-V412 PolarHBondContact O-N 3.04Å; L364-V412 HydrophobicContact CB-CG2 3.96Å; L364-V412 HydrophobicContact CD1-CG2 3.99Å; Y367-V412 HydrophobicContact CD1-CG1 4.22Å; Y367-V412 HydrophobicContact CD1-CG2 4.25Å; Y367-V412 HydrophobicContact CD2-CB 4.1Å; Y367-V412 HydrophobicContact CD2-CG1 3.94Å; Y367-V412 HydrophobicContact CD2-CG2 4.18Å; Y367-V412 HydrophobicContact CE1-CG1 4.16Å; Y367-V412 HydrophobicContact CE2-CB 4.5Å; Y367-V412 HydrophobicContact CE2-CG1 3.89Å; Y367-V412 HydrophobicContact CG-CB 4.25Å; Y367-V412 HydrophobicContact CG-CG1 4.13Å; Y367-V412 HydrophobicContact CG-CG2 3.83Å; V412-T417 WeakPolarHBondContact CA-O 3.5Å; V412-I418 HydrophobicContact CB-CD1 4.28Å; V412-I418 HydrophobicContact CG1-CD1 4.05Å; V412-I418 HydrophobicContact CG2-CD1 3.79Å
413	G	89.9	Confident	90.9	Very high	7 Å²	7	23.5 Å²	23.5	7%	0.072	12%	0.123	C	C	.	.			trans	-101.2	-163.3	175	0	0	0	0	0	111.5	M359 N361 T417	M359-G413 VanDerWaalsContact CE-N 3.31Å; N361-G413 PolarHBondContact ND2-O 3.13Å; G413-T417 PolarHBondContact N-O 3.35Å
414	T	82.9	Confident	89.4	Confident	85 Å²	85	23.3 Å²	23.3	52%	0.521	13%	0.126	S	C	.	.	G	3₁₀ helix	trans	-59.1	148.8	170.2	46.5	0	0	0	0	111.3	H416 T417	T414-H416 VanDerWaalsContact C-N 3.31Å; T414-H416 PolarHBondContact O-N 2.96Å; T414-T417 WeakPolarHBondContact O-CB 3.47Å; T414-T417 PolarHBondContact O-N 3.07Å; T414-T417 VanDerWaalsContact O-N 3.09Å; T414-T417 PolarHBondContact O-OG1 2.96Å
415	Q	80.5	Confident	87.7	Confident	97 Å²	97	23.6 Å²	23.6	45%	0.453	13%	0.127	S	C	.	.	G	3₁₀ helix	trans	53.1	45	170.3	-54.6	174.6	17.4	0	0	113.3	Y179 R260 T417	Y179-Q415 VanDerWaalsContact OH-C 3.24Å; Y179-Q415 PolarHBondContact OH-O 3.45Å; R260-Q415 VanDerWaalsContact CB-OE1 3.3Å; Q415-T417 PolarHBondContact O-N 3.03Å
416	H	88.8	Confident	85.9	Confident	23 Å²	23	23.8 Å²	23.8	11%	0.106	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	55.5	22.3	-179.9	-54.7	164.6	0	0	0	115.3	Y179 Y367 V380 M384 Q387 T414 I418	Y179-H416 HydrophobicContact CE2-CB 4.32Å; Y179-H416 AromaticContact CE2-ND1 3.36Å; Y179-H416 WeakPolarHBondContact CE2-ND1 3.47Å; Y179-H416 AromaticContact CZ-ND1 3.9Å; Y367-H416 PolarHBondContact OH-CD2 3.08Å; Y367-H416 VanDerWaalsContact OH-CD2 3.24Å; Y367-H416 PolarHBondContact OH-NE2 3.3Å; V380-H416 VanDerWaalsContact CG1-ND1 3.28Å; V380-H416 WeakPolarHBondContact CG1-ND1 3.37Å; M384-H416 HydrophobicContact CE-CB 3.82Å; Q387-H416 PolarHBondContact NE2-O 2.87Å; T414-H416 VanDerWaalsContact C-N 3.31Å; T414-H416 PolarHBondContact O-N 2.96Å; H416-I418 PolarHBondContact O-N 3.09Å
417	T	90.8	Very high	84.4	Confident	41 Å²	41	26.5 Å²	26.5	25%	0.252	14%	0.139	S	C	.	.			trans	-64.1	123.6	173.4	-56.4	0	0	0	0	109.9	V412 G413 T414 Q415	V412-T417 WeakPolarHBondContact CA-O 3.5Å; G413-T417 PolarHBondContact N-O 3.35Å; T414-T417 WeakPolarHBondContact O-CB 3.47Å; T414-T417 PolarHBondContact O-N 3.07Å; T414-T417 VanDerWaalsContact O-N 3.09Å; T414-T417 PolarHBondContact O-OG1 2.96Å; Q415-T417 PolarHBondContact O-N 3.03Å
418	I	96.9	Very high	82.5	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	133.9	178.6	-52.2	-59	0	0	0	110.5	N338 L364 M384 Q387 V388 C410 L411 V412 H416	N338-I418 WeakPolarHBondContact CA-O 3.45Å; N338-I418 WeakPolarHBondContact CB-O 3.42Å; N338-I418 PolarHBondContact ND2-O 3.15Å; L364-I418 HydrophobicContact CD1-CD1 4.02Å; M384-I418 HydrophobicContact CB-CD1 4.34Å; M384-I418 HydrophobicContact CB-CG1 3.89Å; M384-I418 HydrophobicContact CG-CD1 3.92Å; M384-I418 HydrophobicContact CG-CG1 3.83Å; M384-I418 HydrophobicContact SD-CD1 4.39Å; Q387-I418 HydrophobicContact CB-CB 4.05Å; Q387-I418 HydrophobicContact CB-CG1 4.48Å; V388-I418 HydrophobicContact CG2-CB 4.44Å; V388-I418 HydrophobicContact CG2-CG2 3.52Å; C410-I418 HydrophobicContact CB-CG2 4.01Å; L411-I418 WeakPolarHBondContact O-CA 3.43Å; V412-I418 HydrophobicContact CB-CD1 4.28Å; V412-I418 HydrophobicContact CG1-CD1 4.05Å; V412-I418 HydrophobicContact CG2-CD1 3.79Å; H416-I418 PolarHBondContact O-N 3.09Å
419	K	96.3	Very high	81	Confident	3 Å²	3	27.1 Å²	27.1	1%	0.013	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	133.3	171.6	-55.3	-167.8	179.3	-159.9	0	111.6	S264 P337 N338 V340 E357 M359 L411	S264-K419 PolarHBondContact OG-NZ 3.03Å; P337-K419 WeakPolarHBondContact O-CE 3.19Å; P337-K419 WeakPolarHBondContact O-CG 3.47Å; N338-K419 WeakPolarHBondContact O-CA 3.27Å; V340-K419 HydrophobicContact CG2-CB 3.71Å; E357-K419 WeakPolarHBondContact OE1-CD 3.14Å; E357-K419 IonicContact OE1-NZ 3.72Å; E357-K419 PolarHBondContact OE1-NZ 3.48Å; E357-K419 WeakPolarHBondContact OE2-CE 3.33Å; E357-K419 IonicContact OE2-NZ 2.73Å; E357-K419 PolarHBondContact OE2-NZ 3.22Å; M359-K419 HydrophobicContact CE-CB 3.82Å; M359-K419 HydrophobicContact CE-CD 3.98Å; M359-K419 HydrophobicContact CE-CG 3.6Å; M359-K419 HydrophobicContact SD-CB 4.47Å; M359-K419 HydrophobicContact SD-CD 3.85Å; M359-K419 HydrophobicContact SD-CG 4.17Å; L411-K419 PolarHBondContact N-O 3.18Å; L411-K419 PolarHBondContact O-N 3.24Å
420	V	95.6	Very high	79.1	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	141.9	176.5	-169	0	0	0	0	110.3	N338 L339 V340 V388 M392 H402 L405 F423	N338-V420 PolarHBondContact O-N 3.16Å; L339-V420 HydrophobicContact CD2-CB 3.84Å; L339-V420 HydrophobicContact CD2-CG2 4.29Å; V340-V420 PolarHBondContact N-O 3.22Å; V388-V420 HydrophobicContact CG1-CG2 3.89Å; M392-V420 HydrophobicContact SD-CG1 4.45Å; H402-V420 WeakPolarHBondContact NE2-CG1 3.27Å; L405-V420 HydrophobicContact CD1-CG1 3.96Å; V420-F423 WeakPolarHBondContact O-CZ 3.49Å
421	A	90.9	Very high	77.1	Confident	10 Å²	10	40.7 Å²	40.7	8%	0.083	21%	0.208	C	C	.	.			trans	-146.2	173.7	-166.6	0	0	0	0	0	114.4	V340 H402 N409 L411	V340-A421 HydrophobicContact CB-CB 4.31Å; V340-A421 HydrophobicContact CG2-CB 3.68Å; H402-A421 PolarHBondContact CE1-O 2.95Å; H402-A421 PolarHBondContact NE2-O 3.42Å; N409-A421 PolarHBondContact O-N 3.24Å; L411-A421 HydrophobicContact CD1-CB 3.92Å; L411-A421 HydrophobicContact CG-CB 3.83Å
422	D	78.3	Confident	75.3	Confident	52 Å²	52	44.1 Å²	44.1	28%	0.278	23%	0.227	S	C	.	.			trans	61.7	54	-176.4	-152.6	9.7	0	0	0	114.5	K312 G424	K312-D422 IonicContact NZ-OD1 3.79Å; K312-D422 PolarHBondContact NZ-OD1 3.39Å; D422-G424 PolarHBondContact O-N 3.3Å
423	F	68.2	Low	73.9	Confident	4 Å²	4	49.7 Å²	49.7	2%	0.018	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-62	9.6	171.6	-51.8	-72.6	0	0	0	114.6	E327 M331 L339 L395 H402 V420 L425 A426	E327-F423 HydrophobicContact CG-CB 4.44Å; M331-F423 HydrophobicContact CE-CD2 3.81Å; M331-F423 HydrophobicContact CE-CE2 3.99Å; M331-F423 HydrophobicContact CG-CB 4.22Å; M331-F423 HydrophobicContact CG-CD2 3.66Å; M331-F423 HydrophobicContact CG-CE2 4.43Å; M331-F423 HydrophobicContact CG-CG 4.25Å; M331-F423 HydrophobicContact SD-CD2 3.8Å; L339-F423 HydrophobicContact CB-CZ 4.15Å; L339-F423 HydrophobicContact CD2-CE1 4.28Å; L339-F423 HydrophobicContact CD2-CZ 4.05Å; L339-F423 HydrophobicContact CG-CZ 4.48Å; L395-F423 HydrophobicContact CD1-CE1 4.26Å; L395-F423 HydrophobicContact CD2-CE1 4.42Å; H402-F423 AromaticContact CD2-CD1 3.91Å; H402-F423 AromaticContact CD2-CE1 3.96Å; V420-F423 WeakPolarHBondContact O-CZ 3.49Å; F423-L425 PolarHBondContact O-N 3.3Å; F423-L425 VanDerWaalsContact O-N 3.14Å; F423-A426 HydrophobicContact CB-CB 3.83Å; F423-A426 HydrophobicContact CD1-CB 4.36Å; F423-A426 WeakPolarHBondContact O-CB 3.23Å; F423-A426 PolarHBondContact O-N 2.96Å
424	G	57.8	Low	72.9	Confident	13 Å²	13	52.4 Å²	52.4	13%	0.134	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-63.6	-13.4	172.5	0	0	0	0	0	113.9	Y294 E327 D422	Y294-G424 PolarHBondContact OH-O 2.82Å; Y294-G424 VanDerWaalsContact OH-O 3.09Å; E327-G424 VanDerWaalsContact CD-CA 3.48Å; E327-G424 VanDerWaalsContact CD-N 3.34Å; E327-G424 PolarHBondContact OE1-N 3.31Å; E327-G424 VanDerWaalsContact OE2-CA 3.27Å; E327-G424 WeakPolarHBondContact OE2-CA 3.49Å; D422-G424 PolarHBondContact O-N 3.3Å
425	L	56.8	Low	72.6	Confident	31 Å²	31	50.6 Å²	50.6	16%	0.162	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-106.5	5.6	164.6	-74.4	173.8	0	0	0	113.8	Y294 H402 R403 D404 F423	Y294-L425 VanDerWaalsContact OH-CD2 3.26Å; Y294-L425 WeakPolarHBondContact OH-CD2 3.41Å; Y294-L425 WeakPolarHBondContact OH-CG 3.48Å; H402-L425 CarbonylContact O-C 3.54Å; R403-L425 HydrophobicContact CB-CB 4.35Å; R403-L425 PolarHBondContact NE-O 3.37Å; R403-L425 PolarHBondContact NH2-O 2.9Å; D404-L425 HydrophobicContact CB-CB 4.47Å; D404-L425 HydrophobicContact CB-CD1 3.82Å; F423-L425 PolarHBondContact O-N 3.3Å; F423-L425 VanDerWaalsContact O-N 3.14Å
426	A	58.5	Low	72.6	Confident	3 Å²	3	52.9 Å²	52.9	3%	0.025	26%	0.259	C	S	.	.			trans	-65.9	152.4	175.2	0	0	0	0	0	112.1	L330 I401 F423	L330-A426 HydrophobicContact CD1-CB 4.48Å; I401-A426 VanDerWaalsContact O-CA 3.23Å; I401-A426 WeakPolarHBondContact O-CA 3.19Å; F423-A426 HydrophobicContact CB-CB 3.83Å; F423-A426 HydrophobicContact CD1-CB 4.36Å; F423-A426 WeakPolarHBondContact O-CB 3.23Å; F423-A426 PolarHBondContact O-N 2.96Å
427	R	63.2	Low	72.1	Confident	57 Å²	57	52 Å²	52	22%	0.215	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	132.5	164.8	-69.2	-63.8	-173.7	-144.5	0.3	108.7	I401 Y435	I401-R427 PolarHBondContact N-O 3.38Å; I401-R427 PolarHBondContact O-N 2.89Å; I401-R427 VanDerWaalsContact O-N 3.1Å; R427-Y435 HydrophobicContact CB-CD2 4.31Å; R427-Y435 HydrophobicContact CG-CD2 3.93Å; R427-Y435 HydrophobicContact CG-CE2 3.79Å; R427-Y435 HydrophobicContact CG-CG 4.37Å
428	C	58.1	Low	71.4	Confident	60 Å²	60	55.6 Å²	55.6	41%	0.405	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	143.5	162.5	-177.8	0	0	0	0	109.3	L330 F400	L330-C428 HydrophobicContact CD2-CB 3.96Å; F400-C428 HydrophobicContact CD1-CB 4.45Å; F400-C428 HydrophobicContact CD2-CB 4.5Å; F400-C428 HydrophobicContact CE1-CB 4.15Å; F400-C428 HydrophobicContact CE2-CB 4.17Å; F400-C428 HydrophobicContact CZ-CB 4Å
429	I	63.6	Low	70.2	Confident	21 Å²	21	62.3 Å²	62.3	11%	0.108	30%	0.302	C	S	.	.			trans	-105	118.5	175.6	-52.4	177.2	0	0	0	109.8	N399 I401 D432	N399-I429 HydrophobicContact CB-CB 4.37Å; N399-I429 PolarHBondContact O-N 2.9Å; I401-I429 HydrophobicContact CD1-CD1 3.66Å; I401-I429 HydrophobicContact CD1-CG1 3.89Å; I401-I429 HydrophobicContact CG1-CD1 3.67Å; I401-I429 HydrophobicContact CG1-CG1 3.95Å; I429-D432 WeakPolarHBondContact CG2-O 3.43Å
430	E	56	Low	69.1	Low	157 Å²	157	65.8 Å²	65.8	73%	0.734	34%	0.338	S	S	*	.	S	Bend	trans	-84.7	-27.9	175.1	-67.1	-175.9	-170.8	0	0	114.8
431	R	54.3	Low	67.9	Low	144 Å²	144	67.6 Å²	67.6	54%	0.543	35%	0.353	S	S	.	.	S	Bend	trans	-144.8	-69.6	-164.4	-56.8	179.8	-159	167.4	14.7	113.9	C609	R431-C609 PolarHBondContact NH1-SG 3.23Å; R431-C609 PolarHBondContact NH2-SG 3.3Å
432	D	58.6	Low	67.1	Low	119 Å²	119	75.3 Å²	75.3	64%	0.636	39%	0.385	S	S	*	.	S	Bend	trans	-91	115.2	-177.6	-65	-34.5	0	0	0	109.7	I429 T434	I429-D432 WeakPolarHBondContact CG2-O 3.43Å; D432-T434 PolarHBondContact O-N 2.93Å
433	L	65.7	Low	67.2	Low	117 Å²	117	74.6 Å²	74.6	61%	0.613	38%	0.379	S	S	*	.	S	Bend	trans	-59.6	14.1	-175.8	-66	174.1	0	0	0	116.4	S459	L433-S459 VanDerWaalsContact O-CB 3.24Å; L433-S459 WeakPolarHBondContact O-CB 3.35Å
434	T	69.7	Low	68.3	Low	64 Å²	64	75.6 Å²	75.6	39%	0.393	39%	0.386	S	S	.	.			trans	-134.7	116.7	175.5	58.3	0	0	0	0	111.2	D432 F458	D432-T434 PolarHBondContact O-N 2.93Å; T434-F458 CarbonylContact C-O 3.57Å; T434-F458 VanDerWaalsContact CA-O 3.24Å; T434-F458 WeakPolarHBondContact CA-O 3.34Å
435	Y	75.8	Confident	70	Confident	46 Å²	46	77.3 Å²	77.3	18%	0.18	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	128.9	166	178.1	-95.7	0	0	0	110.2	R427 A437 H438 F458	R427-Y435 HydrophobicContact CB-CD2 4.31Å; R427-Y435 HydrophobicContact CG-CD2 3.93Å; R427-Y435 HydrophobicContact CG-CE2 3.79Å; R427-Y435 HydrophobicContact CG-CG 4.37Å; Y435-A437 HydrophobicContact CD1-CB 4.25Å; Y435-A437 HydrophobicContact CE1-CB 3.71Å; Y435-H438 PolarHBondContact OH-CE1 3.05Å; Y435-H438 VanDerWaalsContact OH-CE1 3.25Å; Y435-H438 PolarHBondContact OH-NE2 3.38Å; Y435-F458 PolarHBondContact N-O 3.24Å; Y435-F458 PolarHBondContact O-N 2.82Å
436	R	81.5	Confident	71.9	Confident	145 Å²	145	76.8 Å²	76.8	55%	0.547	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	115.3	171.5	-165.2	172.3	-175.5	-138	-8.1	111	Y455 N456 L457	R436-Y455 PolarHBondContact NE-O 3.05Å; R436-N456 CarbonylContact C-O 3.56Å; R436-N456 WeakPolarHBondContact CA-O 3.45Å; R436-L457 HydrophobicContact CB-CD2 3.9Å; R436-L457 HydrophobicContact CG-CD2 3.86Å
437	A	77.2	Confident	73.7	Confident	6 Å²	6	78.4 Å²	78.4	5%	0.05	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-79.7	156.6	179.7	0	0	0	0	0	112.9	Y435 F443 N456 F458	Y435-A437 HydrophobicContact CD1-CB 4.25Å; Y435-A437 HydrophobicContact CE1-CB 3.71Å; A437-F443 HydrophobicContact CB-CE1 4.24Å; A437-F443 HydrophobicContact CB-CE2 4.39Å; A437-F443 HydrophobicContact CB-CZ 3.52Å; A437-N456 HydrophobicContact CB-CB 4.2Å; A437-N456 PolarHBondContact N-O 2.95Å; A437-N456 WeakPolarHBondContact O-CB 3.42Å; A437-F458 HydrophobicContact CB-CD2 4.15Å; A437-F458 HydrophobicContact CB-CE2 3.88Å
438	H	76.2	Confident	75.2	Confident	115 Å²	115	76 Å²	76	53%	0.532	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-64.4	144.9	-175.3	-20.4	-71.3	0	0	0	112	Y435 G440 A441	Y435-H438 PolarHBondContact OH-CE1 3.05Å; Y435-H438 VanDerWaalsContact OH-CE1 3.25Å; Y435-H438 PolarHBondContact OH-NE2 3.38Å; H438-G440 PolarHBondContact O-N 3.24Å; H438-A441 VanDerWaalsContact O-CB 3.26Å; H438-A441 WeakPolarHBondContact O-CB 3.42Å; H438-A441 PolarHBondContact O-N 2.89Å
439	E	73.1	Confident	77.1	Confident	142 Å²	142	73.1 Å²	73.1	66%	0.664	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	133.5	173.3	-75	-171.7	-146	0	0	110.8	A441 R1191	E439-A441 VanDerWaalsContact C-N 3.34Å; E439-R1191 IonicContact OE2-NH1 2.69Å; E439-R1191 IonicContact OE2-NH2 3.25Å
440	G	71.3	Confident	78.6	Confident	76 Å²	76	72.2 Å²	72.2	78%	0.784	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.1	0.3	-177.7	0	0	0	0	0	115.8	H438	H438-G440 PolarHBondContact O-N 3.24Å
441	A	71.1	Confident	80.3	Confident	37 Å²	37	65.1 Å²	65.1	31%	0.306	33%	0.328	S	S	.	.			trans	-60.7	154.7	165.5	0	0	0	0	0	111.3	H438 E439 F443	H438-A441 VanDerWaalsContact O-CB 3.26Å; H438-A441 WeakPolarHBondContact O-CB 3.42Å; H438-A441 PolarHBondContact O-N 2.89Å; E439-A441 VanDerWaalsContact C-N 3.34Å; A441-F443 HydrophobicContact CB-CE1 4.19Å; A441-F443 HydrophobicContact CB-CE2 3.83Å; A441-F443 HydrophobicContact CB-CZ 3.38Å
442	K	75.3	Confident	82.1	Confident	173 Å²	173	58.2 Å²	58.2	75%	0.752	30%	0.302	S	S	*	.			trans	-112.1	138.4	-175.8	-62.6	177.7	-172.9	167.9	0	110.7
443	F	79.3	Confident	83.7	Confident	37 Å²	37	54.8 Å²	54.8	16%	0.162	28%	0.284	C	S	.	.			trans	-135.7	156.1	-177	-53.7	-62.7	0	0	0	111.1	A437 A441 I445 T448 F458	A437-F443 HydrophobicContact CB-CE1 4.24Å; A437-F443 HydrophobicContact CB-CE2 4.39Å; A437-F443 HydrophobicContact CB-CZ 3.52Å; A441-F443 HydrophobicContact CB-CE1 4.19Å; A441-F443 HydrophobicContact CB-CE2 3.83Å; A441-F443 HydrophobicContact CB-CZ 3.38Å; F443-I445 VanDerWaalsContact C-N 3.33Å; F443-I445 PolarHBondContact O-N 2.99Å; F443-T448 HydrophobicContact CB-CG2 4.38Å; F443-T448 WeakPolarHBondContact CB-OG1 3.47Å; F443-F458 HydrophobicContact CB-CZ 4.47Å; F443-F458 HydrophobicContact CD1-CE1 4.12Å; F443-F458 HydrophobicContact CD1-CE2 4.19Å; F443-F458 AromaticContact CD1-CZ 3.46Å; F443-F458 HydrophobicContact CD1-CZ 3.46Å; F443-F458 VanDerWaalsContact CD1-CZ 3.46Å; F443-F458 HydrophobicContact CD2-CE2 4.38Å; F443-F458 AromaticContact CD2-CZ 3.83Å; F443-F458 HydrophobicContact CD2-CZ 3.83Å; F443-F458 HydrophobicContact CE1-CE1 4.43Å; F443-F458 AromaticContact CE1-CE2 3.79Å; F443-F458 HydrophobicContact CE1-CE2 3.79Å; F443-F458 AromaticContact CE1-CZ 3.54Å; F443-F458 HydrophobicContact CE1-CZ 3.54Å; F443-F458 AromaticContact CE2-CE2 3.98Å; F443-F458 HydrophobicContact CE2-CE2 3.98Å; F443-F458 AromaticContact CE2-CZ 3.89Å; F443-F458 HydrophobicContact CE2-CZ 3.89Å; F443-F458 HydrophobicContact CG-CE1 4.41Å; F443-F458 HydrophobicContact CG-CE2 4.48Å; F443-F458 AromaticContact CG-CZ 3.62Å; F443-F458 HydrophobicContact CG-CZ 3.62Å; F443-F458 AromaticContact CZ-CE2 3.67Å; F443-F458 HydrophobicContact CZ-CE2 3.67Å; F443-F458 AromaticContact CZ-CZ 3.76Å; F443-F458 HydrophobicContact CZ-CZ 3.76Å
444	P	90.7	Very high	84.8	Confident	25 Å²	25	51 Å²	51	16%	0.162	27%	0.265	C	S	.	.			trans	-73	81.9	177.2	35.2	-42.4	0	0	0	110.7	D404 K446 W447 T448	D404-P444 VanDerWaalsContact OD1-CG 3.31Å; D404-P444 WeakPolarHBondContact OD1-CG 3.19Å; P444-K446 PolarHBondContact O-N 3.31Å; P444-W447 HydrophobicContact CB-CB 4.32Å; P444-W447 HydrophobicContact CB-CE3 3.9Å; P444-W447 HydrophobicContact CG-CB 4.11Å; P444-W447 WeakPolarHBondContact O-CA 3.36Å; P444-W447 PolarHBondContact O-N 3.37Å; P444-T448 PolarHBondContact O-N 3.39Å; P444-T448 VanDerWaalsContact O-N 3.1Å; P444-T448 PolarHBondContact O-OG1 3.19Å
445	I	93.4	Very high	85.5	Confident	49 Å²	49	50 Å²	50	25%	0.251	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-39.6	-41.1	-169.5	-65.9	169.6	0	0	0	115.2	F443 W447 T448 L453 L487 V490	F443-I445 VanDerWaalsContact C-N 3.33Å; F443-I445 PolarHBondContact O-N 2.99Å; I445-W447 VanDerWaalsContact C-N 3.32Å; I445-W447 PolarHBondContact O-N 3.4Å; I445-T448 PolarHBondContact O-N 3.12Å; I445-L453 HydrophobicContact CB-CD2 4.36Å; I445-L453 HydrophobicContact CG1-CD2 4.37Å; I445-L453 HydrophobicContact CG2-CD2 4.05Å; I445-L487 HydrophobicContact CB-CD2 4.38Å; I445-L487 HydrophobicContact CD1-CB 4.26Å; I445-V490 HydrophobicContact CG2-CB 4.2Å; I445-V490 HydrophobicContact CG2-CG1 4.49Å; I445-V490 HydrophobicContact CG2-CG2 4.33Å
446	K	96.5	Very high	86.1	Confident	20 Å²	20	49.1 Å²	49.1	9%	0.087	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-11.9	-179.1	-67.8	-171.3	164.5	-162.9	0	115.3	P444 P481 Y482 V485 L487 V490	P444-K446 PolarHBondContact O-N 3.31Å; K446-P481 HydrophobicContact CB-CB 4.36Å; K446-P481 VanDerWaalsContact CD-O 3.24Å; K446-P481 WeakPolarHBondContact CD-O 3.4Å; K446-P481 WeakPolarHBondContact CE-O 3.48Å; K446-P481 PolarHBondContact NZ-O 3.11Å; K446-Y482 HydrophobicContact CB-CD2 4.05Å; K446-Y482 HydrophobicContact CB-CE2 4.36Å; K446-Y482 HydrophobicContact CD-CD2 4.21Å; K446-Y482 HydrophobicContact CG-CD2 4.01Å; K446-Y482 PolarHBondContact NZ-O 3.11Å; K446-Y482 WeakPolarHBondContact O-CE2 3.37Å; K446-V485 PolarHBondContact NZ-O 3.17Å; K446-V485 VanDerWaalsContact NZ-O 3.09Å; K446-L487 HydrophobicContact CD-CD2 4.06Å; K446-L487 HydrophobicContact CG-CD2 3.87Å; K446-V490 HydrophobicContact CG-CG2 4.14Å
447	W	97.1	Very high	86.5	Confident	36 Å²	36	43 Å²	43	14%	0.136	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-15.4	173.1	-64.8	-104.4	0	0	0	112.4	A406 P444 I445 A466 I469 E473 P481	A406-W447 HydrophobicContact CB-CD2 4.33Å; A406-W447 HydrophobicContact CB-CG 4.18Å; P444-W447 HydrophobicContact CB-CB 4.32Å; P444-W447 HydrophobicContact CB-CE3 3.9Å; P444-W447 HydrophobicContact CG-CB 4.11Å; P444-W447 WeakPolarHBondContact O-CA 3.36Å; P444-W447 PolarHBondContact O-N 3.37Å; I445-W447 VanDerWaalsContact C-N 3.32Å; I445-W447 PolarHBondContact O-N 3.4Å; W447-A466 HydrophobicContact CB-CB 4.4Å; W447-A466 WeakPolarHBondContact O-CB 3.12Å; W447-I469 VanDerWaalsContact CD1-CG2 3.47Å; W447-I469 HydrophobicContact CD2-CG2 4.25Å; W447-I469 HydrophobicContact CG-CB 4.39Å; W447-I469 HydrophobicContact CG-CG2 3.91Å; W447-E473 WeakPolarHBondContact CZ2-OE1 3.37Å; W447-E473 PolarHBondContact NE1-OE2 3.26Å; W447-P481 HydrophobicContact CH2-CG 4.34Å; W447-P481 HydrophobicContact CZ2-CG 3.88Å
448	T	95.2	Very high	87.1	Confident	6 Å²	6	42.9 Å²	42.9	4%	0.037	23%	0.229	C	C	.	.	S	Bend	trans	-75	130.2	-180	-50.1	0	0	0	0	111.8	F443 P444 I445 L453 F458	F443-T448 HydrophobicContact CB-CG2 4.38Å; F443-T448 WeakPolarHBondContact CB-OG1 3.47Å; P444-T448 PolarHBondContact O-N 3.39Å; P444-T448 VanDerWaalsContact O-N 3.1Å; P444-T448 PolarHBondContact O-OG1 3.19Å; I445-T448 PolarHBondContact O-N 3.12Å; T448-L453 HydrophobicContact CG2-CD2 3.94Å; T448-L453 HydrophobicContact CG2-CG 3.91Å; T448-F458 HydrophobicContact CG2-CE1 4.2Å; T448-F458 HydrophobicContact CG2-CZ 4.33Å
449	A	96.6	Very high	87.8	Confident	1 Å²	1	38 Å²	38	1%	0.008	21%	0.208	C	C	.	.			trans	-65.2	157.1	174.9	0	0	0	0	0	113	E451 G452 L453 W465	A449-E451 VanDerWaalsContact C-N 3.32Å; A449-E451 WeakPolarHBondContact CB-OE1 3.36Å; A449-E451 WeakPolarHBondContact CB-OE2 3.26Å; A449-E451 PolarHBondContact O-N 3.05Å; A449-G452 WeakPolarHBondContact O-CA 3.25Å; A449-G452 PolarHBondContact O-N 2.75Å; A449-L453 PolarHBondContact O-N 2.92Å; A449-W465 HydrophobicContact CB-CB 3.72Å; A449-W465 HydrophobicContact CB-CD2 4.03Å; A449-W465 HydrophobicContact CB-CG 3.64Å
450	P	95.2	Very high	88.8	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.006	18%	0.183	C	C	.	.	H	α-helix	trans	-53.9	-41.1	-177.8	-27.4	35.5	0	0	0	114.5	G452 L453 V454 W465 Y491 W520	P450-G452 VanDerWaalsContact C-N 3.31Å; P450-G452 PolarHBondContact O-N 3.34Å; P450-L453 PolarHBondContact O-N 2.96Å; P450-V454 WeakPolarHBondContact O-CG2 3.3Å; P450-V454 PolarHBondContact O-N 3.4Å; P450-W465 HydrophobicContact CG-CE3 4.43Å; P450-W465 HydrophobicContact CG-CH2 3.73Å; P450-W465 HydrophobicContact CG-CZ2 4.22Å; P450-W465 HydrophobicContact CG-CZ3 3.84Å; P450-Y491 HydrophobicContact CB-CE2 4.36Å; P450-W520 HydrophobicContact CB-CE3 4.09Å; P450-W520 HydrophobicContact CB-CH2 3.99Å; P450-W520 HydrophobicContact CB-CZ3 3.74Å; P450-W520 HydrophobicContact CG-CE3 3.78Å; P450-W520 HydrophobicContact CG-CH2 4.49Å; P450-W520 HydrophobicContact CG-CZ3 3.73Å
451	E	93.4	Very high	90	Very high	8 Å²	8	30.8 Å²	30.8	4%	0.037	16%	0.155	C	C	.	.	H	α-helix	trans	-68.4	-28.9	176.7	71	-74.9	-179.4	0	0	113.3	A449 Y455 L457 P522 R525	A449-E451 VanDerWaalsContact C-N 3.32Å; A449-E451 WeakPolarHBondContact CB-OE1 3.36Å; A449-E451 WeakPolarHBondContact CB-OE2 3.26Å; A449-E451 PolarHBondContact O-N 3.05Å; E451-Y455 HydrophobicContact CB-CD2 4.31Å; E451-Y455 WeakPolarHBondContact O-CA 3.46Å; E451-Y455 WeakPolarHBondContact O-CB 3.2Å; E451-Y455 PolarHBondContact O-N 3.1Å; E451-L457 HydrophobicContact CB-CB 4.49Å; E451-L457 HydrophobicContact CG-CB 4.36Å; E451-L457 PolarHBondContact O-N 3.23Å; E451-P522 HydrophobicContact CG-CG 4Å; E451-R525 IonicContact OE1-CZ 3.28Å; E451-R525 IonicContact OE1-NH1 2.67Å; E451-R525 PolarHBondContact OE1-NH1 2.81Å; E451-R525 IonicContact OE1-NH2 2.66Å; E451-R525 IonicContact OE2-CZ 3.08Å; E451-R525 IonicContact OE2-NH1 3.91Å; E451-R525 PolarHBondContact OE2-NH1 2.73Å; E451-R525 IonicContact OE2-NH2 3.79Å; E451-R525 PolarHBondContact OE2-NH2 2.75Å
452	G	91.6	Very high	91.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-71.8	-40.6	171	0	0	0	0	0	112	A449 P450 N456 L457	A449-G452 WeakPolarHBondContact O-CA 3.25Å; A449-G452 PolarHBondContact O-N 2.75Å; P450-G452 VanDerWaalsContact C-N 3.31Å; P450-G452 PolarHBondContact O-N 3.34Å; G452-N456 WeakPolarHBondContact O-CA 3.46Å; G452-N456 PolarHBondContact O-N 3.45Å; G452-L457 WeakPolarHBondContact CA-O 3.37Å; G452-L457 PolarHBondContact N-O 2.98Å
453	L	91	Very high	92.2	Very high	47 Å²	47	21.2 Å²	21.2	25%	0.246	11%	0.107	C	C	.	.	H	α-helix	trans	-67.1	-37	178	-69.5	173.4	0	0	0	113.2	I445 T448 A449 P450 Y491	I445-L453 HydrophobicContact CB-CD2 4.36Å; I445-L453 HydrophobicContact CG1-CD2 4.37Å; I445-L453 HydrophobicContact CG2-CD2 4.05Å; T448-L453 HydrophobicContact CG2-CD2 3.94Å; T448-L453 HydrophobicContact CG2-CG 3.91Å; A449-L453 PolarHBondContact O-N 2.92Å; P450-L453 PolarHBondContact O-N 2.96Å; L453-Y491 HydrophobicContact CB-CD2 4.35Å; L453-Y491 HydrophobicContact CD1-CD2 4.34Å
454	V	88.6	Confident	93.1	Very high	37 Å²	37	19.4 Å²	19.4	22%	0.224	10%	0.099	C	C	.	.	H	α-helix	trans	-95.8	-41.1	-175	-177	0	0	0	0	113.1	P450 Y491	P450-V454 WeakPolarHBondContact O-CG2 3.3Å; P450-V454 PolarHBondContact O-N 3.4Å; V454-Y491 HydrophobicContact CG2-CD2 3.81Å; V454-Y491 HydrophobicContact CG2-CE1 4.36Å; V454-Y491 HydrophobicContact CG2-CE2 3.22Å
455	Y	86.3	Confident	93.5	Very high	43 Å²	43	18.3 Å²	18.3	17%	0.169	9%	0.092	C	C	.	.	H	α-helix	trans	-112.8	-3.3	-169.2	-53.8	-59.4	0	0	0	114.3	R436 E451 L457 P597	R436-Y455 PolarHBondContact NE-O 3.05Å; E451-Y455 HydrophobicContact CB-CD2 4.31Å; E451-Y455 WeakPolarHBondContact O-CA 3.46Å; E451-Y455 WeakPolarHBondContact O-CB 3.2Å; E451-Y455 PolarHBondContact O-N 3.1Å; Y455-L457 HydrophobicContact CD2-CD1 4.15Å; Y455-L457 HydrophobicContact CG-CD1 4.16Å; Y455-L457 PolarHBondContact O-N 2.93Å; Y455-P597 HydrophobicContact CE2-CB 4.23Å; Y455-P597 HydrophobicContact CE2-CG 4.45Å
456	N	87.2	Confident	93.7	Very high	28 Å²	28	16.2 Å²	16.2	15%	0.15	8%	0.082	C	C	.	.			trans	56.8	31.7	-166.4	-60.8	-31.2	0	0	0	112.9	R436 A437 G452 F458	R436-N456 CarbonylContact C-O 3.56Å; R436-N456 WeakPolarHBondContact CA-O 3.45Å; A437-N456 HydrophobicContact CB-CB 4.2Å; A437-N456 PolarHBondContact N-O 2.95Å; A437-N456 WeakPolarHBondContact O-CB 3.42Å; G452-N456 WeakPolarHBondContact O-CA 3.46Å; G452-N456 PolarHBondContact O-N 3.45Å; N456-F458 WeakPolarHBondContact O-CD2 3.48Å
457	L	89.3	Confident	93.8	Very high	15 Å²	15	15.2 Å²	15.2	8%	0.079	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	132.3	179.7	-67.5	169.7	0	0	0	111.2	R436 E451 G452 Y455 P600	R436-L457 HydrophobicContact CB-CD2 3.9Å; R436-L457 HydrophobicContact CG-CD2 3.86Å; E451-L457 HydrophobicContact CB-CB 4.49Å; E451-L457 HydrophobicContact CG-CB 4.36Å; E451-L457 PolarHBondContact O-N 3.23Å; G452-L457 WeakPolarHBondContact CA-O 3.37Å; G452-L457 PolarHBondContact N-O 2.98Å; Y455-L457 HydrophobicContact CD2-CD1 4.15Å; Y455-L457 HydrophobicContact CG-CD1 4.16Å; Y455-L457 PolarHBondContact O-N 2.93Å; L457-P600 HydrophobicContact CD1-CG 3.65Å; L457-P600 HydrophobicContact CD2-CG 4.04Å
458	F	90.6	Very high	93.9	Very high	5 Å²	5	13.5 Å²	13.5	2%	0.022	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	144.4	178.3	-63.3	-92.8	0	0	0	109.7	I401 R403 T434 Y435 A437 F443 T448 N456 S462	I401-F458 HydrophobicContact CD1-CB 4.45Å; I401-F458 WeakPolarHBondContact CD1-O 3.43Å; I401-F458 HydrophobicContact CG2-CB 4.28Å; R403-F458 HydrophobicContact CB-CD1 4.07Å; R403-F458 HydrophobicContact CB-CE1 4.48Å; R403-F458 HydrophobicContact CG-CB 3.88Å; R403-F458 HydrophobicContact CG-CD1 3.83Å; R403-F458 HydrophobicContact CG-CG 3.94Å; T434-F458 CarbonylContact C-O 3.57Å; T434-F458 VanDerWaalsContact CA-O 3.24Å; T434-F458 WeakPolarHBondContact CA-O 3.34Å; Y435-F458 PolarHBondContact N-O 3.24Å; Y435-F458 PolarHBondContact O-N 2.82Å; A437-F458 HydrophobicContact CB-CD2 4.15Å; A437-F458 HydrophobicContact CB-CE2 3.88Å; F443-F458 HydrophobicContact CB-CZ 4.47Å; F443-F458 HydrophobicContact CD1-CE1 4.12Å; F443-F458 HydrophobicContact CD1-CE2 4.19Å; F443-F458 AromaticContact CD1-CZ 3.46Å; F443-F458 HydrophobicContact CD1-CZ 3.46Å; F443-F458 VanDerWaalsContact CD1-CZ 3.46Å; F443-F458 HydrophobicContact CD2-CE2 4.38Å; F443-F458 AromaticContact CD2-CZ 3.83Å; F443-F458 HydrophobicContact CD2-CZ 3.83Å; F443-F458 HydrophobicContact CE1-CE1 4.43Å; F443-F458 AromaticContact CE1-CE2 3.79Å; F443-F458 HydrophobicContact CE1-CE2 3.79Å; F443-F458 AromaticContact CE1-CZ 3.54Å; F443-F458 HydrophobicContact CE1-CZ 3.54Å; F443-F458 AromaticContact CE2-CE2 3.98Å; F443-F458 HydrophobicContact CE2-CE2 3.98Å; F443-F458 AromaticContact CE2-CZ 3.89Å; F443-F458 HydrophobicContact CE2-CZ 3.89Å; F443-F458 HydrophobicContact CG-CE1 4.41Å; F443-F458 HydrophobicContact CG-CE2 4.48Å; F443-F458 AromaticContact CG-CZ 3.62Å; F443-F458 HydrophobicContact CG-CZ 3.62Å; F443-F458 AromaticContact CZ-CE2 3.67Å; F443-F458 HydrophobicContact CZ-CE2 3.67Å; F443-F458 AromaticContact CZ-CZ 3.76Å; F443-F458 HydrophobicContact CZ-CZ 3.76Å; T448-F458 HydrophobicContact CG2-CE1 4.2Å; T448-F458 HydrophobicContact CG2-CZ 4.33Å; N456-F458 WeakPolarHBondContact O-CD2 3.48Å; F458-S462 WeakPolarHBondContact CA-OG 3.49Å
459	S	91.6	Very high	94.1	Very high	12 Å²	12	13.2 Å²	13.2	8%	0.084	7%	0.069	C	C	.	.			trans	-158.1	175.3	177.8	60.7	0	0	0	0	108.9	L433 K461 S462 D463	L433-S459 VanDerWaalsContact O-CB 3.24Å; L433-S459 WeakPolarHBondContact O-CB 3.35Å; S459-K461 PolarHBondContact O-N 2.96Å; S459-K461 PolarHBondContact OG-N 2.93Å; S459-S462 PolarHBondContact N-OG 3.18Å; S459-S462 WeakPolarHBondContact O-CA 3.27Å; S459-S462 WeakPolarHBondContact O-CB 3.46Å; S459-S462 PolarHBondContact O-N 2.78Å; S459-S462 PolarHBondContact O-OG 3.43Å; S459-S462 PolarHBondContact OG-N 3.22Å; S459-D463 PolarHBondContact O-N 3.09Å
460	T	93.6	Very high	94.2	Very high	23 Å²	23	13.2 Å²	13.2	14%	0.141	7%	0.069	C	C	.	.	H	α-helix	trans	-56	-35.4	172	65.5	0	0	0	0	111.3	E396 S462 D463 V464	E396-T460 HydrophobicContact CB-CG2 4.09Å; E396-T460 HydrophobicContact CG-CG2 3.97Å; E396-T460 WeakPolarHBondContact OE1-CB 3.41Å; E396-T460 PolarHBondContact OE1-OG1 2.97Å; T460-S462 VanDerWaalsContact C-N 3.27Å; T460-S462 PolarHBondContact O-N 2.85Å; T460-D463 CarbonylContact O-C 3.59Å; T460-D463 WeakPolarHBondContact O-CA 3.35Å; T460-D463 WeakPolarHBondContact O-CB 3.24Å; T460-D463 PolarHBondContact O-N 3.07Å; T460-V464 WeakPolarHBondContact O-CG2 3.26Å; T460-V464 PolarHBondContact O-N 3.3Å
461	K	96.6	Very high	94.3	Very high	44 Å²	44	13.4 Å²	13.4	19%	0.191	7%	0.07	C	C	.	.	H	α-helix	trans	-65.6	-22.6	172.9	-57.5	-60.5	-179.2	174.7	0	114.4	S459 W465 P522 R525 P526	S459-K461 PolarHBondContact O-N 2.96Å; S459-K461 PolarHBondContact OG-N 2.93Å; K461-W465 PolarHBondContact O-N 3.21Å; K461-P522 HydrophobicContact CB-CB 3.86Å; K461-P522 HydrophobicContact CG-CB 4.49Å; K461-P522 WeakPolarHBondContact CG-O 3.32Å; K461-R525 HydrophobicContact CD-CB 4.39Å; K461-R525 PolarHBondContact NZ-O 2.87Å; K461-R525 WeakPolarHBondContact O-CD 3Å; K461-R525 PolarHBondContact O-NH1 2.9Å; K461-P526 PolarHBondContact NZ-O 2.82Å; K461-P526 VanDerWaalsContact NZ-O 3.15Å
462	S	96	Very high	94.6	Very high	6 Å²	6	13.7 Å²	13.7	4%	0.042	7%	0.071	C	C	.	.	H	α-helix	trans	-79.4	-29.6	169.5	76.2	0	0	0	0	112.3	F458 S459 T460 A466	F458-S462 WeakPolarHBondContact CA-OG 3.49Å; S459-S462 PolarHBondContact N-OG 3.18Å; S459-S462 WeakPolarHBondContact O-CA 3.27Å; S459-S462 WeakPolarHBondContact O-CB 3.46Å; S459-S462 PolarHBondContact O-N 2.78Å; S459-S462 PolarHBondContact O-OG 3.43Å; S459-S462 PolarHBondContact OG-N 3.22Å; T460-S462 VanDerWaalsContact C-N 3.27Å; T460-S462 PolarHBondContact O-N 2.85Å; S462-A466 PolarHBondContact O-N 2.85Å
463	D	97	Very high	94.9	Very high	2 Å²	2	13.8 Å²	13.8	1%	0.011	7%	0.071	C	C	.	.	H	α-helix	trans	-73.9	-32.8	170.5	-64.9	-37.6	0	0	0	111.6	M392 I401 H402 R403 S459 T460 W465 A466 F467 F528	M392-D463 HydrophobicContact CE-CB 3.76Å; I401-D463 WeakPolarHBondContact CA-OD2 3.1Å; I401-D463 WeakPolarHBondContact CG2-OD2 3.46Å; H402-D463 PolarHBondContact N-OD2 3.39Å; R403-D463 WeakPolarHBondContact CA-OD1 3.45Å; R403-D463 PolarHBondContact N-OD1 2.95Å; S459-D463 PolarHBondContact O-N 3.09Å; T460-D463 CarbonylContact O-C 3.59Å; T460-D463 WeakPolarHBondContact O-CA 3.35Å; T460-D463 WeakPolarHBondContact O-CB 3.24Å; T460-D463 PolarHBondContact O-N 3.07Å; D463-W465 VanDerWaalsContact C-N 3.31Å; D463-W465 PolarHBondContact O-N 3.44Å; D463-A466 CarbonylContact O-C 3.57Å; D463-A466 WeakPolarHBondContact O-CA 3.48Å; D463-A466 WeakPolarHBondContact O-CB 3.46Å; D463-A466 PolarHBondContact O-N 3.28Å; D463-A466 VanDerWaalsContact O-N 3.12Å; D463-F467 PolarHBondContact O-N 3.41Å; D463-F528 HydrophobicContact CB-CE2 4.03Å; D463-F528 HydrophobicContact CB-CZ 4.16Å
464	V	98.4	Very high	95.2	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-58.4	-42.7	171	166.9	0	0	0	0	111.3	T460 A466 F467 G468 C517 R525 P526 F528 I531	T460-V464 WeakPolarHBondContact O-CG2 3.26Å; T460-V464 PolarHBondContact O-N 3.3Å; V464-A466 VanDerWaalsContact C-N 3.34Å; V464-A466 PolarHBondContact O-N 2.92Å; V464-F467 WeakPolarHBondContact O-CB 3.36Å; V464-F467 PolarHBondContact O-N 3.21Å; V464-G468 PolarHBondContact O-N 2.91Å; V464-C517 HydrophobicContact CG1-CB 4.1Å; V464-C517 WeakPolarHBondContact O-CB 3.4Å; V464-R525 HydrophobicContact CG1-CB 3.85Å; V464-P526 WeakPolarHBondContact CG2-O 3.39Å; V464-F528 HydrophobicContact CB-CE2 4.43Å; V464-F528 HydrophobicContact CB-CZ 4.35Å; V464-F528 HydrophobicContact CG2-CD1 4.48Å; V464-F528 HydrophobicContact CG2-CD2 3.75Å; V464-F528 HydrophobicContact CG2-CE1 4.24Å; V464-F528 HydrophobicContact CG2-CE2 3.47Å; V464-F528 VanDerWaalsContact CG2-CE2 3.47Å; V464-F528 HydrophobicContact CG2-CG 4.26Å; V464-F528 HydrophobicContact CG2-CZ 3.74Å; V464-I531 HydrophobicContact CB-CD1 4.29Å; V464-I531 HydrophobicContact CG1-CD1 3.68Å; V464-I531 HydrophobicContact CG2-CD1 3.85Å
465	W	98.5	Very high	95.6	Very high	1 Å²	1	10.9 Å²	10.9	0%	0.004	6%	0.057	C	C	.	.	H	α-helix	trans	-58.6	-47.1	172.8	177.7	-75.7	0	0	0	111.4	A449 P450 K461 D463 F467 G468 I469 L494 W518	A449-W465 HydrophobicContact CB-CB 3.72Å; A449-W465 HydrophobicContact CB-CD2 4.03Å; A449-W465 HydrophobicContact CB-CG 3.64Å; P450-W465 HydrophobicContact CG-CE3 4.43Å; P450-W465 HydrophobicContact CG-CH2 3.73Å; P450-W465 HydrophobicContact CG-CZ2 4.22Å; P450-W465 HydrophobicContact CG-CZ3 3.84Å; K461-W465 PolarHBondContact O-N 3.21Å; D463-W465 VanDerWaalsContact C-N 3.31Å; D463-W465 PolarHBondContact O-N 3.44Å; W465-F467 VanDerWaalsContact C-N 3.29Å; W465-F467 PolarHBondContact O-N 3.25Å; W465-G468 PolarHBondContact O-N 3.1Å; W465-I469 PolarHBondContact O-N 3.09Å; W465-I469 VanDerWaalsContact O-N 3.17Å; W465-L494 HydrophobicContact CH2-CD1 4.14Å; W465-L494 HydrophobicContact CH2-CD2 3.88Å; W465-L494 HydrophobicContact CH2-CG 4.48Å; W465-L494 HydrophobicContact CZ2-CD1 3.62Å; W465-L494 HydrophobicContact CZ2-CD2 3.77Å; W465-L494 HydrophobicContact CZ2-CG 4.29Å; W465-W518 AromaticContact CD2-CD1 3.96Å; W465-W518 HydrophobicContact CE3-CB 4.25Å; W465-W518 HydrophobicContact CH2-CB 4.18Å; W465-W518 HydrophobicContact CZ3-CB 3.97Å; W465-W518 WeakPolarHBondContact CZ3-O 3.43Å; W465-W518 PolarHBondContact O-NE1 3.2Å
466	A	98.2	Very high	96	Very high	5 Å²	5	9.2 Å²	9.2	4%	0.041	5%	0.051	C	C	.	.	H	α-helix	trans	-63.8	-33.5	177.8	0	0	0	0	0	112.4	L405 W447 S462 D463 V464 I469 L470	L405-A466 HydrophobicContact CB-CB 4.03Å; W447-A466 HydrophobicContact CB-CB 4.4Å; W447-A466 WeakPolarHBondContact O-CB 3.12Å; S462-A466 PolarHBondContact O-N 2.85Å; D463-A466 CarbonylContact O-C 3.57Å; D463-A466 WeakPolarHBondContact O-CA 3.48Å; D463-A466 WeakPolarHBondContact O-CB 3.46Å; D463-A466 PolarHBondContact O-N 3.28Å; D463-A466 VanDerWaalsContact O-N 3.12Å; V464-A466 VanDerWaalsContact C-N 3.34Å; V464-A466 PolarHBondContact O-N 2.92Å; A466-I469 WeakPolarHBondContact O-CB 3.4Å; A466-I469 PolarHBondContact O-N 3.38Å; A466-L470 PolarHBondContact O-N 3.32Å
