DHX30_MOUSE Loading...

ATP-dependent RNA helicase DHX30

RNA-dependent helicase¹. Plays an important role in the assembly of the mitochondrial large ribosomal subunit (By similarity). Required for optimal function of the zinc-finger antiviral protein ZC3HAV1 (By similarity). Associates with mitochondrial DNA (By similarity). Involved in nervous system development and differentiation through its involvement in the up-regulation of a number of genes which are required for neurogenesis, including GSC, NCAM1, neurogenin, and NEUROD².

AlphaFold DB , UniProt , Accession Q99PU8, Species MOUSE (Mus musculus, Mouse), Gene Dhx30, Length 1,217 aa.

						>DHX30_MOUSE|Q99PU8|Dhx30
MVTPVCNSSTWQPKDSSFLSWPEMFSLDSFRKDRTQHRQRQCKLPPPRLPPMCVNPAPGGTITRASRDLLKEFPQPKNLLNSVIGRALGISHAKDKLVYVHTNGPKKKKVTLHIKWPKSVEVEGYGSKKIDAERQAAAAACQLFKGWGLLGPRNELFDAAKYRVLADRFGSPADSWWRPEPTMPPTSWRQLNPENIRPGGPAGLSRSLGREEEEDEEEELEEGTIDVTEFLSMTQQDSHNPLRDSRGGSFEMTDDDSAIRALTQFPLPKNLLAKVIQIATSSSTAKNLMQFHTVGTKTKLATLTLLWPCPMTFVAKGRRKAEAENKAAALACKKLKSLGLVDRNNEPLTHAMYNLASLRELGETQRRPCTIQVPEPILRKIEAFLSHYPVDSSWISPELRLQSDDILPLGKDSGPLSDPITGKPYMPLSEAEEVRLSQSLLELWRRRGPIWQEAPQLPVDPHRDTILSAIEQHPVVVISGDTGCGKTTRIPQLLLERYVTEGRGARCNVIITQPRRISAVSVAQRVSHELGPSLRRNVGFQVRLESKPPARGGALLFCTVGILLRKLQSNPSLEGVSHVIVDEVHERDVNTDFLLILLKGLQRLNPALRLVLMSATGDNERFSRYFGGCPVIKVPGFMYPVKEHYLEDILAKLGKHQYPHRHRHHESEDECALDLDLVTDLVLHIDARGEPGGILCFLPGWQEIKGVQQRLQEALGMHESKYLILPVHSNIPMMDQKAIFQQPPLGVRKIVLATNIAETSITVNDIVHVVDSGLHKEERYDLKTKVSCLETVWVSRANVIQRRGRAGRCQSGFAYHLFPRSRLEKMVPFQVPEILRTPLENLVLQAKIHMPEKTAVEFLSKAVDSPNIKAVDEAVILLQEIGVLDQREYLTTLGQRLAHISTDPRLAKAIVLAAIFRCLHPLLVVVSCLTRDPFSSSLQNRAEVDKVKALLSHDSGSDHLAFVRAVAGWEEVLRWQDRTSRENYLEENLLYAPSLRFIHGLIKQFSENIYEAFLVGKPSDCTLPSAQCNEYSEEEELVKGVLMAGLYPNLIQVRQGKVTRQGKFKPNSVTYRTKSGNILLHKSTINREATRLRSRWLTYFMAVKSNGSVFVRDSSQVHPLAVLLLTDGDVHIRDDGRRATISLSDSDLLRLEGDSRTVRLLREFRRALGRMVERSLRSELAALPLSVQQEHGQLLALLAELLRGPCGSFDMRKTADD
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.7	Very low	26.5	Very low	241 Å²	241	146.5 Å²	146.5	100%	1.187	84%	0.836	S	S	*	*				0	144.3	0	-73.9	180	-178.9	0	0	107.4
2	V	28.1	Very low	26.2	Very low	142 Å²	142	148.8 Å²	148.8	86%	0.861	83%	0.834	S	S	*	*			trans	84.9	73.3	-163.8	-161	0	0	0	0	113.4
3	T	24.5	Very low	26.4	Very low	131 Å²	131	146.7 Å²	146.7	80%	0.804	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-80.3	119.9	158	32.7	0	0	0	0	109.2
4	P	32.5	Very low	26.3	Very low	117 Å²	117	150.8 Å²	150.8	76%	0.76	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-83	125.7	172	16.2	-2.3	0	0	0	110	C6	P4-C6 PolarHBondContact O-N 3.44Å
5	V	29.2	Very low	26.3	Very low	128 Å²	128	151.9 Å²	151.9	78%	0.776	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-67.2	120	178.3	174.1	0	0	0	0	109.8	N7	V5-N7 PolarHBondContact O-N 3.16Å; V5-N7 VanDerWaalsContact O-N 3.16Å
6	C	23.9	Very low	26.3	Very low	125 Å²	125	148.4 Å²	148.4	85%	0.845	83%	0.828	S	S	*	*			trans	-65.8	102.2	169.5	-78.3	0	0	0	0	110.5	P4 S8	P4-C6 PolarHBondContact O-N 3.44Å; C6-S8 PolarHBondContact O-N 3.46Å
7	N	25.3	Very low	26.3	Very low	150 Å²	150	146.2 Å²	146.2	80%	0.802	83%	0.825	S	S	*	*			trans	-86.4	103.3	161.9	-92.4	-11.4	0	0	0	109.3	V5 S9	V5-N7 PolarHBondContact O-N 3.16Å; V5-N7 VanDerWaalsContact O-N 3.16Å; N7-S9 PolarHBondContact O-N 3.14Å; N7-S9 VanDerWaalsContact O-N 3.14Å
8	S	25	Very low	26.3	Very low	113 Å²	113	149.2 Å²	149.2	79%	0.79	83%	0.828	S	S	*	*			trans	-72.1	89.4	170.8	54.2	0	0	0	0	110.5	C6	C6-S8 PolarHBondContact O-N 3.46Å
9	S	25.6	Very low	26.2	Very low	92 Å²	92	149.5 Å²	149.5	64%	0.643	83%	0.827	S	S	*	*			trans	-93.2	100.9	162.7	59.2	0	0	0	0	108.9	N7 W11	N7-S9 PolarHBondContact O-N 3.14Å; N7-S9 VanDerWaalsContact O-N 3.14Å; S9-W11 PolarHBondContact O-N 3.29Å; S9-W11 VanDerWaalsContact O-N 3.1Å
10	T	26.6	Very low	26.2	Very low	134 Å²	134	147.7 Å²	147.7	82%	0.822	83%	0.825	S	S	*	*			trans	-56.2	103.9	171.2	42.1	0	0	0	0	110.9	Q12	T10-Q12 PolarHBondContact O-N 3.24Å
11	W	22.9	Very low	26	Very low	239 Å²	239	149.6 Å²	149.6	91%	0.905	82%	0.82	S	S	*	*			trans	-76.8	101.3	167.4	-86.9	76.5	0	0	0	109.2	S9	S9-W11 PolarHBondContact O-N 3.29Å; S9-W11 VanDerWaalsContact O-N 3.1Å
12	Q	23.5	Very low	25.9	Very low	173 Å²	173	144.3 Å²	144.3	81%	0.808	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-76.7	127.6	163.4	-81.2	-176.5	-23.5	0	0	109.1	T10 K14	T10-Q12 PolarHBondContact O-N 3.24Å; Q12-K14 PolarHBondContact O-N 3.31Å
13	P	28.4	Very low	25.8	Very low	122 Å²	122	143 Å²	143	79%	0.792	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-73.5	117.7	-177.2	28.9	-31.4	0	0	0	109.8
14	K	24.9	Very low	25.7	Very low	204 Å²	204	145 Å²	145	89%	0.887	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-71.9	131.1	170.2	-82.3	-176.4	174.1	179.5	0	110.1	Q12 S16	Q12-K14 PolarHBondContact O-N 3.31Å; K14-S16 PolarHBondContact O-N 3.09Å; K14-S16 VanDerWaalsContact O-N 3.12Å
15	D	26.3	Very low	25.4	Very low	167 Å²	167	149.1 Å²	149.1	89%	0.893	80%	0.797	S	S	*	*			trans	-45.9	105.8	175.4	-63.9	-58.4	0	0	0	113
16	S	26.1	Very low	25.2	Very low	97 Å²	97	146.5 Å²	146.5	68%	0.678	78%	0.784	S	S	*	*			trans	-94.1	98.2	163.7	62.6	0	0	0	0	108.7	K14 F18	K14-S16 PolarHBondContact O-N 3.09Å; K14-S16 VanDerWaalsContact O-N 3.12Å; S16-F18 PolarHBondContact O-N 2.96Å
17	S	26	Very low	25.5	Very low	110 Å²	110	148.1 Å²	148.1	77%	0.769	78%	0.783	S	S	*	*			trans	-55.9	114.3	168.5	41.9	0	0	0	0	110.4	L19	S17-L19 PolarHBondContact O-N 3.45Å; S17-L19 VanDerWaalsContact O-N 3.09Å
18	F	26.9	Very low	25.5	Very low	200 Å²	200	147.6 Å²	147.6	88%	0.877	78%	0.781	S	S	*	*			trans	-66.7	102.2	172.2	-88.9	-100.4	0	0	0	109.4	S16 S20	S16-F18 PolarHBondContact O-N 2.96Å; F18-S20 PolarHBondContact O-N 3.06Å
19	L	25.2	Very low	25.5	Very low	155 Å²	155	146.5 Å²	146.5	81%	0.812	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-69.7	118.5	164.4	-88.3	154.6	0	0	0	109.1	S17	S17-L19 PolarHBondContact O-N 3.45Å; S17-L19 VanDerWaalsContact O-N 3.09Å
20	S	25	Very low	25.7	Very low	113 Å²	113	149.4 Å²	149.4	79%	0.79	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-60.1	128.5	-177.1	41.6	0	0	0	0	112.8	F18	F18-S20 PolarHBondContact O-N 3.06Å
21	W	22.1	Very low	25.6	Very low	189 Å²	189	154.3 Å²	154.3	72%	0.716	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-85.2	134.1	166.9	-76.9	51.8	0	0	0	108.6	E23	W21-E23 PolarHBondContact O-N 3.5Å; W21-E23 VanDerWaalsContact O-N 3.08Å
22	P	25	Very low	25.7	Very low	130 Å²	130	152.6 Å²	152.6	84%	0.844	78%	0.776	S	S	*	*			trans	-76.3	98.4	172.3	27.7	-25.7	0	0	0	108.8	M24	P22-M24 PolarHBondContact O-N 2.92Å
23	E	26.6	Very low	25.8	Very low	114 Å²	114	151 Å²	151	53%	0.533	77%	0.773	S	S	.	*			trans	-76.1	108.3	171.9	-72.4	-172	141.4	0	0	110.1	W21 F25	W21-E23 PolarHBondContact O-N 3.5Å; W21-E23 VanDerWaalsContact O-N 3.08Å; E23-F25 PolarHBondContact O-N 3Å
24	M	23.7	Very low	25.7	Very low	173 Å²	173	157.5 Å²	157.5	85%	0.852	78%	0.782	S	S	*	*	S	Bend	trans	-87.1	102.7	160.8	-150.6	175.7	-95	0	0	106.4	P22	P22-M24 PolarHBondContact O-N 2.92Å
25	F	26.1	Very low	25.8	Very low	204 Å²	204	152.9 Å²	152.9	90%	0.895	77%	0.771	S	S	*	*	S	Bend	trans	65.2	74.9	179.8	-58.3	-79.4	0	0	0	116.4	E23	E23-F25 PolarHBondContact O-N 3Å
26	S	25.1	Very low	25.7	Very low	72 Å²	72	152.8 Å²	152.8	50%	0.503	77%	0.765	S	S	.	*			trans	-143.8	127.8	153.5	177.9	0	0	0	0	108.7	D28	S26-D28 PolarHBondContact O-N 3.44Å; S26-D28 VanDerWaalsContact O-N 3.1Å
27	L	29.4	Very low	25.8	Very low	160 Å²	160	157.4 Å²	157.4	84%	0.838	78%	0.776	S	S	*	*			trans	-79.3	81.8	-174.1	-83.9	140.6	0	0	0	110.5
28	D	25.6	Very low	25.8	Very low	139 Å²	139	162 Å²	162	74%	0.743	78%	0.776	S	S	*	*			trans	-107.2	67.4	166.6	-108.7	-0.3	0	0	0	110.4	S26	S26-D28 PolarHBondContact O-N 3.44Å; S26-D28 VanDerWaalsContact O-N 3.1Å
29	S	25.2	Very low	25.8	Very low	89 Å²	89	161.4 Å²	161.4	62%	0.622	78%	0.776	S	S	*	*			trans	-119.7	45	166.1	58.5	0	0	0	0	111.4
30	F	29.1	Very low	25.8	Very low	153 Å²	153	165 Å²	165	67%	0.671	78%	0.779	S	S	*	*			trans	-138.4	53.7	171.9	-86.6	-79.9	0	0	0	111.8
31	R	24.2	Very low	25.9	Very low	238 Å²	238	167.5 Å²	167.5	90%	0.898	78%	0.778	S	S	*	*			trans	-143.2	90.8	164.5	-106.1	-177.1	174.8	179.1	-1.4	109.8
32	K	26	Very low	26.1	Very low	203 Å²	203	163.8 Å²	163.8	88%	0.883	78%	0.78	S	S	*	*	S	Bend	trans	-179.7	143.8	142.5	-97.6	162	-174.7	-175.4	0	108.1
33	D	25.7	Very low	26.1	Very low	138 Å²	138	166.2 Å²	166.2	74%	0.738	78%	0.777	S	S	*	*			trans	78.3	64.7	178.6	-60.1	-12.8	0	0	0	118	T35	D33-T35 PolarHBondContact O-N 2.93Å
34	R	24.8	Very low	26.1	Very low	259 Å²	259	168.1 Å²	168.1	98%	0.977	79%	0.79	S	S	*	*			trans	-83.9	67.5	142.4	-80.7	-170.9	175.1	-171.9	-1.2	109.3
35	T	26.8	Very low	26.2	Very low	107 Å²	107	165.2 Å²	165.2	66%	0.656	78%	0.784	S	S	*	*			trans	-86.8	117.4	162.8	35.6	0	0	0	0	108.6	D33 H37	D33-T35 PolarHBondContact O-N 2.93Å; T35-H37 PolarHBondContact O-N 3.37Å
36	Q	26	Very low	26.4	Very low	165 Å²	165	160.9 Å²	160.9	77%	0.771	78%	0.776	S	S	*	*			trans	-14.5	90.3	169.5	-65.7	173.2	-3.8	0	0	116	R38	Q36-R38 PolarHBondContact O-N 2.78Å
37	H	26.6	Very low	26.4	Very low	194 Å²	194	163 Å²	163	90%	0.898	79%	0.788	S	S	*	*			trans	-74.6	80.7	153.2	-90	-53.1	0	0	0	108.5	T35 Q39	T35-H37 PolarHBondContact O-N 3.37Å; H37-Q39 PolarHBondContact O-N 3.1Å
38	R	26.3	Very low	26.2	Very low	208 Å²	208	167.2 Å²	167.2	79%	0.785	79%	0.793	S	S	*	*			trans	-53.8	107.2	155.9	-81	-179.7	170.6	-175.7	-2.7	106.6	Q36 R40	Q36-R38 PolarHBondContact O-N 2.78Å; R38-R40 VanDerWaalsContact C-N 3.27Å; R38-R40 PolarHBondContact O-N 3.28Å
39	Q	27.3	Very low	26.2	Very low	187 Å²	187	168 Å²	168	87%	0.874	80%	0.797	S	S	*	*			trans	-53.5	98.1	162.3	-81.5	177.7	-17.8	0	0	107.3	H37 Q41	H37-Q39 PolarHBondContact O-N 3.1Å; Q39-Q41 VanDerWaalsContact C-N 3.28Å; Q39-Q41 PolarHBondContact O-N 2.8Å
40	R	25.8	Very low	26.2	Very low	231 Å²	231	168.7 Å²	168.7	87%	0.872	80%	0.799	S	S	*	*			trans	-63.1	99.7	163.6	-77.8	-176.5	172.9	-169.2	-1.5	105.3	R38 C42	R38-R40 VanDerWaalsContact C-N 3.27Å; R38-R40 PolarHBondContact O-N 3.28Å; R40-C42 VanDerWaalsContact C-N 3.29Å; R40-C42 PolarHBondContact O-N 2.73Å
41	Q	27.4	Very low	26	Very low	164 Å²	164	167.4 Å²	167.4	77%	0.766	81%	0.806	S	S	*	*			trans	-54.8	99.7	162.2	-77	178	-10.9	0	0	107.1	Q39 K43	Q39-Q41 VanDerWaalsContact C-N 3.28Å; Q39-Q41 PolarHBondContact O-N 2.8Å; Q41-K43 PolarHBondContact O-N 3.12Å
42	C	24.7	Very low	26	Very low	111 Å²	111	164.3 Å²	164.3	75%	0.75	80%	0.804	S	S	*	*			trans	-62.8	90.1	164.4	-74.4	0	0	0	0	107.4	R40 L44	R40-C42 VanDerWaalsContact C-N 3.29Å; R40-C42 PolarHBondContact O-N 2.73Å; C42-L44 PolarHBondContact O-N 2.75Å
43	K	26.4	Very low	25.8	Very low	182 Å²	182	160.8 Å²	160.8	79%	0.791	80%	0.803	S	S	*	*			trans	-66.8	80.6	162.8	-74.6	-176.4	177.8	179.9	0	107.7	Q41	Q41-K43 PolarHBondContact O-N 3.12Å
44	L	25.2	Very low	25.8	Very low	153 Å²	153	159.9 Å²	159.9	80%	0.801	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-68.1	121.2	163.2	-84.6	154.3	0	0	0	107.5	C42	C42-L44 PolarHBondContact O-N 2.75Å
45	P	27.5	Very low	25.8	Very low	112 Å²	112	155 Å²	155	73%	0.727	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-67.7	142.8	179.1	27	-31.4	0	0	0	110.1
46	P	29.6	Very low	25.8	Very low	114 Å²	114	155.8 Å²	155.8	74%	0.74	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-67.6	138.2	-175	27.7	-33.1	0	0	0	110.6	R48	P46-R48 PolarHBondContact O-N 3.24Å
47	P	25.6	Very low	25.8	Very low	116 Å²	116	152.5 Å²	152.5	75%	0.753	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-68.9	121.8	-177.3	27.2	-31.5	0	0	0	110.1	L49	P47-L49 PolarHBondContact O-N 2.96Å; P47-L49 VanDerWaalsContact O-N 3.09Å
48	R	23.8	Very low	26.2	Very low	248 Å²	248	149.7 Å²	149.7	94%	0.936	80%	0.802	S	S	*	*			trans	-69.5	98.1	169	-71.5	-176.3	-179.6	-172.2	0.2	108.6	P46	P46-R48 PolarHBondContact O-N 3.24Å
49	L	26.7	Very low	26.2	Very low	156 Å²	156	143.9 Å²	143.9	82%	0.817	81%	0.807	S	S	*	*			trans	-78.5	127.3	167.9	-79.5	159.8	0	0	0	109.2	P47	P47-L49 PolarHBondContact O-N 2.96Å; P47-L49 VanDerWaalsContact O-N 3.09Å
50	P	25.1	Very low	26.1	Very low	104 Å²	104	138.6 Å²	138.6	68%	0.675	80%	0.803	S	S	*	*			trans	-75.7	150.3	-179.5	30	-31.8	0	0	0	111.5	M52	P50-M52 PolarHBondContact O-N 3.06Å
51	P	25.2	Very low	26.2	Very low	125 Å²	125	133.4 Å²	133.4	81%	0.812	80%	0.797	S	S	*	*			trans	-77.8	107.4	-172.4	31.3	-31.7	0	0	0	110.2	C53	P51-C53 PolarHBondContact O-N 3.18Å
52	M	24	Very low	26.2	Very low	173 Å²	173	131.4 Å²	131.4	85%	0.852	79%	0.791	S	S	*	*			trans	-86	98.7	169.4	-82	-157.2	-92.3	0	0	110.1	P50 V54	P50-M52 PolarHBondContact O-N 3.06Å; M52-V54 HydrophobicContact CB-CG2 4.41Å
53	C	22	Very low	26.6	Very low	129 Å²	129	131.8 Å²	131.8	87%	0.872	79%	0.79	S	S	*	*			trans	-73.7	116	158.6	-70.1	0	0	0	0	108.3	P51	P51-C53 PolarHBondContact O-N 3.18Å
54	V	25.6	Very low	27.2	Very low	119 Å²	119	134.1 Å²	134.1	72%	0.721	79%	0.793	S	S	*	*			trans	-131.9	106.7	170.9	-174.5	0	0	0	0	108.8	M52	M52-V54 HydrophobicContact CB-CG2 4.41Å
55	N	23.8	Very low	28.1	Very low	156 Å²	156	130.4 Å²	130.4	83%	0.834	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-65.7	140.6	166.1	-86.3	-26.4	0	0	0	109.9	A57	N55-A57 PolarHBondContact O-N 2.81Å
56	P	27.8	Very low	29	Very low	125 Å²	125	127.9 Å²	127.9	81%	0.812	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-85.3	117.2	-170.5	32.1	-31.3	0	0	0	111.6
57	A	25.3	Very low	29.8	Very low	95 Å²	95	132.8 Å²	132.8	79%	0.785	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-90.7	139.3	163.3	0	0	0	0	0	110.1	N55	N55-A57 PolarHBondContact O-N 2.81Å
58	P	35.5	Very low	31.8	Very low	135 Å²	135	131.7 Å²	131.7	88%	0.877	76%	0.761	S	S	*	*	S	Bend	trans	-90.1	133.5	-170.2	33.8	-31.1	0	0	0	112.2
59	G	26.1	Very low	34.5	Very low	86 Å²	86	120.9 Å²	120.9	89%	0.887	72%	0.722	S	S	*	*			trans	112.7	77.2	166.4	0	0	0	0	0	114.2
60	G	26	Very low	37.1	Very low	76 Å²	76	115.9 Å²	115.9	78%	0.784	70%	0.696	S	S	*	*			trans	-167.6	134.4	173.7	0	0	0	0	0	112.2
61	T	27.7	Very low	39.7	Very low	123 Å²	123	119.1 Å²	119.1	76%	0.755	70%	0.699	S	S	*	*			trans	-57.3	143	-167.4	-26.6	0	0	0	0	114.5	T63	T61-T63 WeakPolarHBondContact O-CG2 3.5Å; T61-T63 PolarHBondContact O-N 2.82Å; T61-T63 PolarHBondContact O-OG1 3.45Å
62	I	27.8	Very low	42.5	Very low	122 Å²	122	116.8 Å²	116.8	63%	0.626	68%	0.678	S	S	*	*			trans	-49.7	98.9	-179.5	-57.9	167.5	0	0	0	110.9
63	T	33	Very low	45.6	Very low	119 Å²	119	108.7 Å²	108.7	73%	0.73	64%	0.638	S	S	*	*			trans	-125.8	121.1	-174.9	40.5	0	0	0	0	111.3	T61 A65	T61-T63 WeakPolarHBondContact O-CG2 3.5Å; T61-T63 PolarHBondContact O-N 2.82Å; T61-T63 PolarHBondContact O-OG1 3.45Å; T63-A65 PolarHBondContact O-N 2.92Å
64	R	38	Very low	48.4	Very low	230 Å²	230	106.3 Å²	106.3	87%	0.868	62%	0.621	S	S	*	*	S	Bend	trans	60.7	-51.7	169.1	-94.5	175.6	165.9	168.8	-4.5	120.6	S66 R67	R64-S66 VanDerWaalsContact C-N 3.25Å; R64-S66 PolarHBondContact O-N 2.91Å; R64-R67 PolarHBondContact O-N 3.25Å
65	A	43.7	Very low	51.3	Low	75 Å²	75	106.9 Å²	106.9	62%	0.62	62%	0.616	S	S	*	*	H	α-helix	trans	-59.3	-29.9	-166.2	0	0	0	0	0	115	T63	T63-A65 PolarHBondContact O-N 2.92Å
66	S	46.3	Very low	54.5	Low	59 Å²	59	99.6 Å²	99.6	41%	0.413	58%	0.577	S	S	.	*	H	α-helix	trans	-77.3	-26	-174.5	-41.4	0	0	0	0	114.8	R64 D68 Q135	R64-S66 VanDerWaalsContact C-N 3.25Å; R64-S66 PolarHBondContact O-N 2.91Å; S66-D68 VanDerWaalsContact C-N 3.34Å; S66-Q135 PolarHBondContact O-NE2 3.13Å
67	R	47.7	Very low	57.5	Low	218 Å²	218	96.2 Å²	96.2	82%	0.823	55%	0.549	S	S	*	.	H	α-helix	trans	-78	-19.2	-177.2	-92.5	-176.8	174.2	170.6	-2	113.2	R64	R64-R67 PolarHBondContact O-N 3.25Å
68	D	66.7	Low	60.5	Low	92 Å²	92	96 Å²	96	49%	0.492	54%	0.535	S	S	.	.	H	α-helix	trans	-79.3	-28.3	-175.3	-67.9	-30.3	0	0	0	112.9	S66 L70 K71 E72	S66-D68 VanDerWaalsContact C-N 3.34Å; D68-L70 PolarHBondContact O-N 2.97Å; D68-K71 WeakPolarHBondContact O-CB 3.5Å; D68-K71 PolarHBondContact O-N 2.9Å; D68-K71 VanDerWaalsContact O-N 3.12Å; D68-E72 PolarHBondContact O-N 2.84Å; D68-E72 VanDerWaalsContact O-N 3.1Å
69	L	80.9	Confident	62.9	Low	22 Å²	22	91 Å²	91	12%	0.115	50%	0.5	C	S	.	.	H	α-helix	trans	-63.5	-37.8	-179.4	-67	174.8	0	0	0	113.9	K71 E72 F73 A138 A139 Q142	L69-K71 VanDerWaalsContact C-N 3.27Å; L69-K71 PolarHBondContact O-N 3.4Å; L69-E72 PolarHBondContact O-N 3.16Å; L69-F73 WeakPolarHBondContact O-CD2 3.41Å; L69-F73 PolarHBondContact O-N 3.26Å; L69-A138 HydrophobicContact CB-CB 4.1Å; L69-A139 HydrophobicContact CD1-CB 4.3Å; L69-Q142 HydrophobicContact CD2-CB 4.24Å; L69-Q142 HydrophobicContact CD2-CG 4.2Å
70	L	81.7	Confident	65.9	Low	50 Å²	50	86.9 Å²	86.9	26%	0.262	46%	0.458	S	S	.	.	H	α-helix	trans	-74.6	-18.8	178	-73.9	173.2	0	0	0	112.9	D68 F73 P74 P76 R134 Q135 A138	D68-L70 PolarHBondContact O-N 2.97Å; L70-F73 CarbonylContact O-C 3.55Å; L70-P74 WeakPolarHBondContact O-CA 3.46Å; L70-P76 HydrophobicContact CD2-CG 4.28Å; L70-R134 HydrophobicContact CD2-CB 3.97Å; L70-Q135 VanDerWaalsContact CD1-OE1 3.24Å; L70-A138 HydrophobicContact CD2-CB 3.98Å
71	K	79.4	Confident	68.8	Low	172 Å²	172	86.6 Å²	86.6	75%	0.748	44%	0.439	S	S	*	.	H	α-helix	trans	-75.7	-40.4	169	-70.8	-177	175.1	179.8	0	110.8	D68 L69	D68-K71 WeakPolarHBondContact O-CB 3.5Å; D68-K71 PolarHBondContact O-N 2.9Å; D68-K71 VanDerWaalsContact O-N 3.12Å; L69-K71 VanDerWaalsContact C-N 3.27Å; L69-K71 PolarHBondContact O-N 3.4Å
72	E	82.9	Confident	71.6	Confident	77 Å²	77	83.3 Å²	83.3	36%	0.36	42%	0.421	S	S	.	.	H	α-helix	trans	-69.9	-38.5	176.8	-168.6	177.1	178.8	0	0	111.9	D68 L69 P74 K145 N154	D68-E72 PolarHBondContact O-N 2.84Å; D68-E72 VanDerWaalsContact O-N 3.1Å; L69-E72 PolarHBondContact O-N 3.16Å; E72-P74 WeakPolarHBondContact O-CD 3.3Å; E72-K145 IonicContact OE1-NZ 3.97Å; E72-K145 PolarHBondContact OE1-NZ 2.72Å; E72-N154 PolarHBondContact O-ND2 3.32Å
73	F	88.9	Confident	74.3	Confident	2 Å²	2	77.5 Å²	77.5	1%	0.009	39%	0.391	C	S	.	.			trans	-121.6	82.4	179.6	-53.4	-78.5	0	0	0	110.6	L69 L70 Q75 P76 L79 A138 C141 Q142 K145 L150 N154	L69-F73 WeakPolarHBondContact O-CD2 3.41Å; L69-F73 PolarHBondContact O-N 3.26Å; L70-F73 CarbonylContact O-C 3.55Å; F73-Q75 VanDerWaalsContact C-N 3.32Å; F73-Q75 PolarHBondContact O-N 2.94Å; F73-P76 HydrophobicContact CB-CB 4.04Å; F73-P76 VanDerWaalsContact O-CD 3.31Å; F73-P76 WeakPolarHBondContact O-CD 3.42Å; F73-L79 HydrophobicContact CD1-CD2 3.86Å; F73-L79 HydrophobicContact CE1-CD2 4.35Å; F73-A138 HydrophobicContact CB-CB 4.3Å; F73-C141 HydrophobicContact CB-CB 4.35Å; F73-C141 HydrophobicContact CD1-CB 3.44Å; F73-C141 VanDerWaalsContact CD1-CB 3.44Å; F73-C141 HydrophobicContact CD2-CB 4.03Å; F73-C141 HydrophobicContact CE1-CB 3.58Å; F73-C141 HydrophobicContact CE2-CB 4.19Å; F73-C141 HydrophobicContact CG-CB 3.67Å; F73-C141 HydrophobicContact CZ-CB 3.97Å; F73-Q142 HydrophobicContact CE2-CB 3.96Å; F73-Q142 HydrophobicContact CE2-CG 4.49Å; F73-Q142 HydrophobicContact CZ-CB 4.37Å; F73-K145 HydrophobicContact CE1-CD 4.38Å; F73-K145 HydrophobicContact CZ-CD 3.99Å; F73-L150 HydrophobicContact CE1-CD1 4.46Å; F73-N154 HydrophobicContact CE1-CB 4.4Å; F73-N154 VanDerWaalsContact CE1-CG 3.46Å; F73-N154 WeakPolarHBondContact CE1-OD1 3.31Å
74	P	81.1	Confident	76.7	Confident	80 Å²	80	71.9 Å²	71.9	52%	0.519	36%	0.356	S	S	.	.	S	Bend	trans	-65.6	-33.5	-175.4	20.8	-29.9	0	0	0	113.1	L70 E72 P76 R134	L70-P74 WeakPolarHBondContact O-CA 3.46Å; E72-P74 WeakPolarHBondContact O-CD 3.3Å; P74-P76 WeakPolarHBondContact O-CD 3.41Å; P74-R134 PolarHBondContact O-NH2 3.43Å
75	Q	87	Confident	78.7	Confident	131 Å²	131	61.6 Å²	61.6	61%	0.612	32%	0.322	S	S	*	.	S	Bend	trans	-123.8	68.7	177.2	-64.4	-170.7	-5.8	0	0	111.7	F73 K77 N78 L79	F73-Q75 VanDerWaalsContact C-N 3.32Å; F73-Q75 PolarHBondContact O-N 2.94Å; Q75-K77 PolarHBondContact O-N 2.78Å; Q75-N78 HydrophobicContact CB-CB 4.43Å; Q75-N78 PolarHBondContact O-N 3.49Å; Q75-N78 PolarHBondContact OE1-ND2 2.87Å; Q75-L79 PolarHBondContact O-N 2.89Å
76	P	90.6	Very high	80.4	Confident	2 Å²	2	64.5 Å²	64.5	1%	0.013	32%	0.317	C	S	.	.	H	α-helix	trans	-71.8	-33	-166.2	28.1	-32.7	0	0	0	113.3	L70 F73 P74 L79 L80 R134 A137 A138 C141	L70-P76 HydrophobicContact CD2-CG 4.28Å; F73-P76 HydrophobicContact CB-CB 4.04Å; F73-P76 VanDerWaalsContact O-CD 3.31Å; F73-P76 WeakPolarHBondContact O-CD 3.42Å; P74-P76 WeakPolarHBondContact O-CD 3.41Å; P76-L79 PolarHBondContact O-N 3.36Å; P76-L80 WeakPolarHBondContact O-CG 3.49Å; P76-L80 PolarHBondContact O-N 3.37Å; P76-R134 HydrophobicContact CG-CB 4.37Å; P76-R134 VanDerWaalsContact CG-O 3.3Å; P76-R134 WeakPolarHBondContact CG-O 3.37Å; P76-A137 HydrophobicContact CB-CB 3.8Å; P76-A137 HydrophobicContact CG-CB 3.93Å; P76-A138 HydrophobicContact CB-CB 3.94Å; P76-A138 HydrophobicContact CG-CB 4.11Å; P76-C141 PolarHBondContact O-SG 2.87Å
77	K	91.8	Very high	81.9	Confident	55 Å²	55	62.2 Å²	62.2	24%	0.239	30%	0.302	C	S	.	.	H	α-helix	trans	-64.3	-46.4	178.1	-68.4	-171.6	172.7	-171.8	0	112.4	Q75 L79 L80 N81 E133 A137	Q75-K77 PolarHBondContact O-N 2.78Å; K77-L79 VanDerWaalsContact C-N 3.32Å; K77-L80 PolarHBondContact O-N 3.45Å; K77-N81 PolarHBondContact O-N 3Å; K77-E133 VanDerWaalsContact CE-CB 3.46Å; K77-E133 IonicContact NZ-OE2 3.24Å; K77-E133 PolarHBondContact NZ-OE2 2.86Å; K77-A137 HydrophobicContact CG-CB 3.8Å
78	N	86.9	Confident	83.3	Confident	90 Å²	90	54.7 Å²	54.7	48%	0.481	28%	0.277	S	S	.	.	H	α-helix	trans	-62.8	-46.2	179.2	-64.7	3.1	0	0	0	109.1	Q75 L80 N81 S82	Q75-N78 HydrophobicContact CB-CB 4.43Å; Q75-N78 PolarHBondContact O-N 3.49Å; Q75-N78 PolarHBondContact OE1-ND2 2.87Å; N78-L80 PolarHBondContact O-N 3.37Å; N78-N81 PolarHBondContact O-N 3.46Å; N78-S82 WeakPolarHBondContact O-CB 3.4Å; N78-S82 PolarHBondContact O-N 2.9Å; N78-S82 PolarHBondContact O-OG 2.83Å
79	L	86.5	Confident	83.7	Confident	29 Å²	29	53.7 Å²	53.7	15%	0.152	29%	0.289	C	S	.	.	H	α-helix	trans	-58.1	-45.4	178.2	-170	63.6	0	0	0	112.7	F73 Q75 P76 K77 S82 V83 C141 L150 N154 L156	F73-L79 HydrophobicContact CD1-CD2 3.86Å; F73-L79 HydrophobicContact CE1-CD2 4.35Å; Q75-L79 PolarHBondContact O-N 2.89Å; P76-L79 PolarHBondContact O-N 3.36Å; K77-L79 VanDerWaalsContact C-N 3.32Å; L79-S82 PolarHBondContact O-N 2.86Å; L79-V83 VanDerWaalsContact O-CG2 3.31Å; L79-V83 WeakPolarHBondContact O-CG2 3.25Å; L79-V83 PolarHBondContact O-N 2.94Å; L79-C141 HydrophobicContact CD2-CB 4.43Å; L79-L150 HydrophobicContact CD1-CD2 3.74Å; L79-L150 HydrophobicContact CD2-CD1 3.77Å; L79-L150 HydrophobicContact CD2-CD2 3.99Å; L79-L150 HydrophobicContact CG-CD1 4.21Å; L79-L150 HydrophobicContact CG-CD2 3.88Å; L79-N154 HydrophobicContact CD2-CB 3.98Å; L79-L156 HydrophobicContact CD1-CD2 4.05Å; L79-L156 HydrophobicContact CD1-CG 4.45Å
80	L	88.7	Confident	83.4	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-61.8	-46.5	175.1	-73.9	169.8	0	0	0	112.6	P76 K77 N78 S82 V83 I84 L97 L112 A137 A140 F144	P76-L80 WeakPolarHBondContact O-CG 3.49Å; P76-L80 PolarHBondContact O-N 3.37Å; K77-L80 PolarHBondContact O-N 3.45Å; N78-L80 PolarHBondContact O-N 3.37Å; L80-S82 VanDerWaalsContact C-N 3.3Å; L80-S82 PolarHBondContact O-N 3.48Å; L80-V83 PolarHBondContact O-N 3.24Å; L80-I84 WeakPolarHBondContact O-CG1 3.08Å; L80-I84 PolarHBondContact O-N 2.66Å; L80-L97 HydrophobicContact CB-CD1 3.8Å; L80-L97 HydrophobicContact CD1-CD2 4.45Å; L80-L112 HydrophobicContact CD1-CD2 3.94Å; L80-A137 HydrophobicContact CD1-CB 3.84Å; L80-A140 HydrophobicContact CD1-CB 3.73Å; L80-A140 HydrophobicContact CD2-CB 4.02Å; L80-A140 HydrophobicContact CG-CB 4.47Å; L80-F144 HydrophobicContact CD2-CD1 4.3Å; L80-F144 HydrophobicContact CD2-CD2 3.69Å; L80-F144 HydrophobicContact CD2-CE1 4.23Å; L80-F144 HydrophobicContact CD2-CE2 3.62Å; L80-F144 HydrophobicContact CD2-CG 4.05Å; L80-F144 HydrophobicContact CD2-CZ 3.91Å
81	N	87.8	Confident	82.5	Confident	71 Å²	71	58.6 Å²	58.6	38%	0.38	32%	0.324	S	S	.	.	H	α-helix	trans	-59.2	-43.5	177.2	-84.8	-31	0	0	0	110.9	K77 N78 I84 G85 L97	K77-N81 PolarHBondContact O-N 3Å; N78-N81 PolarHBondContact O-N 3.46Å; N81-I84 PolarHBondContact O-N 3.22Å; N81-G85 WeakPolarHBondContact O-CA 3.28Å; N81-G85 PolarHBondContact O-N 3.34Å; N81-L97 WeakPolarHBondContact OD1-CD1 3.15Å
82	S	84.9	Confident	81.5	Confident	54 Å²	54	55 Å²	55	38%	0.378	31%	0.31	S	S	.	.	H	α-helix	trans	-66.6	-41.1	179	-56.6	0	0	0	0	112.4	N78 L79 L80 R86	N78-S82 WeakPolarHBondContact O-CB 3.4Å; N78-S82 PolarHBondContact O-N 2.9Å; N78-S82 PolarHBondContact O-OG 2.83Å; L79-S82 PolarHBondContact O-N 2.86Å; L80-S82 VanDerWaalsContact C-N 3.3Å; L80-S82 PolarHBondContact O-N 3.48Å; S82-R86 WeakPolarHBondContact O-CB 3.4Å; S82-R86 PolarHBondContact O-N 3.32Å
83	V	84.6	Confident	80.7	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.5	-50.6	175.4	173.8	0	0	0	0	110.4	L79 L80 A87 W116 F144 L149 L150 L156 Y162	L79-V83 VanDerWaalsContact O-CG2 3.31Å; L79-V83 WeakPolarHBondContact O-CG2 3.25Å; L79-V83 PolarHBondContact O-N 2.94Å; L80-V83 PolarHBondContact O-N 3.24Å; V83-A87 WeakPolarHBondContact O-CB 3.37Å; V83-A87 PolarHBondContact O-N 3.01Å; V83-W116 HydrophobicContact CG1-CZ3 4.31Å; V83-F144 HydrophobicContact CB-CD2 4.09Å; V83-F144 HydrophobicContact CB-CE2 4.16Å; V83-F144 HydrophobicContact CG1-CD2 3.71Å; V83-F144 HydrophobicContact CG1-CE2 3.8Å; V83-F144 HydrophobicContact CG2-CD2 4.34Å; V83-L149 HydrophobicContact CG1-CB 4.28Å; V83-L150 HydrophobicContact CG2-CD2 3.52Å; V83-L150 HydrophobicContact CG2-CG 3.98Å; V83-L156 HydrophobicContact CB-CD2 4.27Å; V83-L156 HydrophobicContact CG2-CD2 3.35Å; V83-Y162 HydrophobicContact CG1-CE1 3.83Å
84	I	84.1	Confident	79.7	Confident	0 Å²	0	59 Å²	59	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-69	-43.1	-176.3	-63.4	178.5	0	0	0	111	L80 N81 R86 A87 L88 I90 A93 K96 L97 W116 F144	L80-I84 WeakPolarHBondContact O-CG1 3.08Å; L80-I84 PolarHBondContact O-N 2.66Å; N81-I84 PolarHBondContact O-N 3.22Å; I84-R86 VanDerWaalsContact C-N 3.34Å; I84-R86 PolarHBondContact O-N 3.14Å; I84-A87 PolarHBondContact O-N 3.38Å; I84-L88 HydrophobicContact CG2-CD1 3.68Å; I84-L88 HydrophobicContact CG2-CG 4.29Å; I84-L88 WeakPolarHBondContact O-CB 3.3Å; I84-L88 PolarHBondContact O-N 3.39Å; I84-I90 HydrophobicContact CG2-CD1 4.3Å; I84-A93 HydrophobicContact CB-CB 3.77Å; I84-A93 HydrophobicContact CD1-CB 4.29Å; I84-A93 HydrophobicContact CG2-CB 3.54Å; I84-K96 HydrophobicContact CD1-CB 4.32Å; I84-K96 HydrophobicContact CG2-CB 4.16Å; I84-K96 HydrophobicContact CG2-CG 4.19Å; I84-L97 HydrophobicContact CD1-CD1 3.83Å; I84-L97 HydrophobicContact CD1-CD2 3.66Å; I84-L97 HydrophobicContact CD1-CG 3.59Å; I84-W116 HydrophobicContact CG1-CE3 4.02Å; I84-W116 HydrophobicContact CG1-CZ3 4.48Å; I84-F144 HydrophobicContact CD1-CE2 4.37Å; I84-F144 HydrophobicContact CD1-CZ 4.19Å; I84-F144 HydrophobicContact CG1-CE2 3.99Å; I84-F144 HydrophobicContact CG1-CZ 4.21Å
85	G	80.1	Confident	79.4	Confident	15 Å²	15	61.5 Å²	61.5	16%	0.155	34%	0.335	C	S	.	.	H	α-helix	trans	-60.4	-44	178.3	0	0	0	0	0	111.8	N81 G89 I90	N81-G85 WeakPolarHBondContact O-CA 3.28Å; N81-G85 PolarHBondContact O-N 3.34Å; G85-G89 VanDerWaalsContact O-CA 3.29Å; G85-G89 WeakPolarHBondContact O-CA 3.39Å; G85-G89 PolarHBondContact O-N 3.05Å; G85-I90 WeakPolarHBondContact CA-O 3.47Å; G85-I90 PolarHBondContact O-N 3.34Å; G85-I90 VanDerWaalsContact O-N 3.15Å
86	R	79.7	Confident	79	Confident	136 Å²	136	58.9 Å²	58.9	51%	0.513	32%	0.321	S	S	.	.	H	α-helix	trans	-73	-33.4	178.8	-156.5	166.2	-171.6	125.3	0.4	112.9	S82 I84 F157 A159 Y162	S82-R86 WeakPolarHBondContact O-CB 3.4Å; S82-R86 PolarHBondContact O-N 3.32Å; I84-R86 VanDerWaalsContact C-N 3.34Å; I84-R86 PolarHBondContact O-N 3.14Å; R86-F157 WeakPolarHBondContact CD-O 3.37Å; R86-F157 PolarHBondContact NE-O 2.99Å; R86-A159 HydrophobicContact CG-CB 4.41Å; R86-Y162 HydrophobicContact CB-CD2 4.24Å; R86-Y162 HydrophobicContact CB-CE2 4.29Å; R86-Y162 HydrophobicContact CG-CD2 4.25Å; R86-Y162 HydrophobicContact CG-CE2 4.42Å
87	A	77.3	Confident	78.7	Confident	10 Å²	10	59.2 Å²	59.2	8%	0.083	32%	0.323	C	S	.	.	H	α-helix	trans	-74.3	-37.4	178	0	0	0	0	0	113.5	V83 I84 W116 Y162	V83-A87 WeakPolarHBondContact O-CB 3.37Å; V83-A87 PolarHBondContact O-N 3.01Å; I84-A87 PolarHBondContact O-N 3.38Å; A87-W116 HydrophobicContact CB-CH2 3.28Å; A87-W116 HydrophobicContact CB-CZ2 3.65Å; A87-W116 HydrophobicContact CB-CZ3 3.88Å; A87-Y162 HydrophobicContact CB-CD1 4.04Å; A87-Y162 HydrophobicContact CB-CD2 4.43Å; A87-Y162 HydrophobicContact CB-CG 3.81Å
88	L	77.6	Confident	78.5	Confident	60 Å²	60	59.2 Å²	59.2	31%	0.314	33%	0.328	S	S	.	.	H	α-helix	trans	-99.2	-8	-177.1	-64	-178.8	0	0	0	113.8	I84 I90 K96 W116	I84-L88 HydrophobicContact CG2-CD1 3.68Å; I84-L88 HydrophobicContact CG2-CG 4.29Å; I84-L88 WeakPolarHBondContact O-CB 3.3Å; I84-L88 PolarHBondContact O-N 3.39Å; L88-I90 VanDerWaalsContact C-N 3.3Å; L88-I90 HydrophobicContact CB-CD1 4.02Å; L88-I90 HydrophobicContact CB-CG1 3.98Å; L88-I90 HydrophobicContact CB-CG2 4.25Å; L88-I90 HydrophobicContact CD1-CD1 3.88Å; L88-I90 PolarHBondContact O-N 3.28Å; L88-K96 HydrophobicContact CD1-CD 4.4Å; L88-K96 HydrophobicContact CD1-CG 4.11Å; L88-W116 HydrophobicContact CD1-CG 4.18Å; L88-W116 HydrophobicContact CD2-CD2 4.46Å; L88-W116 HydrophobicContact CD2-CG 4.36Å; L88-W116 HydrophobicContact CG-CD2 4.48Å
89	G	74.1	Confident	78.6	Confident	72 Å²	72	57.4 Å²	57.4	74%	0.742	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	33.6	-175.2	0	0	0	0	0	113	G85	G85-G89 VanDerWaalsContact O-CA 3.29Å; G85-G89 WeakPolarHBondContact O-CA 3.39Å; G85-G89 PolarHBondContact O-N 3.05Å
90	I	74.6	Confident	78.7	Confident	64 Å²	64	58.9 Å²	58.9	33%	0.328	32%	0.324	S	S	.	.			trans	-113.9	142.1	-179.9	63.3	-176.6	0	0	0	110.5	I84 G85 L88 K96	I84-I90 HydrophobicContact CG2-CD1 4.3Å; G85-I90 WeakPolarHBondContact CA-O 3.47Å; G85-I90 PolarHBondContact O-N 3.34Å; G85-I90 VanDerWaalsContact O-N 3.15Å; L88-I90 VanDerWaalsContact C-N 3.3Å; L88-I90 HydrophobicContact CB-CD1 4.02Å; L88-I90 HydrophobicContact CB-CG1 3.98Å; L88-I90 HydrophobicContact CB-CG2 4.25Å; L88-I90 HydrophobicContact CD1-CD1 3.88Å; L88-I90 PolarHBondContact O-N 3.28Å; I90-K96 HydrophobicContact CD1-CG 4.45Å
91	S	62.8	Low	78.5	Confident	110 Å²	110	62.5 Å²	62.5	77%	0.769	34%	0.341	S	S	*	.	S	Bend	trans	-68	-33.9	178	51	0	0	0	0	112.6
92	H	59.2	Low	78.1	Confident	98 Å²	98	62.1 Å²	62.1	45%	0.454	34%	0.341	S	S	.	.			trans	-135.3	128.6	-179.9	-58.8	-57.2	0	0	0	113.3	K94 D215	H92-K94 VanDerWaalsContact C-N 3.27Å; H92-K94 PolarHBondContact O-N 3.45Å; H92-D215 IonicContact NE2-OD2 3.76Å
93	A	66.3	Low	77.5	Confident	2 Å²	2	65.9 Å²	65.9	2%	0.017	36%	0.357	C	S	.	.			trans	-87.3	18.3	176.7	0	0	0	0	0	113.7	I84 D95 K96 L97	I84-A93 HydrophobicContact CB-CB 3.77Å; I84-A93 HydrophobicContact CD1-CB 4.29Å; I84-A93 HydrophobicContact CG2-CB 3.54Å; A93-D95 PolarHBondContact O-N 3.19Å; A93-K96 HydrophobicContact CB-CB 4.48Å; A93-K96 CarbonylContact O-C 3.59Å; A93-K96 WeakPolarHBondContact O-CA 3.26Å; A93-K96 WeakPolarHBondContact O-CB 3.3Å; A93-K96 PolarHBondContact O-N 3.29Å; A93-L97 HydrophobicContact CB-CD1 4.19Å; A93-L97 HydrophobicContact CB-CG 4.47Å; A93-L97 PolarHBondContact O-N 3.28Å
94	K	68.2	Low	76.4	Confident	160 Å²	160	67 Å²	67	70%	0.696	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-38.7	-174.3	-83.9	-179.8	179.3	163.3	0	112.8	H92 K96	H92-K94 VanDerWaalsContact C-N 3.27Å; H92-K94 PolarHBondContact O-N 3.45Å; K94-K96 VanDerWaalsContact C-N 3.25Å; K94-K96 PolarHBondContact O-N 3.27Å
95	D	73.8	Confident	75.3	Confident	133 Å²	133	73.8 Å²	73.8	71%	0.711	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-13.5	-179.7	-62.4	-18.9	0	0	0	113.4	A93	A93-D95 PolarHBondContact O-N 3.19Å
96	K	79.1	Confident	74.8	Confident	75 Å²	75	83 Å²	83	33%	0.326	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-23.7	-179.9	-56	-59.6	-175.5	-179.4	0	112.9	I84 L88 I90 A93 K94 I114 K115	I84-K96 HydrophobicContact CD1-CB 4.32Å; I84-K96 HydrophobicContact CG2-CB 4.16Å; I84-K96 HydrophobicContact CG2-CG 4.19Å; L88-K96 HydrophobicContact CD1-CD 4.4Å; L88-K96 HydrophobicContact CD1-CG 4.11Å; I90-K96 HydrophobicContact CD1-CG 4.45Å; A93-K96 HydrophobicContact CB-CB 4.48Å; A93-K96 CarbonylContact O-C 3.59Å; A93-K96 WeakPolarHBondContact O-CA 3.26Å; A93-K96 WeakPolarHBondContact O-CB 3.3Å; A93-K96 PolarHBondContact O-N 3.29Å; K94-K96 VanDerWaalsContact C-N 3.25Å; K94-K96 PolarHBondContact O-N 3.27Å; K96-I114 CarbonylContact O-C 3.6Å; K96-I114 VanDerWaalsContact O-CA 3.32Å; K96-I114 WeakPolarHBondContact O-CA 3.28Å; K96-K115 HydrophobicContact CD-CB 4.28Å; K96-K115 PolarHBondContact O-N 3.46Å
97	L	85.2	Confident	74.5	Confident	10 Å²	10	81.1 Å²	81.1	5%	0.052	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	92.5	179.3	-66.2	174.5	0	0	0	110	L80 N81 I84 A93 Y99 L112 I114	L80-L97 HydrophobicContact CB-CD1 3.8Å; L80-L97 HydrophobicContact CD1-CD2 4.45Å; N81-L97 WeakPolarHBondContact OD1-CD1 3.15Å; I84-L97 HydrophobicContact CD1-CD1 3.83Å; I84-L97 HydrophobicContact CD1-CD2 3.66Å; I84-L97 HydrophobicContact CD1-CG 3.59Å; A93-L97 HydrophobicContact CB-CD1 4.19Å; A93-L97 HydrophobicContact CB-CG 4.47Å; A93-L97 PolarHBondContact O-N 3.28Å; L97-Y99 HydrophobicContact CB-CE2 4.39Å; L97-L112 HydrophobicContact CB-CD1 4.12Å; L97-L112 HydrophobicContact CD2-CD1 4.14Å; L97-L112 HydrophobicContact CD2-CD2 4.46Å; L97-I114 HydrophobicContact CD2-CB 4.3Å; L97-I114 HydrophobicContact CD2-CG1 4.01Å; L97-I114 HydrophobicContact CD2-CG2 3.88Å
98	V	86.8	Confident	74.5	Confident	55 Å²	55	85.3 Å²	85.3	33%	0.333	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	114.4	-178.2	-177.7	0	0	0	0	109.6	V100 H113	V98-V100 HydrophobicContact CG1-CG2 4.21Å; V98-H113 HydrophobicContact CB-CB 4.35Å; V98-H113 PolarHBondContact N-O 2.99Å; V98-H113 PolarHBondContact O-N 3.22Å
99	Y	90	Very high	74.9	Confident	52 Å²	52	84.6 Å²	84.6	20%	0.204	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	117.4	175.5	-64.4	-94	0	0	0	110.2	L97 V110 L112 E133 A137	L97-Y99 HydrophobicContact CB-CE2 4.39Å; Y99-V110 HydrophobicContact CD1-CG1 3.8Å; Y99-V110 HydrophobicContact CG-CG1 4.43Å; Y99-L112 HydrophobicContact CD1-CB 4.06Å; Y99-L112 HydrophobicContact CD1-CD1 3.83Å; Y99-L112 HydrophobicContact CD1-CG 4.36Å; Y99-L112 HydrophobicContact CD2-CD1 3.91Å; Y99-L112 HydrophobicContact CE1-CB 4.03Å; Y99-L112 HydrophobicContact CE1-CD1 3.64Å; Y99-L112 HydrophobicContact CE1-CD2 3.76Å; Y99-L112 HydrophobicContact CE1-CG 4Å; Y99-L112 HydrophobicContact CE2-CD1 3.71Å; Y99-L112 HydrophobicContact CG-CD1 3.97Å; Y99-E133 HydrophobicContact CD1-CB 4.21Å; Y99-E133 HydrophobicContact CD1-CG 4.11Å; Y99-E133 HydrophobicContact CE1-CB 4.31Å; Y99-A137 HydrophobicContact CE1-CB 4.45Å
100	V	87.6	Confident	75.7	Confident	59 Å²	59	81.2 Å²	81.2	36%	0.358	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	118.5	176.8	179.1	0	0	0	0	109.2	V98 V110 T111 H113	V98-V100 HydrophobicContact CG1-CG2 4.21Å; V100-V110 CarbonylContact O-C 3.5Å; V100-V110 WeakPolarHBondContact O-CA 3.47Å; V100-T111 PolarHBondContact N-O 3.43Å; V100-T111 PolarHBondContact O-N 3.38Å; V100-H113 VanDerWaalsContact CG2-CD2 3.47Å; V100-H113 WeakPolarHBondContact CG2-CD2 3.4Å; V100-H113 WeakPolarHBondContact CG2-NE2 3.5Å
101	H	84.5	Confident	76.5	Confident	77 Å²	77	78.7 Å²	78.7	36%	0.356	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	127.7	-177.6	-57.2	-76.1	0	0	0	111	V110 K129 E133	H101-V110 WeakPolarHBondContact ND1-CG2 3.36Å; H101-K129 WeakPolarHBondContact CD2-CE 3.22Å; H101-K129 WeakPolarHBondContact CE1-CE 3.31Å; H101-K129 VanDerWaalsContact ND1-CE 3.28Å; H101-K129 WeakPolarHBondContact ND1-CE 3.39Å; H101-K129 WeakPolarHBondContact NE2-CE 3.3Å; H101-E133 IonicContact CE1-OE1 3.1Å; H101-E133 PolarHBondContact CE1-OE1 3Å; H101-E133 IonicContact ND1-OE1 2.7Å; H101-E133 IonicContact NE2-OE1 2.62Å; H101-E133 PolarHBondContact NE2-OE1 3.16Å
102	T	78.8	Confident	77.9	Confident	62 Å²	62	73.5 Å²	73.5	38%	0.38	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	143.3	172.7	52	0	0	0	0	110.3	G104 K109	T102-G104 PolarHBondContact O-N 3.17Å; T102-K109 PolarHBondContact N-O 3.26Å; T102-K109 PolarHBondContact O-N 3.16Å; T102-K109 WeakPolarHBondContact OG1-CB 3.49Å; T102-K109 WeakPolarHBondContact OG1-CD 3.33Å; T102-K109 WeakPolarHBondContact OG1-CG 3.27Å
103	N	73.4	Confident	79.4	Confident	133 Å²	133	71.1 Å²	71.1	71%	0.711	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	103.2	174.3	-78	-31.6	0	0	0	108.3	K108	N103-K108 PolarHBondContact OD1-NZ 3.41Å
104	G	61.6	Low	80.5	Confident	23 Å²	23	71.1 Å²	71.1	24%	0.237	36%	0.36	C	S	.	.			trans	-76.3	161.2	171.7	0	0	0	0	0	112	T102 K106 K107	T102-G104 PolarHBondContact O-N 3.17Å; G104-K106 VanDerWaalsContact C-N 3.27Å; G104-K106 PolarHBondContact O-N 2.96Å; G104-K107 CarbonylContact C-O 3.54Å; G104-K107 VanDerWaalsContact CA-O 3.25Å; G104-K107 WeakPolarHBondContact CA-O 3.31Å; G104-K107 PolarHBondContact N-O 3.23Å
105	P	61.2	Low	81.1	Confident	144 Å²	144	68.9 Å²	68.9	94%	0.935	35%	0.35	S	S	*	.	S	Bend	trans	-65.7	-21.1	-170.8	21.7	-31.9	0	0	0	115
106	K	68.5	Low	81.5	Confident	207 Å²	207	63.9 Å²	63.9	90%	0.9	32%	0.321	S	S	*	.	S	Bend	trans	-136.9	-11.2	176.7	-68.1	-173.5	178.3	-179.4	0	115	G104	G104-K106 VanDerWaalsContact C-N 3.27Å; G104-K106 PolarHBondContact O-N 2.96Å
107	K	74.9	Confident	81.3	Confident	98 Å²	98	61.2 Å²	61.2	43%	0.426	31%	0.312	S	S	.	.	S	Bend	trans	-147	153.6	-176.6	-68.4	-174.9	-178.1	177.9	0	109.7	G104 K109	G104-K107 CarbonylContact C-O 3.54Å; G104-K107 VanDerWaalsContact CA-O 3.25Å; G104-K107 WeakPolarHBondContact CA-O 3.31Å; G104-K107 PolarHBondContact N-O 3.23Å; K107-K109 PolarHBondContact O-N 2.95Å
108	K	77.3	Confident	80.9	Confident	97 Å²	97	65.8 Å²	65.8	42%	0.422	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	129	173	-64.1	-70.6	175.3	177.3	0	108.1	N103 Y125 G126 A132	N103-K108 PolarHBondContact OD1-NZ 3.41Å; K108-Y125 WeakPolarHBondContact O-CA 3.48Å; K108-G126 PolarHBondContact N-O 3.26Å; K108-G126 PolarHBondContact O-N 3.05Å; K108-A132 HydrophobicContact CB-CB 4.47Å; K108-A132 WeakPolarHBondContact O-CB 3.4Å
109	K	85.5	Confident	80.6	Confident	45 Å²	45	68.1 Å²	68.1	20%	0.196	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	138.2	179.6	177.7	-179.6	174.9	165.5	0	108.6	T102 K107 E123 G124 Y125	T102-K109 PolarHBondContact N-O 3.26Å; T102-K109 PolarHBondContact O-N 3.16Å; T102-K109 WeakPolarHBondContact OG1-CB 3.49Å; T102-K109 WeakPolarHBondContact OG1-CD 3.33Å; T102-K109 WeakPolarHBondContact OG1-CG 3.27Å; K107-K109 PolarHBondContact O-N 2.95Å; K109-E123 WeakPolarHBondContact CE-OE1 3.47Å; K109-E123 WeakPolarHBondContact CE-OE2 3.34Å; K109-E123 IonicContact NZ-OE1 3.63Å; K109-E123 PolarHBondContact NZ-OE1 3.13Å; K109-E123 IonicContact NZ-OE2 3.3Å; K109-E123 PolarHBondContact NZ-OE2 3.35Å; K109-G124 WeakPolarHBondContact CA-O 3.22Å; K109-Y125 HydrophobicContact CB-CD1 4.01Å; K109-Y125 HydrophobicContact CB-CE1 3.85Å; K109-Y125 HydrophobicContact CD-CE1 3.63Å; K109-Y125 WeakPolarHBondContact CD-OH 3.43Å; K109-Y125 VanDerWaalsContact CE-OH 3.24Å; K109-Y125 WeakPolarHBondContact CE-OH 3.49Å; K109-Y125 HydrophobicContact CG-CD1 4.1Å; K109-Y125 HydrophobicContact CG-CE1 3.58Å; K109-Y125 PolarHBondContact NZ-OH 2.89Å
110	V	91.3	Very high	80.5	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.006	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	125.8	175.9	178.7	0	0	0	0	108.6	Y99 V100 H101 E123 G124 A132 E133	Y99-V110 HydrophobicContact CD1-CG1 3.8Å; Y99-V110 HydrophobicContact CG-CG1 4.43Å; V100-V110 CarbonylContact O-C 3.5Å; V100-V110 WeakPolarHBondContact O-CA 3.47Å; H101-V110 WeakPolarHBondContact ND1-CG2 3.36Å; V110-E123 CarbonylContact O-C 3.55Å; V110-E123 WeakPolarHBondContact O-CA 3.46Å; V110-G124 PolarHBondContact N-O 2.76Å; V110-G124 PolarHBondContact O-N 3.33Å; V110-A132 HydrophobicContact CB-CB 4.14Å; V110-A132 HydrophobicContact CG2-CB 3.55Å; V110-E133 HydrophobicContact CG1-CG 4.05Å; V110-E133 HydrophobicContact CG2-CG 4.12Å
111	T	90.2	Very high	80.6	Confident	12 Å²	12	70.4 Å²	70.4	7%	0.074	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	115.1	171.6	-54.1	0	0	0	0	107.6	V100 E121 E123	V100-T111 PolarHBondContact N-O 3.43Å; V100-T111 PolarHBondContact O-N 3.38Å; T111-E121 HydrophobicContact CG2-CB 3.98Å; T111-E123 HydrophobicContact CG2-CG 4.34Å
112	L	92.5	Very high	80.9	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	112.1	173.4	172.4	56.4	0	0	0	108.7	L80 L97 Y99 I114 E121 V122 A136 A140	L80-L112 HydrophobicContact CD1-CD2 3.94Å; L97-L112 HydrophobicContact CB-CD1 4.12Å; L97-L112 HydrophobicContact CD2-CD1 4.14Å; L97-L112 HydrophobicContact CD2-CD2 4.46Å; Y99-L112 HydrophobicContact CD1-CB 4.06Å; Y99-L112 HydrophobicContact CD1-CD1 3.83Å; Y99-L112 HydrophobicContact CD1-CG 4.36Å; Y99-L112 HydrophobicContact CD2-CD1 3.91Å; Y99-L112 HydrophobicContact CE1-CB 4.03Å; Y99-L112 HydrophobicContact CE1-CD1 3.64Å; Y99-L112 HydrophobicContact CE1-CD2 3.76Å; Y99-L112 HydrophobicContact CE1-CG 4Å; Y99-L112 HydrophobicContact CE2-CD1 3.71Å; Y99-L112 HydrophobicContact CG-CD1 3.97Å; L112-I114 HydrophobicContact CD2-CD1 4.41Å; L112-I114 HydrophobicContact CD2-CG1 4.17Å; L112-I114 HydrophobicContact CG-CG1 3.87Å; L112-E121 WeakPolarHBondContact O-CA 3.3Å; L112-V122 PolarHBondContact N-O 3.01Å; L112-V122 PolarHBondContact O-N 2.96Å; L112-A136 HydrophobicContact CB-CB 3.91Å; L112-A140 HydrophobicContact CD2-CB 3.8Å
113	H	90	Very high	81.4	Confident	49 Å²	49	68.5 Å²	68.5	23%	0.227	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	113.7	171.4	-56.2	-101.2	0	0	0	108.4	V98 V100 E121	V98-H113 HydrophobicContact CB-CB 4.35Å; V98-H113 PolarHBondContact N-O 2.99Å; V98-H113 PolarHBondContact O-N 3.22Å; V100-H113 VanDerWaalsContact CG2-CD2 3.47Å; V100-H113 WeakPolarHBondContact CG2-CD2 3.4Å; V100-H113 WeakPolarHBondContact CG2-NE2 3.5Å; H113-E121 IonicContact CE1-OE1 3.59Å; H113-E121 PolarHBondContact CE1-OE1 3.41Å; H113-E121 IonicContact CE1-OE2 3.76Å; H113-E121 PolarHBondContact CE1-OE2 3.4Å; H113-E121 WeakPolarHBondContact ND1-CG 3.35Å; H113-E121 IonicContact ND1-OE1 2.8Å; H113-E121 PolarHBondContact ND1-OE1 3.15Å; H113-E121 IonicContact ND1-OE2 3.25Å
114	I	89.4	Confident	82.1	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.01	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	122.1	176.6	-45.3	176.9	0	0	0	107	K96 L97 L112 W116 S119 V120 V122 A140 F144	K96-I114 CarbonylContact O-C 3.6Å; K96-I114 VanDerWaalsContact O-CA 3.32Å; K96-I114 WeakPolarHBondContact O-CA 3.28Å; L97-I114 HydrophobicContact CD2-CB 4.3Å; L97-I114 HydrophobicContact CD2-CG1 4.01Å; L97-I114 HydrophobicContact CD2-CG2 3.88Å; L112-I114 HydrophobicContact CD2-CD1 4.41Å; L112-I114 HydrophobicContact CD2-CG1 4.17Å; L112-I114 HydrophobicContact CG-CG1 3.87Å; I114-W116 WeakPolarHBondContact CG2-O 3.23Å; I114-S119 CarbonylContact O-C 3.5Å; I114-S119 WeakPolarHBondContact O-CA 3.5Å; I114-V120 HydrophobicContact CB-CG1 3.76Å; I114-V120 HydrophobicContact CD1-CG1 3.74Å; I114-V120 HydrophobicContact CG1-CG1 4.03Å; I114-V120 PolarHBondContact N-O 3.46Å; I114-V120 PolarHBondContact O-N 3.17Å; I114-V122 HydrophobicContact CD1-CG2 4.01Å; I114-A140 HydrophobicContact CD1-CB 3.38Å; I114-A140 HydrophobicContact CG1-CB 4.48Å; I114-F144 HydrophobicContact CD1-CE1 4.14Å; I114-F144 HydrophobicContact CG2-CE1 4Å; I114-F144 HydrophobicContact CG2-CZ 3.94Å
115	K	82.1	Confident	83.2	Confident	113 Å²	113	66.2 Å²	66.2	49%	0.491	32%	0.323	S	S	.	.			trans	-95.4	-1.1	-178.2	-63.4	-174.5	-176.2	168.1	0	114.5	K96	K96-K115 HydrophobicContact CD-CB 4.28Å; K96-K115 PolarHBondContact O-N 3.46Å
116	W	81.6	Confident	84.3	Confident	27 Å²	27	59.7 Å²	59.7	10%	0.102	28%	0.282	C	S	.	.	S	Bend	trans	-146.4	143.9	-175.6	-176.4	90.1	0	0	0	111.4	V83 I84 A87 L88 I114 K118 L149 A166	V83-W116 HydrophobicContact CG1-CZ3 4.31Å; I84-W116 HydrophobicContact CG1-CE3 4.02Å; I84-W116 HydrophobicContact CG1-CZ3 4.48Å; A87-W116 HydrophobicContact CB-CH2 3.28Å; A87-W116 HydrophobicContact CB-CZ2 3.65Å; A87-W116 HydrophobicContact CB-CZ3 3.88Å; L88-W116 HydrophobicContact CD1-CG 4.18Å; L88-W116 HydrophobicContact CD2-CD2 4.46Å; L88-W116 HydrophobicContact CD2-CG 4.36Å; L88-W116 HydrophobicContact CG-CD2 4.48Å; I114-W116 WeakPolarHBondContact CG2-O 3.23Å; W116-K118 VanDerWaalsContact C-N 3.27Å; W116-L149 HydrophobicContact CH2-CD1 4.36Å; W116-L149 HydrophobicContact CH2-CD2 4.09Å; W116-L149 HydrophobicContact CZ3-CD1 3.99Å; W116-A166 HydrophobicContact CZ2-CB 4.04Å
117	P	74	Confident	84.8	Confident	19 Å²	19	54.5 Å²	54.5	12%	0.123	27%	0.272	C	S	.	.	S	Bend	cis	-68.5	-19.3	-4.4	30.4	-41.1	0	0	0	114	W147 L149 F169	P117-W147 HydrophobicContact CG-CE3 3.71Å; P117-W147 HydrophobicContact CG-CZ3 3.88Å; P117-L149 HydrophobicContact CG-CD1 3.85Å; P117-F169 HydrophobicContact CB-CB 3.87Å; P117-F169 HydrophobicContact CB-CD1 4.48Å; P117-F169 HydrophobicContact CB-CD2 3.76Å; P117-F169 HydrophobicContact CB-CE2 4.48Å; P117-F169 HydrophobicContact CB-CG 3.79Å; P117-F169 HydrophobicContact CG-CD2 4.15Å; P117-F169 HydrophobicContact CG-CE2 4.4Å; P117-F169 HydrophobicContact CG-CG 4.3Å
118	K	78.2	Confident	85	Confident	106 Å²	106	56.9 Å²	56.9	46%	0.461	28%	0.283	S	S	.	.	S	Bend	trans	-133.8	156.9	171.5	60.9	-177.3	176.8	-176.9	0	109.8	W116 V120 W147	W116-K118 VanDerWaalsContact C-N 3.27Å; K118-V120 PolarHBondContact O-N 2.8Å; K118-W147 HydrophobicContact CD-CH2 4.31Å; K118-W147 HydrophobicContact CD-CZ2 4.26Å; K118-W147 VanDerWaalsContact CE-CE2 3.43Å; K118-W147 HydrophobicContact CG-CH2 3.79Å; K118-W147 HydrophobicContact CG-CZ2 4.25Å; K118-W147 HydrophobicContact CG-CZ3 4.2Å
119	S	80.3	Confident	85.2	Confident	104 Å²	104	57.7 Å²	57.7	73%	0.727	29%	0.286	S	S	*	.			trans	-69.2	115.5	175.9	-67.5	0	0	0	0	110.2	I114	I114-S119 CarbonylContact O-C 3.5Å; I114-S119 WeakPolarHBondContact O-CA 3.5Å
120	V	88.1	Confident	85	Confident	34 Å²	34	60.4 Å²	60.4	21%	0.206	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	149.2	175.6	68	0	0	0	0	109.9	I114 K118 V122 L143 W147	I114-V120 HydrophobicContact CB-CG1 3.76Å; I114-V120 HydrophobicContact CD1-CG1 3.74Å; I114-V120 HydrophobicContact CG1-CG1 4.03Å; I114-V120 PolarHBondContact N-O 3.46Å; I114-V120 PolarHBondContact O-N 3.17Å; K118-V120 PolarHBondContact O-N 2.8Å; V120-V122 HydrophobicContact CG1-CG2 4.41Å; V120-V122 HydrophobicContact CG2-CG2 4.46Å; V120-L143 HydrophobicContact CG1-CD1 4.36Å; V120-L143 HydrophobicContact CG2-CD1 4.05Å; V120-W147 HydrophobicContact CB-CH2 4.13Å; V120-W147 HydrophobicContact CG1-CH2 3.62Å; V120-W147 HydrophobicContact CG1-CZ2 4.43Å; V120-W147 HydrophobicContact CG1-CZ3 4.47Å
121	E	89.2	Confident	84.7	Confident	125 Å²	125	62.8 Å²	62.8	58%	0.584	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.1	132.3	174.1	-58.4	-171.6	177.1	0	0	109.4	T111 L112 H113	T111-E121 HydrophobicContact CG2-CB 3.98Å; L112-E121 WeakPolarHBondContact O-CA 3.3Å; H113-E121 IonicContact CE1-OE1 3.59Å; H113-E121 PolarHBondContact CE1-OE1 3.41Å; H113-E121 IonicContact CE1-OE2 3.76Å; H113-E121 PolarHBondContact CE1-OE2 3.4Å; H113-E121 WeakPolarHBondContact ND1-CG 3.35Å; H113-E121 IonicContact ND1-OE1 2.8Å; H113-E121 PolarHBondContact ND1-OE1 3.15Å; H113-E121 IonicContact ND1-OE2 3.25Å
122	V	90.2	Very high	84.5	Confident	12 Å²	12	62.2 Å²	62.2	7%	0.073	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	126.7	-179.6	-169.9	0	0	0	0	109.2	L112 I114 V120 A139 A140 L143	L112-V122 PolarHBondContact N-O 3.01Å; L112-V122 PolarHBondContact O-N 2.96Å; I114-V122 HydrophobicContact CD1-CG2 4.01Å; V120-V122 HydrophobicContact CG1-CG2 4.41Å; V120-V122 HydrophobicContact CG2-CG2 4.46Å; V122-A139 HydrophobicContact CG1-CB 3.33Å; V122-A140 HydrophobicContact CG2-CB 4.18Å; V122-L143 HydrophobicContact CG2-CD1 3.51Å
123	E	89.7	Confident	84.5	Confident	87 Å²	87	63.2 Å²	63.2	41%	0.407	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	138.7	-178.7	-57.9	-169.8	155.8	0	0	111.9	K109 V110 T111 Y125	K109-E123 WeakPolarHBondContact CE-OE1 3.47Å; K109-E123 WeakPolarHBondContact CE-OE2 3.34Å; K109-E123 IonicContact NZ-OE1 3.63Å; K109-E123 PolarHBondContact NZ-OE1 3.13Å; K109-E123 IonicContact NZ-OE2 3.3Å; K109-E123 PolarHBondContact NZ-OE2 3.35Å; V110-E123 CarbonylContact O-C 3.55Å; V110-E123 WeakPolarHBondContact O-CA 3.46Å; T111-E123 HydrophobicContact CG2-CG 4.34Å; E123-Y125 HydrophobicContact CB-CE2 3.94Å; E123-Y125 PolarHBondContact OE2-OH 3.5Å
124	G	87.7	Confident	84.5	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	143.7	173.4	0	0	0	0	0	111.1	K109 V110 A132	K109-G124 WeakPolarHBondContact CA-O 3.22Å; V110-G124 PolarHBondContact N-O 2.76Å; V110-G124 PolarHBondContact O-N 3.33Å; G124-A132 WeakPolarHBondContact CA-O 3.46Å
125	Y	85.8	Confident	84.5	Confident	108 Å²	108	66.8 Å²	66.8	42%	0.424	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	133.8	-177.8	-63.2	-94.3	0	0	0	109.5	K108 K109 E123	K108-Y125 WeakPolarHBondContact O-CA 3.48Å; K109-Y125 HydrophobicContact CB-CD1 4.01Å; K109-Y125 HydrophobicContact CB-CE1 3.85Å; K109-Y125 HydrophobicContact CD-CE1 3.63Å; K109-Y125 WeakPolarHBondContact CD-OH 3.43Å; K109-Y125 VanDerWaalsContact CE-OH 3.24Å; K109-Y125 WeakPolarHBondContact CE-OH 3.49Å; K109-Y125 HydrophobicContact CG-CD1 4.1Å; K109-Y125 HydrophobicContact CG-CE1 3.58Å; K109-Y125 PolarHBondContact NZ-OH 2.89Å; E123-Y125 HydrophobicContact CB-CE2 3.94Å; E123-Y125 PolarHBondContact OE2-OH 3.5Å
126	G	83.5	Confident	85	Confident	7 Å²	7	61.4 Å²	61.4	7%	0.072	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	159.1	-177	0	0	0	0	0	112.5	K108	K108-G126 PolarHBondContact N-O 3.26Å; K108-G126 PolarHBondContact O-N 3.05Å
127	S	79.8	Confident	85.6	Confident	98 Å²	98	60.1 Å²	60.1	69%	0.685	30%	0.3	S	S	*	.	S	Bend	trans	-68.4	-39.5	170.9	45.4	0	0	0	0	110.6	D131	S127-D131 PolarHBondContact OG-OD2 3.1Å
128	K	79.7	Confident	86.5	Confident	148 Å²	148	59.2 Å²	59.2	64%	0.643	29%	0.294	S	S	*	.	S	Bend	trans	-108.1	158.3	172.9	-55.7	178.7	-179.8	179.4	0	111.1	I130 D131 A132	K128-I130 VanDerWaalsContact C-N 3.27Å; K128-I130 PolarHBondContact O-N 2.81Å; K128-D131 WeakPolarHBondContact CB-OD2 3.34Å; K128-D131 PolarHBondContact N-OD2 2.87Å; K128-D131 PolarHBondContact O-N 2.6Å; K128-D131 VanDerWaalsContact O-N 3.11Å; K128-A132 PolarHBondContact O-N 2.85Å; K128-A132 VanDerWaalsContact O-N 3.1Å
129	K	80	Confident	87.1	Confident	114 Å²	114	55 Å²	55	50%	0.496	28%	0.279	S	S	.	.	H	α-helix	trans	-53.3	-45.9	176.7	-173.8	-173.5	177.4	-170.9	0	111.6	H101 D131 A132 E133	H101-K129 WeakPolarHBondContact CD2-CE 3.22Å; H101-K129 WeakPolarHBondContact CE1-CE 3.31Å; H101-K129 VanDerWaalsContact ND1-CE 3.28Å; H101-K129 WeakPolarHBondContact ND1-CE 3.39Å; H101-K129 WeakPolarHBondContact NE2-CE 3.3Å; K129-D131 VanDerWaalsContact C-N 3.33Å; K129-D131 PolarHBondContact O-N 3.04Å; K129-A132 PolarHBondContact O-N 2.83Å; K129-E133 VanDerWaalsContact CE-OE1 3.28Å; K129-E133 WeakPolarHBondContact CE-OE1 3.43Å; K129-E133 WeakPolarHBondContact O-CG 3.4Å; K129-E133 PolarHBondContact O-N 2.78Å
130	I	82.3	Confident	87.7	Confident	103 Å²	103	50.1 Å²	50.1	53%	0.528	25%	0.245	S	C	.	.	H	α-helix	trans	-63.4	-37.6	179.4	-110.8	163.1	0	0	0	112.2	K128 E133 R134	K128-I130 VanDerWaalsContact C-N 3.27Å; K128-I130 PolarHBondContact O-N 2.81Å; I130-E133 PolarHBondContact O-N 2.86Å; I130-R134 WeakPolarHBondContact O-CB 3.27Å; I130-R134 WeakPolarHBondContact O-CG 3.44Å; I130-R134 PolarHBondContact O-N 2.84Å
131	D	84.3	Confident	87.9	Confident	51 Å²	51	48.5 Å²	48.5	27%	0.273	24%	0.235	S	C	.	.	H	α-helix	trans	-69.5	-41	-179.8	-58.7	-33.5	0	0	0	110.5	S127 K128 K129 R134 Q135	S127-D131 PolarHBondContact OG-OD2 3.1Å; K128-D131 WeakPolarHBondContact CB-OD2 3.34Å; K128-D131 PolarHBondContact N-OD2 2.87Å; K128-D131 PolarHBondContact O-N 2.6Å; K128-D131 VanDerWaalsContact O-N 3.11Å; K129-D131 VanDerWaalsContact C-N 3.33Å; K129-D131 PolarHBondContact O-N 3.04Å; D131-R134 PolarHBondContact O-N 3.39Å; D131-Q135 WeakPolarHBondContact O-CB 3.32Å; D131-Q135 PolarHBondContact O-N 2.82Å
132	A	86.7	Confident	87.9	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64.1	-40.6	175.8	0	0	0	0	0	111.9	K108 V110 G124 K128 K129 Q135 A136	K108-A132 HydrophobicContact CB-CB 4.47Å; K108-A132 WeakPolarHBondContact O-CB 3.4Å; V110-A132 HydrophobicContact CB-CB 4.14Å; V110-A132 HydrophobicContact CG2-CB 3.55Å; G124-A132 WeakPolarHBondContact CA-O 3.46Å; K128-A132 PolarHBondContact O-N 2.85Å; K128-A132 VanDerWaalsContact O-N 3.1Å; K129-A132 PolarHBondContact O-N 2.83Å; A132-Q135 PolarHBondContact O-N 2.94Å; A132-A136 PolarHBondContact O-N 3.01Å
133	E	91.4	Very high	87.9	Confident	21 Å²	21	49.3 Å²	49.3	10%	0.098	24%	0.24	C	C	.	.	H	α-helix	trans	-64.6	-44.9	174.1	-70.3	167.4	-179.3	0	0	112.4	K77 Y99 H101 V110 K129 I130 Q135 A136 A137	K77-E133 VanDerWaalsContact CE-CB 3.46Å; K77-E133 IonicContact NZ-OE2 3.24Å; K77-E133 PolarHBondContact NZ-OE2 2.86Å; Y99-E133 HydrophobicContact CD1-CB 4.21Å; Y99-E133 HydrophobicContact CD1-CG 4.11Å; Y99-E133 HydrophobicContact CE1-CB 4.31Å; H101-E133 IonicContact CE1-OE1 3.1Å; H101-E133 PolarHBondContact CE1-OE1 3Å; H101-E133 IonicContact ND1-OE1 2.7Å; H101-E133 IonicContact NE2-OE1 2.62Å; H101-E133 PolarHBondContact NE2-OE1 3.16Å; V110-E133 HydrophobicContact CG1-CG 4.05Å; V110-E133 HydrophobicContact CG2-CG 4.12Å; K129-E133 VanDerWaalsContact CE-OE1 3.28Å; K129-E133 WeakPolarHBondContact CE-OE1 3.43Å; K129-E133 WeakPolarHBondContact O-CG 3.4Å; K129-E133 PolarHBondContact O-N 2.78Å; I130-E133 PolarHBondContact O-N 2.86Å; E133-Q135 VanDerWaalsContact C-N 3.27Å; E133-Q135 PolarHBondContact O-N 2.8Å; E133-A136 PolarHBondContact O-N 3.25Å; E133-A137 VanDerWaalsContact O-CB 3.32Å; E133-A137 WeakPolarHBondContact O-CB 3.29Å; E133-A137 PolarHBondContact O-N 2.55Å
134	R	91.6	Very high	87.8	Confident	99 Å²	99	45.1 Å²	45.1	37%	0.374	22%	0.22	S	C	.	.	H	α-helix	trans	-62	-38.8	176.5	-75.1	-179.8	74.6	-174.9	5.5	110.8	L70 P74 P76 I130 D131 A137 A138	L70-R134 HydrophobicContact CD2-CB 3.97Å; P74-R134 PolarHBondContact O-NH2 3.43Å; P76-R134 HydrophobicContact CG-CB 4.37Å; P76-R134 VanDerWaalsContact CG-O 3.3Å; P76-R134 WeakPolarHBondContact CG-O 3.37Å; I130-R134 WeakPolarHBondContact O-CB 3.27Å; I130-R134 WeakPolarHBondContact O-CG 3.44Å; I130-R134 PolarHBondContact O-N 2.84Å; D131-R134 PolarHBondContact O-N 3.39Å; R134-A137 PolarHBondContact O-N 2.86Å; R134-A138 WeakPolarHBondContact O-CB 3.37Å; R134-A138 PolarHBondContact O-N 3.05Å
135	Q	89.5	Confident	87.8	Confident	26 Å²	26	47.7 Å²	47.7	12%	0.121	23%	0.231	C	C	.	.	H	α-helix	trans	-65.6	-45.8	177	-165.3	69	19.9	0	0	112	S66 L70 D131 A132 E133 A137 A138 A139	S66-Q135 PolarHBondContact O-NE2 3.13Å; L70-Q135 VanDerWaalsContact CD1-OE1 3.24Å; D131-Q135 WeakPolarHBondContact O-CB 3.32Å; D131-Q135 PolarHBondContact O-N 2.82Å; A132-Q135 PolarHBondContact O-N 2.94Å; E133-Q135 VanDerWaalsContact C-N 3.27Å; E133-Q135 PolarHBondContact O-N 2.8Å; Q135-A137 VanDerWaalsContact C-N 3.3Å; Q135-A137 PolarHBondContact O-N 2.85Å; Q135-A138 PolarHBondContact O-N 3.46Å; Q135-A139 PolarHBondContact O-N 2.94Å
136	A	92.2	Very high	87.7	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61	-43	176.4	0	0	0	0	0	110.9	L112 A132 E133 A140	L112-A136 HydrophobicContact CB-CB 3.91Å; A132-A136 PolarHBondContact O-N 3.01Å; E133-A136 PolarHBondContact O-N 3.25Å; A136-A140 WeakPolarHBondContact O-CB 3.41Å; A136-A140 PolarHBondContact O-N 3.02Å
137	A	93.7	Very high	87.8	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.4	-40.3	175.9	0	0	0	0	0	112.3	P76 K77 L80 Y99 E133 R134 Q135 A140 C141	P76-A137 HydrophobicContact CB-CB 3.8Å; P76-A137 HydrophobicContact CG-CB 3.93Å; K77-A137 HydrophobicContact CG-CB 3.8Å; L80-A137 HydrophobicContact CD1-CB 3.84Å; Y99-A137 HydrophobicContact CE1-CB 4.45Å; E133-A137 VanDerWaalsContact O-CB 3.32Å; E133-A137 WeakPolarHBondContact O-CB 3.29Å; E133-A137 PolarHBondContact O-N 2.55Å; R134-A137 PolarHBondContact O-N 2.86Å; Q135-A137 VanDerWaalsContact C-N 3.3Å; Q135-A137 PolarHBondContact O-N 2.85Å; A137-A140 WeakPolarHBondContact O-CB 3.43Å; A137-A140 PolarHBondContact O-N 2.86Å; A137-C141 PolarHBondContact O-N 3.28Å; A137-C141 PolarHBondContact O-SG 3.14Å
138	A	92.2	Very high	88	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66.8	-41	179.7	0	0	0	0	0	111.8	L69 L70 F73 P76 R134 Q135 A140 C141 Q142	L69-A138 HydrophobicContact CB-CB 4.1Å; L70-A138 HydrophobicContact CD2-CB 3.98Å; F73-A138 HydrophobicContact CB-CB 4.3Å; P76-A138 HydrophobicContact CB-CB 3.94Å; P76-A138 HydrophobicContact CG-CB 4.11Å; R134-A138 WeakPolarHBondContact O-CB 3.37Å; R134-A138 PolarHBondContact O-N 3.05Å; Q135-A138 PolarHBondContact O-N 3.46Å; A138-A140 VanDerWaalsContact C-N 3.28Å; A138-A140 PolarHBondContact O-N 3.02Å; A138-C141 WeakPolarHBondContact O-CB 3.36Å; A138-C141 PolarHBondContact O-N 3.1Å; A138-Q142 PolarHBondContact O-N 3.32Å
139	A	91.4	Very high	88.2	Confident	19 Å²	19	37.9 Å²	37.9	16%	0.157	21%	0.205	C	C	.	.	H	α-helix	trans	-63.4	-36.3	172.7	0	0	0	0	0	111.8	L69 V122 Q135 Q142 L143	L69-A139 HydrophobicContact CD1-CB 4.3Å; V122-A139 HydrophobicContact CG1-CB 3.33Å; Q135-A139 PolarHBondContact O-N 2.94Å; A139-Q142 WeakPolarHBondContact O-CB 3.49Å; A139-Q142 PolarHBondContact O-N 3.26Å; A139-L143 PolarHBondContact O-N 3.3Å; A139-L143 VanDerWaalsContact O-N 3.1Å
140	A	92.6	Very high	88.5	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-66	-40.9	172.6	0	0	0	0	0	113.1	L80 L112 I114 V122 A136 A137 A138 Q142 L143 F144	L80-A140 HydrophobicContact CD1-CB 3.73Å; L80-A140 HydrophobicContact CD2-CB 4.02Å; L80-A140 HydrophobicContact CG-CB 4.47Å; L112-A140 HydrophobicContact CD2-CB 3.8Å; I114-A140 HydrophobicContact CD1-CB 3.38Å; I114-A140 HydrophobicContact CG1-CB 4.48Å; V122-A140 HydrophobicContact CG2-CB 4.18Å; A136-A140 WeakPolarHBondContact O-CB 3.41Å; A136-A140 PolarHBondContact O-N 3.02Å; A137-A140 WeakPolarHBondContact O-CB 3.43Å; A137-A140 PolarHBondContact O-N 2.86Å; A138-A140 VanDerWaalsContact C-N 3.28Å; A138-A140 PolarHBondContact O-N 3.02Å; A140-Q142 VanDerWaalsContact C-N 3.26Å; A140-Q142 PolarHBondContact O-N 2.89Å; A140-L143 WeakPolarHBondContact O-CB 3.09Å; A140-L143 PolarHBondContact O-N 2.98Å; A140-F144 WeakPolarHBondContact O-CD1 3.47Å; A140-F144 PolarHBondContact O-N 3.14Å
141	C	91.8	Very high	88.4	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.9	-39	172.2	-68	0	0	0	0	111.8	F73 P76 L79 A137 A138 L143 F144 K145 L150	F73-C141 HydrophobicContact CB-CB 4.35Å; F73-C141 HydrophobicContact CD1-CB 3.44Å; F73-C141 VanDerWaalsContact CD1-CB 3.44Å; F73-C141 HydrophobicContact CD2-CB 4.03Å; F73-C141 HydrophobicContact CE1-CB 3.58Å; F73-C141 HydrophobicContact CE2-CB 4.19Å; F73-C141 HydrophobicContact CG-CB 3.67Å; F73-C141 HydrophobicContact CZ-CB 3.97Å; P76-C141 PolarHBondContact O-SG 2.87Å; L79-C141 HydrophobicContact CD2-CB 4.43Å; A137-C141 PolarHBondContact O-N 3.28Å; A137-C141 PolarHBondContact O-SG 3.14Å; A138-C141 WeakPolarHBondContact O-CB 3.36Å; A138-C141 PolarHBondContact O-N 3.1Å; C141-L143 VanDerWaalsContact C-N 3.34Å; C141-L143 PolarHBondContact O-N 3.04Å; C141-F144 PolarHBondContact O-N 3.34Å; C141-K145 WeakPolarHBondContact O-CB 3.34Å; C141-K145 PolarHBondContact O-N 3.13Å; C141-L150 HydrophobicContact CB-CD1 4.31Å
142	Q	90.7	Very high	88	Confident	95 Å²	95	30.6 Å²	30.6	44%	0.444	18%	0.178	S	C	.	.	H	α-helix	trans	-62.9	-41	176	-165.3	-178.2	28.9	0	0	111.7	L69 F73 A138 A139 A140 K145 G146	L69-Q142 HydrophobicContact CD2-CB 4.24Å; L69-Q142 HydrophobicContact CD2-CG 4.2Å; F73-Q142 HydrophobicContact CE2-CB 3.96Å; F73-Q142 HydrophobicContact CE2-CG 4.49Å; F73-Q142 HydrophobicContact CZ-CB 4.37Å; A138-Q142 PolarHBondContact O-N 3.32Å; A139-Q142 WeakPolarHBondContact O-CB 3.49Å; A139-Q142 PolarHBondContact O-N 3.26Å; A140-Q142 VanDerWaalsContact C-N 3.26Å; A140-Q142 PolarHBondContact O-N 2.89Å; Q142-K145 PolarHBondContact O-N 2.95Å; Q142-G146 PolarHBondContact O-N 3.06Å
143	L	89	Confident	87.6	Confident	59 Å²	59	40.9 Å²	40.9	31%	0.309	22%	0.217	S	C	.	.	H	α-helix	trans	-61.4	-43.9	171.9	-70	175.7	0	0	0	111.7	V120 V122 A139 A140 C141 K145 G146 W147	V120-L143 HydrophobicContact CG1-CD1 4.36Å; V120-L143 HydrophobicContact CG2-CD1 4.05Å; V122-L143 HydrophobicContact CG2-CD1 3.51Å; A139-L143 PolarHBondContact O-N 3.3Å; A139-L143 VanDerWaalsContact O-N 3.1Å; A140-L143 WeakPolarHBondContact O-CB 3.09Å; A140-L143 PolarHBondContact O-N 2.98Å; C141-L143 VanDerWaalsContact C-N 3.34Å; C141-L143 PolarHBondContact O-N 3.04Å; L143-K145 VanDerWaalsContact C-N 3.3Å; L143-K145 PolarHBondContact O-N 2.78Å; L143-G146 CarbonylContact O-C 3.56Å; L143-G146 PolarHBondContact O-N 3.5Å; L143-G146 VanDerWaalsContact O-N 3.14Å; L143-W147 HydrophobicContact CB-CZ2 4.18Å; L143-W147 HydrophobicContact CD1-CZ2 4.44Å; L143-W147 PolarHBondContact O-N 3.16Å
144	F	89	Confident	87.3	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.2	-39.9	178.8	-83.6	28.9	0	0	0	111.6	L80 V83 I84 I114 A140 C141 W147 G148 L149 L150	L80-F144 HydrophobicContact CD2-CD1 4.3Å; L80-F144 HydrophobicContact CD2-CD2 3.69Å; L80-F144 HydrophobicContact CD2-CE1 4.23Å; L80-F144 HydrophobicContact CD2-CE2 3.62Å; L80-F144 HydrophobicContact CD2-CG 4.05Å; L80-F144 HydrophobicContact CD2-CZ 3.91Å; V83-F144 HydrophobicContact CB-CD2 4.09Å; V83-F144 HydrophobicContact CB-CE2 4.16Å; V83-F144 HydrophobicContact CG1-CD2 3.71Å; V83-F144 HydrophobicContact CG1-CE2 3.8Å; V83-F144 HydrophobicContact CG2-CD2 4.34Å; I84-F144 HydrophobicContact CD1-CE2 4.37Å; I84-F144 HydrophobicContact CD1-CZ 4.19Å; I84-F144 HydrophobicContact CG1-CE2 3.99Å; I84-F144 HydrophobicContact CG1-CZ 4.21Å; I114-F144 HydrophobicContact CD1-CE1 4.14Å; I114-F144 HydrophobicContact CG2-CE1 4Å; I114-F144 HydrophobicContact CG2-CZ 3.94Å; A140-F144 WeakPolarHBondContact O-CD1 3.47Å; A140-F144 PolarHBondContact O-N 3.14Å; C141-F144 PolarHBondContact O-N 3.34Å; F144-W147 AromaticContact CD1-CE3 3.97Å; F144-W147 HydrophobicContact CD1-CE3 3.97Å; F144-W147 AromaticContact CD1-CZ3 3.97Å; F144-W147 HydrophobicContact CD1-CZ3 3.97Å; F144-W147 HydrophobicContact CE1-CE3 4.22Å; F144-W147 AromaticContact CE1-CZ3 3.84Å; F144-W147 HydrophobicContact CE1-CZ3 3.84Å; F144-W147 PolarHBondContact O-N 2.99Å; F144-G148 PolarHBondContact O-N 3.27Å; F144-L149 HydrophobicContact CB-CB 4.17Å; F144-L149 HydrophobicContact CB-CD1 4.42Å; F144-L149 HydrophobicContact CD1-CD1 4.2Å; F144-L149 HydrophobicContact CD2-CB 4.44Å; F144-L149 HydrophobicContact CD2-CD1 4.07Å; F144-L149 HydrophobicContact CE1-CD1 4.46Å; F144-L149 HydrophobicContact CE2-CD1 4.34Å; F144-L149 HydrophobicContact CG-CB 4.45Å; F144-L149 HydrophobicContact CG-CD1 3.98Å; F144-L149 WeakPolarHBondContact O-CB 3.32Å; F144-L149 PolarHBondContact O-N 3.48Å; F144-L150 HydrophobicContact CB-CD1 3.88Å; F144-L150 HydrophobicContact CB-CG 4.31Å