467	F	98.7	Very high	96.5	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-64.7	-40.8	172.1	-176.9	-98.3	0	0	0	111.9	V388 A389 L405 D463 V464 W465 I469 L470 L471 F528 I531 L535	V388-F467 HydrophobicContact CB-CE2 4.07Å; V388-F467 HydrophobicContact CG1-CD2 4.02Å; V388-F467 HydrophobicContact CG1-CE2 3.87Å; A389-F467 HydrophobicContact CB-CE2 4.21Å; A389-F467 HydrophobicContact CB-CZ 3.91Å; L405-F467 HydrophobicContact CD2-CB 3.81Å; L405-F467 HydrophobicContact CD2-CD2 4.22Å; D463-F467 PolarHBondContact O-N 3.41Å; V464-F467 WeakPolarHBondContact O-CB 3.36Å; V464-F467 PolarHBondContact O-N 3.21Å; W465-F467 VanDerWaalsContact C-N 3.29Å; W465-F467 PolarHBondContact O-N 3.25Å; F467-I469 VanDerWaalsContact C-N 3.28Å; F467-I469 PolarHBondContact O-N 2.86Å; F467-L470 HydrophobicContact CD2-CD2 4.28Å; F467-L470 CarbonylContact O-C 3.52Å; F467-L470 WeakPolarHBondContact O-CA 3.41Å; F467-L470 WeakPolarHBondContact O-CB 3.49Å; F467-L470 PolarHBondContact O-N 3.45Å; F467-L470 VanDerWaalsContact O-N 3.09Å; F467-L471 HydrophobicContact CD1-CD1 4.11Å; F467-L471 HydrophobicContact CD1-CG 4.06Å; F467-L471 HydrophobicContact CE1-CD1 3.68Å; F467-L471 HydrophobicContact CE1-CD2 3.8Å; F467-L471 HydrophobicContact CE1-CG 3.63Å; F467-L471 HydrophobicContact CZ-CD2 3.78Å; F467-L471 HydrophobicContact CZ-CG 4.06Å; F467-L471 PolarHBondContact O-N 2.95Å; F467-F528 HydrophobicContact CB-CE1 3.69Å; F467-F528 HydrophobicContact CB-CZ 3.98Å; F467-F528 HydrophobicContact CD1-CE1 4.3Å; F467-F528 HydrophobicContact CD2-CE1 4.06Å; F467-F528 AromaticContact CG-CE1 3.75Å; F467-F528 HydrophobicContact CG-CE1 3.75Å; F467-I531 HydrophobicContact CD1-CD1 4.48Å; F467-I531 HydrophobicContact CD1-CG2 3.81Å; F467-I531 HydrophobicContact CE1-CG2 3.32Å; F467-I531 HydrophobicContact CZ-CG2 4.06Å; F467-L535 HydrophobicContact CE1-CD1 3.99Å; F467-L535 HydrophobicContact CZ-CD1 3.7Å
468	G	98.6	Very high	96.8	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-58.4	-39.6	171	0	0	0	0	0	112.6	V464 W465 L471 W472 W518	V464-G468 PolarHBondContact O-N 2.91Å; W465-G468 PolarHBondContact O-N 3.1Å; G468-L471 PolarHBondContact O-N 3.03Å; G468-W472 PolarHBondContact O-N 3.07Å; G468-W518 VanDerWaalsContact C-NE1 3.31Å; G468-W518 WeakPolarHBondContact O-CZ2 3.44Å
469	I	98.5	Very high	97.1	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-66.5	-39.2	174	-54.9	-66.7	0	0	0	111.1	W447 W465 A466 F467 W472 E473 P481 Y482 M500 W518	W447-I469 VanDerWaalsContact CD1-CG2 3.47Å; W447-I469 HydrophobicContact CD2-CG2 4.25Å; W447-I469 HydrophobicContact CG-CB 4.39Å; W447-I469 HydrophobicContact CG-CG2 3.91Å; W465-I469 PolarHBondContact O-N 3.09Å; W465-I469 VanDerWaalsContact O-N 3.17Å; A466-I469 WeakPolarHBondContact O-CB 3.4Å; A466-I469 PolarHBondContact O-N 3.38Å; F467-I469 VanDerWaalsContact C-N 3.28Å; F467-I469 PolarHBondContact O-N 2.86Å; I469-W472 WeakPolarHBondContact O-CB 3.44Å; I469-W472 PolarHBondContact O-N 3.39Å; I469-E473 PolarHBondContact O-N 2.89Å; I469-P481 HydrophobicContact CG2-CB 3.96Å; I469-P481 HydrophobicContact CG2-CG 3.66Å; I469-Y482 HydrophobicContact CD1-CE2 3.95Å; I469-Y482 WeakPolarHBondContact CD1-OH 3.46Å; I469-M500 HydrophobicContact CD1-CE 3.58Å; I469-M500 HydrophobicContact CG2-CE 4.49Å; I469-W518 HydrophobicContact CD1-CZ2 3.86Å; I469-W518 VanDerWaalsContact CD1-NE1 3.34Å
470	L	98.6	Very high	97.3	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-64.6	-40.7	174.6	171	59.5	0	0	0	112.7	L364 V388 L405 A407 A466 F467 W472 E473 I474	L364-L470 HydrophobicContact CD2-CD1 4.45Å; V388-L470 HydrophobicContact CB-CD2 4.37Å; V388-L470 HydrophobicContact CG1-CD2 3.69Å; V388-L470 HydrophobicContact CG2-CD2 4.35Å; L405-L470 HydrophobicContact CD1-CD2 4.12Å; L405-L470 HydrophobicContact CG-CD2 4.25Å; A407-L470 HydrophobicContact CB-CD1 3.66Å; A466-L470 PolarHBondContact O-N 3.32Å; F467-L470 HydrophobicContact CD2-CD2 4.28Å; F467-L470 CarbonylContact O-C 3.52Å; F467-L470 WeakPolarHBondContact O-CA 3.41Å; F467-L470 WeakPolarHBondContact O-CB 3.49Å; F467-L470 PolarHBondContact O-N 3.45Å; F467-L470 VanDerWaalsContact O-N 3.09Å; L470-W472 PolarHBondContact O-N 3.47Å; L470-E473 WeakPolarHBondContact O-CB 3.33Å; L470-E473 PolarHBondContact O-N 3.06Å; L470-E473 VanDerWaalsContact O-N 3.09Å; L470-I474 HydrophobicContact CD1-CD1 3.96Å; L470-I474 HydrophobicContact CD1-CG1 4.05Å; L470-I474 HydrophobicContact CG-CD1 4.01Å; L470-I474 WeakPolarHBondContact O-CG1 3.47Å; L470-I474 PolarHBondContact O-N 2.82Å
471	L	98.5	Very high	97.5	Very high	5 Å²	5	16.7 Å²	16.7	3%	0.026	9%	0.086	C	C	.	.	H	α-helix	trans	-56.4	-40.4	171.4	-73.2	-179.5	0	0	0	111	A385 F467 G468 I474 A475 L513 M514 L535	A385-L471 HydrophobicContact CB-CD2 3.63Å; F467-L471 HydrophobicContact CD1-CD1 4.11Å; F467-L471 HydrophobicContact CD1-CG 4.06Å; F467-L471 HydrophobicContact CE1-CD1 3.68Å; F467-L471 HydrophobicContact CE1-CD2 3.8Å; F467-L471 HydrophobicContact CE1-CG 3.63Å; F467-L471 HydrophobicContact CZ-CD2 3.78Å; F467-L471 HydrophobicContact CZ-CG 4.06Å; F467-L471 PolarHBondContact O-N 2.95Å; G468-L471 PolarHBondContact O-N 3.03Å; L471-I474 PolarHBondContact O-N 3.22Å; L471-A475 WeakPolarHBondContact O-CB 3.31Å; L471-A475 PolarHBondContact O-N 2.97Å; L471-L513 HydrophobicContact CD1-CD2 4.04Å; L471-L513 HydrophobicContact CD1-CG 4.06Å; L471-M514 HydrophobicContact CB-CE 4.08Å; L471-M514 HydrophobicContact CB-CG 3.81Å; L471-M514 HydrophobicContact CB-SD 4.36Å; L471-M514 HydrophobicContact CD1-CG 4.06Å; L471-L535 HydrophobicContact CD2-CD2 4.48Å
472	W	98.3	Very high	97.4	Very high	15 Å²	15	14.9 Å²	14.9	6%	0.057	8%	0.078	C	C	.	.	H	α-helix	trans	-68.8	-37.7	174.7	-165.6	96.6	0	0	0	112.4	G468 I469 L470 T476 K479 P481 P483 M500 L501 P503 M514 W518	G468-W472 PolarHBondContact O-N 3.07Å; I469-W472 WeakPolarHBondContact O-CB 3.44Å; I469-W472 PolarHBondContact O-N 3.39Å; L470-W472 PolarHBondContact O-N 3.47Å; W472-T476 HydrophobicContact CD2-CG2 3.77Å; W472-T476 HydrophobicContact CE3-CG2 3.84Å; W472-T476 HydrophobicContact CG-CG2 4.46Å; W472-T476 HydrophobicContact CH2-CG2 3.87Å; W472-T476 HydrophobicContact CZ2-CG2 3.8Å; W472-T476 HydrophobicContact CZ3-CG2 3.87Å; W472-T476 VanDerWaalsContact O-CB 3.29Å; W472-T476 WeakPolarHBondContact O-CB 3.49Å; W472-T476 VanDerWaalsContact O-CG2 3.24Å; W472-T476 WeakPolarHBondContact O-CG2 3.26Å; W472-T476 PolarHBondContact O-N 3.41Å; W472-T476 PolarHBondContact O-OG1 2.78Å; W472-K479 HydrophobicContact CH2-CB 4.14Å; W472-K479 HydrophobicContact CZ3-CB 4.01Å; W472-P481 HydrophobicContact CE3-CB 4.43Å; W472-P481 HydrophobicContact CE3-CG 4.3Å; W472-P481 HydrophobicContact CZ3-CB 4.45Å; W472-P481 HydrophobicContact CZ3-CG 4.42Å; W472-P483 HydrophobicContact CH2-CG 4.35Å; W472-M500 HydrophobicContact CB-CE 3.72Å; W472-M500 HydrophobicContact CD2-CE 3.67Å; W472-M500 HydrophobicContact CD2-SD 3.8Å; W472-M500 HydrophobicContact CE3-CE 4.17Å; W472-M500 HydrophobicContact CE3-SD 4.1Å; W472-M500 HydrophobicContact CG-CE 3.46Å; W472-M500 VanDerWaalsContact CG-CE 3.46Å; W472-M500 HydrophobicContact CG-SD 4.2Å; W472-M500 HydrophobicContact CH2-SD 4.47Å; W472-M500 HydrophobicContact CZ2-SD 4.18Å; W472-M500 HydrophobicContact CZ3-SD 4.44Å; W472-L501 PolarHBondContact NE1-O 3.21Å; W472-P503 HydrophobicContact CG-CG 4.28Å; W472-M514 HydrophobicContact CB-SD 3.86Å; W472-M514 HydrophobicContact CG-SD 4.36Å; W472-W518 HydrophobicContact CB-CH2 4.16Å; W472-W518 HydrophobicContact CB-CZ2 4.15Å; W472-W518 AromaticContact CD1-CH2 3.96Å; W472-W518 HydrophobicContact CG-CH2 4.31Å
473	E	98.4	Very high	97.3	Very high	2 Å²	2	19 Å²	19	1%	0.009	10%	0.104	C	C	.	.	H	α-helix	trans	-59.4	-45.6	170.3	-68.3	-173.8	98.5	0	0	111.4	A407 W447 I469 L470 T476 Y477 G478 P481	A407-E473 HydrophobicContact CB-CB 4.1Å; A407-E473 HydrophobicContact CB-CG 4.47Å; A407-E473 PolarHBondContact N-OE2 2.95Å; W447-E473 WeakPolarHBondContact CZ2-OE1 3.37Å; W447-E473 PolarHBondContact NE1-OE2 3.26Å; I469-E473 PolarHBondContact O-N 2.89Å; L470-E473 WeakPolarHBondContact O-CB 3.33Å; L470-E473 PolarHBondContact O-N 3.06Å; L470-E473 VanDerWaalsContact O-N 3.09Å; E473-T476 PolarHBondContact O-OG1 2.67Å; E473-Y477 PolarHBondContact O-N 3.32Å; E473-G478 PolarHBondContact O-N 3.09Å; E473-P481 HydrophobicContact CG-CG 4.04Å
474	I	97.8	Very high	97.1	Very high	5 Å²	5	23.2 Å²	23.2	3%	0.026	15%	0.148	C	C	.	.	H	α-helix	trans	-63.5	-56	179.3	-68.6	168	0	0	0	110.5	L364 L368 L381 A385 L470 L471 T476 Y477	L364-I474 HydrophobicContact CD2-CD1 4.24Å; L364-I474 HydrophobicContact CD2-CG1 4.2Å; L368-I474 HydrophobicContact CD1-CG1 4.19Å; L381-I474 HydrophobicContact CB-CG2 3.87Å; L381-I474 HydrophobicContact CD2-CG2 4Å; L381-I474 HydrophobicContact CG-CG2 4.44Å; A385-I474 HydrophobicContact CB-CD1 4.03Å; L470-I474 HydrophobicContact CD1-CD1 3.96Å; L470-I474 HydrophobicContact CD1-CG1 4.05Å; L470-I474 HydrophobicContact CG-CD1 4.01Å; L470-I474 WeakPolarHBondContact O-CG1 3.47Å; L470-I474 PolarHBondContact O-N 2.82Å; L471-I474 PolarHBondContact O-N 3.22Å; I474-T476 PolarHBondContact O-N 2.93Å; I474-Y477 PolarHBondContact O-N 2.61Å
475	A	96.4	Very high	96.8	Very high	18 Å²	18	25 Å²	25	15%	0.149	16%	0.159	C	C	.	.	H	α-helix	trans	-62.6	-25.1	-178.7	0	0	0	0	0	113.6	L471 P503 M514	L471-A475 WeakPolarHBondContact O-CB 3.31Å; L471-A475 PolarHBondContact O-N 2.97Å; A475-P503 HydrophobicContact CB-CB 4.15Å; A475-P503 HydrophobicContact CB-CG 3.89Å; A475-M514 HydrophobicContact CB-CE 4.02Å
476	T	96.1	Very high	96.6	Very high	7 Å²	7	30.5 Å²	30.5	4%	0.043	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-2.9	175.3	60	0	0	0	0	114.9	W472 E473 I474 K479 P503	W472-T476 HydrophobicContact CD2-CG2 3.77Å; W472-T476 HydrophobicContact CE3-CG2 3.84Å; W472-T476 HydrophobicContact CG-CG2 4.46Å; W472-T476 HydrophobicContact CH2-CG2 3.87Å; W472-T476 HydrophobicContact CZ2-CG2 3.8Å; W472-T476 HydrophobicContact CZ3-CG2 3.87Å; W472-T476 VanDerWaalsContact O-CB 3.29Å; W472-T476 WeakPolarHBondContact O-CB 3.49Å; W472-T476 VanDerWaalsContact O-CG2 3.24Å; W472-T476 WeakPolarHBondContact O-CG2 3.26Å; W472-T476 PolarHBondContact O-N 3.41Å; W472-T476 PolarHBondContact O-OG1 2.78Å; E473-T476 PolarHBondContact O-OG1 2.67Å; I474-T476 PolarHBondContact O-N 2.93Å; T476-K479 HydrophobicContact CG2-CB 4.38Å; T476-K479 HydrophobicContact CG2-CD 4.22Å; T476-K479 PolarHBondContact OG1-N 2.92Å; T476-P503 HydrophobicContact CG2-CB 3.78Å; T476-P503 HydrophobicContact CG2-CG 3.91Å
477	Y	96.6	Very high	96.3	Very high	43 Å²	43	35 Å²	35	17%	0.169	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	48.1	-173	-55.7	-116.4	0	0	0	111.5	R373 L376 L381 E473 I474	R373-Y477 HydrophobicContact CB-CE1 4.26Å; R373-Y477 HydrophobicContact CG-CD1 4.05Å; R373-Y477 HydrophobicContact CG-CE1 3.78Å; L376-Y477 HydrophobicContact CB-CD1 4.34Å; L376-Y477 HydrophobicContact CB-CE1 3.87Å; L376-Y477 HydrophobicContact CD1-CD1 4.1Å; L376-Y477 HydrophobicContact CD1-CE1 4.45Å; L376-Y477 PolarHBondContact O-OH 2.74Å; L381-Y477 HydrophobicContact CD1-CD2 4.49Å; L381-Y477 HydrophobicContact CD1-CE1 4.08Å; L381-Y477 HydrophobicContact CD1-CE2 3.83Å; E473-Y477 PolarHBondContact O-N 3.32Å; I474-Y477 PolarHBondContact O-N 2.61Å
478	G	96.2	Very high	95.9	Very high	3 Å²	3	39 Å²	39	3%	0.031	23%	0.226	C	C	.	.	S	Bend	trans	77.1	26.4	174.4	0	0	0	0	0	115.7	R369 E473	R369-G478 VanDerWaalsContact CZ-O 3.3Å; R369-G478 PolarHBondContact NE-O 3.07Å; R369-G478 PolarHBondContact NH2-O 3.12Å; E473-G478 PolarHBondContact O-N 3.09Å
479	K	96.6	Very high	95.6	Very high	110 Å²	110	42.5 Å²	42.5	48%	0.478	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-64.9	151.8	169.8	-65.9	178.6	-167.2	173.4	0	109.6	W472 T476 P481	W472-K479 HydrophobicContact CH2-CB 4.14Å; W472-K479 HydrophobicContact CZ3-CB 4.01Å; T476-K479 HydrophobicContact CG2-CB 4.38Å; T476-K479 HydrophobicContact CG2-CD 4.22Å; T476-K479 PolarHBondContact OG1-N 2.92Å; K479-P481 WeakPolarHBondContact O-CD 3.31Å
480	T	95.6	Very high	95.3	Very high	84 Å²	84	42.5 Å²	42.5	52%	0.515	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-69.5	124.9	175.9	-56.5	0	0	0	0	110.3
481	P	97.1	Very high	95.1	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.006	25%	0.247	C	C	.	.	S	Bend	trans	-54.8	152.6	175.5	-28.7	36.8	0	0	0	113.2	K446 W447 I469 W472 E473 K479 M500	K446-P481 HydrophobicContact CB-CB 4.36Å; K446-P481 VanDerWaalsContact CD-O 3.24Å; K446-P481 WeakPolarHBondContact CD-O 3.4Å; K446-P481 WeakPolarHBondContact CE-O 3.48Å; K446-P481 PolarHBondContact NZ-O 3.11Å; W447-P481 HydrophobicContact CH2-CG 4.34Å; W447-P481 HydrophobicContact CZ2-CG 3.88Å; I469-P481 HydrophobicContact CG2-CB 3.96Å; I469-P481 HydrophobicContact CG2-CG 3.66Å; W472-P481 HydrophobicContact CE3-CB 4.43Å; W472-P481 HydrophobicContact CE3-CG 4.3Å; W472-P481 HydrophobicContact CZ3-CB 4.45Å; W472-P481 HydrophobicContact CZ3-CG 4.42Å; E473-P481 HydrophobicContact CG-CG 4.04Å; K479-P481 WeakPolarHBondContact O-CD 3.31Å; P481-M500 HydrophobicContact CB-CE 4.26Å; P481-M500 HydrophobicContact CB-SD 3.79Å
482	Y	95.9	Very high	94.8	Very high	6 Å²	6	43.1 Å²	43.1	2%	0.024	25%	0.248	C	C	.	.	S	Bend	trans	45	64.7	-174.2	-51.7	-88.3	0	0	0	111.9	K446 I469 V485 V490 L493 L494 M500	K446-Y482 HydrophobicContact CB-CD2 4.05Å; K446-Y482 HydrophobicContact CB-CE2 4.36Å; K446-Y482 HydrophobicContact CD-CD2 4.21Å; K446-Y482 HydrophobicContact CG-CD2 4.01Å; K446-Y482 PolarHBondContact NZ-O 3.11Å; K446-Y482 WeakPolarHBondContact O-CE2 3.37Å; I469-Y482 HydrophobicContact CD1-CE2 3.95Å; I469-Y482 WeakPolarHBondContact CD1-OH 3.46Å; Y482-V485 PolarHBondContact O-N 2.95Å; Y482-V490 HydrophobicContact CD2-CG1 4.37Å; Y482-V490 HydrophobicContact CE2-CG1 4.25Å; Y482-L493 HydrophobicContact CD1-CD2 4.2Å; Y482-L493 HydrophobicContact CE1-CD2 4.09Å; Y482-L494 HydrophobicContact CE1-CD2 4.09Å; Y482-M500 HydrophobicContact CD1-CG 3.59Å; Y482-M500 HydrophobicContact CD1-SD 4.19Å; Y482-M500 HydrophobicContact CD2-CG 4.42Å; Y482-M500 HydrophobicContact CD2-SD 3.98Å; Y482-M500 HydrophobicContact CE1-CG 3.52Å; Y482-M500 HydrophobicContact CE1-SD 4.27Å; Y482-M500 HydrophobicContact CE2-CE 4.47Å; Y482-M500 HydrophobicContact CE2-CG 4.37Å; Y482-M500 HydrophobicContact CE2-SD 4.06Å; Y482-M500 HydrophobicContact CG-CG 4.04Å; Y482-M500 HydrophobicContact CG-SD 4.03Å; Y482-M500 PolarHBondContact N-SD 3.01Å
483	P	93.4	Very high	94.5	Very high	91 Å²	91	44 Å²	44	59%	0.591	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	139.8	179.6	26.3	-34.8	0	0	0	110.6	W472 V485	W472-P483 HydrophobicContact CH2-CG 4.35Å; P483-V485 PolarHBondContact O-N 3.33Å; P483-V485 VanDerWaalsContact O-N 3.15Å
484	G	92.7	Very high	94.3	Very high	92 Å²	92	44 Å²	44	95%	0.948	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.4	-13.4	-175.9	0	0	0	0	0	115.9
485	V	93.2	Very high	94	Very high	36 Å²	36	44.2 Å²	44.2	22%	0.218	26%	0.255	C	S	.	.			trans	-92.3	125.9	-178.4	-169.9	0	0	0	0	110.8	K446 Y482 P483 D489 V490 L493	K446-V485 PolarHBondContact NZ-O 3.17Å; K446-V485 VanDerWaalsContact NZ-O 3.09Å; Y482-V485 PolarHBondContact O-N 2.95Å; P483-V485 PolarHBondContact O-N 3.33Å; P483-V485 VanDerWaalsContact O-N 3.15Å; V485-D489 HydrophobicContact CG1-CB 3.99Å; V485-V490 HydrophobicContact CG1-CG2 4.32Å; V485-L493 HydrophobicContact CG1-CD1 4.22Å; V485-L493 HydrophobicContact CG2-CD1 3.88Å
486	E	92.8	Very high	93.8	Very high	117 Å²	117	50.2 Å²	50.2	55%	0.547	27%	0.274	S	S	.	.			trans	-67	153.2	172.9	-61.8	-158.8	152	0	0	111.6	Q488 D489	E486-Q488 HydrophobicContact CB-CG 4.13Å; E486-Q488 PolarHBondContact O-N 2.79Å; E486-Q488 PolarHBondContact OE2-NE2 3.25Å; E486-D489 PolarHBondContact O-N 2.86Å; E486-D489 VanDerWaalsContact O-N 3.09Å
487	L	91.9	Very high	93.6	Very high	99 Å²	99	51.6 Å²	51.6	52%	0.518	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-22.9	178.6	-65.2	176.1	0	0	0	113.3	I445 K446	I445-L487 HydrophobicContact CB-CD2 4.38Å; I445-L487 HydrophobicContact CD1-CB 4.26Å; K446-L487 HydrophobicContact CD-CD2 4.06Å; K446-L487 HydrophobicContact CG-CD2 3.87Å
488	Q	90.1	Very high	93.4	Very high	85 Å²	85	52.8 Å²	52.8	40%	0.397	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-14.8	179.9	62.8	-175.5	-5	0	0	114.8	E486 P1091 I1093	E486-Q488 HydrophobicContact CB-CG 4.13Å; E486-Q488 PolarHBondContact O-N 2.79Å; E486-Q488 PolarHBondContact OE2-NE2 3.25Å; Q488-P1091 HydrophobicContact CB-CB 4.49Å; Q488-I1093 HydrophobicContact CB-CD1 4.29Å; Q488-I1093 HydrophobicContact CB-CG1 3.94Å; Q488-I1093 WeakPolarHBondContact O-CG2 3.26Å
489	D	93.4	Very high	93.4	Very high	73 Å²	73	54.7 Å²	54.7	39%	0.39	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-8	-178.5	-59.6	-61.8	0	0	0	113.4	V485 E486 Y491 V492 L493	V485-D489 HydrophobicContact CG1-CB 3.99Å; E486-D489 PolarHBondContact O-N 2.86Å; E486-D489 VanDerWaalsContact O-N 3.09Å; D489-Y491 PolarHBondContact O-N 2.77Å; D489-V492 WeakPolarHBondContact O-CB 3.42Å; D489-V492 PolarHBondContact O-N 3.01Å; D489-V492 VanDerWaalsContact O-N 3.16Å; D489-L493 WeakPolarHBondContact O-CB 3.24Å; D489-L493 PolarHBondContact O-N 3.3Å
490	V	92.6	Very high	93.4	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.006	29%	0.287	C	S	.	.	H	α-helix	trans	-56.2	-52.6	-177	179.9	0	0	0	0	111.7	I445 K446 Y482 V485 V492 L493 L494	I445-V490 HydrophobicContact CG2-CB 4.2Å; I445-V490 HydrophobicContact CG2-CG1 4.49Å; I445-V490 HydrophobicContact CG2-CG2 4.33Å; K446-V490 HydrophobicContact CG-CG2 4.14Å; Y482-V490 HydrophobicContact CD2-CG1 4.37Å; Y482-V490 HydrophobicContact CE2-CG1 4.25Å; V485-V490 HydrophobicContact CG1-CG2 4.32Å; V490-V492 VanDerWaalsContact C-N 3.32Å; V490-V492 PolarHBondContact O-N 3.44Å; V490-L493 PolarHBondContact O-N 3.12Å; V490-L494 HydrophobicContact CG1-CD1 4.01Å; V490-L494 VanDerWaalsContact O-CG 3.26Å; V490-L494 WeakPolarHBondContact O-CG 3.24Å; V490-L494 PolarHBondContact O-N 3.21Å
491	Y	92.6	Very high	93.3	Very high	8 Å²	8	52.9 Å²	52.9	3%	0.031	30%	0.299	C	S	.	.	H	α-helix	trans	-62.7	-39.7	178.4	176.3	-94.5	0	0	0	112.1	P450 L453 V454 D489 L493 L494 E495 W520 L1094	P450-Y491 HydrophobicContact CB-CE2 4.36Å; L453-Y491 HydrophobicContact CB-CD2 4.35Å; L453-Y491 HydrophobicContact CD1-CD2 4.34Å; V454-Y491 HydrophobicContact CG2-CD2 3.81Å; V454-Y491 HydrophobicContact CG2-CE1 4.36Å; V454-Y491 HydrophobicContact CG2-CE2 3.22Å; D489-Y491 PolarHBondContact O-N 2.77Å; Y491-L493 VanDerWaalsContact C-N 3.33Å; Y491-L493 PolarHBondContact O-N 3.43Å; Y491-L494 PolarHBondContact O-N 2.9Å; Y491-E495 HydrophobicContact CE1-CB 3.98Å; Y491-E495 HydrophobicContact CE1-CG 4.17Å; Y491-E495 WeakPolarHBondContact CE1-OE1 3.3Å; Y491-E495 VanDerWaalsContact CZ-OE1 3.3Å; Y491-E495 WeakPolarHBondContact O-CB 3.36Å; Y491-E495 PolarHBondContact O-N 2.82Å; Y491-E495 PolarHBondContact OH-OE1 3.09Å; Y491-W520 AromaticContact CE2-CH2 3.87Å; Y491-W520 HydrophobicContact CE2-CH2 3.87Å; Y491-L1094 HydrophobicContact CD1-CD2 3.87Å; Y491-L1094 HydrophobicContact CE1-CD2 3.54Å
492	V	92.2	Very high	93.3	Very high	10 Å²	10	55.6 Å²	55.6	6%	0.061	32%	0.317	C	S	.	.	H	α-helix	trans	-61.2	-41.8	178.3	163.8	0	0	0	0	111.6	D489 V490 R496 T1096	D489-V492 WeakPolarHBondContact O-CB 3.42Å; D489-V492 PolarHBondContact O-N 3.01Å; D489-V492 VanDerWaalsContact O-N 3.16Å; V490-V492 VanDerWaalsContact C-N 3.32Å; V490-V492 PolarHBondContact O-N 3.44Å; V492-R496 WeakPolarHBondContact O-CD 3.39Å; V492-R496 VanDerWaalsContact O-CG 3.26Å; V492-R496 WeakPolarHBondContact O-CG 3.32Å; V492-R496 PolarHBondContact O-N 2.79Å; V492-T1096 WeakPolarHBondContact CG1-OG1 3.29Å
493	L	92.8	Very high	93.3	Very high	34 Å²	34	55.8 Å²	55.8	18%	0.178	32%	0.319	C	S	.	.	H	α-helix	trans	-63.8	-45	175	-179.7	154.8	0	0	0	110.8	Y482 V485 D489 V490 Y491 R496 T498	Y482-L493 HydrophobicContact CD1-CD2 4.2Å; Y482-L493 HydrophobicContact CE1-CD2 4.09Å; V485-L493 HydrophobicContact CG1-CD1 4.22Å; V485-L493 HydrophobicContact CG2-CD1 3.88Å; D489-L493 WeakPolarHBondContact O-CB 3.24Å; D489-L493 PolarHBondContact O-N 3.3Å; V490-L493 PolarHBondContact O-N 3.12Å; Y491-L493 VanDerWaalsContact C-N 3.33Å; Y491-L493 PolarHBondContact O-N 3.43Å; L493-R496 PolarHBondContact O-N 3.09Å; L493-T498 HydrophobicContact CD1-CG2 4.45Å; L493-T498 HydrophobicContact CD2-CG2 3.83Å; L493-T498 HydrophobicContact CG-CG2 3.9Å; L493-T498 VanDerWaalsContact O-CB 3.31Å; L493-T498 WeakPolarHBondContact O-CB 3.39Å; L493-T498 PolarHBondContact O-N 2.86Å; L493-T498 PolarHBondContact O-OG1 2.89Å
494	L	94.4	Very high	93.1	Very high	1 Å²	1	60 Å²	60	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-67.8	-38.4	179.7	-64.2	172.3	0	0	0	113.3	W465 Y482 V490 Y491 R496 G497 R499 W520	W465-L494 HydrophobicContact CH2-CD1 4.14Å; W465-L494 HydrophobicContact CH2-CD2 3.88Å; W465-L494 HydrophobicContact CH2-CG 4.48Å; W465-L494 HydrophobicContact CZ2-CD1 3.62Å; W465-L494 HydrophobicContact CZ2-CD2 3.77Å; W465-L494 HydrophobicContact CZ2-CG 4.29Å; Y482-L494 HydrophobicContact CE1-CD2 4.09Å; V490-L494 HydrophobicContact CG1-CD1 4.01Å; V490-L494 VanDerWaalsContact O-CG 3.26Å; V490-L494 WeakPolarHBondContact O-CG 3.24Å; V490-L494 PolarHBondContact O-N 3.21Å; Y491-L494 PolarHBondContact O-N 2.9Å; L494-R496 PolarHBondContact O-N 2.93Å; L494-G497 PolarHBondContact O-N 3.36Å; L494-R499 PolarHBondContact O-NH1 3.38Å; L494-W520 HydrophobicContact CB-CZ3 4.13Å; L494-W520 WeakPolarHBondContact O-CZ3 3.35Å
495	E	91.9	Very high	92.8	Very high	10 Å²	10	59.4 Å²	59.4	5%	0.047	33%	0.325	C	S	.	.	H	α-helix	trans	-67.2	-20.9	177.3	-165.6	-175.1	-109.1	0	0	112.3	Y491 G497 W520 R593 S1097	Y491-E495 HydrophobicContact CE1-CB 3.98Å; Y491-E495 HydrophobicContact CE1-CG 4.17Å; Y491-E495 WeakPolarHBondContact CE1-OE1 3.3Å; Y491-E495 VanDerWaalsContact CZ-OE1 3.3Å; Y491-E495 WeakPolarHBondContact O-CB 3.36Å; Y491-E495 PolarHBondContact O-N 2.82Å; Y491-E495 PolarHBondContact OH-OE1 3.09Å; E495-G497 VanDerWaalsContact C-N 3.26Å; E495-W520 HydrophobicContact CB-CH2 3.93Å; E495-W520 HydrophobicContact CB-CZ3 4.4Å; E495-W520 HydrophobicContact CG-CH2 4.06Å; E495-R593 VanDerWaalsContact CD-NH1 3.35Å; E495-R593 IonicContact OE2-CZ 3.19Å; E495-R593 IonicContact OE2-NH1 2.74Å; E495-R593 PolarHBondContact OE2-NH1 2.68Å; E495-S1097 PolarHBondContact OE2-OG 3.48Å
496	R	92.3	Very high	92.8	Very high	143 Å²	143	58.6 Å²	58.6	54%	0.54	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	3.5	170.3	-65.9	167.8	-171.2	-152.7	6.3	113.2	V492 L493 L494 T498 T1096	V492-R496 WeakPolarHBondContact O-CD 3.39Å; V492-R496 VanDerWaalsContact O-CG 3.26Å; V492-R496 WeakPolarHBondContact O-CG 3.32Å; V492-R496 PolarHBondContact O-N 2.79Å; L493-R496 PolarHBondContact O-N 3.09Å; L494-R496 PolarHBondContact O-N 2.93Å; R496-T498 PolarHBondContact O-N 3.33Å; R496-T1096 PolarHBondContact NH2-OG1 2.97Å
497	G	91.2	Very high	92.6	Very high	37 Å²	37	56.5 Å²	56.5	38%	0.381	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	-9.3	-176.2	0	0	0	0	0	114.6	L494 E495 R499	L494-G497 PolarHBondContact O-N 3.36Å; E495-G497 VanDerWaalsContact C-N 3.26Å; G497-R499 PolarHBondContact O-NH1 3.21Å
498	T	92.2	Very high	92.7	Very high	67 Å²	67	58.7 Å²	58.7	41%	0.411	33%	0.325	S	S	.	.			trans	-62.8	146.4	180	-45	0	0	0	0	111.3	L493 R496	L493-T498 HydrophobicContact CD1-CG2 4.45Å; L493-T498 HydrophobicContact CD2-CG2 3.83Å; L493-T498 HydrophobicContact CG-CG2 3.9Å; L493-T498 VanDerWaalsContact O-CB 3.31Å; L493-T498 WeakPolarHBondContact O-CB 3.39Å; L493-T498 PolarHBondContact O-N 2.86Å; L493-T498 PolarHBondContact O-OG1 2.89Å; R496-T498 PolarHBondContact O-N 3.33Å
499	R	96.3	Very high	92.9	Very high	43 Å²	43	57.6 Å²	57.6	16%	0.162	33%	0.325	C	S	.	.			trans	-130.6	174.3	175.1	-63.4	-61.2	-180	-94.3	2.3	109.8	L494 G497 L515 W518	L494-R499 PolarHBondContact O-NH1 3.38Å; G497-R499 PolarHBondContact O-NH1 3.21Å; R499-L515 HydrophobicContact CB-CD2 4.3Å; R499-L515 HydrophobicContact CG-CD2 4.32Å; R499-W518 HydrophobicContact CB-CE3 4.08Å; R499-W518 HydrophobicContact CB-CZ3 4.45Å; R499-W518 HydrophobicContact CG-CE3 4.36Å; R499-W518 PolarHBondContact NE-O 2.78Å; R499-W518 PolarHBondContact NH2-O 2.84Å
500	M	96.3	Very high	93	Very high	9 Å²	9	54.9 Å²	54.9	4%	0.044	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-69.6	143.6	170.8	-64.4	-170.8	-66.3	0	0	109.7	I469 W472 P481 Y482 Y511 W518	I469-M500 HydrophobicContact CD1-CE 3.58Å; I469-M500 HydrophobicContact CG2-CE 4.49Å; W472-M500 HydrophobicContact CB-CE 3.72Å; W472-M500 HydrophobicContact CD2-CE 3.67Å; W472-M500 HydrophobicContact CD2-SD 3.8Å; W472-M500 HydrophobicContact CE3-CE 4.17Å; W472-M500 HydrophobicContact CE3-SD 4.1Å; W472-M500 HydrophobicContact CG-CE 3.46Å; W472-M500 VanDerWaalsContact CG-CE 3.46Å; W472-M500 HydrophobicContact CG-SD 4.2Å; W472-M500 HydrophobicContact CH2-SD 4.47Å; W472-M500 HydrophobicContact CZ2-SD 4.18Å; W472-M500 HydrophobicContact CZ3-SD 4.44Å; P481-M500 HydrophobicContact CB-CE 4.26Å; P481-M500 HydrophobicContact CB-SD 3.79Å; Y482-M500 HydrophobicContact CD1-CG 3.59Å; Y482-M500 HydrophobicContact CD1-SD 4.19Å; Y482-M500 HydrophobicContact CD2-CG 4.42Å; Y482-M500 HydrophobicContact CD2-SD 3.98Å; Y482-M500 HydrophobicContact CE1-CG 3.52Å; Y482-M500 HydrophobicContact CE1-SD 4.27Å; Y482-M500 HydrophobicContact CE2-CE 4.47Å; Y482-M500 HydrophobicContact CE2-CG 4.37Å; Y482-M500 HydrophobicContact CE2-SD 4.06Å; Y482-M500 HydrophobicContact CG-CG 4.04Å; Y482-M500 HydrophobicContact CG-SD 4.03Å; Y482-M500 PolarHBondContact N-SD 3.01Å; M500-Y511 PolarHBondContact O-OH 2.79Å; M500-W518 HydrophobicContact CB-CH2 4.12Å; M500-W518 HydrophobicContact CB-CZ3 4.31Å; M500-W518 HydrophobicContact CE-CH2 3.59Å; M500-W518 HydrophobicContact CE-CZ2 3.44Å; M500-W518 VanDerWaalsContact CE-CZ2 3.44Å
501	L	94.4	Very high	93.2	Very high	148 Å²	148	57 Å²	57	78%	0.775	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-65.6	153.9	175.6	-59.9	176.6	0	0	0	111	W472	W472-L501 PolarHBondContact NE1-O 3.21Å
502	C	96.7	Very high	93.4	Very high	57 Å²	57	61.7 Å²	61.7	39%	0.385	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-52.7	128.4	170.4	-172.3	0	0	0	0	110.3	Y511	C502-Y511 VanDerWaalsContact CA-CE2 3.43Å; C502-Y511 HydrophobicContact CB-CD1 3.73Å; C502-Y511 HydrophobicContact CB-CD2 3.83Å; C502-Y511 HydrophobicContact CB-CE1 3.78Å; C502-Y511 HydrophobicContact CB-CE2 3.87Å; C502-Y511 HydrophobicContact CB-CG 3.75Å
503	P	94.9	Very high	93.7	Very high	10 Å²	10	61.2 Å²	61.2	7%	0.065	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-62.1	141.5	173.5	-20.9	32.3	0	0	0	111.8	W472 A475 T476 G505 C506 M514	W472-P503 HydrophobicContact CG-CG 4.28Å; A475-P503 HydrophobicContact CB-CB 4.15Å; A475-P503 HydrophobicContact CB-CG 3.89Å; T476-P503 HydrophobicContact CG2-CB 3.78Å; T476-P503 HydrophobicContact CG2-CG 3.91Å; P503-G505 PolarHBondContact O-N 3.23Å; P503-C506 HydrophobicContact CB-CB 3.96Å; P503-C506 HydrophobicContact CG-CB 4.18Å; P503-C506 WeakPolarHBondContact O-CB 3.29Å; P503-C506 PolarHBondContact O-N 2.67Å; P503-M514 HydrophobicContact CG-CE 4.27Å
504	E	90.3	Very high	94	Very high	179 Å²	179	59.6 Å²	59.6	84%	0.836	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	120.6	171.8	-177.1	179.6	-163.8	0	0	110.9	C506	E504-C506 VanDerWaalsContact C-N 3.35Å
505	G	87.1	Confident	94.2	Very high	80 Å²	80	62.4 Å²	62.4	83%	0.825	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.2	6.4	-176.8	0	0	0	0	0	115.8	P503	P503-G505 PolarHBondContact O-N 3.23Å
506	C	91.8	Very high	94.5	Very high	20 Å²	20	64.5 Å²	64.5	14%	0.135	36%	0.355	C	S	.	.			trans	-72.4	131.6	172	-173.1	0	0	0	0	110.8	P503 E504	P503-C506 HydrophobicContact CB-CB 3.96Å; P503-C506 HydrophobicContact CG-CB 4.18Å; P503-C506 WeakPolarHBondContact O-CB 3.29Å; P503-C506 PolarHBondContact O-N 2.67Å; E504-C506 VanDerWaalsContact C-N 3.35Å
507	P	90.1	Very high	94.8	Very high	73 Å²	73	57.7 Å²	57.7	47%	0.474	33%	0.329	S	S	.	.			trans	-59.5	143.6	168.5	-22.3	33.6	0	0	0	111.4	V510 Y511	P507-V510 HydrophobicContact CB-CG2 4.07Å; P507-V510 HydrophobicContact CG-CG2 4.22Å; P507-V510 PolarHBondContact O-N 3.26Å; P507-Y511 PolarHBondContact O-N 3.03Å
508	E	92.2	Very high	95.1	Very high	144 Å²	144	56 Å²	56	67%	0.673	31%	0.311	S	S	*	.	H	α-helix	trans	-59.3	-45.7	-177.8	-173.6	157.8	-136.2	0	0	113.1	V510 Y511 E512	E508-V510 VanDerWaalsContact C-N 3.25Å; E508-V510 PolarHBondContact O-N 3.18Å; E508-Y511 PolarHBondContact O-N 2.88Å; E508-E512 HydrophobicContact CG-CG 4.46Å; E508-E512 PolarHBondContact O-N 2.93Å
509	P	94.3	Very high	95.4	Very high	62 Å²	62	56.5 Å²	56.5	40%	0.403	31%	0.309	S	S	.	.	H	α-helix	trans	-58.9	-32.8	176.3	-26	35.9	0	0	0	114.1	L513 M538	P509-L513 WeakPolarHBondContact O-CB 3.4Å; P509-L513 PolarHBondContact O-N 3.25Å; P509-M538 HydrophobicContact CB-CE 3.86Å; P509-M538 HydrophobicContact CB-CG 4.27Å; P509-M538 HydrophobicContact CB-SD 4.26Å; P509-M538 WeakPolarHBondContact O-CE 3.41Å
510	V	95.5	Very high	95.4	Very high	17 Å²	17	55 Å²	55	10%	0.103	30%	0.303	C	S	.	.	H	α-helix	trans	-70.5	-35.8	177.4	180	0	0	0	0	110.6	L382 P507 E508 M514 M538	L382-V510 HydrophobicContact CD1-CG2 4.2Å; P507-V510 HydrophobicContact CB-CG2 4.07Å; P507-V510 HydrophobicContact CG-CG2 4.22Å; P507-V510 PolarHBondContact O-N 3.26Å; E508-V510 VanDerWaalsContact C-N 3.25Å; E508-V510 PolarHBondContact O-N 3.18Å; V510-M514 HydrophobicContact CG1-CE 4.05Å; V510-M514 WeakPolarHBondContact O-CG 3.46Å; V510-M514 PolarHBondContact O-N 2.91Å; V510-M538 HydrophobicContact CG2-SD 3.61Å
511	Y	97.5	Very high	95.3	Very high	45 Å²	45	55.9 Å²	55.9	18%	0.176	31%	0.308	C	S	.	.	H	α-helix	trans	-76.8	-36.3	175.1	178.8	-115.5	0	0	0	112.8	M500 C502 P507 E508 L513 M514 L515 W518	M500-Y511 PolarHBondContact O-OH 2.79Å; C502-Y511 VanDerWaalsContact CA-CE2 3.43Å; C502-Y511 HydrophobicContact CB-CD1 3.73Å; C502-Y511 HydrophobicContact CB-CD2 3.83Å; C502-Y511 HydrophobicContact CB-CE1 3.78Å; C502-Y511 HydrophobicContact CB-CE2 3.87Å; C502-Y511 HydrophobicContact CB-CG 3.75Å; P507-Y511 PolarHBondContact O-N 3.03Å; E508-Y511 PolarHBondContact O-N 2.88Å; Y511-L513 VanDerWaalsContact C-N 3.28Å; Y511-L513 PolarHBondContact O-N 3.31Å; Y511-M514 HydrophobicContact CD2-CB 4.45Å; Y511-M514 HydrophobicContact CD2-SD 4.12Å; Y511-M514 WeakPolarHBondContact O-CB 3.24Å; Y511-M514 PolarHBondContact O-N 3.19Å; Y511-M514 VanDerWaalsContact O-N 3.1Å; Y511-L515 HydrophobicContact CD1-CD1 4.12Å; Y511-L515 HydrophobicContact CE1-CD1 3.68Å; Y511-L515 HydrophobicContact CE1-CG 4.19Å; Y511-L515 HydrophobicContact CE2-CD2 4.41Å; Y511-L515 HydrophobicContact CE2-CG 4.39Å; Y511-L515 WeakPolarHBondContact O-CG 3.38Å; Y511-L515 PolarHBondContact O-N 2.86Å; Y511-W518 HydrophobicContact CE2-CZ3 4.41Å
512	E	97.4	Very high	95.3	Very high	107 Å²	107	49.8 Å²	49.8	50%	0.5	28%	0.278	S	S	.	.	H	α-helix	trans	-57.1	-43.3	169.4	-70.8	-168.3	149.5	0	0	111.2	E508 M514 L515 Q516	E508-E512 HydrophobicContact CG-CG 4.46Å; E508-E512 PolarHBondContact O-N 2.93Å; E512-M514 VanDerWaalsContact C-N 3.33Å; E512-M514 PolarHBondContact O-N 3.36Å; E512-L515 CarbonylContact O-C 3.51Å; E512-L515 WeakPolarHBondContact O-CA 3.48Å; E512-L515 WeakPolarHBondContact O-CB 3.24Å; E512-L515 PolarHBondContact O-N 2.87Å; E512-Q516 WeakPolarHBondContact O-CG 3.42Å; E512-Q516 PolarHBondContact O-N 2.85Å
513	L	98.1	Very high	95.2	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62.1	-36.4	174.3	-176.7	61.4	0	0	0	112.7	L471 P509 Y511 Q516 C517 I531 Q534 L535 M538	L471-L513 HydrophobicContact CD1-CD2 4.04Å; L471-L513 HydrophobicContact CD1-CG 4.06Å; P509-L513 WeakPolarHBondContact O-CB 3.4Å; P509-L513 PolarHBondContact O-N 3.25Å; Y511-L513 VanDerWaalsContact C-N 3.28Å; Y511-L513 PolarHBondContact O-N 3.31Å; L513-Q516 PolarHBondContact O-N 3.49Å; L513-C517 PolarHBondContact O-N 3.05Å; L513-C517 PolarHBondContact O-SG 2.98Å; L513-I531 HydrophobicContact CD1-CB 4.49Å; L513-I531 HydrophobicContact CD1-CG1 4.19Å; L513-I531 HydrophobicContact CD1-CG2 4.39Å; L513-I531 HydrophobicContact CD2-CG2 4.32Å; L513-Q534 HydrophobicContact CD1-CB 4.49Å; L513-L535 HydrophobicContact CD2-CD1 4.16Å; L513-L535 HydrophobicContact CD2-CD2 3.61Å; L513-L535 HydrophobicContact CD2-CG 3.57Å; L513-M538 HydrophobicContact CB-CE 4.26Å; L513-M538 HydrophobicContact CD2-CE 4.07Å
514	M	98.5	Very high	95.3	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61.7	-42.5	170	-62.5	-179.4	-148.5	0	0	111.5	L471 W472 A475 P503 V510 Y511 E512 C517 W518	L471-M514 HydrophobicContact CB-CE 4.08Å; L471-M514 HydrophobicContact CB-CG 3.81Å; L471-M514 HydrophobicContact CB-SD 4.36Å; L471-M514 HydrophobicContact CD1-CG 4.06Å; W472-M514 HydrophobicContact CB-SD 3.86Å; W472-M514 HydrophobicContact CG-SD 4.36Å; A475-M514 HydrophobicContact CB-CE 4.02Å; P503-M514 HydrophobicContact CG-CE 4.27Å; V510-M514 HydrophobicContact CG1-CE 4.05Å; V510-M514 WeakPolarHBondContact O-CG 3.46Å; V510-M514 PolarHBondContact O-N 2.91Å; Y511-M514 HydrophobicContact CD2-CB 4.45Å; Y511-M514 HydrophobicContact CD2-SD 4.12Å; Y511-M514 WeakPolarHBondContact O-CB 3.24Å; Y511-M514 PolarHBondContact O-N 3.19Å; Y511-M514 VanDerWaalsContact O-N 3.1Å; E512-M514 VanDerWaalsContact C-N 3.33Å; E512-M514 PolarHBondContact O-N 3.36Å; M514-C517 WeakPolarHBondContact O-CB 3.39Å; M514-C517 PolarHBondContact O-N 2.85Å; M514-W518 HydrophobicContact CB-CD2 4.43Å; M514-W518 HydrophobicContact CB-CE3 4.14Å; M514-W518 HydrophobicContact CB-CH2 3.76Å; M514-W518 HydrophobicContact CB-CZ2 4.07Å; M514-W518 HydrophobicContact CB-CZ3 3.8Å; M514-W518 HydrophobicContact CG-CH2 4.26Å; M514-W518 HydrophobicContact CG-CZ2 4.48Å; M514-W518 VanDerWaalsContact O-CD2 3.26Å; M514-W518 VanDerWaalsContact O-CG 3.26Å; M514-W518 PolarHBondContact O-N 3.48Å; M514-W518 HydrophobicContact SD-CH2 3.86Å; M514-W518 HydrophobicContact SD-CZ2 4.41Å
515	L	98.3	Very high	95.6	Very high	59 Å²	59	49.4 Å²	49.4	31%	0.309	27%	0.269	S	S	.	.	H	α-helix	trans	-67.3	-34.8	177.8	-66.1	175.2	0	0	0	112.7	R499 Y511 E512 W518 Q519	R499-L515 HydrophobicContact CB-CD2 4.3Å; R499-L515 HydrophobicContact CG-CD2 4.32Å; Y511-L515 HydrophobicContact CD1-CD1 4.12Å; Y511-L515 HydrophobicContact CE1-CD1 3.68Å; Y511-L515 HydrophobicContact CE1-CG 4.19Å; Y511-L515 HydrophobicContact CE2-CD2 4.41Å; Y511-L515 HydrophobicContact CE2-CG 4.39Å; Y511-L515 WeakPolarHBondContact O-CG 3.38Å; Y511-L515 PolarHBondContact O-N 2.86Å; E512-L515 CarbonylContact O-C 3.51Å; E512-L515 WeakPolarHBondContact O-CA 3.48Å; E512-L515 WeakPolarHBondContact O-CB 3.24Å; E512-L515 PolarHBondContact O-N 2.87Å; L515-W518 HydrophobicContact CD2-CE3 4.27Å; L515-W518 CarbonylContact O-C 3.56Å; L515-W518 PolarHBondContact O-N 2.85Å; L515-Q519 PolarHBondContact O-N 3.39Å; L515-Q519 PolarHBondContact O-NE2 3.21Å
516	Q	98.3	Very high	96.2	Very high	54 Å²	54	46.3 Å²	46.3	25%	0.252	24%	0.235	S	C	.	.	H	α-helix	trans	-62.2	-44.7	168.7	-67.2	176	35.5	0	0	111.3	E512 L513 W518 Q519 P526	E512-Q516 WeakPolarHBondContact O-CG 3.42Å; E512-Q516 PolarHBondContact O-N 2.85Å; L513-Q516 PolarHBondContact O-N 3.49Å; Q516-W518 VanDerWaalsContact C-N 3.28Å; Q516-W518 PolarHBondContact O-N 2.7Å; Q516-Q519 WeakPolarHBondContact O-CG 3.34Å; Q516-Q519 PolarHBondContact O-N 2.93Å; Q516-P526 HydrophobicContact CB-CG 4.01Å; Q516-P526 WeakPolarHBondContact O-CD 3.46Å
517	C	98.6	Very high	96.4	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-64.6	-30.9	176.8	-67.2	0	0	0	0	112.8	V464 L513 M514 R525	V464-C517 HydrophobicContact CG1-CB 4.1Å; V464-C517 WeakPolarHBondContact O-CB 3.4Å; L513-C517 PolarHBondContact O-N 3.05Å; L513-C517 PolarHBondContact O-SG 2.98Å; M514-C517 WeakPolarHBondContact O-CB 3.39Å; M514-C517 PolarHBondContact O-N 2.85Å; C517-R525 WeakPolarHBondContact O-CD 3.42Å
518	W	98.3	Very high	96.8	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.008	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	21.5	179.3	-54.4	-34.5	0	0	0	114.9	W465 G468 I469 W472 R499 M500 Y511 M514 L515 Q516 W520	W465-W518 AromaticContact CD2-CD1 3.96Å; W465-W518 HydrophobicContact CE3-CB 4.25Å; W465-W518 HydrophobicContact CH2-CB 4.18Å; W465-W518 HydrophobicContact CZ3-CB 3.97Å; W465-W518 WeakPolarHBondContact CZ3-O 3.43Å; W465-W518 PolarHBondContact O-NE1 3.2Å; G468-W518 VanDerWaalsContact C-NE1 3.31Å; G468-W518 WeakPolarHBondContact O-CZ2 3.44Å; I469-W518 HydrophobicContact CD1-CZ2 3.86Å; I469-W518 VanDerWaalsContact CD1-NE1 3.34Å; W472-W518 HydrophobicContact CB-CH2 4.16Å; W472-W518 HydrophobicContact CB-CZ2 4.15Å; W472-W518 AromaticContact CD1-CH2 3.96Å; W472-W518 HydrophobicContact CG-CH2 4.31Å; R499-W518 HydrophobicContact CB-CE3 4.08Å; R499-W518 HydrophobicContact CB-CZ3 4.45Å; R499-W518 HydrophobicContact CG-CE3 4.36Å; R499-W518 PolarHBondContact NE-O 2.78Å; R499-W518 PolarHBondContact NH2-O 2.84Å; M500-W518 HydrophobicContact CB-CH2 4.12Å; M500-W518 HydrophobicContact CB-CZ3 4.31Å; M500-W518 HydrophobicContact CE-CH2 3.59Å; M500-W518 HydrophobicContact CE-CZ2 3.44Å; M500-W518 VanDerWaalsContact CE-CZ2 3.44Å; Y511-W518 HydrophobicContact CE2-CZ3 4.41Å; M514-W518 HydrophobicContact CB-CD2 4.43Å; M514-W518 HydrophobicContact CB-CE3 4.14Å; M514-W518 HydrophobicContact CB-CH2 3.76Å; M514-W518 HydrophobicContact CB-CZ2 4.07Å; M514-W518 HydrophobicContact CB-CZ3 3.8Å; M514-W518 HydrophobicContact CG-CH2 4.26Å; M514-W518 HydrophobicContact CG-CZ2 4.48Å; M514-W518 VanDerWaalsContact O-CD2 3.26Å; M514-W518 VanDerWaalsContact O-CG 3.26Å; M514-W518 PolarHBondContact O-N 3.48Å; M514-W518 HydrophobicContact SD-CH2 3.86Å; M514-W518 HydrophobicContact SD-CZ2 4.41Å; L515-W518 HydrophobicContact CD2-CE3 4.27Å; L515-W518 CarbonylContact O-C 3.56Å; L515-W518 PolarHBondContact O-N 2.85Å; Q516-W518 VanDerWaalsContact C-N 3.28Å; Q516-W518 PolarHBondContact O-N 2.7Å; W518-W520 PolarHBondContact O-N 3.39Å
519	Q	98	Very high	97	Very high	78 Å²	78	39.1 Å²	39.1	36%	0.364	20%	0.201	S	C	.	.			trans	-57.7	138.7	167.6	-69	-58.7	-29.2	0	0	110.4	L515 Q516 Q524 R525	L515-Q519 PolarHBondContact O-N 3.39Å; L515-Q519 PolarHBondContact O-NE2 3.21Å; Q516-Q519 WeakPolarHBondContact O-CG 3.34Å; Q516-Q519 PolarHBondContact O-N 2.93Å; Q519-Q524 HydrophobicContact CB-CB 3.73Å; Q519-Q524 HydrophobicContact CG-CB 4.15Å; Q519-R525 HydrophobicContact CB-CG 3.97Å; Q519-R525 PolarHBondContact O-NE 3.19Å; Q519-R525 PolarHBondContact O-NH2 3.41Å
520	W	96.2	Very high	97.2	Very high	10 Å²	10	39.6 Å²	39.6	4%	0.038	20%	0.2	C	C	.	.	S	Bend	trans	-65.7	-48.3	-170.6	175.9	-97.5	0	0	0	111.5	P450 Y491 L494 E495 W518 R525 P594 P595	P450-W520 HydrophobicContact CB-CE3 4.09Å; P450-W520 HydrophobicContact CB-CH2 3.99Å; P450-W520 HydrophobicContact CB-CZ3 3.74Å; P450-W520 HydrophobicContact CG-CE3 3.78Å; P450-W520 HydrophobicContact CG-CH2 4.49Å; P450-W520 HydrophobicContact CG-CZ3 3.73Å; Y491-W520 AromaticContact CE2-CH2 3.87Å; Y491-W520 HydrophobicContact CE2-CH2 3.87Å; L494-W520 HydrophobicContact CB-CZ3 4.13Å; L494-W520 WeakPolarHBondContact O-CZ3 3.35Å; E495-W520 HydrophobicContact CB-CH2 3.93Å; E495-W520 HydrophobicContact CB-CZ3 4.4Å; E495-W520 HydrophobicContact CG-CH2 4.06Å; W518-W520 PolarHBondContact O-N 3.39Å; W520-R525 PolarHBondContact O-NH2 3.3Å; W520-P594 HydrophobicContact CB-CB 4.32Å; W520-P594 HydrophobicContact CD2-CB 4.27Å; W520-P594 HydrophobicContact CD2-CG 3.93Å; W520-P594 HydrophobicContact CE3-CG 4.44Å; W520-P594 HydrophobicContact CG-CB 3.84Å; W520-P594 HydrophobicContact CG-CG 3.99Å; W520-P595 PolarHBondContact NE1-O 2.99Å
521	L	94.4	Very high	97.3	Very high	28 Å²	28	38.8 Å²	38.8	15%	0.147	20%	0.196	C	C	.	.	S	Bend	trans	-79	129.3	176.2	-62.5	175.1	0	0	0	110.2	E523 Q524	L521-E523 HydrophobicContact CB-CG 4.37Å; L521-E523 PolarHBondContact O-N 2.68Å; L521-Q524 HydrophobicContact CB-CB 4.47Å; L521-Q524 HydrophobicContact CB-CG 4.03Å; L521-Q524 WeakPolarHBondContact O-CB 3.45Å; L521-Q524 PolarHBondContact O-N 3.15Å
522	P	95.1	Very high	97.3	Very high	21 Å²	21	37.8 Å²	37.8	14%	0.136	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-56.5	-35	-178.6	-26.6	35.2	0	0	0	114.4	E451 K461 Q524 R525	E451-P522 HydrophobicContact CG-CG 4Å; K461-P522 HydrophobicContact CB-CB 3.86Å; K461-P522 HydrophobicContact CG-CB 4.49Å; K461-P522 WeakPolarHBondContact CG-O 3.32Å; P522-Q524 PolarHBondContact O-N 2.78Å; P522-R525 PolarHBondContact O-N 2.85Å
523	E	93.8	Very high	97.2	Very high	123 Å²	123	37.3 Å²	37.3	58%	0.575	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-69.6	-15.5	178.6	64.9	-88.5	-155	0	0	114.2	L521	L521-E523 HydrophobicContact CB-CG 4.37Å; L521-E523 PolarHBondContact O-N 2.68Å
524	Q	97	Very high	97	Very high	111 Å²	111	39.8 Å²	39.8	52%	0.519	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-89.7	-8.3	175.2	-66.8	179.1	-42.5	0	0	113.1	Q519 L521 P522	Q519-Q524 HydrophobicContact CB-CB 3.73Å; Q519-Q524 HydrophobicContact CG-CB 4.15Å; L521-Q524 HydrophobicContact CB-CB 4.47Å; L521-Q524 HydrophobicContact CB-CG 4.03Å; L521-Q524 WeakPolarHBondContact O-CB 3.45Å; L521-Q524 PolarHBondContact O-N 3.15Å; P522-Q524 PolarHBondContact O-N 2.78Å
525	R	98.1	Very high	96.8	Very high	3 Å²	3	39.8 Å²	39.8	1%	0.011	21%	0.205	C	C	.	.	S	Bend	trans	-84.5	138	178.8	-55.2	172.1	-162.7	151.5	10.4	109.4	E451 K461 V464 C517 Q519 W520 P522	E451-R525 IonicContact OE1-CZ 3.28Å; E451-R525 IonicContact OE1-NH1 2.67Å; E451-R525 PolarHBondContact OE1-NH1 2.81Å; E451-R525 IonicContact OE1-NH2 2.66Å; E451-R525 IonicContact OE2-CZ 3.08Å; E451-R525 IonicContact OE2-NH1 3.91Å; E451-R525 PolarHBondContact OE2-NH1 2.73Å; E451-R525 IonicContact OE2-NH2 3.79Å; E451-R525 PolarHBondContact OE2-NH2 2.75Å; K461-R525 HydrophobicContact CD-CB 4.39Å; K461-R525 PolarHBondContact NZ-O 2.87Å; K461-R525 WeakPolarHBondContact O-CD 3Å; K461-R525 PolarHBondContact O-NH1 2.9Å; V464-R525 HydrophobicContact CG1-CB 3.85Å; C517-R525 WeakPolarHBondContact O-CD 3.42Å; Q519-R525 HydrophobicContact CB-CG 3.97Å; Q519-R525 PolarHBondContact O-NE 3.19Å; Q519-R525 PolarHBondContact O-NH2 3.41Å; W520-R525 PolarHBondContact O-NH2 3.3Å; P522-R525 PolarHBondContact O-N 2.85Å
526	P	98	Very high	96.4	Very high	16 Å²	16	38.7 Å²	38.7	10%	0.104	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-61	153.6	178	25.7	-34.2	0	0	0	111.6	K461 V464 Q516 D530 I531	K461-P526 PolarHBondContact NZ-O 2.82Å; K461-P526 VanDerWaalsContact NZ-O 3.15Å; V464-P526 WeakPolarHBondContact CG2-O 3.39Å; Q516-P526 HydrophobicContact CB-CG 4.01Å; Q516-P526 WeakPolarHBondContact O-CD 3.46Å; P526-D530 HydrophobicContact CB-CB 4.25Å; P526-I531 HydrophobicContact CB-CG1 3.99Å; P526-I531 HydrophobicContact CG-CD1 4.06Å; P526-I531 HydrophobicContact CG-CG1 3.64Å
527	P	97.6	Very high	96	Very high	31 Å²	31	40.5 Å²	40.5	20%	0.201	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-71.7	163.7	164.8	33	-35.8	0	0	0	110.3	E396 S529 D530 I531	E396-P527 WeakPolarHBondContact OE2-CA 3.34Å; E396-P527 WeakPolarHBondContact OE2-CB 3.43Å; P527-S529 WeakPolarHBondContact CG-OG 3.47Å; P527-S529 PolarHBondContact O-N 3Å; P527-D530 VanDerWaalsContact CD-OD2 3.24Å; P527-D530 WeakPolarHBondContact CD-OD2 3.44Å; P527-D530 HydrophobicContact CG-CB 3.96Å; P527-D530 WeakPolarHBondContact CG-OD1 3.42Å; P527-D530 VanDerWaalsContact CG-OD2 3.27Å; P527-D530 WeakPolarHBondContact CG-OD2 3.44Å; P527-D530 PolarHBondContact O-N 3.15Å; P527-D530 VanDerWaalsContact O-N 3.07Å; P527-I531 WeakPolarHBondContact O-CG1 3.36Å; P527-I531 PolarHBondContact O-N 3.21Å; P527-I531 VanDerWaalsContact O-N 3.09Å
528	F	98.2	Very high	95.5	Very high	1 Å²	1	41.5 Å²	41.5	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-65.5	-23.8	178.9	-80.8	-71.1	0	0	0	113.4	M392 A393 E396 L405 D463 V464 F467 D530 I531 L532	M392-F528 HydrophobicContact CB-CB 4.49Å; M392-F528 HydrophobicContact CB-CD1 3.43Å; M392-F528 VanDerWaalsContact CB-CD1 3.43Å; M392-F528 HydrophobicContact CB-CD2 3.92Å; M392-F528 HydrophobicContact CB-CE1 3.4Å; M392-F528 HydrophobicContact CB-CE2 3.89Å; M392-F528 HydrophobicContact CB-CG 3.69Å; M392-F528 HydrophobicContact CB-CZ 3.63Å; M392-F528 HydrophobicContact CE-CE2 3.76Å; M392-F528 HydrophobicContact CE-CZ 3.81Å; M392-F528 HydrophobicContact CG-CD1 4.36Å; M392-F528 HydrophobicContact CG-CE1 3.85Å; M392-F528 HydrophobicContact CG-CZ 3.93Å; A393-F528 HydrophobicContact CB-CB 3.91Å; E396-F528 HydrophobicContact CB-CD2 4.28Å; E396-F528 PolarHBondContact OE2-N 2.68Å; L405-F528 HydrophobicContact CD2-CZ 4.41Å; D463-F528 HydrophobicContact CB-CE2 4.03Å; D463-F528 HydrophobicContact CB-CZ 4.16Å; V464-F528 HydrophobicContact CB-CE2 4.43Å; V464-F528 HydrophobicContact CB-CZ 4.35Å; V464-F528 HydrophobicContact CG2-CD1 4.48Å; V464-F528 HydrophobicContact CG2-CD2 3.75Å; V464-F528 HydrophobicContact CG2-CE1 4.24Å; V464-F528 HydrophobicContact CG2-CE2 3.47Å; V464-F528 VanDerWaalsContact CG2-CE2 3.47Å; V464-F528 HydrophobicContact CG2-CG 4.26Å; V464-F528 HydrophobicContact CG2-CZ 3.74Å; F467-F528 HydrophobicContact CB-CE1 3.69Å; F467-F528 HydrophobicContact CB-CZ 3.98Å; F467-F528 HydrophobicContact CD1-CE1 4.3Å; F467-F528 HydrophobicContact CD2-CE1 4.06Å; F467-F528 AromaticContact CG-CE1 3.75Å; F467-F528 HydrophobicContact CG-CE1 3.75Å; F528-D530 VanDerWaalsContact C-N 3.33Å; F528-I531 HydrophobicContact CD1-CD1 3.92Å; F528-I531 HydrophobicContact CE1-CD1 4.2Å; F528-I531 HydrophobicContact CG-CD1 4.44Å; F528-L532 WeakPolarHBondContact O-CB 3.44Å; F528-L532 PolarHBondContact O-N 2.97Å
529	S	96.4	Very high	94.3	Very high	53 Å²	53	44.9 Å²	44.9	37%	0.371	24%	0.244	S	C	.	.	H	α-helix	trans	-57.3	-45.5	168	53.5	0	0	0	0	112.1	P527 L532 N533	P527-S529 WeakPolarHBondContact CG-OG 3.47Å; P527-S529 PolarHBondContact O-N 3Å; S529-L532 PolarHBondContact O-N 3.23Å; S529-N533 PolarHBondContact O-N 3.42Å; S529-N533 PolarHBondContact O-ND2 3.4Å; S529-N533 PolarHBondContact O-OD1 3.18Å
530	D	97.6	Very high	92.6	Very high	73 Å²	73	41.8 Å²	41.8	39%	0.39	23%	0.231	S	C	.	.	H	α-helix	trans	-84.3	-29	-171	-55.7	5.3	0	0	0	110.5	P526 P527 F528 Q534	P526-D530 HydrophobicContact CB-CB 4.25Å; P527-D530 VanDerWaalsContact CD-OD2 3.24Å; P527-D530 WeakPolarHBondContact CD-OD2 3.44Å; P527-D530 HydrophobicContact CG-CB 3.96Å; P527-D530 WeakPolarHBondContact CG-OD1 3.42Å; P527-D530 VanDerWaalsContact CG-OD2 3.27Å; P527-D530 WeakPolarHBondContact CG-OD2 3.44Å; P527-D530 PolarHBondContact O-N 3.15Å; P527-D530 VanDerWaalsContact O-N 3.07Å; F528-D530 VanDerWaalsContact C-N 3.33Å; D530-Q534 WeakPolarHBondContact O-CB 3.26Å; D530-Q534 VanDerWaalsContact O-CG 3.26Å; D530-Q534 WeakPolarHBondContact O-CG 3.2Å; D530-Q534 PolarHBondContact O-N 3.46Å; D530-Q534 VanDerWaalsContact O-N 3.11Å; D530-Q534 PolarHBondContact O-NE2 3.47Å; D530-Q534 VanDerWaalsContact O-NE2 3.11Å
531	I	98.3	Very high	90.6	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.4	-44.5	166.8	-65.7	168.9	0	0	0	110.3	A389 V464 F467 L513 P526 P527 F528 L535	A389-I531 HydrophobicContact CB-CG2 4.35Å; V464-I531 HydrophobicContact CB-CD1 4.29Å; V464-I531 HydrophobicContact CG1-CD1 3.68Å; V464-I531 HydrophobicContact CG2-CD1 3.85Å; F467-I531 HydrophobicContact CD1-CD1 4.48Å; F467-I531 HydrophobicContact CD1-CG2 3.81Å; F467-I531 HydrophobicContact CE1-CG2 3.32Å; F467-I531 HydrophobicContact CZ-CG2 4.06Å; L513-I531 HydrophobicContact CD1-CB 4.49Å; L513-I531 HydrophobicContact CD1-CG1 4.19Å; L513-I531 HydrophobicContact CD1-CG2 4.39Å; L513-I531 HydrophobicContact CD2-CG2 4.32Å; P526-I531 HydrophobicContact CB-CG1 3.99Å; P526-I531 HydrophobicContact CG-CD1 4.06Å; P526-I531 HydrophobicContact CG-CG1 3.64Å; P527-I531 WeakPolarHBondContact O-CG1 3.36Å; P527-I531 PolarHBondContact O-N 3.21Å; P527-I531 VanDerWaalsContact O-N 3.09Å; F528-I531 HydrophobicContact CD1-CD1 3.92Å; F528-I531 HydrophobicContact CE1-CD1 4.2Å; F528-I531 HydrophobicContact CG-CD1 4.44Å; I531-L535 HydrophobicContact CG2-CD1 3.97Å; I531-L535 WeakPolarHBondContact O-CG 3.47Å; I531-L535 PolarHBondContact O-N 3.17Å
532	L	97.1	Very high	88.1	Confident	24 Å²	24	49.2 Å²	49.2	13%	0.126	28%	0.281	C	S	.	.	H	α-helix	trans	-62.9	-54.2	178.1	177.4	61.6	0	0	0	110.7	T386 A389 R390 A393 F528 S529 Q534 L535 E536	T386-L532 HydrophobicContact CG2-CD1 3.7Å; A389-L532 HydrophobicContact CB-CB 4.33Å; A389-L532 HydrophobicContact CB-CD1 4.02Å; R390-L532 HydrophobicContact CB-CD1 4.48Å; R390-L532 HydrophobicContact CG-CD1 3.39Å; R390-L532 HydrophobicContact CG-CD2 3.8Å; R390-L532 HydrophobicContact CG-CG 4.25Å; A393-L532 HydrophobicContact CB-CD2 4.43Å; F528-L532 WeakPolarHBondContact O-CB 3.44Å; F528-L532 PolarHBondContact O-N 2.97Å; S529-L532 PolarHBondContact O-N 3.23Å; L532-Q534 VanDerWaalsContact C-N 3.26Å; L532-Q534 PolarHBondContact O-N 3.4Å; L532-L535 PolarHBondContact O-N 2.85Å; L532-E536 HydrophobicContact CD1-CG 3.88Å; L532-E536 WeakPolarHBondContact CD1-OE1 3.43Å; L532-E536 HydrophobicContact CG-CG 4.28Å; L532-E536 WeakPolarHBondContact O-CG 3.46Å; L532-E536 PolarHBondContact O-N 3.05Å
533	N	94.5	Very high	85.3	Confident	96 Å²	96	49.9 Å²	49.9	51%	0.513	29%	0.285	S	S	.	.	H	α-helix	trans	-54	-42.8	179	-66.3	-17.6	0	0	0	111.8	S529 E536 S537	S529-N533 PolarHBondContact O-N 3.42Å; S529-N533 PolarHBondContact O-ND2 3.4Å; S529-N533 PolarHBondContact O-OD1 3.18Å; N533-E536 PolarHBondContact O-N 3.03Å; N533-S537 WeakPolarHBondContact O-CB 3.49Å; N533-S537 PolarHBondContact O-N 2.98Å; N533-S537 PolarHBondContact O-OG 3.41Å
534	Q	95.7	Very high	82.3	Confident	52 Å²	52	48.8 Å²	48.8	24%	0.243	28%	0.281	C	S	.	.	H	α-helix	trans	-62.1	-47.1	175.3	-78.8	177.6	87.4	0	0	112.7	L513 D530 L532 E536 S537 M538	L513-Q534 HydrophobicContact CD1-CB 4.49Å; D530-Q534 WeakPolarHBondContact O-CB 3.26Å; D530-Q534 VanDerWaalsContact O-CG 3.26Å; D530-Q534 WeakPolarHBondContact O-CG 3.2Å; D530-Q534 PolarHBondContact O-N 3.46Å; D530-Q534 VanDerWaalsContact O-N 3.11Å; D530-Q534 PolarHBondContact O-NE2 3.47Å; D530-Q534 VanDerWaalsContact O-NE2 3.11Å; L532-Q534 VanDerWaalsContact C-N 3.26Å; L532-Q534 PolarHBondContact O-N 3.4Å; Q534-E536 VanDerWaalsContact C-N 3.27Å; Q534-E536 PolarHBondContact O-N 3.17Å; Q534-S537 PolarHBondContact O-N 3Å; Q534-S537 PolarHBondContact O-OG 3.23Å; Q534-M538 HydrophobicContact CB-CE 4.34Å; Q534-M538 VanDerWaalsContact O-CG 3.31Å; Q534-M538 WeakPolarHBondContact O-CG 3.46Å; Q534-M538 PolarHBondContact O-N 3.19Å
535	L	94.3	Very high	79.6	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-67.4	-26.1	178.3	-72.9	168.2	0	0	0	113.4	L382 T386 A389 F467 L471 L513 I531 L532 M538	L382-L535 HydrophobicContact CD1-CD2 3.67Å; T386-L535 HydrophobicContact CG2-CB 4.09Å; A389-L535 HydrophobicContact CB-CD1 3.77Å; F467-L535 HydrophobicContact CE1-CD1 3.99Å; F467-L535 HydrophobicContact CZ-CD1 3.7Å; L471-L535 HydrophobicContact CD2-CD2 4.48Å; L513-L535 HydrophobicContact CD2-CD1 4.16Å; L513-L535 HydrophobicContact CD2-CD2 3.61Å; L513-L535 HydrophobicContact CD2-CG 3.57Å; I531-L535 HydrophobicContact CG2-CD1 3.97Å; I531-L535 WeakPolarHBondContact O-CG 3.47Å; I531-L535 PolarHBondContact O-N 3.17Å; L532-L535 PolarHBondContact O-N 2.85Å; L535-M538 HydrophobicContact CD2-SD 4.17Å
536	E	89.4	Confident	76.8	Confident	37 Å²	37	57 Å²	57	17%	0.173	32%	0.32	C	S	.	.	H	α-helix	trans	-79	-34.1	175.4	-67.7	-175.4	152.1	0	0	111.5	Q173 T386 R390 L532 N533 Q534	Q173-E536 PolarHBondContact NE2-OE1 3.46Å; Q173-E536 PolarHBondContact NE2-OE2 2.85Å; Q173-E536 VanDerWaalsContact NE2-OE2 3.12Å; Q173-E536 PolarHBondContact OE1-OE1 3.24Å; T386-E536 HydrophobicContact CG2-CG 3.46Å; T386-E536 VanDerWaalsContact CG2-CG 3.46Å; R390-E536 IonicContact CZ-OE1 3.94Å; R390-E536 IonicContact NE-OE1 3.36Å; R390-E536 PolarHBondContact NE-OE1 3.1Å; R390-E536 IonicContact NH2-OE1 2.66Å; R390-E536 PolarHBondContact NH2-OE1 3.21Å; L532-E536 HydrophobicContact CD1-CG 3.88Å; L532-E536 WeakPolarHBondContact CD1-OE1 3.43Å; L532-E536 HydrophobicContact CG-CG 4.28Å; L532-E536 WeakPolarHBondContact O-CG 3.46Å; L532-E536 PolarHBondContact O-N 3.05Å; N533-E536 PolarHBondContact O-N 3.03Å; Q534-E536 VanDerWaalsContact C-N 3.27Å; Q534-E536 PolarHBondContact O-N 3.17Å
537	S	89.4	Confident	74.1	Confident	91 Å²	91	61.4 Å²	61.4	64%	0.636	34%	0.339	S	S	*	.	H	α-helix	trans	-79.6	-10.6	176.6	63.9	0	0	0	0	115.6	N533 Q534	N533-S537 WeakPolarHBondContact O-CB 3.49Å; N533-S537 PolarHBondContact O-N 2.98Å; N533-S537 PolarHBondContact O-OG 3.41Å; Q534-S537 PolarHBondContact O-N 3Å; Q534-S537 PolarHBondContact O-OG 3.23Å
538	M	88.7	Confident	71.6	Confident	21 Å²	21	65.5 Å²	65.5	10%	0.103	36%	0.355	C	S	.	.	S	Bend	trans	-73.7	126.2	-177	-81.6	171	-164	0	0	112.1	L382 P509 V510 L513 Q534 L535 T540	L382-M538 HydrophobicContact CD1-SD 4.18Å; L382-M538 HydrophobicContact CD2-CB 4.06Å; P509-M538 HydrophobicContact CB-CE 3.86Å; P509-M538 HydrophobicContact CB-CG 4.27Å; P509-M538 HydrophobicContact CB-SD 4.26Å; P509-M538 WeakPolarHBondContact O-CE 3.41Å; V510-M538 HydrophobicContact CG2-SD 3.61Å; L513-M538 HydrophobicContact CB-CE 4.26Å; L513-M538 HydrophobicContact CD2-CE 4.07Å; Q534-M538 HydrophobicContact CB-CE 4.34Å; Q534-M538 VanDerWaalsContact O-CG 3.31Å; Q534-M538 WeakPolarHBondContact O-CG 3.46Å; Q534-M538 PolarHBondContact O-N 3.19Å; L535-M538 HydrophobicContact CD2-SD 4.17Å; M538-T540 PolarHBondContact O-N 3.19Å
539	P	71.6	Confident	68.9	Low	73 Å²	73	74.2 Å²	74.2	47%	0.474	40%	0.396	S	S	.	.			trans	-67.4	130.5	174.3	27.5	-33.6	0	0	0	110.7
540	T	64.1	Low	66.1	Low	13 Å²	13	76.8 Å²	76.8	8%	0.08	40%	0.402	C	S	.	.	S	Bend	trans	-86	-9.1	-174.9	31	0	0	0	0	114.9	E178 L382 M538	E178-T540 WeakPolarHBondContact OE2-CB 3.33Å; E178-T540 PolarHBondContact OE2-OG1 2.92Å; L382-T540 HydrophobicContact CB-CG2 4.15Å; L382-T540 HydrophobicContact CD2-CG2 3.37Å; L382-T540 HydrophobicContact CG-CG2 4.38Å; M538-T540 PolarHBondContact O-N 3.19Å
541	N	53.4	Low	63.5	Low	71 Å²	71	77.5 Å²	77.5	38%	0.38	41%	0.405	S	S	.	.	S	Bend	trans	-144.8	157.2	173.4	-75.6	-73.9	0	0	0	110	E178 T543	E178-N541 PolarHBondContact OE2-ND2 2.96Å; N541-T543 VanDerWaalsContact C-N 3.25Å; N541-T543 PolarHBondContact O-N 3.14Å
542	S	42.1	Very low	60.7	Low	123 Å²	123	82.9 Å²	82.9	86%	0.86	43%	0.433	S	S	*	.			trans	-77.8	71.7	172.3	57.1	0	0	0	0	111.4
543	T	36.3	Very low	57.9	Low	35 Å²	35	88.4 Å²	88.4	22%	0.215	46%	0.457	C	S	.	.			trans	-90.8	138.2	165	50	0	0	0	0	109.5	R174 N541 E545	R174-T543 PolarHBondContact NH2-OG1 2.86Å; N541-T543 VanDerWaalsContact C-N 3.25Å; N541-T543 PolarHBondContact O-N 3.14Å; T543-E545 PolarHBondContact O-N 3.5Å
544	M	31	Very low	55.2	Low	101 Å²	101	87.6 Å²	87.6	50%	0.498	45%	0.452	S	S	.	.			trans	-73.3	89.9	-168	-57.3	-95.5	58.1	0	0	112.9	E546 E547	M544-E546 PolarHBondContact O-N 3.1Å; M544-E547 HydrophobicContact CB-CB 4.14Å; M544-E547 HydrophobicContact CB-CG 3.89Å; M544-E547 HydrophobicContact CG-CG 4.42Å; M544-E547 PolarHBondContact O-N 2.85Å
545	E	40.1	Very low	52.7	Low	115 Å²	115	89.6 Å²	89.6	54%	0.537	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-2.8	165.7	-64.8	-175.7	164.7	0	0	112.2	R174 T543	R174-E545 IonicContact CZ-OE1 2.66Å; R174-E545 IonicContact NH1-OE1 3.99Å; R174-E545 PolarHBondContact NH1-OE1 3.18Å; R174-E545 VanDerWaalsContact NH1-OE1 3.07Å; T543-E545 PolarHBondContact O-N 3.5Å
546	E	39.6	Very low	50.2	Low	172 Å²	172	94.4 Å²	94.4	80%	0.804	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-4.4	171.9	-62.2	-173.8	146.6	0	0	114	M544	M544-E546 PolarHBondContact O-N 3.1Å
547	E	40.5	Very low	47.7	Very low	108 Å²	108	95.8 Å²	95.8	51%	0.505	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	-20.5	177.6	-71.5	-175.4	157	0	0	113.9	M544 E549 Q550 I551	M544-E547 HydrophobicContact CB-CB 4.14Å; M544-E547 HydrophobicContact CB-CG 3.89Å; M544-E547 HydrophobicContact CG-CG 4.42Å; M544-E547 PolarHBondContact O-N 2.85Å; E547-E549 PolarHBondContact O-N 3.45Å; E547-Q550 WeakPolarHBondContact O-CB 3.4Å; E547-Q550 PolarHBondContact O-N 2.97Å; E547-I551 HydrophobicContact CB-CD1 4.32Å; E547-I551 WeakPolarHBondContact O-CG1 3.19Å; E547-I551 PolarHBondContact O-N 2.63Å; E547-I551 VanDerWaalsContact O-N 3.12Å
548	E	44.7	Very low	45.1	Very low	117 Å²	117	96.6 Å²	96.6	55%	0.547	51%	0.508	S	S	.	.	H	α-helix	trans	-66.1	-34.4	-175.2	-68.7	-171.8	173.3	0	0	113.4	Q550	E548-Q550 VanDerWaalsContact C-N 3.27Å; E548-Q550 PolarHBondContact O-N 2.75Å
549	E	42.5	Very low	42.6	Very low	183 Å²	183	101.6 Å²	101.6	86%	0.855	54%	0.54	S	S	*	.	H	α-helix	trans	-69.7	-21	172.9	-70.8	-164.1	151.5	0	0	113.3	E547	E547-E549 PolarHBondContact O-N 3.45Å
550	Q	37.9	Very low	40.8	Very low	108 Å²	108	103 Å²	103	51%	0.505	55%	0.551	S	S	.	*	H	α-helix	trans	-86.6	-35	179.9	-169	62.4	62.6	0	0	111.6	E547 E548 F553 D554	E547-Q550 WeakPolarHBondContact O-CB 3.4Å; E547-Q550 PolarHBondContact O-N 2.97Å; E548-Q550 VanDerWaalsContact C-N 3.27Å; E548-Q550 PolarHBondContact O-N 2.75Å; Q550-F553 WeakPolarHBondContact O-CB 3.46Å; Q550-F553 PolarHBondContact O-N 3.18Å; Q550-D554 PolarHBondContact O-N 3.22Å
551	I	41.9	Very low	39.3	Very low	87 Å²	87	108 Å²	108	45%	0.446	59%	0.587	S	S	.	*	H	α-helix	trans	-69.7	-37.9	-177.5	-68.9	165.6	0	0	0	111.9	E547 F553 D554 I555	E547-I551 HydrophobicContact CB-CD1 4.32Å; E547-I551 WeakPolarHBondContact O-CG1 3.19Å; E547-I551 PolarHBondContact O-N 2.63Å; E547-I551 VanDerWaalsContact O-N 3.12Å; I551-F553 PolarHBondContact O-N 2.94Å; I551-D554 PolarHBondContact O-N 3.21Å; I551-I555 HydrophobicContact CG2-CD1 3.57Å; I551-I555 HydrophobicContact CG2-CG1 4.21Å; I551-I555 WeakPolarHBondContact O-CB 3.21Å; I551-I555 WeakPolarHBondContact O-CG1 3.32Å; I551-I555 PolarHBondContact O-N 3.4Å
552	D	40.1	Very low	38.1	Very low	113 Å²	113	111 Å²	111	60%	0.604	61%	0.614	S	S	*	*	H	α-helix	trans	-65.4	-25.8	176.7	-129.6	9.1	0	0	0	112.1	T556	D552-T556 WeakPolarHBondContact O-CG2 3.18Å; D552-T556 PolarHBondContact O-OG1 3.44Å
553	F	38.3	Very low	37.6	Very low	141 Å²	141	109.9 Å²	109.9	62%	0.618	61%	0.606	S	S	*	*	H	α-helix	trans	-80.3	-35.5	176	-166.2	-94.9	0	0	0	113.2	Q550 I551 T556 S557	Q550-F553 WeakPolarHBondContact O-CB 3.46Å; Q550-F553 PolarHBondContact O-N 3.18Å; I551-F553 PolarHBondContact O-N 2.94Å; F553-T556 PolarHBondContact O-OG1 3.34Å; F553-S557 PolarHBondContact O-OG 3.49Å
554	D	36.8	Very low	37.5	Very low	78 Å²	78	116.6 Å²	116.6	42%	0.417	64%	0.64	S	S	.	*	H	α-helix	trans	-83.9	-27.9	-178.9	-71	-11.7	0	0	0	112.6	Q550 I551 S557 T558	Q550-D554 PolarHBondContact O-N 3.22Å; I551-D554 PolarHBondContact O-N 3.21Å; D554-S557 PolarHBondContact O-OG 3.08Å; D554-T558 WeakPolarHBondContact O-CB 3.29Å; D554-T558 VanDerWaalsContact O-CG2 3.25Å; D554-T558 WeakPolarHBondContact O-CG2 3.47Å; D554-T558 PolarHBondContact O-N 3.18Å; D554-T558 PolarHBondContact O-OG1 3.2Å
555	I	43.8	Very low	37.4	Very low	95 Å²	95	119.2 Å²	119.2	49%	0.487	66%	0.655	S	S	.	*	H	α-helix	trans	-71.4	-34.8	174	-70.1	175.1	0	0	0	111.7	I551 S557	I551-I555 HydrophobicContact CG2-CD1 3.57Å; I551-I555 HydrophobicContact CG2-CG1 4.21Å; I551-I555 WeakPolarHBondContact O-CB 3.21Å; I551-I555 WeakPolarHBondContact O-CG1 3.32Å; I551-I555 PolarHBondContact O-N 3.4Å; I555-S557 VanDerWaalsContact C-N 3.34Å; I555-S557 PolarHBondContact O-N 3.06Å
556	T	41.8	Very low	36.9	Very low	100 Å²	100	120.4 Å²	120.4	61%	0.613	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-12	-179.4	48.6	0	0	0	0	114.2	D552 F553	D552-T556 WeakPolarHBondContact O-CG2 3.18Å; D552-T556 PolarHBondContact O-OG1 3.44Å; F553-T556 PolarHBondContact O-OG1 3.34Å
557	S	37.9	Very low	36.5	Very low	66 Å²	66	119.5 Å²	119.5	46%	0.462	67%	0.665	S	S	.	*	T	Hydrogen-bonded Turn	trans	-111	-13.6	-174	56.5	0	0	0	0	115.3	F553 D554 I555 T559	F553-S557 PolarHBondContact O-OG 3.49Å; D554-S557 PolarHBondContact O-OG 3.08Å; I555-S557 VanDerWaalsContact C-N 3.34Å; I555-S557 PolarHBondContact O-N 3.06Å; S557-T559 PolarHBondContact O-N 3.09Å
558	T	33.5	Very low	36.1	Very low	108 Å²	108	119.9 Å²	119.9	66%	0.663	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-2	-170.1	33.1	0	0	0	0	116.2	D554 S560	D554-T558 WeakPolarHBondContact O-CB 3.29Å; D554-T558 VanDerWaalsContact O-CG2 3.25Å; D554-T558 WeakPolarHBondContact O-CG2 3.47Å; D554-T558 PolarHBondContact O-N 3.18Å; D554-T558 PolarHBondContact O-OG1 3.2Å; T558-S560 VanDerWaalsContact C-N 3.34Å; T558-S560 PolarHBondContact O-N 3.45Å
559	T	36.4	Very low	35.5	Very low	127 Å²	127	121.6 Å²	121.6	78%	0.779	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	7.3	179.1	50.9	0	0	0	0	114.9	S557	S557-T559 PolarHBondContact O-N 3.09Å
560	S	33.3	Very low	35	Very low	101 Å²	101	122 Å²	122	71%	0.706	69%	0.685	S	S	*	*	S	Bend	trans	-152.8	68.2	-176.9	-76.7	0	0	0	0	116.3	T558	T558-S560 VanDerWaalsContact C-N 3.34Å; T558-S560 PolarHBondContact O-N 3.45Å
561	S	33.1	Very low	34.5	Very low	119 Å²	119	123.9 Å²	123.9	83%	0.832	70%	0.697	S	S	*	*			trans	176.9	98.3	140.8	-84	0	0	0	0	113.4	S563	S561-S563 PolarHBondContact O-N 3.38Å
562	S	28.2	Very low	34	Very low	134 Å²	134	128.8 Å²	128.8	94%	0.937	72%	0.715	S	S	*	*			trans	-99.4	68.9	-178.5	-52	0	0	0	0	113.8
563	S	31.8	Very low	33.4	Very low	100 Å²	100	128.9 Å²	128.9	70%	0.699	72%	0.72	S	S	*	*			trans	-165.5	111.2	165.8	59.4	0	0	0	0	115.3	S561	S561-S563 PolarHBondContact O-N 3.38Å
564	L	34.1	Very low	33.1	Very low	175 Å²	175	128.8 Å²	128.8	92%	0.916	72%	0.724	S	S	*	*				177	158	111.3	-91.3	170.6	0	0	0	110.3
565	L	29.6	Very low	32.6	Very low	156 Å²	156	132.3 Å²	132.3	82%	0.817	74%	0.743	S	S	*	*			trans	-114.3	155.8	-162.9	-69.5	168.4	0	0	0	114.1
566	L	28.1	Very low	32.1	Very low	140 Å²	140	133.1 Å²	133.1	73%	0.733	76%	0.757	S	S	*	*			trans	1.6	134.8	160.5	-63.8	92.9	0	0	0	118.7
567	N	32.8	Very low	31.5	Very low	154 Å²	154	133.2 Å²	133.2	82%	0.824	76%	0.762	S	S	*	*				-151.2	165.3	119.6	-129.7	-37.4	0	0	0	114.7
568	N	31.8	Very low	31.1	Very low	116 Å²	116	138.8 Å²	138.8	62%	0.62	78%	0.781	S	S	*	*			trans	-88.2	161.5	-160.3	-58.7	-84.1	0	0	0	115.2
569	N	31.3	Very low	31	Very low	152 Å²	152	138.4 Å²	138.4	81%	0.813	78%	0.783	S	S	*	*			trans	49.2	118.8	145.5	-60.6	-16.1	0	0	0	120.4
570	E	32.3	Very low	30.6	Very low	191 Å²	191	140.5 Å²	140.5	89%	0.893	79%	0.789	S	S	*	*				-155.1	155.2	111.6	-126.2	-179.6	-153.1	0	0	112.7
571	I	27.6	Very low	30.4	Very low	148 Å²	148	146.7 Å²	146.7	76%	0.759	80%	0.797	S	S	*	*			trans	-99.9	134.1	-176.5	-65.2	170.2	0	0	0	109.9	V573	I571-V573 HydrophobicContact CG2-CG2 4.21Å
572	K	32.3	Very low	30.2	Very low	191 Å²	191	145.8 Å²	145.8	83%	0.83	79%	0.79	S	S	*	*			trans	-136.7	96.8	162.4	-119.1	167.7	-172	161.6	0	112.6
573	V	26.8	Very low	30.4	Very low	114 Å²	114	146.8 Å²	146.8	69%	0.691	78%	0.784	S	S	*	*			trans	-67.7	126.5	165.5	177.3	0	0	0	0	108.5	I571	I571-V573 HydrophobicContact CG2-CG2 4.21Å
574	I	31.4	Very low	30.3	Very low	140 Å²	140	151.3 Å²	151.3	72%	0.718	79%	0.791	S	S	*	*			trans	-124.4	108.3	163.3	-65.8	168.7	0	0	0	107.4	S576	I574-S576 PolarHBondContact O-N 3.22Å
575	N	26.1	Very low	30.2	Very low	151 Å²	151	151.2 Å²	151.2	81%	0.807	79%	0.785	S	S	*	*			trans	-71.1	124.2	165.4	-70.4	-24.8	0	0	0	108.6
576	S	34.6	Very low	30.4	Very low	113 Å²	113	149.2 Å²	149.2	79%	0.79	78%	0.782	S	S	*	*			trans	-128.3	123.8	159	47.9	0	0	0	0	108.7	I574	I574-S576 PolarHBondContact O-N 3.22Å
577	S	28.9	Very low	30.4	Very low	102 Å²	102	147.4 Å²	147.4	71%	0.713	78%	0.778	S	S	*	*			trans	-84	159.1	-171.4	51.4	0	0	0	0	112.6
578	E	28.6	Very low	30.3	Very low	182 Å²	182	147.5 Å²	147.5	85%	0.85	78%	0.779	S	S	*	*			trans	53.5	100.7	150.6	-66	169.3	135.6	0	0	118.6
579	S	32.3	Very low	30.3	Very low	101 Å²	101	147.3 Å²	147.3	71%	0.706	78%	0.777	S	S	*	*				-145.2	112.1	127.2	56.7	0	0	0	0	111.7	R581	S579-R581 PolarHBondContact O-N 3.23Å
580	N	27.6	Very low	30.3	Very low	170 Å²	170	143.4 Å²	143.4	91%	0.909	77%	0.765	S	S	*	*			trans	-68.2	90.7	171.3	-88	-44	0	0	0	109.8	S582	N580-S582 PolarHBondContact O-N 3.24Å
581	R	29.3	Very low	30.3	Very low	231 Å²	231	143.4 Å²	143.4	87%	0.872	76%	0.759	S	S	*	*			trans	-75.5	72.5	165.8	-74	-166.6	175.6	-159.1	-0.4	110.2	S579 I583	S579-R581 PolarHBondContact O-N 3.23Å; R581-I583 PolarHBondContact O-N 3.34Å
582	S	27.9	Very low	30.7	Very low	100 Å²	100	142 Å²	142	70%	0.699	76%	0.759	S	S	*	*			trans	-52	132	160.5	-177.8	0	0	0	0	108.9	N580 K584	N580-S582 PolarHBondContact O-N 3.24Å; S582-K584 PolarHBondContact O-N 3.05Å
583	I	33.1	Very low	31.1	Very low	156 Å²	156	137.5 Å²	137.5	80%	0.8	74%	0.737	S	S	*	*			trans	-66	100.1	179.2	-60.6	175	0	0	0	107.1	R581 H585	R581-I583 PolarHBondContact O-N 3.34Å; I583-H585 PolarHBondContact O-N 2.99Å
584	K	29.3	Very low	31.8	Very low	194 Å²	194	133.7 Å²	133.7	84%	0.843	71%	0.714	S	S	*	*			trans	-66.6	110.7	178.4	-70.9	-173.2	177.1	-176.5	0	108.5	S582	S582-K584 PolarHBondContact O-N 3.05Å
585	H	31.7	Very low	32.4	Very low	173 Å²	173	130.7 Å²	130.7	80%	0.801	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-48.3	138.9	162.1	-63.1	-77.4	0	0	0	109.2	I583	I583-H585 PolarHBondContact O-N 2.99Å
586	P	34.2	Very low	33.1	Very low	114 Å²	114	126.9 Å²	126.9	74%	0.74	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-57.4	138.2	168.7	26	-33.3	0	0	0	108.6
587	P	28.2	Very low	33.3	Very low	102 Å²	102	121.9 Å²	121.9	66%	0.662	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-60.3	149.5	178.7	26	-33.7	0	0	0	110.1	I589	P587-I589 HydrophobicContact CG-CD1 4.38Å; P587-I589 HydrophobicContact CG-CG1 4.29Å; P587-I589 PolarHBondContact O-N 3.47Å
588	N	31.7	Very low	33.9	Very low	157 Å²	157	121.7 Å²	121.7	84%	0.84	64%	0.644	S	S	*	*			trans	-73.2	66.6	-176.4	-170.4	27.7	0	0	0	111.6	A590	N588-A590 PolarHBondContact O-N 3.33Å
589	I	30.9	Very low	34.4	Very low	111 Å²	111	120.2 Å²	120.2	57%	0.569	63%	0.631	S	S	*	*			trans	-66.6	115.8	177.2	-63.2	173.8	0	0	0	107.8	P587 Y591	P587-I589 HydrophobicContact CG-CD1 4.38Å; P587-I589 HydrophobicContact CG-CG1 4.29Å; P587-I589 PolarHBondContact O-N 3.47Å; I589-Y591 VanDerWaalsContact C-N 3.35Å; I589-Y591 VanDerWaalsContact O-CD2 3.28Å; I589-Y591 WeakPolarHBondContact O-CD2 3.48Å; I589-Y591 PolarHBondContact O-N 3.3Å
590	A	32	Very low	34.7	Very low	70 Å²	70	117.5 Å²	117.5	58%	0.579	61%	0.611	S	S	*	*			trans	-67.3	88.8	179.8	0	0	0	0	0	111.1	N588	N588-A590 PolarHBondContact O-N 3.33Å
591	Y	32.1	Very low	35	Very low	191 Å²	191	114.7 Å²	114.7	75%	0.749	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-55	130.4	172.7	-67.3	-82.6	0	0	0	110.1	I589 R593	I589-Y591 VanDerWaalsContact C-N 3.35Å; I589-Y591 VanDerWaalsContact O-CD2 3.28Å; I589-Y591 WeakPolarHBondContact O-CD2 3.48Å; I589-Y591 PolarHBondContact O-N 3.3Å; Y591-R593 PolarHBondContact O-N 3.26Å
592	P	36.6	Very low	35.1	Very low	118 Å²	118	108.2 Å²	108.2	77%	0.766	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-60	130.5	176.6	25.2	-33.3	0	0	0	109.2
593	R	39.4	Very low	35.4	Very low	98 Å²	98	108.7 Å²	108.7	37%	0.37	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-47.7	123	-176	178	175.8	-63.9	-97.6	-13.6	110.3	E495 Y591	E495-R593 VanDerWaalsContact CD-NH1 3.35Å; E495-R593 IonicContact OE2-CZ 3.19Å; E495-R593 IonicContact OE2-NH1 2.74Å; E495-R593 PolarHBondContact OE2-NH1 2.68Å; Y591-R593 PolarHBondContact O-N 3.26Å
594	P	42.7	Very low	35.4	Very low	33 Å²	33	112.5 Å²	112.5	21%	0.214	60%	0.595	C	S	.	*	P	Polyproline II helix	trans	-61.3	142.9	-178	26.5	-34.9	0	0	0	110	W520	W520-P594 HydrophobicContact CB-CB 4.32Å; W520-P594 HydrophobicContact CD2-CB 4.27Å; W520-P594 HydrophobicContact CD2-CG 3.93Å; W520-P594 HydrophobicContact CE3-CG 4.44Å; W520-P594 HydrophobicContact CG-CB 3.84Å; W520-P594 HydrophobicContact CG-CG 3.99Å
595	P	43.2	Very low	35.4	Very low	78 Å²	78	114.8 Å²	114.8	51%	0.506	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-62	140.8	179.6	26.9	-34.3	0	0	0	109.9	W520	W520-P595 PolarHBondContact NE1-O 2.99Å
596	L	41.5	Very low	35.3	Very low	70 Å²	70	110.5 Å²	110.5	37%	0.366	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-53.1	138.2	171.7	-69.6	173.6	0	0	0	109.7
597	P	38.7	Very low	35.1	Very low	9 Å²	9	111.4 Å²	111.4	6%	0.058	59%	0.591	C	S	.	*	P	Polyproline II helix	trans	-54.8	136.2	179.8	-24	33.2	0	0	0	110.6	Y455 R599	Y455-P597 HydrophobicContact CE2-CB 4.23Å; Y455-P597 HydrophobicContact CE2-CG 4.45Å; P597-R599 PolarHBondContact O-N 3.46Å; P597-R599 VanDerWaalsContact O-N 3.16Å
598	P	40	Very low	35.2	Very low	97 Å²	97	110 Å²	110	63%	0.63	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-61	122.6	-176.2	24.1	-33.1	0	0	0	110.3
599	R	40.9	Very low	35.1	Very low	151 Å²	151	106.7 Å²	106.7	57%	0.57	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-57.3	123.3	176.3	-177	-176.2	-175.4	-85.6	14.5	108.7	P597	P597-R599 PolarHBondContact O-N 3.46Å; P597-R599 VanDerWaalsContact O-N 3.16Å
600	P	38.5	Very low	35.1	Very low	45 Å²	45	108.4 Å²	108.4	29%	0.292	58%	0.583	S	S	.	*	P	Polyproline II helix	trans	-60.2	151	179.1	24.4	-33.8	0	0	0	110.6	L457	L457-P600 HydrophobicContact CD1-CG 3.65Å; L457-P600 HydrophobicContact CD2-CG 4.04Å
601	P	34.1	Very low	34.9	Very low	110 Å²	110	115.6 Å²	115.6	71%	0.714	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-57.5	145.3	176.4	25.8	-34.3	0	0	0	110
602	P	31.3	Very low	34.8	Very low	95 Å²	95	114.6 Å²	114.6	62%	0.617	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-58.9	136.1	174	26.6	-33.5	0	0	0	109.2	R604	P602-R604 PolarHBondContact O-N 2.94Å
603	P	33.1	Very low	34.5	Very low	111 Å²	111	116.2 Å²	116.2	72%	0.721	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-58.2	127.9	-177.8	23.2	-33.3	0	0	0	109.5	R605	P603-R605 PolarHBondContact O-N 2.78Å
604	R	33.2	Very low	33.9	Very low	235 Å²	235	118.5 Å²	118.5	89%	0.887	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-62.8	131.3	170.9	-66.1	-179.4	-177.8	-116	2.4	107	P602 S606	P602-R604 PolarHBondContact O-N 2.94Å; R604-S606 VanDerWaalsContact C-N 3.33Å; R604-S606 PolarHBondContact O-N 3.46Å