145	K	86.8	Confident	86.9	Confident	53 Å²	53	41.1 Å²	41.1	23%	0.23	22%	0.224	C	C	.	.	H	α-helix	trans	-63.8	-44	173	-164.8	172.1	-173.9	169.3	0	111.6	E72 F73 C141 Q142 L143 W147 G148 L150 P152 N154	E72-K145 IonicContact OE1-NZ 3.97Å; E72-K145 PolarHBondContact OE1-NZ 2.72Å; F73-K145 HydrophobicContact CE1-CD 4.38Å; F73-K145 HydrophobicContact CZ-CD 3.99Å; C141-K145 WeakPolarHBondContact O-CB 3.34Å; C141-K145 PolarHBondContact O-N 3.13Å; Q142-K145 PolarHBondContact O-N 2.95Å; L143-K145 VanDerWaalsContact C-N 3.3Å; L143-K145 PolarHBondContact O-N 2.78Å; K145-W147 VanDerWaalsContact C-N 3.27Å; K145-W147 PolarHBondContact O-N 3.39Å; K145-G148 PolarHBondContact O-N 2.75Å; K145-L150 HydrophobicContact CB-CB 4.21Å; K145-L150 HydrophobicContact CG-CB 4.45Å; K145-P152 WeakPolarHBondContact CE-O 3.15Å; K145-P152 PolarHBondContact NZ-O 3.38Å; K145-N154 PolarHBondContact NZ-OD1 3.05Å
146	G	84	Confident	86.7	Confident	69 Å²	69	42.8 Å²	42.8	71%	0.711	23%	0.233	S	C	*	.	H	α-helix	trans	-63.2	-29.7	174.4	0	0	0	0	0	114	Q142 L143 G148	Q142-G146 PolarHBondContact O-N 3.06Å; L143-G146 CarbonylContact O-C 3.56Å; L143-G146 PolarHBondContact O-N 3.5Å; L143-G146 VanDerWaalsContact O-N 3.14Å; G146-G148 VanDerWaalsContact C-N 3.28Å
147	W	84.6	Confident	86.3	Confident	51 Å²	51	44.3 Å²	44.3	19%	0.193	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-1.5	173.9	-59.9	-14.6	0	0	0	113.4	P117 K118 V120 L143 F144 K145 L149 F169	P117-W147 HydrophobicContact CG-CE3 3.71Å; P117-W147 HydrophobicContact CG-CZ3 3.88Å; K118-W147 HydrophobicContact CD-CH2 4.31Å; K118-W147 HydrophobicContact CD-CZ2 4.26Å; K118-W147 VanDerWaalsContact CE-CE2 3.43Å; K118-W147 HydrophobicContact CG-CH2 3.79Å; K118-W147 HydrophobicContact CG-CZ2 4.25Å; K118-W147 HydrophobicContact CG-CZ3 4.2Å; V120-W147 HydrophobicContact CB-CH2 4.13Å; V120-W147 HydrophobicContact CG1-CH2 3.62Å; V120-W147 HydrophobicContact CG1-CZ2 4.43Å; V120-W147 HydrophobicContact CG1-CZ3 4.47Å; L143-W147 HydrophobicContact CB-CZ2 4.18Å; L143-W147 HydrophobicContact CD1-CZ2 4.44Å; L143-W147 PolarHBondContact O-N 3.16Å; F144-W147 AromaticContact CD1-CE3 3.97Å; F144-W147 HydrophobicContact CD1-CE3 3.97Å; F144-W147 AromaticContact CD1-CZ3 3.97Å; F144-W147 HydrophobicContact CD1-CZ3 3.97Å; F144-W147 HydrophobicContact CE1-CE3 4.22Å; F144-W147 AromaticContact CE1-CZ3 3.84Å; F144-W147 HydrophobicContact CE1-CZ3 3.84Å; F144-W147 PolarHBondContact O-N 2.99Å; K145-W147 VanDerWaalsContact C-N 3.27Å; K145-W147 PolarHBondContact O-N 3.39Å; W147-L149 VanDerWaalsContact C-N 3.34Å; W147-L149 HydrophobicContact CB-CD1 4.49Å; W147-L149 HydrophobicContact CB-CG 4.3Å; W147-L149 HydrophobicContact CE3-CD1 4.11Å; W147-F169 HydrophobicContact CB-CZ 4.43Å
148	G	84	Confident	85.5	Confident	35 Å²	35	48.4 Å²	48.4	36%	0.361	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.8	24.7	-178	0	0	0	0	0	114.1	F144 K145 G146 F157	F144-G148 PolarHBondContact O-N 3.27Å; K145-G148 PolarHBondContact O-N 2.75Å; G146-G148 VanDerWaalsContact C-N 3.28Å; G148-F157 VanDerWaalsContact O-CE2 3.28Å; G148-F157 WeakPolarHBondContact O-CE2 3.4Å
149	L	85.4	Confident	84.7	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.277	C	S	.	.	S	Bend	trans	-89.3	-12.1	172.8	-62.2	175.7	0	0	0	113.2	V83 W116 P117 F144 W147 Y162 L165 F169	V83-L149 HydrophobicContact CG1-CB 4.28Å; W116-L149 HydrophobicContact CH2-CD1 4.36Å; W116-L149 HydrophobicContact CH2-CD2 4.09Å; W116-L149 HydrophobicContact CZ3-CD1 3.99Å; P117-L149 HydrophobicContact CG-CD1 3.85Å; F144-L149 HydrophobicContact CB-CB 4.17Å; F144-L149 HydrophobicContact CB-CD1 4.42Å; F144-L149 HydrophobicContact CD1-CD1 4.2Å; F144-L149 HydrophobicContact CD2-CB 4.44Å; F144-L149 HydrophobicContact CD2-CD1 4.07Å; F144-L149 HydrophobicContact CE1-CD1 4.46Å; F144-L149 HydrophobicContact CE2-CD1 4.34Å; F144-L149 HydrophobicContact CG-CB 4.45Å; F144-L149 HydrophobicContact CG-CD1 3.98Å; F144-L149 WeakPolarHBondContact O-CB 3.32Å; F144-L149 PolarHBondContact O-N 3.48Å; W147-L149 VanDerWaalsContact C-N 3.34Å; W147-L149 HydrophobicContact CB-CD1 4.49Å; W147-L149 HydrophobicContact CB-CG 4.3Å; W147-L149 HydrophobicContact CE3-CD1 4.11Å; L149-Y162 HydrophobicContact CB-CE1 4.35Å; L149-Y162 HydrophobicContact CD2-CD1 4.4Å; L149-Y162 HydrophobicContact CD2-CE1 4.43Å; L149-Y162 WeakPolarHBondContact O-CE1 3.46Å; L149-Y162 PolarHBondContact O-OH 3.08Å; L149-L165 HydrophobicContact CD2-CB 4.27Å; L149-L165 HydrophobicContact CD2-CD1 4.26Å; L149-F169 HydrophobicContact CD2-CE2 4.3Å
150	L	85.8	Confident	83.9	Confident	7 Å²	7	52.2 Å²	52.2	4%	0.037	29%	0.293	C	S	.	.	S	Bend	trans	-125.1	141.4	172.6	-76.4	165.8	0	0	0	108.4	F73 L79 V83 C141 F144 K145 L156	F73-L150 HydrophobicContact CE1-CD1 4.46Å; L79-L150 HydrophobicContact CD1-CD2 3.74Å; L79-L150 HydrophobicContact CD2-CD1 3.77Å; L79-L150 HydrophobicContact CD2-CD2 3.99Å; L79-L150 HydrophobicContact CG-CD1 4.21Å; L79-L150 HydrophobicContact CG-CD2 3.88Å; V83-L150 HydrophobicContact CG2-CD2 3.52Å; V83-L150 HydrophobicContact CG2-CG 3.98Å; C141-L150 HydrophobicContact CB-CD1 4.31Å; F144-L150 HydrophobicContact CB-CD1 3.88Å; F144-L150 HydrophobicContact CB-CG 4.31Å; K145-L150 HydrophobicContact CB-CB 4.21Å; K145-L150 HydrophobicContact CG-CB 4.45Å; L150-L156 HydrophobicContact CD2-CD2 4.2Å
151	G	78.9	Confident	83.1	Confident	2 Å²	2	56.8 Å²	56.8	2%	0.021	31%	0.313	C	S	.	.			trans	-69.5	168.9	173	0	0	0	0	0	112.8	R153 N154 E155	G151-R153 PolarHBondContact O-N 3.15Å; G151-R153 VanDerWaalsContact O-N 3.09Å; G151-N154 WeakPolarHBondContact O-CA 3.37Å; G151-N154 PolarHBondContact O-N 2.89Å; G151-E155 WeakPolarHBondContact CA-OE1 3.38Å; G151-E155 PolarHBondContact N-O 2.67Å
152	P	76.2	Confident	82.7	Confident	106 Å²	106	56.8 Å²	56.8	69%	0.688	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-28.5	-178.2	18.7	-31.9	0	0	0	114.1	K145 E155	K145-P152 WeakPolarHBondContact CE-O 3.15Å; K145-P152 PolarHBondContact NZ-O 3.38Å; P152-E155 VanDerWaalsContact CD-OE1 3.27Å; P152-E155 WeakPolarHBondContact CD-OE1 3.38Å
153	R	78.7	Confident	81.5	Confident	217 Å²	217	60.1 Å²	60.1	82%	0.819	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	21.1	175.3	-62.6	-176.6	176.8	-170.7	-0.5	113.9	G151 E155	G151-R153 PolarHBondContact O-N 3.15Å; G151-R153 VanDerWaalsContact O-N 3.09Å; R153-E155 PolarHBondContact O-N 3.18Å
154	N	85.8	Confident	80.6	Confident	34 Å²	34	61.9 Å²	61.9	18%	0.182	33%	0.334	C	S	.	.	S	Bend	trans	64	23.2	-175.2	-47.6	-27.3	0	0	0	113.4	E72 F73 L79 K145 G151	E72-N154 PolarHBondContact O-ND2 3.32Å; F73-N154 HydrophobicContact CE1-CB 4.4Å; F73-N154 VanDerWaalsContact CE1-CG 3.46Å; F73-N154 WeakPolarHBondContact CE1-OD1 3.31Å; L79-N154 HydrophobicContact CD2-CB 3.98Å; K145-N154 PolarHBondContact NZ-OD1 3.05Å; G151-N154 WeakPolarHBondContact O-CA 3.37Å; G151-N154 PolarHBondContact O-N 2.89Å
155	E	83.2	Confident	79.6	Confident	90 Å²	90	63.2 Å²	63.2	42%	0.421	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-72.7	145	175.5	66.5	-124	156.7	0	0	111.4	G151 P152 R153	G151-E155 WeakPolarHBondContact CA-OE1 3.38Å; G151-E155 PolarHBondContact N-O 2.67Å; P152-E155 VanDerWaalsContact CD-OE1 3.27Å; P152-E155 WeakPolarHBondContact CD-OE1 3.38Å; R153-E155 PolarHBondContact O-N 3.18Å
156	L	85	Confident	78.4	Confident	61 Å²	61	61.7 Å²	61.7	32%	0.319	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-80.7	147.4	175.4	-63.2	170	0	0	0	109.7	L79 V83 L150	L79-L156 HydrophobicContact CD1-CD2 4.05Å; L79-L156 HydrophobicContact CD1-CG 4.45Å; V83-L156 HydrophobicContact CB-CD2 4.27Å; V83-L156 HydrophobicContact CG2-CD2 3.35Å; L150-L156 HydrophobicContact CD2-CD2 4.2Å
157	F	83.5	Confident	77.4	Confident	32 Å²	32	64.3 Å²	64.3	14%	0.14	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-87.5	162.7	170.2	-58.2	-50.9	0	0	0	111.6	R86 G148 K161 Y162 L165	R86-F157 WeakPolarHBondContact CD-O 3.37Å; R86-F157 PolarHBondContact NE-O 2.99Å; G148-F157 VanDerWaalsContact O-CE2 3.28Å; G148-F157 WeakPolarHBondContact O-CE2 3.4Å; F157-K161 HydrophobicContact CB-CB 4.08Å; F157-K161 HydrophobicContact CB-CD 3.85Å; F157-K161 HydrophobicContact CB-CG 4.03Å; F157-K161 HydrophobicContact CD1-CD 3.78Å; F157-K161 HydrophobicContact CD2-CD 4.36Å; F157-K161 HydrophobicContact CE1-CD 4.47Å; F157-K161 HydrophobicContact CG-CD 3.71Å; F157-K161 HydrophobicContact CG-CG 4.2Å; F157-Y162 HydrophobicContact CB-CD2 4.09Å; F157-Y162 HydrophobicContact CB-CE1 4.28Å; F157-Y162 HydrophobicContact CB-CE2 3.76Å; F157-Y162 HydrophobicContact CB-CG 4.5Å; F157-Y162 AromaticContact CD2-CE1 3.85Å; F157-Y162 HydrophobicContact CD2-CE1 3.85Å; F157-Y162 AromaticContact CD2-CZ 3.93Å; F157-Y162 PolarHBondContact N-OH 2.73Å; F157-Y162 VanDerWaalsContact N-OH 3.15Å; F157-Y162 WeakPolarHBondContact O-CD2 3.25Å; F157-Y162 WeakPolarHBondContact O-CE2 3.05Å; F157-L165 HydrophobicContact CD2-CD1 4.07Å; F157-L165 HydrophobicContact CE2-CD1 4.4Å
158	D	77.6	Confident	76.4	Confident	87 Å²	87	72 Å²	72	47%	0.465	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-64.1	161.3	168.3	63.8	52.6	0	0	0	111.2	A160 K161 Y162	D158-A160 PolarHBondContact O-N 2.91Å; D158-A160 WeakPolarHBondContact OD1-CB 3.49Å; D158-A160 PolarHBondContact OD1-N 3.42Å; D158-A160 VanDerWaalsContact OD1-N 3.1Å; D158-K161 PolarHBondContact O-N 3.39Å; D158-K161 VanDerWaalsContact OD1-CB 3.29Å; D158-K161 WeakPolarHBondContact OD1-CB 3.2Å; D158-K161 PolarHBondContact OD1-N 2.63Å; D158-Y162 WeakPolarHBondContact O-CD2 3.39Å; D158-Y162 PolarHBondContact O-N 2.89Å; D158-Y162 VanDerWaalsContact O-N 3.16Å
159	A	74.3	Confident	75.3	Confident	38 Å²	38	74.1 Å²	74.1	31%	0.314	37%	0.365	S	S	.	.	H	α-helix	trans	-63.7	-28.4	-177.3	0	0	0	0	0	112.6	R86 R163	R86-A159 HydrophobicContact CG-CB 4.41Å; A159-R163 PolarHBondContact O-N 3.33Å
160	A	74.1	Confident	73.4	Confident	61 Å²	61	76.7 Å²	76.7	50%	0.504	39%	0.391	S	S	.	.	H	α-helix	trans	-69.8	-44.8	179.7	0	0	0	0	0	111.4	D158 Y162 R163 V164	D158-A160 PolarHBondContact O-N 2.91Å; D158-A160 WeakPolarHBondContact OD1-CB 3.49Å; D158-A160 PolarHBondContact OD1-N 3.42Å; D158-A160 VanDerWaalsContact OD1-N 3.1Å; A160-Y162 VanDerWaalsContact C-N 3.35Å; A160-Y162 PolarHBondContact O-N 2.69Å; A160-R163 VanDerWaalsContact O-CB 3.29Å; A160-R163 WeakPolarHBondContact O-CB 3.31Å; A160-R163 PolarHBondContact O-N 3.02Å; A160-R163 VanDerWaalsContact O-N 3.14Å; A160-V164 WeakPolarHBondContact O-CG2 3.3Å; A160-V164 PolarHBondContact O-N 3.07Å
161	K	77.7	Confident	70.9	Confident	96 Å²	96	81.5 Å²	81.5	42%	0.417	43%	0.425	S	S	.	.	H	α-helix	trans	-64.6	-38.8	176.1	-177.4	167.7	175.7	-170.7	0	111.6	F157 D158 R163 V164 L165	F157-K161 HydrophobicContact CB-CB 4.08Å; F157-K161 HydrophobicContact CB-CD 3.85Å; F157-K161 HydrophobicContact CB-CG 4.03Å; F157-K161 HydrophobicContact CD1-CD 3.78Å; F157-K161 HydrophobicContact CD2-CD 4.36Å; F157-K161 HydrophobicContact CE1-CD 4.47Å; F157-K161 HydrophobicContact CG-CD 3.71Å; F157-K161 HydrophobicContact CG-CG 4.2Å; D158-K161 PolarHBondContact O-N 3.39Å; D158-K161 VanDerWaalsContact OD1-CB 3.29Å; D158-K161 WeakPolarHBondContact OD1-CB 3.2Å; D158-K161 PolarHBondContact OD1-N 2.63Å; K161-R163 VanDerWaalsContact C-N 3.32Å; K161-V164 PolarHBondContact O-N 3.31Å; K161-L165 HydrophobicContact CG-CD1 4.26Å; K161-L165 WeakPolarHBondContact O-CB 3.4Å; K161-L165 VanDerWaalsContact O-CG 3.3Å; K161-L165 WeakPolarHBondContact O-CG 3.17Å; K161-L165 PolarHBondContact O-N 3.3Å
162	Y	81.6	Confident	68.9	Low	0 Å²	0	87.5 Å²	87.5	0%	0	46%	0.464	C	S	.	.	H	α-helix	trans	-64.4	-36.5	171.9	-78.8	-56.7	0	0	0	113	V83 R86 A87 L149 F157 D158 A160 L165 A166	V83-Y162 HydrophobicContact CG1-CE1 3.83Å; R86-Y162 HydrophobicContact CB-CD2 4.24Å; R86-Y162 HydrophobicContact CB-CE2 4.29Å; R86-Y162 HydrophobicContact CG-CD2 4.25Å; R86-Y162 HydrophobicContact CG-CE2 4.42Å; A87-Y162 HydrophobicContact CB-CD1 4.04Å; A87-Y162 HydrophobicContact CB-CD2 4.43Å; A87-Y162 HydrophobicContact CB-CG 3.81Å; L149-Y162 HydrophobicContact CB-CE1 4.35Å; L149-Y162 HydrophobicContact CD2-CD1 4.4Å; L149-Y162 HydrophobicContact CD2-CE1 4.43Å; L149-Y162 WeakPolarHBondContact O-CE1 3.46Å; L149-Y162 PolarHBondContact O-OH 3.08Å; F157-Y162 HydrophobicContact CB-CD2 4.09Å; F157-Y162 HydrophobicContact CB-CE1 4.28Å; F157-Y162 HydrophobicContact CB-CE2 3.76Å; F157-Y162 HydrophobicContact CB-CG 4.5Å; F157-Y162 AromaticContact CD2-CE1 3.85Å; F157-Y162 HydrophobicContact CD2-CE1 3.85Å; F157-Y162 AromaticContact CD2-CZ 3.93Å; F157-Y162 PolarHBondContact N-OH 2.73Å; F157-Y162 VanDerWaalsContact N-OH 3.15Å; F157-Y162 WeakPolarHBondContact O-CD2 3.25Å; F157-Y162 WeakPolarHBondContact O-CE2 3.05Å; D158-Y162 WeakPolarHBondContact O-CD2 3.39Å; D158-Y162 PolarHBondContact O-N 2.89Å; D158-Y162 VanDerWaalsContact O-N 3.16Å; A160-Y162 VanDerWaalsContact C-N 3.35Å; A160-Y162 PolarHBondContact O-N 2.69Å; Y162-L165 HydrophobicContact CD1-CD1 4.32Å; Y162-L165 PolarHBondContact O-N 3.1Å; Y162-A166 VanDerWaalsContact O-CB 3.31Å; Y162-A166 WeakPolarHBondContact O-CB 3.29Å; Y162-A166 PolarHBondContact O-N 3.28Å
163	R	65.8	Low	66.7	Low	165 Å²	165	86.6 Å²	86.6	62%	0.623	47%	0.465	S	S	*	.	H	α-helix	trans	-59.6	-48.7	173.5	-119.2	174.6	-97.6	164	-8.8	111.4	A159 A160 K161 L165 A166 D167	A159-R163 PolarHBondContact O-N 3.33Å; A160-R163 VanDerWaalsContact O-CB 3.29Å; A160-R163 WeakPolarHBondContact O-CB 3.31Å; A160-R163 PolarHBondContact O-N 3.02Å; A160-R163 VanDerWaalsContact O-N 3.14Å; K161-R163 VanDerWaalsContact C-N 3.32Å; R163-L165 VanDerWaalsContact C-N 3.32Å; R163-L165 PolarHBondContact O-N 3.01Å; R163-A166 WeakPolarHBondContact O-CB 3.29Å; R163-A166 PolarHBondContact O-N 2.91Å; R163-A166 VanDerWaalsContact O-N 3.14Å; R163-D167 PolarHBondContact O-N 2.87Å
164	V	71.4	Confident	64.3	Low	95 Å²	95	83.9 Å²	83.9	58%	0.576	47%	0.467	S	S	*	.	H	α-helix	trans	-61	-39.8	175.7	176.6	0	0	0	0	112.1	A160 K161 R168	A160-V164 WeakPolarHBondContact O-CG2 3.3Å; A160-V164 PolarHBondContact O-N 3.07Å; K161-V164 PolarHBondContact O-N 3.31Å; V164-R168 PolarHBondContact O-N 3.06Å
165	L	67.2	Low	61.5	Low	28 Å²	28	87.8 Å²	87.8	15%	0.147	50%	0.497	C	S	.	.	H	α-helix	trans	-67.7	-39.4	175.6	-72.3	168.2	0	0	0	111.6	L149 F157 K161 Y162 R163 D167 R168 F169	L149-L165 HydrophobicContact CD2-CB 4.27Å; L149-L165 HydrophobicContact CD2-CD1 4.26Å; F157-L165 HydrophobicContact CD2-CD1 4.07Å; F157-L165 HydrophobicContact CE2-CD1 4.4Å; K161-L165 HydrophobicContact CG-CD1 4.26Å; K161-L165 WeakPolarHBondContact O-CB 3.4Å; K161-L165 VanDerWaalsContact O-CG 3.3Å; K161-L165 WeakPolarHBondContact O-CG 3.17Å; K161-L165 PolarHBondContact O-N 3.3Å; Y162-L165 HydrophobicContact CD1-CD1 4.32Å; Y162-L165 PolarHBondContact O-N 3.1Å; R163-L165 VanDerWaalsContact C-N 3.32Å; R163-L165 PolarHBondContact O-N 3.01Å; L165-D167 VanDerWaalsContact C-N 3.34Å; L165-R168 WeakPolarHBondContact O-CB 3.49Å; L165-R168 PolarHBondContact O-N 3.06Å; L165-F169 WeakPolarHBondContact O-CD2 3.01Å
166	A	62.7	Low	58.7	Low	21 Å²	21	94.8 Å²	94.8	17%	0.174	52%	0.52	C	S	.	.	H	α-helix	trans	-62.9	-40.9	177.9	0	0	0	0	0	111.5	W116 Y162 R163 R168 F169 G170	W116-A166 HydrophobicContact CZ2-CB 4.04Å; Y162-A166 VanDerWaalsContact O-CB 3.31Å; Y162-A166 WeakPolarHBondContact O-CB 3.29Å; Y162-A166 PolarHBondContact O-N 3.28Å; R163-A166 WeakPolarHBondContact O-CB 3.29Å; R163-A166 PolarHBondContact O-N 2.91Å; R163-A166 VanDerWaalsContact O-N 3.14Å; A166-R168 VanDerWaalsContact C-N 3.27Å; A166-R168 PolarHBondContact O-N 3.12Å; A166-F169 CarbonylContact O-C 3.07Å; A166-F169 PolarHBondContact O-N 3.43Å; A166-G170 PolarHBondContact O-N 2.94Å
167	D	61.4	Low	55.8	Low	124 Å²	124	103.3 Å²	103.3	66%	0.663	55%	0.548	S	S	*	.	H	α-helix	trans	-60	-37.1	176.9	-66.8	-22.6	0	0	0	111.8	R163 L165 F169 G170	R163-D167 PolarHBondContact O-N 2.87Å; L165-D167 VanDerWaalsContact C-N 3.34Å; D167-F169 PolarHBondContact O-N 3.13Å; D167-G170 PolarHBondContact O-N 3.49Å
168	R	64.7	Low	52.9	Low	212 Å²	212	113 Å²	113	80%	0.8	58%	0.584	S	S	*	*	H	α-helix	trans	-62.7	-27	173.9	-88.7	-175.5	173.8	-169.3	-2.4	113.8	V164 L165 A166	V164-R168 PolarHBondContact O-N 3.06Å; L165-R168 WeakPolarHBondContact O-CB 3.49Å; L165-R168 PolarHBondContact O-N 3.06Å; A166-R168 VanDerWaalsContact C-N 3.27Å; A166-R168 PolarHBondContact O-N 3.12Å
169	F	60.3	Low	50.5	Low	81 Å²	81	114.7 Å²	114.7	36%	0.355	60%	0.599	S	S	.	*	H	α-helix	trans	-98.2	-4.3	178.8	-62.8	-70.2	0	0	0	112.8	P117 W147 L149 L165 A166 D167	P117-F169 HydrophobicContact CB-CB 3.87Å; P117-F169 HydrophobicContact CB-CD1 4.48Å; P117-F169 HydrophobicContact CB-CD2 3.76Å; P117-F169 HydrophobicContact CB-CE2 4.48Å; P117-F169 HydrophobicContact CB-CG 3.79Å; P117-F169 HydrophobicContact CG-CD2 4.15Å; P117-F169 HydrophobicContact CG-CE2 4.4Å; P117-F169 HydrophobicContact CG-CG 4.3Å; W147-F169 HydrophobicContact CB-CZ 4.43Å; L149-F169 HydrophobicContact CD2-CE2 4.3Å; L165-F169 WeakPolarHBondContact O-CD2 3.01Å; A166-F169 CarbonylContact O-C 3.07Å; A166-F169 PolarHBondContact O-N 3.43Å; D167-F169 PolarHBondContact O-N 3.13Å
170	G	45.8	Very low	48.1	Very low	53 Å²	53	121.8 Å²	121.8	55%	0.546	63%	0.626	S	S	.	*			trans	-109.4	24.3	-157.3	0	0	0	0	0	118.3	A166 D167	A166-G170 PolarHBondContact O-N 2.94Å; D167-G170 PolarHBondContact O-N 3.49Å
171	S	32.7	Very low	46	Very low	108 Å²	108	124.1 Å²	124.1	76%	0.755	64%	0.636	S	S	*	*			trans	-108.9	109.5	166.6	-167.1	0	0	0	0	110.9	A173	S171-A173 PolarHBondContact O-N 3.32Å
172	P	36.9	Very low	43.5	Very low	128 Å²	128	126.4 Å²	126.4	83%	0.831	66%	0.658	S	S	*	*			trans	-86.4	90	176.7	32.4	-28.1	0	0	0	110
173	A	29.7	Very low	40.6	Very low	87 Å²	87	134.8 Å²	134.8	72%	0.719	70%	0.699	S	S	*	*			trans	-160	130.9	159	0	0	0	0	0	110.4	S171	S171-A173 PolarHBondContact O-N 3.32Å
174	D	28.8	Very low	38.9	Very low	160 Å²	160	131.9 Å²	131.9	86%	0.856	70%	0.702	S	S	*	*			trans	-16.2	124	177.2	-66.7	-43.1	0	0	0	119.3
175	S	28	Very low	36.9	Very low	116 Å²	116	133.2 Å²	133.2	81%	0.811	71%	0.712	S	S	*	*				165.7	123.5	113.8	50.2	0	0	0	0	110.8
176	W	24.1	Very low	34.8	Very low	237 Å²	237	138.1 Å²	138.1	90%	0.898	74%	0.743	S	S	*	*			trans	-73.4	138.3	-179.8	-70.9	-13.5	0	0	0	112.4	R178	W176-R178 PolarHBondContact O-N 3.36Å
177	W	23.4	Very low	33	Very low	241 Å²	241	142.1 Å²	142.1	91%	0.913	77%	0.77	S	S	*	*			trans	26.2	87.5	147	-59.4	92.1	0	0	0	116.4
178	R	23.9	Very low	30.9	Very low	236 Å²	236	148.5 Å²	148.5	89%	0.891	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-97.5	128.4	142	-73.3	-166.1	-176.9	-148.1	2.8	107.8	W176 E180	W176-R178 PolarHBondContact O-N 3.36Å; R178-E180 PolarHBondContact O-N 3.29Å
179	P	26.5	Very low	29	Very low	121 Å²	121	149.7 Å²	149.7	79%	0.786	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-66.6	121.9	178.9	9.3	-0.5	0	0	0	108.9	P181	P179-P181 WeakPolarHBondContact O-CD 3.43Å
180	E	23.7	Very low	27.2	Very low	188 Å²	188	155.2 Å²	155.2	88%	0.879	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-60.4	124	170.9	-81.5	179.5	147.9	0	0	109.9	R178 T182	R178-E180 PolarHBondContact O-N 3.29Å; E180-T182 PolarHBondContact O-N 3.23Å
181	P	29.9	Very low	26	Very low	110 Å²	110	160.9 Å²	160.9	71%	0.714	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-74.5	123.3	162.1	19.5	-8.7	0	0	0	108.6	P179 M183	P179-P181 WeakPolarHBondContact O-CD 3.43Å; P181-M183 PolarHBondContact O-N 3.44Å
182	T	24.2	Very low	25.6	Very low	143 Å²	143	163.4 Å²	163.4	88%	0.877	84%	0.838	S	S	*	*			trans	-9.4	104.7	162.4	50.6	0	0	0	0	115.1	E180	E180-T182 PolarHBondContact O-N 3.23Å
183	M	22.1	Very low	25.3	Very low	177 Å²	177	162.8 Å²	162.8	87%	0.872	84%	0.835	S	S	*	*			trans	-112.7	136.2	165.1	-82	-122.7	119.1	0	0	110.4	P181	P181-M183 PolarHBondContact O-N 3.44Å
184	P	29.2	Very low	25	Very low	104 Å²	104	167.1 Å²	167.1	68%	0.675	84%	0.84	S	S	*	*			trans	-81.8	161.1	-173.3	34.1	-33.9	0	0	0	112.4
185	P	30.2	Very low	24.8	Very low	122 Å²	122	167.3 Å²	167.3	79%	0.792	84%	0.841	S	S	*	*			trans	-84.9	129.2	-164.6	33.1	-30.9	0	0	0	111
186	T	23.8	Very low	24.6	Very low	131 Å²	131	170 Å²	170	80%	0.804	84%	0.844	S	S	*	*			trans	-156.5	130	160.9	8.6	0	0	0	0	113.8
187	S	22.8	Very low	24.7	Very low	105 Å²	105	170.3 Å²	170.3	73%	0.734	85%	0.845	S	S	*	*			trans	59.7	105.1	148.5	61.6	0	0	0	0	120.3
188	W	19.2	Very low	25.3	Very low	258 Å²	258	165 Å²	165	98%	0.977	84%	0.842	S	S	*	*			trans	-58.8	121.4	157.8	-62.6	75.1	0	0	0	111.3
189	R	23.1	Very low	25.4	Very low	237 Å²	237	157.6 Å²	157.6	89%	0.894	84%	0.84	S	S	*	*			trans	-132.5	134.1	156.8	-89.4	-166.9	-179.2	-162.5	1.5	110.8
190	Q	22.4	Very low	25.3	Very low	198 Å²	198	155.4 Å²	155.4	93%	0.925	84%	0.839	S	S	*	*			trans	-53.4	137.4	-179.5	-69.2	155.3	-35.8	0	0	112.1
191	L	22.2	Very low	26.2	Very low	172 Å²	172	153 Å²	153	90%	0.901	84%	0.839	S	S	*	*			trans	-124.7	127.2	166.9	-99.4	150.9	0	0	0	109.4
192	N	24.6	Very low	26	Very low	160 Å²	160	152.7 Å²	152.7	86%	0.856	85%	0.847	S	S	*	*			trans	-69.2	146.2	-173.4	-104.6	-21	0	0	0	112.5
193	P	28.6	Very low	25.9	Very low	116 Å²	116	149.3 Å²	149.3	75%	0.753	84%	0.84	S	S	*	*			trans	-100.8	92.4	-178	36	-25.9	0	0	0	111.4
194	E	23.6	Very low	26.1	Very low	177 Å²	177	149.2 Å²	149.2	83%	0.827	84%	0.842	S	S	*	*			trans	-143.8	108.5	161.5	-73.1	-167.3	163.1	0	0	108.5
195	N	26.3	Very low	25.7	Very low	165 Å²	165	149.7 Å²	149.7	88%	0.882	85%	0.848	S	S	*	*			trans	167.5	76.5	146.2	-83.7	-21.9	0	0	0	109.8
196	I	23.7	Very low	25.4	Very low	172 Å²	172	155.3 Å²	155.3	88%	0.882	85%	0.853	S	S	*	*			trans	-120.6	108.7	162.3	-59.6	176.8	0	0	0	106.6
197	R	25.2	Very low	25.3	Very low	243 Å²	243	154.8 Å²	154.8	92%	0.917	86%	0.855	S	S	*	*			trans	-117.3	147.2	164.5	-83.3	-170.9	179.2	-172.1	1.2	109.7
198	P	35.7	Very low	25.4	Very low	129 Å²	129	157.6 Å²	157.6	84%	0.838	86%	0.86	S	S	*	*			trans	-101.8	136.6	-156.6	34.2	-22.7	0	0	0	112.6
199	G	26.1	Very low	25.5	Very low	82 Å²	82	149.5 Å²	149.5	85%	0.845	86%	0.857	S	S	*	*			trans	-101.5	127.5	171	0	0	0	0	0	111
200	G	24.1	Very low	25.5	Very low	75 Å²	75	149.1 Å²	149.1	77%	0.773	86%	0.856	S	S	*	*			trans	-82.1	-166.4	-170.8	0	0	0	0	0	117
201	P	42.3	Very low	25.5	Very low	136 Å²	136	148.8 Å²	148.8	88%	0.883	85%	0.854	S	S	*	*			trans	-102.3	151.2	-143.6	38.1	-34.2	0	0	0	114.2
202	A	26.7	Very low	25.5	Very low	105 Å²	105	148.9 Å²	148.9	87%	0.868	85%	0.85	S	S	*	*			trans	-128.5	108.1	164	0	0	0	0	0	108.3
203	G	22.1	Very low	25.5	Very low	71 Å²	71	149.6 Å²	149.6	73%	0.732	85%	0.848	S	S	*	*			trans	-74.3	152.6	173.7	0	0	0	0	0	111.2
204	L	25.9	Very low	25.3	Very low	176 Å²	176	150.7 Å²	150.7	92%	0.921	84%	0.843	S	S	*	*			trans	-160	94.9	148.4	-100	165.4	0	0	0	106.3
205	S	21.6	Very low	25.3	Very low	114 Å²	114	147.8 Å²	147.8	80%	0.797	83%	0.834	S	S	*	*			trans	-75.4	122.9	171.2	64.6	0	0	0	0	109
206	R	23.5	Very low	25.3	Very low	240 Å²	240	147.2 Å²	147.2	91%	0.906	83%	0.826	S	S	*	*			trans	-133.6	96.7	153.4	-89.7	-172.2	173.4	174.2	-1.5	107.4	L208	R206-L208 PolarHBondContact O-N 3.3Å
207	S	22	Very low	25.5	Very low	119 Å²	119	148.2 Å²	148.2	83%	0.832	83%	0.826	S	S	*	*			trans	-58	107.2	167.9	50.2	0	0	0	0	110.2
208	L	24	Very low	25.6	Very low	164 Å²	164	143 Å²	143	86%	0.859	81%	0.812	S	S	*	*			trans	-118.4	98.5	154.6	-84.6	163.5	0	0	0	105.3	R206 R210	R206-L208 PolarHBondContact O-N 3.3Å; L208-R210 PolarHBondContact O-N 3.12Å; L208-R210 VanDerWaalsContact O-N 3.13Å
209	G	22	Very low	25.5	Very low	88 Å²	88	144.1 Å²	144.1	91%	0.907	81%	0.807	S	S	*	*			trans	-56.1	114.7	172.7	0	0	0	0	0	108.5
210	R	22.2	Very low	25.9	Very low	230 Å²	230	146.8 Å²	146.8	87%	0.868	80%	0.8	S	S	*	*			trans	-122.6	107.9	167	-161.7	175.6	-171	-172.1	-0.1	104.3	L208 E212	L208-R210 PolarHBondContact O-N 3.12Å; L208-R210 VanDerWaalsContact O-N 3.13Å; R210-E212 PolarHBondContact O-N 3.25Å
211	E	22.9	Very low	26.9	Very low	190 Å²	190	146.4 Å²	146.4	89%	0.888	78%	0.779	S	S	*	*			trans	-44.9	121.8	176.4	-68.7	169	161.8	0	0	108.8	E213	E211-E213 PolarHBondContact O-N 2.81Å; E211-E213 VanDerWaalsContact O-N 3.14Å
212	E	22.6	Very low	27	Very low	175 Å²	175	144.7 Å²	144.7	82%	0.818	76%	0.759	S	S	*	*			trans	-74.1	95.1	180	-66.6	175.5	156.8	0	0	107	R210 E214	R210-E212 PolarHBondContact O-N 3.25Å; E212-E214 VanDerWaalsContact C-N 3.34Å; E212-E214 PolarHBondContact O-N 3.32Å; E212-E214 VanDerWaalsContact O-N 3.11Å
213	E	24.1	Very low	28.1	Very low	175 Å²	175	140.7 Å²	140.7	82%	0.818	73%	0.728	S	S	*	*			trans	-72.7	96.7	162.3	-74.7	-178.8	158.9	0	0	107	E211 D215	E211-E213 PolarHBondContact O-N 2.81Å; E211-E213 VanDerWaalsContact O-N 3.14Å; E213-D215 PolarHBondContact O-N 3.22Å
214	E	24.5	Very low	30	Very low	139 Å²	139	139.6 Å²	139.6	65%	0.65	71%	0.707	S	S	*	*			trans	-65.7	93.3	169.3	-70.9	-175.6	146.7	0	0	108.9	E212 E216 R661	E212-E214 VanDerWaalsContact C-N 3.34Å; E212-E214 PolarHBondContact O-N 3.32Å; E212-E214 VanDerWaalsContact O-N 3.11Å; E214-E216 PolarHBondContact O-N 3.03Å; E214-R661 IonicContact OE1-NH2 2.67Å; E214-R661 PolarHBondContact OE1-NH2 3.02Å
215	D	24.8	Very low	32	Very low	116 Å²	116	132.8 Å²	132.8	62%	0.62	67%	0.671	S	S	*	*			trans	-73.8	74.8	169.5	-78.2	-30.9	0	0	0	109.8	H92 E213 E217	H92-D215 IonicContact NE2-OD2 3.76Å; E213-D215 PolarHBondContact O-N 3.22Å; D215-E217 PolarHBondContact O-N 2.87Å
216	E	25.3	Very low	34.4	Very low	153 Å²	153	127.5 Å²	127.5	72%	0.715	63%	0.634	S	S	*	*			trans	-75.2	111.9	152.3	-70.2	-167.3	166.4	0	0	107	E214 E218	E214-E216 PolarHBondContact O-N 3.03Å; E216-E218 PolarHBondContact O-N 3.33Å
217	E	26.9	Very low	36.8	Very low	193 Å²	193	116 Å²	116	90%	0.902	59%	0.591	S	S	*	*	S	Bend	trans	-68.9	51.3	177	-70.2	-176.2	165.8	0	0	112.1	D215	D215-E217 PolarHBondContact O-N 2.87Å
218	E	28.7	Very low	39	Very low	132 Å²	132	110.9 Å²	110.9	62%	0.617	55%	0.554	S	S	*	*			trans	-82.5	103.7	139	-72	-163.2	165.7	0	0	105.2	E216 L220	E216-E218 PolarHBondContact O-N 3.33Å; E218-L220 PolarHBondContact O-N 2.87Å
219	E	32.2	Very low	41.3	Very low	154 Å²	154	106.9 Å²	106.9	72%	0.72	53%	0.531	S	S	*	.			trans	-55.3	88.9	168.3	-72.9	179.2	149.3	0	0	107.8	E221	E219-E221 PolarHBondContact O-N 3.44Å
220	L	34.5	Very low	43.7	Very low	137 Å²	137	103.9 Å²	103.9	72%	0.717	49%	0.493	S	S	*	.			trans	-59.2	93.1	161.1	-76.4	170.4	0	0	0	103.9	E218 E222	E218-L220 PolarHBondContact O-N 2.87Å; L220-E222 PolarHBondContact O-N 3.03Å
221	E	45.7	Very low	46.1	Very low	68 Å²	68	93.6 Å²	93.6	32%	0.318	46%	0.455	S	S	.	.			trans	-53.1	104.9	-174.7	-78	-177.9	128.2	0	0	107.9	E219 G223 L1079 R1087 F1110	E219-E221 PolarHBondContact O-N 3.44Å; E221-G223 PolarHBondContact O-N 3.48Å; E221-L1079 WeakPolarHBondContact OE2-CD1 3.3Å; E221-R1087 IonicContact OE1-CZ 2.74Å; E221-R1087 IonicContact OE1-NH1 3.81Å; E221-R1087 PolarHBondContact OE1-NH1 2.89Å; E221-R1087 IonicContact OE1-NH2 2.81Å; E221-R1087 PolarHBondContact OE1-NH2 2.92Å; E221-F1110 VanDerWaalsContact OE2-CE1 3.32Å; E221-F1110 WeakPolarHBondContact OE2-CE1 3.42Å
222	E	44.8	Very low	48.4	Very low	100 Å²	100	87.4 Å²	87.4	47%	0.467	43%	0.433	S	S	.	.			trans	-46.6	119.1	176.8	-74.1	-178.4	156.4	0	0	107.7	L220 T224 Q1061	L220-E222 PolarHBondContact O-N 3.03Å; E222-T224 WeakPolarHBondContact O-CG2 3.29Å; E222-T224 PolarHBondContact O-N 3.38Å; E222-Q1061 PolarHBondContact OE1-NE2 3.04Å
223	G	50.5	Low	50.5	Low	21 Å²	21	83.7 Å²	83.7	22%	0.216	42%	0.417	C	S	.	.			trans	-48	121.2	-177.9	0	0	0	0	0	110.8	E221 R1060	E221-G223 PolarHBondContact O-N 3.48Å; G223-R1060 WeakPolarHBondContact O-CB 3.36Å; G223-R1060 WeakPolarHBondContact O-CG 3.44Å; G223-R1060 PolarHBondContact O-N 2.84Å; G223-R1060 VanDerWaalsContact O-N 3.07Å
224	T	62	Low	52.2	Low	47 Å²	47	76.8 Å²	76.8	29%	0.288	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	140	178.6	56.6	0	0	0	0	110.2	E222 K1057 V1058 T1059	E222-T224 WeakPolarHBondContact O-CG2 3.29Å; E222-T224 PolarHBondContact O-N 3.38Å; T224-K1057 HydrophobicContact CG2-CD 3.99Å; T224-K1057 HydrophobicContact CG2-CG 4.3Å; T224-V1058 WeakPolarHBondContact CA-O 3.42Å; T224-T1059 HydrophobicContact CG2-CG2 4.43Å
225	I	67.1	Low	53.7	Low	34 Å²	34	76.8 Å²	76.8	17%	0.174	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	138.8	-176.8	-52.4	173.7	0	0	0	108.2	E229 F230 M233 V1058	I225-E229 HydrophobicContact CG2-CB 3.75Å; I225-E229 HydrophobicContact CG2-CG 3.68Å; I225-F230 HydrophobicContact CG2-CB 4.15Å; I225-M233 HydrophobicContact CD1-SD 4.28Å; I225-V1058 PolarHBondContact N-O 2.93Å; I225-V1058 PolarHBondContact O-N 2.94Å
226	D	73	Confident	54.7	Low	2 Å²	2	79.5 Å²	79.5	1%	0.011	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	149.6	172.3	-179.4	37.1	0	0	0	110.7	T228 E229 F230 R1054 T1070	D226-T228 VanDerWaalsContact C-N 3.26Å; D226-T228 PolarHBondContact O-N 3.4Å; D226-T228 PolarHBondContact OD2-N 2.9Å; D226-T228 PolarHBondContact OD2-OG1 3.34Å; D226-E229 HydrophobicContact CB-CB 4.29Å; D226-E229 PolarHBondContact O-N 2.9Å; D226-E229 VanDerWaalsContact O-N 3.16Å; D226-F230 PolarHBondContact O-N 3.33Å; D226-R1054 IonicContact OD2-NH1 2.88Å; D226-R1054 PolarHBondContact OD2-NH1 2.57Å; D226-R1054 VanDerWaalsContact OD2-NH1 3.12Å; D226-T1070 PolarHBondContact OD1-OG1 3.04Å
227	V	72.2	Confident	55.5	Low	0 Å²	0	79.4 Å²	79.4	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-56.3	-42.5	179.2	170.8	0	0	0	0	111.1	E229 F230 L231 L358 L361 F1064	V227-E229 VanDerWaalsContact C-N 3.34Å; V227-E229 PolarHBondContact O-N 3.25Å; V227-F230 PolarHBondContact O-N 3.43Å; V227-L231 HydrophobicContact CG1-CD1 4.02Å; V227-L231 HydrophobicContact CG1-CG 4.48Å; V227-L231 WeakPolarHBondContact O-CB 3.45Å; V227-L231 VanDerWaalsContact O-CG 3.23Å; V227-L231 WeakPolarHBondContact O-CG 3.25Å; V227-L231 PolarHBondContact O-N 3.38Å; V227-L358 HydrophobicContact CB-CD2 4.1Å; V227-L358 HydrophobicContact CG1-CB 4.28Å; V227-L358 HydrophobicContact CG1-CD2 3.59Å; V227-L358 WeakPolarHBondContact CG1-O 3.46Å; V227-L358 HydrophobicContact CG2-CD2 3.68Å; V227-L361 HydrophobicContact CG2-CD2 4.17Å; V227-F1064 HydrophobicContact CG2-CE2 4.03Å
228	T	70	Confident	55.9	Low	10 Å²	10	74 Å²	74	6%	0.061	38%	0.383	C	S	.	.	H	α-helix	trans	-68.2	-34.7	-178.8	65	0	0	0	0	112.9	D226 S232 R1054	D226-T228 VanDerWaalsContact C-N 3.26Å; D226-T228 PolarHBondContact O-N 3.4Å; D226-T228 PolarHBondContact OD2-N 2.9Å; D226-T228 PolarHBondContact OD2-OG1 3.34Å; T228-S232 PolarHBondContact O-N 2.75Å; T228-S232 VanDerWaalsContact O-N 3.12Å; T228-R1054 PolarHBondContact OG1-NH1 2.94Å