605	R	28.6	Very low	33.5	Very low	242 Å²	242	125.1 Å²	125.1	91%	0.913	65%	0.652	S	S	*	*			trans	-64.3	94.6	170.8	-76.7	-170.1	177.9	-154.5	0.9	109.6	P603	P603-R605 PolarHBondContact O-N 2.78Å
606	S	30.6	Very low	33.1	Very low	83 Å²	83	128.3 Å²	128.3	58%	0.58	66%	0.664	S	S	*	*			trans	-76.8	110.6	158.3	37.9	0	0	0	0	107.9	R604 S608	R604-S606 VanDerWaalsContact C-N 3.33Å; R604-S606 PolarHBondContact O-N 3.46Å; S606-S608 PolarHBondContact O-N 2.73Å
607	T	30.8	Very low	32.7	Very low	133 Å²	133	132.7 Å²	132.7	82%	0.816	69%	0.688	S	S	*	*	S	Bend	trans	-79.8	53.5	175.2	53.1	0	0	0	0	110.3
608	S	28.8	Very low	32.5	Very low	73 Å²	73	139.6 Å²	139.6	51%	0.51	73%	0.725	S	S	.	*			trans	-156.3	54.1	-167	67.6	0	0	0	0	112.3	S606	S606-S608 PolarHBondContact O-N 2.73Å
609	C	29.8	Very low	32.2	Very low	87 Å²	87	142 Å²	142	59%	0.588	73%	0.732	S	S	*	*	S	Bend	trans	-153.8	42.1	157.9	-85.2	0	0	0	0	109.3	R431	R431-C609 PolarHBondContact NH1-SG 3.23Å; R431-C609 PolarHBondContact NH2-SG 3.3Å
610	D	31.2	Very low	31.7	Very low	148 Å²	148	143.7 Å²	143.7	79%	0.791	75%	0.747	S	S	*	*	S	Bend	trans	-135.9	38.7	178.2	-79.4	-55.4	0	0	0	110
611	Y	28.5	Very low	31.3	Very low	220 Å²	220	150.8 Å²	150.8	86%	0.863	77%	0.773	S	S	*	*			trans	-151.1	150.9	171.9	-79.4	-73.9	0	0	0	108.9
612	L	29.4	Very low	31.2	Very low	171 Å²	171	151.9 Å²	151.9	90%	0.895	77%	0.773	S	S	*	*	S	Bend	trans	66.9	114.7	-159.3	-46	176.2	0	0	0	110.8
613	I	29.4	Very low	31.1	Very low	152 Å²	152	155 Å²	155	78%	0.779	78%	0.781	S	S	*	*			cis	-115.9	134.2	7	-61.5	162.6	0	0	0	108.9	E615	I613-E615 HydrophobicContact CG2-CB 4.18Å; I613-E615 HydrophobicContact CG2-CG 4.22Å
614	D	28.4	Very low	31.2	Very low	146 Å²	146	155.7 Å²	155.7	78%	0.781	78%	0.778	S	S	*	*			trans	-130.1	85.6	167	-156.7	4.7	0	0	0	107.7
615	E	34	Very low	31.2	Very low	172 Å²	172	151.9 Å²	151.9	80%	0.804	77%	0.768	S	S	*	*			trans	-125.4	85.6	174.7	-73.9	-173.1	172.6	0	0	107.9	I613	I613-E615 HydrophobicContact CG2-CB 4.18Å; I613-E615 HydrophobicContact CG2-CG 4.22Å
616	N	33.8	Very low	31.4	Very low	144 Å²	144	146.9 Å²	146.9	77%	0.77	76%	0.755	S	S	*	*			trans	-117.6	65.8	168.3	-75.4	-82.6	0	0	0	109.3
617	D	34.5	Very low	31.7	Very low	163 Å²	163	149.5 Å²	149.5	87%	0.872	76%	0.762	S	S	*	*			trans	-137.2	91.1	165.5	-97.1	-41.9	0	0	0	108.9
618	D	33.7	Very low	32	Very low	154 Å²	154	148.1 Å²	148.1	82%	0.824	76%	0.758	S	S	*	*			trans	-172.3	158.4	137.3	-118.7	-27.9	0	0	0	112.9
619	N	34.4	Very low	32.3	Very low	148 Å²	148	153.5 Å²	153.5	79%	0.791	77%	0.772	S	S	*	*			trans	76	76.4	176.3	-50.3	-83.6	0	0	0	117.9
620	Q	29.9	Very low	32.7	Very low	186 Å²	186	154 Å²	154	87%	0.869	78%	0.776	S	S	*	*			trans	-137.2	66.5	152.4	-166.3	172	110.2	0	0	113.5
621	F	30.9	Very low	32.9	Very low	193 Å²	193	153.6 Å²	153.6	85%	0.846	77%	0.774	S	S	*	*			trans	-153.7	143.4	153.1	-91.1	-82.2	0	0	0	105.3
622	D	30.6	Very low	33.3	Very low	134 Å²	134	151.3 Å²	151.3	72%	0.717	78%	0.776	S	S	*	*			cis	-134.6	155.4	13.1	-107.7	-62.7	0	0	0	110.9
623	M	30.7	Very low	33.6	Very low	159 Å²	159	146 Å²	146	78%	0.783	76%	0.763	S	S	*	*				175.7	139.4	118	-99.6	176.7	63.3	0	0	114.5
624	I	33.8	Very low	34	Very low	127 Å²	127	144 Å²	144	65%	0.651	76%	0.763	S	S	*	*			trans	78	103.1	155.7	-65.4	167.7	0	0	0	117.5
625	K	33.3	Very low	34.4	Very low	155 Å²	155	143.7 Å²	143.7	67%	0.674	76%	0.761	S	S	*	*				52.6	145.9	125.2	-65.6	165.3	159.4	-92.3	0	119.8
626	E	33.8	Very low	34.6	Very low	137 Å²	137	142.6 Å²	142.6	64%	0.64	76%	0.759	S	S	*	*			cis	-160.3	170	6.1	-120.9	150.1	-179.5	0	0	110.8
627	D	36	Very low	34.9	Very low	138 Å²	138	140.7 Å²	140.7	74%	0.738	75%	0.754	S	S	*	*			trans	64.2	78.2	153.4	-61.3	-10.3	0	0	0	124.6
628	S	36.7	Very low	35	Very low	103 Å²	103	138.7 Å²	138.7	72%	0.72	75%	0.748	S	S	*	*				81.3	138.1	112.3	82	0	0	0	0	125.5
629	K	35.8	Very low	35	Very low	187 Å²	187	138.4 Å²	138.4	81%	0.813	75%	0.746	S	S	*	*			trans	90.8	125.5	144.9	-76.8	177.1	177.6	177.9	0	124.3
630	S	37.1	Very low	35.2	Very low	97 Å²	97	135.8 Å²	135.8	68%	0.678	75%	0.745	S	S	*	*			trans	63.4	143.8	143.2	54.5	0	0	0	0	121.3
631	D	36.3	Very low	35.5	Very low	139 Å²	139	135.1 Å²	135.1	74%	0.743	74%	0.744	S	S	*	*			cis	-168.2	151.6	-13.1	-103.4	-35.9	0	0	0	111.9
632	L	37.2	Very low	35.7	Very low	172 Å²	172	132.2 Å²	132.2	90%	0.901	74%	0.737	S	S	*	*			trans	49.9	145.2	150.5	-55.1	167.1	0	0	0	121.7
633	G	36.2	Very low	36.1	Very low	61 Å²	61	131.7 Å²	131.7	63%	0.629	73%	0.734	S	S	*	*			cis	158.9	154.4	-9.7	0	0	0	0	0	114.4
634	S	37.5	Very low	36.3	Very low	110 Å²	110	129.8 Å²	129.8	77%	0.769	73%	0.727	S	S	*	*			trans	62.5	156.7	154.4	62.7	0	0	0	0	122.6
635	D	36.3	Very low	36.5	Very low	139 Å²	139	131.5 Å²	131.5	74%	0.743	73%	0.73	S	S	*	*			cis	-170.8	129.9	-24.4	-97.9	-27.9	0	0	0	116.4
636	I	38	Very low	36.6	Very low	149 Å²	149	130.4 Å²	130.4	76%	0.764	73%	0.732	S	S	*	*			trans	63.2	-162.7	139.7	-23.3	173.9	0	0	0	120.5
637	P	41.3	Very low	36.7	Very low	104 Å²	104	130.3 Å²	130.3	68%	0.675	74%	0.735	S	S	*	*				-140.4	-179.8	-115.7	45.6	-27.4	0	0	0	124.8
638	V	35.6	Very low	36.6	Very low	121 Å²	121	129.1 Å²	129.1	73%	0.733	73%	0.733	S	S	*	*			trans	78.1	136.8	145.3	-83.8	0	0	0	0	128.5
639	N	34.6	Very low	36.4	Very low	148 Å²	148	128.3 Å²	128.3	79%	0.791	73%	0.728	S	S	*	*			trans	73.3	122.1	139.2	-72.3	-19.2	0	0	0	123.9
640	A	36.9	Very low	36.4	Very low	92 Å²	92	126.6 Å²	126.6	76%	0.76	72%	0.722	S	S	*	*				162.7	120.6	97.6	0	0	0	0	0	117.5
641	M	36.1	Very low	36.2	Very low	173 Å²	173	130 Å²	130	85%	0.852	72%	0.724	S	S	*	*			trans	52.6	131.4	138.4	-63.6	-169.2	175	0	0	126.4
642	N	36.9	Very low	35.9	Very low	131 Å²	131	127.4 Å²	127.4	70%	0.701	72%	0.717	S	S	*	*				99	109.5	126	-88.9	-12.8	0	0	0	125.4
643	N	37.6	Very low	35.8	Very low	123 Å²	123	126.7 Å²	126.7	66%	0.658	71%	0.709	S	S	*	*				85.7	109.2	117.8	-84.5	-25.1	0	0	0	125.3
644	N	36.2	Very low	35.6	Very low	120 Å²	120	133.9 Å²	133.9	64%	0.642	72%	0.717	S	S	*	*				94.4	129.7	115.8	-94.9	-41.7	0	0	0	124.8
645	K	36.8	Very low	35.2	Very low	162 Å²	162	132.7 Å²	132.7	70%	0.704	72%	0.722	S	S	*	*				100.2	137.5	129.6	-84.7	169.9	-174.9	176.8	0	123
646	N	35.6	Very low	35	Very low	132 Å²	132	133.5 Å²	133.5	71%	0.706	73%	0.725	S	S	*	*			trans	74.8	145.5	149.9	-62.9	-5.5	0	0	0	118.3
647	N	35.5	Very low	34.5	Very low	135 Å²	135	134.8 Å²	134.8	72%	0.722	73%	0.725	S	S	*	*			cis	-167.5	163.8	-16.3	-121.5	-16.4	0	0	0	114.2
648	V	35.3	Very low	33.9	Very low	114 Å²	114	134.9 Å²	134.9	69%	0.691	72%	0.724	S	S	*	*			trans	72.3	93.1	139.5	172.7	0	0	0	0	122.4
649	S	31	Very low	33.7	Very low	86 Å²	86	140.5 Å²	140.5	60%	0.601	73%	0.732	S	S	*	*				82.2	154.8	117.5	86.9	0	0	0	0	125.5
650	H	36.5	Very low	33.4	Very low	150 Å²	150	137.8 Å²	137.8	69%	0.694	73%	0.725	S	S	*	*			trans	73.9	149.3	145	-76.3	0.8	0	0	0	119.6
651	K	32.6	Very low	33	Very low	168 Å²	168	142.1 Å²	142.1	73%	0.73	73%	0.727	S	S	*	*			cis	-167.7	142.9	-21.8	-129.3	173	-173.5	158.8	0	111.4
652	S	30.5	Very low	32.9	Very low	85 Å²	85	143 Å²	143	59%	0.594	73%	0.726	S	S	*	*			trans	72	152.7	144	-141	0	0	0	0	123.6
653	H	35.7	Very low	32.5	Very low	158 Å²	158	144 Å²	144	73%	0.731	73%	0.731	S	S	*	*			trans	70.4	158.5	150.8	-66.9	-26.8	0	0	0	122.5
654	R	30.9	Very low	32.7	Very low	212 Å²	212	142.6 Å²	142.6	80%	0.8	73%	0.729	S	S	*	*			cis	-171.7	71.3	-33.7	-160.5	-176.9	-161.7	179.2	3.3	113.7
655	G	28.9	Very low	32.4	Very low	84 Å²	84	144.2 Å²	144.2	87%	0.866	74%	0.736	S	S	*	*			trans	61	-156.7	155.9	0	0	0	0	0	120.5
656	I	31.8	Very low	32.1	Very low	156 Å²	156	140.8 Å²	140.8	80%	0.8	73%	0.733	S	S	*	*			trans	91.1	102.5	169.7	-57.3	178.4	0	0	0	119.4
657	F	28.1	Very low	31.9	Very low	177 Å²	177	143 Å²	143	78%	0.776	74%	0.736	S	S	*	*			trans	55.5	114.3	137.7	-83.7	-109.8	0	0	0	125
658	T	28.7	Very low	31.6	Very low	106 Å²	106	144.4 Å²	144.4	65%	0.65	74%	0.739	S	S	*	*				44.6	122.9	126	69.5	0	0	0	0	122.5
659	R	31.6	Very low	31.4	Very low	238 Å²	238	145.6 Å²	145.6	90%	0.898	74%	0.74	S	S	*	*				176	136.7	101.5	-90	167.1	-179.2	-173.5	-0	107
660	S	28.5	Very low	31.5	Very low	91 Å²	91	149.2 Å²	149.2	64%	0.636	75%	0.747	S	S	*	*			cis	105.1	132.9	35.1	-167.1	0	0	0	0	112
661	F	27.7	Very low	31.4	Very low	184 Å²	184	149.7 Å²	149.7	81%	0.807	75%	0.753	S	S	*	*			trans	83	135.2	167.1	-72.9	-66.5	0	0	0	123
662	K	34.1	Very low	31.4	Very low	191 Å²	191	144.9 Å²	144.9	83%	0.83	75%	0.751	S	S	*	*			trans	89.3	99.1	142.4	-75.5	165.9	-173.4	-175.4	0	122.2
663	N	29.9	Very low	31.6	Very low	151 Å²	151	147.4 Å²	147.4	81%	0.807	76%	0.758	S	S	*	*				-34.6	169.1	126.1	-117.8	3.8	0	0	0	114.3
664	P	40.8	Very low	31.5	Very low	94 Å²	94	147.3 Å²	147.3	61%	0.61	76%	0.762	S	S	*	*			cis	-147.2	-167	6.7	37.6	-14	0	0	0	116.9
665	L	29.3	Very low	31.6	Very low	154 Å²	154	141.1 Å²	141.1	81%	0.806	75%	0.752	S	S	*	*			trans	72.1	114.8	139.7	-88.2	166.6	0	0	0	123.7
666	S	30.3	Very low	31.9	Very low	90 Å²	90	142.6 Å²	142.6	63%	0.629	74%	0.744	S	S	*	*				114.3	143.7	111.5	78.8	0	0	0	0	121.8
667	K	32.1	Very low	32.1	Very low	180 Å²	180	142 Å²	142	78%	0.783	74%	0.743	S	S	*	*			trans	70.1	131	161.3	-65.4	165.5	-177.5	179	0	117.2
668	Q	30.1	Very low	32.4	Very low	164 Å²	164	140 Å²	140	77%	0.766	74%	0.735	S	S	*	*			cis	97.4	146.1	30.2	-173.7	-177	12.3	0	0	112.6
669	L	31.2	Very low	32.8	Very low	139 Å²	139	144 Å²	144	73%	0.728	74%	0.744	S	S	*	*			trans	91.4	140.7	-178.3	-58.5	172.6	0	0	0	114.2
670	H	31.7	Very low	32.9	Very low	162 Å²	162	135.3 Å²	135.3	75%	0.75	73%	0.729	S	S	*	*			cis	-169	173.4	-17.6	-137.5	8.9	0	0	0	111.1
671	I	34	Very low	33.2	Very low	159 Å²	159	138.1 Å²	138.1	82%	0.815	74%	0.742	S	S	*	*			trans	67.1	148.5	166.8	-55.3	145.2	0	0	0	113.1
672	G	33.5	Very low	33.6	Very low	67 Å²	67	133.7 Å²	133.7	69%	0.691	74%	0.739	S	S	*	*			cis	161.4	169.3	0.8	0	0	0	0	0	107
673	D	34.9	Very low	33.6	Very low	139 Å²	139	131.3 Å²	131.3	74%	0.743	73%	0.731	S	S	*	*			cis	-167.6	166.7	-1.8	-134.8	-34	0	0	0	109.4
674	L	34.2	Very low	33.9	Very low	156 Å²	156	131.1 Å²	131.1	82%	0.817	72%	0.723	S	S	*	*			trans	63.4	154.6	161.5	-60.3	163.5	0	0	0	119.9
675	S	32.4	Very low	33.6	Very low	82 Å²	82	132.6 Å²	132.6	57%	0.573	73%	0.726	S	S	*	*			cis	-175	173.2	-28.3	54.2	0	0	0	0	111.1
676	T	35.9	Very low	33.8	Very low	114 Å²	114	132.6 Å²	132.6	70%	0.699	73%	0.726	S	S	*	*			trans	68.8	147	163.2	63.7	0	0	0	0	118.5
677	D	34.9	Very low	34.3	Very low	145 Å²	145	132.7 Å²	132.7	78%	0.775	72%	0.724	S	S	*	*			cis	-173.7	162	-14.6	-96.9	-12.1	0	0	0	107
678	E	35.5	Very low	34.5	Very low	133 Å²	133	132.5 Å²	132.5	62%	0.621	72%	0.724	S	S	*	*			cis	-164.3	172.9	-30.6	-136.6	-60.7	78.1	0	0	107.3
679	F	35.3	Very low	34.7	Very low	190 Å²	190	129.7 Å²	129.7	83%	0.833	72%	0.718	S	S	*	*			trans	72.5	131.1	173.5	-56.3	-73.6	0	0	0	117.6
680	G	34	Very low	34.9	Very low	56 Å²	56	128.1 Å²	128.1	58%	0.577	71%	0.711	S	S	*	*			cis	172.3	151.2	-9.3	0	0	0	0	0	113.8
681	T	35.4	Very low	35.1	Very low	151 Å²	151	124 Å²	124	93%	0.926	70%	0.7	S	S	*	*			trans	62.3	141.1	174.9	72.1	0	0	0	0	117.4
682	A	35.9	Very low	35.1	Very low	90 Å²	90	119 Å²	119	74%	0.744	69%	0.688	S	S	*	*			cis	-170.2	154.6	-17.5	0	0	0	0	0	106.9
683	E	34.2	Very low	35.2	Very low	142 Å²	142	120.6 Å²	120.6	66%	0.664	69%	0.688	S	S	*	*			cis	-164.4	171.8	-15.4	-109.5	-161.3	148.1	0	0	109.4
684	K	35.7	Very low	35.2	Very low	147 Å²	147	122.3 Å²	122.3	64%	0.639	70%	0.697	S	S	*	*			trans	36.6	135.2	145.2	-64.4	171.1	-173.9	142.1	0	121.4
685	D	34.7	Very low	35.2	Very low	125 Å²	125	118.4 Å²	118.4	67%	0.668	69%	0.694	S	S	*	*			cis	-157.8	128.3	-5.9	-82.6	-40.6	0	0	0	106.6
686	L	34.5	Very low	35.2	Very low	153 Å²	153	126.3 Å²	126.3	80%	0.801	71%	0.711	S	S	*	*				69.4	147.8	79.7	-71	176.6	0	0	0	116.4
687	P	40.4	Very low	35.3	Very low	92 Å²	92	130.1 Å²	130.1	60%	0.597	72%	0.718	S	S	*	*				-129.9	174.2	-55	25.3	-2.6	0	0	0	113.1
688	F	35.8	Very low	35.1	Very low	177 Å²	177	135.1 Å²	135.1	78%	0.776	73%	0.726	S	S	*	*				179.9	138	86.5	-108.7	-82.6	0	0	0	115.2
689	T	35.3	Very low	35.1	Very low	105 Å²	105	135.8 Å²	135.8	64%	0.644	74%	0.739	S	S	*	*			trans	55.1	113.2	153.3	43.9	0	0	0	0	122
690	N	34.1	Very low	35.2	Very low	106 Å²	106	131.1 Å²	131.1	57%	0.567	74%	0.736	S	S	*	*				85.4	138.2	83.3	-69	6.7	0	0	0	114.4	S955	N690-S955 PolarHBondContact ND2-OG 2.91Å; N690-S955 PolarHBondContact OD1-OG 3.31Å
691	S	36.5	Very low	35.2	Very low	74 Å²	74	134.8 Å²	134.8	52%	0.517	75%	0.749	S	S	.	*			cis	-163.6	172.2	3.2	42.7	0	0	0	0	113.7
692	G	34.4	Very low	35.1	Very low	56 Å²	56	137.2 Å²	137.2	58%	0.577	74%	0.742	S	S	*	*			trans	-80.5	-163.3	-172	0	0	0	0	0	118.1
693	S	35.4	Very low	35.2	Very low	99 Å²	99	138.1 Å²	138.1	69%	0.692	74%	0.74	S	S	*	*			cis	-166.2	159.4	27.3	-160.5	0	0	0	0	116.1
694	L	34.9	Very low	35.2	Very low	176 Å²	176	137.4 Å²	137.4	92%	0.921	75%	0.747	S	S	*	*			trans	50	140.6	155.4	-70.2	163.7	0	0	0	123.5
695	G	33.6	Very low	34.9	Very low	73 Å²	73	138.9 Å²	138.9	75%	0.753	75%	0.749	S	S	*	*			trans	-165.5	-12.2	-178.9	0	0	0	0	0	125.3
696	R	33.4	Very low	34.8	Very low	249 Å²	249	144.7 Å²	144.7	94%	0.94	76%	0.762	S	S	*	*			trans	66.6	153.4	172.9	-83.5	-179	170.3	178.2	-2.7	121.7
697	K	37.5	Very low	34.6	Very low	193 Å²	193	143.1 Å²	143.1	84%	0.839	76%	0.758	S	S	*	*			trans	69.6	95.4	159.3	-76	-173.1	176	-176.4	0	122
698	R	30.4	Very low	34.4	Very low	250 Å²	250	145.2 Å²	145.2	94%	0.943	77%	0.77	S	S	*	*			trans	27.8	124.1	132.5	-74.6	179.2	163.5	167.7	-5.8	120.2
699	T	36.2	Very low	34.2	Very low	148 Å²	148	142.4 Å²	142.4	91%	0.908	77%	0.769	S	S	*	*			trans	-123.1	153.5	151.8	49.9	0	0	0	0	110.6
700	A	36.8	Very low	33.8	Very low	92 Å²	92	143.9 Å²	143.9	76%	0.76	78%	0.778	S	S	*	*			trans	-111.1	153.8	175.8	0	0	0	0	0	110.6
701	P	33.4	Very low	33.9	Very low	132 Å²	132	148.2 Å²	148.2	86%	0.857	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-73.6	155	-171.3	29.5	-35.5	0	0	0	113.8
702	R	33.2	Very low	33.7	Very low	203 Å²	203	150.9 Å²	150.9	77%	0.766	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-98.5	130.8	-169.6	-162.1	-167.8	-145.7	-178.7	12.2	111.8
703	P	39.6	Very low	33.5	Very low	108 Å²	108	155.5 Å²	155.5	70%	0.701	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-70.8	157.6	171.4	28.5	-33.2	0	0	0	112.4
704	P	33.9	Very low	33.3	Very low	127 Å²	127	156.8 Å²	156.8	83%	0.825	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-79.1	161.8	-168.3	31.1	-36.4	0	0	0	114.8
705	R	28.2	Very low	33.2	Very low	178 Å²	178	157.6 Å²	157.6	67%	0.672	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-63.5	145.9	174.5	-67.9	-177.4	176.3	-157.1	1.7	111.7	Y1089	R705-Y1089 PolarHBondContact NE-OH 2.93Å; R705-Y1089 VanDerWaalsContact NH2-CZ 3.28Å; R705-Y1089 PolarHBondContact NH2-OH 3.06Å
706	R	33.2	Very low	32.9	Very low	248 Å²	248	160.9 Å²	160.9	94%	0.936	81%	0.813	S	S	*	*			trans	-133.6	129.6	146.1	-138	177.8	-167.3	-167.2	3	110.3
707	T	30.1	Very low	32.9	Very low	119 Å²	119	155.8 Å²	155.8	73%	0.73	81%	0.81	S	S	*	*			trans	-89.6	145.3	171.1	45.2	0	0	0	0	109.6
708	T	36	Very low	32.5	Very low	136 Å²	136	153.1 Å²	153.1	83%	0.834	81%	0.805	S	S	*	*			trans	-112.8	145.6	166.3	44.2	0	0	0	0	110.1
709	P	31.4	Very low	32.6	Very low	118 Å²	118	151 Å²	151	77%	0.766	80%	0.802	S	S	*	*			trans	-98.9	164.2	-157.4	38.5	-37.1	0	0	0	114.8
710	V	28.6	Very low	32.2	Very low	137 Å²	137	150.8 Å²	150.8	83%	0.83	80%	0.796	S	S	*	*			trans	-70.1	145.7	161.7	179.2	0	0	0	0	109.8
711	K	35.5	Very low	31.9	Very low	196 Å²	196	154 Å²	154	85%	0.852	80%	0.8	S	S	*	*			trans	-118.3	138.1	161.1	-85	-169.7	172	-172.4	0	109.9
712	P	33	Very low	31.7	Very low	131 Å²	131	153.9 Å²	153.9	85%	0.851	79%	0.791	S	S	*	*			trans	-90.1	-179.2	172	37.3	-34.9	0	0	0	112.8
713	L	29.2	Very low	31.6	Very low	153 Å²	153	151.5 Å²	151.5	80%	0.801	79%	0.789	S	S	*	*			trans	-107.1	157.3	-175.3	-89.8	158.8	0	0	0	113.7
714	N	31.8	Very low	31.4	Very low	125 Å²	125	151.9 Å²	151.9	67%	0.668	79%	0.785	S	S	*	*			trans	66.8	152.3	162.9	-55.9	-5.6	0	0	0	116.3
715	F	31.4	Very low	31.4	Very low	193 Å²	193	151.4 Å²	151.4	85%	0.846	78%	0.775	S	S	*	*			cis	-141.5	176.5	31.5	-103.2	-90.6	0	0	0	114.6
716	L	27.1	Very low	31.6	Very low	143 Å²	143	149.8 Å²	149.8	75%	0.749	78%	0.78	S	S	*	*			trans	-74.6	150.9	174.4	-73.9	75.3	0	0	0	113.5
717	T	34.4	Very low	31.6	Very low	142 Å²	142	144.5 Å²	144.5	87%	0.871	78%	0.779	S	S	*	*				-154.5	144	126.4	22.7	0	0	0	0	110.2
718	D	28.2	Very low	31.8	Very low	136 Å²	136	145 Å²	145	73%	0.727	78%	0.782	S	S	*	*			trans	-74.6	154.7	175.6	-50.8	-87.9	0	0	0	112.8
719	F	33.5	Very low	31.6	Very low	205 Å²	205	143.8 Å²	143.8	90%	0.899	78%	0.778	S	S	*	*				-173.5	146.1	114.4	-108.7	-75.6	0	0	0	111.3
720	N	26.7	Very low	32	Very low	144 Å²	144	144.3 Å²	144.3	77%	0.77	78%	0.781	S	S	*	*			trans	-72.5	147.8	-179.8	-61.7	-64.2	0	0	0	112.8
721	L	31	Very low	32.2	Very low	160 Å²	160	145 Å²	145	84%	0.838	78%	0.781	S	S	*	*				-175.8	143.4	115.2	-96.7	160.5	0	0	0	114.2
722	L	29.9	Very low	32.7	Very low	129 Å²	129	140.4 Å²	140.4	68%	0.675	77%	0.771	S	S	*	*			trans	-25.9	159.8	157.8	-85.9	71.3	0	0	0	118.1
723	E	31.3	Very low	33.1	Very low	154 Å²	154	145 Å²	145	72%	0.72	77%	0.773	S	S	*	*			cis	-171.1	177.5	-17.1	-126.6	167.6	-168	0	0	110.2
724	D	35.1	Very low	33.3	Very low	116 Å²	116	146.9 Å²	146.9	62%	0.62	77%	0.769	S	S	*	*			trans	69.2	106.9	145.8	-86.9	34.6	0	0	0	126.1
725	N	34	Very low	33.7	Very low	117 Å²	117	148.5 Å²	148.5	63%	0.626	78%	0.778	S	S	*	*				62	113.1	111.1	-63.8	-28.3	0	0	0	122.6
726	N	33	Very low	34	Very low	144 Å²	144	143.9 Å²	143.9	77%	0.77	76%	0.762	S	S	*	*				162.3	133.1	100.6	-90.4	-61.8	0	0	0	114.9
727	C	32.9	Very low	34.6	Very low	136 Å²	136	146.4 Å²	146.4	92%	0.919	77%	0.767	S	S	*	*			trans	-174	156.4	136	-99.4	0	0	0	0	111.7
728	V	33.3	Very low	34.8	Very low	129 Å²	129	145.4 Å²	145.4	78%	0.782	76%	0.756	S	S	*	*			trans	-124.5	160.8	-159.4	172.6	0	0	0	0	113.6
729	C	32.2	Very low	35.3	Very low	111 Å²	111	147.2 Å²	147.2	75%	0.75	76%	0.76	S	S	*	*			trans	-39.5	175.3	-178.9	-47.4	0	0	0	0	118.8
730	P	40.3	Very low	35.4	Very low	130 Å²	130	142 Å²	142	84%	0.844	76%	0.755	S	S	*	*				-139.9	160.3	97	39.3	-28.5	0	0	0	115.4
731	N	33.2	Very low	35.9	Very low	152 Å²	152	141 Å²	141	81%	0.813	76%	0.756	S	S	*	*			trans	-144.2	126	166.3	-178.9	34.7	0	0	0	109.8
732	P	46.2	Very low	36.5	Very low	99 Å²	99	141.3 Å²	141.3	64%	0.643	76%	0.758	S	S	*	*			trans	-111.8	123.2	175.3	35.6	-24.6	0	0	0	112.7
733	Y	39.6	Very low	37.3	Very low	228 Å²	228	140.5 Å²	140.5	89%	0.894	76%	0.76	S	S	*	*				-173.9	135.4	120.2	-106	-72.6	0	0	0	108.9
734	R	33.3	Very low	37.9	Very low	192 Å²	192	138.7 Å²	138.7	73%	0.725	76%	0.762	S	S	*	*			trans	-147.5	138.3	-178.6	-151.3	-167.4	-159.3	-133	-0.6	106.8	D736	R734-D736 IonicContact CZ-OD1 3.64Å; R734-D736 VanDerWaalsContact CZ-OD1 3.22Å; R734-D736 IonicContact NE-OD1 2.67Å; R734-D736 IonicContact NH1-OD1 3.14Å; R734-D736 PolarHBondContact NH1-OD1 2.98Å; R734-D736 IonicContact NH1-OD2 2.68Å; R734-D736 IonicContact NH2-OD1 2.78Å
735	D	41.7	Very low	38.8	Very low	159 Å²	159	139 Å²	139	85%	0.85	77%	0.77	S	S	*	*			trans	-135.4	140.9	153.9	-84.6	-56.3	0	0	0	105.8
736	D	36.8	Very low	39.3	Very low	95 Å²	95	139.1 Å²	139.1	51%	0.508	78%	0.778	S	S	.	*			trans	-94.8	162.7	-166	-70.7	-70.2	0	0	0	113	R734	R734-D736 IonicContact CZ-OD1 3.64Å; R734-D736 VanDerWaalsContact CZ-OD1 3.22Å; R734-D736 IonicContact NE-OD1 2.67Å; R734-D736 IonicContact NH1-OD1 3.14Å; R734-D736 PolarHBondContact NH1-OD1 2.98Å; R734-D736 IonicContact NH1-OD2 2.68Å; R734-D736 IonicContact NH2-OD1 2.78Å
737	F	39.8	Very low	39.5	Very low	196 Å²	196	138.7 Å²	138.7	86%	0.86	78%	0.78	S	S	*	*				-177	110.8	121.3	-96.9	-64.5	0	0	0	112.9
738	D	38.3	Very low	40.1	Very low	121 Å²	121	140.7 Å²	140.7	65%	0.647	78%	0.775	S	S	*	*			trans	57.9	104.3	141.1	-63.9	0.6	0	0	0	124.6
739	H	39.5	Very low	40.1	Very low	174 Å²	174	141.6 Å²	141.6	81%	0.806	78%	0.775	S	S	*	*				96.5	122.3	118.8	-80.5	-54.1	0	0	0	124.1
740	A	36.2	Very low	40.2	Very low	96 Å²	96	143.1 Å²	143.1	79%	0.793	78%	0.776	S	S	*	*			trans	72	129.6	157.6	0	0	0	0	0	117.4
741	P	35.8	Very low	39.9	Very low	122 Å²	122	141.6 Å²	141.6	79%	0.792	77%	0.768	S	S	*	*				-144.3	164.9	65.3	40.1	-22.5	0	0	0	118.8
742	L	44.1	Very low	40	Very low	167 Å²	167	139.6 Å²	139.6	87%	0.874	77%	0.766	S	S	*	*			trans	24	146.2	151.1	-60.8	172.6	0	0	0	124.5
743	P	47.8	Very low	39.5	Very low	113 Å²	113	142.4 Å²	142.4	73%	0.734	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-92.4	168.9	178.5	39.3	-37.5	0	0	0	115.4
744	P	43.1	Very low	39.5	Very low	115 Å²	115	140.5 Å²	140.5	75%	0.747	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-88.6	162	-173.8	35.8	-37.6	0	0	0	115.7
745	P	54.2	Low	39.5	Very low	123 Å²	123	138.6 Å²	138.6	80%	0.799	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-83.2	147.8	177.2	33.6	-35.1	0	0	0	113.9
746	P	45	Very low	39.2	Very low	120 Å²	120	137.4 Å²	137.4	78%	0.779	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-94.8	168.7	179.9	37.7	-36.2	0	0	0	114.4
747	V	36.5	Very low	39.3	Very low	134 Å²	134	141.6 Å²	141.6	81%	0.812	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-99.3	139.1	173.5	179.9	0	0	0	0	110.3
748	H	44.6	Very low	39	Very low	179 Å²	179	141 Å²	141	83%	0.829	78%	0.777	S	S	*	*			trans	-148.8	146.5	166.5	-106.2	-86.4	0	0	0	112.5
749	L	33.2	Very low	38.9	Very low	147 Å²	147	141.8 Å²	141.8	77%	0.77	79%	0.786	S	S	*	*			trans	-85.3	152.2	165.6	-66.9	75.5	0	0	0	109
750	D	34.7	Very low	38.7	Very low	144 Å²	144	144.9 Å²	144.9	77%	0.77	79%	0.791	S	S	*	*				-177.5	163.2	88.8	-135.9	-40.3	0	0	0	114.9
751	S	34.2	Very low	38.7	Very low	97 Å²	97	144.6 Å²	144.6	68%	0.678	78%	0.782	S	S	*	*			trans	-17	140.5	166.1	-57.2	0	0	0	0	120.9
752	S	35.2	Very low	38.8	Very low	111 Å²	111	146.7 Å²	146.7	78%	0.776	78%	0.782	S	S	*	*				164.9	146.2	93.4	53.1	0	0	0	0	116.7
753	H	37	Very low	38.4	Very low	157 Å²	157	146.3 Å²	146.3	73%	0.727	78%	0.775	S	S	*	*			trans	29.7	124.6	150.8	-76.6	-104.4	0	0	0	123.1
754	H	38.7	Very low	37.9	Very low	189 Å²	189	149.6 Å²	149.6	88%	0.875	78%	0.781	S	S	*	*				-154.9	155.3	103.2	-110.2	-74.9	0	0	0	112.4
755	Q	33.2	Very low	37.7	Very low	152 Å²	152	149.6 Å²	149.6	71%	0.71	78%	0.78	S	S	*	*			trans	-120.6	166.2	-179.5	-73	-179.9	-16	0	0	111.3
756	I	35.7	Very low	36.9	Very low	134 Å²	134	154.7 Å²	154.7	69%	0.687	78%	0.784	S	S	*	*				142.4	104.8	125.7	-68.8	158.9	0	0	0	111.7
757	H	39.3	Very low	36.7	Very low	183 Å²	183	155.1 Å²	155.1	85%	0.847	79%	0.787	S	S	*	*				-176.2	150.6	114.2	-104.6	-65.4	0	0	0	111.6
758	Q	33.1	Very low	36.4	Very low	183 Å²	183	152.8 Å²	152.8	86%	0.855	78%	0.781	S	S	*	*			trans	-143.9	144.1	178.5	-71.6	-174.7	-6.5	0	0	112.2
759	T	36.1	Very low	36.5	Very low	137 Å²	137	149.7 Å²	149.7	84%	0.84	78%	0.777	S	S	*	*			trans	-152.8	116.6	148	37.2	0	0	0	0	106.9
760	R	35.6	Very low	36.7	Very low	240 Å²	240	152.2 Å²	152.2	91%	0.906	79%	0.785	S	S	*	*				49.8	126.8	78.5	-111.4	-173	174.6	176.4	-2.2	112.4
761	S	36.5	Very low	36.5	Very low	89 Å²	89	150 Å²	150	62%	0.622	78%	0.781	S	S	*	*			cis	-149.7	-174.6	17.7	-47.9	0	0	0	0	110.2
762	Q	36.7	Very low	36.7	Very low	167 Å²	167	153.1 Å²	153.1	78%	0.78	79%	0.79	S	S	*	*			cis	-146.5	-114.6	11.2	-154.4	163.7	100.5	0	0	114.7
763	Q	36.1	Very low	36.4	Very low	158 Å²	158	155.8 Å²	155.8	74%	0.738	80%	0.796	S	S	*	*			trans	-155.3	152.9	-161.8	-63	167.4	-41.9	0	0	113
764	H	37.7	Very low	36.3	Very low	183 Å²	183	152.3 Å²	152.3	85%	0.847	80%	0.802	S	S	*	*				-164.8	153.1	118.3	-107.6	-78.7	0	0	0	111
765	P	39.3	Very low	35.9	Very low	114 Å²	114	148.3 Å²	148.3	74%	0.74	80%	0.795	S	S	*	*			trans	-129.8	169.3	-158.4	42	-26.8	0	0	0	119
766	R	36.2	Very low	35.9	Very low	231 Å²	231	148.8 Å²	148.8	87%	0.872	80%	0.802	S	S	*	*			trans	-13.9	154.9	153.6	-108.8	-176.9	-168	-147.7	4.3	118.9
767	P	40.1	Very low	35.7	Very low	129 Å²	129	146.4 Å²	146.4	84%	0.838	80%	0.797	S	S	*	*				-153	177.7	81.7	42.4	-23.9	0	0	0	118.7
768	A	32	Very low	35.2	Very low	84 Å²	84	144 Å²	144	69%	0.694	79%	0.79	S	S	*	*			trans	-158.4	-178.8	162.7	0	0	0	0	0	106.7
769	P	46	Very low	35.2	Very low	115 Å²	115	142.1 Å²	142.1	75%	0.747	79%	0.786	S	S	*	*			cis	-121.2	-170.1	-24.3	41.9	-28.3	0	0	0	111.1
770	Q	36.8	Very low	34.9	Very low	199 Å²	199	139.5 Å²	139.5	93%	0.93	77%	0.774	S	S	*	*			trans	-168.9	169.4	140.6	-111.8	167.8	45.3	0	0	114.3
771	S	31.9	Very low	34.9	Very low	98 Å²	98	135.1 Å²	135.1	69%	0.685	77%	0.768	S	S	*	*			trans	-108.4	160.7	-171.2	54.5	0	0	0	0	113.6
772	N	36.9	Very low	34.9	Very low	162 Å²	162	135.2 Å²	135.2	87%	0.866	77%	0.769	S	S	*	*			trans	-160.3	156	138.5	-107.2	-29.4	0	0	0	113.9
773	N	30	Very low	34.9	Very low	168 Å²	168	133.6 Å²	133.6	90%	0.898	77%	0.771	S	S	*	*			trans	-92.4	154.1	177	-66.8	-45.8	0	0	0	111.5
774	G	34.9	Very low	35.1	Very low	83 Å²	83	131 Å²	131	86%	0.856	77%	0.767	S	S	*	*			trans	-159	122.4	168.3	0	0	0	0	0	110.4
775	S	30.4	Very low	35	Very low	106 Å²	106	132.6 Å²	132.6	74%	0.741	77%	0.772	S	S	*	*			trans	-116.5	-178.4	-174.1	57.3	0	0	0	0	112
776	L	32.9	Very low	34.7	Very low	162 Å²	162	131.6 Å²	131.6	85%	0.848	77%	0.768	S	S	*	*			trans	84.6	148.6	175.7	-51.3	160.5	0	0	0	115.9
777	S	30.4	Very low	34.7	Very low	83 Å²	83	126.8 Å²	126.8	58%	0.58	76%	0.764	S	S	*	*			cis	-173.4	152.4	-28.9	57.2	0	0	0	0	111.5
778	N	30.4	Very low	34.5	Very low	133 Å²	133	126.1 Å²	126.1	71%	0.711	76%	0.759	S	S	*	*			trans	73.6	132.1	145.7	-64.3	-9.3	0	0	0	122.4
779	N	31.5	Very low	34.6	Very low	144 Å²	144	126.8 Å²	126.8	77%	0.77	76%	0.759	S	S	*	*			trans	73.7	148.2	136.8	-66	-0.3	0	0	0	120.8
780	S	31.5	Very low	34.1	Very low	82 Å²	82	127.5 Å²	127.5	57%	0.573	76%	0.761	S	S	*	*			cis	-172.4	170.6	-19.3	51.4	0	0	0	0	110.4
781	N	35.3	Very low	33.9	Very low	147 Å²	147	125.6 Å²	125.6	79%	0.786	75%	0.754	S	S	*	*			trans	78.7	145.5	162.2	-54.7	-24.7	0	0	0	117.4
782	S	36.3	Very low	33.9	Very low	92 Å²	92	126.7 Å²	126.7	64%	0.643	76%	0.762	S	S	*	*			cis	-168.9	155.2	-15.3	47.4	0	0	0	0	114.3
783	T	36.8	Very low	33.6	Very low	133 Å²	133	124.3 Å²	124.3	82%	0.816	76%	0.758	S	S	*	*			trans	74.3	151.7	148.5	43.7	0	0	0	0	121.4
784	P	39.5	Very low	33.8	Very low	103 Å²	103	122.1 Å²	122.1	67%	0.669	76%	0.756	S	S	*	*			trans	-137.6	-177.5	-149.4	43.8	-25.2	0	0	0	116.7
785	F	35.3	Very low	33.8	Very low	217 Å²	217	122.7 Å²	122.7	95%	0.952	75%	0.752	S	S	*	*			trans	-143.3	161.1	146.3	-105	-80.7	0	0	0	110
786	S	34.1	Very low	33.7	Very low	93 Å²	93	124.9 Å²	124.9	65%	0.65	75%	0.754	S	S	*	*			trans	-149	138.2	-142.8	-147.5	0	0	0	0	117.8
787	V	35.2	Very low	33.7	Very low	129 Å²	129	125.8 Å²	125.8	78%	0.782	75%	0.751	S	S	*	*			trans	54.1	164.1	154.9	-69.1	0	0	0	0	121.2
788	P	36.9	Very low	33.9	Very low	115 Å²	115	127 Å²	127	75%	0.747	76%	0.758	S	S	*	*			cis	-115.6	153.8	-10.5	31.3	-13.1	0	0	0	113.2
789	S	33.4	Very low	34	Very low	99 Å²	99	125.2 Å²	125.2	69%	0.692	76%	0.755	S	S	*	*				63	117.8	59.7	-155.3	0	0	0	0	112.8
790	V	36.3	Very low	33.9	Very low	129 Å²	129	123.4 Å²	123.4	78%	0.782	75%	0.754	S	S	*	*				-164.5	159	71.1	-94.7	0	0	0	0	110.8
791	M	31.6	Very low	34	Very low	160 Å²	160	131.3 Å²	131.3	79%	0.788	77%	0.771	S	S	*	*			cis	-156.9	145.7	-14.2	-157.2	168.5	-173.6	0	0	110.1
792	S	32.6	Very low	33.8	Very low	121 Å²	121	132.9 Å²	132.9	85%	0.846	77%	0.774	S	S	*	*			trans	-156.2	133.4	162.2	-75.2	0	0	0	0	107.8
793	S	30.4	Very low	33.4	Very low	112 Å²	112	138.2 Å²	138.2	78%	0.783	79%	0.786	S	S	*	*			trans	-154.8	138.2	176.1	-83.3	0	0	0	0	112.9
794	S	34.8	Very low	33.1	Very low	122 Å²	122	137.1 Å²	137.1	85%	0.853	78%	0.783	S	S	*	*			trans	-109.6	160.8	168.1	-49.7	0	0	0	0	110.2
795	A	33.3	Very low	32.6	Very low	94 Å²	94	142.6 Å²	142.6	78%	0.777	79%	0.792	S	S	*	*			trans	-163.1	152.1	169.1	0	0	0	0	0	111.3
796	I	29.9	Very low	32.4	Very low	152 Å²	152	137.8 Å²	137.8	78%	0.779	78%	0.78	S	S	*	*			cis	-162.4	160.7	-33.8	-116.5	154.1	0	0	0	109.6
797	F	31.9	Very low	32.2	Very low	181 Å²	181	139 Å²	139	79%	0.794	78%	0.78	S	S	*	*			trans	-39.9	172.4	171.1	-79.9	-89.2	0	0	0	118.1
798	P	35	Very low	32	Very low	110 Å²	110	139.2 Å²	139.2	71%	0.714	78%	0.783	S	S	*	*			cis	-154.8	136.4	35	40.4	-15.9	0	0	0	123
799	S	31.9	Very low	31.8	Very low	95 Å²	95	140.4 Å²	140.4	66%	0.664	78%	0.782	S	S	*	*				63.2	149.1	124.3	88.3	0	0	0	0	125.7
800	S	30.4	Very low	31.7	Very low	106 Å²	106	141.3 Å²	141.3	74%	0.741	79%	0.786	S	S	*	*			trans	88.3	99.6	139.3	-54.8	0	0	0	0	122.4
801	R	33.9	Very low	31.6	Very low	248 Å²	248	143.8 Å²	143.8	94%	0.936	79%	0.794	S	S	*	*				-170.1	175.9	117.6	-105.4	175.5	-173.2	-157.9	1	113.8
802	Q	30.4	Very low	31.7	Very low	179 Å²	179	142.5 Å²	142.5	84%	0.836	79%	0.79	S	S	*	*			trans	-99.2	156.9	-154.2	-65.4	157	-66.1	0	0	116.2
803	F	28.7	Very low	31.7	Very low	205 Å²	205	142.8 Å²	142.8	90%	0.899	78%	0.782	S	S	*	*			trans	-8.2	134.8	155.4	-74.3	-96.1	0	0	0	119.5
804	S	29.9	Very low	32	Very low	109 Å²	109	143 Å²	143	76%	0.762	78%	0.783	S	S	*	*			trans	-143	147.4	132.9	59.2	0	0	0	0	109.8
805	Y	28.4	Very low	31.8	Very low	219 Å²	219	143.8 Å²	143.8	86%	0.859	78%	0.777	S	S	*	*			trans	-91.3	130.5	-177.4	-150.4	-94.8	0	0	0	108.4
806	V	31.7	Very low	31.9	Very low	116 Å²	116	146.4 Å²	146.4	70%	0.703	78%	0.784	S	S	*	*			trans	-143.3	135.6	175.7	-174.3	0	0	0	0	109.4
807	D	30.2	Very low	31.9	Very low	118 Å²	118	149.9 Å²	149.9	63%	0.631	79%	0.787	S	S	*	*			trans	-71.5	159.1	-175.3	-56.9	-77.9	0	0	0	114	I809	D807-I809 PolarHBondContact O-N 3.47Å
808	P	31.5	Very low	31.9	Very low	133 Å²	133	147.3 Å²	147.3	86%	0.864	79%	0.792	S	S	*	*			trans	-71.5	90.2	175	30.2	-35.7	0	0	0	111.7
809	I	32.4	Very low	31.6	Very low	141 Å²	141	148.6 Å²	148.6	72%	0.723	79%	0.791	S	S	*	*			trans	-85.7	129.3	170.5	-62	177.1	0	0	0	109	D807	D807-I809 PolarHBondContact O-N 3.47Å
810	P	31.4	Very low	31.7	Very low	118 Å²	118	150.2 Å²	150.2	77%	0.766	80%	0.801	S	S	*	*			trans	-71.7	144.4	-179.1	29.8	-35.4	0	0	0	111.9
811	L	33.5	Very low	31.9	Very low	181 Å²	181	149.7 Å²	149.7	95%	0.948	80%	0.795	S	S	*	*			trans	-112.6	116.2	172.5	-106.4	153.6	0	0	0	108.9
812	D	32.8	Very low	32.1	Very low	132 Å²	132	145.6 Å²	145.6	71%	0.706	79%	0.792	S	S	*	*			trans	-108.8	149.4	-173.3	-172.7	40.4	0	0	0	112.5
813	N	34.4	Very low	32.1	Very low	128 Å²	128	148 Å²	148	68%	0.684	79%	0.793	S	S	*	*			trans	41.2	117.3	161	-83.2	-54.3	0	0	0	121.4
814	S	35.1	Very low	32.2	Very low	116 Å²	116	145.5 Å²	145.5	81%	0.811	79%	0.788	S	S	*	*			trans	-138.9	83.1	137.1	50.4	0	0	0	0	113.6
815	L	32.3	Very low	32.4	Very low	138 Å²	138	147.9 Å²	147.9	72%	0.723	79%	0.791	S	S	*	*			trans	48.6	105.9	130.5	-64.5	166.3	0	0	0	119.9
816	T	34	Very low	32.6	Very low	150 Å²	150	143.1 Å²	143.1	92%	0.92	79%	0.789	S	S	*	*				-122.5	149.3	126.3	43.7	0	0	0	0	109.3
817	R	30.4	Very low	32.8	Very low	225 Å²	225	143.2 Å²	143.2	85%	0.849	79%	0.793	S	S	*	*			trans	-100.2	139.8	-163.1	-64.4	176	174	179.9	-3	113.4
818	S	31	Very low	33	Very low	126 Å²	126	145.4 Å²	145.4	88%	0.881	80%	0.803	S	S	*	*			trans	-147.7	124.9	138.3	-164.5	0	0	0	0	111
819	I	30.3	Very low	33.2	Very low	138 Å²	138	143.9 Å²	143.9	71%	0.708	80%	0.802	S	S	*	*			trans	-73.3	136.4	-164.1	-64.9	153.5	0	0	0	113
820	C	32.6	Very low	33.6	Very low	128 Å²	128	142.9 Å²	142.9	87%	0.865	81%	0.805	S	S	*	*			trans	-152.2	120.8	142.7	-92.7	0	0	0	0	108.6
821	P	36.1	Very low	34	Very low	96 Å²	96	143.2 Å²	143.2	62%	0.623	81%	0.806	S	S	*	*			trans	-100.1	-178.8	-173.8	40.1	-36.4	0	0	0	114.1
822	D	36.7	Very low	34	Very low	161 Å²	161	140.8 Å²	140.8	86%	0.861	80%	0.8	S	S	*	*			trans	73.5	103.9	158.8	-55.7	-27.4	0	0	0	119.6
823	R	30.8	Very low	34.3	Very low	231 Å²	231	140.5 Å²	140.5	87%	0.872	81%	0.805	S	S	*	*			trans	-128.7	147.5	159	-158.8	-175.8	-160.8	-151.7	6.7	107.6
824	L	30.7	Very low	34.3	Very low	151 Å²	151	139.5 Å²	139.5	79%	0.791	81%	0.808	S	S	*	*			trans	76.6	115.4	177.5	-45.5	173.9	0	0	0	115.8
825	I	34	Very low	34.4	Very low	160 Å²	160	144 Å²	144	82%	0.821	81%	0.813	S	S	*	*				-173.5	136.2	104.9	-90.7	156.3	0	0	0	108.4
826	S	32.3	Very low	34.6	Very low	118 Å²	118	144.7 Å²	144.7	83%	0.825	81%	0.812	S	S	*	*			trans	-84.3	140.5	177	-47	0	0	0	0	111.7
827	P	36.5	Very low	34.6	Very low	119 Å²	119	144.4 Å²	144.4	77%	0.773	81%	0.81	S	S	*	*			trans	-132.4	158.7	147.6	33.8	-19.7	0	0	0	115.1
828	L	33.8	Very low	34.8	Very low	164 Å²	164	141.2 Å²	141.2	86%	0.859	81%	0.805	S	S	*	*			trans	-39.8	148.3	179.9	-80.5	45.9	0	0	0	117.3
829	A	35.3	Very low	35	Very low	100 Å²	100	142.8 Å²	142.8	83%	0.826	80%	0.802	S	S	*	*			trans	-80.8	147.1	161.3	0	0	0	0	0	112.7
830	P	41	Very low	35.1	Very low	121 Å²	121	141.1 Å²	141.1	79%	0.786	80%	0.803	S	S	*	*			trans	-115.9	176.6	149.1	32.9	-19.9	0	0	0	111.4
831	P	39.9	Very low	35.3	Very low	124 Å²	124	140 Å²	140	81%	0.805	80%	0.796	S	S	*	*			trans	-107.7	173.7	-140.2	18.9	-0.9	0	0	0	117.6
832	T	33.4	Very low	35.2	Very low	131 Å²	131	144.7 Å²	144.7	80%	0.804	81%	0.807	S	S	*	*			trans	-72.5	160.4	172.1	50.8	0	0	0	0	113.4
833	P	40.5	Very low	35	Very low	126 Å²	126	142.4 Å²	142.4	82%	0.818	80%	0.803	S	S	*	*			trans	-133.5	143.4	130.1	36.3	-27.2	0	0	0	114.6
834	S	33.4	Very low	35.4	Very low	106 Å²	106	137.6 Å²	137.6	74%	0.741	80%	0.802	S	S	*	*			trans	-66.6	160.1	-174.3	-38.7	0	0	0	0	116.4
835	K	37.5	Very low	35.5	Very low	211 Å²	211	134.5 Å²	134.5	92%	0.917	80%	0.799	S	S	*	*			trans	-153.1	146	138.1	-112.7	162.8	-171.6	175.7	0	113
836	H	36.1	Very low	35.5	Very low	152 Å²	152	134.8 Å²	134.8	70%	0.704	80%	0.801	S	S	*	*			trans	-78.7	154.4	-173	-73.7	-134.3	0	0	0	113.8
837	V	35	Very low	35.5	Very low	145 Å²	145	133.5 Å²	133.5	88%	0.879	79%	0.792	S	S	*	*				-145	155.7	110.6	176.1	0	0	0	0	108.3
838	Q	33.5	Very low	35.3	Very low	158 Å²	158	137.2 Å²	137.2	74%	0.738	80%	0.796	S	S	*	*			trans	-111.6	165	-176.2	-65.4	175.3	-41.9	0	0	113.5
839	L	34.4	Very low	35.2	Very low	159 Å²	159	134.9 Å²	134.9	83%	0.832	79%	0.793	S	S	*	*			trans	154.1	98	142.4	-82.3	159.8	0	0	0	108.3
840	S	33.7	Very low	35	Very low	103 Å²	103	136.2 Å²	136.2	72%	0.72	79%	0.791	S	S	*	*				49.2	133.8	84	74.9	0	0	0	0	115.1
841	S	36.5	Very low	34.6	Very low	104 Å²	104	136.9 Å²	136.9	73%	0.727	79%	0.793	S	S	*	*			cis	-162.4	142.7	27.6	55.8	0	0	0	0	117.2
842	K	34.7	Very low	34	Very low	195 Å²	195	138 Å²	138	85%	0.848	79%	0.792	S	S	*	*			trans	39	118.8	137.9	-59.6	-179.5	178.9	179.6	0	122.5
843	S	32.6	Very low	34.1	Very low	112 Å²	112	137.5 Å²	137.5	78%	0.783	79%	0.794	S	S	*	*				26.8	165.8	110.7	-29.6	0	0	0	0	122
844	P	39.4	Very low	33.7	Very low	130 Å²	130	138.5 Å²	138.5	84%	0.844	79%	0.792	S	S	*	*			cis	-135.4	-157.7	4.8	42.1	-21.5	0	0	0	114.8
845	A	32.9	Very low	33.7	Very low	87 Å²	87	141.1 Å²	141.1	72%	0.719	80%	0.797	S	S	*	*			trans	-116.5	167.3	-177	0	0	0	0	0	114
846	L	32.8	Very low	33.4	Very low	165 Å²	165	135 Å²	135	86%	0.864	78%	0.781	S	S	*	*			trans	177.8	129.2	137.6	-98.8	157.3	0	0	0	117.1
847	S	32.2	Very low	33.4	Very low	91 Å²	91	134.1 Å²	134.1	64%	0.636	78%	0.781	S	S	*	*			trans	43.2	122.4	142.8	64	0	0	0	0	126