229	E	71.4	Confident	56	Low	81 Å²	81	76.9 Å²	76.9	38%	0.379	40%	0.396	S	S	.	.	H	α-helix	trans	-71.5	-44.8	177.3	-176.1	178.9	-174.1	0	0	110.7	I225 D226 V227 L231 S232 M233 N1077	I225-E229 HydrophobicContact CG2-CB 3.75Å; I225-E229 HydrophobicContact CG2-CG 3.68Å; D226-E229 HydrophobicContact CB-CB 4.29Å; D226-E229 PolarHBondContact O-N 2.9Å; D226-E229 VanDerWaalsContact O-N 3.16Å; V227-E229 VanDerWaalsContact C-N 3.34Å; V227-E229 PolarHBondContact O-N 3.25Å; E229-L231 VanDerWaalsContact C-N 3.29Å; E229-L231 PolarHBondContact O-N 2.81Å; E229-S232 WeakPolarHBondContact CA-OG 3.48Å; E229-S232 PolarHBondContact O-N 3.42Å; E229-S232 VanDerWaalsContact O-N 3.08Å; E229-S232 PolarHBondContact O-OG 2.9Å; E229-M233 WeakPolarHBondContact O-CG 3.15Å; E229-M233 PolarHBondContact O-N 3.13Å; E229-N1077 PolarHBondContact OE2-ND2 2.72Å
230	F	71.6	Confident	56	Low	25 Å²	25	76.7 Å²	76.7	11%	0.11	40%	0.4	C	S	.	.	H	α-helix	trans	-59.2	-40	173.9	-176.9	-94.3	0	0	0	112.2	I225 D226 V227 M233 T234 A351 L358 V1058	I225-F230 HydrophobicContact CG2-CB 4.15Å; D226-F230 PolarHBondContact O-N 3.33Å; V227-F230 PolarHBondContact O-N 3.43Å; F230-M233 PolarHBondContact O-N 3.5Å; F230-T234 HydrophobicContact CD1-CG2 4.32Å; F230-T234 HydrophobicContact CE1-CG2 3.82Å; F230-T234 HydrophobicContact CE2-CG2 4.49Å; F230-T234 HydrophobicContact CZ-CG2 3.91Å; F230-T234 PolarHBondContact O-N 2.89Å; F230-T234 VanDerWaalsContact O-N 3.08Å; F230-T234 PolarHBondContact O-OG1 3.16Å; F230-A351 HydrophobicContact CE1-CB 3.71Å; F230-A351 HydrophobicContact CE2-CB 4.32Å; F230-A351 HydrophobicContact CZ-CB 3.58Å; F230-L358 HydrophobicContact CD1-CD1 4.1Å; F230-L358 HydrophobicContact CE1-CD1 4.03Å; F230-V1058 HydrophobicContact CB-CB 4.41Å; F230-V1058 HydrophobicContact CB-CG2 4.19Å; F230-V1058 HydrophobicContact CD1-CG2 4.21Å; F230-V1058 HydrophobicContact CD2-CB 4.17Å; F230-V1058 HydrophobicContact CD2-CG1 3.72Å; F230-V1058 HydrophobicContact CD2-CG2 4.42Å; F230-V1058 HydrophobicContact CE2-CG1 3.83Å; F230-V1058 HydrophobicContact CG-CB 4.21Å; F230-V1058 HydrophobicContact CG-CG1 4.15Å; F230-V1058 HydrophobicContact CG-CG2 4.01Å; F230-V1058 HydrophobicContact CZ-CG1 4.35Å
231	L	73.4	Confident	55.9	Low	14 Å²	14	75.8 Å²	75.8	7%	0.073	40%	0.403	C	S	.	.	H	α-helix	trans	-65.1	-37.2	175	-73	171.6	0	0	0	112.3	V227 E229 T234 Q235 L358 R359	V227-L231 HydrophobicContact CG1-CD1 4.02Å; V227-L231 HydrophobicContact CG1-CG 4.48Å; V227-L231 WeakPolarHBondContact O-CB 3.45Å; V227-L231 VanDerWaalsContact O-CG 3.23Å; V227-L231 WeakPolarHBondContact O-CG 3.25Å; V227-L231 PolarHBondContact O-N 3.38Å; E229-L231 VanDerWaalsContact C-N 3.29Å; E229-L231 PolarHBondContact O-N 2.81Å; L231-T234 WeakPolarHBondContact CA-OG1 3.38Å; L231-T234 PolarHBondContact O-OG1 2.79Å; L231-T234 VanDerWaalsContact O-OG1 3.13Å; L231-Q235 WeakPolarHBondContact O-CG 3.26Å; L231-Q235 PolarHBondContact O-N 3.04Å; L231-L358 HydrophobicContact CD2-CB 4.25Å; L231-R359 HydrophobicContact CD2-CG 3.77Å
232	S	70.1	Confident	55.4	Low	59 Å²	59	79.7 Å²	79.7	41%	0.413	43%	0.425	S	S	.	.	H	α-helix	trans	-68.1	-37.2	175.5	55.8	0	0	0	0	113	T228 E229 Q235	T228-S232 PolarHBondContact O-N 2.75Å; T228-S232 VanDerWaalsContact O-N 3.12Å; E229-S232 WeakPolarHBondContact CA-OG 3.48Å; E229-S232 PolarHBondContact O-N 3.42Å; E229-S232 VanDerWaalsContact O-N 3.08Å; E229-S232 PolarHBondContact O-OG 2.9Å; S232-Q235 PolarHBondContact O-N 2.79Å
233	M	67.9	Low	54.8	Low	98 Å²	98	86 Å²	86	48%	0.483	44%	0.444	S	S	.	.	H	α-helix	trans	-65	-44.1	176.1	-66	175.9	70.5	0	0	111.6	I225 E229 F230 Q235 Q236	I225-M233 HydrophobicContact CD1-SD 4.28Å; E229-M233 WeakPolarHBondContact O-CG 3.15Å; E229-M233 PolarHBondContact O-N 3.13Å; F230-M233 PolarHBondContact O-N 3.5Å; M233-Q235 VanDerWaalsContact C-N 3.32Å; M233-Q235 PolarHBondContact O-N 2.85Å; M233-Q236 PolarHBondContact O-N 2.96Å
234	T	58.9	Low	53.9	Low	30 Å²	30	92.8 Å²	92.8	18%	0.184	48%	0.476	C	S	.	.	H	α-helix	trans	-71.7	-22.6	-178.5	47.7	0	0	0	0	114	F230 L231 Q236 D237 S238	F230-T234 HydrophobicContact CD1-CG2 4.32Å; F230-T234 HydrophobicContact CE1-CG2 3.82Å; F230-T234 HydrophobicContact CE2-CG2 4.49Å; F230-T234 HydrophobicContact CZ-CG2 3.91Å; F230-T234 PolarHBondContact O-N 2.89Å; F230-T234 VanDerWaalsContact O-N 3.08Å; F230-T234 PolarHBondContact O-OG1 3.16Å; L231-T234 WeakPolarHBondContact CA-OG1 3.38Å; L231-T234 PolarHBondContact O-OG1 2.79Å; L231-T234 VanDerWaalsContact O-OG1 3.13Å; T234-Q236 VanDerWaalsContact C-N 3.26Å; T234-Q236 PolarHBondContact O-N 2.93Å; T234-D237 PolarHBondContact O-N 2.69Å; T234-S238 PolarHBondContact O-N 2.92Å; T234-S238 PolarHBondContact O-OG 3.36Å
235	Q	56.9	Low	52.5	Low	138 Å²	138	95.4 Å²	95.4	65%	0.645	50%	0.496	S	S	*	.	H	α-helix	trans	-68.4	-23.1	173.6	-79.5	179.6	0.9	0	0	113.1	L231 S232 M233 D237	L231-Q235 WeakPolarHBondContact O-CG 3.26Å; L231-Q235 PolarHBondContact O-N 3.04Å; S232-Q235 PolarHBondContact O-N 2.79Å; M233-Q235 VanDerWaalsContact C-N 3.32Å; M233-Q235 PolarHBondContact O-N 2.85Å; Q235-D237 VanDerWaalsContact C-N 3.34Å
236	Q	46	Very low	50.8	Low	173 Å²	173	105.5 Å²	105.5	81%	0.808	53%	0.532	S	S	*	.	H	α-helix	trans	-75.1	-22.8	176.8	-69.4	-177.1	-22.5	0	0	113	M233 T234	M233-Q236 PolarHBondContact O-N 2.96Å; T234-Q236 VanDerWaalsContact C-N 3.26Å; T234-Q236 PolarHBondContact O-N 2.93Å
237	D	41.1	Very low	48.8	Very low	152 Å²	152	109.5 Å²	109.5	81%	0.813	57%	0.574	S	S	*	*	H	α-helix	trans	-109.3	-5.3	-172.1	-75.2	-31	0	0	0	115.8	T234 Q235	T234-D237 PolarHBondContact O-N 2.69Å; Q235-D237 VanDerWaalsContact C-N 3.34Å
238	S	36.9	Very low	47	Very low	79 Å²	79	111.7 Å²	111.7	55%	0.552	60%	0.596	S	S	*	*			trans	-114.9	93.7	-168.3	53.8	0	0	0	0	115.5	T234	T234-S238 PolarHBondContact O-N 2.92Å; T234-S238 PolarHBondContact O-OG 3.36Å
239	H	29.7	Very low	45.4	Very low	193 Å²	193	117.2 Å²	117.2	89%	0.894	64%	0.635	S	S	*	*			trans	-85.1	112.4	154.7	-90.3	-76.2	0	0	0	110.7
240	N	31.7	Very low	44	Very low	150 Å²	150	120.9 Å²	120.9	80%	0.802	65%	0.65	S	S	*	*			trans	130.5	111.5	152.3	-83.8	-16.3	0	0	0	113.5
241	P	33.3	Very low	42.8	Very low	118 Å²	118	126.3 Å²	126.3	77%	0.766	68%	0.676	S	S	*	*			trans	-70.2	147.7	174.5	-7.4	22.3	0	0	0	112.1	R243	P241-R243 PolarHBondContact O-N 3.35Å; P241-R243 VanDerWaalsContact O-N 3.16Å
242	L	35.7	Very low	41.5	Very low	150 Å²	150	129.4 Å²	129.4	79%	0.785	69%	0.691	S	S	*	*			trans	-50.6	114.8	165.1	-75.9	143	0	0	0	109.7	D244	L242-D244 PolarHBondContact O-N 2.92Å
243	R	32.1	Very low	40.8	Very low	231 Å²	231	131.5 Å²	131.5	87%	0.872	70%	0.702	S	S	*	*			trans	-83	110.7	175.4	-137.4	178.8	-179.2	-176.5	-0.3	108	P241 S245	P241-R243 PolarHBondContact O-N 3.35Å; P241-R243 VanDerWaalsContact O-N 3.16Å; R243-S245 PolarHBondContact O-N 3.4Å; R243-S245 PolarHBondContact O-OG 3.24Å
244	D	30.3	Very low	40.6	Very low	165 Å²	165	130.5 Å²	130.5	88%	0.882	70%	0.698	S	S	*	*			trans	-53.8	95.1	172.2	-86.9	-26.3	0	0	0	110.4	L242	L242-D244 PolarHBondContact O-N 2.92Å
245	S	32.9	Very low	41.4	Very low	102 Å²	102	132.6 Å²	132.6	71%	0.713	71%	0.708	S	S	*	*			trans	-100.3	96.8	171.9	-55.7	0	0	0	0	107	R243 G247	R243-S245 PolarHBondContact O-N 3.4Å; R243-S245 PolarHBondContact O-OG 3.24Å; S245-G247 PolarHBondContact O-N 3.43Å
246	R	32.6	Very low	42.5	Very low	246 Å²	246	130.8 Å²	130.8	93%	0.928	70%	0.703	S	S	*	*			trans	-48.5	135.5	173.6	-74.1	179.4	174.7	-178	-2.3	110.4	G248	R246-G248 PolarHBondContact O-N 3.12Å
247	G	30.9	Very low	44.2	Very low	86 Å²	86	123 Å²	123	89%	0.887	67%	0.667	S	S	*	*			trans	-58.9	116.3	-169.8	0	0	0	0	0	113.9	S245	S245-G247 PolarHBondContact O-N 3.43Å
248	G	32.8	Very low	46.2	Very low	45 Å²	45	115.9 Å²	115.9	46%	0.464	63%	0.63	S	S	.	*			trans	-111.5	131.4	150.2	0	0	0	0	0	107.8	R246 F250	R246-G248 PolarHBondContact O-N 3.12Å; G248-F250 WeakPolarHBondContact O-CD2 3.38Å; G248-F250 PolarHBondContact O-N 3.15Å
249	S	36.7	Very low	48.5	Very low	127 Å²	127	115.9 Å²	115.9	89%	0.888	62%	0.623	S	S	*	*			trans	-62.5	93.6	170.8	52.5	0	0	0	0	109.3	E251	S249-E251 PolarHBondContact O-N 3.49Å
250	F	42.6	Very low	51.3	Low	157 Å²	157	113.2 Å²	113.2	69%	0.689	61%	0.605	S	S	*	*			trans	-86.3	100.9	178.6	-89.3	-86.5	0	0	0	110	G248 M252	G248-F250 WeakPolarHBondContact O-CD2 3.38Å; G248-F250 PolarHBondContact O-N 3.15Å; F250-M252 PolarHBondContact O-N 2.88Å
251	E	45.9	Very low	53.9	Low	139 Å²	139	106.1 Å²	106.1	65%	0.65	57%	0.567	S	S	*	*			trans	-75.3	98.2	163.7	-72.6	-173.1	155.9	0	0	109.2	S249 T253	S249-E251 PolarHBondContact O-N 3.49Å; E251-T253 PolarHBondContact O-N 3.42Å
252	M	47.6	Very low	56.6	Low	79 Å²	79	102.8 Å²	102.8	39%	0.389	54%	0.542	S	S	.	.			trans	-78.9	97.7	169.1	-73.5	-148.8	-173.3	0	0	109.6	F250 V314 L330	F250-M252 PolarHBondContact O-N 2.88Å; M252-V314 VanDerWaalsContact O-O 3.1Å; M252-L330 HydrophobicContact CB-CD1 4.45Å
253	T	55.1	Low	59.1	Low	104 Å²	104	100.9 Å²	100.9	64%	0.638	54%	0.537	S	S	*	.			trans	-107.5	56.3	173.1	48.8	0	0	0	0	110.6	E251 V314	E251-T253 PolarHBondContact O-N 3.42Å; T253-V314 HydrophobicContact CG2-CB 4.24Å; T253-V314 HydrophobicContact CG2-CG1 4.46Å
254	D	63.8	Low	61.8	Low	77 Å²	77	93.5 Å²	93.5	41%	0.412	51%	0.512	S	S	.	.			trans	-117.2	109.9	172.8	179.1	20	0	0	0	109.8	D256 S257 A258 R260	D254-D256 VanDerWaalsContact C-N 3.27Å; D254-D256 PolarHBondContact O-N 2.87Å; D254-D256 PolarHBondContact OD1-N 3.13Å; D254-S257 WeakPolarHBondContact O-CB 3.33Å; D254-S257 PolarHBondContact O-N 3.46Å; D254-S257 VanDerWaalsContact OD2-CB 3.31Å; D254-S257 WeakPolarHBondContact OD2-CB 3.44Å; D254-S257 PolarHBondContact OD2-N 3Å; D254-A258 PolarHBondContact O-N 3.26Å; D254-R260 IonicContact OD2-NH2 3.9Å
255	D	74.4	Confident	64.7	Low	73 Å²	73	85.8 Å²	85.8	39%	0.39	47%	0.471	S	S	.	.	H	α-helix	trans	-65.7	-32.5	-175.6	-151.5	16.8	0	0	0	111.1	A258 I259 K326	D255-A258 WeakPolarHBondContact O-CB 3.32Å; D255-A258 PolarHBondContact O-N 3.15Å; D255-I259 VanDerWaalsContact O-CG1 3.31Å; D255-I259 WeakPolarHBondContact O-CG1 3.38Å; D255-I259 PolarHBondContact O-N 2.83Å; D255-K326 IonicContact OD1-NZ 3.77Å; D255-K326 PolarHBondContact OD1-NZ 3.02Å; D255-K326 IonicContact OD2-NZ 2.75Å
256	D	80.5	Confident	67.3	Low	101 Å²	101	85.7 Å²	85.7	54%	0.54	47%	0.468	S	S	.	.	H	α-helix	trans	-67.6	-42.1	174.8	-81.2	-2.3	0	0	0	111.4	D254 A258 I259 R260	D254-D256 VanDerWaalsContact C-N 3.27Å; D254-D256 PolarHBondContact O-N 2.87Å; D254-D256 PolarHBondContact OD1-N 3.13Å; D256-A258 VanDerWaalsContact C-N 3.28Å; D256-A258 PolarHBondContact O-N 2.91Å; D256-I259 PolarHBondContact O-N 3.35Å; D256-R260 WeakPolarHBondContact O-CG 3.47Å; D256-R260 PolarHBondContact O-N 2.93Å
257	S	82.1	Confident	70	Confident	9 Å²	9	79.6 Å²	79.6	6%	0.063	45%	0.453	C	S	.	.	H	α-helix	trans	-60.9	-38.9	172.7	-173.6	0	0	0	0	111.7	D254 R260 A261 K333	D254-S257 WeakPolarHBondContact O-CB 3.33Å; D254-S257 PolarHBondContact O-N 3.46Å; D254-S257 VanDerWaalsContact OD2-CB 3.31Å; D254-S257 WeakPolarHBondContact OD2-CB 3.44Å; D254-S257 PolarHBondContact OD2-N 3Å; S257-R260 PolarHBondContact O-N 2.99Å; S257-A261 WeakPolarHBondContact O-CB 3.13Å; S257-A261 PolarHBondContact O-N 3.23Å; S257-K333 PolarHBondContact OG-NZ 2.89Å
258	A	83.8	Confident	72.9	Confident	2 Å²	2	75.6 Å²	75.6	2%	0.017	41%	0.411	C	S	.	.	H	α-helix	trans	-67.4	-39.5	178.8	0	0	0	0	0	112.5	D254 D255 D256 A261 L262 K326 L330	D254-A258 PolarHBondContact O-N 3.26Å; D255-A258 WeakPolarHBondContact O-CB 3.32Å; D255-A258 PolarHBondContact O-N 3.15Å; D256-A258 VanDerWaalsContact C-N 3.28Å; D256-A258 PolarHBondContact O-N 2.91Å; A258-A261 PolarHBondContact O-N 2.82Å; A258-L262 WeakPolarHBondContact O-CB 3.37Å; A258-L262 PolarHBondContact O-N 3.1Å; A258-K326 HydrophobicContact CB-CB 4.07Å; A258-K326 HydrophobicContact CB-CD 4.28Å; A258-K326 HydrophobicContact CB-CG 4.27Å; A258-L330 HydrophobicContact CB-CD1 4.06Å; A258-L330 HydrophobicContact CB-CD2 4.2Å; A258-L330 HydrophobicContact CB-CG 4.09Å
259	I	84.7	Confident	75.7	Confident	79 Å²	79	75.8 Å²	75.8	41%	0.405	40%	0.399	S	S	.	.	H	α-helix	trans	-65.6	-44.5	175.1	-66.6	164	0	0	0	110.8	D255 D256 A261 L262 T263	D255-I259 VanDerWaalsContact O-CG1 3.31Å; D255-I259 WeakPolarHBondContact O-CG1 3.38Å; D255-I259 PolarHBondContact O-N 2.83Å; D256-I259 PolarHBondContact O-N 3.35Å; I259-A261 VanDerWaalsContact C-N 3.32Å; I259-A261 PolarHBondContact O-N 3.03Å; I259-L262 PolarHBondContact O-N 3.19Å; I259-T263 PolarHBondContact O-N 3.35Å; I259-T263 PolarHBondContact O-OG1 3.08Å
260	R	87.5	Confident	78.2	Confident	138 Å²	138	74.3 Å²	74.3	52%	0.521	38%	0.382	S	S	.	.	H	α-helix	trans	-62.6	-37.6	174.2	-72.2	-174.9	-67.6	-116.6	-1.9	112.5	D254 D256 S257 T263 Q264	D254-R260 IonicContact OD2-NH2 3.9Å; D256-R260 WeakPolarHBondContact O-CG 3.47Å; D256-R260 PolarHBondContact O-N 2.93Å; S257-R260 PolarHBondContact O-N 2.99Å; R260-T263 VanDerWaalsContact C-OG1 3.31Å; R260-T263 VanDerWaalsContact CA-OG1 3.32Å; R260-T263 WeakPolarHBondContact CA-OG1 3.31Å; R260-T263 PolarHBondContact O-OG1 2.89Å; R260-Q264 PolarHBondContact O-N 3.5Å
261	A	87.7	Confident	80.5	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-68.2	-41.4	175.5	0	0	0	0	0	111.3	S257 A258 I259 T263 Q264 F265 A329 L330 K333	S257-A261 WeakPolarHBondContact O-CB 3.13Å; S257-A261 PolarHBondContact O-N 3.23Å; A258-A261 PolarHBondContact O-N 2.82Å; I259-A261 VanDerWaalsContact C-N 3.32Å; I259-A261 PolarHBondContact O-N 3.03Å; A261-T263 VanDerWaalsContact C-N 3.33Å; A261-T263 PolarHBondContact O-N 3.48Å; A261-Q264 WeakPolarHBondContact O-CB 3.5Å; A261-Q264 PolarHBondContact O-N 3.39Å; A261-Q264 VanDerWaalsContact O-N 3.16Å; A261-F265 WeakPolarHBondContact O-CD2 3.34Å; A261-F265 PolarHBondContact O-N 3.41Å; A261-A329 HydrophobicContact CB-CB 3.87Å; A261-L330 HydrophobicContact CB-CD2 4.2Å; A261-K333 HydrophobicContact CB-CB 4.21Å; A261-K333 HydrophobicContact CB-CD 3.99Å
262	L	88.6	Confident	82.6	Confident	48 Å²	48	61.2 Å²	61.2	25%	0.251	32%	0.323	S	S	.	.	H	α-helix	trans	-68	-32.7	-179.3	-172.5	63.4	0	0	0	112.5	A258 I259 F265 P268 N325 K326 A329	A258-L262 WeakPolarHBondContact O-CB 3.37Å; A258-L262 PolarHBondContact O-N 3.1Å; I259-L262 PolarHBondContact O-N 3.19Å; L262-F265 CarbonylContact O-C 3.52Å; L262-F265 VanDerWaalsContact O-C 3.27Å; L262-P268 HydrophobicContact CD1-CG 4.02Å; L262-N325 HydrophobicContact CD1-CB 4Å; L262-K326 HydrophobicContact CD2-CG 4.07Å; L262-A329 HydrophobicContact CB-CB 4.09Å; L262-A329 HydrophobicContact CD1-CB 4.11Å
263	T	88.6	Confident	84.5	Confident	110 Å²	110	58.8 Å²	58.8	68%	0.675	32%	0.316	S	S	*	.	H	α-helix	trans	-68.6	-35.9	170.8	41.9	0	0	0	0	112.1	I259 R260 A261	I259-T263 PolarHBondContact O-N 3.35Å; I259-T263 PolarHBondContact O-OG1 3.08Å; R260-T263 VanDerWaalsContact C-OG1 3.31Å; R260-T263 VanDerWaalsContact CA-OG1 3.32Å; R260-T263 WeakPolarHBondContact CA-OG1 3.31Å; R260-T263 PolarHBondContact O-OG1 2.89Å; A261-T263 VanDerWaalsContact C-N 3.33Å; A261-T263 PolarHBondContact O-N 3.48Å
264	Q	89.8	Confident	85.9	Confident	76 Å²	76	59.8 Å²	59.8	36%	0.355	31%	0.311	S	S	.	.	H	α-helix	trans	-71	-34	174.6	-172.6	175.2	26.8	0	0	113.2	R260 A261 N345	R260-Q264 PolarHBondContact O-N 3.5Å; A261-Q264 WeakPolarHBondContact O-CB 3.5Å; A261-Q264 PolarHBondContact O-N 3.39Å; A261-Q264 VanDerWaalsContact O-N 3.16Å; Q264-N345 PolarHBondContact O-ND2 2.75Å
265	F	90.9	Very high	87	Confident	4 Å²	4	56.2 Å²	56.2	2%	0.018	29%	0.292	C	S	.	.			trans	-125.9	85.9	-177.5	-58.2	-79.3	0	0	0	110.2	A261 L262 L267 P268 L271 C332 K333 K336 V341 N345	A261-F265 WeakPolarHBondContact O-CD2 3.34Å; A261-F265 PolarHBondContact O-N 3.41Å; L262-F265 CarbonylContact O-C 3.52Å; L262-F265 VanDerWaalsContact O-C 3.27Å; F265-L267 VanDerWaalsContact C-N 3.27Å; F265-L267 PolarHBondContact O-N 2.88Å; F265-P268 HydrophobicContact CB-CB 4.2Å; F265-P268 VanDerWaalsContact O-CD 3.26Å; F265-P268 WeakPolarHBondContact O-CD 3.49Å; F265-L271 HydrophobicContact CD1-CD2 3.54Å; F265-L271 HydrophobicContact CE1-CD2 3.91Å; F265-C332 HydrophobicContact CB-CB 4.16Å; F265-C332 HydrophobicContact CD1-CB 3.73Å; F265-C332 HydrophobicContact CD2-CB 3.65Å; F265-C332 HydrophobicContact CE1-CB 3.94Å; F265-C332 HydrophobicContact CE2-CB 3.92Å; F265-C332 HydrophobicContact CG-CB 3.56Å; F265-C332 HydrophobicContact CZ-CB 4.04Å; F265-K333 HydrophobicContact CE2-CB 3.92Å; F265-K336 HydrophobicContact CE1-CD 4.37Å; F265-K336 HydrophobicContact CZ-CB 4.03Å; F265-K336 HydrophobicContact CZ-CD 3.8Å; F265-V341 HydrophobicContact CE1-CG1 4.45Å; F265-N345 HydrophobicContact CD1-CB 3.96Å; F265-N345 HydrophobicContact CE1-CB 3.77Å; F265-N345 VanDerWaalsContact CE1-CG 3.47Å; F265-N345 WeakPolarHBondContact CE1-OD1 3.26Å
266	P	86.9	Confident	87.5	Confident	100 Å²	100	52.8 Å²	52.8	65%	0.649	27%	0.274	S	S	*	.	S	Bend	trans	-66.4	-26.5	-173.5	22.7	-32.4	0	0	0	113.7	P268	P266-P268 VanDerWaalsContact C-CD 3.49Å; P266-P268 WeakPolarHBondContact O-CD 3.3Å
267	L	90	Very high	87.7	Confident	117 Å²	117	53.3 Å²	53.3	61%	0.613	27%	0.273	S	S	*	.	S	Bend	trans	-123.7	62.7	178.6	-64.3	175	0	0	0	111.6	F265 K269 N270 L271	F265-L267 VanDerWaalsContact C-N 3.27Å; F265-L267 PolarHBondContact O-N 2.88Å; L267-K269 PolarHBondContact O-N 2.96Å; L267-N270 HydrophobicContact CB-CB 4.28Å; L267-N270 PolarHBondContact O-N 3.04Å; L267-L271 PolarHBondContact O-N 2.85Å; L267-L271 VanDerWaalsContact O-N 3.07Å
268	P	91.6	Very high	87.7	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.013	29%	0.285	C	S	.	.	H	α-helix	trans	-69.7	-38.5	-164.3	28.3	-32.6	0	0	0	112.6	L262 F265 P266 N270 L271 L272 N325 A328 A329 C332	L262-P268 HydrophobicContact CD1-CG 4.02Å; F265-P268 HydrophobicContact CB-CB 4.2Å; F265-P268 VanDerWaalsContact O-CD 3.26Å; F265-P268 WeakPolarHBondContact O-CD 3.49Å; P266-P268 VanDerWaalsContact C-CD 3.49Å; P266-P268 WeakPolarHBondContact O-CD 3.3Å; P268-N270 VanDerWaalsContact C-N 3.31Å; P268-N270 PolarHBondContact O-N 2.8Å; P268-L271 PolarHBondContact O-N 3.19Å; P268-L272 WeakPolarHBondContact O-CG 3.44Å; P268-L272 PolarHBondContact O-N 2.85Å; P268-N325 HydrophobicContact CG-CB 4.31Å; P268-N325 VanDerWaalsContact CG-O 3.3Å; P268-N325 WeakPolarHBondContact CG-O 3.38Å; P268-A328 HydrophobicContact CB-CB 3.81Å; P268-A328 HydrophobicContact CG-CB 3.93Å; P268-A329 HydrophobicContact CB-CB 3.97Å; P268-A329 HydrophobicContact CG-CB 4.12Å; P268-C332 PolarHBondContact O-SG 3.42Å
269	K	91.4	Very high	87.6	Confident	49 Å²	49	55.9 Å²	55.9	21%	0.213	29%	0.286	C	S	.	.	H	α-helix	trans	-61	-39.6	176	-68.3	-179.3	177.1	176	0	112.6	L267 A273 F291 E324 N325 A328	L267-K269 PolarHBondContact O-N 2.96Å; K269-A273 WeakPolarHBondContact O-CB 3.35Å; K269-A273 PolarHBondContact O-N 3.01Å; K269-F291 HydrophobicContact CD-CZ 4.38Å; K269-F291 HydrophobicContact CG-CE2 4.49Å; K269-F291 HydrophobicContact CG-CZ 4.08Å; K269-E324 VanDerWaalsContact CE-CB 3.46Å; K269-E324 VanDerWaalsContact NZ-CB 3.3Å; K269-E324 IonicContact NZ-OE2 3.64Å; K269-E324 PolarHBondContact NZ-OE2 3.1Å; K269-N325 VanDerWaalsContact CD-OD1 3.27Å; K269-N325 WeakPolarHBondContact CD-OD1 3.24Å; K269-N325 WeakPolarHBondContact CE-OD1 3.45Å; K269-A328 HydrophobicContact CG-CB 3.81Å
270	N	89.6	Confident	87.3	Confident	97 Å²	97	54.3 Å²	54.3	52%	0.519	28%	0.28	S	S	.	.	H	α-helix	trans	-69.4	-42.4	178.4	-69.5	-12.5	0	0	0	110.6	L267 P268 A273 K274	L267-N270 HydrophobicContact CB-CB 4.28Å; L267-N270 PolarHBondContact O-N 3.04Å; P268-N270 VanDerWaalsContact C-N 3.31Å; P268-N270 PolarHBondContact O-N 2.8Å; N270-A273 PolarHBondContact O-N 2.94Å; N270-K274 WeakPolarHBondContact O-CB 3.48Å; N270-K274 WeakPolarHBondContact O-CG 3.32Å; N270-K274 PolarHBondContact O-N 3.34Å
271	L	89.7	Confident	86.5	Confident	20 Å²	20	51.1 Å²	51.1	11%	0.105	28%	0.279	C	S	.	.	H	α-helix	trans	-61.4	-48.9	175.8	-179.3	59.4	0	0	0	111.2	F265 L267 P268 A273 K274 V275 C332 V341 N345 P347	F265-L271 HydrophobicContact CD1-CD2 3.54Å; F265-L271 HydrophobicContact CE1-CD2 3.91Å; L267-L271 PolarHBondContact O-N 2.85Å; L267-L271 VanDerWaalsContact O-N 3.07Å; P268-L271 PolarHBondContact O-N 3.19Å; L271-A273 PolarHBondContact O-N 2.69Å; L271-K274 PolarHBondContact O-N 2.87Å; L271-V275 HydrophobicContact CD1-CG2 4.07Å; L271-V275 HydrophobicContact CG-CG2 4.32Å; L271-V275 WeakPolarHBondContact O-CB 3.42Å; L271-V275 VanDerWaalsContact O-CG2 3.26Å; L271-V275 WeakPolarHBondContact O-CG2 3.32Å; L271-V275 PolarHBondContact O-N 3.26Å; L271-C332 HydrophobicContact CD2-CB 4.34Å; L271-V341 HydrophobicContact CD2-CG1 4.3Å; L271-N345 WeakPolarHBondContact CD1-O 3.45Å; L271-N345 WeakPolarHBondContact CD2-O 3.48Å; L271-P347 HydrophobicContact CD1-CG 3.9Å
272	L	89.7	Confident	85.5	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-56.8	-47.6	175.6	-71.9	173.6	0	0	0	112	P268 K274 V275 I276 M289 L303 A328 A331 L335	P268-L272 WeakPolarHBondContact O-CG 3.44Å; P268-L272 PolarHBondContact O-N 2.85Å; L272-K274 VanDerWaalsContact C-N 3.34Å; L272-K274 PolarHBondContact O-N 3.14Å; L272-V275 PolarHBondContact O-N 2.8Å; L272-I276 WeakPolarHBondContact O-CB 3.47Å; L272-I276 WeakPolarHBondContact O-CD1 3.46Å; L272-I276 WeakPolarHBondContact O-CG1 3.08Å; L272-I276 PolarHBondContact O-N 3.42Å; L272-M289 HydrophobicContact CB-SD 3.76Å; L272-M289 HydrophobicContact CD1-SD 3.6Å; L272-M289 VanDerWaalsContact CD1-SD 3.6Å; L272-M289 HydrophobicContact CG-SD 4.33Å; L272-L303 HydrophobicContact CD1-CD2 3.97Å; L272-A328 HydrophobicContact CD1-CB 3.76Å; L272-A331 HydrophobicContact CD1-CB 3.99Å; L272-A331 HydrophobicContact CD2-CB 4.05Å; L272-L335 HydrophobicContact CD2-CD1 3.45Å; L272-L335 VanDerWaalsContact CD2-CD1 3.45Å
273	A	87.8	Confident	84.2	Confident	29 Å²	29	56 Å²	56	24%	0.24	32%	0.317	C	S	.	.	H	α-helix	trans	-60.1	-44	178.7	0	0	0	0	0	111.8	K269 N270 L271 Q277 A285	K269-A273 WeakPolarHBondContact O-CB 3.35Å; K269-A273 PolarHBondContact O-N 3.01Å; N270-A273 PolarHBondContact O-N 2.94Å; L271-A273 PolarHBondContact O-N 2.69Å; A273-Q277 WeakPolarHBondContact O-CB 3.19Å; A273-Q277 PolarHBondContact O-N 2.98Å; A273-A285 HydrophobicContact CB-CB 4.39Å
274	K	85.9	Confident	82.9	Confident	125 Å²	125	53.5 Å²	53.5	54%	0.543	30%	0.302	S	S	.	.	H	α-helix	trans	-62.5	-48.2	175.2	-76.9	-176.3	177.5	-173	0	111.9	N270 L271 L272 I276 Q277 I278 P347	N270-K274 WeakPolarHBondContact O-CB 3.48Å; N270-K274 WeakPolarHBondContact O-CG 3.32Å; N270-K274 PolarHBondContact O-N 3.34Å; L271-K274 PolarHBondContact O-N 2.87Å; L272-K274 VanDerWaalsContact C-N 3.34Å; L272-K274 PolarHBondContact O-N 3.14Å; K274-I276 PolarHBondContact O-N 3.49Å; K274-Q277 PolarHBondContact O-N 3.48Å; K274-I278 WeakPolarHBondContact O-CB 3.49Å; K274-I278 VanDerWaalsContact O-CG1 3.23Å; K274-I278 WeakPolarHBondContact O-CG1 3.02Å; K274-I278 PolarHBondContact O-N 3.24Å; K274-P347 HydrophobicContact CB-CG 3.91Å
275	V	86.9	Confident	81.9	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.006	29%	0.291	C	S	.	.	H	α-helix	trans	-56.8	-51.2	178.6	167	0	0	0	0	110.7	L271 L272 Q277 I278 A279 W307 L335 V341 P347 Y353	L271-V275 HydrophobicContact CD1-CG2 4.07Å; L271-V275 HydrophobicContact CG-CG2 4.32Å; L271-V275 WeakPolarHBondContact O-CB 3.42Å; L271-V275 VanDerWaalsContact O-CG2 3.26Å; L271-V275 WeakPolarHBondContact O-CG2 3.32Å; L271-V275 PolarHBondContact O-N 3.26Å; L272-V275 PolarHBondContact O-N 2.8Å; V275-Q277 PolarHBondContact O-N 3.22Å; V275-I278 PolarHBondContact O-N 3.19Å; V275-A279 WeakPolarHBondContact O-CB 3.37Å; V275-A279 PolarHBondContact O-N 3.14Å; V275-W307 HydrophobicContact CG1-CE3 4.48Å; V275-W307 HydrophobicContact CG1-CH2 4.13Å; V275-W307 HydrophobicContact CG1-CZ3 3.63Å; V275-L335 HydrophobicContact CG1-CD1 4.17Å; V275-V341 HydrophobicContact CG2-CG2 4.14Å; V275-P347 HydrophobicContact CG2-CB 3.94Å; V275-P347 HydrophobicContact CG2-CG 4.14Å; V275-Y353 HydrophobicContact CG1-CE1 4.13Å; V275-Y353 WeakPolarHBondContact CG1-OH 3.39Å
276	I	85.1	Confident	81.1	Confident	1 Å²	1	59 Å²	59	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-61.6	-47	179.2	-64.9	165.1	0	0	0	110.6	L272 K274 I278 A279 T280 A285 L288 M289 L305	L272-I276 WeakPolarHBondContact O-CB 3.47Å; L272-I276 WeakPolarHBondContact O-CD1 3.46Å; L272-I276 WeakPolarHBondContact O-CG1 3.08Å; L272-I276 PolarHBondContact O-N 3.42Å; K274-I276 PolarHBondContact O-N 3.49Å; I276-I278 VanDerWaalsContact C-N 3.33Å; I276-I278 PolarHBondContact O-N 2.84Å; I276-A279 PolarHBondContact O-N 2.83Å; I276-T280 HydrophobicContact CG2-CG2 4.43Å; I276-T280 PolarHBondContact O-N 2.85Å; I276-T280 PolarHBondContact O-OG1 3.11Å; I276-T280 VanDerWaalsContact O-OG1 3.04Å; I276-A285 HydrophobicContact CB-CB 4.29Å; I276-A285 HydrophobicContact CG2-CB 4.08Å; I276-L288 HydrophobicContact CD1-CB 4.49Å; I276-L288 HydrophobicContact CG2-CB 4.09Å; I276-L288 HydrophobicContact CG2-CD1 3.43Å; I276-L288 VanDerWaalsContact CG2-CD1 3.43Å; I276-L288 HydrophobicContact CG2-CG 4.37Å; I276-M289 HydrophobicContact CD1-CB 4.04Å; I276-L305 HydrophobicContact CD1-CD1 3.63Å; I276-L305 HydrophobicContact CG1-CD1 4.43Å
277	Q	83.5	Confident	80.7	Confident	113 Å²	113	59.1 Å²	59.1	53%	0.528	32%	0.322	S	S	.	.	H	α-helix	trans	-61	-41.9	-179	-176.3	177.8	-1.1	0	0	112	A273 K274 V275 S281	A273-Q277 WeakPolarHBondContact O-CB 3.19Å; A273-Q277 PolarHBondContact O-N 2.98Å; K274-Q277 PolarHBondContact O-N 3.48Å; V275-Q277 PolarHBondContact O-N 3.22Å; Q277-S281 WeakPolarHBondContact O-CA 3.22Å; Q277-S281 PolarHBondContact O-N 2.65Å; Q277-S281 VanDerWaalsContact O-N 3.13Å
278	I	82.8	Confident	80.3	Confident	59 Å²	59	55.5 Å²	55.5	30%	0.303	30%	0.303	S	S	.	.	H	α-helix	trans	-72.8	-42.8	178.1	-64.7	164.6	0	0	0	110.7	K274 V275 I276 P347 L348 H350 Y353	K274-I278 WeakPolarHBondContact O-CB 3.49Å; K274-I278 VanDerWaalsContact O-CG1 3.23Å; K274-I278 WeakPolarHBondContact O-CG1 3.02Å; K274-I278 PolarHBondContact O-N 3.24Å; V275-I278 PolarHBondContact O-N 3.19Å; I276-I278 VanDerWaalsContact C-N 3.33Å; I276-I278 PolarHBondContact O-N 2.84Å; I278-P347 HydrophobicContact CD1-CB 3.6Å; I278-P347 HydrophobicContact CD1-CG 3.97Å; I278-L348 WeakPolarHBondContact CG2-O 3.2Å; I278-H350 HydrophobicContact CG2-CB 3.99Å; I278-H350 WeakPolarHBondContact O-CB 3.26Å; I278-H350 PolarHBondContact O-CD2 3.01Å; I278-Y353 HydrophobicContact CB-CE2 4.17Å; I278-Y353 HydrophobicContact CG2-CD2 3.98Å; I278-Y353 HydrophobicContact CG2-CE2 3.84Å
279	A	81.4	Confident	80.1	Confident	5 Å²	5	56.6 Å²	56.6	4%	0.041	31%	0.309	C	S	.	.	H	α-helix	trans	-67.6	-41.2	-177.3	0	0	0	0	0	112.9	V275 I276 W307 Y353 N354	V275-A279 WeakPolarHBondContact O-CB 3.37Å; V275-A279 PolarHBondContact O-N 3.14Å; I276-A279 PolarHBondContact O-N 2.83Å; A279-W307 HydrophobicContact CB-CD2 4.48Å; A279-W307 HydrophobicContact CB-CH2 3.75Å; A279-W307 HydrophobicContact CB-CZ2 3.35Å; A279-W307 HydrophobicContact CB-CZ3 4.46Å; A279-Y353 VanDerWaalsContact CA-CD2 3.49Å; A279-Y353 HydrophobicContact CB-CD1 3.94Å; A279-Y353 HydrophobicContact CB-CD2 3.61Å; A279-Y353 HydrophobicContact CB-CE1 4.43Å; A279-Y353 HydrophobicContact CB-CE2 4.11Å; A279-Y353 HydrophobicContact CB-CG 3.51Å; A279-N354 PolarHBondContact O-ND2 3.1Å
280	T	78	Confident	80	Confident	47 Å²	47	59.5 Å²	59.5	29%	0.288	32%	0.323	S	S	.	.	H	α-helix	trans	-103.2	0.1	-172.4	78.2	0	0	0	0	113.7	I276 S282 L288 W307	I276-T280 HydrophobicContact CG2-CG2 4.43Å; I276-T280 PolarHBondContact O-N 2.85Å; I276-T280 PolarHBondContact O-OG1 3.11Å; I276-T280 VanDerWaalsContact O-OG1 3.04Å; T280-S282 PolarHBondContact O-N 2.9Å; T280-S282 WeakPolarHBondContact OG1-CB 3.36Å; T280-S282 PolarHBondContact OG1-N 2.81Å; T280-L288 HydrophobicContact CG2-CD1 4.13Å; T280-W307 HydrophobicContact CG2-CG 4.2Å
281	S	70.4	Confident	80	Confident	70 Å²	70	57.6 Å²	57.6	49%	0.49	31%	0.31	S	S	.	.			trans	50.2	20.7	-171.8	-85.9	0	0	0	0	114.4	Q277 H350	Q277-S281 WeakPolarHBondContact O-CA 3.22Å; Q277-S281 PolarHBondContact O-N 2.65Å; Q277-S281 VanDerWaalsContact O-N 3.13Å; S281-H350 PolarHBondContact OG-CD2 2.93Å; S281-H350 PolarHBondContact OG-NE2 3.41Å
282	S	66.7	Low	80.1	Confident	36 Å²	36	62.6 Å²	62.6	25%	0.252	33%	0.333	S	S	.	.			trans	-101.7	140.7	-170.8	-172.8	0	0	0	0	111.5	T280 T284	T280-S282 PolarHBondContact O-N 2.9Å; T280-S282 WeakPolarHBondContact OG1-CB 3.36Å; T280-S282 PolarHBondContact OG1-N 2.81Å; S282-T284 PolarHBondContact O-N 2.6Å; S282-T284 PolarHBondContact OG-N 2.68Å; S282-T284 PolarHBondContact OG-OG1 3.29Å
283	S	60.7	Low	80.1	Confident	116 Å²	116	64.2 Å²	64.2	81%	0.811	34%	0.343	S	S	*	.	S	Bend	trans	-75.4	-1.9	174.1	57.5	0	0	0	0	113.9
284	T	62.8	Low	80.1	Confident	57 Å²	57	66 Å²	66	35%	0.35	35%	0.35	S	S	.	.			trans	-114.9	47.2	-169.8	46.3	0	0	0	0	114.2	S282 K286 N287	S282-T284 PolarHBondContact O-N 2.6Å; S282-T284 PolarHBondContact OG-N 2.68Å; S282-T284 PolarHBondContact OG-OG1 3.29Å; T284-K286 PolarHBondContact O-N 2.92Å; T284-N287 PolarHBondContact O-N 2.96Å
285	A	69.2	Low	79.9	Confident	14 Å²	14	62.1 Å²	62.1	12%	0.116	35%	0.346	C	S	.	.	H	α-helix	trans	-50.8	-30.7	173	0	0	0	0	0	113.2	A273 I276 N287 L288 M289	A273-A285 HydrophobicContact CB-CB 4.39Å; I276-A285 HydrophobicContact CB-CB 4.29Å; I276-A285 HydrophobicContact CG2-CB 4.08Å; A285-N287 VanDerWaalsContact C-N 3.3Å; A285-N287 PolarHBondContact O-N 3.01Å; A285-L288 PolarHBondContact O-N 3.39Å; A285-M289 PolarHBondContact O-N 3.31Å
286	K	73.6	Confident	79.6	Confident	182 Å²	182	68 Å²	68	79%	0.791	38%	0.382	S	S	*	.	H	α-helix	trans	-61.3	-30.1	174.9	-73.2	-173.1	177.8	-179.6	0	114.7	T284 L288 M289	T284-K286 PolarHBondContact O-N 2.92Å; K286-L288 VanDerWaalsContact C-N 3.34Å; K286-M289 VanDerWaalsContact O-O 3.11Å
287	N	78.1	Confident	79.4	Confident	101 Å²	101	77 Å²	77	54%	0.54	42%	0.421	S	S	.	.	H	α-helix	trans	-78.3	-27.2	-178.9	-66.8	-0.2	0	0	0	111.5	T284 A285 Q290	T284-N287 PolarHBondContact O-N 2.96Å; A285-N287 VanDerWaalsContact C-N 3.3Å; A285-N287 PolarHBondContact O-N 3.01Å; N287-Q290 PolarHBondContact O-NE2 3.38Å
288	L	81.5	Confident	79.5	Confident	42 Å²	42	75.8 Å²	75.8	22%	0.22	42%	0.421	C	S	.	.	H	α-helix	trans	-90.3	-12.1	-178.4	-64.5	173.4	0	0	0	113.1	I276 T280 A285 K286 L305 L306	I276-L288 HydrophobicContact CD1-CB 4.49Å; I276-L288 HydrophobicContact CG2-CB 4.09Å; I276-L288 HydrophobicContact CG2-CD1 3.43Å; I276-L288 VanDerWaalsContact CG2-CD1 3.43Å; I276-L288 HydrophobicContact CG2-CG 4.37Å; T280-L288 HydrophobicContact CG2-CD1 4.13Å; A285-L288 PolarHBondContact O-N 3.39Å; K286-L288 VanDerWaalsContact C-N 3.34Å; L288-L305 WeakPolarHBondContact O-CA 3.26Å; L288-L306 HydrophobicContact CD2-CB 4.09Å; L288-L306 PolarHBondContact O-N 3.26Å
289	M	87.6	Confident	79.6	Confident	25 Å²	25	75.9 Å²	75.9	12%	0.123	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	104.4	-178.8	-176.9	-178.5	58.9	0	0	110	L272 I276 A285 K286 F291 L303 L305	L272-M289 HydrophobicContact CB-SD 3.76Å; L272-M289 HydrophobicContact CD1-SD 3.6Å; L272-M289 VanDerWaalsContact CD1-SD 3.6Å; L272-M289 HydrophobicContact CG-SD 4.33Å; I276-M289 HydrophobicContact CD1-CB 4.04Å; A285-M289 PolarHBondContact O-N 3.31Å; K286-M289 VanDerWaalsContact O-O 3.11Å; M289-F291 HydrophobicContact CE-CE2 3.95Å; M289-F291 HydrophobicContact CG-CE2 3.93Å; M289-F291 HydrophobicContact CG-CZ 4.43Å; M289-F291 HydrophobicContact SD-CE2 3.82Å; M289-F291 HydrophobicContact SD-CZ 4.09Å; M289-L303 HydrophobicContact CG-CD1 3.28Å; M289-L303 HydrophobicContact CG-CG 4.45Å; M289-L303 HydrophobicContact SD-CD1 4.15Å; M289-L305 HydrophobicContact CB-CD1 4.01Å; M289-L305 HydrophobicContact CG-CD1 4.19Å
290	Q	88.7	Confident	80.1	Confident	109 Å²	109	78.2 Å²	78.2	51%	0.509	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	127.7	-174.7	-61	179.1	10.6	0	0	110.8	N287 L303 T304	N287-Q290 PolarHBondContact O-NE2 3.38Å; Q290-L303 WeakPolarHBondContact O-CA 3.47Å; Q290-T304 PolarHBondContact N-O 3.39Å; Q290-T304 PolarHBondContact O-N 3.35Å
291	F	90.7	Very high	80.7	Confident	58 Å²	58	76 Å²	76	25%	0.254	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	130.1	175.2	-70.2	-86.9	0	0	0	110.5	K269 M289 T302 L303 E324 A328	K269-F291 HydrophobicContact CD-CZ 4.38Å; K269-F291 HydrophobicContact CG-CE2 4.49Å; K269-F291 HydrophobicContact CG-CZ 4.08Å; M289-F291 HydrophobicContact CE-CE2 3.95Å; M289-F291 HydrophobicContact CG-CE2 3.93Å; M289-F291 HydrophobicContact CG-CZ 4.43Å; M289-F291 HydrophobicContact SD-CE2 3.82Å; M289-F291 HydrophobicContact SD-CZ 4.09Å; F291-T302 CarbonylContact C-O 3.56Å; F291-T302 WeakPolarHBondContact CA-O 3.13Å; F291-L303 HydrophobicContact CD1-CB 4Å; F291-L303 HydrophobicContact CD1-CD1 3.85Å; F291-L303 HydrophobicContact CD1-CG 4.44Å; F291-L303 HydrophobicContact CD2-CD1 3.99Å; F291-L303 HydrophobicContact CE1-CB 3.79Å; F291-L303 HydrophobicContact CE1-CD1 3.53Å; F291-L303 HydrophobicContact CE1-CD2 3.94Å; F291-L303 HydrophobicContact CE1-CG 3.95Å; F291-L303 HydrophobicContact CE2-CD1 3.67Å; F291-L303 HydrophobicContact CG-CD1 4.07Å; F291-L303 HydrophobicContact CZ-CB 4.49Å; F291-L303 HydrophobicContact CZ-CD1 3.43Å; F291-L303 VanDerWaalsContact CZ-CD1 3.43Å; F291-L303 HydrophobicContact CZ-CD2 3.96Å; F291-L303 HydrophobicContact CZ-CG 4.15Å; F291-E324 HydrophobicContact CB-CG 4.3Å; F291-E324 HydrophobicContact CD1-CB 3.76Å; F291-E324 HydrophobicContact CD1-CG 3.69Å; F291-E324 HydrophobicContact CE1-CB 3.85Å; F291-E324 HydrophobicContact CE1-CG 4.31Å; F291-E324 WeakPolarHBondContact CE1-O 3.37Å; F291-E324 HydrophobicContact CG-CG 4.16Å; F291-A328 HydrophobicContact CE1-CB 4.4Å; F291-A328 HydrophobicContact CZ-CB 4.09Å
292	H	91.2	Very high	81.7	Confident	124 Å²	124	74.3 Å²	74.3	57%	0.574	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.4	119.5	168.9	-174.3	74.6	0	0	0	108.8	V294 A301 T302	H292-V294 VanDerWaalsContact NE2-CG1 3.28Å; H292-V294 WeakPolarHBondContact NE2-CG1 3.47Å; H292-A301 WeakPolarHBondContact O-CA 3.32Å; H292-T302 PolarHBondContact N-O 3.27Å; H292-T302 PolarHBondContact O-N 3.03Å
293	T	89.6	Confident	83	Confident	34 Å²	34	72.6 Å²	72.6	21%	0.209	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	126.7	-178.1	-55.6	0	0	0	0	111.1	K299 L300 A301 K320 E324	T293-K299 HydrophobicContact CG2-CB 3.8Å; T293-K299 HydrophobicContact CG2-CD 4.45Å; T293-L300 CarbonylContact C-O 3.58Å; T293-L300 VanDerWaalsContact CA-O 3.28Å; T293-L300 WeakPolarHBondContact CA-O 3.36Å; T293-A301 HydrophobicContact CG2-CB 4.21Å; T293-A301 WeakPolarHBondContact OG1-CB 3.16Å; T293-K320 HydrophobicContact CG2-CB 4.41Å; T293-K320 HydrophobicContact CG2-CG 4.07Å; T293-E324 WeakPolarHBondContact OG1-CG 3.29Å; T293-E324 PolarHBondContact OG1-OE1 3.37Å
294	V	87.4	Confident	84.4	Confident	66 Å²	66	69.3 Å²	69.3	40%	0.4	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	160.9	180	-66	0	0	0	0	111.7	H292 K299 L300	H292-V294 VanDerWaalsContact NE2-CG1 3.28Å; H292-V294 WeakPolarHBondContact NE2-CG1 3.47Å; V294-K299 WeakPolarHBondContact O-CA 3.42Å; V294-L300 HydrophobicContact CG2-CB 4.13Å; V294-L300 HydrophobicContact CG2-CD2 4.34Å; V294-L300 PolarHBondContact N-O 2.81Å; V294-L300 PolarHBondContact O-N 2.76Å
295	G	82.6	Confident	85.7	Confident	44 Å²	44	66.6 Å²	66.6	45%	0.454	35%	0.351	S	S	.	.			trans	104.5	157.4	177	0	0	0	0	0	114.9	K299	G295-K299 WeakPolarHBondContact O-CD 3.36Å; G295-K299 WeakPolarHBondContact O-CE 3.49Å; G295-K299 PolarHBondContact O-NZ 2.92Å
296	T	79	Confident	86.4	Confident	125 Å²	125	69.5 Å²	69.5	77%	0.767	36%	0.364	S	S	*	.	S	Bend	trans	-101.2	-69.1	-177.1	52.2	0	0	0	0	112.3	K299	T296-K299 VanDerWaalsContact O-CE 3.28Å; T296-K299 WeakPolarHBondContact O-CE 3.29Å; T296-K299 PolarHBondContact O-NZ 2.82Å
297	K	81.5	Confident	87	Confident	191 Å²	191	62.9 Å²	62.9	83%	0.83	33%	0.334	S	S	*	.	S	Bend	trans	-75.2	-40.4	-179.9	-67.9	-175.3	178.5	-179.5	0	113
298	T	85.1	Confident	86.9	Confident	86 Å²	86	60.9 Å²	60.9	53%	0.528	33%	0.327	S	S	.	.	S	Bend	trans	-119.8	122.2	174.9	-49.4	0	0	0	0	107.5	K316	T298-K316 HydrophobicContact CG2-CB 4.15Å
299	K	86.6	Confident	86.9	Confident	61 Å²	61	62 Å²	62	27%	0.265	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	122.4	179.5	-58.3	-62.4	179.6	177.9	0	108.6	T293 V294 G295 T296 K316 G317 A323	T293-K299 HydrophobicContact CG2-CB 3.8Å; T293-K299 HydrophobicContact CG2-CD 4.45Å; V294-K299 WeakPolarHBondContact O-CA 3.42Å; G295-K299 WeakPolarHBondContact O-CD 3.36Å; G295-K299 WeakPolarHBondContact O-CE 3.49Å; G295-K299 PolarHBondContact O-NZ 2.92Å; T296-K299 VanDerWaalsContact O-CE 3.28Å; T296-K299 WeakPolarHBondContact O-CE 3.29Å; T296-K299 PolarHBondContact O-NZ 2.82Å; K299-K316 CarbonylContact O-C 3.53Å; K299-K316 WeakPolarHBondContact O-CA 3.28Å; K299-G317 PolarHBondContact N-O 3.28Å; K299-G317 PolarHBondContact O-N 3.4Å; K299-A323 HydrophobicContact CB-CB 4.07Å; K299-A323 VanDerWaalsContact O-CB 3.31Å; K299-A323 WeakPolarHBondContact O-CB 3.29Å
300	L	90.2	Very high	86.8	Confident	55 Å²	55	65.7 Å²	65.7	29%	0.288	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	111.6	171.7	-176.2	72.8	0	0	0	107.7	T293 V294 V314 K316	T293-L300 CarbonylContact C-O 3.58Å; T293-L300 VanDerWaalsContact CA-O 3.28Å; T293-L300 WeakPolarHBondContact CA-O 3.36Å; V294-L300 HydrophobicContact CG2-CB 4.13Å; V294-L300 HydrophobicContact CG2-CD2 4.34Å; V294-L300 PolarHBondContact N-O 2.81Å; V294-L300 PolarHBondContact O-N 2.76Å; L300-V314 HydrophobicContact CD1-CG1 3.45Å; L300-V314 VanDerWaalsContact CD1-CG1 3.45Å; L300-V314 HydrophobicContact CD2-CG1 4.41Å; L300-V314 HydrophobicContact CG-CG1 3.91Å; L300-K316 HydrophobicContact CD1-CD 4.15Å; L300-K316 HydrophobicContact CD1-CG 3.38Å
301	A	90.9	Very high	86.9	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	126.5	178.2	0	0	0	0	0	110.4	H292 T293 V314 A315 A323 E324	H292-A301 WeakPolarHBondContact O-CA 3.32Å; T293-A301 HydrophobicContact CG2-CB 4.21Å; T293-A301 WeakPolarHBondContact OG1-CB 3.16Å; A301-V314 WeakPolarHBondContact O-CA 3.31Å; A301-A315 PolarHBondContact N-O 2.93Å; A301-A315 PolarHBondContact O-N 3.37Å; A301-A323 VanDerWaalsContact CB-C 3.5Å; A301-A323 HydrophobicContact CB-CB 3.59Å; A301-E324 HydrophobicContact CB-CB 4.36Å; A301-E324 HydrophobicContact CB-CG 3.8Å
302	T	92.5	Very high	86.9	Confident	35 Å²	35	61.6 Å²	61.6	22%	0.215	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	121.4	172.8	-58.1	0	0	0	0	108.7	F291 H292 T312 F313 V314	F291-T302 CarbonylContact C-O 3.56Å; F291-T302 WeakPolarHBondContact CA-O 3.13Å; H292-T302 PolarHBondContact N-O 3.27Å; H292-T302 PolarHBondContact O-N 3.03Å; T302-T312 HydrophobicContact CG2-CG2 3.35Å; T302-F313 CarbonylContact C-O 3.57Å; T302-F313 WeakPolarHBondContact CA-O 3.35Å; T302-V314 HydrophobicContact CG2-CG2 4.04Å
303	L	92.7	Very high	87	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	115.4	174.4	172.4	60.6	0	0	0	109.3	L272 M289 Q290 F291 T312 F313 A327 A328 A331	L272-L303 HydrophobicContact CD1-CD2 3.97Å; M289-L303 HydrophobicContact CG-CD1 3.28Å; M289-L303 HydrophobicContact CG-CG 4.45Å; M289-L303 HydrophobicContact SD-CD1 4.15Å; Q290-L303 WeakPolarHBondContact O-CA 3.47Å; F291-L303 HydrophobicContact CD1-CB 4Å; F291-L303 HydrophobicContact CD1-CD1 3.85Å; F291-L303 HydrophobicContact CD1-CG 4.44Å; F291-L303 HydrophobicContact CD2-CD1 3.99Å; F291-L303 HydrophobicContact CE1-CB 3.79Å; F291-L303 HydrophobicContact CE1-CD1 3.53Å; F291-L303 HydrophobicContact CE1-CD2 3.94Å; F291-L303 HydrophobicContact CE1-CG 3.95Å; F291-L303 HydrophobicContact CE2-CD1 3.67Å; F291-L303 HydrophobicContact CG-CD1 4.07Å; F291-L303 HydrophobicContact CZ-CB 4.49Å; F291-L303 HydrophobicContact CZ-CD1 3.43Å; F291-L303 VanDerWaalsContact CZ-CD1 3.43Å; F291-L303 HydrophobicContact CZ-CD2 3.96Å; F291-L303 HydrophobicContact CZ-CG 4.15Å; L303-T312 CarbonylContact O-C 3.5Å; L303-T312 VanDerWaalsContact O-CA 3.29Å; L303-T312 WeakPolarHBondContact O-CA 3.18Å; L303-F313 HydrophobicContact CB-CB 4.34Å; L303-F313 HydrophobicContact CD2-CD2 4.42Å; L303-F313 PolarHBondContact N-O 3.43Å; L303-F313 PolarHBondContact O-N 3.43Å; L303-A327 HydrophobicContact CB-CB 4.01Å; L303-A328 HydrophobicContact CD2-CB 4.31Å; L303-A331 HydrophobicContact CD2-CB 3.83Å
304	T	91.4	Very high	87	Confident	47 Å²	47	55.3 Å²	55.3	29%	0.288	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	116.2	170.5	-53.5	0	0	0	0	108.9	Q290 L306	Q290-T304 PolarHBondContact N-O 3.39Å; Q290-T304 PolarHBondContact O-N 3.35Å; T304-L306 HydrophobicContact CG2-CD2 4.29Å
305	L	89.8	Confident	87.1	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	121.8	177.9	-171.4	71.1	0	0	0	108.6	I276 L288 M289 W307 P310 M311 F313 L335	I276-L305 HydrophobicContact CD1-CD1 3.63Å; I276-L305 HydrophobicContact CG1-CD1 4.43Å; L288-L305 WeakPolarHBondContact O-CA 3.26Å; M289-L305 HydrophobicContact CB-CD1 4.01Å; M289-L305 HydrophobicContact CG-CD1 4.19Å; L305-W307 WeakPolarHBondContact CD2-O 3.28Å; L305-W307 VanDerWaalsContact CG-O 3.27Å; L305-W307 WeakPolarHBondContact CG-O 3.36Å; L305-P310 CarbonylContact O-C 3.21Å; L305-P310 VanDerWaalsContact O-CA 3.29Å; L305-P310 WeakPolarHBondContact O-CA 3.17Å; L305-M311 HydrophobicContact CD2-CE 4.2Å; L305-M311 PolarHBondContact N-O 3.28Å; L305-M311 PolarHBondContact O-N 2.76Å; L305-F313 HydrophobicContact CB-CE2 4.42Å; L305-L335 HydrophobicContact CD2-CD2 4.48Å
306	L	84.8	Confident	87.4	Confident	75 Å²	75	56 Å²	56	39%	0.393	30%	0.304	S	S	.	.			trans	-89.6	-9.7	-176.8	-63.3	178	0	0	0	114	L288 T304 C309 P310	L288-L306 HydrophobicContact CD2-CB 4.09Å; L288-L306 PolarHBondContact O-N 3.26Å; T304-L306 HydrophobicContact CG2-CD2 4.29Å; L306-C309 CarbonylContact O-C 2.95Å; L306-P310 HydrophobicContact CD2-CB 4.31Å; L306-P310 HydrophobicContact CD2-CG 4.31Å
307	W	84.3	Confident	87.8	Confident	43 Å²	43	50.3 Å²	50.3	16%	0.163	27%	0.27	C	S	.	.	S	Bend	trans	-122.5	144.3	-178.1	-178.9	92.8	0	0	0	111.3	V275 A279 T280 L305 L335 L340 Y353	V275-W307 HydrophobicContact CG1-CE3 4.48Å; V275-W307 HydrophobicContact CG1-CH2 4.13Å; V275-W307 HydrophobicContact CG1-CZ3 3.63Å; A279-W307 HydrophobicContact CB-CD2 4.48Å; A279-W307 HydrophobicContact CB-CH2 3.75Å; A279-W307 HydrophobicContact CB-CZ2 3.35Å; A279-W307 HydrophobicContact CB-CZ3 4.46Å; T280-W307 HydrophobicContact CG2-CG 4.2Å; L305-W307 WeakPolarHBondContact CD2-O 3.28Å; L305-W307 VanDerWaalsContact CG-O 3.27Å; L305-W307 WeakPolarHBondContact CG-O 3.36Å; W307-L335 HydrophobicContact CZ3-CD2 4.18Å; W307-L340 HydrophobicContact CH2-CB 4.47Å; W307-L340 HydrophobicContact CH2-CD1 3.96Å; W307-L340 HydrophobicContact CH2-CD2 4.09Å; W307-L340 HydrophobicContact CH2-CG 4.41Å; W307-L340 HydrophobicContact CZ3-CD1 4.12Å; W307-Y353 AromaticContact CH2-CD1 3.69Å; W307-Y353 HydrophobicContact CH2-CD1 3.69Å; W307-Y353 AromaticContact CH2-CE1 3.8Å; W307-Y353 HydrophobicContact CH2-CE1 3.8Å; W307-Y353 HydrophobicContact CZ2-CD1 4.01Å
308	P	77.8	Confident	88.2	Confident	59 Å²	59	51 Å²	51	38%	0.383	27%	0.268	S	S	.	.	S	Bend	cis	-68	-20.6	-6.7	31.5	-40.3	0	0	0	113.1	M311 L340	P308-M311 HydrophobicContact CG-CE 4.39Å; P308-L340 HydrophobicContact CB-CD1 4.41Å; P308-L340 HydrophobicContact CG-CD1 3.69Å
309	C	81.5	Confident	88.4	Confident	65 Å²	65	56.2 Å²	56.2	44%	0.439	28%	0.278	S	S	.	.	S	Bend	trans	-140.4	161.6	170.8	60.2	0	0	0	0	109.2	L306 M311	L306-C309 CarbonylContact O-C 2.95Å; C309-M311 PolarHBondContact O-N 3.06Å; C309-M311 VanDerWaalsContact O-N 3.17Å
310	P	84.9	Confident	88.5	Confident	102 Å²	102	59.2 Å²	59.2	66%	0.662	29%	0.291	S	S	*	.			trans	-56.8	118	175.5	-26.3	36	0	0	0	112.5	L305 L306	L305-P310 CarbonylContact O-C 3.21Å; L305-P310 VanDerWaalsContact O-CA 3.29Å; L305-P310 WeakPolarHBondContact O-CA 3.17Å; L306-P310 HydrophobicContact CD2-CB 4.31Å; L306-P310 HydrophobicContact CD2-CG 4.31Å
311	M	91.1	Very high	88.5	Confident	29 Å²	29	59.3 Å²	59.3	14%	0.143	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	148.3	176.2	-68.5	179.6	-78.2	0	0	109.7	L305 P308 C309 F313 K334 L335	L305-M311 HydrophobicContact CD2-CE 4.2Å; L305-M311 PolarHBondContact N-O 3.28Å; L305-M311 PolarHBondContact O-N 2.76Å; P308-M311 HydrophobicContact CG-CE 4.39Å; C309-M311 PolarHBondContact O-N 3.06Å; C309-M311 VanDerWaalsContact O-N 3.17Å; M311-F313 HydrophobicContact CB-CE2 3.69Å; M311-F313 HydrophobicContact CB-CZ 3.96Å; M311-F313 HydrophobicContact SD-CZ 4.06Å; M311-K334 HydrophobicContact SD-CG 4.07Å; M311-L335 HydrophobicContact CE-CD2 4.43Å
312	T	90.9	Very high	88.4	Confident	53 Å²	53	62.1 Å²	62.1	33%	0.325	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	131.7	178.6	-56.5	0	0	0	0	110	T302 L303 V314	T302-T312 HydrophobicContact CG2-CG2 3.35Å; L303-T312 CarbonylContact O-C 3.5Å; L303-T312 VanDerWaalsContact O-CA 3.29Å; L303-T312 WeakPolarHBondContact O-CA 3.18Å; T312-V314 HydrophobicContact CG2-CG2 4.32Å
313	F	92.5	Very high	88.3	Confident	11 Å²	11	60.5 Å²	60.5	5%	0.048	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	132.4	178.8	-56.3	-88.3	0	0	0	109.3	T302 L303 L305 M311 L330 A331 K334	T302-F313 CarbonylContact C-O 3.57Å; T302-F313 WeakPolarHBondContact CA-O 3.35Å; L303-F313 HydrophobicContact CB-CB 4.34Å; L303-F313 HydrophobicContact CD2-CD2 4.42Å; L303-F313 PolarHBondContact N-O 3.43Å; L303-F313 PolarHBondContact O-N 3.43Å; L305-F313 HydrophobicContact CB-CE2 4.42Å; M311-F313 HydrophobicContact CB-CE2 3.69Å; M311-F313 HydrophobicContact CB-CZ 3.96Å; M311-F313 HydrophobicContact SD-CZ 4.06Å; F313-L330 HydrophobicContact CB-CB 4.47Å; F313-L330 HydrophobicContact CD1-CB 4Å; F313-A331 HydrophobicContact CD1-CB 4.35Å; F313-A331 HydrophobicContact CD2-CB 3.56Å; F313-A331 HydrophobicContact CE1-CB 4.32Å; F313-A331 HydrophobicContact CE2-CB 3.52Å; F313-A331 HydrophobicContact CG-CB 3.99Å; F313-A331 HydrophobicContact CZ-CB 3.93Å; F313-K334 HydrophobicContact CE1-CB 3.7Å; F313-K334 HydrophobicContact CE1-CG 4.08Å; F313-K334 HydrophobicContact CZ-CB 3.82Å; F313-K334 HydrophobicContact CZ-CG 3.99Å
314	V	89.1	Confident	88.3	Confident	15 Å²	15	61.5 Å²	61.5	9%	0.091	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	129.9	-175.7	-176.5	0	0	0	0	109.3	M252 T253 L300 A301 T302 T312	M252-V314 VanDerWaalsContact O-O 3.1Å; T253-V314 HydrophobicContact CG2-CB 4.24Å; T253-V314 HydrophobicContact CG2-CG1 4.46Å; L300-V314 HydrophobicContact CD1-CG1 3.45Å; L300-V314 VanDerWaalsContact CD1-CG1 3.45Å; L300-V314 HydrophobicContact CD2-CG1 4.41Å; L300-V314 HydrophobicContact CG-CG1 3.91Å; A301-V314 WeakPolarHBondContact O-CA 3.31Å; T302-V314 HydrophobicContact CG2-CG2 4.04Å; T312-V314 HydrophobicContact CG2-CG2 4.32Å
315	A	90.8	Very high	88.4	Confident	6 Å²	6	61.7 Å²	61.7	5%	0.05	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	153.6	176.5	0	0	0	0	0	112.5	A301 K326 A327 L330	A301-A315 PolarHBondContact N-O 2.93Å; A301-A315 PolarHBondContact O-N 3.37Å; A315-K326 HydrophobicContact CB-CB 3.55Å; A315-A327 HydrophobicContact CB-CB 3.99Å; A315-L330 HydrophobicContact CB-CD1 4.47Å
316	K	88.7	Confident	88.6	Confident	118 Å²	118	62.2 Å²	62.2	51%	0.513	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	142.5	179.4	-66.6	174.2	-174.4	171.6	0	110.6	T298 K299 L300 K326	T298-K316 HydrophobicContact CG2-CB 4.15Å; K299-K316 CarbonylContact O-C 3.53Å; K299-K316 WeakPolarHBondContact O-CA 3.28Å; L300-K316 HydrophobicContact CD1-CD 4.15Å; L300-K316 HydrophobicContact CD1-CG 3.38Å; K316-K326 VanDerWaalsContact O-CD 3.24Å; K316-K326 WeakPolarHBondContact O-CD 3.39Å; K316-K326 PolarHBondContact O-NZ 2.68Å
317	G	87.7	Confident	88.9	Confident	5 Å²	5	58.7 Å²	58.7	5%	0.052	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	161.9	176.5	0	0	0	0	0	111.9	K299 R319	K299-G317 PolarHBondContact N-O 3.28Å; K299-G317 PolarHBondContact O-N 3.4Å; G317-R319 VanDerWaalsContact C-N 3.26Å; G317-R319 PolarHBondContact O-N 3.25Å
318	R	88.3	Confident	89.3	Confident	207 Å²	207	56.6 Å²	56.6	78%	0.781	28%	0.282	S	S	*	.	S	Bend	trans	-71.9	-28.2	177.7	-53.3	-177.6	-157.7	-178.1	5.1	111	E322	R318-E322 WeakPolarHBondContact CB-OE2 3.48Å; R318-E322 PolarHBondContact N-OE2 3.47Å
319	R	89.3	Confident	90	Very high	195 Å²	195	53.8 Å²	53.8	74%	0.736	26%	0.264	S	S	*	.	S	Bend	trans	-123.8	153.7	178.7	-59.9	179.6	-177.3	140.5	-1.5	110.6	G317 A321 E322 A323	G317-R319 VanDerWaalsContact C-N 3.26Å; G317-R319 PolarHBondContact O-N 3.25Å; R319-A321 VanDerWaalsContact C-N 3.32Å; R319-A321 PolarHBondContact O-N 2.8Å; R319-E322 HydrophobicContact CB-CB 4.36Å; R319-E322 PolarHBondContact N-OE2 3.3Å; R319-E322 WeakPolarHBondContact O-CB 3.42Å; R319-E322 PolarHBondContact O-N 3.25Å; R319-E322 VanDerWaalsContact O-N 3.12Å; R319-A323 PolarHBondContact O-N 2.98Å
320	K	90.1	Very high	90.6	Very high	123 Å²	123	51 Å²	51	54%	0.535	25%	0.245	S	C	.	.	H	α-helix	trans	-55	-48.4	179.6	173.2	176.1	177.4	-179.7	0	111.3	T293 E322 A323 E324	T293-K320 HydrophobicContact CG2-CB 4.41Å; T293-K320 HydrophobicContact CG2-CG 4.07Å; K320-E322 VanDerWaalsContact C-N 3.3Å; K320-E322 PolarHBondContact O-N 2.79Å; K320-A323 PolarHBondContact O-N 3.21Å; K320-E324 WeakPolarHBondContact CE-OE1 3.18Å; K320-E324 HydrophobicContact CG-CG 4.36Å; K320-E324 IonicContact NZ-OE1 2.84Å; K320-E324 WeakPolarHBondContact O-CG 3.19Å; K320-E324 PolarHBondContact O-N 2.6Å
321	A	89.8	Confident	90.9	Very high	57 Å²	57	46.1 Å²	46.1	47%	0.471	21%	0.213	S	C	.	.	H	α-helix	trans	-60.8	-38	179.6	0	0	0	0	0	113	R319 N325	R319-A321 VanDerWaalsContact C-N 3.32Å; R319-A321 PolarHBondContact O-N 2.8Å; A321-N325 VanDerWaalsContact O-CB 3.26Å; A321-N325 WeakPolarHBondContact O-CB 3.33Å; A321-N325 PolarHBondContact O-N 2.85Å; A321-N325 PolarHBondContact O-ND2 3.36Å
322	E	89.6	Confident	90.9	Very high	60 Å²	60	44.7 Å²	44.7	28%	0.28	21%	0.206	S	C	.	.	H	α-helix	trans	-66.3	-49.4	177.8	-173.3	-166.4	162.3	0	0	111	R318 R319 K320 E324 N325 K326	R318-E322 WeakPolarHBondContact CB-OE2 3.48Å; R318-E322 PolarHBondContact N-OE2 3.47Å; R319-E322 HydrophobicContact CB-CB 4.36Å; R319-E322 PolarHBondContact N-OE2 3.3Å; R319-E322 WeakPolarHBondContact O-CB 3.42Å; R319-E322 PolarHBondContact O-N 3.25Å; R319-E322 VanDerWaalsContact O-N 3.12Å; K320-E322 VanDerWaalsContact C-N 3.3Å; K320-E322 PolarHBondContact O-N 2.79Å; E322-E324 PolarHBondContact O-N 2.69Å; E322-N325 PolarHBondContact O-N 2.82Å; E322-K326 WeakPolarHBondContact O-CB 3.28Å; E322-K326 WeakPolarHBondContact O-CG 3.27Å; E322-K326 PolarHBondContact O-N 2.96Å; E322-K326 IonicContact OE1-NZ 3.12Å
323	A	89.5	Confident	90.9	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.8	-46.2	177.9	0	0	0	0	0	111.6	K299 A301 R319 K320 K326 A327	K299-A323 HydrophobicContact CB-CB 4.07Å; K299-A323 VanDerWaalsContact O-CB 3.31Å; K299-A323 WeakPolarHBondContact O-CB 3.29Å; A301-A323 VanDerWaalsContact CB-C 3.5Å; A301-A323 HydrophobicContact CB-CB 3.59Å; R319-A323 PolarHBondContact O-N 2.98Å; K320-A323 PolarHBondContact O-N 3.21Å; A323-K326 PolarHBondContact O-N 2.77Å; A323-A327 PolarHBondContact O-N 2.96Å
324	E	93.7	Very high	90.8	Very high	22 Å²	22	48.1 Å²	48.1	10%	0.103	22%	0.217	C	C	.	.	H	α-helix	trans	-66.8	-38.5	178.4	-69	177.1	167.8	0	0	112.6	K269 F291 T293 A301 K320 E322 A327 A328	K269-E324 VanDerWaalsContact CE-CB 3.46Å; K269-E324 VanDerWaalsContact NZ-CB 3.3Å; K269-E324 IonicContact NZ-OE2 3.64Å; K269-E324 PolarHBondContact NZ-OE2 3.1Å; F291-E324 HydrophobicContact CB-CG 4.3Å; F291-E324 HydrophobicContact CD1-CB 3.76Å; F291-E324 HydrophobicContact CD1-CG 3.69Å; F291-E324 HydrophobicContact CE1-CB 3.85Å; F291-E324 HydrophobicContact CE1-CG 4.31Å; F291-E324 WeakPolarHBondContact CE1-O 3.37Å; F291-E324 HydrophobicContact CG-CG 4.16Å; T293-E324 WeakPolarHBondContact OG1-CG 3.29Å; T293-E324 PolarHBondContact OG1-OE1 3.37Å; A301-E324 HydrophobicContact CB-CB 4.36Å; A301-E324 HydrophobicContact CB-CG 3.8Å; K320-E324 WeakPolarHBondContact CE-OE1 3.18Å; K320-E324 HydrophobicContact CG-CG 4.36Å; K320-E324 IonicContact NZ-OE1 2.84Å; K320-E324 WeakPolarHBondContact O-CG 3.19Å; K320-E324 PolarHBondContact O-N 2.6Å; E322-E324 PolarHBondContact O-N 2.69Å; E324-A327 PolarHBondContact O-N 3.04Å; E324-A328 WeakPolarHBondContact O-CB 3.49Å; E324-A328 PolarHBondContact O-N 2.64Å
325	N	93.4	Very high	90.8	Very high	50 Å²	50	47.5 Å²	47.5	27%	0.267	21%	0.212	S	C	.	.	H	α-helix	trans	-67.2	-39.3	176.6	-78.1	-16.9	0	0	0	111.5	L262 P268 K269 A321 E322 A328 A329	L262-N325 HydrophobicContact CD1-CB 4Å; P268-N325 HydrophobicContact CG-CB 4.31Å; P268-N325 VanDerWaalsContact CG-O 3.3Å; P268-N325 WeakPolarHBondContact CG-O 3.38Å; K269-N325 VanDerWaalsContact CD-OD1 3.27Å; K269-N325 WeakPolarHBondContact CD-OD1 3.24Å; K269-N325 WeakPolarHBondContact CE-OD1 3.45Å; A321-N325 VanDerWaalsContact O-CB 3.26Å; A321-N325 WeakPolarHBondContact O-CB 3.33Å; A321-N325 PolarHBondContact O-N 2.85Å; A321-N325 PolarHBondContact O-ND2 3.36Å; E322-N325 PolarHBondContact O-N 2.82Å; N325-A328 PolarHBondContact O-N 3.19Å; N325-A329 WeakPolarHBondContact O-CB 3.37Å; N325-A329 PolarHBondContact O-N 3.35Å
326	K	92.5	Very high	90.7	Very high	12 Å²	12	49.8 Å²	49.8	5%	0.052	22%	0.221	C	C	.	.	H	α-helix	trans	-60.7	-46.4	172.6	-79.4	-178.4	176.2	-170.5	0	111.8	D255 A258 L262 A315 K316 E322 A323 A328 A329 L330	D255-K326 IonicContact OD1-NZ 3.77Å; D255-K326 PolarHBondContact OD1-NZ 3.02Å; D255-K326 IonicContact OD2-NZ 2.75Å; A258-K326 HydrophobicContact CB-CB 4.07Å; A258-K326 HydrophobicContact CB-CD 4.28Å; A258-K326 HydrophobicContact CB-CG 4.27Å; L262-K326 HydrophobicContact CD2-CG 4.07Å; A315-K326 HydrophobicContact CB-CB 3.55Å; K316-K326 VanDerWaalsContact O-CD 3.24Å; K316-K326 WeakPolarHBondContact O-CD 3.39Å; K316-K326 PolarHBondContact O-NZ 2.68Å; E322-K326 WeakPolarHBondContact O-CB 3.28Å; E322-K326 WeakPolarHBondContact O-CG 3.27Å; E322-K326 PolarHBondContact O-N 2.96Å; E322-K326 IonicContact OE1-NZ 3.12Å; A323-K326 PolarHBondContact O-N 2.77Å; K326-A328 PolarHBondContact O-N 3.06Å; K326-A329 PolarHBondContact O-N 3.15Å; K326-L330 WeakPolarHBondContact O-CG 2.81Å; K326-L330 PolarHBondContact O-N 3.48Å
327	A	91.7	Very high	90.7	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.3	-42.2	176.5	0	0	0	0	0	111.9	L303 A315 A323 E324 A329 L330 A331	L303-A327 HydrophobicContact CB-CB 4.01Å; A315-A327 HydrophobicContact CB-CB 3.99Å; A323-A327 PolarHBondContact O-N 2.96Å; E324-A327 PolarHBondContact O-N 3.04Å; A327-A329 PolarHBondContact O-N 2.83Å; A327-L330 PolarHBondContact O-N 3.22Å; A327-A331 PolarHBondContact O-N 3.14Å; A327-A331 VanDerWaalsContact O-N 3.12Å
328	A	93.3	Very high	90.6	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62.8	-39.5	174	0	0	0	0	0	112.5	P268 K269 L272 F291 L303 E324 N325 K326 A331 C332	P268-A328 HydrophobicContact CB-CB 3.81Å; P268-A328 HydrophobicContact CG-CB 3.93Å; K269-A328 HydrophobicContact CG-CB 3.81Å; L272-A328 HydrophobicContact CD1-CB 3.76Å; F291-A328 HydrophobicContact CE1-CB 4.4Å; F291-A328 HydrophobicContact CZ-CB 4.09Å; L303-A328 HydrophobicContact CD2-CB 4.31Å; E324-A328 WeakPolarHBondContact O-CB 3.49Å; E324-A328 PolarHBondContact O-N 2.64Å; N325-A328 PolarHBondContact O-N 3.19Å; K326-A328 PolarHBondContact O-N 3.06Å; A328-A331 WeakPolarHBondContact O-CB 3.35Å; A328-A331 PolarHBondContact O-N 2.92Å; A328-C332 PolarHBondContact O-N 3.1Å; A328-C332 PolarHBondContact O-SG 3.11Å; A328-C332 VanDerWaalsContact O-SG 3.41Å
329	A	92.5	Very high	90.4	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.7	-39.1	178.7	0	0	0	0	0	111.9	A261 L262 P268 N325 K326 A327 A331 C332 K333	A261-A329 HydrophobicContact CB-CB 3.87Å; L262-A329 HydrophobicContact CB-CB 4.09Å; L262-A329 HydrophobicContact CD1-CB 4.11Å; P268-A329 HydrophobicContact CB-CB 3.97Å; P268-A329 HydrophobicContact CG-CB 4.12Å; N325-A329 WeakPolarHBondContact O-CB 3.37Å; N325-A329 PolarHBondContact O-N 3.35Å; K326-A329 PolarHBondContact O-N 3.15Å; A327-A329 PolarHBondContact O-N 2.83Å; A329-A331 VanDerWaalsContact C-N 3.28Å; A329-A331 PolarHBondContact O-N 2.83Å; A329-C332 PolarHBondContact O-N 2.7Å; A329-K333 WeakPolarHBondContact O-CB 3.32Å; A329-K333 PolarHBondContact O-N 3.34Å
330	L	92.5	Very high	90.3	Very high	5 Å²	5	35.3 Å²	35.3	3%	0.026	20%	0.196	C	C	.	.	H	α-helix	trans	-59	-41.4	170.6	-70.4	175.1	0	0	0	111.4	M252 A258 A261 F313 A315 K326 A327 K333 K334	M252-L330 HydrophobicContact CB-CD1 4.45Å; A258-L330 HydrophobicContact CB-CD1 4.06Å; A258-L330 HydrophobicContact CB-CD2 4.2Å; A258-L330 HydrophobicContact CB-CG 4.09Å; A261-L330 HydrophobicContact CB-CD2 4.2Å; F313-L330 HydrophobicContact CB-CB 4.47Å; F313-L330 HydrophobicContact CD1-CB 4Å; A315-L330 HydrophobicContact CB-CD1 4.47Å; K326-L330 WeakPolarHBondContact O-CG 2.81Å; K326-L330 PolarHBondContact O-N 3.48Å; A327-L330 PolarHBondContact O-N 3.22Å; L330-K333 PolarHBondContact O-N 2.84Å; L330-K334 PolarHBondContact O-N 3.15Å
331	A	91.8	Very high	90.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.3	-45.5	174.3	0	0	0	0	0	112.1	L272 L303 F313 A327 A328 A329 K333 K334 L335	L272-A331 HydrophobicContact CD1-CB 3.99Å; L272-A331 HydrophobicContact CD2-CB 4.05Å; L303-A331 HydrophobicContact CD2-CB 3.83Å; F313-A331 HydrophobicContact CD1-CB 4.35Å; F313-A331 HydrophobicContact CD2-CB 3.56Å; F313-A331 HydrophobicContact CE1-CB 4.32Å; F313-A331 HydrophobicContact CE2-CB 3.52Å; F313-A331 HydrophobicContact CG-CB 3.99Å; F313-A331 HydrophobicContact CZ-CB 3.93Å; A327-A331 PolarHBondContact O-N 3.14Å; A327-A331 VanDerWaalsContact O-N 3.12Å; A328-A331 WeakPolarHBondContact O-CB 3.35Å; A328-A331 PolarHBondContact O-N 2.92Å; A329-A331 VanDerWaalsContact C-N 3.28Å; A329-A331 PolarHBondContact O-N 2.83Å; A331-K333 VanDerWaalsContact C-N 3.33Å; A331-K333 PolarHBondContact O-N 3.37Å; A331-K334 PolarHBondContact O-N 3.18Å; A331-K334 VanDerWaalsContact O-N 3.16Å; A331-L335 WeakPolarHBondContact O-CG 3.32Å; A331-L335 PolarHBondContact O-N 3.19Å
332	C	91.6	Very high	89.9	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-57.7	-44.3	174	-68.2	0	0	0	0	112.2	F265 P268 L271 A328 A329 K334 L335 K336	F265-C332 HydrophobicContact CB-CB 4.16Å; F265-C332 HydrophobicContact CD1-CB 3.73Å; F265-C332 HydrophobicContact CD2-CB 3.65Å; F265-C332 HydrophobicContact CE1-CB 3.94Å; F265-C332 HydrophobicContact CE2-CB 3.92Å; F265-C332 HydrophobicContact CG-CB 3.56Å; F265-C332 HydrophobicContact CZ-CB 4.04Å; P268-C332 PolarHBondContact O-SG 3.42Å; L271-C332 HydrophobicContact CD2-CB 4.34Å; A328-C332 PolarHBondContact O-N 3.1Å; A328-C332 PolarHBondContact O-SG 3.11Å; A328-C332 VanDerWaalsContact O-SG 3.41Å; A329-C332 PolarHBondContact O-N 2.7Å; C332-K334 VanDerWaalsContact C-N 3.32Å; C332-K334 PolarHBondContact O-N 3.06Å; C332-L335 PolarHBondContact O-N 2.99Å; C332-K336 WeakPolarHBondContact O-CB 3.36Å; C332-K336 PolarHBondContact O-N 2.83Å
333	K	90.6	Very high	89.7	Confident	69 Å²	69	37.3 Å²	37.3	30%	0.3	19%	0.19	S	C	.	.	H	α-helix	trans	-60.9	-41.8	176.3	-175.8	177.6	175.4	-177.9	0	111.4	S257 A261 F265 A329 L330 A331 K336 S337	S257-K333 PolarHBondContact OG-NZ 2.89Å; A261-K333 HydrophobicContact CB-CB 4.21Å; A261-K333 HydrophobicContact CB-CD 3.99Å; F265-K333 HydrophobicContact CE2-CB 3.92Å; A329-K333 WeakPolarHBondContact O-CB 3.32Å; A329-K333 PolarHBondContact O-N 3.34Å; L330-K333 PolarHBondContact O-N 2.84Å; A331-K333 VanDerWaalsContact C-N 3.33Å; A331-K333 PolarHBondContact O-N 3.37Å; K333-K336 PolarHBondContact O-N 2.92Å; K333-S337 PolarHBondContact O-N 2.78Å
334	K	90	Very high	89.4	Confident	67 Å²	67	43.4 Å²	43.4	29%	0.291	22%	0.222	S	C	.	.	H	α-helix	trans	-64.6	-46.6	175.3	-174.5	63.4	179.9	176.5	0	111.3	M311 F313 L330 A331 C332 K336 S337 L338	M311-K334 HydrophobicContact SD-CG 4.07Å; F313-K334 HydrophobicContact CE1-CB 3.7Å; F313-K334 HydrophobicContact CE1-CG 4.08Å; F313-K334 HydrophobicContact CZ-CB 3.82Å; F313-K334 HydrophobicContact CZ-CG 3.99Å; L330-K334 PolarHBondContact O-N 3.15Å; A331-K334 PolarHBondContact O-N 3.18Å; A331-K334 VanDerWaalsContact O-N 3.16Å; C332-K334 VanDerWaalsContact C-N 3.32Å; C332-K334 PolarHBondContact O-N 3.06Å; K334-K336 VanDerWaalsContact C-N 3.32Å; K334-K336 PolarHBondContact O-N 3.24Å; K334-S337 PolarHBondContact O-N 3.09Å; K334-S337 VanDerWaalsContact O-N 3.12Å; K334-S337 PolarHBondContact O-OG 2.82Å; K334-L338 HydrophobicContact CG-CD1 4.34Å; K334-L338 WeakPolarHBondContact O-CG 3.3Å; K334-L338 PolarHBondContact O-N 3.01Å
335	L	89.9	Confident	89.1	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-59.1	-41.7	175.6	-67.6	-179.8	0	0	0	112	L272 V275 L305 W307 M311 A331 C332 S337 L338 G339 L340 V341	L272-L335 HydrophobicContact CD2-CD1 3.45Å; L272-L335 VanDerWaalsContact CD2-CD1 3.45Å; V275-L335 HydrophobicContact CG1-CD1 4.17Å; L305-L335 HydrophobicContact CD2-CD2 4.48Å; W307-L335 HydrophobicContact CZ3-CD2 4.18Å; M311-L335 HydrophobicContact CE-CD2 4.43Å; A331-L335 WeakPolarHBondContact O-CG 3.32Å; A331-L335 PolarHBondContact O-N 3.19Å; C332-L335 PolarHBondContact O-N 2.99Å; L335-S337 PolarHBondContact O-N 3.35Å; L335-L338 CarbonylContact O-C 3.57Å; L335-L338 PolarHBondContact O-N 3.38Å; L335-L338 VanDerWaalsContact O-N 3.15Å; L335-G339 PolarHBondContact O-N 3.01Å; L335-L340 HydrophobicContact CB-CB 4.24Å; L335-L340 HydrophobicContact CD2-CB 4.39Å; L335-L340 HydrophobicContact CD2-CD1 3.76Å; L335-L340 WeakPolarHBondContact O-CB 3.32Å; L335-L340 PolarHBondContact O-N 3.28Å; L335-V341 HydrophobicContact CB-CG2 3.92Å
336	K	89	Confident	88.8	Confident	54 Å²	54	47.9 Å²	47.9	24%	0.235	24%	0.243	C	C	.	.	H	α-helix	trans	-62.5	-41.4	173.9	-170.5	168.8	-171.7	168.5	0	112.2	F265 C332 K333 K334 L338 G339 V341 D342 R343 N345	F265-K336 HydrophobicContact CE1-CD 4.37Å; F265-K336 HydrophobicContact CZ-CB 4.03Å; F265-K336 HydrophobicContact CZ-CD 3.8Å; C332-K336 WeakPolarHBondContact O-CB 3.36Å; C332-K336 PolarHBondContact O-N 2.83Å; K333-K336 PolarHBondContact O-N 2.92Å; K334-K336 VanDerWaalsContact C-N 3.32Å; K334-K336 PolarHBondContact O-N 3.24Å; K336-L338 PolarHBondContact O-N 2.93Å; K336-G339 PolarHBondContact O-N 3.22Å; K336-V341 HydrophobicContact CB-CB 4.14Å; K336-D342 VanDerWaalsContact CE-O 3.25Å; K336-D342 WeakPolarHBondContact CE-O 3.21Å; K336-R343 PolarHBondContact NZ-O 2.79Å; K336-N345 WeakPolarHBondContact CD-OD1 3.4Å; K336-N345 PolarHBondContact NZ-OD1 2.95Å