848	K	31.6	Very low	33.4	Very low	198 Å²	198	135 Å²	135	86%	0.861	77%	0.773	S	S	*	*				53	123.1	128.8	-58.4	-179.6	178.4	-178.2	0	121.7
849	S	33	Very low	33.6	Very low	115 Å²	115	132.9 Å²	132.9	80%	0.804	77%	0.771	S	S	*	*				168.1	142	91.8	48.2	0	0	0	0	116.8
850	T	30.1	Very low	33.5	Very low	127 Å²	127	132.4 Å²	132.4	78%	0.779	77%	0.77	S	S	*	*			trans	6.9	134.9	150.6	-31.7	0	0	0	0	122.8
851	V	32.6	Very low	33.8	Very low	136 Å²	136	132.5 Å²	132.5	82%	0.824	77%	0.768	S	S	*	*				172.5	147.8	115.8	156	0	0	0	0	111.6
852	N	28.5	Very low	33.7	Very low	148 Å²	148	134.5 Å²	134.5	79%	0.791	78%	0.776	S	S	*	*			trans	-84.4	163	-173.4	-55.6	-21.3	0	0	0	114.4
853	S	35.8	Very low	33.5	Very low	119 Å²	119	131 Å²	131	83%	0.832	77%	0.77	S	S	*	*			trans	-157	150.8	143.2	42.6	0	0	0	0	111.4
854	D	30.4	Very low	33.6	Very low	147 Å²	147	133.7 Å²	133.7	79%	0.786	78%	0.776	S	S	*	*			trans	-87.4	167.6	-169.1	-46.4	-98.9	0	0	0	114.3
855	L	34.2	Very low	33.3	Very low	161 Å²	161	133.7 Å²	133.7	84%	0.843	77%	0.769	S	S	*	*				-174.1	104.6	114.2	-117.3	81.5	0	0	0	114.4
856	S	32.1	Very low	33.4	Very low	84 Å²	84	134.6 Å²	134.6	59%	0.587	77%	0.768	S	S	*	*			trans	14	157.7	139.1	67.2	0	0	0	0	124.9
857	N	34.9	Very low	33.6	Very low	132 Å²	132	134 Å²	134	71%	0.706	76%	0.761	S	S	*	*			trans	91.1	144.8	150.9	-64.9	-50.6	0	0	0	118.2
858	K	36.3	Very low	33.5	Very low	164 Å²	164	136 Å²	136	71%	0.713	77%	0.765	S	S	*	*			cis	-163.8	140.9	6.9	-131	167.5	-171.6	176.5	0	114.7
859	T	36.5	Very low	33.6	Very low	114 Å²	114	135.2 Å²	135.2	70%	0.699	76%	0.761	S	S	*	*			trans	57.5	154.7	145.2	46.3	0	0	0	0	120.9
860	N	31.9	Very low	33.6	Very low	148 Å²	148	140.2 Å²	140.2	79%	0.791	76%	0.762	S	S	*	*			cis	-152.3	154.8	15.4	-119	-6.5	0	0	0	112
861	P	40.9	Very low	33.7	Very low	106 Å²	106	138.2 Å²	138.2	69%	0.688	75%	0.754	S	S	*	*			trans	-108.9	177.8	173.9	41.1	-33.7	0	0	0	114.2
862	V	34	Very low	33.8	Very low	146 Å²	146	139.3 Å²	139.3	89%	0.885	75%	0.752	S	S	*	*			trans	-134.7	148.2	163.2	178.1	0	0	0	0	109
863	V	31	Very low	34.1	Very low	122 Å²	122	138.9 Å²	138.9	74%	0.739	75%	0.749	S	S	*	*			trans	-136.4	148	-176.4	-177.6	0	0	0	0	108.4
864	D	34.9	Very low	34	Very low	168 Å²	168	137.1 Å²	137.1	90%	0.898	74%	0.737	S	S	*	*			trans	-150.9	157.9	152.5	-113	-36.1	0	0	0	111
865	D	32.4	Very low	34.1	Very low	130 Å²	130	136.3 Å²	136.3	70%	0.695	73%	0.733	S	S	*	*			trans	-118.6	166.3	-159.9	-156.9	-25.6	0	0	0	112.7
866	C	34.5	Very low	33.9	Very low	105 Å²	105	137 Å²	137	71%	0.709	73%	0.73	S	S	*	*			trans	159.7	102.1	135.8	-89.3	0	0	0	0	115.8
867	H	37.5	Very low	33.9	Very low	152 Å²	152	139.9 Å²	139.9	70%	0.704	74%	0.737	S	S	*	*				68.3	96	125.3	-62.5	-11.1	0	0	0	123.6
868	N	31	Very low	33.5	Very low	135 Å²	135	140.4 Å²	140.4	72%	0.722	74%	0.74	S	S	*	*				61.5	111.4	99.9	-156.4	-4.2	0	0	0	121.4
869	K	34	Very low	33.3	Very low	180 Å²	180	142 Å²	142	78%	0.783	75%	0.75	S	S	*	*				178.4	124.4	121.7	-98	161.3	-172.9	172.3	0	116.1
870	R	32.9	Very low	33	Very low	220 Å²	220	141.4 Å²	141.4	83%	0.83	75%	0.751	S	S	*	*				43.1	148.8	128.6	-63.5	-176.1	-175.8	-174.1	-1	122.2
871	S	32.3	Very low	33	Very low	86 Å²	86	145.6 Å²	145.6	60%	0.601	76%	0.757	S	S	*	*			cis	178.6	169.3	-16.3	53.2	0	0	0	0	110.9
872	M	34.9	Very low	32.5	Very low	159 Å²	159	145.6 Å²	145.6	78%	0.783	76%	0.76	S	S	*	*			trans	75.9	148.3	160.7	-61	168.7	147.2	0	0	117.7
873	D	34	Very low	32.5	Very low	138 Å²	138	142.1 Å²	142.1	74%	0.738	75%	0.754	S	S	*	*			cis	-156.9	-166.2	-16.8	-103.9	-16.3	0	0	0	111.6
874	S	32.9	Very low	32.6	Very low	83 Å²	83	143.3 Å²	143.3	58%	0.58	76%	0.756	S	S	*	*			trans	-148.4	165.7	-139.8	56.3	0	0	0	0	118
875	N	32.4	Very low	32.6	Very low	129 Å²	129	142.9 Å²	142.9	69%	0.69	75%	0.754	S	S	*	*			trans	68.3	169.9	164.6	-42	-44.1	0	0	0	115.9
876	F	31.9	Very low	32.5	Very low	177 Å²	177	143.4 Å²	143.4	78%	0.776	76%	0.761	S	S	*	*			cis	-132.3	146.9	-1.1	-83.9	-94.8	0	0	0	107.9
877	L	30.2	Very low	32.4	Very low	144 Å²	144	143.3 Å²	143.3	75%	0.754	76%	0.762	S	S	*	*				82.6	144	63.2	-103	176.2	0	0	0	116.9
878	N	26.8	Very low	32.3	Very low	143 Å²	143	140.5 Å²	140.5	77%	0.765	76%	0.759	S	S	*	*			trans	-53.8	159.6	-165.2	-53.2	-16.7	0	0	0	119
879	E	32.3	Very low	32.3	Very low	197 Å²	197	143.9 Å²	143.9	92%	0.921	77%	0.768	S	S	*	*				-168.9	173.2	110	-106.2	176.2	-168.4	0	0	113.2
880	S	30	Very low	32.2	Very low	102 Å²	102	140.3 Å²	140.3	71%	0.713	76%	0.763	S	S	*	*			trans	-134.6	161.7	-166.6	58.5	0	0	0	0	113.4
881	Y	32.4	Very low	32	Very low	235 Å²	235	137.5 Å²	137.5	92%	0.922	76%	0.764	S	S	*	*			trans	-173.1	175.9	144.3	-110.3	-70.4	0	0	0	112.6
882	S	30.5	Very low	32	Very low	106 Å²	106	140.2 Å²	140.2	74%	0.741	78%	0.777	S	S	*	*			trans	-107.7	157.6	-154.1	57.1	0	0	0	0	117.4
883	G	34.2	Very low	31.8	Very low	74 Å²	74	140.2 Å²	140.2	76%	0.763	78%	0.775	S	S	*	*			trans	-171.6	131.1	162.7	0	0	0	0	0	114.5
884	N	33.6	Very low	32	Very low	146 Å²	146	139.9 Å²	139.9	78%	0.781	78%	0.78	S	S	*	*			trans	-94.3	145.6	-172.2	-60.2	-27	0	0	0	113.8
885	N	34.5	Very low	32.1	Very low	160 Å²	160	141.3 Å²	141.3	86%	0.856	79%	0.785	S	S	*	*				178.3	154.9	108	-92.1	-38.4	0	0	0	116.3
886	V	30.5	Very low	32.2	Very low	140 Å²	140	142.4 Å²	142.4	85%	0.848	79%	0.791	S	S	*	*			trans	-72.7	139.5	-168.8	172.2	0	0	0	0	115.6
887	S	32.7	Very low	32.5	Very low	104 Å²	104	141.9 Å²	141.9	73%	0.727	79%	0.794	S	S	*	*				-175.6	110.6	124.5	-161	0	0	0	0	116.9
888	S	34.4	Very low	32.9	Very low	93 Å²	93	138 Å²	138	65%	0.65	78%	0.779	S	S	*	*			trans	53.4	110.4	139.8	67.1	0	0	0	0	124.8
889	K	31	Very low	33.6	Very low	206 Å²	206	135.7 Å²	135.7	90%	0.896	78%	0.775	S	S	*	*			trans	68.7	158.2	138	-68.3	-174.1	175.4	-177.6	0	120.7
890	P	32.7	Very low	34.4	Very low	105 Å²	105	129.2 Å²	129.2	68%	0.682	75%	0.751	S	S	*	*			cis	-138	174.4	-38.5	40	-23.6	0	0	0	114.8
891	N	27.1	Very low	35.8	Very low	160 Å²	160	128.6 Å²	128.6	86%	0.856	74%	0.743	S	S	*	*			trans	41.7	114.1	162.5	-73.5	26.4	0	0	0	121
892	V	33.1	Very low	36.6	Very low	143 Å²	143	124 Å²	124	87%	0.867	73%	0.728	S	S	*	*			trans	-141.9	131.6	158	179.7	0	0	0	0	110
893	H	31.2	Very low	37.9	Very low	160 Å²	160	124 Å²	124	74%	0.741	72%	0.716	S	S	*	*			trans	-77	147.6	171.1	-71.3	-94.9	0	0	0	111.6
894	P	37.7	Very low	39.5	Very low	131 Å²	131	126.2 Å²	126.2	85%	0.851	71%	0.707	S	S	*	*			trans	-65.1	136.6	159.3	29.7	-32.8	0	0	0	109.6
895	T	35.5	Very low	41	Very low	113 Å²	113	123.7 Å²	123.7	69%	0.693	69%	0.69	S	S	*	*			trans	-121.5	150.4	-168.8	49.8	0	0	0	0	113.9
896	N	33.9	Very low	42.3	Very low	151 Å²	151	120 Å²	120	81%	0.807	67%	0.67	S	S	*	*			trans	45.5	96.4	149.9	-63.4	-32	0	0	0	118.6
897	I	37.5	Very low	44.2	Very low	166 Å²	166	119.8 Å²	119.8	85%	0.851	65%	0.654	S	S	*	*			trans	-73.5	130.3	142.8	-62	178	0	0	0	107.6	S899	I897-S899 PolarHBondContact O-N 2.83Å
898	S	38.8	Very low	46.2	Very low	62 Å²	62	118.3 Å²	118.3	43%	0.434	64%	0.638	S	S	.	*			trans	-63.4	131.5	-174.3	-179.9	0	0	0	0	112.8	S900 V901	S898-S900 PolarHBondContact O-N 3.37Å; S898-S900 VanDerWaalsContact O-N 3.09Å; S898-S900 PolarHBondContact OG-N 3.31Å; S898-S900 PolarHBondContact OG-OG 3.46Å; S898-V901 PolarHBondContact O-N 2.89Å
899	S	42.7	Very low	47.8	Very low	96 Å²	96	121.6 Å²	121.6	67%	0.671	64%	0.636	S	S	*	*	H	α-helix	trans	-62.6	-15.4	175.7	62.2	0	0	0	0	113.9	I897 Q903	I897-S899 PolarHBondContact O-N 2.83Å; S899-Q903 WeakPolarHBondContact O-CB 3.15Å; S899-Q903 WeakPolarHBondContact O-CG 3.34Å; S899-Q903 PolarHBondContact O-N 2.92Å; S899-Q903 VanDerWaalsContact O-N 3.08Å
900	S	48.6	Very low	49.6	Very low	61 Å²	61	117 Å²	117	43%	0.427	62%	0.621	S	S	.	*	H	α-helix	trans	-62.3	-43.1	173.1	61.5	0	0	0	0	112.6	S898 Q903 E904	S898-S900 PolarHBondContact O-N 3.37Å; S898-S900 VanDerWaalsContact O-N 3.09Å; S898-S900 PolarHBondContact OG-N 3.31Å; S898-S900 PolarHBondContact OG-OG 3.46Å; S900-Q903 PolarHBondContact O-N 3.38Å; S900-E904 PolarHBondContact O-N 3.38Å
901	V	59.4	Low	51.5	Low	89 Å²	89	117.8 Å²	117.8	54%	0.539	61%	0.613	S	S	.	*	H	α-helix	trans	-68.6	-45.6	-175.5	-176.2	0	0	0	0	110.3	S898 Q903 E904 E905	S898-V901 PolarHBondContact O-N 2.89Å; V901-Q903 VanDerWaalsContact C-N 3.34Å; V901-Q903 PolarHBondContact O-N 2.92Å; V901-E904 PolarHBondContact O-N 3.26Å; V901-E905 PolarHBondContact O-N 3.07Å
902	F	50.1	Low	53.5	Low	138 Å²	138	115.7 Å²	115.7	61%	0.605	60%	0.599	S	S	*	*	H	α-helix	trans	-63.5	-37.5	175.7	-170.8	-103.5	0	0	0	112.4	E904 L906	F902-E904 PolarHBondContact O-N 3.27Å; F902-L906 HydrophobicContact CD1-CD1 4.39Å; F902-L906 HydrophobicContact CE1-CD1 3.68Å; F902-L906 HydrophobicContact CZ-CD1 3.92Å; F902-L906 WeakPolarHBondContact O-CB 3.34Å; F902-L906 PolarHBondContact O-N 2.82Å
903	Q	55.9	Low	55	Low	105 Å²	105	114.2 Å²	114.2	49%	0.491	58%	0.582	S	S	.	*	H	α-helix	trans	-64.3	-35.2	174	-81.1	-83.1	-39.7	0	0	113.1	S899 S900 V901 R907	S899-Q903 WeakPolarHBondContact O-CB 3.15Å; S899-Q903 WeakPolarHBondContact O-CG 3.34Å; S899-Q903 PolarHBondContact O-N 2.92Å; S899-Q903 VanDerWaalsContact O-N 3.08Å; S900-Q903 PolarHBondContact O-N 3.38Å; V901-Q903 VanDerWaalsContact C-N 3.34Å; V901-Q903 PolarHBondContact O-N 2.92Å; Q903-R907 WeakPolarHBondContact O-CB 3.39Å; Q903-R907 VanDerWaalsContact O-CG 3.29Å; Q903-R907 WeakPolarHBondContact O-CG 3.49Å; Q903-R907 PolarHBondContact O-N 3.21Å
904	E	68.7	Low	56.4	Low	121 Å²	121	109.1 Å²	109.1	57%	0.565	56%	0.564	S	S	*	*	H	α-helix	trans	-78	-42.6	176.8	-72.3	-171.4	124.4	0	0	112.3	S900 V901 F902 L906 R907 D908	S900-E904 PolarHBondContact O-N 3.38Å; V901-E904 PolarHBondContact O-N 3.26Å; F902-E904 PolarHBondContact O-N 3.27Å; E904-L906 VanDerWaalsContact C-N 3.33Å; E904-L906 PolarHBondContact O-N 2.95Å; E904-R907 WeakPolarHBondContact O-CB 3.4Å; E904-R907 PolarHBondContact O-N 3.16Å; E904-D908 PolarHBondContact O-N 3.09Å
905	E	66.2	Low	57.5	Low	93 Å²	93	109 Å²	109	44%	0.435	55%	0.552	S	S	.	*	H	α-helix	trans	-61.6	-42	175.1	-162.8	-169.1	152.4	0	0	111.6	V901 R907 D908 R909	V901-E905 PolarHBondContact O-N 3.07Å; E905-R907 PolarHBondContact O-N 3.26Å; E905-D908 PolarHBondContact O-N 3.46Å; E905-R909 WeakPolarHBondContact O-CB 3.43Å; E905-R909 WeakPolarHBondContact O-CG 3.21Å; E905-R909 PolarHBondContact O-N 3.15Å; E905-R909 IonicContact OE1-CZ 3.97Å; E905-R909 IonicContact OE1-NE 2.72Å; E905-R909 PolarHBondContact OE1-NE 2.78Å; E905-R909 IonicContact OE1-NH2 2.67Å; E905-R909 PolarHBondContact OE1-NH2 3.31Å
906	L	61.4	Low	58.5	Low	82 Å²	82	108.3 Å²	108.3	43%	0.429	54%	0.541	S	S	.	.	H	α-helix	trans	-68.7	-33.8	178.4	-157.3	155.3	0	0	0	111.5	F902 E904 L910	F902-L906 HydrophobicContact CD1-CD1 4.39Å; F902-L906 HydrophobicContact CE1-CD1 3.68Å; F902-L906 HydrophobicContact CZ-CD1 3.92Å; F902-L906 WeakPolarHBondContact O-CB 3.34Å; F902-L906 PolarHBondContact O-N 2.82Å; E904-L906 VanDerWaalsContact C-N 3.33Å; E904-L906 PolarHBondContact O-N 2.95Å; L906-L910 HydrophobicContact CD2-CD1 3.72Å; L906-L910 HydrophobicContact CD2-CG 4.26Å; L906-L910 WeakPolarHBondContact O-CB 3.35Å; L906-L910 VanDerWaalsContact O-CG 3.29Å; L906-L910 WeakPolarHBondContact O-CG 3.34Å; L906-L910 PolarHBondContact O-N 3.16Å
907	R	69.1	Low	59.2	Low	136 Å²	136	106.2 Å²	106.2	51%	0.513	53%	0.53	S	S	.	.	H	α-helix	trans	-63.4	-42.5	168.7	-82.5	179.7	-169.1	132.8	9.7	112.3	Q903 E904 E905 L910 K911	Q903-R907 WeakPolarHBondContact O-CB 3.39Å; Q903-R907 VanDerWaalsContact O-CG 3.29Å; Q903-R907 WeakPolarHBondContact O-CG 3.49Å; Q903-R907 PolarHBondContact O-N 3.21Å; E904-R907 WeakPolarHBondContact O-CB 3.4Å; E904-R907 PolarHBondContact O-N 3.16Å; E905-R907 PolarHBondContact O-N 3.26Å; R907-L910 PolarHBondContact O-N 2.8Å; R907-K911 WeakPolarHBondContact O-CG 3.46Å; R907-K911 PolarHBondContact O-N 3.03Å
908	D	75.5	Confident	59.8	Low	73 Å²	73	104.5 Å²	104.5	39%	0.39	52%	0.516	S	S	.	.	H	α-helix	trans	-76.9	-34.8	-175.4	-78.6	4	0	0	0	112.3	E904 E905 L910 K911 Q912	E904-D908 PolarHBondContact O-N 3.09Å; E905-D908 PolarHBondContact O-N 3.46Å; D908-L910 VanDerWaalsContact C-N 3.34Å; D908-L910 PolarHBondContact O-N 2.98Å; D908-K911 PolarHBondContact O-N 3.34Å; D908-K911 WeakPolarHBondContact OD1-CD 3.24Å; D908-K911 WeakPolarHBondContact OD1-CE 3.33Å; D908-K911 IonicContact OD1-NZ 2.59Å; D908-K911 PolarHBondContact OD1-NZ 3.18Å; D908-Q912 WeakPolarHBondContact O-CB 3.21Å; D908-Q912 WeakPolarHBondContact O-CG 3.43Å; D908-Q912 PolarHBondContact O-N 3.43Å
909	R	68.5	Low	60.1	Low	162 Å²	162	105.4 Å²	105.4	61%	0.611	52%	0.522	S	S	*	.	H	α-helix	trans	-59.4	-42.6	165.1	-71	179.8	-178	-120.8	7.7	111.6	E905 Q912 H913	E905-R909 WeakPolarHBondContact O-CB 3.43Å; E905-R909 WeakPolarHBondContact O-CG 3.21Å; E905-R909 PolarHBondContact O-N 3.15Å; E905-R909 IonicContact OE1-CZ 3.97Å; E905-R909 IonicContact OE1-NE 2.72Å; E905-R909 PolarHBondContact OE1-NE 2.78Å; E905-R909 IonicContact OE1-NH2 2.67Å; E905-R909 PolarHBondContact OE1-NH2 3.31Å; R909-Q912 PolarHBondContact O-N 3.04Å; R909-H913 WeakPolarHBondContact O-CB 3.43Å; R909-H913 PolarHBondContact O-N 3.21Å
910	L	67.9	Low	60	Low	111 Å²	111	105.9 Å²	105.9	58%	0.581	53%	0.526	S	S	*	.	H	α-helix	trans	-66.1	-36.6	174.2	-77.2	172.4	0	0	0	113.3	L906 R907 D908 S914	L906-L910 HydrophobicContact CD2-CD1 3.72Å; L906-L910 HydrophobicContact CD2-CG 4.26Å; L906-L910 WeakPolarHBondContact O-CB 3.35Å; L906-L910 VanDerWaalsContact O-CG 3.29Å; L906-L910 WeakPolarHBondContact O-CG 3.34Å; L906-L910 PolarHBondContact O-N 3.16Å; R907-L910 PolarHBondContact O-N 2.8Å; D908-L910 VanDerWaalsContact C-N 3.34Å; D908-L910 PolarHBondContact O-N 2.98Å; L910-S914 VanDerWaalsContact O-CB 3.3Å; L910-S914 WeakPolarHBondContact O-CB 3.26Å; L910-S914 PolarHBondContact O-N 3.31Å
911	K	72.6	Confident	59.4	Low	120 Å²	120	107.4 Å²	107.4	52%	0.522	54%	0.536	S	S	.	.	H	α-helix	trans	-62.9	-47.9	171.8	-72.8	174.7	-163	159.8	0	110.8	R907 D908 S914 Q915	R907-K911 WeakPolarHBondContact O-CG 3.46Å; R907-K911 PolarHBondContact O-N 3.03Å; D908-K911 PolarHBondContact O-N 3.34Å; D908-K911 WeakPolarHBondContact OD1-CD 3.24Å; D908-K911 WeakPolarHBondContact OD1-CE 3.33Å; D908-K911 IonicContact OD1-NZ 2.59Å; D908-K911 PolarHBondContact OD1-NZ 3.18Å; K911-S914 CarbonylContact O-C 3.41Å; K911-S914 PolarHBondContact O-N 3.41Å; K911-Q915 WeakPolarHBondContact O-CG 3.41Å; K911-Q915 PolarHBondContact O-N 3.05Å
912	Q	69.8	Low	58.2	Low	117 Å²	117	111.3 Å²	111.3	55%	0.547	55%	0.549	S	S	.	.	H	α-helix	trans	-60	-46.6	178.8	-73.7	176.8	6.4	0	0	111.3	D908 R909 S914 Q915 Q916	D908-Q912 WeakPolarHBondContact O-CB 3.21Å; D908-Q912 WeakPolarHBondContact O-CG 3.43Å; D908-Q912 PolarHBondContact O-N 3.43Å; R909-Q912 PolarHBondContact O-N 3.04Å; Q912-S914 VanDerWaalsContact C-N 3.34Å; Q912-S914 PolarHBondContact O-N 3.13Å; Q912-Q915 CarbonylContact O-C 3.55Å; Q912-Q915 PolarHBondContact O-N 3.49Å; Q912-Q916 WeakPolarHBondContact O-CG 3.32Å; Q912-Q916 PolarHBondContact O-N 2.64Å
913	H	63.9	Low	57.6	Low	112 Å²	112	114.2 Å²	114.2	52%	0.519	56%	0.564	S	S	.	*	H	α-helix	trans	-63.3	-38.6	176.1	-159	-100.4	0	0	0	112.1	R909 Q915 Q916 L917	R909-H913 WeakPolarHBondContact O-CB 3.43Å; R909-H913 PolarHBondContact O-N 3.21Å; H913-Q915 VanDerWaalsContact C-N 3.27Å; H913-Q915 PolarHBondContact O-N 3.48Å; H913-Q916 PolarHBondContact O-N 3.36Å; H913-L917 WeakPolarHBondContact O-CG 3.16Å; H913-L917 PolarHBondContact O-N 3.32Å; H913-L917 VanDerWaalsContact O-N 3.07Å
914	S	59.9	Low	56.5	Low	52 Å²	52	118.1 Å²	118.1	36%	0.364	58%	0.579	S	S	.	*	H	α-helix	trans	-69.6	-20.5	173.7	-163.5	0	0	0	0	114	L910 K911 Q912 K918	L910-S914 VanDerWaalsContact O-CB 3.3Å; L910-S914 WeakPolarHBondContact O-CB 3.26Å; L910-S914 PolarHBondContact O-N 3.31Å; K911-S914 CarbonylContact O-C 3.41Å; K911-S914 PolarHBondContact O-N 3.41Å; Q912-S914 VanDerWaalsContact C-N 3.34Å; Q912-S914 PolarHBondContact O-N 3.13Å; S914-K918 VanDerWaalsContact O-CD 3.24Å; S914-K918 WeakPolarHBondContact O-CD 3.44Å; S914-K918 VanDerWaalsContact O-CG 3.3Å; S914-K918 WeakPolarHBondContact O-CG 3.28Å; S914-K918 PolarHBondContact O-NZ 3.09Å; S914-K918 PolarHBondContact OG-NZ 2.85Å
915	Q	61.8	Low	54.6	Low	130 Å²	130	118.6 Å²	118.6	61%	0.607	59%	0.593	S	S	*	*	H	α-helix	trans	-85.9	-42.6	173.2	-75.2	175.5	-5.5	0	0	111.2	K911 Q912 H913 L917 K918 S919	K911-Q915 WeakPolarHBondContact O-CG 3.41Å; K911-Q915 PolarHBondContact O-N 3.05Å; Q912-Q915 CarbonylContact O-C 3.55Å; Q912-Q915 PolarHBondContact O-N 3.49Å; H913-Q915 VanDerWaalsContact C-N 3.27Å; H913-Q915 PolarHBondContact O-N 3.48Å; Q915-L917 PolarHBondContact O-N 2.72Å; Q915-K918 CarbonylContact O-C 3.55Å; Q915-K918 WeakPolarHBondContact O-CA 3.18Å; Q915-K918 WeakPolarHBondContact O-CB 3.37Å; Q915-K918 PolarHBondContact O-N 2.77Å; Q915-S919 PolarHBondContact O-N 2.98Å; Q915-S919 PolarHBondContact O-OG 3.26Å
916	Q	55.5	Low	53.1	Low	97 Å²	97	121.8 Å²	121.8	45%	0.453	61%	0.611	S	S	.	*	H	α-helix	trans	-58.7	-45.1	175	-76.2	176.3	-24.4	0	0	111.8	Q912 H913 K918 S919 S920	Q912-Q916 WeakPolarHBondContact O-CG 3.32Å; Q912-Q916 PolarHBondContact O-N 2.64Å; H913-Q916 PolarHBondContact O-N 3.36Å; Q916-K918 PolarHBondContact O-N 3.34Å; Q916-K918 VanDerWaalsContact O-N 3.15Å; Q916-S919 WeakPolarHBondContact CA-OG 3.08Å; Q916-S919 PolarHBondContact O-N 3.37Å; Q916-S919 PolarHBondContact O-OG 3.22Å; Q916-S920 PolarHBondContact O-N 3.5Å; Q916-S920 PolarHBondContact O-OG 3.16Å; Q916-S920 VanDerWaalsContact O-OG 3.09Å
917	L	49.4	Very low	51.8	Low	108 Å²	108	123.3 Å²	123.3	57%	0.565	62%	0.624	S	S	*	*	H	α-helix	trans	-61.4	-22.2	173.6	-71.2	169.2	0	0	0	113.5	H913 Q915 S921	H913-L917 WeakPolarHBondContact O-CG 3.16Å; H913-L917 PolarHBondContact O-N 3.32Å; H913-L917 VanDerWaalsContact O-N 3.07Å; Q915-L917 PolarHBondContact O-N 2.72Å; L917-S921 PolarHBondContact O-OG 3.47Å
918	K	49.4	Very low	50.3	Low	130 Å²	130	122.8 Å²	122.8	57%	0.565	64%	0.638	S	S	*	*	H	α-helix	trans	-91.6	-31.8	176.5	-71.1	172.1	-172.1	130.8	0	113.1	S914 Q915 Q916 S921	S914-K918 VanDerWaalsContact O-CD 3.24Å; S914-K918 WeakPolarHBondContact O-CD 3.44Å; S914-K918 VanDerWaalsContact O-CG 3.3Å; S914-K918 WeakPolarHBondContact O-CG 3.28Å; S914-K918 PolarHBondContact O-NZ 3.09Å; S914-K918 PolarHBondContact OG-NZ 2.85Å; Q915-K918 CarbonylContact O-C 3.55Å; Q915-K918 WeakPolarHBondContact O-CA 3.18Å; Q915-K918 WeakPolarHBondContact O-CB 3.37Å; Q915-K918 PolarHBondContact O-N 2.77Å; Q916-K918 PolarHBondContact O-N 3.34Å; Q916-K918 VanDerWaalsContact O-N 3.15Å; K918-S921 WeakPolarHBondContact O-CB 3.45Å; K918-S921 PolarHBondContact O-N 3.44Å
919	S	44.8	Very low	48.4	Very low	81 Å²	81	128.5 Å²	128.5	57%	0.566	66%	0.66	S	S	*	*	H	α-helix	trans	-69.6	-35.2	171.9	50.4	0	0	0	0	111.9	Q915 Q916 S921 Q922	Q915-S919 PolarHBondContact O-N 2.98Å; Q915-S919 PolarHBondContact O-OG 3.26Å; Q916-S919 WeakPolarHBondContact CA-OG 3.08Å; Q916-S919 PolarHBondContact O-N 3.37Å; Q916-S919 PolarHBondContact O-OG 3.22Å; S919-S921 PolarHBondContact O-N 2.88Å; S919-S921 VanDerWaalsContact O-N 3.08Å; S919-Q922 PolarHBondContact O-N 3.07Å
920	S	40.8	Very low	46.7	Very low	106 Å²	106	126.8 Å²	126.8	74%	0.741	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-1.5	173.6	-54.5	0	0	0	0	114.1	Q916	Q916-S920 PolarHBondContact O-N 3.5Å; Q916-S920 PolarHBondContact O-OG 3.16Å; Q916-S920 VanDerWaalsContact O-OG 3.09Å
921	S	37.4	Very low	45.3	Very low	93 Å²	93	128.3 Å²	128.3	65%	0.65	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	16.2	179.4	-61.5	0	0	0	0	113.7	L917 K918 S919	L917-S921 PolarHBondContact O-OG 3.47Å; K918-S921 WeakPolarHBondContact O-CB 3.45Å; K918-S921 PolarHBondContact O-N 3.44Å; S919-S921 PolarHBondContact O-N 2.88Å; S919-S921 VanDerWaalsContact O-N 3.08Å
922	Q	34.3	Very low	43.5	Very low	171 Å²	171	127.1 Å²	127.1	80%	0.799	69%	0.686	S	S	*	*			trans	-127	80.4	178.8	-67.3	-164.7	6.6	0	0	113.8	S919	S919-Q922 PolarHBondContact O-N 3.07Å
923	Q	36.2	Very low	41.7	Very low	198 Å²	198	128.3 Å²	128.3	93%	0.925	70%	0.696	S	S	*	*			trans	-119.8	155.8	150.4	-72.1	-160.7	0.8	0	0	110.8
924	K	32.9	Very low	40.2	Very low	187 Å²	187	129.5 Å²	129.5	81%	0.813	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-73.7	147.8	-159.2	-67.7	170.6	180	169.9	0	112.7	I926	K924-I926 PolarHBondContact O-N 2.91Å
925	P	28.1	Very low	39.1	Very low	131 Å²	131	131.9 Å²	131.9	85%	0.851	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-65.6	121.2	166.9	28.9	-33.4	0	0	0	109.6
926	I	36.5	Very low	38	Very low	161 Å²	161	131.1 Å²	131.1	83%	0.826	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-100.4	128.3	171.2	-63.1	-178.7	0	0	0	108.2	K924	K924-I926 PolarHBondContact O-N 2.91Å
927	T	32.5	Very low	36.9	Very low	113 Å²	113	131.6 Å²	131.6	69%	0.693	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-76.7	139.8	-173.9	43.1	0	0	0	0	112.3	K929	T927-K929 PolarHBondContact O-N 3.39Å
928	P	37.6	Very low	36.1	Very low	125 Å²	125	133.5 Å²	133.5	81%	0.812	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-67.6	126.7	165.1	29	-32.6	0	0	0	109.2	T930	P928-T930 PolarHBondContact O-N 2.91Å
929	K	37	Very low	35.3	Very low	193 Å²	193	132.5 Å²	132.5	84%	0.839	76%	0.757	S	S	*	*			trans	-79.6	102.7	178.9	-77.5	-175.3	178.5	176.9	0	111.4	T927	T927-K929 PolarHBondContact O-N 3.39Å
930	T	32.9	Very low	34.6	Very low	127 Å²	127	134 Å²	134	78%	0.779	76%	0.763	S	S	*	*			trans	32.6	100.5	135.2	-25.2	0	0	0	0	118.2	P928	P928-T930 PolarHBondContact O-N 2.91Å
931	V	37.3	Very low	34.2	Very low	143 Å²	143	135.9 Å²	135.9	87%	0.867	76%	0.764	S	S	*	*			trans	-122.7	132.1	143.6	-178.2	0	0	0	0	106.2
932	P	34.8	Very low	34	Very low	95 Å²	95	136.2 Å²	136.2	62%	0.617	77%	0.767	S	S	*	*			trans	-92.1	152.2	-156.7	34.6	-37	0	0	0	115.8
933	N	32	Very low	34	Very low	141 Å²	141	134 Å²	134	75%	0.754	77%	0.765	S	S	*	*			trans	43	113.1	145.7	-51.4	-15.7	0	0	0	117.7
934	N	32.9	Very low	33.8	Very low	138 Å²	138	132.4 Å²	132.4	74%	0.738	76%	0.759	S	S	*	*				-172.6	133.5	72.5	-99.5	-59.5	0	0	0	114.7
935	S	36.7	Very low	33.7	Very low	102 Å²	102	127.2 Å²	127.2	71%	0.713	75%	0.746	S	S	*	*				55.8	146.4	116.5	-50.5	0	0	0	0	122.4
936	P	38.1	Very low	33.9	Very low	114 Å²	114	127.1 Å²	127.1	74%	0.74	74%	0.738	S	S	*	*			trans	-141.4	-174.7	-138	43.7	-24.5	0	0	0	117.5
937	C	32.7	Very low	33.7	Very low	107 Å²	107	125.9 Å²	125.9	72%	0.723	73%	0.729	S	S	*	*			trans	79.1	140.3	149.5	-68.9	0	0	0	0	121.6
938	N	32.4	Very low	33.7	Very low	148 Å²	148	127.5 Å²	127.5	79%	0.791	73%	0.728	S	S	*	*				112.8	137.2	123.1	-94	-2.5	0	0	0	122.6
939	V	33.2	Very low	33.4	Very low	109 Å²	109	131 Å²	131	66%	0.661	73%	0.731	S	S	*	*			trans	86.3	90.1	138.8	169.5	0	0	0	0	119.9
940	T	31.2	Very low	33.1	Very low	111 Å²	111	126.7 Å²	126.7	68%	0.681	73%	0.725	S	S	*	*				45.5	164.4	124.4	66.7	0	0	0	0	123.5
941	N	31.9	Very low	33.1	Very low	146 Å²	146	127 Å²	127	78%	0.781	72%	0.722	S	S	*	*			trans	92.5	143.6	161.8	-62.1	-31.5	0	0	0	115.8
942	S	32.6	Very low	32.9	Very low	101 Å²	101	125.1 Å²	125.1	71%	0.706	72%	0.715	S	S	*	*			cis	-167.9	-173.8	-15.7	-176.5	0	0	0	0	108.4
943	V	33.6	Very low	32.7	Very low	124 Å²	124	129.6 Å²	129.6	75%	0.752	73%	0.725	S	S	*	*			trans	70.4	134.9	163.7	177.6	0	0	0	0	114.2
944	M	31.9	Very low	32.5	Very low	164 Å²	164	126.4 Å²	126.4	81%	0.808	71%	0.714	S	S	*	*			cis	-163.1	174.4	-12.2	-109.5	179.5	167.8	0	0	105.4
945	C	31.9	Very low	32.3	Very low	79 Å²	79	122.5 Å²	122.5	53%	0.534	70%	0.698	S	S	.	*			cis	-158.4	152.1	-1.7	-129.6	0	0	0	0	108.2
946	N	32.1	Very low	32	Very low	128 Å²	128	121.9 Å²	121.9	68%	0.684	69%	0.689	S	S	*	*			trans	60.9	150.8	144.4	-61.7	12.6	0	0	0	120.1
947	Q	32.5	Very low	31.6	Very low	135 Å²	135	121.8 Å²	121.8	63%	0.631	69%	0.691	S	S	*	*			cis	-155.5	-174.4	-10.3	-114.4	174.2	-80.5	0	0	110.7
948	E	31.5	Very low	31.3	Very low	147 Å²	147	124.4 Å²	124.4	69%	0.687	70%	0.698	S	S	*	*			trans	-13.8	133.6	175	-65.1	102.9	-116.5	0	0	119.5
949	K	31.2	Very low	31.3	Very low	198 Å²	198	123.3 Å²	123.3	86%	0.861	70%	0.702	S	S	*	*				73.5	118.7	54.7	-80.1	-169	174.5	178.5	0	117.5
950	S	32.2	Very low	31.2	Very low	104 Å²	104	123.5 Å²	123.5	73%	0.727	71%	0.708	S	S	*	*			trans	92.5	150.6	143	83.9	0	0	0	0	123
951	D	31.7	Very low	31.6	Very low	134 Å²	134	122.7 Å²	122.7	72%	0.717	71%	0.705	S	S	*	*			trans	79.7	80	151.9	-51.5	-42.8	0	0	0	124.2
952	S	32.8	Very low	31.5	Very low	102 Å²	102	125.1 Å²	125.1	71%	0.713	70%	0.704	S	S	*	*				68.2	138.1	116.6	85.7	0	0	0	0	123.7
953	K	30.5	Very low	31.5	Very low	189 Å²	189	129.8 Å²	129.8	82%	0.822	71%	0.712	S	S	*	*			trans	74.4	114.1	153.5	-68.9	-179.9	178.5	176.7	0	121.4
954	S	28.8	Very low	31.4	Very low	74 Å²	74	128.6 Å²	128.6	52%	0.517	71%	0.705	S	S	.	*			trans	74.3	139.6	141.1	63.1	0	0	0	0	121.7
955	S	29	Very low	31.3	Very low	57 Å²	57	127.2 Å²	127.2	40%	0.399	70%	0.7	S	S	.	*			trans	80.1	112	161.7	-69.4	0	0	0	0	116.4	N690	N690-S955 PolarHBondContact ND2-OG 2.91Å; N690-S955 PolarHBondContact OD1-OG 3.31Å
956	V	29.6	Very low	31.3	Very low	88 Å²	88	129.3 Å²	129.3	53%	0.533	71%	0.713	S	S	.	*				87.9	144.4	76.5	162.2	0	0	0	0	111.9
957	S	30.2	Very low	31.3	Very low	113 Å²	113	134 Å²	134	79%	0.79	72%	0.721	S	S	*	*			trans	86.2	145.9	172.7	79.6	0	0	0	0	117.9
958	N	27.1	Very low	31.4	Very low	162 Å²	162	136.2 Å²	136.2	87%	0.866	74%	0.736	S	S	*	*			trans	-78.4	150	-171.7	-49.4	-54.8	0	0	0	112.3
959	S	31.6	Very low	31.5	Very low	124 Å²	124	140.1 Å²	140.1	87%	0.867	74%	0.744	S	S	*	*			trans	-156.9	148.9	133.4	38.5	0	0	0	0	112.1
960	S	31.2	Very low	31.7	Very low	113 Å²	113	135.8 Å²	135.8	79%	0.79	74%	0.736	S	S	*	*			trans	-89.2	176.7	163.9	-136.9	0	0	0	0	107.8
961	P	39.7	Very low	32.4	Very low	94 Å²	94	136.6 Å²	136.6	61%	0.61	74%	0.739	S	S	*	*				-157.5	-167.9	55.3	46.5	-24.8	0	0	0	116.8
962	Y	30	Very low	32.6	Very low	197 Å²	197	136 Å²	136	77%	0.773	74%	0.742	S	S	*	*			trans	35.1	143.5	155.3	-55.5	-55.4	0	0	0	120.4
963	F	32.9	Very low	32.5	Very low	200 Å²	200	143 Å²	143	88%	0.877	75%	0.753	S	S	*	*			cis	-135.9	173.9	35.2	-83	-115.3	0	0	0	112.2
964	T	31.8	Very low	32.7	Very low	99 Å²	99	139.2 Å²	139.2	61%	0.607	75%	0.751	S	S	*	*			cis	-161	150.5	-39	-86.9	0	0	0	0	107.1
965	I	29.9	Very low	33.1	Very low	134 Å²	134	140.2 Å²	140.2	69%	0.687	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-96.8	142	-168.3	-59.1	156.3	0	0	0	111.5	R967	I965-R967 HydrophobicContact CG2-CG 3.88Å
966	P	31.8	Very low	33.4	Very low	124 Å²	124	145.2 Å²	145.2	81%	0.805	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-98.1	117.6	144.5	32.1	-27.6	0	0	0	110.6
967	R	31	Very low	34.3	Very low	226 Å²	226	146 Å²	146	85%	0.853	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-86.6	123	173.4	-77.9	177.4	169.3	164.3	-5.9	108.9	I965	I965-R967 HydrophobicContact CG2-CG 3.88Å
968	L	34.8	Very low	34.8	Very low	181 Å²	181	146.5 Å²	146.5	95%	0.948	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-91.7	150.1	156.4	-70.7	176.5	0	0	0	110.6
969	R	34.3	Very low	34.8	Very low	230 Å²	230	146.4 Å²	146.4	87%	0.868	79%	0.792	S	S	*	*			trans	-113.4	141.8	-151.7	-171.6	-176.4	-65	-172.3	0.7	110.6
970	P	35.2	Very low	34.9	Very low	107 Å²	107	148.1 Å²	148.1	70%	0.695	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-70	152.7	177.6	29.7	-36.4	0	0	0	112.3
971	P	46.1	Very low	34.8	Very low	121 Å²	121	147.4 Å²	147.4	79%	0.786	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-68.2	160.1	168.1	29.7	-33.9	0	0	0	112.1
972	P	36.2	Very low	34.4	Very low	120 Å²	120	147.6 Å²	147.6	78%	0.779	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-97.3	169.5	-153	37.3	-37.9	0	0	0	116.5
973	R	30.7	Very low	34.6	Very low	250 Å²	250	144.2 Å²	144.2	94%	0.943	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-96.7	123.8	164.8	-76.5	-178	168.4	-160.8	-2	111.3
974	S	35.1	Very low	34.4	Very low	110 Å²	110	141 Å²	141	77%	0.769	78%	0.775	S	S	*	*			trans	-178.2	145.3	161.3	50	0	0	0	0	110.1
975	A	36.8	Very low	34.4	Very low	95 Å²	95	142.4 Å²	142.4	79%	0.785	78%	0.784	S	S	*	*			cis	-160.5	156.5	-17.6	0	0	0	0	0	110.5
976	N	35.2	Very low	34.4	Very low	161 Å²	161	141.3 Å²	141.3	86%	0.861	79%	0.788	S	S	*	*			trans	-6.5	165.3	162.2	-83	6.3	0	0	0	124
977	P	48	Very low	34.6	Very low	106 Å²	106	138.8 Å²	138.8	69%	0.688	78%	0.784	S	S	*	*			trans	-99.8	-162.9	-151	41.7	-38.2	0	0	0	114.7
978	P	40.4	Very low	34.7	Very low	123 Å²	123	133.9 Å²	133.9	80%	0.799	79%	0.785	S	S	*	*				-135.1	166.5	107.8	40.1	-32.5	0	0	0	116
979	L	28.2	Very low	34.6	Very low	160 Å²	160	130.4 Å²	130.4	84%	0.838	78%	0.776	S	S	*	*			trans	-74.5	151.9	161.4	-66.5	145.1	0	0	0	110.5
980	I	33.9	Very low	34.4	Very low	159 Å²	159	127.1 Å²	127.1	82%	0.815	78%	0.775	S	S	*	*			trans	164.3	104.6	152.1	-89.6	151.6	0	0	0	104.5
981	S	28.4	Very low	34.3	Very low	99 Å²	99	128.5 Å²	128.5	69%	0.692	78%	0.777	S	S	*	*			cis	98	153.1	43.3	79.4	0	0	0	0	113.5
982	S	31.1	Very low	33.7	Very low	97 Å²	97	130 Å²	130	68%	0.678	77%	0.773	S	S	*	*			trans	81.3	134	167.8	81.3	0	0	0	0	119.7
983	N	33.8	Very low	33.5	Very low	126 Å²	126	132.6 Å²	132.6	67%	0.674	78%	0.777	S	S	*	*			trans	76.5	118.3	154.9	-56.6	-35.4	0	0	0	118.4
984	N	28.9	Very low	33.4	Very low	133 Å²	133	124.9 Å²	124.9	71%	0.711	76%	0.762	S	S	*	*				67.6	135.2	58.6	-59.9	-39.6	0	0	0	110
985	T	31.7	Very low	33.2	Very low	129 Å²	129	125.2 Å²	125.2	79%	0.791	76%	0.759	S	S	*	*			cis	-170.8	169.3	27.2	6.3	0	0	0	0	106.3
986	S	30.6	Very low	32.7	Very low	111 Å²	111	132.5 Å²	132.5	78%	0.776	77%	0.767	S	S	*	*			cis	-175	149.5	-18.3	45	0	0	0	0	108.3
987	G	37.3	Very low	32.5	Very low	70 Å²	70	128.2 Å²	128.2	72%	0.722	76%	0.76	S	S	*	*			trans	160.5	83.7	-177.9	0	0	0	0	0	108.9
988	S	31.9	Very low	31.5	Very low	124 Å²	124	133 Å²	133	87%	0.867	77%	0.771	S	S	*	*				52.7	128.2	59.1	-76.2	0	0	0	0	112.7
989	S	33.7	Very low	30.9	Very low	108 Å²	108	132.9 Å²	132.9	76%	0.755	77%	0.767	S	S	*	*			cis	-135.8	148.8	16.6	51.4	0	0	0	0	114.2
990	N	28.9	Very low	30.8	Very low	160 Å²	160	134 Å²	134	86%	0.856	77%	0.768	S	S	*	*			trans	-59.9	150.4	165.7	-58.5	-57.2	0	0	0	111.2
991	N	33.8	Very low	31.1	Very low	137 Å²	137	131 Å²	131	73%	0.733	76%	0.758	S	S	*	*			trans	-155.6	135.5	148.7	-125.7	-29.2	0	0	0	112.6
992	Q	33.3	Very low	31.8	Very low	151 Å²	151	132.2 Å²	132.2	71%	0.706	76%	0.764	S	S	*	*			trans	66.6	129.5	163.6	-64.1	170.8	34.2	0	0	116
993	M	31.8	Very low	31.7	Very low	175 Å²	175	135.8 Å²	135.8	86%	0.862	77%	0.77	S	S	*	*				67.9	141.9	57.6	-67.7	163.3	49	0	0	112.8
994	S	28.7	Very low	31.6	Very low	89 Å²	89	135.5 Å²	135.5	62%	0.622	78%	0.776	S	S	*	*			cis	-171.4	161.1	-14.4	177	0	0	0	0	109.2
995	T	30	Very low	31.6	Very low	116 Å²	116	133.6 Å²	133.6	71%	0.712	77%	0.774	S	S	*	*			trans	47.4	114.2	149.5	43.2	0	0	0	0	121.8
996	R	26.6	Very low	31.9	Very low	249 Å²	249	133 Å²	133	94%	0.94	77%	0.774	S	S	*	*				67	100.1	109.9	-164.8	-170.1	-164.5	177.8	4.1	119.5
997	G	30.8	Very low	32	Very low	71 Å²	71	135.9 Å²	135.9	73%	0.732	78%	0.775	S	S	*	*			trans	166.3	136.9	163.6	0	0	0	0	0	107.5
998	K	27.2	Very low	31.8	Very low	207 Å²	207	139.2 Å²	139.2	90%	0.9	78%	0.776	S	S	*	*			cis	71.2	129.2	16.4	-145.6	-172.1	-174.5	-168.7	0	114.6
999	V	27.3	Very low	32.1	Very low	119 Å²	119	138.5 Å²	138.5	72%	0.721	76%	0.761	S	S	*	*			trans	88.2	95.5	174	-172.6	0	0	0	0	116.1
1000	E	26.7	Very low	32.3	Very low	184 Å²	184	143.8 Å²	143.8	86%	0.86	77%	0.765	S	S	*	*				65.6	174.2	128.2	-87.9	179.8	164.1	0	0	121.6
1001	P	39.5	Very low	32.6	Very low	95 Å²	95	140.4 Å²	140.4	62%	0.617	75%	0.754	S	S	*	*			trans	-115.5	-177.4	-141.9	45.4	-38.8	0	0	0	114.8
1002	P	44.5	Very low	32.6	Very low	125 Å²	125	141.7 Å²	141.7	81%	0.812	76%	0.76	S	S	*	*			trans	-93	121.9	152	33.5	-26.5	0	0	0	111.7
1003	H	29	Very low	32.7	Very low	173 Å²	173	138.7 Å²	138.7	80%	0.801	76%	0.761	S	S	*	*			trans	-71.2	146.7	157.6	-83.8	-103.2	0	0	0	110.3
1004	C	30.8	Very low	32.7	Very low	119 Å²	119	135.6 Å²	135.6	80%	0.804	76%	0.757	S	S	*	*			trans	154.2	154.2	131.1	-87.6	0	0	0	0	111.5
1005	S	28.4	Very low	32.9	Very low	94 Å²	94	137.7 Å²	137.7	66%	0.657	77%	0.766	S	S	*	*			cis	-179.7	164.7	-25.4	-100.4	0	0	0	0	107.6
1006	S	38.8	Very low	33	Very low	115 Å²	115	140 Å²	140	80%	0.804	77%	0.769	S	S	*	*			trans	67	144	163.9	73	0	0	0	0	117.5
1007	E	32	Very low	33.2	Very low	172 Å²	172	134 Å²	134	80%	0.804	75%	0.754	S	S	*	*			cis	-166.4	-169.7	-28.8	-135.2	-180	179.2	0	0	109.5
1008	L	34	Very low	33.3	Very low	141 Å²	141	139.2 Å²	139.2	74%	0.738	76%	0.756	S	S	*	*			trans	79.6	128.6	164.7	-46.2	-175.6	0	0	0	116.9
1009	I	39	Very low	33.4	Very low	108 Å²	108	135.2 Å²	135.2	55%	0.554	75%	0.745	S	S	*	*			cis	-160.1	134.2	-16.4	-136.4	176.3	0	0	0	111
1010	R	36.4	Very low	33.7	Very low	219 Å²	219	135.1 Å²	135.1	83%	0.826	74%	0.74	S	S	*	*			trans	60.2	159	152.6	-70.7	164.3	-158	168.1	7.7	118.1
1011	S	35.2	Very low	34	Very low	89 Å²	89	133.4 Å²	133.4	62%	0.622	74%	0.737	S	S	*	*			cis	-159.8	137.7	1.9	128.2	0	0	0	0	111.7
1012	L	35.3	Very low	33.7	Very low	164 Å²	164	133.1 Å²	133.1	86%	0.859	74%	0.742	S	S	*	*			trans	52.9	147.3	135.7	-51.4	174	0	0	0	120.9
1013	A	34.1	Very low	33.1	Very low	89 Å²	89	131.5 Å²	131.5	74%	0.736	73%	0.734	S	S	*	*			cis	-162.4	153.3	-17.2	0	0	0	0	0	111.9
1014	S	32.5	Very low	33.4	Very low	110 Å²	110	130.4 Å²	130.4	77%	0.769	73%	0.734	S	S	*	*			trans	-59	145.1	169	-34.6	0	0	0	0	114.8
1015	T	33.6	Very low	33.7	Very low	132 Å²	132	129.5 Å²	129.5	81%	0.81	73%	0.729	S	S	*	*				-166	134.2	115.8	27	0	0	0	0	109.1
1016	Q	31.1	Very low	33.8	Very low	166 Å²	166	130.7 Å²	130.7	78%	0.776	73%	0.733	S	S	*	*				70.5	133	52.1	-101.2	-79.5	3.3	0	0	114.8
1017	I	30.1	Very low	33.6	Very low	122 Å²	122	131.1 Å²	131.1	63%	0.626	73%	0.73	S	S	*	*			trans	114.9	120.5	156.2	-64.3	160.4	0	0	0	118.3
1018	K	32.8	Very low	33.6	Very low	181 Å²	181	127.9 Å²	127.9	79%	0.787	72%	0.722	S	S	*	*			trans	72.5	150.4	153.8	-78.3	167.6	-165.6	174.4	0	120.7
1019	N	29.8	Very low	33.7	Very low	123 Å²	123	126.8 Å²	126.8	66%	0.658	72%	0.722	S	S	*	*			cis	-171.1	-178.3	-26.5	-129.6	55.7	0	0	0	111.2
1020	D	34.8	Very low	33.3	Very low	116 Å²	116	127.2 Å²	127.2	62%	0.62	73%	0.729	S	S	*	*			trans	71.4	115.4	151.8	-61.4	-23.1	0	0	0	118.2
1021	N	31.8	Very low	33.2	Very low	148 Å²	148	121.8 Å²	121.8	79%	0.791	73%	0.725	S	S	*	*				80.8	149.1	94.1	-61.8	-29.6	0	0	0	113.2
1022	A	34.7	Very low	33.3	Very low	89 Å²	89	126 Å²	126	74%	0.736	73%	0.732	S	S	*	*			cis	-172	162.1	-9.8	0	0	0	0	0	106.9
1023	S	31.5	Very low	33.2	Very low	92 Å²	92	125.4 Å²	125.4	64%	0.643	73%	0.729	S	S	*	*			cis	-168.5	-162.8	-11.9	55	0	0	0	0	108.3
1024	N	35.4	Very low	33.3	Very low	149 Å²	149	125.6 Å²	125.6	80%	0.797	72%	0.723	S	S	*	*			trans	73.5	145.4	166.4	-58.1	-22.6	0	0	0	117.4
1025	S	35.4	Very low	33.4	Very low	100 Å²	100	126 Å²	126	70%	0.699	72%	0.72	S	S	*	*			cis	-160.7	147.1	-9.8	42.8	0	0	0	0	113.4
1026	T	30.6	Very low	33.1	Very low	120 Å²	120	125.9 Å²	125.9	74%	0.736	72%	0.715	S	S	*	*			trans	-5.1	147.3	151.6	51.7	0	0	0	0	119.3
1027	V	35.7	Very low	33.1	Very low	123 Å²	123	124 Å²	124	75%	0.745	71%	0.709	S	S	*	*				-152.9	123.9	67.3	150.8	0	0	0	0	111