337	S	88.3	Confident	88.5	Confident	85 Å²	85	49 Å²	49	59%	0.594	25%	0.251	S	S	*	.	H	α-helix	trans	-65.3	-25	175.2	76.1	0	0	0	0	113.7	K333 K334 L335 G339	K333-S337 PolarHBondContact O-N 2.78Å; K334-S337 PolarHBondContact O-N 3.09Å; K334-S337 VanDerWaalsContact O-N 3.12Å; K334-S337 PolarHBondContact O-OG 2.82Å; L335-S337 PolarHBondContact O-N 3.35Å; S337-G339 VanDerWaalsContact C-N 3.29Å
338	L	86	Confident	88.2	Confident	61 Å²	61	50.1 Å²	50.1	32%	0.319	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	0	173.2	-65	173.7	0	0	0	112.5	K334 L335 K336 L340	K334-L338 HydrophobicContact CG-CD1 4.34Å; K334-L338 WeakPolarHBondContact O-CG 3.3Å; K334-L338 PolarHBondContact O-N 3.01Å; L335-L338 CarbonylContact O-C 3.57Å; L335-L338 PolarHBondContact O-N 3.38Å; L335-L338 VanDerWaalsContact O-N 3.15Å; K336-L338 PolarHBondContact O-N 2.93Å; L338-L340 VanDerWaalsContact C-N 3.31Å; L338-L340 HydrophobicContact CB-CD1 4.1Å; L338-L340 HydrophobicContact CB-CG 4.19Å; L338-L340 HydrophobicContact CD1-CD1 4.35Å; L338-L340 PolarHBondContact O-N 2.89Å
339	G	84	Confident	87.7	Confident	48 Å²	48	52.6 Å²	52.6	50%	0.495	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	19.5	-177.1	0	0	0	0	0	114.5	L335 K336 S337 L348	L335-G339 PolarHBondContact O-N 3.01Å; K336-G339 PolarHBondContact O-N 3.22Å; S337-G339 VanDerWaalsContact C-N 3.29Å; G339-L348 WeakPolarHBondContact O-CD1 3.42Å
340	L	87.4	Confident	87.2	Confident	27 Å²	27	53.6 Å²	53.6	14%	0.141	28%	0.277	C	S	.	.	S	Bend	trans	-93.9	0.9	179.8	-62.9	171.7	0	0	0	113.4	W307 P308 L335 L338 Y353	W307-L340 HydrophobicContact CH2-CB 4.47Å; W307-L340 HydrophobicContact CH2-CD1 3.96Å; W307-L340 HydrophobicContact CH2-CD2 4.09Å; W307-L340 HydrophobicContact CH2-CG 4.41Å; W307-L340 HydrophobicContact CZ3-CD1 4.12Å; P308-L340 HydrophobicContact CB-CD1 4.41Å; P308-L340 HydrophobicContact CG-CD1 3.69Å; L335-L340 HydrophobicContact CB-CB 4.24Å; L335-L340 HydrophobicContact CD2-CB 4.39Å; L335-L340 HydrophobicContact CD2-CD1 3.76Å; L335-L340 WeakPolarHBondContact O-CB 3.32Å; L335-L340 PolarHBondContact O-N 3.28Å; L338-L340 VanDerWaalsContact C-N 3.31Å; L338-L340 HydrophobicContact CB-CD1 4.1Å; L338-L340 HydrophobicContact CB-CG 4.19Å; L338-L340 HydrophobicContact CD1-CD1 4.35Å; L338-L340 PolarHBondContact O-N 2.89Å; L340-Y353 HydrophobicContact CB-CE1 4.19Å; L340-Y353 HydrophobicContact CD2-CD1 4.06Å; L340-Y353 HydrophobicContact CD2-CE1 4.23Å; L340-Y353 VanDerWaalsContact O-CE1 3.27Å; L340-Y353 WeakPolarHBondContact O-CE1 3.37Å; L340-Y353 PolarHBondContact O-OH 3.17Å
341	V	86.9	Confident	86.6	Confident	5 Å²	5	53.4 Å²	53.4	3%	0.03	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-135.3	138.1	171.6	177.1	0	0	0	0	105.3	F265 L271 V275 L335 K336 E346	F265-V341 HydrophobicContact CE1-CG1 4.45Å; L271-V341 HydrophobicContact CD2-CG1 4.3Å; V275-V341 HydrophobicContact CG2-CG2 4.14Å; L335-V341 HydrophobicContact CB-CG2 3.92Å; K336-V341 HydrophobicContact CB-CB 4.14Å; V341-E346 WeakPolarHBondContact CG1-O 3.36Å
342	D	84.7	Confident	86.2	Confident	48 Å²	48	57.5 Å²	57.5	26%	0.257	30%	0.296	S	S	.	.			trans	-71.3	-176.4	-175.4	80.9	-1.3	0	0	0	112.9	K336 N344 N345 E346 L348	K336-D342 VanDerWaalsContact CE-O 3.25Å; K336-D342 WeakPolarHBondContact CE-O 3.21Å; D342-N344 VanDerWaalsContact C-N 3.25Å; D342-N344 PolarHBondContact O-N 3.47Å; D342-N344 VanDerWaalsContact OD1-C 3.27Å; D342-N344 VanDerWaalsContact OD1-CA 3.31Å; D342-N344 WeakPolarHBondContact OD1-CA 3.35Å; D342-N344 PolarHBondContact OD1-N 2.89Å; D342-N345 PolarHBondContact O-N 3Å; D342-N345 PolarHBondContact OD1-N 3.35Å; D342-E346 PolarHBondContact N-O 2.98Å; D342-E346 PolarHBondContact OD1-N 2.93Å; D342-L348 HydrophobicContact CB-CD2 4.01Å
343	R	84.1	Confident	85.8	Confident	229 Å²	229	58.9 Å²	58.9	86%	0.864	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-29.8	179.2	-63.3	-176.8	-176.3	-176.9	2.9	112.5	K336 N345	K336-R343 PolarHBondContact NZ-O 2.79Å; R343-N345 VanDerWaalsContact C-N 3.34Å
344	N	84.5	Confident	85.4	Confident	128 Å²	128	57.6 Å²	57.6	68%	0.684	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	5.7	-177.5	-63.1	-23.2	0	0	0	113.7	D342 E346	D342-N344 VanDerWaalsContact C-N 3.25Å; D342-N344 PolarHBondContact O-N 3.47Å; D342-N344 VanDerWaalsContact OD1-C 3.27Å; D342-N344 VanDerWaalsContact OD1-CA 3.31Å; D342-N344 WeakPolarHBondContact OD1-CA 3.35Å; D342-N344 PolarHBondContact OD1-N 2.89Å; N344-E346 VanDerWaalsContact C-N 3.3Å; N344-E346 HydrophobicContact CB-CG 4.35Å
345	N	87	Confident	84.9	Confident	46 Å²	46	56 Å²	56	25%	0.246	29%	0.293	C	S	.	.	S	Bend	trans	67.8	25.7	-175.4	-54.3	-38.6	0	0	0	113.9	Q264 F265 L271 K336 D342 R343	Q264-N345 PolarHBondContact O-ND2 2.75Å; F265-N345 HydrophobicContact CD1-CB 3.96Å; F265-N345 HydrophobicContact CE1-CB 3.77Å; F265-N345 VanDerWaalsContact CE1-CG 3.47Å; F265-N345 WeakPolarHBondContact CE1-OD1 3.26Å; L271-N345 WeakPolarHBondContact CD1-O 3.45Å; L271-N345 WeakPolarHBondContact CD2-O 3.48Å; K336-N345 WeakPolarHBondContact CD-OD1 3.4Å; K336-N345 PolarHBondContact NZ-OD1 2.95Å; D342-N345 PolarHBondContact O-N 3Å; D342-N345 PolarHBondContact OD1-N 3.35Å; R343-N345 VanDerWaalsContact C-N 3.34Å
346	E	86.6	Confident	84.3	Confident	121 Å²	121	59.6 Å²	59.6	57%	0.565	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-99.4	151.4	174.6	-57.4	-154.7	144.5	0	0	111.7	V341 D342 N344	V341-E346 WeakPolarHBondContact CG1-O 3.36Å; D342-E346 PolarHBondContact N-O 2.98Å; D342-E346 PolarHBondContact OD1-N 2.93Å; N344-E346 VanDerWaalsContact C-N 3.3Å; N344-E346 HydrophobicContact CB-CG 4.35Å
347	P	85.2	Confident	83.8	Confident	34 Å²	34	59.5 Å²	59.5	22%	0.221	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-61.3	141.7	172.2	-16.4	28.7	0	0	0	111.3	L271 K274 V275 I278 Y353	L271-P347 HydrophobicContact CD1-CG 3.9Å; K274-P347 HydrophobicContact CB-CG 3.91Å; V275-P347 HydrophobicContact CG2-CB 3.94Å; V275-P347 HydrophobicContact CG2-CG 4.14Å; I278-P347 HydrophobicContact CD1-CB 3.6Å; I278-P347 HydrophobicContact CD1-CG 3.97Å; P347-Y353 WeakPolarHBondContact CA-OH 3.37Å
348	L	86.3	Confident	83.4	Confident	24 Å²	24	55.5 Å²	55.5	13%	0.126	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-64.7	166.3	166.1	-55.3	177.7	0	0	0	111.5	I278 G339 D342 M352 Y353	I278-L348 WeakPolarHBondContact CG2-O 3.2Å; G339-L348 WeakPolarHBondContact O-CD1 3.42Å; D342-L348 HydrophobicContact CB-CD2 4.01Å; L348-M352 HydrophobicContact CB-CB 3.93Å; L348-M352 HydrophobicContact CB-SD 4.45Å; L348-M352 HydrophobicContact CD1-CB 4.18Å; L348-M352 HydrophobicContact CD1-CE 4.45Å; L348-M352 HydrophobicContact CD2-CE 4.25Å; L348-M352 HydrophobicContact CD2-SD 4.17Å; L348-Y353 HydrophobicContact CB-CD1 4.47Å; L348-Y353 HydrophobicContact CB-CD2 4.32Å; L348-Y353 HydrophobicContact CB-CE1 4.02Å; L348-Y353 HydrophobicContact CB-CE2 3.88Å; L348-Y353 HydrophobicContact CD1-CD1 4.37Å; L348-Y353 HydrophobicContact CD1-CE1 4.07Å; L348-Y353 HydrophobicContact CG-CE1 4.23Å; L348-Y353 PolarHBondContact N-OH 2.86Å; L348-Y353 WeakPolarHBondContact O-CE2 3.43Å
349	T	83.3	Confident	83.1	Confident	52 Å²	52	58.6 Å²	58.6	32%	0.319	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-69.6	155.3	171	64.3	0	0	0	0	111.2	A351 M352 Y353	T349-A351 PolarHBondContact O-N 3.37Å; T349-M352 PolarHBondContact O-N 3.24Å; T349-M352 WeakPolarHBondContact OG1-CG 3.34Å; T349-M352 PolarHBondContact OG1-N 3.09Å; T349-Y353 WeakPolarHBondContact O-CD2 3.32Å; T349-Y353 PolarHBondContact O-N 2.87Å; T349-Y353 VanDerWaalsContact O-N 3.16Å
350	H	81.7	Confident	82.9	Confident	22 Å²	22	62.4 Å²	62.4	10%	0.102	31%	0.313	C	S	.	.	H	α-helix	trans	-56.3	-35.5	177.9	175.9	-64.7	0	0	0	112.2	I278 S281 Y353 N354 G1062 F1064	I278-H350 HydrophobicContact CG2-CB 3.99Å; I278-H350 WeakPolarHBondContact O-CB 3.26Å; I278-H350 PolarHBondContact O-CD2 3.01Å; S281-H350 PolarHBondContact OG-CD2 2.93Å; S281-H350 PolarHBondContact OG-NE2 3.41Å; H350-Y353 PolarHBondContact O-N 2.93Å; H350-N354 PolarHBondContact CE1-ND2 3.14Å; H350-N354 VanDerWaalsContact CE1-ND2 3.29Å; H350-N354 PolarHBondContact ND1-ND2 2.84Å; H350-N354 PolarHBondContact O-N 2.83Å; H350-N354 VanDerWaalsContact O-N 3.15Å; H350-N354 PolarHBondContact O-ND2 3.49Å; H350-G1062 CarbonylContact C-O 3.53Å; H350-G1062 PolarHBondContact N-O 3.44Å; H350-F1064 PolarHBondContact CE1-O 3.33Å; H350-F1064 PolarHBondContact ND1-N 3.2Å
351	A	80.6	Confident	82.5	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61.7	-45.2	175.1	0	0	0	0	0	111.6	F230 T349 Y353 N354 L355 L358 V1058 G1062 F1064	F230-A351 HydrophobicContact CE1-CB 3.71Å; F230-A351 HydrophobicContact CE2-CB 4.32Å; F230-A351 HydrophobicContact CZ-CB 3.58Å; T349-A351 PolarHBondContact O-N 3.37Å; A351-Y353 VanDerWaalsContact C-N 3.35Å; A351-Y353 PolarHBondContact O-N 2.81Å; A351-N354 CarbonylContact O-C 3.19Å; A351-N354 VanDerWaalsContact O-C 3.27Å; A351-N354 PolarHBondContact O-N 2.92Å; A351-N354 VanDerWaalsContact O-N 3.08Å; A351-L355 PolarHBondContact O-N 2.9Å; A351-L355 VanDerWaalsContact O-N 3.11Å; A351-L358 HydrophobicContact CB-CD1 3.83Å; A351-L358 WeakPolarHBondContact O-CD1 3.44Å; A351-V1058 HydrophobicContact CB-CG1 3.75Å; A351-V1058 HydrophobicContact CB-CG2 4.33Å; A351-G1062 VanDerWaalsContact CB-O 3.24Å; A351-G1062 WeakPolarHBondContact CB-O 3.34Å; A351-G1062 PolarHBondContact N-O 3.31Å; A351-F1064 HydrophobicContact CB-CB 4.32Å
352	M	82.1	Confident	82.1	Confident	86 Å²	86	62.1 Å²	62.1	42%	0.424	31%	0.312	S	S	.	.	H	α-helix	trans	-65.2	-35.7	177.6	-71.4	-168.2	75.4	0	0	113.1	L348 T349 N354 L355	L348-M352 HydrophobicContact CB-CB 3.93Å; L348-M352 HydrophobicContact CB-SD 4.45Å; L348-M352 HydrophobicContact CD1-CB 4.18Å; L348-M352 HydrophobicContact CD1-CE 4.45Å; L348-M352 HydrophobicContact CD2-CE 4.25Å; L348-M352 HydrophobicContact CD2-SD 4.17Å; T349-M352 PolarHBondContact O-N 3.24Å; T349-M352 WeakPolarHBondContact OG1-CG 3.34Å; T349-M352 PolarHBondContact OG1-N 3.09Å; M352-N354 VanDerWaalsContact C-N 3.26Å; M352-N354 PolarHBondContact O-N 3.38Å; M352-L355 WeakPolarHBondContact O-CB 3.36Å; M352-L355 PolarHBondContact O-N 2.63Å
353	Y	83.9	Confident	81.7	Confident	29 Å²	29	65.1 Å²	65.1	11%	0.114	32%	0.324	C	S	.	.	H	α-helix	trans	-67.2	-27.5	172.6	-68.4	-59.5	0	0	0	113.4	V275 I278 A279 W307 L340 P347 L348 T349 H350 A351	V275-Y353 HydrophobicContact CG1-CE1 4.13Å; V275-Y353 WeakPolarHBondContact CG1-OH 3.39Å; I278-Y353 HydrophobicContact CB-CE2 4.17Å; I278-Y353 HydrophobicContact CG2-CD2 3.98Å; I278-Y353 HydrophobicContact CG2-CE2 3.84Å; A279-Y353 VanDerWaalsContact CA-CD2 3.49Å; A279-Y353 HydrophobicContact CB-CD1 3.94Å; A279-Y353 HydrophobicContact CB-CD2 3.61Å; A279-Y353 HydrophobicContact CB-CE1 4.43Å; A279-Y353 HydrophobicContact CB-CE2 4.11Å; A279-Y353 HydrophobicContact CB-CG 3.51Å; W307-Y353 AromaticContact CH2-CD1 3.69Å; W307-Y353 HydrophobicContact CH2-CD1 3.69Å; W307-Y353 AromaticContact CH2-CE1 3.8Å; W307-Y353 HydrophobicContact CH2-CE1 3.8Å; W307-Y353 HydrophobicContact CZ2-CD1 4.01Å; L340-Y353 HydrophobicContact CB-CE1 4.19Å; L340-Y353 HydrophobicContact CD2-CD1 4.06Å; L340-Y353 HydrophobicContact CD2-CE1 4.23Å; L340-Y353 VanDerWaalsContact O-CE1 3.27Å; L340-Y353 WeakPolarHBondContact O-CE1 3.37Å; L340-Y353 PolarHBondContact O-OH 3.17Å; P347-Y353 WeakPolarHBondContact CA-OH 3.37Å; L348-Y353 HydrophobicContact CB-CD1 4.47Å; L348-Y353 HydrophobicContact CB-CD2 4.32Å; L348-Y353 HydrophobicContact CB-CE1 4.02Å; L348-Y353 HydrophobicContact CB-CE2 3.88Å; L348-Y353 HydrophobicContact CD1-CD1 4.37Å; L348-Y353 HydrophobicContact CD1-CE1 4.07Å; L348-Y353 HydrophobicContact CG-CE1 4.23Å; L348-Y353 PolarHBondContact N-OH 2.86Å; L348-Y353 WeakPolarHBondContact O-CE2 3.43Å; T349-Y353 WeakPolarHBondContact O-CD2 3.32Å; T349-Y353 PolarHBondContact O-N 2.87Å; T349-Y353 VanDerWaalsContact O-N 3.16Å; H350-Y353 PolarHBondContact O-N 2.93Å; A351-Y353 VanDerWaalsContact C-N 3.35Å; A351-Y353 PolarHBondContact O-N 2.81Å
354	N	81.9	Confident	81.3	Confident	42 Å²	42	56.9 Å²	56.9	23%	0.225	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	27.7	-179.2	-68.2	-90.4	0	0	0	112	A279 H350 A351 M352 A356 S357 L358 F1064	A279-N354 PolarHBondContact O-ND2 3.1Å; H350-N354 PolarHBondContact CE1-ND2 3.14Å; H350-N354 VanDerWaalsContact CE1-ND2 3.29Å; H350-N354 PolarHBondContact ND1-ND2 2.84Å; H350-N354 PolarHBondContact O-N 2.83Å; H350-N354 VanDerWaalsContact O-N 3.15Å; H350-N354 PolarHBondContact O-ND2 3.49Å; A351-N354 CarbonylContact O-C 3.19Å; A351-N354 VanDerWaalsContact O-C 3.27Å; A351-N354 PolarHBondContact O-N 2.92Å; A351-N354 VanDerWaalsContact O-N 3.08Å; M352-N354 VanDerWaalsContact C-N 3.26Å; M352-N354 PolarHBondContact O-N 3.38Å; N354-A356 VanDerWaalsContact C-N 3.29Å; N354-A356 PolarHBondContact O-N 3Å; N354-S357 PolarHBondContact O-N 3.04Å; N354-L358 PolarHBondContact O-N 3.28Å; N354-F1064 HydrophobicContact CB-CD1 3.76Å; N354-F1064 HydrophobicContact CB-CE1 4.42Å
355	L	80.1	Confident	80.9	Confident	34 Å²	34	51.2 Å²	51.2	18%	0.178	27%	0.269	C	S	.	.	H	α-helix	trans	-65.2	-30.1	-173.1	-165.3	127.7	0	0	0	113.2	A351 M352 L358 R359	A351-L355 PolarHBondContact O-N 2.9Å; A351-L355 VanDerWaalsContact O-N 3.11Å; M352-L355 WeakPolarHBondContact O-CB 3.36Å; M352-L355 PolarHBondContact O-N 2.63Å; L355-L358 PolarHBondContact O-N 3.32Å; L355-R359 HydrophobicContact CD2-CG 4.45Å; L355-R359 VanDerWaalsContact CD2-CZ 3.41Å; L355-R359 VanDerWaalsContact CD2-NE 3.31Å; L355-R359 WeakPolarHBondContact O-CG 3.3Å; L355-R359 PolarHBondContact O-N 3.37Å
356	A	77.3	Confident	80.3	Confident	76 Å²	76	55.6 Å²	55.6	63%	0.628	28%	0.282	S	S	*	.	H	α-helix	trans	-63.2	-51	172.9	0	0	0	0	0	111.4	N354 L358 R359 E360	N354-A356 VanDerWaalsContact C-N 3.29Å; N354-A356 PolarHBondContact O-N 3Å; A356-L358 VanDerWaalsContact C-N 3.3Å; A356-L358 PolarHBondContact O-N 2.99Å; A356-R359 PolarHBondContact O-N 2.93Å; A356-R359 VanDerWaalsContact O-N 3.15Å; A356-E360 PolarHBondContact O-N 3.41Å
357	S	77.7	Confident	79.9	Confident	53 Å²	53	57.8 Å²	57.8	37%	0.371	29%	0.285	S	S	.	.	H	α-helix	trans	-63.4	-35.4	176	-51.1	0	0	0	0	112.4	N354 L361	N354-S357 PolarHBondContact O-N 3.04Å; S357-L361 WeakPolarHBondContact O-CB 3.08Å; S357-L361 PolarHBondContact O-N 3.42Å
358	L	79.5	Confident	79.8	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.6	-45.2	172.1	-81.4	165.6	0	0	0	111.8	V227 F230 L231 A351 N354 L355 A356 L361 G362 V1058 F1064	V227-L358 HydrophobicContact CB-CD2 4.1Å; V227-L358 HydrophobicContact CG1-CB 4.28Å; V227-L358 HydrophobicContact CG1-CD2 3.59Å; V227-L358 WeakPolarHBondContact CG1-O 3.46Å; V227-L358 HydrophobicContact CG2-CD2 3.68Å; F230-L358 HydrophobicContact CD1-CD1 4.1Å; F230-L358 HydrophobicContact CE1-CD1 4.03Å; L231-L358 HydrophobicContact CD2-CB 4.25Å; A351-L358 HydrophobicContact CB-CD1 3.83Å; A351-L358 WeakPolarHBondContact O-CD1 3.44Å; N354-L358 PolarHBondContact O-N 3.28Å; L355-L358 PolarHBondContact O-N 3.32Å; A356-L358 VanDerWaalsContact C-N 3.3Å; A356-L358 PolarHBondContact O-N 2.99Å; L358-L361 PolarHBondContact O-N 2.98Å; L358-G362 PolarHBondContact O-N 3.42Å; L358-V1058 HydrophobicContact CD1-CG2 4.43Å; L358-V1058 HydrophobicContact CD2-CG2 3.7Å; L358-F1064 HydrophobicContact CD1-CG 4.48Å; L358-F1064 HydrophobicContact CD2-CD1 4.45Å; L358-F1064 HydrophobicContact CD2-CD2 3.31Å; L358-F1064 HydrophobicContact CD2-CE1 4.48Å; L358-F1064 HydrophobicContact CD2-CE2 3.35Å; L358-F1064 HydrophobicContact CD2-CG 3.89Å; L358-F1064 HydrophobicContact CD2-CZ 3.95Å; L358-F1064 HydrophobicContact CG-CD1 4.21Å; L358-F1064 HydrophobicContact CG-CD2 3.95Å; L358-F1064 HydrophobicContact CG-CE1 4.28Å; L358-F1064 HydrophobicContact CG-CE2 4.03Å; L358-F1064 HydrophobicContact CG-CG 4.03Å; L358-F1064 HydrophobicContact CG-CZ 4.18Å
359	R	80.3	Confident	79.7	Confident	126 Å²	126	58 Å²	58	48%	0.475	29%	0.288	S	S	.	.	H	α-helix	trans	-63.2	-47.8	177.5	-77.4	179.8	-176.3	171.7	2.5	111.5	L231 L355 A356 L361 G362 E363	L231-R359 HydrophobicContact CD2-CG 3.77Å; L355-R359 HydrophobicContact CD2-CG 4.45Å; L355-R359 VanDerWaalsContact CD2-CZ 3.41Å; L355-R359 VanDerWaalsContact CD2-NE 3.31Å; L355-R359 WeakPolarHBondContact O-CG 3.3Å; L355-R359 PolarHBondContact O-N 3.37Å; A356-R359 PolarHBondContact O-N 2.93Å; A356-R359 VanDerWaalsContact O-N 3.15Å; R359-L361 VanDerWaalsContact C-N 3.34Å; R359-L361 PolarHBondContact O-N 3.21Å; R359-G362 PolarHBondContact O-N 2.95Å; R359-E363 WeakPolarHBondContact O-CB 3.47Å; R359-E363 WeakPolarHBondContact O-CG 3.34Å; R359-E363 PolarHBondContact O-N 2.92Å
360	E	79.4	Confident	79.7	Confident	129 Å²	129	59 Å²	59	60%	0.603	29%	0.294	S	S	*	.	H	α-helix	trans	-59.2	-44.8	177.3	-178.4	176.8	-161.4	0	0	111.7	A356 E363 T364	A356-E360 PolarHBondContact O-N 3.41Å; E360-E363 PolarHBondContact O-N 3.32Å; E360-T364 WeakPolarHBondContact O-CB 3.36Å; E360-T364 PolarHBondContact O-N 2.94Å; E360-T364 PolarHBondContact O-OG1 3.49Å
361	L	78.6	Confident	79.9	Confident	24 Å²	24	58.9 Å²	58.9	13%	0.126	29%	0.294	C	S	.	.	H	α-helix	trans	-64.4	-45.6	176	-172.8	58.9	0	0	0	111	V227 S357 L358 R359 E363 T364 Q365 Q1055 F1064	V227-L361 HydrophobicContact CG2-CD2 4.17Å; S357-L361 WeakPolarHBondContact O-CB 3.08Å; S357-L361 PolarHBondContact O-N 3.42Å; L358-L361 PolarHBondContact O-N 2.98Å; R359-L361 VanDerWaalsContact C-N 3.34Å; R359-L361 PolarHBondContact O-N 3.21Å; L361-E363 VanDerWaalsContact C-N 3.33Å; L361-E363 PolarHBondContact O-N 3.05Å; L361-T364 PolarHBondContact O-N 2.69Å; L361-Q365 VanDerWaalsContact O-CG 3.29Å; L361-Q365 WeakPolarHBondContact O-CG 3.33Å; L361-Q365 PolarHBondContact O-N 3.37Å; L361-Q1055 HydrophobicContact CD1-CB 4.21Å; L361-Q1055 WeakPolarHBondContact CD2-O 3.3Å; L361-F1064 HydrophobicContact CD2-CE2 3.9Å; L361-F1064 HydrophobicContact CD2-CZ 3.78Å
362	G	78.3	Confident	79.9	Confident	2 Å²	2	66.8 Å²	66.8	2%	0.021	33%	0.331	C	S	.	.	H	α-helix	trans	-60.7	-38.4	176.6	0	0	0	0	0	113.4	L358 R359 R366	L358-G362 PolarHBondContact O-N 3.42Å; R359-G362 PolarHBondContact O-N 2.95Å; G362-R366 VanDerWaalsContact O-CG 3.31Å; G362-R366 WeakPolarHBondContact O-CG 3.46Å; G362-R366 PolarHBondContact O-N 3.01Å
363	E	77.1	Confident	80.2	Confident	111 Å²	111	63.5 Å²	63.5	52%	0.519	32%	0.316	S	S	.	.	H	α-helix	trans	-66.5	-45.2	172.9	-75.5	175.9	-166.8	0	0	111.4	R359 E360 L361 Q365 R366 R367	R359-E363 WeakPolarHBondContact O-CB 3.47Å; R359-E363 WeakPolarHBondContact O-CG 3.34Å; R359-E363 PolarHBondContact O-N 2.92Å; E360-E363 PolarHBondContact O-N 3.32Å; L361-E363 VanDerWaalsContact C-N 3.33Å; L361-E363 PolarHBondContact O-N 3.05Å; E363-Q365 VanDerWaalsContact C-N 3.29Å; E363-Q365 PolarHBondContact O-N 2.79Å; E363-R366 PolarHBondContact O-N 3.49Å; E363-R367 WeakPolarHBondContact O-CG 3.37Å; E363-R367 PolarHBondContact O-N 3.33Å
364	T	76.1	Confident	80.5	Confident	55 Å²	55	65 Å²	65	34%	0.337	33%	0.329	S	S	.	.	H	α-helix	trans	-61.4	-36.8	177.1	-56.4	0	0	0	0	112	E360 L361 R366 R367	E360-T364 WeakPolarHBondContact O-CB 3.36Å; E360-T364 PolarHBondContact O-N 2.94Å; E360-T364 PolarHBondContact O-OG1 3.49Å; L361-T364 PolarHBondContact O-N 2.69Å; T364-R366 VanDerWaalsContact C-N 3.31Å; T364-R366 PolarHBondContact O-N 3.41Å; T364-R367 PolarHBondContact O-N 2.89Å
365	Q	75.7	Confident	81	Confident	9 Å²	9	66.2 Å²	66.2	4%	0.042	33%	0.333	C	S	.	.	H	α-helix	trans	-70.6	-25.1	174.3	-66	-55.8	-40.1	0	0	113.2	L361 E363 R1054	L361-Q365 VanDerWaalsContact O-CG 3.29Å; L361-Q365 WeakPolarHBondContact O-CG 3.33Å; L361-Q365 PolarHBondContact O-N 3.37Å; E363-Q365 VanDerWaalsContact C-N 3.29Å; E363-Q365 PolarHBondContact O-N 2.79Å; Q365-R1054 HydrophobicContact CG-CB 4.47Å
366	R	75.1	Confident	81.7	Confident	139 Å²	139	68.7 Å²	68.7	53%	0.525	35%	0.351	S	S	.	.	H	α-helix	trans	-84.8	-20.4	177.4	-74.3	173.5	179.6	-177.7	0.9	113.2	G362 E363 T364	G362-R366 VanDerWaalsContact O-CG 3.31Å; G362-R366 WeakPolarHBondContact O-CG 3.46Å; G362-R366 PolarHBondContact O-N 3.01Å; E363-R366 PolarHBondContact O-N 3.49Å; T364-R366 VanDerWaalsContact C-N 3.31Å; T364-R366 PolarHBondContact O-N 3.41Å
367	R	77.6	Confident	82.4	Confident	166 Å²	166	65.7 Å²	65.7	63%	0.626	33%	0.325	S	S	*	.	S	Bend	trans	-64.4	136.3	177.3	-74.4	-179	-172.8	-174.8	4.7	110.3	E363 T364	E363-R367 WeakPolarHBondContact O-CG 3.37Å; E363-R367 PolarHBondContact O-N 3.33Å; T364-R367 PolarHBondContact O-N 2.89Å
368	P	82.7	Confident	83.2	Confident	34 Å²	34	63.3 Å²	63.3	22%	0.221	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-57.6	148.4	173.6	-20.9	32.3	0	0	0	111.4	T1140 R1150 E1152	P368-T1140 HydrophobicContact CG-CG2 3.99Å; P368-R1150 WeakPolarHBondContact CA-O 3.28Å; P368-R1150 HydrophobicContact CB-CB 4.26Å; P368-E1152 HydrophobicContact CB-CB 3.76Å; P368-E1152 HydrophobicContact CB-CG 3.89Å; P368-E1152 HydrophobicContact CG-CB 4.42Å
369	C	83.8	Confident	84	Confident	28 Å²	28	70.9 Å²	70.9	19%	0.189	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	123.2	173.1	-174.7	0	0	0	0	109.8	I371 W1096 R1150 L1151 E1152	C369-I371 PolarHBondContact O-N 3.18Å; C369-W1096 HydrophobicContact CB-CH2 3.93Å; C369-R1150 PolarHBondContact N-O 3.32Å; C369-L1151 HydrophobicContact CB-CD2 3.77Å; C369-L1151 CarbonylContact O-C 3.6Å; C369-L1151 VanDerWaalsContact O-CA 3.24Å; C369-L1151 WeakPolarHBondContact O-CA 3.33Å; C369-E1152 PolarHBondContact O-N 3.41Å
370	T	84.9	Confident	84.8	Confident	74 Å²	74	69.4 Å²	69.4	45%	0.454	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	125.3	177.2	-39.7	0	0	0	0	110.8	E1152	T370-E1152 CarbonylContact C-O 3.47Å; T370-E1152 WeakPolarHBondContact CA-O 3.24Å; T370-E1152 HydrophobicContact CG2-CG 4.3Å; T370-E1152 PolarHBondContact OG1-OE1 2.79Å
371	I	84.4	Confident	85.6	Confident	20 Å²	20	63.2 Å²	63.2	10%	0.103	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-92.8	135.1	172.1	-48.4	175.8	0	0	0	108.1	C369 V373 L1120 L1123 L1151 E1152 L1161	C369-I371 PolarHBondContact O-N 3.18Å; I371-V373 HydrophobicContact CG2-CG2 3.89Å; I371-L1120 HydrophobicContact CD1-CD2 3.91Å; I371-L1120 HydrophobicContact CG2-CD1 4.4Å; I371-L1120 HydrophobicContact CG2-CD2 3.84Å; I371-L1120 HydrophobicContact CG2-CG 4.39Å; I371-L1123 HydrophobicContact CD1-CD2 4.44Å; I371-L1151 HydrophobicContact CD1-CB 3.5Å; I371-L1151 HydrophobicContact CD1-CD1 3.46Å; I371-L1151 VanDerWaalsContact CD1-CD1 3.46Å; I371-L1151 HydrophobicContact CD1-CG 4.05Å; I371-L1151 HydrophobicContact CG1-CB 3.66Å; I371-L1151 HydrophobicContact CG1-CD1 3.95Å; I371-L1151 HydrophobicContact CG1-CD2 4.39Å; I371-L1151 HydrophobicContact CG1-CG 4.21Å; I371-E1152 PolarHBondContact N-O 2.8Å; I371-L1161 HydrophobicContact CD1-CD1 4.01Å
372	Q	81	Confident	86.4	Confident	165 Å²	165	66 Å²	66	77%	0.771	32%	0.317	S	S	*	.			trans	-121.8	115.4	166.4	-65.9	-175.6	-3.5	0	0	108.7
373	V	88.7	Confident	87.3	Confident	17 Å²	17	68.6 Å²	68.6	10%	0.103	34%	0.338	C	S	.	.			trans	-103.8	126.8	172.1	-175.7	0	0	0	0	107.8	I371 E375 I377 L378 L1120 T1157 L1161 L1201	I371-V373 HydrophobicContact CG2-CG2 3.89Å; V373-E375 PolarHBondContact O-N 3.47Å; V373-I377 HydrophobicContact CG1-CB 4.22Å; V373-I377 HydrophobicContact CG1-CG2 4.25Å; V373-L378 HydrophobicContact CB-CD1 4.24Å; V373-L378 HydrophobicContact CB-CD2 3.84Å; V373-L378 HydrophobicContact CB-CG 3.9Å; V373-L378 HydrophobicContact CG1-CD2 3.7Å; V373-L378 HydrophobicContact CG1-CG 3.7Å; V373-L378 HydrophobicContact CG2-CD2 4.43Å; V373-L1120 HydrophobicContact CG2-CD1 4.38Å; V373-T1157 HydrophobicContact CB-CG2 4.34Å; V373-T1157 HydrophobicContact CG2-CG2 3.92Å; V373-L1161 HydrophobicContact CG2-CD1 4.42Å; V373-L1201 HydrophobicContact CB-CD1 4.41Å; V373-L1201 HydrophobicContact CG1-CD1 3.49Å; V373-L1201 VanDerWaalsContact CG1-CD1 3.49Å; V373-L1201 HydrophobicContact CG2-CD1 4.04Å
374	P	90.1	Very high	88.3	Confident	60 Å²	60	63.7 Å²	63.7	39%	0.39	32%	0.315	S	S	.	.			trans	-55	131.9	175.2	-26.4	34.3	0	0	0	112.1	P376 I377 L378	P374-P376 VanDerWaalsContact C-N 3.32Å; P374-I377 HydrophobicContact CB-CD1 4.25Å; P374-I377 HydrophobicContact CB-CG1 4.37Å; P374-I377 HydrophobicContact CG-CD1 4.09Å; P374-I377 WeakPolarHBondContact O-CB 3.3Å; P374-I377 PolarHBondContact O-N 3.11Å; P374-L378 PolarHBondContact O-N 3.36Å
375	E	93.1	Very high	89.2	Confident	68 Å²	68	61.6 Å²	61.6	32%	0.318	30%	0.302	S	S	.	.	H	α-helix	trans	-52.2	-38.2	-179.2	-179	59.4	-155.2	0	0	114.4	V373 I377 L378 R379 R1156	V373-E375 PolarHBondContact O-N 3.47Å; E375-I377 VanDerWaalsContact C-N 3.28Å; E375-I377 PolarHBondContact O-N 3.44Å; E375-L378 PolarHBondContact O-N 3.44Å; E375-R379 WeakPolarHBondContact O-CG 3.39Å; E375-R379 PolarHBondContact O-N 2.91Å; E375-R379 WeakPolarHBondContact OE1-CG 3.35Å; E375-R379 IonicContact OE1-CZ 3.99Å; E375-R379 IonicContact OE1-NE 3.11Å; E375-R379 PolarHBondContact OE1-NE 3.45Å; E375-R379 VanDerWaalsContact OE1-NE 3.11Å; E375-R379 IonicContact OE1-NH2 3.99Å; E375-R1156 VanDerWaalsContact CD-NH1 3.29Å; E375-R1156 IonicContact OE1-CZ 3.18Å; E375-R1156 IonicContact OE1-NH1 3Å; E375-R1156 PolarHBondContact OE1-NH1 3.29Å; E375-R1156 IonicContact OE1-NH2 3.05Å; E375-R1156 PolarHBondContact OE1-NH2 2.9Å; E375-R1156 VanDerWaalsContact OE1-NH2 3.11Å; E375-R1156 IonicContact OE2-CZ 3.11Å; E375-R1156 IonicContact OE2-NH1 2.98Å; E375-R1156 PolarHBondContact OE2-NH1 3.14Å
376	P	93.6	Very high	90.1	Very high	86 Å²	86	65.6 Å²	65.6	56%	0.558	33%	0.331	S	S	*	.	H	α-helix	trans	-59.3	-36.5	175	-25.4	35.7	0	0	0	113.6	P374 K380	P374-P376 VanDerWaalsContact C-N 3.32Å; P376-K380 WeakPolarHBondContact O-CG 3.44Å; P376-K380 PolarHBondContact O-N 3.4Å
377	I	93.5	Very high	91	Very high	13 Å²	13	65.5 Å²	65.5	7%	0.067	34%	0.336	C	S	.	.	H	α-helix	trans	-73.4	-42.3	178.6	-59	176.4	0	0	0	109.8	V373 P374 E375 R379 K380 I381 E1200 L1201	V373-I377 HydrophobicContact CG1-CB 4.22Å; V373-I377 HydrophobicContact CG1-CG2 4.25Å; P374-I377 HydrophobicContact CB-CD1 4.25Å; P374-I377 HydrophobicContact CB-CG1 4.37Å; P374-I377 HydrophobicContact CG-CD1 4.09Å; P374-I377 WeakPolarHBondContact O-CB 3.3Å; P374-I377 PolarHBondContact O-N 3.11Å; E375-I377 VanDerWaalsContact C-N 3.28Å; E375-I377 PolarHBondContact O-N 3.44Å; I377-R379 VanDerWaalsContact C-N 3.31Å; I377-R379 PolarHBondContact O-N 3Å; I377-K380 WeakPolarHBondContact O-CB 3.23Å; I377-K380 PolarHBondContact O-N 3.33Å; I377-K380 VanDerWaalsContact O-N 3.13Å; I377-I381 HydrophobicContact CG2-CD1 4.04Å; I377-I381 HydrophobicContact CG2-CG1 4.47Å; I377-I381 WeakPolarHBondContact O-CG1 3.25Å; I377-I381 PolarHBondContact O-N 3.19Å; I377-E1200 HydrophobicContact CD1-CG 4.03Å; I377-E1200 HydrophobicContact CG1-CG 4.21Å; I377-L1201 HydrophobicContact CG2-CB 4.37Å; I377-L1201 HydrophobicContact CG2-CD1 4.05Å
378	L	94	Very high	91.7	Very high	4 Å²	4	60 Å²	60	2%	0.021	32%	0.315	C	S	.	.	H	α-helix	trans	-57.3	-43.4	175.5	-71.9	175.4	0	0	0	112.1	V373 P374 E375 K380 I381 E382 T1157 L1160	V373-L378 HydrophobicContact CB-CD1 4.24Å; V373-L378 HydrophobicContact CB-CD2 3.84Å; V373-L378 HydrophobicContact CB-CG 3.9Å; V373-L378 HydrophobicContact CG1-CD2 3.7Å; V373-L378 HydrophobicContact CG1-CG 3.7Å; V373-L378 HydrophobicContact CG2-CD2 4.43Å; P374-L378 PolarHBondContact O-N 3.36Å; E375-L378 PolarHBondContact O-N 3.44Å; L378-K380 VanDerWaalsContact C-N 3.34Å; L378-K380 PolarHBondContact O-N 2.85Å; L378-I381 PolarHBondContact O-N 3.2Å; L378-E382 WeakPolarHBondContact O-CB 3.39Å; L378-E382 PolarHBondContact O-N 3.06Å; L378-T1157 WeakPolarHBondContact CD1-OG1 3.45Å; L378-T1157 HydrophobicContact CD2-CG2 4.2Å; L378-L1160 HydrophobicContact CB-CD1 4.34Å; L378-L1160 HydrophobicContact CD2-CD1 4.11Å
379	R	96.6	Very high	91.8	Very high	159 Å²	159	62.6 Å²	62.6	60%	0.6	33%	0.332	S	S	*	.	H	α-helix	trans	-63.3	-38.5	176.3	-70.3	-179	-170.9	-179.2	0.2	112.7	E375 I377 E382 A383	E375-R379 WeakPolarHBondContact O-CG 3.39Å; E375-R379 PolarHBondContact O-N 2.91Å; E375-R379 WeakPolarHBondContact OE1-CG 3.35Å; E375-R379 IonicContact OE1-CZ 3.99Å; E375-R379 IonicContact OE1-NE 3.11Å; E375-R379 PolarHBondContact OE1-NE 3.45Å; E375-R379 VanDerWaalsContact OE1-NE 3.11Å; E375-R379 IonicContact OE1-NH2 3.99Å; I377-R379 VanDerWaalsContact C-N 3.31Å; I377-R379 PolarHBondContact O-N 3Å; R379-E382 PolarHBondContact O-N 3.37Å; R379-A383 VanDerWaalsContact O-CB 3.29Å; R379-A383 WeakPolarHBondContact O-CB 2.96Å; R379-A383 PolarHBondContact O-N 3.31Å
380	K	96.8	Very high	91.7	Very high	94 Å²	94	62.5 Å²	62.5	41%	0.409	33%	0.331	S	S	.	.	H	α-helix	trans	-66.1	-41.6	175.3	-70.5	173.5	174.4	179.3	0	111.8	P376 I377 L378 A383 F384 L1197 E1200	P376-K380 WeakPolarHBondContact O-CG 3.44Å; P376-K380 PolarHBondContact O-N 3.4Å; I377-K380 WeakPolarHBondContact O-CB 3.23Å; I377-K380 PolarHBondContact O-N 3.33Å; I377-K380 VanDerWaalsContact O-N 3.13Å; L378-K380 VanDerWaalsContact C-N 3.34Å; L378-K380 PolarHBondContact O-N 2.85Å; K380-A383 PolarHBondContact O-N 2.81Å; K380-F384 WeakPolarHBondContact O-CB 3.34Å; K380-F384 PolarHBondContact O-N 3.33Å; K380-L1197 HydrophobicContact CB-CD2 3.52Å; K380-L1197 HydrophobicContact CD-CD2 4.02Å; K380-L1197 HydrophobicContact CG-CD2 4.38Å; K380-E1200 IonicContact NZ-OE1 3.55Å; K380-E1200 PolarHBondContact NZ-OE1 3.26Å; K380-E1200 IonicContact NZ-OE2 2.74Å; K380-E1200 PolarHBondContact NZ-OE2 3.37Å
381	I	96.1	Very high	91	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-61.6	-47.4	174.6	-69	170	0	0	0	110.3	I377 L378 A383 F384 L385 L1160 F1164 L1201	I377-I381 HydrophobicContact CG2-CD1 4.04Å; I377-I381 HydrophobicContact CG2-CG1 4.47Å; I377-I381 WeakPolarHBondContact O-CG1 3.25Å; I377-I381 PolarHBondContact O-N 3.19Å; L378-I381 PolarHBondContact O-N 3.2Å; I381-A383 PolarHBondContact O-N 3.12Å; I381-F384 PolarHBondContact O-N 2.93Å; I381-L385 HydrophobicContact CG2-CD1 3.71Å; I381-L385 HydrophobicContact CG2-CG 4.29Å; I381-L385 WeakPolarHBondContact O-CB 3.16Å; I381-L385 VanDerWaalsContact O-CG 3.29Å; I381-L385 WeakPolarHBondContact O-CG 3.26Å; I381-L385 PolarHBondContact O-N 3.34Å; I381-L1160 HydrophobicContact CG2-CB 4.4Å; I381-F1164 HydrophobicContact CG1-CD2 4.2Å; I381-F1164 HydrophobicContact CG1-CE2 4.19Å; I381-F1164 HydrophobicContact CG2-CB 4.14Å; I381-F1164 HydrophobicContact CG2-CD2 3.82Å; I381-F1164 HydrophobicContact CG2-CG 4.22Å; I381-L1201 HydrophobicContact CD1-CD1 4.5Å; I381-L1201 HydrophobicContact CD1-CD2 4.35Å
382	E	96.3	Very high	89.6	Confident	82 Å²	82	67.4 Å²	67.4	38%	0.383	36%	0.363	S	S	.	.	H	α-helix	trans	-61.5	-43.3	177.8	-173.7	166.7	-147.4	0	0	111.6	L378 R379 L385 S386 R1156 L1160	L378-E382 WeakPolarHBondContact O-CB 3.39Å; L378-E382 PolarHBondContact O-N 3.06Å; R379-E382 PolarHBondContact O-N 3.37Å; E382-L385 PolarHBondContact O-N 2.95Å; E382-S386 WeakPolarHBondContact O-CB 3.33Å; E382-S386 PolarHBondContact O-N 3.36Å; E382-R1156 IonicContact OE1-NE 3.49Å; E382-R1156 IonicContact OE2-CZ 2.83Å; E382-R1156 IonicContact OE2-NE 2.66Å; E382-R1156 IonicContact OE2-NH2 3.52Å; E382-R1156 PolarHBondContact OE2-NH2 3.15Å; E382-L1160 HydrophobicContact CB-CD1 4.28Å; E382-L1160 HydrophobicContact CB-CD2 3.9Å; E382-L1160 HydrophobicContact CG-CD2 4.13Å
383	A	97.1	Very high	87.9	Confident	56 Å²	56	63.1 Å²	63.1	46%	0.463	35%	0.351	S	S	.	.	H	α-helix	trans	-61.4	-45.9	174	0	0	0	0	0	111.8	R379 K380 I381 S386 H387	R379-A383 VanDerWaalsContact O-CB 3.29Å; R379-A383 WeakPolarHBondContact O-CB 2.96Å; R379-A383 PolarHBondContact O-N 3.31Å; K380-A383 PolarHBondContact O-N 2.81Å; I381-A383 PolarHBondContact O-N 3.12Å; A383-S386 PolarHBondContact O-N 2.86Å; A383-S386 PolarHBondContact O-OG 2.92Å; A383-H387 PolarHBondContact O-N 2.93Å
384	F	97.2	Very high	85.6	Confident	8 Å²	8	70.9 Å²	70.9	4%	0.035	38%	0.378	C	S	.	.	H	α-helix	trans	-59.6	-48.3	175.9	175.5	-87.3	0	0	0	111.8	K380 I381 S386 H387 Y388 A1167 E1190 Q1193 L1194 L1197	K380-F384 WeakPolarHBondContact O-CB 3.34Å; K380-F384 PolarHBondContact O-N 3.33Å; I381-F384 PolarHBondContact O-N 2.93Å; F384-S386 VanDerWaalsContact C-N 3.29Å; F384-S386 PolarHBondContact O-N 2.94Å; F384-H387 PolarHBondContact O-N 2.66Å; F384-H387 VanDerWaalsContact O-N 3.09Å; F384-Y388 AromaticContact CD2-CD2 3.75Å; F384-Y388 HydrophobicContact CD2-CD2 3.75Å; F384-Y388 HydrophobicContact CD2-CE2 4.13Å; F384-Y388 HydrophobicContact CE1-CD2 4.31Å; F384-Y388 AromaticContact CE2-CD2 3.41Å; F384-Y388 HydrophobicContact CE2-CD2 3.41Å; F384-Y388 VanDerWaalsContact CE2-CD2 3.41Å; F384-Y388 AromaticContact CE2-CE2 3.77Å; F384-Y388 HydrophobicContact CE2-CE2 3.77Å; F384-Y388 HydrophobicContact CE2-CG 4.35Å; F384-Y388 HydrophobicContact CG-CD2 4.34Å; F384-Y388 AromaticContact CZ-CD2 3.71Å; F384-Y388 HydrophobicContact CZ-CD2 3.71Å; F384-Y388 HydrophobicContact CZ-CE2 4.42Å; F384-Y388 HydrophobicContact CZ-CG 4.24Å; F384-Y388 PolarHBondContact O-N 2.75Å; F384-A1167 HydrophobicContact CE1-CB 4.33Å; F384-E1190 HydrophobicContact CE2-CG 4.44Å; F384-E1190 HydrophobicContact CZ-CG 4.15Å; F384-Q1193 HydrophobicContact CD2-CB 4.06Å; F384-Q1193 HydrophobicContact CE2-CB 3.94Å; F384-L1194 HydrophobicContact CD1-CD1 4.31Å; F384-L1194 HydrophobicContact CE1-CB 4.36Å; F384-L1194 HydrophobicContact CE1-CD1 3.74Å; F384-L1194 HydrophobicContact CE1-CG 4.45Å; F384-L1194 HydrophobicContact CE2-CB 4.07Å; F384-L1194 HydrophobicContact CZ-CB 3.73Å; F384-L1194 HydrophobicContact CZ-CD1 4.01Å; F384-L1194 HydrophobicContact CZ-CD2 4.39Å; F384-L1194 HydrophobicContact CZ-CG 4.25Å; F384-L1197 HydrophobicContact CB-CD1 3.59Å; F384-L1197 HydrophobicContact CD2-CD1 4.19Å; F384-L1197 HydrophobicContact CG-CD1 3.88Å
385	L	95.9	Very high	83	Confident	12 Å²	12	75 Å²	75	6%	0.063	40%	0.396	C	S	.	.	H	α-helix	trans	-66.5	-30.3	179.7	-69.1	171.2	0	0	0	112.3	I381 E382 H387 Y388 P389 V390 L1160 E1163 A1167	I381-L385 HydrophobicContact CG2-CD1 3.71Å; I381-L385 HydrophobicContact CG2-CG 4.29Å; I381-L385 WeakPolarHBondContact O-CB 3.16Å; I381-L385 VanDerWaalsContact O-CG 3.29Å; I381-L385 WeakPolarHBondContact O-CG 3.26Å; I381-L385 PolarHBondContact O-N 3.34Å; E382-L385 PolarHBondContact O-N 2.95Å; L385-H387 VanDerWaalsContact C-N 3.33Å; L385-Y388 CarbonylContact O-C 3.33Å; L385-P389 VanDerWaalsContact O-CA 3.22Å; L385-P389 WeakPolarHBondContact O-CA 3.5Å; L385-V390 HydrophobicContact CD2-CG2 3.82Å; L385-L1160 HydrophobicContact CD1-CD2 4.09Å; L385-E1163 HydrophobicContact CD1-CB 3.6Å; L385-E1163 HydrophobicContact CD2-CB 4.16Å; L385-A1167 HydrophobicContact CD2-CB 4.16Å
386	S	94.6	Very high	79.9	Confident	93 Å²	93	74.8 Å²	74.8	65%	0.65	40%	0.402	S	S	*	.	H	α-helix	trans	-68.6	-33.3	172	77.5	0	0	0	0	112.5	E382 A383 F384	E382-S386 WeakPolarHBondContact O-CB 3.33Å; E382-S386 PolarHBondContact O-N 3.36Å; A383-S386 PolarHBondContact O-N 2.86Å; A383-S386 PolarHBondContact O-OG 2.92Å; F384-S386 VanDerWaalsContact C-N 3.29Å; F384-S386 PolarHBondContact O-N 2.94Å
387	H	93.6	Very high	77.2	Confident	137 Å²	137	75 Å²	75	63%	0.634	40%	0.403	S	S	*	.	H	α-helix	trans	-81	-35.3	179.2	-155	69.8	0	0	0	112.2	A383 F384 L385 P389	A383-H387 PolarHBondContact O-N 2.93Å; F384-H387 PolarHBondContact O-N 2.66Å; F384-H387 VanDerWaalsContact O-N 3.09Å; L385-H387 VanDerWaalsContact C-N 3.33Å; H387-P389 VanDerWaalsContact C-CD 3.48Å; H387-P389 WeakPolarHBondContact O-CD 3.44Å
388	Y	91.8	Very high	74.2	Confident	49 Å²	49	82.1 Å²	82.1	19%	0.192	44%	0.436	C	S	.	.	S	Bend	trans	-122.5	70.3	178.6	-59.7	-75	0	0	0	111.1	F384 L385 V390 R1170 E1190	F384-Y388 AromaticContact CD2-CD2 3.75Å; F384-Y388 HydrophobicContact CD2-CD2 3.75Å; F384-Y388 HydrophobicContact CD2-CE2 4.13Å; F384-Y388 HydrophobicContact CE1-CD2 4.31Å; F384-Y388 AromaticContact CE2-CD2 3.41Å; F384-Y388 HydrophobicContact CE2-CD2 3.41Å; F384-Y388 VanDerWaalsContact CE2-CD2 3.41Å; F384-Y388 AromaticContact CE2-CE2 3.77Å; F384-Y388 HydrophobicContact CE2-CE2 3.77Å; F384-Y388 HydrophobicContact CE2-CG 4.35Å; F384-Y388 HydrophobicContact CG-CD2 4.34Å; F384-Y388 AromaticContact CZ-CD2 3.71Å; F384-Y388 HydrophobicContact CZ-CD2 3.71Å; F384-Y388 HydrophobicContact CZ-CE2 4.42Å; F384-Y388 HydrophobicContact CZ-CG 4.24Å; F384-Y388 PolarHBondContact O-N 2.75Å; L385-Y388 CarbonylContact O-C 3.33Å; Y388-V390 PolarHBondContact O-N 2.63Å; Y388-R1170 PolarHBondContact O-NH2 3.11Å; Y388-E1190 HydrophobicContact CD1-CB 4.47Å; Y388-E1190 HydrophobicContact CD1-CG 3.8Å; Y388-E1190 HydrophobicContact CD2-CG 4.17Å; Y388-E1190 HydrophobicContact CE1-CB 3.98Å; Y388-E1190 HydrophobicContact CE1-CG 3.81Å; Y388-E1190 HydrophobicContact CE2-CB 4.44Å; Y388-E1190 HydrophobicContact CE2-CG 4.17Å; Y388-E1190 HydrophobicContact CG-CG 3.98Å
389	P	86	Confident	71.3	Confident	89 Å²	89	86.9 Å²	86.9	58%	0.578	46%	0.461	S	S	*	.			trans	-57	138.6	-174.6	20.6	-31.5	0	0	0	112.6	L385 H387 R1170	L385-P389 VanDerWaalsContact O-CA 3.22Å; L385-P389 WeakPolarHBondContact O-CA 3.5Å; H387-P389 VanDerWaalsContact C-CD 3.48Å; H387-P389 WeakPolarHBondContact O-CD 3.44Å; P389-R1170 PolarHBondContact O-NH1 3.4Å; P389-R1170 PolarHBondContact O-NH2 2.94Å
390	V	81.4	Confident	68.5	Low	27 Å²	27	88.1 Å²	88.1	16%	0.164	47%	0.466	C	S	.	.			trans	-100	96.9	175.9	-166.4	0	0	0	0	109.6	L385 Y388 R1166 A1167	L385-V390 HydrophobicContact CD2-CG2 3.82Å; Y388-V390 PolarHBondContact O-N 2.63Å; V390-R1166 HydrophobicContact CB-CB 4.47Å; V390-R1166 HydrophobicContact CG1-CB 3.52Å; V390-A1167 HydrophobicContact CG2-CB 3.78Å
391	D	69.2	Low	65.6	Low	93 Å²	93	90.6 Å²	90.6	50%	0.497	48%	0.483	S	S	.	.			trans	-57.2	145	176.4	-94.8	-27.5	0	0	0	111.4	S393 W394	D391-S393 VanDerWaalsContact C-N 3.33Å; D391-W394 HydrophobicContact CB-CG 4.32Å; D391-W394 VanDerWaalsContact CB-NE1 3.32Å; D391-W394 PolarHBondContact OD2-NE1 2.81Å
392	S	55.7	Low	62.4	Low	103 Å²	103	97.7 Å²	97.7	72%	0.72	52%	0.516	S	S	*	.	S	Bend	trans	-77.7	-17.9	177.9	50.6	0	0	0	0	113.5
393	S	45.1	Very low	59.4	Low	75 Å²	75	96.4 Å²	96.4	52%	0.524	52%	0.516	S	S	.	.			trans	-106.7	5.6	-165.1	54.1	0	0	0	0	115.8	D391 I395	D391-S393 VanDerWaalsContact C-N 3.33Å; S393-I395 CarbonylContact O-C 3.5Å; S393-I395 PolarHBondContact O-N 3.46Å
394	W	40.6	Very low	56.5	Low	180 Å²	180	101 Å²	101	68%	0.682	53%	0.532	S	S	*	.			trans	-70	13.9	-174.8	-81.2	59.9	0	0	0	115.7	D391 S396	D391-W394 HydrophobicContact CB-CG 4.32Å; D391-W394 VanDerWaalsContact CB-NE1 3.32Å; D391-W394 PolarHBondContact OD2-NE1 2.81Å; W394-S396 PolarHBondContact O-N 3.47Å
395	I	35.7	Very low	53.6	Low	148 Å²	148	108.2 Å²	108.2	76%	0.759	57%	0.572	S	S	*	*			trans	-89.6	61.3	160.3	-43.9	175.2	0	0	0	108.3	S393 P397	S393-I395 CarbonylContact O-C 3.5Å; S393-I395 PolarHBondContact O-N 3.46Å; I395-P397 VanDerWaalsContact O-CD 3.31Å; I395-P397 WeakPolarHBondContact O-CD 3.48Å
396	S	27.8	Very low	50.9	Low	63 Å²	63	110.9 Å²	110.9	44%	0.441	59%	0.585	S	S	.	*			trans	-80.1	117	167.3	-62.8	0	0	0	0	108.6	W394 E398	W394-S396 PolarHBondContact O-N 3.47Å; S396-E398 PolarHBondContact O-N 3.36Å; S396-E398 VanDerWaalsContact O-N 3.17Å
397	P	35.9	Very low	48.4	Very low	91 Å²	91	109.5 Å²	109.5	59%	0.591	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-61.6	-21.4	175.6	-20.6	33.4	0	0	0	113	I395 L399 R400	I395-P397 VanDerWaalsContact O-CD 3.31Å; I395-P397 WeakPolarHBondContact O-CD 3.48Å; P397-L399 VanDerWaalsContact C-N 3.32Å; P397-L399 PolarHBondContact O-N 2.92Å; P397-R400 WeakPolarHBondContact O-CB 3.32Å; P397-R400 PolarHBondContact O-N 3.23Å
398	E	30.4	Very low	45.6	Very low	162 Å²	162	107.2 Å²	107.2	76%	0.757	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-75.3	-13.3	-171.9	-72.9	159.8	170	0	0	114.4	S396	S396-E398 PolarHBondContact O-N 3.36Å; S396-E398 VanDerWaalsContact O-N 3.17Å
399	L	33.2	Very low	43.2	Very low	104 Å²	104	109.3 Å²	109.3	55%	0.545	58%	0.582	S	S	.	*	G	3₁₀ helix	trans	-91.3	-0.3	171	-90.5	152.4	0	0	0	113.8	P397 L401 Q402	P397-L399 VanDerWaalsContact C-N 3.32Å; P397-L399 PolarHBondContact O-N 2.92Å; L399-L401 PolarHBondContact O-N 3.04Å; L399-Q402 HydrophobicContact CD2-CB 4.22Å
400	R	37.5	Very low	40.8	Very low	185 Å²	185	107.6 Å²	107.6	70%	0.698	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-69.6	-8.5	166.6	-69	-173	-174.6	-178.5	1.3	113.1	P397 S403	P397-R400 WeakPolarHBondContact O-CB 3.32Å; P397-R400 PolarHBondContact O-N 3.23Å; R400-S403 PolarHBondContact O-OG 3.18Å
401	L	36.7	Very low	39	Very low	146 Å²	146	115.6 Å²	115.6	76%	0.764	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-103.4	-11.1	-179.4	-75.5	159.6	0	0	0	113.9	L399 S403	L399-L401 PolarHBondContact O-N 3.04Å; L401-S403 VanDerWaalsContact C-N 3.34Å
402	Q	28.8	Very low	37.6	Very low	149 Å²	149	118.6 Å²	118.6	70%	0.696	63%	0.629	S	S	*	*			trans	-99.8	24.4	174.1	-68.7	-172.7	-12.6	0	0	112.5	L399 D404	L399-Q402 HydrophobicContact CD2-CB 4.22Å; Q402-D404 PolarHBondContact O-N 2.87Å; Q402-D404 VanDerWaalsContact O-N 3.07Å
403	S	34	Very low	37.4	Very low	54 Å²	54	119.2 Å²	119.2	38%	0.378	63%	0.633	S	S	.	*	G	3₁₀ helix	trans	-77.2	24.5	177.4	53.6	0	0	0	0	114	R400 L401 D405 I406	R400-S403 PolarHBondContact O-OG 3.18Å; L401-S403 VanDerWaalsContact C-N 3.34Å; S403-D405 VanDerWaalsContact C-N 3.28Å; S403-I406 WeakPolarHBondContact O-CD1 3.31Å; S403-I406 VanDerWaalsContact O-CG1 3.26Å; S403-I406 WeakPolarHBondContact O-CG1 3.37Å; S403-I406 PolarHBondContact O-N 3.42Å
404	D	35.5	Very low	38.1	Very low	152 Å²	152	117.9 Å²	117.9	81%	0.813	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-78.3	-12.7	177	-77.8	-15.5	0	0	0	112.7	Q402 I406	Q402-D404 PolarHBondContact O-N 2.87Å; Q402-D404 VanDerWaalsContact O-N 3.07Å; D404-I406 VanDerWaalsContact C-N 3.33Å
405	D	35.9	Very low	39.6	Very low	161 Å²	161	114 Å²	114	86%	0.861	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-91.4	15.3	170.9	-76.1	-19.1	0	0	0	113.3	S403 L407	S403-D405 VanDerWaalsContact C-N 3.28Å; D405-L407 PolarHBondContact O-N 2.99Å; D405-L407 VanDerWaalsContact O-N 3.13Å
406	I	39.4	Very low	42	Very low	68 Å²	68	109.5 Å²	109.5	35%	0.349	61%	0.607	S	S	.	*	S	Bend	trans	-66.2	115.2	168.7	-67.7	175.2	0	0	0	107.1	S403 D404 P408	S403-I406 WeakPolarHBondContact O-CD1 3.31Å; S403-I406 VanDerWaalsContact O-CG1 3.26Å; S403-I406 WeakPolarHBondContact O-CG1 3.37Å; S403-I406 PolarHBondContact O-N 3.42Å; D404-I406 VanDerWaalsContact C-N 3.33Å; I406-P408 WeakPolarHBondContact O-CA 3.16Å; I406-P408 WeakPolarHBondContact O-CD 3.21Å
407	L	42.6	Very low	45	Very low	63 Å²	63	108 Å²	108	33%	0.33	60%	0.596	S	S	.	*			trans	-33.8	102.3	165.4	-88.8	152.2	0	0	0	108.9	D405 L409	D405-L407 PolarHBondContact O-N 2.99Å; D405-L407 VanDerWaalsContact O-N 3.13Å; L407-L409 PolarHBondContact O-N 2.55Å
408	P	34.2	Very low	47.7	Very low	90 Å²	90	104.1 Å²	104.1	58%	0.584	57%	0.57	S	S	*	*			trans	-67.8	117.1	-169.9	16.1	-21	0	0	0	107.4	I406 G410	I406-P408 WeakPolarHBondContact O-CA 3.16Å; I406-P408 WeakPolarHBondContact O-CD 3.21Å; P408-G410 PolarHBondContact O-N 3.43Å
409	L	41.6	Very low	50.8	Low	93 Å²	93	96.5 Å²	96.5	49%	0.487	54%	0.535	S	S	.	.	S	Bend	trans	-65.4	2.2	162.7	-109.4	155.8	0	0	0	112.6	L407 Q895	L407-L409 PolarHBondContact O-N 2.55Å; L409-Q895 VanDerWaalsContact CD1-CA 3.47Å; L409-Q895 HydrophobicContact CD1-CB 3.25Å; L409-Q895 HydrophobicContact CD1-CG 3.37Å
410	G	35.4	Very low	53.7	Low	53 Å²	53	91.6 Å²	91.6	55%	0.546	51%	0.509	S	S	.	.	S	Bend	trans	-174.9	118.4	169.6	0	0	0	0	0	110.8	P408	P408-G410 PolarHBondContact O-N 3.43Å
411	K	42.9	Very low	56.3	Low	195 Å²	195	84.2 Å²	84.2	85%	0.848	49%	0.485	S	S	*	.				168	-4.6	129.1	-95.4	-175.3	-179.4	-179.9	0	113.7	S413	K411-S413 PolarHBondContact O-N 3.35Å
412	D	41.3	Very low	58.7	Low	156 Å²	156	79.3 Å²	79.3	83%	0.834	47%	0.47	S	S	*	.	S	Bend	trans	-69.3	92.1	152.1	-80.1	-11.2	0	0	0	106	G414	D412-G414 PolarHBondContact O-N 2.7Å
413	S	50.5	Low	61.6	Low	115 Å²	115	79.2 Å²	79.2	80%	0.804	47%	0.467	S	S	*	.			trans	-64.7	76.9	172.7	53.4	0	0	0	0	107.6	K411	K411-S413 PolarHBondContact O-N 3.35Å
414	G	59.4	Low	64.3	Low	48 Å²	48	80.5 Å²	80.5	50%	0.495	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-48.4	151.9	157.7	0	0	0	0	0	108.2	D412 L416	D412-G414 PolarHBondContact O-N 2.7Å; G414-L416 PolarHBondContact O-N 2.84Å; G414-L416 VanDerWaalsContact O-N 3.1Å
415	P	72.6	Confident	66.9	Low	99 Å²	99	75.3 Å²	75.3	64%	0.643	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-51.1	126.9	-178.3	22.4	-33	0	0	0	109.2	S417 P424	P415-S417 PolarHBondContact O-N 3.45Å; P415-P424 HydrophobicContact CB-CB 4.14Å; P415-P424 HydrophobicContact CG-CB 4.16Å
416	L	86.7	Confident	69.5	Low	53 Å²	53	73.4 Å²	73.4	28%	0.277	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-46.7	144.2	179.1	-67.6	171.4	0	0	0	109.3	G414 Y425 E574	G414-L416 PolarHBondContact O-N 2.84Å; G414-L416 VanDerWaalsContact O-N 3.1Å; L416-Y425 WeakPolarHBondContact O-CA 3.34Å; L416-Y425 WeakPolarHBondContact O-CB 3.37Å; L416-Y425 PolarHBondContact O-N 3.49Å; L416-E574 HydrophobicContact CD1-CB 4.29Å; L416-E574 WeakPolarHBondContact CD1-OE2 3.45Å
417	S	90.5	Very high	71.9	Confident	31 Å²	31	74.2 Å²	74.2	22%	0.217	44%	0.44	C	S	.	.	B	Isolated β-bridge	trans	-77.4	134	171	-170.6	0	0	0	0	109.4	P415 P419 G422 S569 N570	P415-S417 PolarHBondContact O-N 3.45Å; S417-P419 WeakPolarHBondContact O-CD 3.27Å; S417-G422 PolarHBondContact OG-O 3.25Å; S417-S569 WeakPolarHBondContact CB-OG 3.12Å; S417-N570 WeakPolarHBondContact O-CB 3.3Å; S417-N570 PolarHBondContact O-ND2 3.15Å
418	D	93.5	Very high	74.2	Confident	10 Å²	10	73.3 Å²	73.3	5%	0.053	44%	0.435	C	S	.	.			trans	-63.6	114.3	170.4	177.1	-7.6	0	0	0	108.7	I420 T421 G422 K423 Y425	D418-I420 PolarHBondContact O-N 3.39Å; D418-I420 VanDerWaalsContact O-N 3.07Å; D418-I420 WeakPolarHBondContact OD1-CB 3.33Å; D418-I420 PolarHBondContact OD1-N 3.33Å; D418-T421 WeakPolarHBondContact CB-OG1 3.46Å; D418-T421 VanDerWaalsContact CG-OG1 3.25Å; D418-T421 PolarHBondContact O-N 3.32Å; D418-T421 PolarHBondContact OD1-N 3.44Å; D418-T421 WeakPolarHBondContact OD2-CB 3.42Å; D418-T421 VanDerWaalsContact OD2-CG2 3.31Å; D418-T421 WeakPolarHBondContact OD2-CG2 3.47Å; D418-T421 PolarHBondContact OD2-OG1 3.36Å; D418-G422 WeakPolarHBondContact O-CA 3.42Å; D418-G422 PolarHBondContact O-N 3.14Å; D418-K423 VanDerWaalsContact CB-O 3.27Å; D418-K423 WeakPolarHBondContact CB-O 3.38Å; D418-K423 PolarHBondContact N-O 3.25Å; D418-Y425 HydrophobicContact CB-CD2 4.27Å
419	P	94	Very high	77.1	Confident	1 Å²	1	71.7 Å²	71.7	1%	0.006	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-19.5	-177.9	-23.8	37.1	0	0	0	113.1	S417 I510 L556 K566 N570 L573 V576	S417-P419 WeakPolarHBondContact O-CD 3.27Å; P419-I510 HydrophobicContact CB-CD1 3.82Å; P419-L556 WeakPolarHBondContact O-CD2 3.46Å; P419-K566 HydrophobicContact CB-CD 4.4Å; P419-K566 VanDerWaalsContact O-CD 3.23Å; P419-K566 WeakPolarHBondContact O-CD 3.42Å; P419-K566 WeakPolarHBondContact O-CE 3.11Å; P419-K566 PolarHBondContact O-NZ 3.46Å; P419-N570 WeakPolarHBondContact CD-ND2 3.25Å; P419-N570 HydrophobicContact CG-CB 4.04Å; P419-N570 WeakPolarHBondContact CG-ND2 3.49Å; P419-L573 HydrophobicContact CB-CD2 4.17Å; P419-L573 HydrophobicContact CG-CD2 4.04Å; P419-V576 HydrophobicContact CB-CG2 3.69Å; P419-V576 HydrophobicContact CG-CG2 3.84Å
420	I	95	Very high	79.6	Confident	2 Å²	2	75 Å²	75	1%	0.01	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-52.2	178.6	-59.5	-59.4	0	0	0	111.2	D418 N508 I510 P549 A554 L556	D418-I420 PolarHBondContact O-N 3.39Å; D418-I420 VanDerWaalsContact O-N 3.07Å; D418-I420 WeakPolarHBondContact OD1-CB 3.33Å; D418-I420 PolarHBondContact OD1-N 3.33Å; I420-N508 HydrophobicContact CD1-CB 4.19Å; I420-N508 HydrophobicContact CG1-CB 4.06Å; I420-I510 HydrophobicContact CD1-CD1 4.33Å; I420-I510 HydrophobicContact CD1-CG1 3.76Å; I420-P549 HydrophobicContact CG2-CG 3.58Å; I420-A554 HydrophobicContact CD1-CB 4.43Å; I420-A554 HydrophobicContact CG1-CB 4.4Å; I420-A554 HydrophobicContact CG2-CB 3.53Å; I420-L556 HydrophobicContact CD1-CB 4.21Å
421	T	91.4	Very high	82.4	Confident	30 Å²	30	76.2 Å²	76.2	18%	0.184	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-18.8	-169.9	68.3	0	0	0	0	114.4	D418 K423 R551	D418-T421 WeakPolarHBondContact CB-OG1 3.46Å; D418-T421 VanDerWaalsContact CG-OG1 3.25Å; D418-T421 PolarHBondContact O-N 3.32Å; D418-T421 PolarHBondContact OD1-N 3.44Å; D418-T421 WeakPolarHBondContact OD2-CB 3.42Å; D418-T421 VanDerWaalsContact OD2-CG2 3.31Å; D418-T421 WeakPolarHBondContact OD2-CG2 3.47Å; D418-T421 PolarHBondContact OD2-OG1 3.36Å; T421-K423 PolarHBondContact O-N 3.21Å; T421-K423 PolarHBondContact OG1-N 3.29Å; T421-R551 HydrophobicContact CG2-CB 4.24Å
422	G	87.8	Confident	84.9	Confident	43 Å²	43	70.2 Å²	70.2	44%	0.443	42%	0.419	S	S	.	.	S	Bend	trans	75.5	-1.5	-173.4	0	0	0	0	0	114.6	S417 D418	S417-G422 PolarHBondContact OG-O 3.25Å; D418-G422 WeakPolarHBondContact O-CA 3.42Å; D418-G422 PolarHBondContact O-N 3.14Å
423	K	89.7	Confident	87.4	Confident	146 Å²	146	64.5 Å²	64.5	64%	0.635	39%	0.387	S	S	*	.	S	Bend	trans	-81.8	168.1	175.4	-63.2	-176.4	178.5	-176.7	0	110.5	D418 T421 Y425	D418-K423 VanDerWaalsContact CB-O 3.27Å; D418-K423 WeakPolarHBondContact CB-O 3.38Å; D418-K423 PolarHBondContact N-O 3.25Å; T421-K423 PolarHBondContact O-N 3.21Å; T421-K423 PolarHBondContact OG1-N 3.29Å; K423-Y425 PolarHBondContact O-N 2.88Å
424	P	89.5	Confident	89.6	Confident	81 Å²	81	62.3 Å²	62.3	53%	0.526	37%	0.369	S	S	.	.	B	Isolated β-bridge	trans	-52.2	127.9	167.8	-27.4	36.3	0	0	0	111.1	P415 M426	P415-P424 HydrophobicContact CB-CB 4.14Å; P415-P424 HydrophobicContact CG-CB 4.16Å; P424-M426 PolarHBondContact O-N 3Å
425	Y	91.3	Very high	91.4	Very high	44 Å²	44	67.4 Å²	67.4	17%	0.173	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-68.6	125.2	178.7	179.2	-108.6	0	0	0	109	L416 D418 K423 P427 E574	L416-Y425 WeakPolarHBondContact O-CA 3.34Å; L416-Y425 WeakPolarHBondContact O-CB 3.37Å; L416-Y425 PolarHBondContact O-N 3.49Å; D418-Y425 HydrophobicContact CB-CD2 4.27Å; K423-Y425 PolarHBondContact O-N 2.88Å; Y425-P427 HydrophobicContact CE1-CG 3.91Å; Y425-E574 HydrophobicContact CE1-CB 4.23Å; Y425-E574 HydrophobicContact CE1-CG 3.7Å
426	M	89.7	Confident	92.5	Very high	121 Å²	121	64.9 Å²	64.9	60%	0.596	35%	0.354	S	S	*	.			trans	-123	134.6	166.3	-68.9	-173.9	-81.5	0	0	106	P424 R551	P424-M426 PolarHBondContact O-N 3Å; M426-R551 PolarHBondContact O-NH2 2.94Å
427	P	89.9	Confident	93	Very high	85 Å²	85	62.5 Å²	62.5	55%	0.552	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-60.1	152.7	166.1	-23.9	34.6	0	0	0	110.7	Y425 R551	Y425-P427 HydrophobicContact CE1-CG 3.91Å; P427-R551 PolarHBondContact O-NH2 2.88Å
428	L	91.6	Very high	93.3	Very high	43 Å²	43	66.6 Å²	66.6	23%	0.225	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-77.4	135.6	170.2	-73.6	169.2	0	0	0	108	E432 E433 L436 A505 R551	L428-E432 HydrophobicContact CD2-CB 4.02Å; L428-E433 HydrophobicContact CB-CB 4.3Å; L428-L436 HydrophobicContact CD1-CD1 3.88Å; L428-L436 HydrophobicContact CD2-CD1 3.6Å; L428-L436 HydrophobicContact CG-CD1 4.43Å; L428-A505 HydrophobicContact CD1-CB 4.08Å; L428-R551 VanDerWaalsContact CD2-NH2 3.31Å
429	S	93.9	Very high	93.5	Very high	57 Å²	57	68.7 Å²	68.7	40%	0.399	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-65.3	154.7	164.9	61.6	0	0	0	0	110	A431 E432 E433	S429-A431 PolarHBondContact O-N 3.12Å; S429-E432 PolarHBondContact N-OE2 3.44Å; S429-E432 PolarHBondContact O-N 3.01Å; S429-E432 WeakPolarHBondContact OG-CB 3.48Å; S429-E432 VanDerWaalsContact OG-CD 3.27Å; S429-E432 WeakPolarHBondContact OG-CG 3.19Å; S429-E432 PolarHBondContact OG-N 3.26Å; S429-E432 PolarHBondContact OG-OE2 2.91Å; S429-E433 PolarHBondContact O-N 3.05Å
430	E	94.3	Very high	93.6	Very high	162 Å²	162	69 Å²	69	76%	0.757	37%	0.374	S	S	*	.	H	α-helix	trans	-55.3	-41.1	179.3	-171.1	174.3	-169.3	0	0	111.9	E433 V434	E430-E433 PolarHBondContact O-N 2.87Å; E430-V434 WeakPolarHBondContact O-CG2 3.4Å; E430-V434 PolarHBondContact O-N 3.13Å
431	A	95.2	Very high	93.6	Very high	78 Å²	78	70.8 Å²	70.8	65%	0.645	38%	0.384	S	S	*	.	H	α-helix	trans	-64	-41.3	175.9	0	0	0	0	0	113	S429 R435	S429-A431 PolarHBondContact O-N 3.12Å; A431-R435 VanDerWaalsContact O-CB 3.27Å; A431-R435 WeakPolarHBondContact O-CB 3.25Å; A431-R435 PolarHBondContact O-N 3.05Å
432	E	94.2	Very high	93.8	Very high	69 Å²	69	74 Å²	74	32%	0.322	40%	0.397	S	S	.	.	H	α-helix	trans	-67.2	-39.4	175.5	-73.4	170.9	131.4	0	0	111.9	L428 S429 R435 L436	L428-E432 HydrophobicContact CD2-CB 4.02Å; S429-E432 PolarHBondContact N-OE2 3.44Å; S429-E432 PolarHBondContact O-N 3.01Å; S429-E432 WeakPolarHBondContact OG-CB 3.48Å; S429-E432 VanDerWaalsContact OG-CD 3.27Å; S429-E432 WeakPolarHBondContact OG-CG 3.19Å; S429-E432 PolarHBondContact OG-N 3.26Å; S429-E432 PolarHBondContact OG-OE2 2.91Å; E432-R435 PolarHBondContact O-N 3.21Å; E432-L436 VanDerWaalsContact O-CB 3.27Å; E432-L436 WeakPolarHBondContact O-CB 3.43Å; E432-L436 VanDerWaalsContact O-CG 3.26Å; E432-L436 WeakPolarHBondContact O-CG 3.33Å; E432-L436 PolarHBondContact O-N 3.04Å
433	E	95.2	Very high	94.1	Very high	36 Å²	36	74.4 Å²	74.4	17%	0.168	39%	0.388	C	S	.	.	H	α-helix	trans	-63.2	-47	178.8	-165.6	-158.5	124.7	0	0	111.4	L428 S429 E430 L436 S437 A505 R506	L428-E433 HydrophobicContact CB-CB 4.3Å; S429-E433 PolarHBondContact O-N 3.05Å; E430-E433 PolarHBondContact O-N 2.87Å; E433-L436 PolarHBondContact O-N 3.5Å; E433-S437 VanDerWaalsContact O-CB 3.29Å; E433-S437 WeakPolarHBondContact O-CB 3.4Å; E433-S437 PolarHBondContact O-N 2.74Å; E433-S437 PolarHBondContact O-OG 3.44Å; E433-A505 HydrophobicContact CG-CB 3.85Å; E433-A505 WeakPolarHBondContact O-CB 3.33Å; E433-R506 HydrophobicContact CG-CG 4.3Å; E433-R506 WeakPolarHBondContact OE1-CG 3.41Å; E433-R506 IonicContact OE1-CZ 2.91Å; E433-R506 IonicContact OE1-NE 2.95Å; E433-R506 PolarHBondContact OE1-NE 2.96Å; E433-R506 IonicContact OE1-NH2 3.86Å; E433-R506 PolarHBondContact OE1-NH2 2.93Å; E433-R506 IonicContact OE2-CZ 3.84Å; E433-R506 IonicContact OE2-NE 3.48Å; E433-R506 PolarHBondContact OE2-NE 2.89Å; E433-R506 IonicContact OE2-NH2 3.21Å; E433-R506 PolarHBondContact OE2-NH2 2.97Å
434	V	96.7	Very high	94.2	Very high	70 Å²	70	67.8 Å²	67.8	42%	0.424	36%	0.36	S	S	.	.	H	α-helix	trans	-61.4	-48.6	176	171.1	0	0	0	0	110.3	E430 L436 S437 Q438	E430-V434 WeakPolarHBondContact O-CG2 3.4Å; E430-V434 PolarHBondContact O-N 3.13Å; V434-L436 PolarHBondContact O-N 3.23Å; V434-S437 PolarHBondContact O-N 3.46Å; V434-Q438 WeakPolarHBondContact O-CG 3.23Å; V434-Q438 PolarHBondContact O-N 3.01Å
435	R	96.8	Very high	94.3	Very high	154 Å²	154	72.9 Å²	72.9	58%	0.581	37%	0.368	S	S	*	.	H	α-helix	trans	-60.8	-45.7	179.8	-175.3	-176.1	66.5	-173.6	-3.8	112.1	A431 E432 Q438 S439	A431-R435 VanDerWaalsContact O-CB 3.27Å; A431-R435 WeakPolarHBondContact O-CB 3.25Å; A431-R435 PolarHBondContact O-N 3.05Å; E432-R435 PolarHBondContact O-N 3.21Å; R435-Q438 PolarHBondContact O-N 3.38Å; R435-S439 WeakPolarHBondContact O-CB 3.43Å; R435-S439 PolarHBondContact O-N 3.14Å
436	L	95.5	Very high	94.2	Very high	47 Å²	47	78.9 Å²	78.9	25%	0.246	39%	0.391	C	S	.	.	H	α-helix	trans	-65.7	-40.6	177.8	-76.2	171	0	0	0	111.2	L428 E432 E433 V434 S439 L440 A505	L428-L436 HydrophobicContact CD1-CD1 3.88Å; L428-L436 HydrophobicContact CD2-CD1 3.6Å; L428-L436 HydrophobicContact CG-CD1 4.43Å; E432-L436 VanDerWaalsContact O-CB 3.27Å; E432-L436 WeakPolarHBondContact O-CB 3.43Å; E432-L436 VanDerWaalsContact O-CG 3.26Å; E432-L436 WeakPolarHBondContact O-CG 3.33Å; E432-L436 PolarHBondContact O-N 3.04Å; E433-L436 PolarHBondContact O-N 3.5Å; V434-L436 PolarHBondContact O-N 3.23Å; L436-S439 PolarHBondContact O-N 3.05Å; L436-L440 WeakPolarHBondContact O-CB 3.3Å; L436-L440 VanDerWaalsContact O-CG 3.24Å; L436-L440 WeakPolarHBondContact O-CG 3.37Å; L436-L440 PolarHBondContact O-N 2.96Å; L436-A505 HydrophobicContact CB-CB 3.71Å
437	S	97.6	Very high	93.8	Very high	2 Å²	2	74.3 Å²	74.3	1%	0.014	37%	0.367	C	S	.	.	H	α-helix	trans	-65.6	-40.1	178.3	-61.1	0	0	0	0	112.2	E433 V434 L440 L441 G502 G504 A505	E433-S437 VanDerWaalsContact O-CB 3.29Å; E433-S437 WeakPolarHBondContact O-CB 3.4Å; E433-S437 PolarHBondContact O-N 2.74Å; E433-S437 PolarHBondContact O-OG 3.44Å; V434-S437 PolarHBondContact O-N 3.46Å; S437-L440 PolarHBondContact O-N 2.88Å; S437-L441 PolarHBondContact O-N 3.35Å; S437-G502 WeakPolarHBondContact CB-O 3.27Å; S437-G504 PolarHBondContact OG-N 3.39Å; S437-A505 VanDerWaalsContact OG-CB 3.26Å; S437-A505 WeakPolarHBondContact OG-CB 3.19Å; S437-A505 PolarHBondContact OG-N 2.9Å
438	Q	97.2	Very high	93.1	Very high	118 Å²	118	71.8 Å²	71.8	55%	0.551	36%	0.356	S	S	*	.	H	α-helix	trans	-62.9	-46	172.4	-72.5	173.7	-5.2	0	0	111.6	V434 R435 L440 L441 E442	V434-Q438 WeakPolarHBondContact O-CG 3.23Å; V434-Q438 PolarHBondContact O-N 3.01Å; R435-Q438 PolarHBondContact O-N 3.38Å; Q438-L440 VanDerWaalsContact C-N 3.35Å; Q438-L440 PolarHBondContact O-N 3.28Å; Q438-L441 WeakPolarHBondContact O-CB 3.4Å; Q438-L441 PolarHBondContact O-N 3.27Å; Q438-E442 PolarHBondContact O-N 3.48Å
439	S	96.1	Very high	92	Very high	53 Å²	53	73 Å²	73	37%	0.371	37%	0.366	S	S	.	.	H	α-helix	trans	-60.4	-43.7	176.5	-175.9	0	0	0	0	112	R435 L436 L441 E442 L443	R435-S439 WeakPolarHBondContact O-CB 3.43Å; R435-S439 PolarHBondContact O-N 3.14Å; L436-S439 PolarHBondContact O-N 3.05Å; S439-L441 VanDerWaalsContact C-N 3.32Å; S439-L441 PolarHBondContact O-N 3.05Å; S439-E442 PolarHBondContact O-N 3.4Å; S439-L443 VanDerWaalsContact O-CG 3.31Å; S439-L443 WeakPolarHBondContact O-CG 3.45Å; S439-L443 PolarHBondContact O-N 3.44Å
440	L	96.2	Very high	91.1	Very high	7 Å²	7	73.5 Å²	73.5	4%	0.037	36%	0.364	C	S	.	.	H	α-helix	trans	-62.1	-38.8	176.1	-72.9	167.5	0	0	0	112.1	L436 S437 Q438 L443 W444 V499 L534 N537	L436-L440 WeakPolarHBondContact O-CB 3.3Å; L436-L440 VanDerWaalsContact O-CG 3.24Å; L436-L440 WeakPolarHBondContact O-CG 3.37Å; L436-L440 PolarHBondContact O-N 2.96Å; S437-L440 PolarHBondContact O-N 2.88Å; Q438-L440 VanDerWaalsContact C-N 3.35Å; Q438-L440 PolarHBondContact O-N 3.28Å; L440-L443 PolarHBondContact O-N 3.16Å; L440-W444 VanDerWaalsContact O-CB 3.25Å; L440-W444 WeakPolarHBondContact O-CB 3.32Å; L440-W444 PolarHBondContact O-N 3.36Å; L440-V499 HydrophobicContact CB-CG1 4.18Å; L440-V499 HydrophobicContact CB-CG2 4Å; L440-V499 WeakPolarHBondContact O-CG1 3.17Å; L440-L534 HydrophobicContact CD2-CD2 4.29Å; L440-N537 VanDerWaalsContact CD2-ND2 3.28Å; L440-N537 WeakPolarHBondContact CD2-ND2 3.3Å
441	L	96.1	Very high	90	Very high	40 Å²	40	68.3 Å²	68.3	21%	0.209	34%	0.338	C	S	.	.	H	α-helix	trans	-63.8	-40.6	175.8	-178.7	61.2	0	0	0	111.8	S437 Q438 S439 W444 R445 V499	S437-L441 PolarHBondContact O-N 3.35Å; Q438-L441 WeakPolarHBondContact O-CB 3.4Å; Q438-L441 PolarHBondContact O-N 3.27Å; S439-L441 VanDerWaalsContact C-N 3.32Å; S439-L441 PolarHBondContact O-N 3.05Å; L441-W444 PolarHBondContact O-N 2.83Å; L441-R445 VanDerWaalsContact O-CG 3.32Å; L441-R445 WeakPolarHBondContact O-CG 3.41Å; L441-R445 PolarHBondContact O-N 3Å; L441-V499 HydrophobicContact CB-CG1 4.33Å; L441-V499 HydrophobicContact CD1-CG1 4.4Å
442	E	95.2	Very high	88.9	Confident	98 Å²	98	71.6 Å²	71.6	46%	0.458	34%	0.34	S	S	.	.	H	α-helix	trans	-64.5	-45.2	173.5	-69.3	-179.8	-176.2	0	0	112.3	Q438 S439 W444 R445 R446	Q438-E442 PolarHBondContact O-N 3.48Å; S439-E442 PolarHBondContact O-N 3.4Å; E442-W444 VanDerWaalsContact C-N 3.32Å; E442-W444 PolarHBondContact O-N 3.01Å; E442-R445 PolarHBondContact O-N 3.38Å; E442-R446 WeakPolarHBondContact O-CG 3.29Å; E442-R446 PolarHBondContact O-N 2.93Å
443	L	93.7	Very high	88	Confident	51 Å²	51	75.5 Å²	75.5	27%	0.267	36%	0.358	S	S	.	.	H	α-helix	trans	-62.6	-39.7	176.6	-68	174.8	0	0	0	111.6	S439 L440 R446 R447 L534	S439-L443 VanDerWaalsContact O-CG 3.31Å; S439-L443 WeakPolarHBondContact O-CG 3.45Å; S439-L443 PolarHBondContact O-N 3.44Å; L440-L443 PolarHBondContact O-N 3.16Å; L443-R446 CarbonylContact O-C 3.52Å; L443-R446 PolarHBondContact O-N 2.81Å; L443-R446 VanDerWaalsContact O-N 3.15Å; L443-R447 PolarHBondContact O-N 3.18Å; L443-R447 VanDerWaalsContact O-N 3.1Å; L443-L534 HydrophobicContact CB-CD2 3.89Å; L443-L534 HydrophobicContact CB-CG 4.21Å
444	W	92.3	Very high	87	Confident	8 Å²	8	75 Å²	75	3%	0.03	36%	0.36	C	S	.	.	H	α-helix	trans	-62	-42.9	175	-173.7	-100.5	0	0	0	112.1	L440 L441 E442 R446 R447 W451 E496 V499 L530 L534	L440-W444 VanDerWaalsContact O-CB 3.25Å; L440-W444 WeakPolarHBondContact O-CB 3.32Å; L440-W444 PolarHBondContact O-N 3.36Å; L441-W444 PolarHBondContact O-N 2.83Å; E442-W444 VanDerWaalsContact C-N 3.32Å; E442-W444 PolarHBondContact O-N 3.01Å; W444-R446 VanDerWaalsContact C-N 3.26Å; W444-R446 PolarHBondContact O-N 3.18Å; W444-R447 WeakPolarHBondContact O-CB 3.45Å; W444-R447 WeakPolarHBondContact O-CD 3.35Å; W444-R447 WeakPolarHBondContact O-CG 3.5Å; W444-R447 PolarHBondContact O-N 3.39Å; W444-R447 PolarHBondContact O-NH1 3.46Å; W444-W451 HydrophobicContact CH2-CZ2 4.37Å; W444-W451 HydrophobicContact CZ2-CH2 4.49Å; W444-W451 HydrophobicContact CZ2-CZ2 4.36Å; W444-E496 HydrophobicContact CH2-CB 3.45Å; W444-E496 VanDerWaalsContact CH2-CB 3.45Å; W444-E496 HydrophobicContact CH2-CG 3.92Å; W444-E496 HydrophobicContact CZ2-CB 3.39Å; W444-E496 HydrophobicContact CZ2-CG 3.27Å; W444-E496 HydrophobicContact CZ3-CB 4.18Å; W444-V499 HydrophobicContact CB-CG1 3.62Å; W444-V499 HydrophobicContact CD2-CG1 4.43Å; W444-V499 HydrophobicContact CG-CG1 3.94Å; W444-L530 HydrophobicContact CH2-CD2 4.19Å; W444-L530 HydrophobicContact CZ3-CD2 3.77Å; W444-L534 HydrophobicContact CB-CD1 4.38Å; W444-L534 HydrophobicContact CD2-CD1 4.27Å; W444-L534 HydrophobicContact CE3-CD1 3.4Å; W444-L534 HydrophobicContact CZ3-CD1 3.96Å
445	R	91.1	Very high	86	Confident	187 Å²	187	76.6 Å²	76.6	71%	0.706	37%	0.372	S	S	*	.	H	α-helix	trans	-64	-30.6	173.9	-71.6	171.1	-179.2	173.5	0.5	112.5	L441 E442	L441-R445 VanDerWaalsContact O-CG 3.32Å; L441-R445 WeakPolarHBondContact O-CG 3.41Å; L441-R445 PolarHBondContact O-N 3Å; E442-R445 PolarHBondContact O-N 3.38Å