1028	T	32.1	Very low	33.1	Very low	104 Å²	104	124.6 Å²	124.6	64%	0.638	71%	0.713	S	S	*	*				58.1	140.4	93.7	2	0	0	0	0	114.4
1029	T	35.3	Very low	32.9	Very low	118 Å²	118	120.9 Å²	120.9	72%	0.724	71%	0.71	S	S	*	*			cis	-142.5	137.5	21.9	29.4	0	0	0	0	115.4
1030	T	31.8	Very low	33	Very low	117 Å²	117	121.6 Å²	121.6	72%	0.718	71%	0.714	S	S	*	*			trans	3.2	140.7	136.1	61	0	0	0	0	118.8
1031	S	34.4	Very low	32.7	Very low	105 Å²	105	121.9 Å²	121.9	73%	0.734	72%	0.716	S	S	*	*				167.9	163.6	78.8	50.6	0	0	0	0	110.2
1032	K	36.9	Very low	32.6	Very low	179 Å²	179	121.2 Å²	121.2	78%	0.778	71%	0.712	S	S	*	*			cis	-162.7	151.4	-5.5	-119.5	173.3	177.1	176.8	0	111
1033	L	33.2	Very low	32.5	Very low	150 Å²	150	123.8 Å²	123.8	79%	0.785	71%	0.713	S	S	*	*			trans	71	150.3	146.7	-67.7	164.8	0	0	0	120.9
1034	P	36.9	Very low	32.4	Very low	93 Å²	93	124.1 Å²	124.1	60%	0.604	72%	0.716	S	S	*	*			trans	-153	-159.8	-138.1	43.1	-18.6	0	0	0	115.6
1035	T	32.5	Very low	32.5	Very low	118 Å²	118	122.8 Å²	122.8	72%	0.724	72%	0.716	S	S	*	*			trans	64.7	170.5	151.5	61	0	0	0	0	116.8
1036	N	28.7	Very low	32.5	Very low	131 Å²	131	126.9 Å²	126.9	70%	0.701	72%	0.721	S	S	*	*			cis	-157.8	178.3	13	-146	-14.1	0	0	0	113.4
1037	I	30.3	Very low	32.7	Very low	127 Å²	127	126.9 Å²	126.9	65%	0.651	72%	0.723	S	S	*	*			trans	80.3	113	144.1	-79.4	160.6	0	0	0	120.2
1038	N	31	Very low	32.4	Very low	133 Å²	133	128.1 Å²	128.1	71%	0.711	72%	0.72	S	S	*	*			trans	66	100	137.7	-62.4	3.4	0	0	0	122.3
1039	S	27.5	Very low	32.1	Very low	103 Å²	103	130.4 Å²	130.4	72%	0.72	72%	0.721	S	S	*	*				12.5	125.5	101.4	-43	0	0	0	0	118.5
1040	N	31.8	Very low	31.8	Very low	139 Å²	139	132.9 Å²	132.9	74%	0.743	72%	0.722	S	S	*	*				-177.2	132.7	118.6	-98	-26.1	0	0	0	115.3
1041	N	29.5	Very low	31.7	Very low	122 Å²	122	137.9 Å²	137.9	65%	0.652	73%	0.728	S	S	*	*			trans	52.8	114.5	133.2	-64	-17	0	0	0	123.2
1042	N	28.9	Very low	31.4	Very low	133 Å²	133	136.8 Å²	136.8	71%	0.711	72%	0.721	S	S	*	*				88.2	152.1	120.6	-63.4	-14.2	0	0	0	122.3
1043	N	33.7	Very low	31.2	Very low	143 Å²	143	136.8 Å²	136.8	77%	0.765	72%	0.723	S	S	*	*			trans	78.8	87.5	157.7	-59.1	-17.3	0	0	0	120.3
1044	S	29.2	Very low	31	Very low	100 Å²	100	136.9 Å²	136.9	70%	0.699	72%	0.724	S	S	*	*				10.5	162.7	109.9	68.4	0	0	0	0	121
1045	P	37.1	Very low	30.7	Very low	121 Å²	121	140.3 Å²	140.3	79%	0.786	73%	0.733	S	S	*	*			cis	-136.4	-168.4	4.2	30.5	-5.8	0	0	0	115.6
1046	K	35.7	Very low	30.5	Very low	185 Å²	185	141.8 Å²	141.8	80%	0.804	73%	0.734	S	S	*	*			trans	-61	153.9	170.7	-54.7	171.8	-179.2	176.1	0	112.9
1047	P	33.8	Very low	30.6	Very low	121 Å²	121	140.7 Å²	140.7	79%	0.786	74%	0.737	S	S	*	*				-129.2	173	100.8	6.7	15.1	0	0	0	111.3
1048	H	29.5	Very low	30.6	Very low	148 Å²	148	140.4 Å²	140.4	69%	0.685	74%	0.737	S	S	*	*			cis	149.3	130.3	-17.6	-123.3	-70.1	0	0	0	107.5
1049	F	27.2	Very low	30.6	Very low	152 Å²	152	141.6 Å²	141.6	67%	0.667	74%	0.735	S	S	*	*			trans	73.6	132.4	148.9	-89.3	-48.2	0	0	0	124.8
1050	K	28.6	Very low	30.6	Very low	170 Å²	170	144.6 Å²	144.6	74%	0.739	74%	0.743	S	S	*	*			trans	70.2	155.4	145	-72.7	156.5	-174.8	167.2	0	115.4
1051	R	29.2	Very low	30.5	Very low	222 Å²	222	143.1 Å²	143.1	84%	0.838	74%	0.743	S	S	*	*			cis	-154.8	155.9	10.1	-151.4	-178.2	-177.7	157.2	-3.7	110.1
1052	S	29.3	Very low	30.6	Very low	83 Å²	83	144.2 Å²	144.2	58%	0.58	75%	0.749	S	S	*	*			trans	57.1	159.1	159.3	9.3	0	0	0	0	118.8
1053	E	31	Very low	30.7	Very low	178 Å²	178	144 Å²	144	83%	0.832	75%	0.747	S	S	*	*			cis	-143.9	170	-0.7	-137.2	125.8	-118.4	0	0	109.8
1054	N	29.4	Very low	30.5	Very low	152 Å²	152	143.9 Å²	143.9	81%	0.813	75%	0.745	S	S	*	*			trans	-94.5	152.8	171.5	-67.8	-31	0	0	0	110.5
1055	E	30.2	Very low	30.6	Very low	166 Å²	166	146.9 Å²	146.9	78%	0.776	75%	0.747	S	S	*	*				142.2	118.8	126	-72.6	-158.2	149.6	0	0	116.1
1056	I	29.3	Very low	30.5	Very low	149 Å²	149	149.8 Å²	149.8	76%	0.764	75%	0.748	S	S	*	*			trans	68.4	132.2	132.3	-57.8	168.9	0	0	0	120.4
1057	S	30.2	Very low	30	Very low	108 Å²	108	151.7 Å²	151.7	76%	0.755	75%	0.75	S	S	*	*			trans	102.3	94.4	156.3	-160.8	0	0	0	0	120.3
1058	D	31	Very low	29.8	Very low	121 Å²	121	153.2 Å²	153.2	65%	0.647	75%	0.751	S	S	*	*				48.6	113.1	127.7	-110.3	13.7	0	0	0	123.2
1059	K	31	Very low	29.7	Very low	157 Å²	157	149.9 Å²	149.9	68%	0.683	74%	0.744	S	S	*	*			trans	71.5	119.7	135.6	-64.3	178.9	-179.1	75.4	0	122.5
1060	L	27.9	Very low	29.6	Very low	167 Å²	167	153.7 Å²	153.7	87%	0.874	75%	0.754	S	S	*	*			trans	69.1	94.7	140.2	-69	169.8	0	0	0	120.4
1061	S	29.8	Very low	29.8	Very low	108 Å²	108	152 Å²	152	76%	0.755	76%	0.758	S	S	*	*				-168.8	129.7	125.3	52	0	0	0	0	112.4
1062	D	31.5	Very low	29.9	Very low	145 Å²	145	144.3 Å²	144.3	78%	0.775	75%	0.748	S	S	*	*				38.4	142.7	116.3	-73.5	14.5	0	0	0	120.3
1063	I	30.5	Very low	30.2	Very low	128 Å²	128	146 Å²	146	66%	0.656	76%	0.757	S	S	*	*			cis	-169.6	158.5	1.3	-129.6	171.8	0	0	0	112.3
1064	I	29.6	Very low	30.2	Very low	141 Å²	141	143.1 Å²	143.1	72%	0.723	75%	0.752	S	S	*	*			trans	51.8	122	156.8	-63.9	170	0	0	0	120.4
1065	Q	30.9	Very low	30.5	Very low	162 Å²	162	142.6 Å²	142.6	76%	0.757	75%	0.749	S	S	*	*				-173.8	160.5	114.6	-101.2	-148.3	25	0	0	114.6
1066	K	34.8	Very low	30.6	Very low	183 Å²	183	140.9 Å²	140.9	80%	0.796	75%	0.745	S	S	*	*			trans	66.4	102.4	170.8	-65.3	163.7	-172.4	175.1	0	115.6
1067	R	25.9	Very low	30.6	Very low	225 Å²	225	140.2 Å²	140.2	85%	0.849	74%	0.743	S	S	*	*			cis	89.4	138.4	25.1	-158.4	-166.7	-175.4	-179.8	2.4	113.7
1068	L	28.6	Very low	30.7	Very low	153 Å²	153	141.4 Å²	141.4	80%	0.801	75%	0.752	S	S	*	*			trans	74.8	146.8	178.2	-49.9	175.1	0	0	0	114.3
1069	S	27.1	Very low	30.6	Very low	78 Å²	78	140.9 Å²	140.9	55%	0.545	76%	0.764	S	S	.	*			cis	-169.3	165.7	-31.1	40.1	0	0	0	0	106.9
1070	W	27.1	Very low	30.6	Very low	232 Å²	232	137 Å²	137	88%	0.879	77%	0.768	S	S	*	*				176.2	176.6	91.4	-92.5	99.2	0	0	0	111.1
1071	T	30.9	Very low	30.8	Very low	133 Å²	133	137.2 Å²	137.2	82%	0.816	77%	0.77	S	S	*	*			trans	-151	161.6	-159.7	50.4	0	0	0	0	113.9
1072	G	33	Very low	30.7	Very low	62 Å²	62	141.3 Å²	141.3	64%	0.639	78%	0.778	S	S	*	*			trans	111.2	164.2	164.1	0	0	0	0	0	114.7
1073	P	35	Very low	30.8	Very low	118 Å²	118	144.5 Å²	144.5	77%	0.766	79%	0.785	S	S	*	*			cis	-78	150.5	0	-3.8	23.5	0	0	0	111.8
1074	T	31.6	Very low	30.5	Very low	117 Å²	117	149.6 Å²	149.6	72%	0.718	80%	0.796	S	S	*	*				67.2	137.3	57.4	82.4	0	0	0	0	112.6
1075	D	34.3	Very low	30.6	Very low	141 Å²	141	148.4 Å²	148.4	75%	0.754	80%	0.8	S	S	*	*			cis	-127.1	150.3	33.6	-55.5	-35	0	0	0	117.7
1076	D	31.9	Very low	30.4	Very low	131 Å²	131	149.4 Å²	149.4	70%	0.701	80%	0.804	S	S	*	*			trans	65.4	105.2	140	-76.5	25.4	0	0	0	126.3
1077	N	29.2	Very low	30.1	Very low	134 Å²	134	152.4 Å²	152.4	72%	0.717	81%	0.811	S	S	*	*				74.2	89.9	117.5	-66.5	-36.4	0	0	0	122.2
1078	S	32.8	Very low	30.1	Very low	134 Å²	134	148.8 Å²	148.8	94%	0.937	81%	0.808	S	S	*	*				-175	163.4	100.5	44	0	0	0	0	111.7
1079	A	29.7	Very low	30	Very low	110 Å²	110	148.3 Å²	148.3	91%	0.909	80%	0.796	S	S	*	*			trans	-125.9	150.9	-160.4	0	0	0	0	0	115.3
1080	G	30.5	Very low	29.9	Very low	74 Å²	74	151.2 Å²	151.2	76%	0.763	81%	0.805	S	S	*	*			trans	-176	66.5	179.7	0	0	0	0	0	117.9
1081	N	32.7	Very low	30.1	Very low	172 Å²	172	144.4 Å²	144.4	92%	0.92	79%	0.791	S	S	*	*			trans	47.5	103.6	159.4	-73.1	-32.9	0	0	0	120.5
1082	Q	27.8	Very low	29.8	Very low	194 Å²	194	141.8 Å²	141.8	91%	0.907	77%	0.774	S	S	*	*			trans	-100.7	133.7	154	-75.4	-170.7	-8.4	0	0	111.9
1083	K	33.6	Very low	29.6	Very low	213 Å²	213	141 Å²	141	93%	0.926	76%	0.755	S	S	*	*			trans	-101.6	110.8	158.7	-92.4	-174.6	176.1	177.3	0	109.9
1084	R	24.2	Very low	29.2	Very low	235 Å²	235	137.6 Å²	137.6	89%	0.887	73%	0.73	S	S	*	*			trans	-80	120.6	-179.9	-174.3	-178.2	-172.2	177.1	4.3	111
1085	S	31.2	Very low	28.9	Very low	115 Å²	115	134.6 Å²	134.6	80%	0.804	71%	0.714	S	S	*	*			trans	-113.4	138.9	167.7	-73.9	0	0	0	0	111
1086	Q	26.4	Very low	28.6	Very low	184 Å²	184	130.3 Å²	130.3	86%	0.86	69%	0.693	S	S	*	*			trans	-89.8	129.6	173.2	-58.3	173.7	1.4	0	0	108.9
1087	R	28.2	Very low	28.4	Very low	245 Å²	245	124.8 Å²	124.8	93%	0.925	67%	0.665	S	S	*	*			trans	-151.2	144.5	157.4	-122.8	170.6	-174.1	176.4	0.9	115.1
1088	L	26.7	Very low	28.4	Very low	150 Å²	150	122 Å²	122	79%	0.785	66%	0.655	S	S	*	*			trans	-42.1	156.4	-179	-64.7	153.9	0	0	0	117.2	L1090	L1088-L1090 PolarHBondContact O-N 2.97Å
1089	Y	25.1	Very low	28.2	Very low	142 Å²	142	122.1 Å²	122.1	56%	0.557	65%	0.651	S	S	*	*	S	Bend	trans	-23.7	119.5	164.6	-66	-106.9	0	0	0	116.4	R705	R705-Y1089 PolarHBondContact NE-OH 2.93Å; R705-Y1089 VanDerWaalsContact NH2-CZ 3.28Å; R705-Y1089 PolarHBondContact NH2-OH 3.06Å
1090	L	25.8	Very low	28.1	Very low	139 Å²	139	121.6 Å²	121.6	73%	0.728	65%	0.647	S	S	*	*			trans	159.4	114.5	135.2	-90.5	161.7	0	0	0	109.6	L1088 T1092	L1088-L1090 PolarHBondContact O-N 2.97Å; L1090-T1092 PolarHBondContact O-N 3.39Å; L1090-T1092 VanDerWaalsContact O-N 3.13Å
1091	P	30.8	Very low	28.1	Very low	90 Å²	90	125.4 Å²	125.4	58%	0.584	65%	0.649	S	S	*	*			trans	-65.9	111.5	165	-17	31.8	0	0	0	109.1	Q488 I1093	Q488-P1091 HydrophobicContact CB-CB 4.49Å; P1091-I1093 HydrophobicContact CB-CD1 4.08Å; P1091-I1093 HydrophobicContact CB-CG1 4.12Å; P1091-I1093 PolarHBondContact O-N 2.88Å
1092	T	25.9	Very low	27.9	Very low	78 Å²	78	122.7 Å²	122.7	48%	0.479	63%	0.634	S	S	.	*			trans	-82.3	110	173.1	-74.6	0	0	0	0	108.4	L1090 A1190	L1090-T1092 PolarHBondContact O-N 3.39Å; L1090-T1092 VanDerWaalsContact O-N 3.13Å; T1092-A1190 HydrophobicContact CG2-CB 3.46Å; T1092-A1190 VanDerWaalsContact CG2-CB 3.46Å
1093	I	28.1	Very low	27.9	Very low	44 Å²	44	123 Å²	123	23%	0.226	64%	0.636	C	S	.	*			trans	-122.1	56.3	-173.4	-47.9	171.4	0	0	0	111.3	Q488 P1091	Q488-I1093 HydrophobicContact CB-CD1 4.29Å; Q488-I1093 HydrophobicContact CB-CG1 3.94Å; Q488-I1093 WeakPolarHBondContact O-CG2 3.26Å; P1091-I1093 HydrophobicContact CB-CD1 4.08Å; P1091-I1093 HydrophobicContact CB-CG1 4.12Å; P1091-I1093 PolarHBondContact O-N 2.88Å
1094	L	26.5	Very low	27.6	Very low	47 Å²	47	118.3 Å²	118.3	25%	0.246	63%	0.625	C	S	.	*			trans	-146.1	66.9	163.1	-79.8	-175.1	0	0	0	109.7	Y491 F1194	Y491-L1094 HydrophobicContact CD1-CD2 3.87Å; Y491-L1094 HydrophobicContact CE1-CD2 3.54Å; L1094-F1194 HydrophobicContact CD1-CD2 3.61Å; L1094-F1194 HydrophobicContact CD1-CE2 4.21Å
1095	S	25.7	Very low	27.7	Very low	54 Å²	54	115.4 Å²	115.4	38%	0.378	63%	0.627	S	S	.	*			trans	-150.6	88.9	173.3	178.5	0	0	0	0	111
1096	T	27.2	Very low	27.5	Very low	52 Å²	52	113.3 Å²	113.3	32%	0.319	62%	0.624	S	S	.	*				-175.5	112.6	112.8	29.1	0	0	0	0	108.8	V492 R496	V492-T1096 WeakPolarHBondContact CG1-OG1 3.29Å; R496-T1096 PolarHBondContact NH2-OG1 2.97Å
1097	S	28.2	Very low	27.6	Very low	15 Å²	15	112.6 Å²	112.6	11%	0.105	63%	0.626	C	S	.	*			trans	-128.4	88.1	-179.4	-45.1	0	0	0	0	111.1	E495 D1184 R1197	E495-S1097 PolarHBondContact OE2-OG 3.48Å; S1097-D1184 PolarHBondContact N-OD2 3.17Å; S1097-R1197 PolarHBondContact OG-NH1 3.19Å; S1097-R1197 PolarHBondContact OG-NH2 3.29Å; S1097-R1197 VanDerWaalsContact OG-NH2 3.09Å
1098	S	29.7	Very low	27.8	Very low	74 Å²	74	108.6 Å²	108.6	52%	0.517	62%	0.623	S	S	.	*			trans	92.2	77.7	162.4	-161	0	0	0	0	119.8
1099	T	28.1	Very low	28.2	Very low	138 Å²	138	110.6 Å²	110.6	85%	0.847	63%	0.628	S	S	*	*			trans	-140.9	101.4	136.3	50.9	0	0	0	0	110.3
1100	A	27.8	Very low	29.1	Very low	99 Å²	99	109.2 Å²	109.2	82%	0.818	64%	0.637	S	S	*	*			trans	-143.7	101	158.1	0	0	0	0	0	105.3
1101	L	30.8	Very low	30.6	Very low	154 Å²	154	108.1 Å²	108.1	81%	0.806	64%	0.637	S	S	*	*			trans	-94.6	146.9	167.9	-74.4	168.8	0	0	0	107.3	E1103	L1101-E1103 PolarHBondContact O-N 3.2Å
1102	D	28.3	Very low	31.9	Very low	114 Å²	114	106.4 Å²	106.4	61%	0.61	63%	0.625	S	S	*	*			trans	-62.5	132.7	179.3	-58.9	-76.2	0	0	0	111.8	T1104	D1102-T1104 PolarHBondContact O-N 2.96Å
1103	E	27.1	Very low	34.1	Very low	202 Å²	202	104.3 Å²	104.3	94%	0.944	61%	0.613	S	S	*	*			trans	-77	71.2	171.2	-70.2	-166.8	142.6	0	0	110.7	L1101	L1101-E1103 PolarHBondContact O-N 3.2Å
1104	T	28.6	Very low	36.6	Very low	114 Å²	114	105.6 Å²	105.6	70%	0.699	62%	0.623	S	S	*	*	S	Bend	trans	-129.2	91.3	170	58.8	0	0	0	0	111.6	D1102	D1102-T1104 PolarHBondContact O-N 2.96Å
1105	N	26.2	Very low	39.3	Very low	173 Å²	173	104.9 Å²	104.9	93%	0.925	62%	0.618	S	S	*	*	S	Bend	trans	42.8	89.2	158.8	-66.1	-18.4	0	0	0	118.2
1106	G	26.6	Very low	42	Very low	72 Å²	72	110.2 Å²	110.2	74%	0.742	63%	0.631	S	S	*	*			trans	-179.2	122.5	162.5	0	0	0	0	0	115	N1108	G1106-N1108 PolarHBondContact O-N 3.41Å
1107	N	27.9	Very low	44.7	Very low	169 Å²	169	113 Å²	113	90%	0.904	64%	0.64	S	S	*	*			trans	-68.4	99.2	175.2	-76.2	-21.8	0	0	0	111.5
1108	N	32.3	Very low	47.5	Very low	161 Å²	161	112.4 Å²	112.4	86%	0.861	64%	0.636	S	S	*	*			trans	-160.5	104.1	161.5	-95.9	-44.8	0	0	0	111.5	G1106 C1110	G1106-N1108 PolarHBondContact O-N 3.41Å; N1108-C1110 PolarHBondContact O-N 3.1Å; N1108-C1110 VanDerWaalsContact O-N 3.17Å
1109	H	35	Very low	50.3	Low	191 Å²	191	111.5 Å²	111.5	88%	0.884	62%	0.623	S	S	*	*			trans	-70	108.6	169.6	-96.1	-67.4	0	0	0	110.2	V1111	H1109-V1111 PolarHBondContact O-N 3.09Å; H1109-V1111 VanDerWaalsContact O-N 3.1Å
1110	C	44.7	Very low	53.1	Low	113 Å²	113	110.3 Å²	110.3	76%	0.764	61%	0.605	S	S	*	*			trans	-72.5	102.5	173.3	-165	0	0	0	0	110.1	N1108	N1108-C1110 PolarHBondContact O-N 3.1Å; N1108-C1110 VanDerWaalsContact O-N 3.17Å
1111	V	58.3	Low	56	Low	117 Å²	117	108.4 Å²	108.4	71%	0.709	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-69.4	130.2	179.1	-178.9	0	0	0	0	109.7	H1109	H1109-V1111 PolarHBondContact O-N 3.09Å; H1109-V1111 VanDerWaalsContact O-N 3.1Å
1112	P	57.7	Low	58.8	Low	54 Å²	54	101.2 Å²	101.2	35%	0.351	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-63.4	146.5	-179.5	25.8	-34.9	0	0	0	112.2	T1114 Q1185	P1112-T1114 PolarHBondContact O-N 3.33Å; P1112-Q1185 VanDerWaalsContact CG-OE1 3.31Å
1113	P	71.5	Confident	61.7	Low	34 Å²	34	97.7 Å²	97.7	22%	0.221	53%	0.526	C	S	.	.	P	Polyproline II helix	trans	-68.9	123.4	-173.2	27.7	-34.6	0	0	0	111.5	L1118 S1178 Y1182	P1113-L1118 HydrophobicContact CB-CD2 3.84Å; P1113-L1118 HydrophobicContact CB-CG 4.24Å; P1113-L1118 HydrophobicContact CG-CD2 4.04Å; P1113-S1178 VanDerWaalsContact CG-O 3.28Å; P1113-S1178 WeakPolarHBondContact CG-O 3.26Å; P1113-Y1182 WeakPolarHBondContact O-CD2 3.09Å
1114	T	81	Confident	64.7	Low	71 Å²	71	92 Å²	92	44%	0.436	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-69.5	155.5	177.1	62.6	0	0	0	0	112	P1112 Y1116 H1117 L1118	P1112-T1114 PolarHBondContact O-N 3.33Å; T1114-Y1116 PolarHBondContact O-N 3.3Å; T1114-Y1116 VanDerWaalsContact O-N 3.09Å; T1114-H1117 WeakPolarHBondContact O-CA 3.31Å; T1114-H1117 WeakPolarHBondContact O-CB 3.37Å; T1114-H1117 PolarHBondContact O-N 3.48Å; T1114-H1117 PolarHBondContact OG1-N 2.95Å; T1114-H1117 PolarHBondContact OG1-ND1 2.93Å; T1114-H1117 VanDerWaalsContact OG1-ND1 3.11Å; T1114-L1118 PolarHBondContact O-N 3.28Å
1115	K	83.5	Confident	67.6	Low	31 Å²	31	86.7 Å²	86.7	14%	0.135	47%	0.47	C	S	.	.	H	α-helix	trans	-46	-41.8	172.8	-176.2	-179.8	178.1	161.1	0	112.6	L1118 K1119 Y1182 L1251 D1252 L1254 D1256	K1115-L1118 PolarHBondContact O-N 3.39Å; K1115-K1119 HydrophobicContact CG-CD 4.49Å; K1115-K1119 WeakPolarHBondContact O-CB 3.28Å; K1115-K1119 WeakPolarHBondContact O-CG 3.25Å; K1115-K1119 PolarHBondContact O-N 3.4Å; K1115-Y1182 HydrophobicContact CB-CE2 4.07Å; K1115-L1251 WeakPolarHBondContact CE-O 3.4Å; K1115-L1251 PolarHBondContact NZ-O 2.73Å; K1115-L1251 VanDerWaalsContact NZ-O 3.1Å; K1115-D1252 PolarHBondContact NZ-O 2.93Å; K1115-D1252 VanDerWaalsContact NZ-O 3.08Å; K1115-L1254 PolarHBondContact NZ-O 3.49Å; K1115-D1256 WeakPolarHBondContact CB-OD1 3.11Å; K1115-D1256 WeakPolarHBondContact CD-OD2 3.27Å; K1115-D1256 IonicContact NZ-OD2 2.93Å
1116	Y	82.4	Confident	70.6	Confident	167 Å²	167	79.5 Å²	79.5	66%	0.655	43%	0.431	S	S	*	.	H	α-helix	trans	-61	-46.1	175.7	178.1	-107.5	0	0	0	113	T1114 K1120	T1114-Y1116 PolarHBondContact O-N 3.3Å; T1114-Y1116 VanDerWaalsContact O-N 3.09Å; Y1116-K1120 VanDerWaalsContact O-CB 3.27Å; Y1116-K1120 WeakPolarHBondContact O-CB 3.27Å; Y1116-K1120 PolarHBondContact O-N 3.47Å
1117	H	83.6	Confident	73.6	Confident	110 Å²	110	82.2 Å²	82.2	51%	0.509	42%	0.422	S	S	.	.	H	α-helix	trans	-62.5	-43.9	175.6	-84	96.8	0	0	0	112.1	T1114 K1120 H1121	T1114-H1117 WeakPolarHBondContact O-CA 3.31Å; T1114-H1117 WeakPolarHBondContact O-CB 3.37Å; T1114-H1117 PolarHBondContact O-N 3.48Å; T1114-H1117 PolarHBondContact OG1-N 2.95Å; T1114-H1117 PolarHBondContact OG1-ND1 2.93Å; T1114-H1117 VanDerWaalsContact OG1-ND1 3.11Å; H1117-K1120 PolarHBondContact O-N 3.27Å; H1117-H1121 WeakPolarHBondContact O-CB 3.34Å; H1117-H1121 PolarHBondContact O-N 2.97Å
1118	L	86.4	Confident	76.4	Confident	3 Å²	3	77 Å²	77	2%	0.016	39%	0.393	C	S	.	.	H	α-helix	trans	-63.7	-48.6	178.1	-62.9	-176.2	0	0	0	112	P1113 T1114 K1115 K1120 H1121 L1122 C1179 Y1182 L1251	P1113-L1118 HydrophobicContact CB-CD2 3.84Å; P1113-L1118 HydrophobicContact CB-CG 4.24Å; P1113-L1118 HydrophobicContact CG-CD2 4.04Å; T1114-L1118 PolarHBondContact O-N 3.28Å; K1115-L1118 PolarHBondContact O-N 3.39Å; L1118-K1120 VanDerWaalsContact C-N 3.3Å; L1118-K1120 PolarHBondContact O-N 3.45Å; L1118-H1121 PolarHBondContact O-N 2.81Å; L1118-L1122 WeakPolarHBondContact O-CB 3.49Å; L1118-L1122 WeakPolarHBondContact O-CG 3.34Å; L1118-L1122 PolarHBondContact O-N 3.29Å; L1118-C1179 HydrophobicContact CD1-CB 4.48Å; L1118-Y1182 VanDerWaalsContact CD1-CB 3.45Å; L1118-Y1182 HydrophobicContact CD1-CD1 3.86Å; L1118-Y1182 HydrophobicContact CD1-CD2 4.37Å; L1118-Y1182 HydrophobicContact CD1-CG 3.65Å; L1118-L1251 HydrophobicContact CB-CD1 3.85Å; L1118-L1251 HydrophobicContact CD1-CD2 4.18Å
1119	K	88.4	Confident	78.9	Confident	55 Å²	55	69.4 Å²	69.4	24%	0.239	35%	0.352	C	S	.	.	H	α-helix	trans	-59.6	-40	175.5	-71.7	-167	79.1	-173.6	0	111.9	K1115 S1123 L1251 D1252	K1115-K1119 HydrophobicContact CG-CD 4.49Å; K1115-K1119 WeakPolarHBondContact O-CB 3.28Å; K1115-K1119 WeakPolarHBondContact O-CG 3.25Å; K1115-K1119 PolarHBondContact O-N 3.4Å; K1119-S1123 WeakPolarHBondContact O-CB 3.47Å; K1119-S1123 PolarHBondContact O-N 2.91Å; K1119-S1123 PolarHBondContact O-OG 3.5Å; K1119-L1251 HydrophobicContact CG-CB 4.28Å; K1119-L1251 HydrophobicContact CG-CD1 3.87Å; K1119-D1252 WeakPolarHBondContact CE-OD1 3.16Å; K1119-D1252 WeakPolarHBondContact CE-OD2 3.36Å; K1119-D1252 IonicContact NZ-OD1 3.51Å; K1119-D1252 PolarHBondContact NZ-OD1 2.99Å; K1119-D1252 IonicContact NZ-OD2 2.84Å; K1119-D1252 PolarHBondContact NZ-OD2 3.22Å
1120	K	87.9	Confident	81.4	Confident	112 Å²	112	62.6 Å²	62.6	49%	0.487	32%	0.321	S	S	.	.	H	α-helix	trans	-63.7	-44.1	176.1	-175.2	179.8	177.2	-174.3	0	111.7	Y1116 H1117 L1118 S1123 N1124	Y1116-K1120 VanDerWaalsContact O-CB 3.27Å; Y1116-K1120 WeakPolarHBondContact O-CB 3.27Å; Y1116-K1120 PolarHBondContact O-N 3.47Å; H1117-K1120 PolarHBondContact O-N 3.27Å; L1118-K1120 VanDerWaalsContact C-N 3.3Å; L1118-K1120 PolarHBondContact O-N 3.45Å; K1120-S1123 PolarHBondContact O-N 3.35Å; K1120-N1124 PolarHBondContact O-N 2.82Å
1121	H	88.2	Confident	83.3	Confident	60 Å²	60	61.4 Å²	61.4	28%	0.278	30%	0.3	S	S	.	.	H	α-helix	trans	-66.2	-51.5	179.5	-166.3	-175.7	0	0	0	111.5	H1117 L1118 S1123 N1124 I1125 C1175	H1117-H1121 WeakPolarHBondContact O-CB 3.34Å; H1117-H1121 PolarHBondContact O-N 2.97Å; L1118-H1121 PolarHBondContact O-N 2.81Å; H1121-S1123 VanDerWaalsContact C-N 3.29Å; H1121-S1123 PolarHBondContact O-N 3.43Å; H1121-N1124 PolarHBondContact O-N 3.31Å; H1121-I1125 WeakPolarHBondContact O-CG1 3.16Å; H1121-I1125 PolarHBondContact O-N 3.05Å; H1121-I1125 VanDerWaalsContact O-N 3.07Å; H1121-C1175 PolarHBondContact ND1-SG 3.08Å
1122	L	88.9	Confident	84.3	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.016	27%	0.268	C	S	.	.	H	α-helix	trans	-58.2	-39.1	175.8	-69.9	166.1	0	0	0	112.4	L1118 N1124 I1125 L1126 C1175 I1244 I1247 I1248 L1251	L1118-L1122 WeakPolarHBondContact O-CB 3.49Å; L1118-L1122 WeakPolarHBondContact O-CG 3.34Å; L1118-L1122 PolarHBondContact O-N 3.29Å; L1122-N1124 VanDerWaalsContact C-N 3.28Å; L1122-N1124 PolarHBondContact O-N 3.1Å; L1122-I1125 PolarHBondContact O-N 3.06Å; L1122-L1126 WeakPolarHBondContact O-CB 3.44Å; L1122-L1126 PolarHBondContact O-N 2.78Å; L1122-C1175 VanDerWaalsContact CD2-SG 3.58Å; L1122-I1244 HydrophobicContact CB-CG2 4.24Å; L1122-I1244 HydrophobicContact CD2-CG2 4.32Å; L1122-I1247 HydrophobicContact CD1-CG2 3.67Å; L1122-I1247 HydrophobicContact CD2-CG2 4.41Å; L1122-I1248 HydrophobicContact CB-CD1 3.92Å; L1122-I1248 HydrophobicContact CB-CG1 3.76Å; L1122-I1248 HydrophobicContact CD1-CG1 4.01Å; L1122-L1251 HydrophobicContact CD1-CD1 3.58Å
1123	S	90.4	Very high	85.3	Confident	40 Å²	40	54.4 Å²	54.4	28%	0.28	26%	0.256	S	S	.	.	H	α-helix	trans	-67.2	-26.3	176.9	-61.1	0	0	0	0	113.4	K1119 K1120 H1121 K1127	K1119-S1123 WeakPolarHBondContact O-CB 3.47Å; K1119-S1123 PolarHBondContact O-N 2.91Å; K1119-S1123 PolarHBondContact O-OG 3.5Å; K1120-S1123 PolarHBondContact O-N 3.35Å; H1121-S1123 VanDerWaalsContact C-N 3.29Å; H1121-S1123 PolarHBondContact O-N 3.43Å; S1123-K1127 WeakPolarHBondContact O-CD 3.3Å; S1123-K1127 VanDerWaalsContact O-CG 3.24Å; S1123-K1127 WeakPolarHBondContact O-CG 3.31Å; S1123-K1127 PolarHBondContact O-N 2.9Å
1124	N	89.9	Confident	85.5	Confident	83 Å²	83	58.8 Å²	58.8	44%	0.444	27%	0.268	S	S	.	.	H	α-helix	trans	-78.3	-46.1	174.4	-73.7	-7.5	0	0	0	110.9	K1120 H1121 L1122 L1126 K1127 E1128	K1120-N1124 PolarHBondContact O-N 2.82Å; H1121-N1124 PolarHBondContact O-N 3.31Å; L1122-N1124 VanDerWaalsContact C-N 3.28Å; L1122-N1124 PolarHBondContact O-N 3.1Å; N1124-L1126 VanDerWaalsContact C-N 3.26Å; N1124-L1126 PolarHBondContact O-N 3.47Å; N1124-K1127 PolarHBondContact O-N 3.23Å; N1124-E1128 PolarHBondContact O-N 2.97Å; N1124-E1128 VanDerWaalsContact O-N 3.12Å
1125	I	88.9	Confident	85.1	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-56.3	-42.3	174	-64	169.6	0	0	0	110.4	H1121 L1122 E1128 L1129 L1168 Q1171 M1172 C1175 I1244	H1121-I1125 WeakPolarHBondContact O-CG1 3.16Å; H1121-I1125 PolarHBondContact O-N 3.05Å; H1121-I1125 VanDerWaalsContact O-N 3.07Å; L1122-I1125 PolarHBondContact O-N 3.06Å; I1125-E1128 PolarHBondContact O-N 3.27Å; I1125-L1129 WeakPolarHBondContact O-CB 3.39Å; I1125-L1129 PolarHBondContact O-N 3.42Å; I1125-L1168 HydrophobicContact CB-CD1 4.41Å; I1125-L1168 HydrophobicContact CG2-CD1 3.82Å; I1125-Q1171 HydrophobicContact CD1-CB 4.49Å; I1125-Q1171 HydrophobicContact CG1-CB 4.5Å; I1125-M1172 HydrophobicContact CG2-CE 4.17Å; I1125-M1172 HydrophobicContact CG2-CG 3.72Å; I1125-C1175 HydrophobicContact CD1-CB 3.62Å; I1125-I1244 HydrophobicContact CG2-CD1 3.67Å
1126	L	90.2	Very high	84.1	Confident	21 Å²	21	60.9 Å²	60.9	11%	0.11	28%	0.276	C	S	.	.	H	α-helix	trans	-63.1	-45.9	177.9	-173.6	60.5	0	0	0	112.9	L1122 N1124 E1128 L1129 E1130 E1241 I1244 K1245 I1248	L1122-L1126 WeakPolarHBondContact O-CB 3.44Å; L1122-L1126 PolarHBondContact O-N 2.78Å; N1124-L1126 VanDerWaalsContact C-N 3.26Å; N1124-L1126 PolarHBondContact O-N 3.47Å; L1126-E1128 PolarHBondContact O-N 3.13Å; L1126-L1129 PolarHBondContact O-N 2.86Å; L1126-E1130 WeakPolarHBondContact O-CB 3.44Å; L1126-E1130 WeakPolarHBondContact O-CG 3.28Å; L1126-E1130 PolarHBondContact O-N 3.15Å; L1126-E1241 HydrophobicContact CD1-CG 3.84Å; L1126-I1244 HydrophobicContact CB-CG2 3.95Å; L1126-I1244 HydrophobicContact CD1-CB 4.31Å; L1126-I1244 HydrophobicContact CD1-CG2 4.22Å; L1126-I1244 HydrophobicContact CD2-CG2 4.48Å; L1126-I1244 HydrophobicContact CG-CG2 4.45Å; L1126-K1245 HydrophobicContact CD1-CG 4.2Å; L1126-K1245 HydrophobicContact CD2-CG 3.77Å; L1126-I1248 HydrophobicContact CD2-CD1 4.33Å
1127	K	89.6	Confident	83	Confident	129 Å²	129	58 Å²	58	56%	0.561	27%	0.272	S	S	*	.	H	α-helix	trans	-59.1	-38.4	177.3	-73.6	164.5	-172.5	170.2	0	112	S1123 N1124 R1131	S1123-K1127 WeakPolarHBondContact O-CD 3.3Å; S1123-K1127 VanDerWaalsContact O-CG 3.24Å; S1123-K1127 WeakPolarHBondContact O-CG 3.31Å; S1123-K1127 PolarHBondContact O-N 2.9Å; N1124-K1127 PolarHBondContact O-N 3.23Å; K1127-R1131 PolarHBondContact O-N 2.84Å
1128	E	86.3	Confident	81.4	Confident	61 Å²	61	60.7 Å²	60.7	29%	0.285	28%	0.282	S	S	.	.	H	α-helix	trans	-75.9	-40.7	-178.4	-173.5	57	-164.4	0	0	111.9	N1124 I1125 L1126 E1130 R1131 L1132 L1168	N1124-E1128 PolarHBondContact O-N 2.97Å; N1124-E1128 VanDerWaalsContact O-N 3.12Å; I1125-E1128 PolarHBondContact O-N 3.27Å; L1126-E1128 PolarHBondContact O-N 3.13Å; E1128-E1130 PolarHBondContact O-N 3.09Å; E1128-R1131 WeakPolarHBondContact O-CA 3.45Å; E1128-R1131 VanDerWaalsContact O-CB 3.28Å; E1128-R1131 WeakPolarHBondContact O-CB 3.33Å; E1128-R1131 PolarHBondContact O-N 3.41Å; E1128-R1131 IonicContact OE1-CZ 2.77Å; E1128-R1131 IonicContact OE1-NE 2.61Å; E1128-R1131 PolarHBondContact OE1-NE 2.66Å; E1128-R1131 IonicContact OE1-NH2 3.73Å; E1128-R1131 PolarHBondContact OE1-NH2 3.22Å; E1128-R1131 WeakPolarHBondContact OE2-CD 3.3Å; E1128-R1131 IonicContact OE2-CZ 3.51Å; E1128-R1131 IonicContact OE2-NE 2.69Å; E1128-R1131 PolarHBondContact OE2-NE 2.85Å; E1128-L1132 PolarHBondContact O-N 2.76Å; E1128-L1168 HydrophobicContact CB-CD1 4.06Å; E1128-L1168 HydrophobicContact CG-CD1 3.97Å
1129	L	85	Confident	79.2	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-57.5	-48.1	169.8	-174.6	63.2	0	0	0	111.2	I1125 L1126 R1131 L1132 I1133 L1168 M1172 L1237 A1240 E1241 I1244	I1125-L1129 WeakPolarHBondContact O-CB 3.39Å; I1125-L1129 PolarHBondContact O-N 3.42Å; L1126-L1129 PolarHBondContact O-N 2.86Å; L1129-R1131 VanDerWaalsContact C-N 3.28Å; L1129-R1131 PolarHBondContact O-N 2.7Å; L1129-L1132 PolarHBondContact O-N 3.28Å; L1129-I1133 HydrophobicContact CG-CD1 4.12Å; L1129-I1133 WeakPolarHBondContact O-CG1 3.27Å; L1129-I1133 PolarHBondContact O-N 3.47Å; L1129-L1168 HydrophobicContact CB-CD2 4Å; L1129-L1168 HydrophobicContact CD1-CD2 3.94Å; L1129-M1172 HydrophobicContact CD1-CE 4.39Å; L1129-M1172 HydrophobicContact CD2-CE 4.1Å; L1129-L1237 HydrophobicContact CD1-CD2 3.68Å; L1129-A1240 HydrophobicContact CD2-CB 4.05Å; L1129-E1241 HydrophobicContact CD2-CB 3.91Å; L1129-I1244 HydrophobicContact CD2-CD1 4.13Å
1130	E	86.1	Confident	76.5	Confident	49 Å²	49	74.2 Å²	74.2	23%	0.229	35%	0.346	C	S	.	.	H	α-helix	trans	-62.5	-32.4	174	-70.4	-177.3	-178.1	0	0	112.6	L1126 E1128 R1134 K1245	L1126-E1130 WeakPolarHBondContact O-CB 3.44Å; L1126-E1130 WeakPolarHBondContact O-CG 3.28Å; L1126-E1130 PolarHBondContact O-N 3.15Å; E1128-E1130 PolarHBondContact O-N 3.09Å; E1130-R1134 VanDerWaalsContact CB-CZ 3.46Å; E1130-R1134 VanDerWaalsContact O-CB 3.29Å; E1130-R1134 WeakPolarHBondContact O-CB 3.41Å; E1130-R1134 WeakPolarHBondContact O-CG 3.42Å; E1130-R1134 PolarHBondContact O-N 2.93Å; E1130-R1134 PolarHBondContact O-NE 2.9Å; E1130-R1134 VanDerWaalsContact O-NE 3.07Å; E1130-R1134 IonicContact OE2-CZ 3.85Å; E1130-R1134 IonicContact OE2-NH1 3.38Å; E1130-R1134 PolarHBondContact OE2-NH1 2.94Å; E1130-R1134 IonicContact OE2-NH2 3.07Å; E1130-R1134 PolarHBondContact OE2-NH2 2.99Å; E1130-K1245 IonicContact OE1-NZ 2.87Å
1131	R	85.7	Confident	73.8	Confident	87 Å²	87	75.2 Å²	75.2	33%	0.328	36%	0.364	S	S	.	.	H	α-helix	trans	-62.4	-47.1	174.6	-170.6	-173.7	72	82.4	0.3	110.4	K1127 E1128 L1129 R1134 M1135	K1127-R1131 PolarHBondContact O-N 2.84Å; E1128-R1131 WeakPolarHBondContact O-CA 3.45Å; E1128-R1131 VanDerWaalsContact O-CB 3.28Å; E1128-R1131 WeakPolarHBondContact O-CB 3.33Å; E1128-R1131 PolarHBondContact O-N 3.41Å; E1128-R1131 IonicContact OE1-CZ 2.77Å; E1128-R1131 IonicContact OE1-NE 2.61Å; E1128-R1131 PolarHBondContact OE1-NE 2.66Å; E1128-R1131 IonicContact OE1-NH2 3.73Å; E1128-R1131 PolarHBondContact OE1-NH2 3.22Å; E1128-R1131 WeakPolarHBondContact OE2-CD 3.3Å; E1128-R1131 IonicContact OE2-CZ 3.51Å; E1128-R1131 IonicContact OE2-NE 2.69Å; E1128-R1131 PolarHBondContact OE2-NE 2.85Å; L1129-R1131 VanDerWaalsContact C-N 3.28Å; L1129-R1131 PolarHBondContact O-N 2.7Å; R1131-R1134 PolarHBondContact O-N 3.37Å; R1131-M1135 PolarHBondContact NH1-SD 3.37Å; R1131-M1135 WeakPolarHBondContact O-CG 3.29Å; R1131-M1135 PolarHBondContact O-N 2.87Å; R1131-M1135 VanDerWaalsContact O-N 3.1Å
1132	L	78.6	Confident	71	Confident	6 Å²	6	75.2 Å²	75.2	3%	0.031	38%	0.38	C	S	.	.	H	α-helix	trans	-67.8	-39.8	179.2	-64.3	176.3	0	0	0	112.3	E1128 L1129 M1135 N1136 Q1164 L1165 L1168	E1128-L1132 PolarHBondContact O-N 2.76Å; L1129-L1132 PolarHBondContact O-N 3.28Å; L1132-M1135 PolarHBondContact O-N 3.45Å; L1132-N1136 PolarHBondContact O-N 3.38Å; L1132-Q1164 HydrophobicContact CD2-CB 4.21Å; L1132-L1165 HydrophobicContact CD1-CD2 3.69Å; L1132-L1165 HydrophobicContact CD1-CG 4.09Å; L1132-L1168 HydrophobicContact CD1-CD2 3.82Å
1133	I	78.6	Confident	68.3	Low	19 Å²	19	83 Å²	83	10%	0.097	42%	0.422	C	S	.	.	H	α-helix	trans	-59	-50.5	172.2	-67.7	167.3	0	0	0	110.3	L1129 M1135 N1136 D1137 L1237 E1241	L1129-I1133 HydrophobicContact CG-CD1 4.12Å; L1129-I1133 WeakPolarHBondContact O-CG1 3.27Å; L1129-I1133 PolarHBondContact O-N 3.47Å; I1133-M1135 PolarHBondContact O-N 3.06Å; I1133-M1135 VanDerWaalsContact O-N 3.12Å; I1133-N1136 PolarHBondContact O-N 3.16Å; I1133-N1136 VanDerWaalsContact O-N 3.11Å; I1133-D1137 PolarHBondContact O-N 2.82Å; I1133-D1137 VanDerWaalsContact O-N 3.17Å; I1133-L1237 HydrophobicContact CD1-CB 4.07Å; I1133-L1237 HydrophobicContact CG1-CB 3.93Å; I1133-L1237 HydrophobicContact CG1-CD1 4.27Å; I1133-E1241 HydrophobicContact CD1-CB 4.44Å; I1133-E1241 WeakPolarHBondContact CD1-OE2 3.48Å
1134	R	77	Confident	65.6	Low	126 Å²	126	88.7 Å²	88.7	48%	0.475	45%	0.448	S	S	.	.	H	α-helix	trans	-62.9	-16.6	177.5	-73.5	179.5	-70.4	-120.6	0.5	114.4	E1130 R1131 K1138	E1130-R1134 VanDerWaalsContact CB-CZ 3.46Å; E1130-R1134 VanDerWaalsContact O-CB 3.29Å; E1130-R1134 WeakPolarHBondContact O-CB 3.41Å; E1130-R1134 WeakPolarHBondContact O-CG 3.42Å; E1130-R1134 PolarHBondContact O-N 2.93Å; E1130-R1134 PolarHBondContact O-NE 2.9Å; E1130-R1134 VanDerWaalsContact O-NE 3.07Å; E1130-R1134 IonicContact OE2-CZ 3.85Å; E1130-R1134 IonicContact OE2-NH1 3.38Å; E1130-R1134 PolarHBondContact OE2-NH1 2.94Å; E1130-R1134 IonicContact OE2-NH2 3.07Å; E1130-R1134 PolarHBondContact OE2-NH2 2.99Å; R1131-R1134 PolarHBondContact O-N 3.37Å; R1134-K1138 WeakPolarHBondContact O-CD 3.46Å; R1134-K1138 WeakPolarHBondContact O-CG 3.44Å
1135	M	70.8	Confident	62.8	Low	85 Å²	85	90.6 Å²	90.6	42%	0.419	46%	0.463	S	S	.	.	H	α-helix	trans	-87.9	-36.5	172.7	-76.8	177.4	60.5	0	0	112.8	R1131 L1132 I1133 K1138	R1131-M1135 PolarHBondContact NH1-SD 3.37Å; R1131-M1135 WeakPolarHBondContact O-CG 3.29Å; R1131-M1135 PolarHBondContact O-N 2.87Å; R1131-M1135 VanDerWaalsContact O-N 3.1Å; L1132-M1135 PolarHBondContact O-N 3.45Å; I1133-M1135 PolarHBondContact O-N 3.06Å; I1133-M1135 VanDerWaalsContact O-N 3.12Å; M1135-K1138 PolarHBondContact O-N 3.04Å
1136	N	63.6	Low	60.3	Low	60 Å²	60	95.5 Å²	95.5	32%	0.321	50%	0.497	S	S	.	.	H	α-helix	trans	-69.3	-35.8	176.8	-83.7	-16.5	0	0	0	112.7	L1132 I1133 K1138	L1132-N1136 PolarHBondContact O-N 3.38Å; I1133-N1136 PolarHBondContact O-N 3.16Å; I1133-N1136 VanDerWaalsContact O-N 3.11Å; N1136-K1138 PolarHBondContact O-N 3.13Å; N1136-K1138 VanDerWaalsContact O-N 3.17Å
1137	D	58.6	Low	57.7	Low	108 Å²	108	100.1 Å²	100.1	58%	0.578	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-3.1	179.3	-75.8	-24.8	0	0	0	114.3	I1133	I1133-D1137 PolarHBondContact O-N 2.82Å; I1133-D1137 VanDerWaalsContact O-N 3.17Å
1138	K	50.5	Low	55.1	Low	166 Å²	166	100 Å²	100	72%	0.722	54%	0.543	S	S	*	.			trans	-108.9	55.2	-172.2	-72.5	-173.4	177.9	-177	0	115	R1134 M1135 N1136	R1134-K1138 WeakPolarHBondContact O-CD 3.46Å; R1134-K1138 WeakPolarHBondContact O-CG 3.44Å; M1135-K1138 PolarHBondContact O-N 3.04Å; N1136-K1138 PolarHBondContact O-N 3.13Å; N1136-K1138 VanDerWaalsContact O-N 3.17Å
1139	K	39.8	Very low	52.7	Low	191 Å²	191	102.2 Å²	102.2	83%	0.83	57%	0.565	S	S	*	*			trans	-165.6	130.5	167.2	-99.7	157.5	-174.5	178	0	107.2
1140	I	31.8	Very low	50.2	Low	151 Å²	151	107.6 Å²	107.6	77%	0.774	60%	0.603	S	S	*	*			cis	-147.8	152.2	6.3	-30.6	174.6	0	0	0	107.2
1141	P	31.7	Very low	47.6	Very low	132 Å²	132	110 Å²	110	86%	0.857	63%	0.632	S	S	*	*				-142.7	161.7	99.7	38.7	-26	0	0	0	112.6
1142	G	30.1	Very low	44.9	Very low	60 Å²	60	110.7 Å²	110.7	62%	0.619	66%	0.656	S	S	*	*			cis	168.6	160.4	-4.4	0	0	0	0	0	110.6
1143	N	30.2	Very low	42.7	Very low	168 Å²	168	118.1 Å²	118.1	90%	0.898	69%	0.694	S	S	*	*			trans	69.9	166.2	179	-80.9	0.2	0	0	0	119.4
1144	I	35.6	Very low	40.5	Very low	159 Å²	159	121.9 Å²	121.9	82%	0.815	72%	0.722	S	S	*	*			trans	84.7	93.2	169.9	-45	-171	0	0	0	117.3
1145	T	30.6	Very low	38.1	Very low	123 Å²	123	121.1 Å²	121.1	76%	0.755	74%	0.736	S	S	*	*			trans	-33	143.6	152.4	50.1	0	0	0	0	117.8
1146	S	36.1	Very low	36.1	Very low	105 Å²	105	122.4 Å²	122.4	73%	0.734	75%	0.753	S	S	*	*				153	114.3	118.6	66	0	0	0	0	114.8
1147	S	35	Very low	34.6	Very low	118 Å²	118	125.3 Å²	125.3	83%	0.825	78%	0.778	S	S	*	*			trans	59	146.3	153.2	42.8	0	0	0	0	121.8
1148	P	36.3	Very low	33.4	Very low	126 Å²	126	125.8 Å²	125.8	82%	0.818	79%	0.79	S	S	*	*			trans	-116.7	151.9	-176.3	40.7	-30.3	0	0	0	115.9
1149	S	34.8	Very low	33.1	Very low	107 Å²	107	121.8 Å²	121.8	75%	0.748	78%	0.779	S	S	*	*			trans	-161.5	112.1	158.8	59.4	0	0	0	0	114.3
1150	S	31.9	Very low	34.3	Very low	114 Å²	114	115 Å²	115	80%	0.797	76%	0.756	S	S	*	*			trans	42.9	146.4	140.1	59.2	0	0	0	0	124.3
1151	A	32.3	Very low	36	Very low	100 Å²	100	111.5 Å²	111.5	83%	0.826	74%	0.739	S	S	*	*			trans	72.3	112.1	165.7	0	0	0	0	0	116.3
1152	A	29.1	Very low	37.7	Very low	100 Å²	100	108.4 Å²	108.4	83%	0.826	72%	0.715	S	S	*	*			cis	106.4	94.1	24.7	0	0	0	0	0	113.3
1153	I	33.2	Very low	39.5	Very low	163 Å²	163	110.5 Å²	110.5	84%	0.836	71%	0.709	S	S	*	*			trans	-135.2	120	165.1	-65.1	-175.7	0	0	0	110
1154	S	31.4	Very low	41.7	Very low	98 Å²	98	104.4 Å²	104.4	69%	0.685	68%	0.675	S	S	*	*			trans	-1.2	112.9	165.7	56.9	0	0	0	0	121.9
1155	S	27.2	Very low	43.5	Very low	110 Å²	110	97.8 Å²	97.8	77%	0.769	64%	0.641	S	S	*	*				32.2	113	122	61.5	0	0	0	0	121.5
1156	S	28.2	Very low	45.5	Very low	111 Å²	111	92.5 Å²	92.5	78%	0.776	61%	0.608	S	S	*	*				-171.5	146.9	127.9	32.9	0	0	0	0	112
1157	S	32.1	Very low	47.6	Very low	122 Å²	122	92.7 Å²	92.7	85%	0.853	60%	0.597	S	S	*	*			trans	30.1	93.7	165.2	59.6	0	0	0	0	118.7
1158	S	32.7	Very low	49.9	Very low	117 Å²	117	87.2 Å²	87.2	82%	0.818	56%	0.559	S	S	*	*			trans	-128.3	75.7	162.1	66.1	0	0	0	0	110.9
1159	T	46	Very low	51.8	Low	82 Å²	82	81.3 Å²	81.3	50%	0.503	52%	0.52	S	S	.	.			trans	-59	138.3	165.5	48.3	0	0	0	0	109.1	Q1164	T1159-Q1164 PolarHBondContact O-NE2 3Å; T1159-Q1164 PolarHBondContact OG1-NE2 2.88Å
1160	S	64.3	Low	53.8	Low	50 Å²	50	78.8 Å²	78.8	35%	0.35	50%	0.498	S	S	.	.			trans	-62.9	152.7	-178.9	65.8	0	0	0	0	111.4	L1162 E1163 Q1164	S1160-L1162 PolarHBondContact O-N 3.36Å; S1160-E1163 VanDerWaalsContact CB-OE2 3.29Å; S1160-E1163 WeakPolarHBondContact CB-OE2 3.35Å; S1160-E1163 PolarHBondContact N-OE2 3.18Å; S1160-E1163 PolarHBondContact O-N 3.46Å; S1160-E1163 WeakPolarHBondContact OG-CG 3.21Å; S1160-E1163 PolarHBondContact OG-N 3.32Å; S1160-E1163 VanDerWaalsContact OG-N 3.11Å; S1160-E1163 PolarHBondContact OG-OE2 3.39Å; S1160-Q1164 PolarHBondContact O-N 2.84Å
1161	N	67	Low	56.3	Low	77 Å²	77	76.7 Å²	76.7	41%	0.412	48%	0.476	S	S	.	.	H	α-helix	trans	-56.9	-22.5	172.1	-71.9	12	0	0	0	112.2	L1165	N1161-L1165 WeakPolarHBondContact O-CD1 3.43Å; N1161-L1165 VanDerWaalsContact O-CG 3.27Å; N1161-L1165 WeakPolarHBondContact O-CG 3.48Å; N1161-L1165 PolarHBondContact O-N 3.1Å
1162	L	67.7	Low	58.5	Low	67 Å²	67	72.3 Å²	72.3	35%	0.351	44%	0.439	S	S	.	.	H	α-helix	trans	-76	-43.6	175.6	-177.6	59.8	0	0	0	111.8	S1160 Q1164 L1165 I1166 L1210	S1160-L1162 PolarHBondContact O-N 3.36Å; L1162-Q1164 VanDerWaalsContact C-N 3.34Å; L1162-Q1164 PolarHBondContact O-N 3.04Å; L1162-L1165 PolarHBondContact O-N 3.04Å; L1162-I1166 HydrophobicContact CD1-CD1 4.31Å; L1162-I1166 HydrophobicContact CG-CD1 3.97Å; L1162-I1166 VanDerWaalsContact O-CG1 3.31Å; L1162-I1166 WeakPolarHBondContact O-CG1 3.49Å; L1162-I1166 PolarHBondContact O-N 3.4Å; L1162-L1210 HydrophobicContact CD1-CD2 4.3Å
1163	E	68.9	Low	60.9	Low	103 Å²	103	69.9 Å²	69.9	48%	0.481	41%	0.41	S	S	.	.	H	α-helix	trans	-62.2	-41.3	173.7	-73	159	124.4	0	0	111.6	S1160 L1165 I1166 E1167	S1160-E1163 VanDerWaalsContact CB-OE2 3.29Å; S1160-E1163 WeakPolarHBondContact CB-OE2 3.35Å; S1160-E1163 PolarHBondContact N-OE2 3.18Å; S1160-E1163 PolarHBondContact O-N 3.46Å; S1160-E1163 WeakPolarHBondContact OG-CG 3.21Å; S1160-E1163 PolarHBondContact OG-N 3.32Å; S1160-E1163 VanDerWaalsContact OG-N 3.11Å; S1160-E1163 PolarHBondContact OG-OE2 3.39Å; E1163-L1165 VanDerWaalsContact C-N 3.26Å; E1163-L1165 PolarHBondContact O-N 3.27Å; E1163-I1166 PolarHBondContact O-N 3.15Å; E1163-E1167 WeakPolarHBondContact O-CB 3.4Å; E1163-E1167 PolarHBondContact O-N 2.91Å
1164	Q	75.8	Confident	63.1	Low	41 Å²	41	64.3 Å²	64.3	19%	0.192	39%	0.389	C	S	.	.	H	α-helix	trans	-63.4	-31.1	175.4	-65.3	176.9	34.4	0	0	112.4	L1132 T1159 S1160 L1162 L1168	L1132-Q1164 HydrophobicContact CD2-CB 4.21Å; T1159-Q1164 PolarHBondContact O-NE2 3Å; T1159-Q1164 PolarHBondContact OG1-NE2 2.88Å; S1160-Q1164 PolarHBondContact O-N 2.84Å; L1162-Q1164 VanDerWaalsContact C-N 3.34Å; L1162-Q1164 PolarHBondContact O-N 3.04Å; Q1164-L1168 WeakPolarHBondContact O-CB 3.45Å; Q1164-L1168 PolarHBondContact O-N 3.43Å
1165	L	73.3	Confident	65.6	Low	19 Å²	19	59.7 Å²	59.7	10%	0.099	36%	0.357	C	S	.	.	H	α-helix	trans	-76.3	-34.5	173.1	-77	167.4	0	0	0	113.1	L1132 N1161 L1162 E1163 A1169 F1206 L1210 L1237	L1132-L1165 HydrophobicContact CD1-CD2 3.69Å; L1132-L1165 HydrophobicContact CD1-CG 4.09Å; N1161-L1165 WeakPolarHBondContact O-CD1 3.43Å; N1161-L1165 VanDerWaalsContact O-CG 3.27Å; N1161-L1165 WeakPolarHBondContact O-CG 3.48Å; N1161-L1165 PolarHBondContact O-N 3.1Å; L1162-L1165 PolarHBondContact O-N 3.04Å; E1163-L1165 VanDerWaalsContact C-N 3.26Å; E1163-L1165 PolarHBondContact O-N 3.27Å; L1165-A1169 WeakPolarHBondContact O-CB 3.39Å; L1165-A1169 PolarHBondContact O-N 2.88Å; L1165-F1206 HydrophobicContact CD2-CZ 4.45Å; L1165-L1210 HydrophobicContact CB-CD1 4.26Å; L1165-L1210 HydrophobicContact CB-CD2 4.36Å; L1165-L1237 HydrophobicContact CD2-CD2 3.86Å
1166	I	72.8	Confident	68.2	Low	12 Å²	12	57.2 Å²	57.2	6%	0.062	33%	0.33	C	S	.	.	H	α-helix	trans	-68.6	-48.2	176.1	-69.5	160.6	0	0	0	110.2	L1162 E1163 L1168 A1169 D1170 R1214	L1162-I1166 HydrophobicContact CD1-CD1 4.31Å; L1162-I1166 HydrophobicContact CG-CD1 3.97Å; L1162-I1166 VanDerWaalsContact O-CG1 3.31Å; L1162-I1166 WeakPolarHBondContact O-CG1 3.49Å; L1162-I1166 PolarHBondContact O-N 3.4Å; E1163-I1166 PolarHBondContact O-N 3.15Å; I1166-L1168 VanDerWaalsContact C-N 3.31Å; I1166-L1168 PolarHBondContact O-N 3.12Å; I1166-A1169 WeakPolarHBondContact O-CB 3.44Å; I1166-A1169 PolarHBondContact O-N 3.19Å; I1166-D1170 PolarHBondContact O-N 3.08Å; I1166-R1214 HydrophobicContact CD1-CB 4.26Å; I1166-R1214 HydrophobicContact CD1-CG 4.21Å
1167	E	79.5	Confident	70.7	Confident	109 Å²	109	56 Å²	56	51%	0.509	32%	0.315	S	S	.	.	H	α-helix	trans	-55.1	-45.5	174.5	177.5	59.1	-142.4	0	0	111.4	E1163 A1169 D1170 Q1171	E1163-E1167 WeakPolarHBondContact O-CB 3.4Å; E1163-E1167 PolarHBondContact O-N 2.91Å; E1167-A1169 VanDerWaalsContact C-N 3.34Å; E1167-A1169 PolarHBondContact O-N 2.89Å; E1167-D1170 PolarHBondContact O-N 2.67Å; E1167-Q1171 WeakPolarHBondContact O-CG 3.4Å; E1167-Q1171 PolarHBondContact O-N 3.21Å; E1167-Q1171 PolarHBondContact OE1-NE2 3Å
1168	L	82.9	Confident	73.1	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.016	29%	0.287	C	S	.	.	H	α-helix	trans	-64.2	-36.3	176.1	-173.5	63.5	0	0	0	112.9	I1125 E1128 L1129 L1132 Q1164 I1166 Q1171 M1172	I1125-L1168 HydrophobicContact CB-CD1 4.41Å; I1125-L1168 HydrophobicContact CG2-CD1 3.82Å; E1128-L1168 HydrophobicContact CB-CD1 4.06Å; E1128-L1168 HydrophobicContact CG-CD1 3.97Å; L1129-L1168 HydrophobicContact CB-CD2 4Å; L1129-L1168 HydrophobicContact CD1-CD2 3.94Å; L1132-L1168 HydrophobicContact CD1-CD2 3.82Å; Q1164-L1168 WeakPolarHBondContact O-CB 3.45Å; Q1164-L1168 PolarHBondContact O-N 3.43Å; I1166-L1168 VanDerWaalsContact C-N 3.31Å; I1166-L1168 PolarHBondContact O-N 3.12Å; L1168-Q1171 PolarHBondContact O-N 3.17Å; L1168-M1172 VanDerWaalsContact O-CG 3.29Å; L1168-M1172 WeakPolarHBondContact O-CG 3.48Å; L1168-M1172 PolarHBondContact O-N 3.01Å
1169	A	76.2	Confident	75.5	Confident	2 Å²	2	46.5 Å²	46.5	2%	0.017	25%	0.248	C	C	.	.	H	α-helix	trans	-70.5	-31.1	176.5	0	0	0	0	0	112.9	L1165 I1166 E1167 M1172 E1173 L1210	L1165-A1169 WeakPolarHBondContact O-CB 3.39Å; L1165-A1169 PolarHBondContact O-N 2.88Å; I1166-A1169 WeakPolarHBondContact O-CB 3.44Å; I1166-A1169 PolarHBondContact O-N 3.19Å; E1167-A1169 VanDerWaalsContact C-N 3.34Å; E1167-A1169 PolarHBondContact O-N 2.89Å; A1169-M1172 WeakPolarHBondContact O-CB 3.22Å; A1169-E1173 PolarHBondContact O-N 3.05Å; A1169-L1210 HydrophobicContact CB-CD1 3.84Å
1170	D	78	Confident	77	Confident	54 Å²	54	43.2 Å²	43.2	29%	0.289	23%	0.228	S	C	.	.	H	α-helix	trans	-75.7	-36.3	175	-68.8	-15.9	0	0	0	111	I1166 E1167 E1173 A1174 R1211	I1166-D1170 PolarHBondContact O-N 3.08Å; E1167-D1170 PolarHBondContact O-N 2.67Å; D1170-E1173 PolarHBondContact O-N 3.09Å; D1170-A1174 PolarHBondContact O-N 3.41Å; D1170-R1211 IonicContact OD1-CZ 3.14Å; D1170-R1211 IonicContact OD1-NE 2.76Å; D1170-R1211 PolarHBondContact OD1-NE 2.92Å; D1170-R1211 IonicContact OD1-NH2 3.71Å; D1170-R1211 PolarHBondContact OD1-NH2 3.17Å; D1170-R1211 IonicContact OD2-NH2 2.72Å
1171	Q	83.4	Confident	77.6	Confident	71 Å²	71	42.1 Å²	42.1	33%	0.332	22%	0.222	S	C	.	.	H	α-helix	trans	-64	-39.6	169	-69	176	25	0	0	112.7	I1125 E1167 L1168 E1173 A1174 C1175	I1125-Q1171 HydrophobicContact CD1-CB 4.49Å; I1125-Q1171 HydrophobicContact CG1-CB 4.5Å; E1167-Q1171 WeakPolarHBondContact O-CG 3.4Å; E1167-Q1171 PolarHBondContact O-N 3.21Å; E1167-Q1171 PolarHBondContact OE1-NE2 3Å; L1168-Q1171 PolarHBondContact O-N 3.17Å; Q1171-E1173 VanDerWaalsContact C-N 3.32Å; Q1171-E1173 PolarHBondContact O-N 2.81Å; Q1171-A1174 PolarHBondContact O-N 3.15Å; Q1171-C1175 WeakPolarHBondContact O-CB 3.39Å; Q1171-C1175 PolarHBondContact O-N 2.74Å
1172	M	79.7	Confident	78.4	Confident	8 Å²	8	39.5 Å²	39.5	4%	0.039	21%	0.207	C	C	.	.	H	α-helix	trans	-57.6	-43.1	171.9	-77.8	168.8	163.7	0	0	112	I1125 L1129 L1168 A1169 C1175 R1176 L1203 F1206 A1240 I1244	I1125-M1172 HydrophobicContact CG2-CE 4.17Å; I1125-M1172 HydrophobicContact CG2-CG 3.72Å; L1129-M1172 HydrophobicContact CD1-CE 4.39Å; L1129-M1172 HydrophobicContact CD2-CE 4.1Å; L1168-M1172 VanDerWaalsContact O-CG 3.29Å; L1168-M1172 WeakPolarHBondContact O-CG 3.48Å; L1168-M1172 PolarHBondContact O-N 3.01Å; A1169-M1172 WeakPolarHBondContact O-CB 3.22Å; M1172-C1175 WeakPolarHBondContact O-CB 3.5Å; M1172-C1175 PolarHBondContact O-N 3.22Å; M1172-R1176 PolarHBondContact O-N 2.69Å; M1172-L1203 HydrophobicContact CE-CD2 4.07Å; M1172-L1203 HydrophobicContact SD-CD2 4.22Å; M1172-F1206 HydrophobicContact SD-CD1 4.1Å; M1172-F1206 HydrophobicContact SD-CE1 4.24Å; M1172-A1240 HydrophobicContact CE-CB 4.12Å; M1172-I1244 HydrophobicContact CE-CD1 3.73Å
1173	E	77.9	Confident	78.8	Confident	48 Å²	48	36.4 Å²	36.4	22%	0.224	19%	0.191	C	C	.	.	H	α-helix	trans	-70.7	-40.6	-178.9	-177.5	59.8	-169.3	0	0	112.2	A1169 D1170 Q1171 C1175 R1176 L1177	A1169-E1173 PolarHBondContact O-N 3.05Å; D1170-E1173 PolarHBondContact O-N 3.09Å; Q1171-E1173 VanDerWaalsContact C-N 3.32Å; Q1171-E1173 PolarHBondContact O-N 2.81Å; E1173-C1175 VanDerWaalsContact C-N 3.27Å; E1173-C1175 PolarHBondContact O-N 2.79Å; E1173-R1176 VanDerWaalsContact CD-NE 3.28Å; E1173-R1176 WeakPolarHBondContact O-CB 3.43Å; E1173-R1176 PolarHBondContact O-N 3.08Å; E1173-R1176 IonicContact OE1-CZ 3.8Å; E1173-R1176 VanDerWaalsContact OE1-CZ 3.28Å; E1173-R1176 IonicContact OE1-NE 3.21Å; E1173-R1176 PolarHBondContact OE1-NE 3.44Å; E1173-R1176 VanDerWaalsContact OE1-NE 3.08Å; E1173-R1176 IonicContact OE1-NH2 3.85Å; E1173-R1176 PolarHBondContact OE1-NH2 2.67Å; E1173-R1176 WeakPolarHBondContact OE2-CD 3.43Å; E1173-R1176 IonicContact OE2-CZ 2.65Å; E1173-R1176 IonicContact OE2-NE 3.84Å; E1173-R1176 PolarHBondContact OE2-NE 3.17Å; E1173-R1176 IonicContact OE2-NH2 2.65Å; E1173-L1177 PolarHBondContact O-N 2.66Å; E1173-L1177 VanDerWaalsContact O-N 3.09Å
1174	A	81	Confident	79	Confident	47 Å²	47	33 Å²	33	39%	0.388	18%	0.176	S	C	.	.	H	α-helix	trans	-60.8	-37.6	170.3	0	0	0	0	0	112.1	D1170 Q1171 S1178	D1170-A1174 PolarHBondContact O-N 3.41Å; Q1171-A1174 PolarHBondContact O-N 3.15Å; A1174-S1178 PolarHBondContact O-N 3.41Å; A1174-S1178 VanDerWaalsContact O-N 3.14Å; A1174-S1178 PolarHBondContact O-OG 3.25Å
1175	C	84.1	Confident	78.9	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.007	19%	0.194	C	C	.	.	H	α-helix	trans	-67.5	-38.9	174.5	-155.1	0	0	0	0	112.3	H1121 L1122 I1125 Q1171 M1172 E1173 S1178 C1179	H1121-C1175 PolarHBondContact ND1-SG 3.08Å; L1122-C1175 VanDerWaalsContact CD2-SG 3.58Å; I1125-C1175 HydrophobicContact CD1-CB 3.62Å; Q1171-C1175 WeakPolarHBondContact O-CB 3.39Å; Q1171-C1175 PolarHBondContact O-N 2.74Å; M1172-C1175 WeakPolarHBondContact O-CB 3.5Å; M1172-C1175 PolarHBondContact O-N 3.22Å; E1173-C1175 VanDerWaalsContact C-N 3.27Å; E1173-C1175 PolarHBondContact O-N 2.79Å; C1175-S1178 WeakPolarHBondContact O-CB 3.44Å; C1175-S1178 PolarHBondContact O-N 3.49Å; C1175-C1179 WeakPolarHBondContact O-CB 3.48Å; C1175-C1179 PolarHBondContact O-N 3.49Å; C1175-C1179 PolarHBondContact O-SG 2.62Å
1176	R	81.7	Confident	78.7	Confident	57 Å²	57	36.8 Å²	36.8	22%	0.215	20%	0.196	C	C	.	.	H	α-helix	trans	-58	-47.8	174.1	-175.6	-172.5	74.9	72.6	2	111.6	M1172 E1173 S1178 C1179 S1180 F1200	M1172-R1176 PolarHBondContact O-N 2.69Å; E1173-R1176 VanDerWaalsContact CD-NE 3.28Å; E1173-R1176 WeakPolarHBondContact O-CB 3.43Å; E1173-R1176 PolarHBondContact O-N 3.08Å; E1173-R1176 IonicContact OE1-CZ 3.8Å; E1173-R1176 VanDerWaalsContact OE1-CZ 3.28Å; E1173-R1176 IonicContact OE1-NE 3.21Å; E1173-R1176 PolarHBondContact OE1-NE 3.44Å; E1173-R1176 VanDerWaalsContact OE1-NE 3.08Å; E1173-R1176 IonicContact OE1-NH2 3.85Å; E1173-R1176 PolarHBondContact OE1-NH2 2.67Å; E1173-R1176 WeakPolarHBondContact OE2-CD 3.43Å; E1173-R1176 IonicContact OE2-CZ 2.65Å; E1173-R1176 IonicContact OE2-NE 3.84Å; E1173-R1176 PolarHBondContact OE2-NE 3.17Å; E1173-R1176 IonicContact OE2-NH2 2.65Å; R1176-S1178 PolarHBondContact O-N 2.77Å; R1176-C1179 PolarHBondContact O-N 2.82Å; R1176-S1180 PolarHBondContact O-N 2.82Å; R1176-F1200 HydrophobicContact CB-CD1 3.7Å; R1176-F1200 HydrophobicContact CB-CE1 4.09Å; R1176-F1200 HydrophobicContact CB-CG 4.39Å; R1176-F1200 HydrophobicContact CG-CB 3.83Å; R1176-F1200 HydrophobicContact CG-CD1 3.59Å; R1176-F1200 HydrophobicContact CG-CE1 4.27Å; R1176-F1200 HydrophobicContact CG-CG 3.76Å
1177	L	79.2	Confident	78.6	Confident	87 Å²	87	40.8 Å²	40.8	46%	0.455	22%	0.221	S	C	.	.	H	α-helix	trans	-60.2	-45.1	176.7	-66.6	172.1	0	0	0	111.5	E1173 C1179 S1180 A1181	E1173-L1177 PolarHBondContact O-N 2.66Å; E1173-L1177 VanDerWaalsContact O-N 3.09Å; L1177-C1179 VanDerWaalsContact C-N 3.34Å; L1177-C1179 PolarHBondContact O-N 3.18Å; L1177-S1180 WeakPolarHBondContact O-CB 3.47Å; L1177-S1180 PolarHBondContact O-N 3.02Å; L1177-A1181 PolarHBondContact O-N 3.17Å; L1177-A1181 VanDerWaalsContact O-N 3.07Å
1178	S	82.5	Confident	78	Confident	39 Å²	39	37.4 Å²	37.4	27%	0.273	21%	0.209	S	C	.	.	H	α-helix	trans	-60.1	-41.7	176.3	-53.9	0	0	0	0	112.4	P1113 A1174 C1175 R1176 A1181 Y1182	P1113-S1178 VanDerWaalsContact CG-O 3.28Å; P1113-S1178 WeakPolarHBondContact CG-O 3.26Å; A1174-S1178 PolarHBondContact O-N 3.41Å; A1174-S1178 VanDerWaalsContact O-N 3.14Å; A1174-S1178 PolarHBondContact O-OG 3.25Å; C1175-S1178 WeakPolarHBondContact O-CB 3.44Å; C1175-S1178 PolarHBondContact O-N 3.49Å; R1176-S1178 PolarHBondContact O-N 2.77Å; S1178-A1181 PolarHBondContact O-N 3.28Å; S1178-Y1182 PolarHBondContact O-N 2.97Å
1179	C	82.8	Confident	77.1	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-69.2	-34	176.7	-66.4	0	0	0	0	112.3	L1118 C1175 R1176 L1177 Y1182 I1183 F1196 F1200	L1118-C1179 HydrophobicContact CD1-CB 4.48Å; C1175-C1179 WeakPolarHBondContact O-CB 3.48Å; C1175-C1179 PolarHBondContact O-N 3.49Å; C1175-C1179 PolarHBondContact O-SG 2.62Å; R1176-C1179 PolarHBondContact O-N 2.82Å; L1177-C1179 VanDerWaalsContact C-N 3.34Å; L1177-C1179 PolarHBondContact O-N 3.18Å; C1179-Y1182 PolarHBondContact O-N 3.5Å; C1179-I1183 PolarHBondContact O-N 2.93Å; C1179-F1196 HydrophobicContact CB-CE1 3.89Å; C1179-F1196 HydrophobicContact CB-CZ 4.07Å; C1179-F1200 HydrophobicContact CB-CE1 4.19Å; C1179-F1200 HydrophobicContact CB-CE2 4.03Å; C1179-F1200 HydrophobicContact CB-CZ 3.43Å; C1179-F1200 VanDerWaalsContact CB-CZ 3.43Å
1180	S	77.9	Confident	76	Confident	12 Å²	12	42.8 Å²	42.8	8%	0.084	25%	0.249	C	C	.	.	H	α-helix	trans	-63.8	-40.8	173.7	-163.1	0	0	0	0	111.9	R1176 L1177 Y1182 I1183 D1184	R1176-S1180 PolarHBondContact O-N 2.82Å; L1177-S1180 WeakPolarHBondContact O-CB 3.47Å; L1177-S1180 PolarHBondContact O-N 3.02Å; S1180-Y1182 PolarHBondContact O-N 3.38Å; S1180-I1183 WeakPolarHBondContact O-CG2 3.27Å; S1180-I1183 PolarHBondContact O-N 2.96Å; S1180-D1184 WeakPolarHBondContact O-CB 3.41Å; S1180-D1184 PolarHBondContact O-N 3.07Å; S1180-D1184 VanDerWaalsContact O-N 3.08Å
1181	A	77.8	Confident	75	Confident	27 Å²	27	47.5 Å²	47.5	22%	0.223	26%	0.263	C	S	.	.	H	α-helix	trans	-63.2	-41.2	177	0	0	0	0	0	112.6	L1177 S1178	L1177-A1181 PolarHBondContact O-N 3.17Å; L1177-A1181 VanDerWaalsContact O-N 3.07Å; S1178-A1181 PolarHBondContact O-N 3.28Å
1182	Y	83.3	Confident	74	Confident	23 Å²	23	45.8 Å²	45.8	9%	0.09	26%	0.261	C	S	.	.	H	α-helix	trans	-69.3	-44.1	176.5	176.1	-98.2	0	0	0	112.6	P1113 K1115 L1118 S1178 C1179 S1180 D1184 Q1185 A1186 L1251 L1254 D1256	P1113-Y1182 WeakPolarHBondContact O-CD2 3.09Å; K1115-Y1182 HydrophobicContact CB-CE2 4.07Å; L1118-Y1182 VanDerWaalsContact CD1-CB 3.45Å; L1118-Y1182 HydrophobicContact CD1-CD1 3.86Å; L1118-Y1182 HydrophobicContact CD1-CD2 4.37Å; L1118-Y1182 HydrophobicContact CD1-CG 3.65Å; S1178-Y1182 PolarHBondContact O-N 2.97Å; C1179-Y1182 PolarHBondContact O-N 3.5Å; S1180-Y1182 PolarHBondContact O-N 3.38Å; Y1182-D1184 VanDerWaalsContact C-N 3.32Å; Y1182-D1184 PolarHBondContact O-N 3.19Å; Y1182-Q1185 PolarHBondContact O-N 3.09Å; Y1182-A1186 PolarHBondContact O-N 3.17Å; Y1182-L1251 HydrophobicContact CD1-CD2 3.93Å; Y1182-L1251 HydrophobicContact CE1-CD2 3.76Å; Y1182-L1254 HydrophobicContact CE1-CD1 3.92Å; Y1182-D1256 PolarHBondContact OH-OD1 3.05Å
1183	I	77.3	Confident	73.6	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-69.4	-29.4	-178.7	-157.8	69.1	0	0	0	112.5	C1179 S1180 Q1185 A1186 K1193 F1196 R1197 L1254	C1179-I1183 PolarHBondContact O-N 2.93Å; S1180-I1183 WeakPolarHBondContact O-CG2 3.27Å; S1180-I1183 PolarHBondContact O-N 2.96Å; I1183-Q1185 VanDerWaalsContact C-N 3.27Å; I1183-Q1185 PolarHBondContact O-N 3.27Å; I1183-A1186 HydrophobicContact CD1-CB 4.14Å; I1183-A1186 PolarHBondContact O-N 3.05Å; I1183-K1193 HydrophobicContact CG1-CB 4.21Å; I1183-K1193 HydrophobicContact CG1-CG 4.07Å; I1183-K1193 WeakPolarHBondContact O-CD 3.43Å; I1183-K1193 VanDerWaalsContact O-CE 3.27Å; I1183-K1193 WeakPolarHBondContact O-CE 3.47Å; I1183-K1193 PolarHBondContact O-NZ 2.99Å; I1183-F1196 HydrophobicContact CB-CD1 3.64Å; I1183-F1196 HydrophobicContact CB-CE1 3.87Å; I1183-F1196 HydrophobicContact CD1-CB 4.09Å; I1183-F1196 HydrophobicContact CD1-CD1 3.75Å; I1183-F1196 HydrophobicContact CD1-CE1 4.29Å; I1183-F1196 HydrophobicContact CD1-CG 3.86Å; I1183-F1196 HydrophobicContact CG1-CB 4.17Å; I1183-F1196 HydrophobicContact CG1-CD1 3.57Å; I1183-F1196 HydrophobicContact CG1-CE1 4.24Å; I1183-F1196 HydrophobicContact CG1-CG 4.07Å; I1183-F1196 HydrophobicContact CG2-CD1 3.98Å; I1183-F1196 HydrophobicContact CG2-CE1 4.34Å; I1183-R1197 HydrophobicContact CG2-CG 4.4Å; I1183-L1254 HydrophobicContact CD1-CD1 3.54Å; I1183-L1254 HydrophobicContact CD1-CD2 4.24Å
1184	D	72.8	Confident	73	Confident	32 Å²	32	47.8 Å²	47.8	17%	0.171	27%	0.269	C	S	.	.	H	α-helix	trans	-65.8	-33.1	174.3	-78.3	16.1	0	0	0	110.9	S1097 S1180 Y1182 K1193 R1197	S1097-D1184 PolarHBondContact N-OD2 3.17Å; S1180-D1184 WeakPolarHBondContact O-CB 3.41Å; S1180-D1184 PolarHBondContact O-N 3.07Å; S1180-D1184 VanDerWaalsContact O-N 3.08Å; Y1182-D1184 VanDerWaalsContact C-N 3.32Å; Y1182-D1184 PolarHBondContact O-N 3.19Å; D1184-K1193 PolarHBondContact O-NZ 3.29Å; D1184-R1197 VanDerWaalsContact CG-NH2 3.33Å; D1184-R1197 IonicContact OD1-CZ 2.9Å; D1184-R1197 IonicContact OD1-NE 3.36Å; D1184-R1197 IonicContact OD1-NH2 2.67Å; D1184-R1197 PolarHBondContact OD1-NH2 3.45Å; D1184-R1197 IonicContact OD2-NH2 3.61Å; D1184-R1197 PolarHBondContact OD2-NH2 3.32Å; D1184-R1197 VanDerWaalsContact OD2-NH2 3.15Å
1185	Q	72.9	Confident	72.3	Confident	121 Å²	121	49 Å²	49	57%	0.565	27%	0.269	S	S	*	.	H	α-helix	trans	-80.6	-24.3	173.5	-64	178.7	4	0	0	114.1	P1112 Y1182 I1183	P1112-Q1185 VanDerWaalsContact CG-OE1 3.31Å; Y1182-Q1185 PolarHBondContact O-N 3.09Å; I1183-Q1185 VanDerWaalsContact C-N 3.27Å; I1183-Q1185 PolarHBondContact O-N 3.27Å
1186	A	69.4	Low	71.9	Confident	18 Å²	18	49.2 Å²	49.2	15%	0.149	27%	0.27	C	S	.	.	S	Bend	trans	-65.2	134.3	-177.2	0	0	0	0	0	113.4	Y1182 I1183 C1188 K1193	Y1182-A1186 PolarHBondContact O-N 3.17Å; I1183-A1186 HydrophobicContact CD1-CB 4.14Å; I1183-A1186 PolarHBondContact O-N 3.05Å; A1186-C1188 PolarHBondContact O-N 3.48Å; A1186-K1193 WeakPolarHBondContact O-CE 3.43Å; A1186-K1193 PolarHBondContact O-NZ 2.89Å
1187	T	70.7	Confident	71.5	Confident	97 Å²	97	49 Å²	49	60%	0.595	27%	0.269	S	S	*	.			trans	-82.2	58.4	178.2	53.5	0	0	0	0	112.4	N1257	T1187-N1257 PolarHBondContact OG1-ND2 3.43Å
1188	C	67.6	Low	71.3	Confident	37 Å²	37	48.7 Å²	48.7	25%	0.25	27%	0.268	C	S	.	.			trans	-119.8	166.8	178.1	64	0	0	0	0	112	A1186 A1192 K1193 L1254	A1186-C1188 PolarHBondContact O-N 3.48Å; C1188-A1192 HydrophobicContact CB-CB 3.96Å; C1188-K1193 VanDerWaalsContact SG-CG 3.58Å; C1188-L1254 HydrophobicContact CB-CD2 4Å
1189	S	63.1	Low	70.8	Confident	77 Å²	77	49.7 Å²	49.7	54%	0.538	27%	0.265	S	S	.	.			trans	-68.6	158.5	-175.6	71.4	0	0	0	0	113	R1191 A1192 K1193	S1189-R1191 PolarHBondContact O-N 2.94Å; S1189-A1192 WeakPolarHBondContact O-CA 3.33Å; S1189-A1192 WeakPolarHBondContact O-CB 3.42Å; S1189-A1192 PolarHBondContact O-N 3.26Å; S1189-A1192 PolarHBondContact OG-N 2.9Å; S1189-K1193 PolarHBondContact O-N 3.49Å
1190	A	52.9	Low	70.4	Confident	41 Å²	41	50.1 Å²	50.1	34%	0.339	27%	0.267	S	S	.	.	H	α-helix	trans	-50.6	-42.9	174	0	0	0	0	0	112.9	T1092 A1192 K1193 F1194	T1092-A1190 HydrophobicContact CG2-CB 3.46Å; T1092-A1190 VanDerWaalsContact CG2-CB 3.46Å; A1190-A1192 VanDerWaalsContact C-N 3.33Å; A1190-A1192 PolarHBondContact O-N 3.15Å; A1190-K1193 PolarHBondContact O-N 3.16Å; A1190-F1194 VanDerWaalsContact O-CB 3.32Å; A1190-F1194 WeakPolarHBondContact O-CB 3.35Å; A1190-F1194 PolarHBondContact O-N 3.41Å
1191	R	56.8	Low	69.9	Low	154 Å²	154	51.7 Å²	51.7	58%	0.581	28%	0.278	S	S	*	.	H	α-helix	trans	-65.1	-35.5	177.5	-159.2	83.9	-176.5	-158.7	5.2	111.5	E439 S1189 N1195	E439-R1191 IonicContact OE2-NH1 2.69Å; E439-R1191 IonicContact OE2-NH2 3.25Å; S1189-R1191 PolarHBondContact O-N 2.94Å; R1191-N1195 VanDerWaalsContact O-CB 3.31Å; R1191-N1195 WeakPolarHBondContact O-CB 3.46Å; R1191-N1195 PolarHBondContact O-N 3.4Å; R1191-N1195 PolarHBondContact O-OD1 3.39Å; R1191-N1195 VanDerWaalsContact O-OD1 3.13Å
1192	A	63	Low	69.4	Low	34 Å²	34	52.7 Å²	52.7	28%	0.281	28%	0.283	S	S	.	.	H	α-helix	trans	-69.4	-45.8	174.1	0	0	0	0	0	112	C1188 S1189 A1190 F1194 N1195 F1196	C1188-A1192 HydrophobicContact CB-CB 3.96Å; S1189-A1192 WeakPolarHBondContact O-CA 3.33Å; S1189-A1192 WeakPolarHBondContact O-CB 3.42Å; S1189-A1192 PolarHBondContact O-N 3.26Å; S1189-A1192 PolarHBondContact OG-N 2.9Å; A1190-A1192 VanDerWaalsContact C-N 3.33Å; A1190-A1192 PolarHBondContact O-N 3.15Å; A1192-F1194 VanDerWaalsContact C-N 3.31Å; A1192-F1194 PolarHBondContact O-N 2.87Å; A1192-N1195 PolarHBondContact O-N 3.29Å; A1192-F1196 WeakPolarHBondContact O-CB 3.27Å; A1192-F1196 PolarHBondContact O-N 2.95Å
1193	K	70.8	Confident	68.8	Low	27 Å²	27	52.1 Å²	52.1	12%	0.117	28%	0.281	C	S	.	.	H	α-helix	trans	-60.1	-41.5	174.6	-58.5	-158	-177	-146.7	0	111.8	I1183 D1184 A1186 C1188 S1189 A1190 R1197	I1183-K1193 HydrophobicContact CG1-CB 4.21Å; I1183-K1193 HydrophobicContact CG1-CG 4.07Å; I1183-K1193 WeakPolarHBondContact O-CD 3.43Å; I1183-K1193 VanDerWaalsContact O-CE 3.27Å; I1183-K1193 WeakPolarHBondContact O-CE 3.47Å; I1183-K1193 PolarHBondContact O-NZ 2.99Å; D1184-K1193 PolarHBondContact O-NZ 3.29Å; A1186-K1193 WeakPolarHBondContact O-CE 3.43Å; A1186-K1193 PolarHBondContact O-NZ 2.89Å; C1188-K1193 VanDerWaalsContact SG-CG 3.58Å; S1189-K1193 PolarHBondContact O-N 3.49Å; A1190-K1193 PolarHBondContact O-N 3.16Å; K1193-R1197 WeakPolarHBondContact O-CB 3.31Å; K1193-R1197 VanDerWaalsContact O-CG 3.3Å; K1193-R1197 WeakPolarHBondContact O-CG 3.34Å; K1193-R1197 PolarHBondContact O-N 3.47Å
1194	F	64.9	Low	68.5	Low	71 Å²	71	54.5 Å²	54.5	31%	0.311	29%	0.293	S	S	.	.	H	α-helix	trans	-63.2	-55.3	175.1	-179.6	-94.2	0	0	0	111.9	L1094 A1190 A1192 F1196 R1197 D1198	L1094-F1194 HydrophobicContact CD1-CD2 3.61Å; L1094-F1194 HydrophobicContact CD1-CE2 4.21Å; A1190-F1194 VanDerWaalsContact O-CB 3.32Å; A1190-F1194 WeakPolarHBondContact O-CB 3.35Å; A1190-F1194 PolarHBondContact O-N 3.41Å; A1192-F1194 VanDerWaalsContact C-N 3.31Å; A1192-F1194 PolarHBondContact O-N 2.87Å; F1194-F1196 PolarHBondContact O-N 3.03Å; F1194-R1197 PolarHBondContact O-N 3.09Å; F1194-D1198 HydrophobicContact CE1-CB 4.26Å; F1194-D1198 WeakPolarHBondContact O-CB 3.49Å; F1194-D1198 PolarHBondContact O-N 2.9Å
1195	N	66.9	Low	68.3	Low	73 Å²	73	57 Å²	57	39%	0.39	31%	0.309	S	S	.	.	H	α-helix	trans	-56.1	-40	179.9	-71	2.8	0	0	0	111.7	R1191 A1192 D1198 R1199	R1191-N1195 VanDerWaalsContact O-CB 3.31Å; R1191-N1195 WeakPolarHBondContact O-CB 3.46Å; R1191-N1195 PolarHBondContact O-N 3.4Å; R1191-N1195 PolarHBondContact O-OD1 3.39Å; R1191-N1195 VanDerWaalsContact O-OD1 3.13Å; A1192-N1195 PolarHBondContact O-N 3.29Å; N1195-D1198 PolarHBondContact O-N 3.48Å; N1195-R1199 PolarHBondContact O-N 3.17Å
1196	F	75.2	Confident	68.1	Low	6 Å²	6	51.9 Å²	51.9	3%	0.026	29%	0.285	C	S	.	.	H	α-helix	trans	-65.7	-41.8	177	-174.5	-100.4	0	0	0	112.5	C1179 I1183 A1192 F1194 F1200 I1247 D1250 L1251	C1179-F1196 HydrophobicContact CB-CE1 3.89Å; C1179-F1196 HydrophobicContact CB-CZ 4.07Å; I1183-F1196 HydrophobicContact CB-CD1 3.64Å; I1183-F1196 HydrophobicContact CB-CE1 3.87Å; I1183-F1196 HydrophobicContact CD1-CB 4.09Å; I1183-F1196 HydrophobicContact CD1-CD1 3.75Å; I1183-F1196 HydrophobicContact CD1-CE1 4.29Å; I1183-F1196 HydrophobicContact CD1-CG 3.86Å; I1183-F1196 HydrophobicContact CG1-CB 4.17Å; I1183-F1196 HydrophobicContact CG1-CD1 3.57Å; I1183-F1196 HydrophobicContact CG1-CE1 4.24Å; I1183-F1196 HydrophobicContact CG1-CG 4.07Å; I1183-F1196 HydrophobicContact CG2-CD1 3.98Å; I1183-F1196 HydrophobicContact CG2-CE1 4.34Å; A1192-F1196 WeakPolarHBondContact O-CB 3.27Å; A1192-F1196 PolarHBondContact O-N 2.95Å; F1194-F1196 PolarHBondContact O-N 3.03Å; F1196-F1200 HydrophobicContact CD1-CE2 4.3Å; F1196-F1200 AromaticContact CE1-CE2 3.98Å; F1196-F1200 HydrophobicContact CE1-CE2 3.98Å; F1196-F1200 HydrophobicContact CZ-CE2 4.21Å; F1196-F1200 HydrophobicContact CZ-CZ 4.48Å; F1196-F1200 VanDerWaalsContact O-CD2 3.26Å; F1196-F1200 WeakPolarHBondContact O-CD2 3.29Å; F1196-F1200 WeakPolarHBondContact O-CE2 3.3Å; F1196-I1247 HydrophobicContact CE2-CG2 3.98Å; F1196-I1247 HydrophobicContact CZ-CG2 4.18Å; F1196-D1250 HydrophobicContact CD2-CB 4.1Å; F1196-L1251 HydrophobicContact CE2-CD2 3.86Å; F1196-L1251 HydrophobicContact CE2-CG 3.9Å; F1196-L1251 HydrophobicContact CZ-CD2 3.69Å; F1196-L1251 HydrophobicContact CZ-CG 4.08Å
1197	R	74.6	Confident	68.2	Low	52 Å²	52	51.5 Å²	51.5	20%	0.196	28%	0.281	C	S	.	.	H	α-helix	trans	-67.9	-40.3	175.1	-74.6	170.8	167.6	-133.2	2.1	112.3	S1097 I1183 D1184 K1193 F1194 R1199 F1200	S1097-R1197 PolarHBondContact OG-NH1 3.19Å; S1097-R1197 PolarHBondContact OG-NH2 3.29Å; S1097-R1197 VanDerWaalsContact OG-NH2 3.09Å; I1183-R1197 HydrophobicContact CG2-CG 4.4Å; D1184-R1197 VanDerWaalsContact CG-NH2 3.33Å; D1184-R1197 IonicContact OD1-CZ 2.9Å; D1184-R1197 IonicContact OD1-NE 3.36Å; D1184-R1197 IonicContact OD1-NH2 2.67Å; D1184-R1197 PolarHBondContact OD1-NH2 3.45Å; D1184-R1197 IonicContact OD2-NH2 3.61Å; D1184-R1197 PolarHBondContact OD2-NH2 3.32Å; D1184-R1197 VanDerWaalsContact OD2-NH2 3.15Å; K1193-R1197 WeakPolarHBondContact O-CB 3.31Å; K1193-R1197 VanDerWaalsContact O-CG 3.3Å; K1193-R1197 WeakPolarHBondContact O-CG 3.34Å; K1193-R1197 PolarHBondContact O-N 3.47Å; F1194-R1197 PolarHBondContact O-N 3.09Å; R1197-R1199 VanDerWaalsContact C-N 3.32Å; R1197-R1199 PolarHBondContact O-N 2.92Å; R1197-F1200 WeakPolarHBondContact O-CB 3.45Å; R1197-F1200 PolarHBondContact O-N 3.28Å; R1197-F1200 VanDerWaalsContact O-N 3.09Å
1198	D	73.3	Confident	68.1	Low	81 Å²	81	50.4 Å²	50.4	43%	0.433	28%	0.278	S	S	.	.	H	α-helix	trans	-61.5	-36.3	-176.3	-168.6	51.4	0	0	0	112.4	F1194 N1195 F1200 S1201	F1194-D1198 HydrophobicContact CE1-CB 4.26Å; F1194-D1198 WeakPolarHBondContact O-CB 3.49Å; F1194-D1198 PolarHBondContact O-N 2.9Å; N1195-D1198 PolarHBondContact O-N 3.48Å; D1198-F1200 PolarHBondContact O-N 3.25Å; D1198-F1200 VanDerWaalsContact O-N 3.1Å; D1198-S1201 WeakPolarHBondContact O-CB 3.46Å; D1198-S1201 PolarHBondContact O-N 2.9Å
1199	R	73	Confident	68.2	Low	60 Å²	60	51.4 Å²	51.4	23%	0.226	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-26.1	174.9	-65.7	-171.4	-161.9	-82.8	5.6	113.7	N1195 R1197 S1201 C1202 E1246 I1247 D1250	N1195-R1199 PolarHBondContact O-N 3.17Å; R1197-R1199 VanDerWaalsContact C-N 3.32Å; R1197-R1199 PolarHBondContact O-N 2.92Å; R1199-S1201 VanDerWaalsContact C-N 3.33Å; R1199-C1202 PolarHBondContact O-SG 3.27Å; R1199-E1246 IonicContact CZ-OE2 2.62Å; R1199-E1246 IonicContact NH1-OE1 2.79Å; R1199-E1246 PolarHBondContact NH1-OE1 3.42Å; R1199-E1246 IonicContact NH1-OE2 3.87Å; R1199-E1246 PolarHBondContact NH1-OE2 3.4Å; R1199-I1247 HydrophobicContact CB-CD1 4.11Å; R1199-I1247 HydrophobicContact CB-CG1 3.69Å; R1199-D1250 IonicContact CZ-OD2 2.63Å; R1199-D1250 IonicContact NE-OD2 3.18Å; R1199-D1250 PolarHBondContact NE-OD2 3.22Å; R1199-D1250 VanDerWaalsContact NH2-CG 3.31Å; R1199-D1250 IonicContact NH2-OD1 3.18Å; R1199-D1250 PolarHBondContact NH2-OD1 2.63Å; R1199-D1250 IonicContact NH2-OD2 3.38Å; R1199-D1250 PolarHBondContact NH2-OD2 3.18Å
1200	F	75	Confident	68.4	Low	9 Å²	9	48.7 Å²	48.7	4%	0.039	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-12.3	175.8	-66.8	-91.5	0	0	0	113.9	R1176 C1179 F1196 R1197 D1198 C1202 L1203 Q1204 I1247	R1176-F1200 HydrophobicContact CB-CD1 3.7Å; R1176-F1200 HydrophobicContact CB-CE1 4.09Å; R1176-F1200 HydrophobicContact CB-CG 4.39Å; R1176-F1200 HydrophobicContact CG-CB 3.83Å; R1176-F1200 HydrophobicContact CG-CD1 3.59Å; R1176-F1200 HydrophobicContact CG-CE1 4.27Å; R1176-F1200 HydrophobicContact CG-CG 3.76Å; C1179-F1200 HydrophobicContact CB-CE1 4.19Å; C1179-F1200 HydrophobicContact CB-CE2 4.03Å; C1179-F1200 HydrophobicContact CB-CZ 3.43Å; C1179-F1200 VanDerWaalsContact CB-CZ 3.43Å; F1196-F1200 HydrophobicContact CD1-CE2 4.3Å; F1196-F1200 AromaticContact CE1-CE2 3.98Å; F1196-F1200 HydrophobicContact CE1-CE2 3.98Å; F1196-F1200 HydrophobicContact CZ-CE2 4.21Å; F1196-F1200 HydrophobicContact CZ-CZ 4.48Å; F1196-F1200 VanDerWaalsContact O-CD2 3.26Å; F1196-F1200 WeakPolarHBondContact O-CD2 3.29Å; F1196-F1200 WeakPolarHBondContact O-CE2 3.3Å; R1197-F1200 WeakPolarHBondContact O-CB 3.45Å; R1197-F1200 PolarHBondContact O-N 3.28Å; R1197-F1200 VanDerWaalsContact O-N 3.09Å; D1198-F1200 PolarHBondContact O-N 3.25Å; D1198-F1200 VanDerWaalsContact O-N 3.1Å; F1200-C1202 VanDerWaalsContact C-N 3.27Å; F1200-C1202 PolarHBondContact O-N 2.88Å; F1200-L1203 HydrophobicContact CD1-CD1 4.09Å; F1200-L1203 PolarHBondContact O-N 3.14Å; F1200-Q1204 PolarHBondContact O-N 3.49Å; F1200-I1247 HydrophobicContact CD1-CD1 3.92Å; F1200-I1247 HydrophobicContact CD2-CD1 4.15Å; F1200-I1247 HydrophobicContact CE1-CD1 3.74Å; F1200-I1247 HydrophobicContact CE1-CG2 4.44Å; F1200-I1247 HydrophobicContact CE2-CD1 3.96Å; F1200-I1247 HydrophobicContact CE2-CG1 4.16Å; F1200-I1247 HydrophobicContact CE2-CG2 4.08Å; F1200-I1247 HydrophobicContact CG-CD1 4.12Å; F1200-I1247 HydrophobicContact CZ-CD1 3.75Å; F1200-I1247 HydrophobicContact CZ-CG1 4.2Å; F1200-I1247 HydrophobicContact CZ-CG2 3.64Å
1201	S	66.9	Low	69	Low	44 Å²	44	53 Å²	53	31%	0.308	27%	0.267	S	S	.	.	H	α-helix	trans	-59.9	-36.2	-178.8	-175	0	0	0	0	112.5	D1198 R1199 Q1204 T1205	D1198-S1201 WeakPolarHBondContact O-CB 3.46Å; D1198-S1201 PolarHBondContact O-N 2.9Å; R1199-S1201 VanDerWaalsContact C-N 3.33Å; S1201-Q1204 PolarHBondContact O-N 3.49Å; S1201-T1205 PolarHBondContact O-N 3.22Å; S1201-T1205 PolarHBondContact O-OG1 3.1Å
1202	C	67.8	Low	69.5	Low	49 Å²	49	48 Å²	48	33%	0.331	26%	0.255	S	S	.	.	H	α-helix	trans	-67	-36	175.2	68	0	0	0	0	112.9	R1199 F1200 T1205 F1206 A1243	R1199-C1202 PolarHBondContact O-SG 3.27Å; F1200-C1202 VanDerWaalsContact C-N 3.27Å; F1200-C1202 PolarHBondContact O-N 2.88Å; C1202-T1205 WeakPolarHBondContact O-CB 3.34Å; C1202-T1205 PolarHBondContact O-N 3.45Å; C1202-F1206 WeakPolarHBondContact O-CB 3.15Å; C1202-F1206 PolarHBondContact O-N 3.16Å; C1202-A1243 WeakPolarHBondContact SG-CB 3.23Å
1203	L	70.2	Confident	69.5	Low	10 Å²	10	48.5 Å²	48.5	5%	0.052	25%	0.251	C	S	.	.	H	α-helix	trans	-71.6	-38.9	177.7	-58.2	-176.3	0	0	0	111	M1172 F1200 T1205 F1206 S1207 A1240 A1243 I1244 I1247	M1172-L1203 HydrophobicContact CE-CD2 4.07Å; M1172-L1203 HydrophobicContact SD-CD2 4.22Å; F1200-L1203 HydrophobicContact CD1-CD1 4.09Å; F1200-L1203 PolarHBondContact O-N 3.14Å; L1203-T1205 VanDerWaalsContact C-N 3.35Å; L1203-F1206 PolarHBondContact O-N 3.44Å; L1203-S1207 WeakPolarHBondContact O-CB 3.42Å; L1203-S1207 PolarHBondContact O-N 2.85Å; L1203-A1240 HydrophobicContact CD2-CB 3.66Å; L1203-A1243 HydrophobicContact CD2-CB 4.43Å; L1203-I1244 HydrophobicContact CD1-CG1 4.22Å; L1203-I1247 HydrophobicContact CD1-CD1 4.28Å
1204	Q	71.3	Confident	69.1	Low	52 Å²	52	53.6 Å²	53.6	24%	0.243	27%	0.27	C	S	.	.	H	α-helix	trans	-61.5	-44.3	172.2	-167.9	175.3	-0.5	0	0	111	F1200 S1201 F1206 S1207 S1208	F1200-Q1204 PolarHBondContact O-N 3.49Å; S1201-Q1204 PolarHBondContact O-N 3.49Å; Q1204-F1206 PolarHBondContact O-N 3.18Å; Q1204-S1207 PolarHBondContact O-N 3.32Å; Q1204-S1208 PolarHBondContact O-N 3.45Å; Q1204-S1208 PolarHBondContact O-OG 3.07Å
1205	T	67.5	Low	68.5	Low	85 Å²	85	55.5 Å²	55.5	52%	0.521	28%	0.283	S	S	.	.	H	α-helix	trans	-59.5	-43.1	174.1	-54.3	0	0	0	0	112	S1201 C1202 L1203 L1209	S1201-T1205 PolarHBondContact O-N 3.22Å; S1201-T1205 PolarHBondContact O-OG1 3.1Å; C1202-T1205 WeakPolarHBondContact O-CB 3.34Å; C1202-T1205 PolarHBondContact O-N 3.45Å; L1203-T1205 VanDerWaalsContact C-N 3.35Å; T1205-L1209 WeakPolarHBondContact O-CB 3.39Å; T1205-L1209 PolarHBondContact O-N 3.38Å; T1205-L1209 VanDerWaalsContact O-N 3.09Å
1206	F	70.1	Confident	68	Low	12 Å²	12	56.2 Å²	56.2	5%	0.053	29%	0.287	C	S	.	.	H	α-helix	trans	-63.8	-44.2	176.5	179.1	-103.6	0	0	0	112.3	L1165 M1172 C1202 L1203 Q1204 L1209 L1210 L1236 L1237	L1165-F1206 HydrophobicContact CD2-CZ 4.45Å; M1172-F1206 HydrophobicContact SD-CD1 4.1Å; M1172-F1206 HydrophobicContact SD-CE1 4.24Å; C1202-F1206 WeakPolarHBondContact O-CB 3.15Å; C1202-F1206 PolarHBondContact O-N 3.16Å; L1203-F1206 PolarHBondContact O-N 3.44Å; Q1204-F1206 PolarHBondContact O-N 3.18Å; F1206-L1209 PolarHBondContact O-N 2.72Å; F1206-L1210 HydrophobicContact CD1-CD1 3.99Å; F1206-L1210 HydrophobicContact CE1-CD1 3.48Å; F1206-L1210 VanDerWaalsContact CE1-CD1 3.48Å; F1206-L1210 HydrophobicContact CE2-CD1 4.34Å; F1206-L1210 HydrophobicContact CZ-CD1 3.68Å; F1206-L1210 HydrophobicContact CZ-CG 4.49Å; F1206-L1210 PolarHBondContact O-N 2.91Å; F1206-L1210 VanDerWaalsContact O-N 3.08Å; F1206-L1236 HydrophobicContact CD2-CB 4.15Å; F1206-L1236 HydrophobicContact CD2-CD2 4.16Å; F1206-L1236 HydrophobicContact CE2-CB 4.35Å; F1206-L1237 HydrophobicContact CE2-CD2 3.96Å; F1206-L1237 HydrophobicContact CE2-CG 4.47Å; F1206-L1237 HydrophobicContact CZ-CD2 3.7Å
1207	S	71.4	Confident	66.8	Low	10 Å²	10	59.4 Å²	59.4	7%	0.07	31%	0.31	C	S	.	.	H	α-helix	trans	-63.7	-47.2	177.7	-175.7	0	0	0	0	112.1	L1203 Q1204 L1209 L1210 R1211	L1203-S1207 WeakPolarHBondContact O-CB 3.42Å; L1203-S1207 PolarHBondContact O-N 2.85Å; Q1204-S1207 PolarHBondContact O-N 3.32Å; S1207-L1209 VanDerWaalsContact C-N 3.28Å; S1207-L1209 PolarHBondContact O-N 2.99Å; S1207-L1210 PolarHBondContact O-N 3.11Å; S1207-R1211 WeakPolarHBondContact O-CB 3.45Å; S1207-R1211 WeakPolarHBondContact O-CG 3.46Å; S1207-R1211 PolarHBondContact O-N 3.01Å
1208	S	68.3	Low	65.9	Low	75 Å²	75	62.4 Å²	62.4	52%	0.524	33%	0.328	S	S	.	.	H	α-helix	trans	-57.4	-40.8	174	-66.2	0	0	0	0	112.4	Q1204 L1210 R1211 S1212	Q1204-S1208 PolarHBondContact O-N 3.45Å; Q1204-S1208 PolarHBondContact O-OG 3.07Å; S1208-L1210 PolarHBondContact O-N 3.42Å; S1208-R1211 PolarHBondContact O-N 3.33Å; S1208-S1212 PolarHBondContact O-N 3.42Å
1209	L	69.2	Low	64.6	Low	58 Å²	58	63.3 Å²	63.3	30%	0.304	34%	0.34	S	S	.	.	H	α-helix	trans	-68.4	-30.3	179.7	-170.2	69.1	0	0	0	113.3	T1205 F1206 S1207 S1212 K1213 L1236	T1205-L1209 WeakPolarHBondContact O-CB 3.39Å; T1205-L1209 PolarHBondContact O-N 3.38Å; T1205-L1209 VanDerWaalsContact O-N 3.09Å; F1206-L1209 PolarHBondContact O-N 2.72Å; S1207-L1209 VanDerWaalsContact C-N 3.28Å; S1207-L1209 PolarHBondContact O-N 2.99Å; L1209-S1212 PolarHBondContact O-OG 3.48Å; L1209-K1213 VanDerWaalsContact CD1-CE 3.48Å; L1209-K1213 WeakPolarHBondContact O-CD 3Å; L1209-K1213 VanDerWaalsContact O-CE 3.25Å; L1209-K1213 WeakPolarHBondContact O-CE 3.28Å; L1209-K1213 VanDerWaalsContact O-CG 3.27Å; L1209-K1213 WeakPolarHBondContact O-CG 3.45Å; L1209-L1236 HydrophobicContact CD2-CD1 3.51Å; L1209-L1236 HydrophobicContact CD2-CD2 3.87Å; L1209-L1236 HydrophobicContact CD2-CG 4.35Å
1210	L	67.1	Low	63.1	Low	19 Å²	19	64.8 Å²	64.8	10%	0.099	35%	0.353	C	S	.	.	H	α-helix	trans	-77.8	-42.3	172.7	-73.4	171.4	0	0	0	111.5	L1162 L1165 A1169 F1206 S1207 S1208 K1213 R1214	L1162-L1210 HydrophobicContact CD1-CD2 4.3Å; L1165-L1210 HydrophobicContact CB-CD1 4.26Å; L1165-L1210 HydrophobicContact CB-CD2 4.36Å; A1169-L1210 HydrophobicContact CB-CD1 3.84Å; F1206-L1210 HydrophobicContact CD1-CD1 3.99Å; F1206-L1210 HydrophobicContact CE1-CD1 3.48Å; F1206-L1210 VanDerWaalsContact CE1-CD1 3.48Å; F1206-L1210 HydrophobicContact CE2-CD1 4.34Å; F1206-L1210 HydrophobicContact CZ-CD1 3.68Å; F1206-L1210 HydrophobicContact CZ-CG 4.49Å; F1206-L1210 PolarHBondContact O-N 2.91Å; F1206-L1210 VanDerWaalsContact O-N 3.08Å; S1207-L1210 PolarHBondContact O-N 3.11Å; S1208-L1210 PolarHBondContact O-N 3.42Å; L1210-K1213 PolarHBondContact O-N 3.17Å; L1210-R1214 PolarHBondContact O-N 3.06Å
1211	R	66.9	Low	61.7	Low	131 Å²	131	71.8 Å²	71.8	49%	0.494	39%	0.39	S	S	.	.	H	α-helix	trans	-65	-38.6	179.8	-73.6	175.8	167.3	-146.7	0.6	112.6	D1170 S1207 S1208 K1213 R1214 L1215	D1170-R1211 IonicContact OD1-CZ 3.14Å; D1170-R1211 IonicContact OD1-NE 2.76Å; D1170-R1211 PolarHBondContact OD1-NE 2.92Å; D1170-R1211 IonicContact OD1-NH2 3.71Å; D1170-R1211 PolarHBondContact OD1-NH2 3.17Å; D1170-R1211 IonicContact OD2-NH2 2.72Å; S1207-R1211 WeakPolarHBondContact O-CB 3.45Å; S1207-R1211 WeakPolarHBondContact O-CG 3.46Å; S1207-R1211 PolarHBondContact O-N 3.01Å; S1208-R1211 PolarHBondContact O-N 3.33Å; R1211-K1213 VanDerWaalsContact C-N 3.29Å; R1211-K1213 PolarHBondContact O-N 3.11Å; R1211-R1214 WeakPolarHBondContact O-CB 3.34Å; R1211-R1214 PolarHBondContact O-N 2.66Å; R1211-L1215 PolarHBondContact O-N 3.11Å
1212	S	65.7	Low	60.4	Low	49 Å²	49	75.2 Å²	75.2	34%	0.343	41%	0.405	S	S	.	.	H	α-helix	trans	-62.5	-37.7	173.5	82.5	0	0	0	0	111.9	S1208 L1209 L1215 D1216	S1208-S1212 PolarHBondContact O-N 3.42Å; L1209-S1212 PolarHBondContact O-OG 3.48Å; S1212-L1215 WeakPolarHBondContact O-CA 3.46Å; S1212-L1215 WeakPolarHBondContact O-CB 3.24Å; S1212-L1215 PolarHBondContact O-N 3.49Å; S1212-L1215 VanDerWaalsContact O-N 3.1Å; S1212-D1216 PolarHBondContact O-N 3.12Å
1213	K	62.6	Low	59.3	Low	45 Å²	45	79 Å²	79	20%	0.196	43%	0.427	C	S	.	.	H	α-helix	trans	-78.2	-22.3	-176.8	-66.7	171.2	-163.4	-168.1	0	113.2	L1209 L1210 R1211 L1215 S1217 Y1229	L1209-K1213 VanDerWaalsContact CD1-CE 3.48Å; L1209-K1213 WeakPolarHBondContact O-CD 3Å; L1209-K1213 VanDerWaalsContact O-CE 3.25Å; L1209-K1213 WeakPolarHBondContact O-CE 3.28Å; L1209-K1213 VanDerWaalsContact O-CG 3.27Å; L1209-K1213 WeakPolarHBondContact O-CG 3.45Å; L1210-K1213 PolarHBondContact O-N 3.17Å; R1211-K1213 VanDerWaalsContact C-N 3.29Å; R1211-K1213 PolarHBondContact O-N 3.11Å; K1213-L1215 VanDerWaalsContact C-N 3.31Å; K1213-S1217 VanDerWaalsContact O-CB 3.28Å; K1213-S1217 WeakPolarHBondContact O-CB 3.29Å; K1213-S1217 PolarHBondContact O-N 3.19Å; K1213-Y1229 HydrophobicContact CD-CE1 3.83Å; K1213-Y1229 VanDerWaalsContact CD-OH 3.28Å; K1213-Y1229 WeakPolarHBondContact CD-OH 3.38Å; K1213-Y1229 WeakPolarHBondContact CE-OH 3.28Å; K1213-Y1229 PolarHBondContact NZ-OH 3.46Å
1214	R	62.8	Low	57.9	Low	134 Å²	134	82.6 Å²	82.6	51%	0.506	45%	0.453	S	S	.	.	H	α-helix	trans	-60.4	-42.7	163.9	-168.4	-178.1	-175.4	160.1	1.5	110.4	I1166 L1210 R1211 I1218	I1166-R1214 HydrophobicContact CD1-CB 4.26Å; I1166-R1214 HydrophobicContact CD1-CG 4.21Å; L1210-R1214 PolarHBondContact O-N 3.06Å; R1211-R1214 WeakPolarHBondContact O-CB 3.34Å; R1211-R1214 PolarHBondContact O-N 2.66Å; R1214-I1218 HydrophobicContact CG-CD1 4.09Å; R1214-I1218 WeakPolarHBondContact O-CD1 3.29Å; R1214-I1218 WeakPolarHBondContact O-CG1 3.22Å; R1214-I1218 PolarHBondContact O-N 3.1Å
1215	L	53.6	Low	56.3	Low	112 Å²	112	85.8 Å²	85.8	59%	0.586	47%	0.472	S	S	*	.	H	α-helix	trans	-67.8	-48.4	174.7	-64.8	164.7	0	0	0	111.3	R1211 S1212 K1213 S1217 I1218 C1219	R1211-L1215 PolarHBondContact O-N 3.11Å; S1212-L1215 WeakPolarHBondContact O-CA 3.46Å; S1212-L1215 WeakPolarHBondContact O-CB 3.24Å; S1212-L1215 PolarHBondContact O-N 3.49Å; S1212-L1215 VanDerWaalsContact O-N 3.1Å; K1213-L1215 VanDerWaalsContact C-N 3.31Å; L1215-S1217 PolarHBondContact O-N 2.75Å; L1215-I1218 PolarHBondContact O-N 3.39Å; L1215-C1219 PolarHBondContact O-N 2.97Å; L1215-C1219 PolarHBondContact O-SG 2.95Å; L1215-C1219 VanDerWaalsContact O-SG 3.39Å
1216	D	55.5	Low	54.9	Low	87 Å²	87	87.9 Å²	87.9	47%	0.465	48%	0.479	S	S	.	.	H	α-helix	trans	-52.9	-41	177.1	-65.8	-41.2	0	0	0	112.3	S1212 N1220	S1212-D1216 PolarHBondContact O-N 3.12Å; D1216-N1220 WeakPolarHBondContact O-CB 3.36Å; D1216-N1220 PolarHBondContact O-N 3.24Å; D1216-N1220 PolarHBondContact O-ND2 3Å
1217	S	51	Low	53.4	Low	74 Å²	74	92 Å²	92	52%	0.517	51%	0.51	S	S	.	.	H	α-helix	trans	-78.9	-14.4	179.7	-170.5	0	0	0	0	114.7	K1213 L1215	K1213-S1217 VanDerWaalsContact O-CB 3.28Å; K1213-S1217 WeakPolarHBondContact O-CB 3.29Å; K1213-S1217 PolarHBondContact O-N 3.19Å; L1215-S1217 PolarHBondContact O-N 2.75Å
1218	I	54.4	Low	51.8	Low	114 Å²	114	100.3 Å²	100.3	59%	0.585	55%	0.545	S	S	*	.	H	α-helix	trans	-90	-38	171.9	-72.1	165.6	0	0	0	109.8	R1214 L1215	R1214-I1218 HydrophobicContact CG-CD1 4.09Å; R1214-I1218 WeakPolarHBondContact O-CD1 3.29Å; R1214-I1218 WeakPolarHBondContact O-CG1 3.22Å; R1214-I1218 PolarHBondContact O-N 3.1Å; L1215-I1218 PolarHBondContact O-N 3.39Å
1219	C	46.1	Very low	50.5	Low	100 Å²	100	101.2 Å²	101.2	68%	0.676	54%	0.537	S	S	*	.	H	α-helix	trans	-77.2	-23.2	179.6	-63.1	0	0	0	0	113.6	L1215	L1215-C1219 PolarHBondContact O-N 2.97Å; L1215-C1219 PolarHBondContact O-SG 2.95Å; L1215-C1219 VanDerWaalsContact O-SG 3.39Å
1220	N	42.8	Very low	49.5	Very low	92 Å²	92	103.6 Å²	103.6	49%	0.492	55%	0.55	S	S	.	.			trans	-122.1	105.2	-178.8	-60.3	-87.6	0	0	0	111.6	D1216 N1222	D1216-N1220 WeakPolarHBondContact O-CB 3.36Å; D1216-N1220 PolarHBondContact O-N 3.24Å; D1216-N1220 PolarHBondContact O-ND2 3Å; N1220-N1222 PolarHBondContact O-N 3.07Å
1221	N	43.8	Very low	48.5	Very low	156 Å²	156	111.1 Å²	111.1	83%	0.834	58%	0.582	S	S	*	*			trans	-66.2	18.1	173.6	-74.6	-32	0	0	0	114.8
1222	N	40.7	Very low	47.8	Very low	116 Å²	116	110.5 Å²	110.5	62%	0.62	59%	0.588	S	S	*	*			trans	-104.5	84.2	-174.5	-77.3	-48.7	0	0	0	111.6	N1220 S1224	N1220-N1222 PolarHBondContact O-N 3.07Å; N1222-S1224 PolarHBondContact O-N 3.26Å
1223	T	43.7	Very low	47.5	Very low	127 Å²	127	110.4 Å²	110.4	78%	0.779	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-65.8	-4.6	-179.6	51.8	0	0	0	0	115.2	N1225	T1223-N1225 PolarHBondContact O-N 3.34Å
1224	S	40.6	Very low	47.5	Very low	87 Å²	87	110.3 Å²	110.3	61%	0.608	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-75.3	-18.8	-169.4	52.6	0	0	0	0	115.9	N1222	N1222-S1224 PolarHBondContact O-N 3.26Å
1225	N	38.5	Very low	47.8	Very low	118 Å²	118	108.6 Å²	108.6	63%	0.631	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-88.8	-1.6	-173.2	-84.1	-50	0	0	0	115.7	T1223 S1227	T1223-N1225 PolarHBondContact O-N 3.34Å; N1225-S1227 PolarHBondContact O-N 3.06Å; N1225-S1227 VanDerWaalsContact O-N 3.16Å
1226	L	38	Very low	48.5	Very low	129 Å²	129	105.5 Å²	105.5	68%	0.675	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-65.8	-15.6	-176.2	-108.1	69	0	0	0	115.1	Y1229	L1226-Y1229 WeakPolarHBondContact O-CB 3.49Å; L1226-Y1229 PolarHBondContact O-N 3.07Å
1227	S	38.4	Very low	49.4	Very low	100 Å²	100	101.7 Å²	101.7	70%	0.699	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-71.6	-31.8	-173.6	59.9	0	0	0	0	114.4	N1225 Y1229	N1225-S1227 PolarHBondContact O-N 3.06Å; N1225-S1227 VanDerWaalsContact O-N 3.16Å; S1227-Y1229 PolarHBondContact O-N 3.05Å
1228	K	38	Very low	50.8	Low	184 Å²	184	102.8 Å²	102.8	80%	0.8	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-74.4	-11.2	177.3	-77.6	179.6	176.5	172.9	0	113.6
1229	Y	41.4	Very low	51.8	Low	93 Å²	93	101.6 Å²	101.6	37%	0.365	54%	0.542	S	S	.	.	G	3₁₀ helix	trans	-77.8	-24.4	-170.9	-111.1	-100.6	0	0	0	115	K1213 L1226 S1227 K1231 N1232	K1213-Y1229 HydrophobicContact CD-CE1 3.83Å; K1213-Y1229 VanDerWaalsContact CD-OH 3.28Å; K1213-Y1229 WeakPolarHBondContact CD-OH 3.38Å; K1213-Y1229 WeakPolarHBondContact CE-OH 3.28Å; K1213-Y1229 PolarHBondContact NZ-OH 3.46Å; L1226-Y1229 WeakPolarHBondContact O-CB 3.49Å; L1226-Y1229 PolarHBondContact O-N 3.07Å; S1227-Y1229 PolarHBondContact O-N 3.05Å; Y1229-K1231 VanDerWaalsContact C-N 3.3Å; Y1229-K1231 PolarHBondContact O-N 2.93Å; Y1229-K1231 VanDerWaalsContact O-N 3.13Å; Y1229-N1232 PolarHBondContact O-N 3.37Å
1230	N	47.7	Very low	53.5	Low	108 Å²	108	96.9 Å²	96.9	58%	0.578	51%	0.51	S	S	*	.	H	α-helix	trans	-64.2	-22.9	-165	-94.9	-3.5	0	0	0	116.1
1231	K	46.9	Very low	55.5	Low	177 Å²	177	94.2 Å²	94.2	77%	0.77	50%	0.495	S	S	*	.	H	α-helix	trans	-84.3	-26.7	-179.6	-75.4	-171.5	175	-176.9	0	114.6	Y1229 T1234	Y1229-K1231 VanDerWaalsContact C-N 3.3Å; Y1229-K1231 PolarHBondContact O-N 2.93Å; Y1229-K1231 VanDerWaalsContact O-N 3.13Å; K1231-T1234 PolarHBondContact O-OG1 3.06Å
1232	N	51.9	Low	57.5	Low	118 Å²	118	91 Å²	91	63%	0.631	48%	0.478	S	S	*	.	H	α-helix	trans	-86.3	-32.6	-177.1	-68.5	5.4	0	0	0	111.3	Y1229 T1234 N1235	Y1229-N1232 PolarHBondContact O-N 3.37Å; N1232-T1234 VanDerWaalsContact C-N 3.29Å; N1232-T1234 PolarHBondContact O-N 2.89Å; N1232-N1235 PolarHBondContact O-N 3.23Å
1233	N	58.7	Low	59.6	Low	47 Å²	47	85.7 Å²	85.7	25%	0.251	45%	0.45	S	S	.	.	H	α-helix	trans	-64.2	-29.9	177.8	-73.8	1	0	0	0	113.1	N1235 L1237	N1233-N1235 VanDerWaalsContact C-N 3.25Å; N1233-N1235 PolarHBondContact O-N 2.89Å; N1233-L1237 WeakPolarHBondContact O-CB 3.48Å; N1233-L1237 VanDerWaalsContact O-CG 3.29Å; N1233-L1237 WeakPolarHBondContact O-CG 3.36Å; N1233-L1237 PolarHBondContact O-N 3.39Å
1234	T	63.1	Low	61.6	Low	43 Å²	43	79.7 Å²	79.7	26%	0.264	41%	0.413	S	S	.	.	H	α-helix	trans	-68.1	-22.5	-178.9	52.3	0	0	0	0	114	K1231 N1232 K1238	K1231-T1234 PolarHBondContact O-OG1 3.06Å; N1232-T1234 VanDerWaalsContact C-N 3.29Å; N1232-T1234 PolarHBondContact O-N 2.89Å; T1234-K1238 VanDerWaalsContact O-CD 3.3Å; T1234-K1238 WeakPolarHBondContact O-CD 3.37Å; T1234-K1238 VanDerWaalsContact O-CG 3.27Å; T1234-K1238 WeakPolarHBondContact O-CG 3.36Å
1235	N	69	Low	63.9	Low	99 Å²	99	79.6 Å²	79.6	53%	0.529	40%	0.402	S	S	.	.	H	α-helix	trans	-82	-54.7	175.7	-66	2	0	0	0	109.3	N1232 N1233 L1237 K1238 D1239	N1232-N1235 PolarHBondContact O-N 3.23Å; N1233-N1235 VanDerWaalsContact C-N 3.25Å; N1233-N1235 PolarHBondContact O-N 2.89Å; N1235-L1237 VanDerWaalsContact C-N 3.26Å; N1235-L1237 PolarHBondContact O-N 3.33Å; N1235-L1237 VanDerWaalsContact O-N 3.15Å; N1235-K1238 CarbonylContact O-C 3.56Å; N1235-K1238 WeakPolarHBondContact O-CA 3.36Å; N1235-K1238 WeakPolarHBondContact O-CB 3.38Å; N1235-K1238 PolarHBondContact O-N 3.34Å; N1235-D1239 VanDerWaalsContact O-CG 3.22Å; N1235-D1239 PolarHBondContact O-N 2.79Å
1236	L	69.1	Low	66.2	Low	46 Å²	46	78.4 Å²	78.4	24%	0.241	39%	0.392	C	S	.	.	H	α-helix	trans	-51.2	-40	177	-86.2	144.3	0	0	0	114	F1206 L1209 A1240	F1206-L1236 HydrophobicContact CD2-CB 4.15Å; F1206-L1236 HydrophobicContact CD2-CD2 4.16Å; F1206-L1236 HydrophobicContact CE2-CB 4.35Å; L1209-L1236 HydrophobicContact CD2-CD1 3.51Å; L1209-L1236 HydrophobicContact CD2-CD2 3.87Å; L1209-L1236 HydrophobicContact CD2-CG 4.35Å; L1236-A1240 PolarHBondContact O-N 3.33Å; L1236-A1240 VanDerWaalsContact O-N 3.12Å
1237	L	74.8	Confident	68.4	Low	8 Å²	8	72.2 Å²	72.2	4%	0.042	36%	0.36	C	S	.	.	H	α-helix	trans	-67.6	-36.9	175.8	-71.9	168.8	0	0	0	112.8	L1129 I1133 L1165 F1206 N1233 N1235 E1241	L1129-L1237 HydrophobicContact CD1-CD2 3.68Å; I1133-L1237 HydrophobicContact CD1-CB 4.07Å; I1133-L1237 HydrophobicContact CG1-CB 3.93Å; I1133-L1237 HydrophobicContact CG1-CD1 4.27Å; L1165-L1237 HydrophobicContact CD2-CD2 3.86Å; F1206-L1237 HydrophobicContact CE2-CD2 3.96Å; F1206-L1237 HydrophobicContact CE2-CG 4.47Å; F1206-L1237 HydrophobicContact CZ-CD2 3.7Å; N1233-L1237 WeakPolarHBondContact O-CB 3.48Å; N1233-L1237 VanDerWaalsContact O-CG 3.29Å; N1233-L1237 WeakPolarHBondContact O-CG 3.36Å; N1233-L1237 PolarHBondContact O-N 3.39Å; N1235-L1237 VanDerWaalsContact C-N 3.26Å; N1235-L1237 PolarHBondContact O-N 3.33Å; N1235-L1237 VanDerWaalsContact O-N 3.15Å; L1237-E1241 WeakPolarHBondContact O-CB 3.38Å; L1237-E1241 PolarHBondContact O-N 2.9Å
1238	K	79.2	Confident	70.8	Confident	97 Å²	97	68.7 Å²	68.7	42%	0.422	33%	0.333	S	S	.	.	H	α-helix	trans	-75.2	-34.4	176.8	-71.2	174.3	-174.4	175.5	0	112.1	T1234 N1235 A1240 E1241 N1242	T1234-K1238 VanDerWaalsContact O-CD 3.3Å; T1234-K1238 WeakPolarHBondContact O-CD 3.37Å; T1234-K1238 VanDerWaalsContact O-CG 3.27Å; T1234-K1238 WeakPolarHBondContact O-CG 3.36Å; N1235-K1238 CarbonylContact O-C 3.56Å; N1235-K1238 WeakPolarHBondContact O-CA 3.36Å; N1235-K1238 WeakPolarHBondContact O-CB 3.38Å; N1235-K1238 PolarHBondContact O-N 3.34Å; K1238-A1240 VanDerWaalsContact C-N 3.34Å; K1238-E1241 WeakPolarHBondContact O-CB 3.44Å; K1238-E1241 PolarHBondContact O-N 3.07Å; K1238-N1242 WeakPolarHBondContact O-CB 3.5Å; K1238-N1242 PolarHBondContact O-N 3.42Å; K1238-N1242 PolarHBondContact O-ND2 2.98Å; K1238-N1242 VanDerWaalsContact O-ND2 3.1Å
1239	D	76.3	Confident	73.2	Confident	88 Å²	88	64 Å²	64	47%	0.471	32%	0.317	S	S	.	.	H	α-helix	trans	-62.7	-43.4	174.1	-60.7	-33.3	0	0	0	110.2	N1235 A1243	N1235-D1239 VanDerWaalsContact O-CG 3.22Å; N1235-D1239 PolarHBondContact O-N 2.79Å; D1239-A1243 WeakPolarHBondContact O-CB 3.36Å; D1239-A1243 PolarHBondContact O-N 2.91Å
1240	A	80.3	Confident	75.1	Confident	2 Å²	2	60.6 Å²	60.6	2%	0.017	31%	0.305	C	S	.	.	H	α-helix	trans	-65.3	-39.2	172.4	0	0	0	0	0	113.3	L1129 M1172 L1203 L1236 K1238 A1243 I1244	L1129-A1240 HydrophobicContact CD2-CB 4.05Å; M1172-A1240 HydrophobicContact CE-CB 4.12Å; L1203-A1240 HydrophobicContact CD2-CB 3.66Å; L1236-A1240 PolarHBondContact O-N 3.33Å; L1236-A1240 VanDerWaalsContact O-N 3.12Å; K1238-A1240 VanDerWaalsContact C-N 3.34Å; A1240-A1243 PolarHBondContact O-N 3.04Å; A1240-I1244 WeakPolarHBondContact O-CG1 3.4Å; A1240-I1244 PolarHBondContact O-N 3.49Å; A1240-I1244 VanDerWaalsContact O-N 3.09Å
1241	E	85.1	Confident	76.9	Confident	35 Å²	35	55.5 Å²	55.5	16%	0.164	28%	0.278	C	S	.	.	H	α-helix	trans	-62.4	-45.7	176.4	-169.6	-162.1	138.3	0	0	111.6	L1126 L1129 I1133 L1237 K1238 K1245	L1126-E1241 HydrophobicContact CD1-CG 3.84Å; L1129-E1241 HydrophobicContact CD2-CB 3.91Å; I1133-E1241 HydrophobicContact CD1-CB 4.44Å; I1133-E1241 WeakPolarHBondContact CD1-OE2 3.48Å; L1237-E1241 WeakPolarHBondContact O-CB 3.38Å; L1237-E1241 PolarHBondContact O-N 2.9Å; K1238-E1241 WeakPolarHBondContact O-CB 3.44Å; K1238-E1241 PolarHBondContact O-N 3.07Å; E1241-K1245 HydrophobicContact CG-CD 4.43Å; E1241-K1245 WeakPolarHBondContact O-CG 3.01Å; E1241-K1245 PolarHBondContact O-N 2.95Å; E1241-K1245 IonicContact OE1-NZ 2.73Å; E1241-K1245 PolarHBondContact OE1-NZ 3.32Å
1242	N	85.7	Confident	78.6	Confident	89 Å²	89	50.8 Å²	50.8	48%	0.476	26%	0.261	S	S	.	.	H	α-helix	trans	-62.1	-47.8	175.6	-71.8	-33.1	0	0	0	111	K1238 I1244 K1245 E1246	K1238-N1242 WeakPolarHBondContact O-CB 3.5Å; K1238-N1242 PolarHBondContact O-N 3.42Å; K1238-N1242 PolarHBondContact O-ND2 2.98Å; K1238-N1242 VanDerWaalsContact O-ND2 3.1Å; N1242-I1244 PolarHBondContact O-N 3.39Å; N1242-K1245 WeakPolarHBondContact O-CB 3.46Å; N1242-K1245 PolarHBondContact O-N 2.65Å; N1242-K1245 VanDerWaalsContact O-N 3.16Å; N1242-E1246 WeakPolarHBondContact O-CG 3.41Å; N1242-E1246 PolarHBondContact O-N 3.21Å
1243	A	84.5	Confident	79.7	Confident	5 Å²	5	51 Å²	51	4%	0.041	26%	0.256	C	S	.	.	H	α-helix	trans	-60.3	-42.9	-179.1	0	0	0	0	0	113.1	C1202 L1203 D1239 A1240 K1245 E1246 I1247	C1202-A1243 WeakPolarHBondContact SG-CB 3.23Å; L1203-A1243 HydrophobicContact CD2-CB 4.43Å; D1239-A1243 WeakPolarHBondContact O-CB 3.36Å; D1239-A1243 PolarHBondContact O-N 2.91Å; A1240-A1243 PolarHBondContact O-N 3.04Å; A1243-K1245 PolarHBondContact O-N 2.91Å; A1243-E1246 PolarHBondContact O-N 3.49Å; A1243-I1247 WeakPolarHBondContact O-CD1 3.43Å; A1243-I1247 VanDerWaalsContact O-CG1 3.23Å; A1243-I1247 WeakPolarHBondContact O-CG1 3.43Å; A1243-I1247 PolarHBondContact O-N 2.65Å
1244	I	87.2	Confident	80.3	Confident	1 Å²	1	50 Å²	50	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-63.1	-43.2	175.6	-67.7	165.4	0	0	0	110.9	L1122 I1125 L1126 L1129 M1172 L1203 A1240 N1242 E1246 I1247 I1248	L1122-I1244 HydrophobicContact CB-CG2 4.24Å; L1122-I1244 HydrophobicContact CD2-CG2 4.32Å; I1125-I1244 HydrophobicContact CG2-CD1 3.67Å; L1126-I1244 HydrophobicContact CB-CG2 3.95Å; L1126-I1244 HydrophobicContact CD1-CB 4.31Å; L1126-I1244 HydrophobicContact CD1-CG2 4.22Å; L1126-I1244 HydrophobicContact CD2-CG2 4.48Å; L1126-I1244 HydrophobicContact CG-CG2 4.45Å; L1129-I1244 HydrophobicContact CD2-CD1 4.13Å; M1172-I1244 HydrophobicContact CE-CD1 3.73Å; L1203-I1244 HydrophobicContact CD1-CG1 4.22Å; A1240-I1244 WeakPolarHBondContact O-CG1 3.4Å; A1240-I1244 PolarHBondContact O-N 3.49Å; A1240-I1244 VanDerWaalsContact O-N 3.09Å; N1242-I1244 PolarHBondContact O-N 3.39Å; I1244-E1246 VanDerWaalsContact C-N 3.29Å; I1244-E1246 PolarHBondContact O-N 3.08Å; I1244-I1247 PolarHBondContact O-N 3.19Å; I1244-I1248 HydrophobicContact CG2-CD1 3.86Å; I1244-I1248 HydrophobicContact CG2-CG1 4.41Å; I1244-I1248 VanDerWaalsContact O-CG1 3.3Å; I1244-I1248 WeakPolarHBondContact O-CG1 3.34Å; I1244-I1248 PolarHBondContact O-N 3.47Å
1245	K	88.9	Confident	80.1	Confident	85 Å²	85	53 Å²	53	37%	0.37	27%	0.269	S	S	.	.	H	α-helix	trans	-60	-39.5	175.8	-73.6	170.1	173.8	174.5	0	111.7	L1126 E1130 E1241 N1242 A1243 N1249	L1126-K1245 HydrophobicContact CD1-CG 4.2Å; L1126-K1245 HydrophobicContact CD2-CG 3.77Å; E1130-K1245 IonicContact OE1-NZ 2.87Å; E1241-K1245 HydrophobicContact CG-CD 4.43Å; E1241-K1245 WeakPolarHBondContact O-CG 3.01Å; E1241-K1245 PolarHBondContact O-N 2.95Å; E1241-K1245 IonicContact OE1-NZ 2.73Å; E1241-K1245 PolarHBondContact OE1-NZ 3.32Å; N1242-K1245 WeakPolarHBondContact O-CB 3.46Å; N1242-K1245 PolarHBondContact O-N 2.65Å; N1242-K1245 VanDerWaalsContact O-N 3.16Å; A1243-K1245 PolarHBondContact O-N 2.91Å; K1245-N1249 WeakPolarHBondContact O-CB 3.47Å; K1245-N1249 PolarHBondContact O-N 3.36Å; K1245-N1249 VanDerWaalsContact O-N 3.15Å
1246	E	85.3	Confident	79.5	Confident	92 Å²	92	52 Å²	52	43%	0.43	26%	0.263	S	S	.	.	H	α-helix	trans	-69.8	-39.8	175.3	-69.8	-166.5	136.6	0	0	113.7	R1199 N1242 A1243 I1244 N1249 D1250	R1199-E1246 IonicContact CZ-OE2 2.62Å; R1199-E1246 IonicContact NH1-OE1 2.79Å; R1199-E1246 PolarHBondContact NH1-OE1 3.42Å; R1199-E1246 IonicContact NH1-OE2 3.87Å; R1199-E1246 PolarHBondContact NH1-OE2 3.4Å; N1242-E1246 WeakPolarHBondContact O-CG 3.41Å; N1242-E1246 PolarHBondContact O-N 3.21Å; A1243-E1246 PolarHBondContact O-N 3.49Å; I1244-E1246 VanDerWaalsContact C-N 3.29Å; I1244-E1246 PolarHBondContact O-N 3.08Å; E1246-N1249 WeakPolarHBondContact O-CB 3.44Å; E1246-N1249 PolarHBondContact O-N 2.69Å; E1246-D1250 PolarHBondContact O-N 2.91Å
1247	I	85.4	Confident	78.3	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.9	-41.1	176.2	-67.7	158.3	0	0	0	110.5	L1122 F1196 R1199 F1200 L1203 A1243 I1244 N1249 D1250 L1251	L1122-I1247 HydrophobicContact CD1-CG2 3.67Å; L1122-I1247 HydrophobicContact CD2-CG2 4.41Å; F1196-I1247 HydrophobicContact CE2-CG2 3.98Å; F1196-I1247 HydrophobicContact CZ-CG2 4.18Å; R1199-I1247 HydrophobicContact CB-CD1 4.11Å; R1199-I1247 HydrophobicContact CB-CG1 3.69Å; F1200-I1247 HydrophobicContact CD1-CD1 3.92Å; F1200-I1247 HydrophobicContact CD2-CD1 4.15Å; F1200-I1247 HydrophobicContact CE1-CD1 3.74Å; F1200-I1247 HydrophobicContact CE1-CG2 4.44Å; F1200-I1247 HydrophobicContact CE2-CD1 3.96Å; F1200-I1247 HydrophobicContact CE2-CG1 4.16Å; F1200-I1247 HydrophobicContact CE2-CG2 4.08Å; F1200-I1247 HydrophobicContact CG-CD1 4.12Å; F1200-I1247 HydrophobicContact CZ-CD1 3.75Å; F1200-I1247 HydrophobicContact CZ-CG1 4.2Å; F1200-I1247 HydrophobicContact CZ-CG2 3.64Å; L1203-I1247 HydrophobicContact CD1-CD1 4.28Å; A1243-I1247 WeakPolarHBondContact O-CD1 3.43Å; A1243-I1247 VanDerWaalsContact O-CG1 3.23Å; A1243-I1247 WeakPolarHBondContact O-CG1 3.43Å; A1243-I1247 PolarHBondContact O-N 2.65Å; I1244-I1247 PolarHBondContact O-N 3.19Å; I1247-N1249 VanDerWaalsContact C-N 3.33Å; I1247-N1249 PolarHBondContact O-N 3.3Å; I1247-D1250 PolarHBondContact O-N 3.03Å; I1247-L1251 PolarHBondContact O-N 3.03Å
1248	I	89.2	Confident	76.5	Confident	26 Å²	26	60.6 Å²	60.6	13%	0.133	31%	0.314	C	S	.	.	H	α-helix	trans	-61.7	-42	174.7	-67.7	168.8	0	0	0	110.9	L1122 L1126 I1244 L1251 D1252	L1122-I1248 HydrophobicContact CB-CD1 3.92Å; L1122-I1248 HydrophobicContact CB-CG1 3.76Å; L1122-I1248 HydrophobicContact CD1-CG1 4.01Å; L1126-I1248 HydrophobicContact CD2-CD1 4.33Å; I1244-I1248 HydrophobicContact CG2-CD1 3.86Å; I1244-I1248 HydrophobicContact CG2-CG1 4.41Å; I1244-I1248 VanDerWaalsContact O-CG1 3.3Å; I1244-I1248 WeakPolarHBondContact O-CG1 3.34Å; I1244-I1248 PolarHBondContact O-N 3.47Å; I1248-L1251 PolarHBondContact O-N 2.89Å; I1248-D1252 PolarHBondContact O-N 3.09Å
1249	N	86.9	Confident	74.2	Confident	85 Å²	85	63 Å²	63	46%	0.455	33%	0.332	S	S	.	.	H	α-helix	trans	-65.9	-37.5	176.6	-177.6	24.4	0	0	0	112.6	K1245 E1246 I1247 D1252 K1253	K1245-N1249 WeakPolarHBondContact O-CB 3.47Å; K1245-N1249 PolarHBondContact O-N 3.36Å; K1245-N1249 VanDerWaalsContact O-N 3.15Å; E1246-N1249 WeakPolarHBondContact O-CB 3.44Å; E1246-N1249 PolarHBondContact O-N 2.69Å; I1247-N1249 VanDerWaalsContact C-N 3.33Å; I1247-N1249 PolarHBondContact O-N 3.3Å; N1249-D1252 PolarHBondContact O-N 3.17Å; N1249-K1253 PolarHBondContact ND2-NZ 2.94Å; N1249-K1253 VanDerWaalsContact ND2-NZ 3.15Å; N1249-K1253 VanDerWaalsContact O-CE 3.24Å; N1249-K1253 WeakPolarHBondContact O-CE 3.19Å; N1249-K1253 WeakPolarHBondContact O-CG 3.24Å; N1249-K1253 PolarHBondContact O-N 3.35Å; N1249-K1253 WeakPolarHBondContact OD1-CE 3.42Å; N1249-K1253 PolarHBondContact OD1-NZ 3.34Å
1250	D	82.3	Confident	71.9	Confident	22 Å²	22	64.8 Å²	64.8	12%	0.118	35%	0.346	C	S	.	.	H	α-helix	trans	-75.1	-34.3	175.9	-82.4	8.7	0	0	0	112.9	F1196 R1199 E1246 I1247 D1252 K1253 L1254	F1196-D1250 HydrophobicContact CD2-CB 4.1Å; R1199-D1250 IonicContact CZ-OD2 2.63Å; R1199-D1250 IonicContact NE-OD2 3.18Å; R1199-D1250 PolarHBondContact NE-OD2 3.22Å; R1199-D1250 VanDerWaalsContact NH2-CG 3.31Å; R1199-D1250 IonicContact NH2-OD1 3.18Å; R1199-D1250 PolarHBondContact NH2-OD1 2.63Å; R1199-D1250 IonicContact NH2-OD2 3.38Å; R1199-D1250 PolarHBondContact NH2-OD2 3.18Å; E1246-D1250 PolarHBondContact O-N 2.91Å; I1247-D1250 PolarHBondContact O-N 3.03Å; D1250-D1252 VanDerWaalsContact C-N 3.26Å; D1250-D1252 PolarHBondContact O-N 2.84Å; D1250-K1253 PolarHBondContact O-N 2.65Å; D1250-K1253 IonicContact OD1-NZ 2.68Å; D1250-K1253 PolarHBondContact OD1-NZ 2.9Å; D1250-L1254 PolarHBondContact O-N 3.17Å
1251	L	84.3	Confident	69.4	Low	0 Å²	0	71.7 Å²	71.7	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-55.6	-43.4	168.4	-80.5	176.8	0	0	0	111	K1115 L1118 K1119 L1122 Y1182 F1196 I1247 I1248 K1253 L1254	K1115-L1251 WeakPolarHBondContact CE-O 3.4Å; K1115-L1251 PolarHBondContact NZ-O 2.73Å; K1115-L1251 VanDerWaalsContact NZ-O 3.1Å; L1118-L1251 HydrophobicContact CB-CD1 3.85Å; L1118-L1251 HydrophobicContact CD1-CD2 4.18Å; K1119-L1251 HydrophobicContact CG-CB 4.28Å; K1119-L1251 HydrophobicContact CG-CD1 3.87Å; L1122-L1251 HydrophobicContact CD1-CD1 3.58Å; Y1182-L1251 HydrophobicContact CD1-CD2 3.93Å; Y1182-L1251 HydrophobicContact CE1-CD2 3.76Å; F1196-L1251 HydrophobicContact CE2-CD2 3.86Å; F1196-L1251 HydrophobicContact CE2-CG 3.9Å; F1196-L1251 HydrophobicContact CZ-CD2 3.69Å; F1196-L1251 HydrophobicContact CZ-CG 4.08Å; I1247-L1251 PolarHBondContact O-N 3.03Å; I1248-L1251 PolarHBondContact O-N 2.89Å; L1251-K1253 VanDerWaalsContact C-N 3.28Å; L1251-K1253 PolarHBondContact O-N 3.18Å; L1251-L1254 HydrophobicContact CD2-CD1 4.42Å; L1251-L1254 PolarHBondContact O-N 2.94Å; L1251-L1254 VanDerWaalsContact O-N 3.16Å
1252	D	82.7	Confident	66.6	Low	78 Å²	78	78.1 Å²	78.1	42%	0.417	42%	0.423	S	S	.	.	H	α-helix	trans	-61.3	-34.5	-179.8	-84.4	-33.8	0	0	0	113.5	K1115 K1119 I1248 N1249 D1250 L1254	K1115-D1252 PolarHBondContact NZ-O 2.93Å; K1115-D1252 VanDerWaalsContact NZ-O 3.08Å; K1119-D1252 WeakPolarHBondContact CE-OD1 3.16Å; K1119-D1252 WeakPolarHBondContact CE-OD2 3.36Å; K1119-D1252 IonicContact NZ-OD1 3.51Å; K1119-D1252 PolarHBondContact NZ-OD1 2.99Å; K1119-D1252 IonicContact NZ-OD2 2.84Å; K1119-D1252 PolarHBondContact NZ-OD2 3.22Å; I1248-D1252 PolarHBondContact O-N 3.09Å; N1249-D1252 PolarHBondContact O-N 3.17Å; D1250-D1252 VanDerWaalsContact C-N 3.26Å; D1250-D1252 PolarHBondContact O-N 2.84Å; D1252-L1254 VanDerWaalsContact C-N 3.3Å; D1252-L1254 PolarHBondContact O-N 3.12Å
1253	K	75.9	Confident	63.9	Low	124 Å²	124	80 Å²	80	54%	0.539	44%	0.438	S	S	.	.	H	α-helix	trans	-73.2	-16.3	178.2	-62.2	162.4	-156.8	159.2	0	113.9	N1249 D1250 L1251	N1249-K1253 PolarHBondContact ND2-NZ 2.94Å; N1249-K1253 VanDerWaalsContact ND2-NZ 3.15Å; N1249-K1253 VanDerWaalsContact O-CE 3.24Å; N1249-K1253 WeakPolarHBondContact O-CE 3.19Å; N1249-K1253 WeakPolarHBondContact O-CG 3.24Å; N1249-K1253 PolarHBondContact O-N 3.35Å; N1249-K1253 WeakPolarHBondContact OD1-CE 3.42Å; N1249-K1253 PolarHBondContact OD1-NZ 3.34Å; D1250-K1253 PolarHBondContact O-N 2.65Å; D1250-K1253 IonicContact OD1-NZ 2.68Å; D1250-K1253 PolarHBondContact OD1-NZ 2.9Å; L1251-K1253 VanDerWaalsContact C-N 3.28Å; L1251-K1253 PolarHBondContact O-N 3.18Å
1254	L	70.5	Confident	61.3	Low	24 Å²	24	87.1 Å²	87.1	13%	0.126	47%	0.474	C	S	.	.	S	Bend	trans	-80.4	127	176.8	-65.9	169.3	0	0	0	110.4	K1115 Y1182 I1183 C1188 D1250 L1251 D1252	K1115-L1254 PolarHBondContact NZ-O 3.49Å; Y1182-L1254 HydrophobicContact CE1-CD1 3.92Å; I1183-L1254 HydrophobicContact CD1-CD1 3.54Å; I1183-L1254 HydrophobicContact CD1-CD2 4.24Å; C1188-L1254 HydrophobicContact CB-CD2 4Å; D1250-L1254 PolarHBondContact O-N 3.17Å; L1251-L1254 HydrophobicContact CD2-CD1 4.42Å; L1251-L1254 PolarHBondContact O-N 2.94Å; L1251-L1254 VanDerWaalsContact O-N 3.16Å; D1252-L1254 VanDerWaalsContact C-N 3.3Å; D1252-L1254 PolarHBondContact O-N 3.12Å
1255	T	59.9	Low	58.5	Low	108 Å²	108	94.5 Å²	94.5	66%	0.663	51%	0.509	S	S	*	.			trans	-78.1	125.6	174	51	0	0	0	0	110.6	N1257	T1255-N1257 PolarHBondContact O-N 3.11Å; T1255-N1257 VanDerWaalsContact O-N 3.11Å
1256	D	55.4	Low	55.5	Low	76 Å²	76	97.1 Å²	97.1	41%	0.406	53%	0.532	S	S	.	.			trans	-74.7	99.7	176.7	-65.8	-65.3	0	0	0	111.2	K1115 Y1182 V1258	K1115-D1256 WeakPolarHBondContact CB-OD1 3.11Å; K1115-D1256 WeakPolarHBondContact CD-OD2 3.27Å; K1115-D1256 IonicContact NZ-OD2 2.93Å; Y1182-D1256 PolarHBondContact OH-OD1 3.05Å; D1256-V1258 PolarHBondContact O-N 3.1Å
1257	N	44.3	Very low	52.8	Low	112 Å²	112	98.1 Å²	98.1	60%	0.599	55%	0.545	S	S	*	.			trans	-77.3	64.5	168.7	-88.5	5.2	0	0	0	111	T1187 T1255	T1187-N1257 PolarHBondContact OG1-ND2 3.43Å; T1255-N1257 PolarHBondContact O-N 3.11Å; T1255-N1257 VanDerWaalsContact O-N 3.11Å
1258	V	37.5	Very low	50.1	Low	124 Å²	124	105 Å²	105	75%	0.752	58%	0.58	S	S	*	*			trans	-122.9	63.1	171.4	-168.2	0	0	0	0	109.2	D1256 T1260	D1256-V1258 PolarHBondContact O-N 3.1Å; V1258-T1260 PolarHBondContact O-N 3.46Å
1259	N	29.9	Very low	47.2	Very low	147 Å²	147	110.4 Å²	110.4	79%	0.786	61%	0.61	S	S	*	*			trans	-79.8	117	171	-85.1	-12	0	0	0	110.5
1260	T	29.5	Very low	44.5	Very low	126 Å²	126	113.2 Å²	113.2	77%	0.773	63%	0.625	S	S	*	*	S	Bend	trans	58.1	83.4	151	56	0	0	0	0	119.4	V1258	V1258-T1260 PolarHBondContact O-N 3.46Å
1261	T	27.7	Very low	42	Very low	146 Å²	146	116.7 Å²	116.7	90%	0.896	65%	0.651	S	S	*	*			trans	-145.6	49.4	134.9	-32.5	0	0	0	0	112.5
1262	L	25.6	Very low	39.7	Very low	170 Å²	170	123.2 Å²	123.2	89%	0.89	69%	0.686	S	S	*	*			trans	-146.6	93	173.7	-92.2	179.2	0	0	0	111.9
1263	T	29.3	Very low	37.2	Very low	130 Å²	130	128.7 Å²	128.7	80%	0.798	71%	0.706	S	S	*	*			trans	-155.3	125.1	166.8	44.3	0	0	0	0	109.8
1264	L	28.7	Very low	35.2	Very low	153 Å²	153	127.6 Å²	127.6	80%	0.801	71%	0.711	S	S	*	*			trans	67.1	141.7	171	-49.2	171.1	0	0	0	114.4
1265	E	29.2	Very low	33.3	Very low	157 Å²	157	134.5 Å²	134.5	73%	0.734	74%	0.743	S	S	*	*			cis	-151.5	149.4	3.2	-136.1	157.6	-124.5	0	0	111.3
1266	T	27.1	Very low	32.1	Very low	140 Å²	140	137.9 Å²	137.9	86%	0.859	75%	0.751	S	S	*	*			trans	-113.2	95.2	174.2	47.7	0	0	0	0	111.2
1267	T	28.4	Very low	30.9	Very low	113 Å²	113	143.5 Å²	143.5	69%	0.693	77%	0.772	S	S	*	*			trans	-163.6	140.8	158.6	13.3	0	0	0	0	113.7
1268	L	28	Very low	30.6	Very low	144 Å²	144	143.1 Å²	143.1	75%	0.754	78%	0.776	S	S	*	*			trans	61.1	104.9	145.6	-63.4	164.4	0	0	0	121.1
1269	N	28.5	Very low	30.2	Very low	140 Å²	140	144.4 Å²	144.4	75%	0.749	78%	0.778	S	S	*	*				37.2	137.4	123.1	-60.2	-1.5	0	0	0	122.5
1270	N	29.8	Very low	30.2	Very low	143 Å²	143	141.8 Å²	141.8	77%	0.765	77%	0.771	S	S	*	*			trans	74.2	94.4	146.9	-67.8	5.9	0	0	0	120.3
1271	S	30.8	Very low	30.3	Very low	96 Å²	96	142.8 Å²	142.8	67%	0.671	77%	0.772	S	S	*	*				60.9	130.7	120.3	67.5	0	0	0	0	122.3
1272	N	34.9	Very low	30.4	Very low	137 Å²	137	143 Å²	143	73%	0.733	77%	0.767	S	S	*	*			trans	93.3	106.9	145	-64	-14.6	0	0	0	121.3
1273	F	31.1	Very low	30.7	Very low	193 Å²	193	138.7 Å²	138.7	85%	0.846	76%	0.756	S	S	*	*			trans	71.2	157.9	136.6	-78.7	-94.7	0	0	0	118.3
1274	P	34.2	Very low	30.9	Very low	100 Å²	100	138.4 Å²	138.4	65%	0.649	75%	0.754	S	S	*	*			trans	-132.8	-160.3	-136.9	36.5	-13.7	0	0	0	114.3
1275	E	28.9	Very low	31.3	Very low	169 Å²	169	136 Å²	136	79%	0.79	75%	0.75	S	S	*	*			trans	68.5	119	173.1	-46.2	-169.8	117.9	0	0	114.7
1276	H	34.7	Very low	31.5	Very low	179 Å²	179	134.5 Å²	134.5	83%	0.829	75%	0.747	S	S	*	*				-162.5	-172.8	74.7	-122.3	-98.3	0	0	0	114.6
1277	K	31.9	Very low	31.9	Very low	194 Å²	194	136 Å²	136	84%	0.843	74%	0.744	S	S	*	*			trans	-82.6	164.8	-170.4	-90	177.9	178.2	173.1	0	115.8
1278	P	36.6	Very low	32.3	Very low	105 Å²	105	135.9 Å²	135.9	68%	0.682	75%	0.749	S	S	*	*			trans	-97.4	166.3	-164.6	39	-37.9	0	0	0	115.1
1279	N	29.6	Very low	32.4	Very low	151 Å²	151	136 Å²	136	81%	0.807	75%	0.75	S	S	*	*				-179.4	159.7	120.1	-98.5	-26.9	0	0	0	115.9
1280	S	30.9	Very low	32.5	Very low	91 Å²	91	137.4 Å²	137.4	64%	0.636	76%	0.756	S	S	*	*			trans	68.5	125.6	147	65	0	0	0	0	122.6
1281	N	30.6	Very low	32.4	Very low	147 Å²	147	135.8 Å²	135.8	79%	0.786	75%	0.752	S	S	*	*			trans	70.7	148.8	133.3	-60.3	-6.1	0	0	0	118.7
1282	L	29.3	Very low	32.1	Very low	150 Å²	150	136.6 Å²	136.6	79%	0.785	76%	0.756	S	S	*	*			cis	-157.2	164.8	-0.6	-152.2	70.2	0	0	0	110.5
1283	A	31.8	Very low	31.8	Very low	80 Å²	80	136.1 Å²	136.1	66%	0.661	76%	0.759	S	S	*	*			trans	70	154.3	149.9	0	0	0	0	0	118
1284	T	34.6	Very low	31.5	Very low	124 Å²	124	134.3 Å²	134.3	76%	0.761	75%	0.753	S	S	*	*			cis	-155.9	146.9	-1.7	-10	0	0	0	0	112.2
1285	S	35.8	Very low	31.2	Very low	103 Å²	103	135 Å²	135	72%	0.72	75%	0.751	S	S	*	*			trans	67.3	152.9	156.2	79.8	0	0	0	0	117.9
1286	N	34.8	Very low	31	Very low	125 Å²	125	134 Å²	134	67%	0.668	75%	0.75	S	S	*	*			cis	-150.9	140.5	9.9	-128.3	-23.7	0	0	0	111.3
1287	Q	35.3	Very low	30.6	Very low	171 Å²	171	130.5 Å²	130.5	80%	0.799	75%	0.746	S	S	*	*			trans	59.5	139	152.2	-64	165.8	27.9	0	0	119.6
1288	S	37.1	Very low	30.3	Very low	112 Å²	112	128 Å²	128	78%	0.783	74%	0.74	S	S	*	*			cis	-149.5	160.4	0.5	52.9	0	0	0	0	112.3
1289	N	29.2	Very low	30	Very low	146 Å²	146	129 Å²	129	78%	0.781	75%	0.745	S	S	*	*			trans	-78.8	163.9	-167.3	-47.2	-45	0	0	0	114.2
1290	L	31.8	Very low	30.1	Very low	169 Å²	169	128.3 Å²	128.3	89%	0.885	74%	0.741	S	S	*	*				-163.9	161.3	109.8	-102.2	165.4	0	0	0	111.8
1291	T	27.4	Very low	30	Very low	110 Å²	110	130.2 Å²	130.2	68%	0.675	74%	0.744	S	S	*	*			trans	-148	142.6	-156.6	51	0	0	0	0	114.7
1292	C	24.9	Very low	30.1	Very low	112 Å²	112	134.5 Å²	134.5	76%	0.757	75%	0.749	S	S	*	*			trans	66.3	164.7	153.4	-62.6	0	0	0	0	119.1
1293	T	26.8	Very low	30.1	Very low	128 Å²	128	132.8 Å²	132.8	79%	0.785	75%	0.75	S	S	*	*			trans	60.9	160.4	170.8	75.8	0	0	0	0	116
1294	E	26.6	Very low	30.1	Very low	154 Å²	154	134.1 Å²	134.1	72%	0.72	76%	0.76	S	S	*	*			cis	-155.9	173.1	-29.5	-116.9	-177.3	-176.7	0	0	109.8
1295	N	27.2	Very low	29.8	Very low	114 Å²	114	134.9 Å²	134.9	61%	0.61	77%	0.765	S	S	*	*			trans	50	117.4	145.6	-67.3	-34.4	0	0	0	122.5
1296	L	24.7	Very low	29.5	Very low	149 Å²	149	135.9 Å²	135.9	78%	0.78	77%	0.767	S	S	*	*				59.6	131.1	126.8	-77	150.3	0	0	0	122.1
1297	S	25.8	Very low	29	Very low	105 Å²	105	139 Å²	139	73%	0.734	78%	0.775	S	S	*	*			trans	72.5	162.8	141.4	83.7	0	0	0	0	117.5
1298	I	26.5	Very low	28.9	Very low	141 Å²	141	140.7 Å²	140.7	72%	0.723	80%	0.797	S	S	*	*			cis	-161.7	142.2	-30.5	-110.5	165.3	0	0	0	105.1
1299	T	28.7	Very low	28.5	Very low	127 Å²	127	142.2 Å²	142.2	78%	0.779	80%	0.798	S	S	*	*			trans	59.3	166.2	174.6	47.6	0	0	0	0	116.1
1300	D	31.8	Very low	28.5	Very low	136 Å²	136	141.9 Å²	141.9	73%	0.727	80%	0.799	S	S	*	*			cis	-135.8	174.5	6.4	-151.7	-5.1	0	0	0	113.8
1301	N	30.4	Very low	28.3	Very low	132 Å²	132	140.4 Å²	140.4	71%	0.706	79%	0.794	S	S	*	*			trans	-76.4	145.5	-173.8	-63.1	-95.8	0	0	0	113.1
1302	R	31.6	Very low	28.3	Very low	237 Å²	237	142.2 Å²	142.2	89%	0.894	80%	0.801	S	S	*	*				-173.8	123.7	114.4	-98.2	154	-170	-163.7	3.3	114.7
1303	S	28.9	Very low	28.6	Very low	114 Å²	114	144.1 Å²	144.1	80%	0.797	80%	0.804	S	S	*	*			trans	49.6	95	138.2	-53	0	0	0	0	120.8
1304	A	31.9	Very low	28.7	Very low	107 Å²	107	145.2 Å²	145.2	88%	0.884	81%	0.805	S	S	*	*			trans	-146	86.8	147.7	0	0	0	0	0	111.2
1305	T	29.4	Very low	28.8	Very low	140 Å²	140	144.6 Å²	144.6	86%	0.859	81%	0.811	S	S	*	*			trans	-82.2	130	172.3	-50.9	0	0	0	0	110.3
1306	V	29.3	Very low	29	Very low	125 Å²	125	146.9 Å²	146.9	76%	0.758	83%	0.827	S	S	*	*			trans	-164.4	122.6	151.6	135.4	0	0	0	0	110.7
1307	F	23.8	Very low	29.3	Very low	189 Å²	189	146.8 Å²	146.8	83%	0.829	83%	0.831	S	S	*	*			trans	20.5	115.7	158.1	-62.6	-95.2	0	0	0	122.2
1308	T	33.6	Very low	29.6	Very low	208 Å²	208	150.5 Å²	150.5	100%	1.276	84%	0.839	S	S	*	*			trans	-139.2	0	132.2	58	0	0	0	0	109.6

Retrieved 1,308 of 1,308 residues in 1773.8 ms (Link to these results)

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