446	R	89.2	Confident	85.2	Confident	171 Å²	171	76.1 Å²	76.1	65%	0.645	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	14.1	179.3	-64	177	-175.3	178.5	6.2	114.3	E442 L443 W444 G448 S533	E442-R446 WeakPolarHBondContact O-CG 3.29Å; E442-R446 PolarHBondContact O-N 2.93Å; L443-R446 CarbonylContact O-C 3.52Å; L443-R446 PolarHBondContact O-N 2.81Å; L443-R446 VanDerWaalsContact O-N 3.15Å; W444-R446 VanDerWaalsContact C-N 3.26Å; W444-R446 PolarHBondContact O-N 3.18Å; R446-G448 PolarHBondContact O-N 3.36Å; R446-S533 PolarHBondContact O-OG 3.02Å
447	R	82.2	Confident	84.6	Confident	24 Å²	24	75.9 Å²	75.9	9%	0.091	38%	0.375	C	S	.	.	S	Bend	trans	-67.6	-18.1	-174.2	73.9	-175.2	178.6	-92	14.9	114.5	L443 W444 L530 L534	L443-R447 PolarHBondContact O-N 3.18Å; L443-R447 VanDerWaalsContact O-N 3.1Å; W444-R447 WeakPolarHBondContact O-CB 3.45Å; W444-R447 WeakPolarHBondContact O-CD 3.35Å; W444-R447 WeakPolarHBondContact O-CG 3.5Å; W444-R447 PolarHBondContact O-N 3.39Å; W444-R447 PolarHBondContact O-NH1 3.46Å; R447-L530 WeakPolarHBondContact CB-O 3.34Å; R447-L534 HydrophobicContact CB-CD1 4.18Å
448	G	74.3	Confident	84	Confident	32 Å²	32	77.5 Å²	77.5	33%	0.33	39%	0.385	S	S	.	.			trans	89.1	175.1	177.3	0	0	0	0	0	113.7	R446 I450	R446-G448 PolarHBondContact O-N 3.36Å; G448-I450 VanDerWaalsContact C-N 3.32Å; G448-I450 PolarHBondContact O-N 3.4Å
449	P	68.9	Low	83.7	Confident	68 Å²	68	71.9 Å²	71.9	44%	0.442	36%	0.359	S	S	.	.	H	α-helix	trans	-72.4	-21.1	-170.4	28.1	-34.8	0	0	0	113.7	W451 Q452 E453	P449-W451 PolarHBondContact O-N 3.48Å; P449-Q452 CarbonylContact O-C 3.54Å; P449-Q452 WeakPolarHBondContact O-CA 3.17Å; P449-Q452 PolarHBondContact O-N 2.95Å; P449-E453 HydrophobicContact CB-CG 4.19Å; P449-E453 WeakPolarHBondContact O-CB 3.33Å; P449-E453 PolarHBondContact O-N 2.78Å
450	I	74.4	Confident	83.3	Confident	69 Å²	69	71 Å²	71	35%	0.354	35%	0.35	S	S	.	.	H	α-helix	trans	-48.2	-42.1	-175.9	-61.7	172.8	0	0	0	112.2	G448 A454	G448-I450 VanDerWaalsContact C-N 3.32Å; G448-I450 PolarHBondContact O-N 3.4Å; I450-A454 WeakPolarHBondContact O-CB 3.48Å; I450-A454 PolarHBondContact O-N 2.82Å
451	W	72.1	Confident	83.1	Confident	52 Å²	52	74.7 Å²	74.7	20%	0.197	38%	0.375	C	S	.	.	H	α-helix	trans	-76.5	-36.9	-179.4	-164.1	90.6	0	0	0	112.7	W444 P449 Q492 E496	W444-W451 HydrophobicContact CH2-CZ2 4.37Å; W444-W451 HydrophobicContact CZ2-CH2 4.49Å; W444-W451 HydrophobicContact CZ2-CZ2 4.36Å; P449-W451 PolarHBondContact O-N 3.48Å; W451-Q492 VanDerWaalsContact CD1-OE1 3.29Å; W451-E496 WeakPolarHBondContact CH2-OE1 3.43Å
452	Q	70.9	Confident	82.9	Confident	147 Å²	147	75.2 Å²	75.2	69%	0.687	38%	0.376	S	S	*	.	H	α-helix	trans	-74.1	-32.7	179.7	-71.1	169	-16.6	0	0	112.3	P449	P449-Q452 CarbonylContact O-C 3.54Å; P449-Q452 WeakPolarHBondContact O-CA 3.17Å; P449-Q452 PolarHBondContact O-N 2.95Å
453	E	76.1	Confident	82.8	Confident	151 Å²	151	73.4 Å²	73.4	71%	0.706	37%	0.365	S	S	*	.	S	Bend	trans	-90.3	-4	178.2	-65.3	176.7	179.9	0	0	112.5	P449	P449-E453 HydrophobicContact CB-CG 4.19Å; P449-E453 WeakPolarHBondContact O-CB 3.33Å; P449-E453 PolarHBondContact O-N 2.78Å
454	A	73.7	Confident	82.9	Confident	26 Å²	26	75 Å²	75	22%	0.215	37%	0.374	C	S	.	.	S	Bend	trans	-64	134.5	179.5	0	0	0	0	0	109.8	I450 Q456	I450-A454 WeakPolarHBondContact O-CB 3.48Å; I450-A454 PolarHBondContact O-N 2.82Å; A454-Q456 PolarHBondContact O-N 3.25Å
455	P	75.6	Confident	83	Confident	104 Å²	104	78.7 Å²	78.7	68%	0.675	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-58.1	137.5	178.4	21.7	-30.8	0	0	0	110.3	L457 R489	P455-L457 PolarHBondContact O-N 2.85Å; P455-R489 PolarHBondContact O-NH2 2.89Å
456	Q	81.1	Confident	83.3	Confident	144 Å²	144	69.8 Å²	69.8	67%	0.673	36%	0.364	S	S	*	.	P	Polyproline II helix	trans	-62.6	126.3	178.3	-166	179.6	16.6	0	0	109.4	A454 D460	A454-Q456 PolarHBondContact O-N 3.25Å; Q456-D460 HydrophobicContact CG-CB 3.96Å
457	L	83.3	Confident	83.6	Confident	42 Å²	42	62 Å²	62	22%	0.22	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-98.7	155.6	175.9	-63.4	-179.2	0	0	0	110.1	P455 V459 D460 P461 R489	P455-L457 PolarHBondContact O-N 2.85Å; L457-V459 HydrophobicContact CB-CG1 4.34Å; L457-V459 PolarHBondContact O-N 2.95Å; L457-D460 PolarHBondContact N-OD2 3.18Å; L457-D460 WeakPolarHBondContact O-CB 3.34Å; L457-D460 PolarHBondContact O-N 3.45Å; L457-P461 WeakPolarHBondContact O-CD 3.25Å; L457-R489 HydrophobicContact CD1-CG 3.84Å
458	P	85.3	Confident	84.4	Confident	35 Å²	35	63 Å²	63	23%	0.227	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-21.6	-177.4	-24.5	31	0	0	0	115.5	P461 H462 C484 V634 P635 F637	P458-P461 WeakPolarHBondContact O-CD 3.46Å; P458-H462 PolarHBondContact O-CD2 3.49Å; P458-C484 HydrophobicContact CB-CB 4.01Å; P458-C484 HydrophobicContact CG-CB 4.19Å; P458-V634 WeakPolarHBondContact O-CG1 3.43Å; P458-P635 VanDerWaalsContact CB-O 3.23Å; P458-P635 WeakPolarHBondContact CB-O 3.28Å; P458-F637 HydrophobicContact CG-CB 4.41Å
459	V	89.2	Confident	85.5	Confident	0 Å²	0	62 Å²	62	0%	0	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-25.3	174.1	69.9	0	0	0	0	113.9	L457 H462 R463 I466 C484 R489 I490 V634	L457-V459 HydrophobicContact CB-CG1 4.34Å; L457-V459 PolarHBondContact O-N 2.95Å; V459-H462 PolarHBondContact O-N 3.21Å; V459-R463 PolarHBondContact O-N 3.2Å; V459-I466 HydrophobicContact CG2-CD1 3.5Å; V459-I466 VanDerWaalsContact CG2-CD1 3.5Å; V459-C484 WeakPolarHBondContact CB-O 3.03Å; V459-C484 VanDerWaalsContact CG1-O 3.32Å; V459-C484 WeakPolarHBondContact CG1-O 3.22Å; V459-C484 PolarHBondContact N-O 3.39Å; V459-R489 HydrophobicContact CG1-CB 3.55Å; V459-R489 HydrophobicContact CG1-CG 3.67Å; V459-I490 HydrophobicContact CG2-CD1 4.31Å; V459-I490 HydrophobicContact CG2-CG1 4.05Å; V459-V634 HydrophobicContact CB-CG1 4.01Å; V459-V634 HydrophobicContact CG2-CG1 4.35Å; V459-V634 HydrophobicContact CG2-CG2 4.25Å
460	D	89.4	Confident	86.8	Confident	36 Å²	36	58.9 Å²	58.9	19%	0.193	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-65.2	-40.7	-171.8	-60.1	-28.9	0	0	0	113	Q456 L457 H462 R463 R489	Q456-D460 HydrophobicContact CG-CB 3.96Å; L457-D460 PolarHBondContact N-OD2 3.18Å; L457-D460 WeakPolarHBondContact O-CB 3.34Å; L457-D460 PolarHBondContact O-N 3.45Å; D460-H462 PolarHBondContact O-N 3.01Å; D460-R463 VanDerWaalsContact O-CB 3.25Å; D460-R463 WeakPolarHBondContact O-CB 3.05Å; D460-R463 PolarHBondContact O-N 2.95Å; D460-R463 VanDerWaalsContact O-N 3.15Å; D460-R489 IonicContact OD1-NE 3.64Å; D460-R489 IonicContact OD2-NE 2.89Å
461	P	90.5	Very high	87.8	Confident	84 Å²	84	60 Å²	60	55%	0.545	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-60.3	-22.9	172.1	-23.5	33.3	0	0	0	114.6	L457 P458	L457-P461 WeakPolarHBondContact O-CD 3.25Å; P458-P461 WeakPolarHBondContact O-CD 3.46Å
462	H	92.1	Very high	89	Confident	51 Å²	51	64.1 Å²	64.1	24%	0.236	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-95.1	7.5	-179	-65	-85.2	0	0	0	112.9	P458 V459 D460 D464 T465 I466 P635	P458-H462 PolarHBondContact O-CD2 3.49Å; V459-H462 PolarHBondContact O-N 3.21Å; D460-H462 PolarHBondContact O-N 3.01Å; H462-D464 PolarHBondContact O-N 3.31Å; H462-T465 PolarHBondContact O-N 2.75Å; H462-I466 HydrophobicContact CB-CD1 3.89Å; H462-I466 HydrophobicContact CB-CG1 4.28Å; H462-I466 WeakPolarHBondContact O-CB 3.39Å; H462-I466 VanDerWaalsContact O-CG1 3.29Å; H462-I466 WeakPolarHBondContact O-CG1 3.34Å; H462-I466 PolarHBondContact O-N 2.89Å; H462-P635 VanDerWaalsContact NE2-CD 3.3Å; H462-P635 WeakPolarHBondContact NE2-CD 3.36Å
463	R	93.1	Very high	90.3	Very high	59 Å²	59	60.4 Å²	60.4	22%	0.223	32%	0.321	C	S	.	.	H	α-helix	trans	-46.2	-56.9	-177.2	170	-179.4	-175.8	-87	6.6	113	V459 D460 I466 L467 L493 E496	V459-R463 PolarHBondContact O-N 3.2Å; D460-R463 VanDerWaalsContact O-CB 3.25Å; D460-R463 WeakPolarHBondContact O-CB 3.05Å; D460-R463 PolarHBondContact O-N 2.95Å; D460-R463 VanDerWaalsContact O-N 3.15Å; R463-I466 PolarHBondContact O-N 2.85Å; R463-L467 HydrophobicContact CG-CD1 3.77Å; R463-L467 WeakPolarHBondContact O-CB 3.49Å; R463-L467 VanDerWaalsContact O-CG 3.27Å; R463-L467 WeakPolarHBondContact O-CG 3.15Å; R463-L467 PolarHBondContact O-N 2.87Å; R463-L493 HydrophobicContact CB-CD1 4.13Å; R463-L493 HydrophobicContact CB-CD2 4.4Å; R463-L493 HydrophobicContact CG-CD1 4.14Å; R463-L493 HydrophobicContact CG-CD2 3.84Å; R463-L493 HydrophobicContact CG-CG 4.46Å; R463-E496 IonicContact CZ-OE2 3.24Å; R463-E496 VanDerWaalsContact CZ-OE2 3.3Å; R463-E496 IonicContact NE-OE2 2.86Å; R463-E496 PolarHBondContact NE-OE2 2.97Å; R463-E496 VanDerWaalsContact NH2-CD 3.25Å; R463-E496 IonicContact NH2-OE1 2.85Å; R463-E496 IonicContact NH2-OE2 3.31Å; R463-E496 PolarHBondContact NH2-OE2 2.88Å
464	D	95.3	Very high	91.3	Very high	86 Å²	86	56.4 Å²	56.4	46%	0.46	31%	0.308	S	S	.	.	H	α-helix	trans	-70.3	-39.3	-173.2	-65.5	-36.8	0	0	0	111.5	H462 I466 L467 S468 R497	H462-D464 PolarHBondContact O-N 3.31Å; D464-I466 VanDerWaalsContact C-N 3.33Å; D464-I466 PolarHBondContact O-N 3.1Å; D464-L467 PolarHBondContact O-N 3.31Å; D464-S468 VanDerWaalsContact O-CB 3.28Å; D464-S468 WeakPolarHBondContact O-CB 3.17Å; D464-S468 PolarHBondContact O-N 2.89Å; D464-S468 PolarHBondContact O-OG 3.21Å; D464-S468 VanDerWaalsContact O-OG 3.08Å; D464-R497 IonicContact OD1-NH2 3.81Å
465	T	96	Very high	92.4	Very high	85 Å²	85	55.4 Å²	55.4	52%	0.521	30%	0.3	S	S	.	.	H	α-helix	trans	-58.6	-44.4	173.5	-50.4	0	0	0	0	111.8	H462 A469	H462-T465 PolarHBondContact O-N 2.75Å; T465-A469 VanDerWaalsContact O-CB 3.31Å; T465-A469 WeakPolarHBondContact O-CB 3.4Å; T465-A469 PolarHBondContact O-N 3.38Å; T465-A469 VanDerWaalsContact O-N 3.1Å
466	I	95.8	Very high	93.5	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64.1	-52	178.4	-71.4	165.8	0	0	0	110.6	V459 H462 R463 D464 S468 A469 I470 I478 I632 V634	V459-I466 HydrophobicContact CG2-CD1 3.5Å; V459-I466 VanDerWaalsContact CG2-CD1 3.5Å; H462-I466 HydrophobicContact CB-CD1 3.89Å; H462-I466 HydrophobicContact CB-CG1 4.28Å; H462-I466 WeakPolarHBondContact O-CB 3.39Å; H462-I466 VanDerWaalsContact O-CG1 3.29Å; H462-I466 WeakPolarHBondContact O-CG1 3.34Å; H462-I466 PolarHBondContact O-N 2.89Å; R463-I466 PolarHBondContact O-N 2.85Å; D464-I466 VanDerWaalsContact C-N 3.33Å; D464-I466 PolarHBondContact O-N 3.1Å; I466-S468 PolarHBondContact O-N 3.09Å; I466-A469 PolarHBondContact O-N 2.72Å; I466-I470 HydrophobicContact CG2-CD1 3.69Å; I466-I470 VanDerWaalsContact O-CG1 3.28Å; I466-I470 WeakPolarHBondContact O-CG1 2.98Å; I466-I470 PolarHBondContact O-N 3.01Å; I466-I478 HydrophobicContact CG1-CD1 4.45Å; I466-I478 HydrophobicContact CG2-CD1 3.65Å; I466-I632 HydrophobicContact CB-CD1 4.48Å; I466-I632 HydrophobicContact CG1-CD1 4.15Å; I466-I632 HydrophobicContact CG1-CG2 4.11Å; I466-V634 HydrophobicContact CD1-CG2 3.97Å
467	L	97.3	Very high	94.3	Very high	8 Å²	8	43.6 Å²	43.6	4%	0.042	24%	0.236	C	C	.	.	H	α-helix	trans	-63.6	-44.1	-176.9	-67.7	171.8	0	0	0	111.8	R463 D464 A469 I470 E471 L493 L494 R497	R463-L467 HydrophobicContact CG-CD1 3.77Å; R463-L467 WeakPolarHBondContact O-CB 3.49Å; R463-L467 VanDerWaalsContact O-CG 3.27Å; R463-L467 WeakPolarHBondContact O-CG 3.15Å; R463-L467 PolarHBondContact O-N 2.87Å; D464-L467 PolarHBondContact O-N 3.31Å; L467-A469 PolarHBondContact O-N 3.3Å; L467-I470 PolarHBondContact O-N 3.13Å; L467-E471 PolarHBondContact O-N 2.77Å; L467-L493 HydrophobicContact CD1-CB 4.44Å; L467-L493 HydrophobicContact CD2-CB 4.14Å; L467-L494 HydrophobicContact CD2-CD2 3.74Å; L467-L494 HydrophobicContact CD2-CG 4.22Å; L467-R497 HydrophobicContact CD1-CB 4.09Å; L467-R497 HydrophobicContact CD1-CG 4.3Å; L467-R497 HydrophobicContact CD2-CB 4.3Å
468	S	97.2	Very high	94.9	Very high	43 Å²	43	41.6 Å²	41.6	30%	0.301	23%	0.225	S	C	.	.	H	α-helix	trans	-62.6	-41.9	177.5	-67.2	0	0	0	0	112.2	D464 I466 E471 Q472	D464-S468 VanDerWaalsContact O-CB 3.28Å; D464-S468 WeakPolarHBondContact O-CB 3.17Å; D464-S468 PolarHBondContact O-N 2.89Å; D464-S468 PolarHBondContact O-OG 3.21Å; D464-S468 VanDerWaalsContact O-OG 3.08Å; I466-S468 PolarHBondContact O-N 3.09Å; S468-E471 PolarHBondContact O-N 3.22Å; S468-Q472 WeakPolarHBondContact O-CB 3.48Å; S468-Q472 WeakPolarHBondContact O-CG 3.46Å; S468-Q472 PolarHBondContact O-N 3.06Å
469	A	97.3	Very high	95.1	Very high	12 Å²	12	40.7 Å²	40.7	10%	0.099	22%	0.22	C	C	.	.	H	α-helix	trans	-64.1	-42.5	177.3	0	0	0	0	0	112.3	T465 I466 L467 E471 Q472 H473 V476 I632	T465-A469 VanDerWaalsContact O-CB 3.31Å; T465-A469 WeakPolarHBondContact O-CB 3.4Å; T465-A469 PolarHBondContact O-N 3.38Å; T465-A469 VanDerWaalsContact O-N 3.1Å; I466-A469 PolarHBondContact O-N 2.72Å; L467-A469 PolarHBondContact O-N 3.3Å; A469-E471 VanDerWaalsContact C-N 3.32Å; A469-E471 PolarHBondContact O-N 3.02Å; A469-Q472 PolarHBondContact O-N 3.3Å; A469-H473 WeakPolarHBondContact O-CB 3.38Å; A469-H473 PolarHBondContact O-N 2.88Å; A469-H473 PolarHBondContact O-ND1 3.25Å; A469-V476 HydrophobicContact CB-CG1 4.39Å; A469-V476 HydrophobicContact CB-CG2 4.25Å; A469-V476 WeakPolarHBondContact O-CG2 3.14Å; A469-I632 HydrophobicContact CB-CD1 3.44Å; A469-I632 VanDerWaalsContact CB-CD1 3.44Å; A469-I632 HydrophobicContact CB-CG1 4.36Å
470	I	97.7	Very high	94.9	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.015	22%	0.222	C	C	.	.	H	α-helix	trans	-64.1	-37.6	177.8	-66.4	168	0	0	0	111.1	I466 L467 H473 V476 I478 L494 R609 V611	I466-I470 HydrophobicContact CG2-CD1 3.69Å; I466-I470 VanDerWaalsContact O-CG1 3.28Å; I466-I470 WeakPolarHBondContact O-CG1 2.98Å; I466-I470 PolarHBondContact O-N 3.01Å; L467-I470 PolarHBondContact O-N 3.13Å; I470-H473 VanDerWaalsContact O-O 3.11Å; I470-V476 HydrophobicContact CG1-CB 4.33Å; I470-V476 HydrophobicContact CG1-CG2 4.15Å; I470-I478 HydrophobicContact CD1-CD1 4.26Å; I470-L494 HydrophobicContact CD1-CD2 4.06Å; I470-L494 HydrophobicContact CG2-CD2 4.07Å; I470-R609 HydrophobicContact CG2-CB 4.07Å; I470-R609 HydrophobicContact CG2-CG 4.39Å; I470-R609 WeakPolarHBondContact O-CD 3.48Å; I470-R609 PolarHBondContact O-NE 3.36Å; I470-V611 HydrophobicContact CD1-CG2 3.79Å; I470-V611 HydrophobicContact CG1-CG2 3.93Å; I470-V611 HydrophobicContact CG2-CG2 4.21Å
471	E	95.6	Very high	94.3	Very high	92 Å²	92	41.9 Å²	41.9	43%	0.43	23%	0.227	S	C	.	.	H	α-helix	trans	-69.6	-41.8	178.6	-172.4	161.1	-133.4	0	0	112	L467 S468 A469 R503 R609	L467-E471 PolarHBondContact O-N 2.77Å; S468-E471 PolarHBondContact O-N 3.22Å; A469-E471 VanDerWaalsContact C-N 3.32Å; A469-E471 PolarHBondContact O-N 3.02Å; E471-R503 IonicContact OE1-CZ 3.41Å; E471-R503 IonicContact OE1-NH2 3.68Å; E471-R503 PolarHBondContact OE1-NH2 3.14Å; E471-R609 PolarHBondContact O-NE 3.29Å; E471-R609 PolarHBondContact O-NH2 3.08Å
472	Q	96.3	Very high	93.5	Very high	138 Å²	138	38.8 Å²	38.8	65%	0.645	21%	0.206	S	C	*	.	H	α-helix	trans	-79.2	-25.1	-175	-69.7	170.8	7.5	0	0	114.2	S468 A469	S468-Q472 WeakPolarHBondContact O-CB 3.48Å; S468-Q472 WeakPolarHBondContact O-CG 3.46Å; S468-Q472 PolarHBondContact O-N 3.06Å; A469-Q472 PolarHBondContact O-N 3.3Å
473	H	97.4	Very high	92.5	Very high	70 Å²	70	38.7 Å²	38.7	32%	0.324	22%	0.219	S	C	.	.			trans	-121.6	137.8	-173.8	-56.6	80.6	0	0	0	111.5	A469 I470 V475 V476 R609 P630	A469-H473 WeakPolarHBondContact O-CB 3.38Å; A469-H473 PolarHBondContact O-N 2.88Å; A469-H473 PolarHBondContact O-ND1 3.25Å; I470-H473 VanDerWaalsContact O-O 3.11Å; H473-V475 WeakPolarHBondContact CB-O 3.43Å; H473-V475 PolarHBondContact O-N 3.39Å; H473-V476 HydrophobicContact CB-CG2 4.06Å; H473-R609 WeakPolarHBondContact O-CD 3.27Å; H473-P630 HydrophobicContact CB-CG 4.07Å
474	P	97.2	Very high	91.9	Very high	66 Å²	66	36 Å²	36	43%	0.429	21%	0.209	S	C	.	.	S	Bend	trans	-59.8	-32.6	176.7	21	-30.8	0	0	0	112.8	L610	P474-L610 PolarHBondContact O-N 2.87Å
475	V	98.2	Very high	91.4	Very high	6 Å²	6	32.3 Å²	32.3	4%	0.036	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	140.7	179.3	-169.7	0	0	0	0	109.5	H473 Q602 L610 L612 F626 C629	H473-V475 WeakPolarHBondContact CB-O 3.43Å; H473-V475 PolarHBondContact O-N 3.39Å; V475-Q602 HydrophobicContact CG2-CG 4.37Å; V475-L610 CarbonylContact C-O 3.57Å; V475-L610 VanDerWaalsContact CA-O 3.27Å; V475-L610 WeakPolarHBondContact CA-O 3.24Å; V475-L610 HydrophobicContact CB-CB 4.47Å; V475-L610 HydrophobicContact CG1-CB 4.2Å; V475-L610 HydrophobicContact CG1-CD2 4.05Å; V475-L610 HydrophobicContact CG1-CG 4.09Å; V475-L610 HydrophobicContact CG2-CB 4.15Å; V475-L610 HydrophobicContact CG2-CD2 4.26Å; V475-L612 HydrophobicContact CG1-CD1 4.45Å; V475-L612 HydrophobicContact CG1-CG 4.49Å; V475-F626 HydrophobicContact CB-CB 4.29Å; V475-F626 HydrophobicContact CB-CG 4.47Å; V475-F626 HydrophobicContact CG1-CB 4.03Å; V475-F626 HydrophobicContact CG1-CD1 4.19Å; V475-F626 HydrophobicContact CG1-CD2 4.22Å; V475-F626 HydrophobicContact CG1-CG 3.9Å; V475-F626 HydrophobicContact CG2-CB 4.31Å; V475-F626 HydrophobicContact CG2-CD1 3.85Å; V475-F626 HydrophobicContact CG2-CE1 4.5Å; V475-F626 HydrophobicContact CG2-CG 4.26Å; V475-C629 HydrophobicContact CB-CB 4.05Å; V475-C629 HydrophobicContact CG1-CB 4.46Å; V475-C629 WeakPolarHBondContact O-CB 2.92Å
476	V	98.1	Very high	91.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	137	172.4	-179.2	0	0	0	0	109.7	A469 I470 H473 I478 L610 V611 L612 P630 I632	A469-V476 HydrophobicContact CB-CG1 4.39Å; A469-V476 HydrophobicContact CB-CG2 4.25Å; A469-V476 WeakPolarHBondContact O-CG2 3.14Å; I470-V476 HydrophobicContact CG1-CB 4.33Å; I470-V476 HydrophobicContact CG1-CG2 4.15Å; H473-V476 HydrophobicContact CB-CG2 4.06Å; V476-I478 HydrophobicContact CG1-CG1 4.02Å; V476-L610 PolarHBondContact N-O 2.84Å; V476-V611 WeakPolarHBondContact O-CA 3.32Å; V476-L612 PolarHBondContact O-N 2.85Å; V476-P630 HydrophobicContact CG1-CG 4.43Å; V476-P630 HydrophobicContact CG2-CG 4.08Å; V476-I632 HydrophobicContact CG1-CD1 3.81Å; V476-I632 HydrophobicContact CG1-CG1 4.08Å
477	V	97.4	Very high	90.8	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	125.8	169	-176.9	0	0	0	0	108.8	L612 N619 F622 P630 V631 I632	V477-L612 CarbonylContact C-O 3.56Å; V477-L612 WeakPolarHBondContact CA-O 3.32Å; V477-L612 HydrophobicContact CG2-CB 4.32Å; V477-L612 HydrophobicContact CG2-CD1 4.25Å; V477-N619 HydrophobicContact CG1-CB 4.07Å; V477-F622 HydrophobicContact CG2-CB 4.06Å; V477-P630 PolarHBondContact N-O 3.11Å; V477-V631 HydrophobicContact CB-CG1 4.42Å; V477-V631 HydrophobicContact CB-CG2 4.16Å; V477-V631 HydrophobicContact CG1-CG1 4.32Å; V477-V631 CarbonylContact O-C 3.52Å; V477-V631 WeakPolarHBondContact O-CA 3.5Å; V477-I632 PolarHBondContact O-N 2.95Å
478	I	95.4	Very high	90.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	111.4	174.8	-56.9	176	0	0	0	108.4	I466 I470 V476 K486 I490 V611 L612 M613 S614 V634	I466-I478 HydrophobicContact CG1-CD1 4.45Å; I466-I478 HydrophobicContact CG2-CD1 3.65Å; I470-I478 HydrophobicContact CD1-CD1 4.26Å; V476-I478 HydrophobicContact CG1-CG1 4.02Å; I478-K486 HydrophobicContact CG2-CD 4.16Å; I478-K486 HydrophobicContact CG2-CG 4.27Å; I478-I490 HydrophobicContact CB-CD1 4.45Å; I478-I490 HydrophobicContact CD1-CD1 3.73Å; I478-I490 HydrophobicContact CD1-CG2 4.45Å; I478-I490 HydrophobicContact CG2-CD1 3.92Å; I478-V611 HydrophobicContact CD1-CG1 3.6Å; I478-V611 HydrophobicContact CG1-CG1 4.08Å; I478-L612 PolarHBondContact N-O 2.74Å; I478-M613 WeakPolarHBondContact O-CA 3.44Å; I478-S614 PolarHBondContact O-N 2.81Å; I478-V634 HydrophobicContact CG2-CG2 3.96Å
479	S	91.5	Very high	90.2	Very high	16 Å²	16	29.2 Å²	29.2	11%	0.112	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	138.1	175.7	-175.3	0	0	0	0	110.5	S614 N619 I632 K633 V634	S479-S614 WeakPolarHBondContact CA-O 3.44Å; S479-N619 WeakPolarHBondContact CB-ND2 3.46Å; S479-N619 PolarHBondContact OG-ND2 2.88Å; S479-I632 PolarHBondContact N-O 3.28Å; S479-K633 CarbonylContact O-C 3.56Å; S479-K633 WeakPolarHBondContact O-CA 3.5Å; S479-V634 PolarHBondContact O-N 2.8Å
480	G	85.1	Confident	90.1	Very high	4 Å²	4	28.7 Å²	28.7	4%	0.041	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.3	155.5	168.1	0	0	0	0	0	110.6	K486 S614 A615 V634	G480-K486 WeakPolarHBondContact O-CE 3.17Å; G480-K486 PolarHBondContact O-NZ 2.75Å; G480-S614 PolarHBondContact N-O 2.65Å; G480-S614 VanDerWaalsContact N-O 3.1Å; G480-A615 VanDerWaalsContact O-CA 3.26Å; G480-A615 WeakPolarHBondContact O-CA 3.28Å; G480-V634 WeakPolarHBondContact CA-O 3.41Å
481	D	76.4	Confident	90.1	Very high	56 Å²	56	28.5 Å²	28.5	30%	0.299	16%	0.164	S	C	.	.			trans	-60.5	166.3	-172.5	-62.6	-42.5	0	0	0	113.5	G483 C484 K486	D481-G483 PolarHBondContact O-N 3.37Å; D481-C484 WeakPolarHBondContact O-CB 3.44Å; D481-C484 PolarHBondContact O-N 2.85Å; D481-C484 PolarHBondContact O-SG 3.15Å; D481-K486 PolarHBondContact O-NZ 3.44Å; D481-K486 VanDerWaalsContact O-NZ 3.14Å
482	T	72.3	Confident	90	Very high	20 Å²	20	24.2 Å²	24.2	12%	0.123	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	138.4	174.5	75.3	0	0	0	0	110.9	A615 R808	T482-A615 HydrophobicContact CG2-CB 3.8Å; T482-R808 PolarHBondContact OG1-NE 2.88Å; T482-R808 PolarHBondContact OG1-NH2 2.91Å
483	G	72	Confident	90	Very high	49 Å²	49	17.9 Å²	17.9	51%	0.505	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.5	-5.8	-178	0	0	0	0	0	115.2	D481 G485	D481-G483 PolarHBondContact O-N 3.37Å; G483-G485 PolarHBondContact O-N 3.07Å; G483-G485 VanDerWaalsContact O-N 3.12Å
484	C	80	Confident	90	Very high	1 Å²	1	14.7 Å²	14.7	1%	0.007	10%	0.1	C	C	.	.	S	Bend	trans	-70	-7.8	179.5	72.2	0	0	0	0	114.9	P458 V459 D481 K486 V634	P458-C484 HydrophobicContact CB-CB 4.01Å; P458-C484 HydrophobicContact CG-CB 4.19Å; V459-C484 WeakPolarHBondContact CB-O 3.03Å; V459-C484 VanDerWaalsContact CG1-O 3.32Å; V459-C484 WeakPolarHBondContact CG1-O 3.22Å; V459-C484 PolarHBondContact N-O 3.39Å; D481-C484 WeakPolarHBondContact O-CB 3.44Å; D481-C484 PolarHBondContact O-N 2.85Å; D481-C484 PolarHBondContact O-SG 3.15Å; C484-K486 VanDerWaalsContact SG-CG 3.56Å; C484-K486 PolarHBondContact SG-NZ 3.03Å; C484-V634 HydrophobicContact CB-CG1 4.32Å
485	G	84.9	Confident	89.9	Confident	9 Å²	9	11.6 Å²	11.6	9%	0.093	8%	0.079	C	C	.	.	S	Bend	trans	100.1	2.3	175.2	0	0	0	0	0	116.4	G483 T487 T488 R489	G483-G485 PolarHBondContact O-N 3.07Å; G483-G485 VanDerWaalsContact O-N 3.12Å; G485-T487 PolarHBondContact O-N 3.41Å; G485-T488 PolarHBondContact O-N 3.24Å; G485-T488 PolarHBondContact O-OG1 3.38Å; G485-R489 VanDerWaalsContact O-CB 3.26Å; G485-R489 WeakPolarHBondContact O-CB 3.45Å; G485-R489 PolarHBondContact O-N 3.21Å
486	K	89.6	Confident	89.7	Confident	9 Å²	9	12.1 Å²	12.1	4%	0.039	8%	0.082	C	C	.	.	H	α-helix	trans	-46.1	-62	-178.4	-72.4	176.8	-43.2	-64.2	0	113.6	I478 G480 D481 C484 T488 I490 M613 S614	I478-K486 HydrophobicContact CG2-CD 4.16Å; I478-K486 HydrophobicContact CG2-CG 4.27Å; G480-K486 WeakPolarHBondContact O-CE 3.17Å; G480-K486 PolarHBondContact O-NZ 2.75Å; D481-K486 PolarHBondContact O-NZ 3.44Å; D481-K486 VanDerWaalsContact O-NZ 3.14Å; C484-K486 VanDerWaalsContact SG-CG 3.56Å; C484-K486 PolarHBondContact SG-NZ 3.03Å; K486-T488 VanDerWaalsContact C-N 3.29Å; K486-T488 PolarHBondContact O-N 2.84Å; K486-I490 HydrophobicContact CB-CD1 3.86Å; K486-I490 HydrophobicContact CG-CD1 3.94Å; K486-I490 WeakPolarHBondContact O-CB 3.4Å; K486-I490 WeakPolarHBondContact O-CG1 3.48Å; K486-I490 PolarHBondContact O-N 3.24Å; K486-I490 VanDerWaalsContact O-N 3.11Å; K486-M613 HydrophobicContact CB-SD 3.99Å; K486-S614 WeakPolarHBondContact CE-O 3.32Å
487	T	90	Very high	89.6	Confident	26 Å²	26	15 Å²	15	16%	0.16	9%	0.093	C	C	.	.	H	α-helix	trans	-59.8	-33.6	-173.9	-52.7	0	0	0	0	113.7	G485 V522 D582	G485-T487 PolarHBondContact O-N 3.41Å; T487-V522 HydrophobicContact CG2-CB 4.28Å; T487-V522 HydrophobicContact CG2-CG1 3.55Å; T487-V522 HydrophobicContact CG2-CG2 3.74Å; T487-D582 VanDerWaalsContact CB-OD2 3.22Å; T487-D582 WeakPolarHBondContact CB-OD2 3.34Å; T487-D582 WeakPolarHBondContact CG2-OD2 3.46Å; T487-D582 PolarHBondContact OG1-OD2 2.84Å
488	T	89.7	Confident	89.6	Confident	26 Å²	26	16.6 Å²	16.6	16%	0.16	10%	0.099	C	C	.	.	H	α-helix	trans	-94.4	-42.8	-178	53.1	0	0	0	0	112.5	G485 K486 Q492 R525 V526	G485-T488 PolarHBondContact O-N 3.24Å; G485-T488 PolarHBondContact O-OG1 3.38Å; K486-T488 VanDerWaalsContact C-N 3.29Å; K486-T488 PolarHBondContact O-N 2.84Å; T488-Q492 WeakPolarHBondContact O-CG 3.03Å; T488-Q492 PolarHBondContact O-NE2 2.79Å; T488-R525 HydrophobicContact CG2-CG 4.11Å; T488-V526 HydrophobicContact CG2-CG2 4.22Å
489	R	92.2	Very high	89.7	Confident	10 Å²	10	16.6 Å²	16.6	4%	0.038	10%	0.099	C	C	.	.	H	α-helix	trans	-84.6	-44.3	-172.1	-64.4	-63.2	-164.8	-158.5	4	113.8	P455 L457 V459 D460 G485 Q492 L493 E529	P455-R489 PolarHBondContact O-NH2 2.89Å; L457-R489 HydrophobicContact CD1-CG 3.84Å; V459-R489 HydrophobicContact CG1-CB 3.55Å; V459-R489 HydrophobicContact CG1-CG 3.67Å; D460-R489 IonicContact OD1-NE 3.64Å; D460-R489 IonicContact OD2-NE 2.89Å; G485-R489 VanDerWaalsContact O-CB 3.26Å; G485-R489 WeakPolarHBondContact O-CB 3.45Å; G485-R489 PolarHBondContact O-N 3.21Å; R489-Q492 CarbonylContact O-C 3.6Å; R489-Q492 WeakPolarHBondContact O-CA 3.26Å; R489-Q492 WeakPolarHBondContact O-CB 3.44Å; R489-Q492 PolarHBondContact O-N 2.87Å; R489-L493 WeakPolarHBondContact O-CG 3.49Å; R489-L493 PolarHBondContact O-N 3.03Å; R489-E529 IonicContact NH1-OE2 3.74Å
490	I	95.6	Very high	89.8	Confident	1 Å²	1	18.9 Å²	18.9	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-56.5	-45.3	-173.6	-67.1	166.4	0	0	0	112.3	V459 I478 K486 Q492 L493 L494 I580 M613	V459-I490 HydrophobicContact CG2-CD1 4.31Å; V459-I490 HydrophobicContact CG2-CG1 4.05Å; I478-I490 HydrophobicContact CB-CD1 4.45Å; I478-I490 HydrophobicContact CD1-CD1 3.73Å; I478-I490 HydrophobicContact CD1-CG2 4.45Å; I478-I490 HydrophobicContact CG2-CD1 3.92Å; K486-I490 HydrophobicContact CB-CD1 3.86Å; K486-I490 HydrophobicContact CG-CD1 3.94Å; K486-I490 WeakPolarHBondContact O-CB 3.4Å; K486-I490 WeakPolarHBondContact O-CG1 3.48Å; K486-I490 PolarHBondContact O-N 3.24Å; K486-I490 VanDerWaalsContact O-N 3.11Å; I490-Q492 VanDerWaalsContact C-N 3.28Å; I490-Q492 PolarHBondContact O-N 3.03Å; I490-L493 PolarHBondContact O-N 3.33Å; I490-L494 HydrophobicContact CG2-CD1 4.41Å; I490-L494 PolarHBondContact O-N 3.21Å; I490-I580 HydrophobicContact CG2-CD1 4.25Å; I490-M613 HydrophobicContact CB-SD 4.28Å; I490-M613 HydrophobicContact CD1-SD 3.59Å; I490-M613 VanDerWaalsContact CD1-SD 3.59Å; I490-M613 HydrophobicContact CG2-SD 4.46Å
491	P	96.4	Very high	90.3	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-59.7	-37.7	174.3	-23.2	33.9	0	0	0	113.2	L495 I511 L555 F557 I580	P491-L495 PolarHBondContact O-N 3.44Å; P491-L495 VanDerWaalsContact O-N 3.15Å; P491-I511 HydrophobicContact CB-CD1 4.26Å; P491-I511 HydrophobicContact CB-CG1 4.34Å; P491-I511 HydrophobicContact CG-CD1 4.45Å; P491-I511 HydrophobicContact CG-CG1 4.01Å; P491-L555 HydrophobicContact CB-CD1 4.11Å; P491-L555 HydrophobicContact CB-CD2 4.24Å; P491-F557 HydrophobicContact CB-CZ 4.41Å; P491-F557 HydrophobicContact CG-CZ 4.19Å; P491-I580 HydrophobicContact CG-CD1 4.06Å
492	Q	95	Very high	91.2	Very high	1 Å²	1	22 Å²	22	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-70	-38.8	177.9	-63	177.8	52.2	0	0	111.9	W451 T488 R489 I490 L495 E496 V526 E529 L530	W451-Q492 VanDerWaalsContact CD1-OE1 3.29Å; T488-Q492 WeakPolarHBondContact O-CG 3.03Å; T488-Q492 PolarHBondContact O-NE2 2.79Å; R489-Q492 CarbonylContact O-C 3.6Å; R489-Q492 WeakPolarHBondContact O-CA 3.26Å; R489-Q492 WeakPolarHBondContact O-CB 3.44Å; R489-Q492 PolarHBondContact O-N 2.87Å; I490-Q492 VanDerWaalsContact C-N 3.28Å; I490-Q492 PolarHBondContact O-N 3.03Å; Q492-L495 PolarHBondContact O-N 3.02Å; Q492-E496 WeakPolarHBondContact O-CB 3.4Å; Q492-E496 PolarHBondContact O-N 3.3Å; Q492-V526 HydrophobicContact CG-CG1 3.77Å; Q492-E529 PolarHBondContact NE2-OE2 3.32Å; Q492-L530 HydrophobicContact CB-CD2 4.21Å; Q492-L530 HydrophobicContact CG-CD1 4.33Å; Q492-L530 HydrophobicContact CG-CD2 3.88Å; Q492-L530 HydrophobicContact CG-CG 4Å
493	L	95.3	Very high	92.4	Very high	5 Å²	5	23.7 Å²	23.7	3%	0.026	14%	0.14	C	C	.	.	H	α-helix	trans	-64.9	-40.3	177.3	-65.8	178.4	0	0	0	111.5	R463 L467 R489 I490 E496 R497	R463-L493 HydrophobicContact CB-CD1 4.13Å; R463-L493 HydrophobicContact CB-CD2 4.4Å; R463-L493 HydrophobicContact CG-CD1 4.14Å; R463-L493 HydrophobicContact CG-CD2 3.84Å; R463-L493 HydrophobicContact CG-CG 4.46Å; L467-L493 HydrophobicContact CD1-CB 4.44Å; L467-L493 HydrophobicContact CD2-CB 4.14Å; R489-L493 WeakPolarHBondContact O-CG 3.49Å; R489-L493 PolarHBondContact O-N 3.03Å; I490-L493 PolarHBondContact O-N 3.33Å; L493-E496 PolarHBondContact O-N 2.82Å; L493-R497 WeakPolarHBondContact O-CB 3.36Å; L493-R497 PolarHBondContact O-N 2.92Å
494	L	97.2	Very high	93.5	Very high	4 Å²	4	21.3 Å²	21.3	2%	0.021	12%	0.116	C	C	.	.	H	α-helix	trans	-62.1	-48.1	174	-72.7	170.4	0	0	0	111.3	L467 I470 I490 R497 Y498 I580	L467-L494 HydrophobicContact CD2-CD2 3.74Å; L467-L494 HydrophobicContact CD2-CG 4.22Å; I470-L494 HydrophobicContact CD1-CD2 4.06Å; I470-L494 HydrophobicContact CG2-CD2 4.07Å; I490-L494 HydrophobicContact CG2-CD1 4.41Å; I490-L494 PolarHBondContact O-N 3.21Å; L494-R497 PolarHBondContact O-N 3.5Å; L494-Y498 WeakPolarHBondContact O-CD2 3.42Å; L494-Y498 PolarHBondContact O-N 3.17Å; L494-I580 HydrophobicContact CD1-CD1 3.95Å
495	L	96.2	Very high	94.3	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-61.1	-47	177.2	-177.2	63.5	0	0	0	111.4	P491 Q492 R497 Y498 V499 C507 L530 L555	P491-L495 PolarHBondContact O-N 3.44Å; P491-L495 VanDerWaalsContact O-N 3.15Å; Q492-L495 PolarHBondContact O-N 3.02Å; L495-R497 VanDerWaalsContact C-N 3.3Å; L495-R497 PolarHBondContact O-N 3.07Å; L495-Y498 PolarHBondContact O-N 2.82Å; L495-V499 HydrophobicContact CD1-CG2 3.9Å; L495-V499 HydrophobicContact CG-CG2 4.19Å; L495-V499 WeakPolarHBondContact O-CB 3.43Å; L495-V499 WeakPolarHBondContact O-CG2 3.37Å; L495-V499 PolarHBondContact O-N 2.88Å; L495-C507 HydrophobicContact CD1-CB 4.23Å; L495-L530 HydrophobicContact CD2-CD1 4.1Å; L495-L555 HydrophobicContact CB-CD1 4.48Å; L495-L555 HydrophobicContact CB-CD2 4.37Å; L495-L555 HydrophobicContact CD2-CD1 4.06Å; L495-L555 HydrophobicContact CD2-CG 4.25Å
496	E	94.2	Very high	94.8	Very high	18 Å²	18	27.7 Å²	27.7	8%	0.084	14%	0.137	C	C	.	.	H	α-helix	trans	-52.6	-49.8	175.7	176.1	176.1	-137	0	0	111.1	W444 W451 R463 Q492 L493 Y498 V499 T500	W444-E496 HydrophobicContact CH2-CB 3.45Å; W444-E496 VanDerWaalsContact CH2-CB 3.45Å; W444-E496 HydrophobicContact CH2-CG 3.92Å; W444-E496 HydrophobicContact CZ2-CB 3.39Å; W444-E496 HydrophobicContact CZ2-CG 3.27Å; W444-E496 HydrophobicContact CZ3-CB 4.18Å; W451-E496 WeakPolarHBondContact CH2-OE1 3.43Å; R463-E496 IonicContact CZ-OE2 3.24Å; R463-E496 VanDerWaalsContact CZ-OE2 3.3Å; R463-E496 IonicContact NE-OE2 2.86Å; R463-E496 PolarHBondContact NE-OE2 2.97Å; R463-E496 VanDerWaalsContact NH2-CD 3.25Å; R463-E496 IonicContact NH2-OE1 2.85Å; R463-E496 IonicContact NH2-OE2 3.31Å; R463-E496 PolarHBondContact NH2-OE2 2.88Å; Q492-E496 WeakPolarHBondContact O-CB 3.4Å; Q492-E496 PolarHBondContact O-N 3.3Å; L493-E496 PolarHBondContact O-N 2.82Å; E496-Y498 PolarHBondContact O-N 2.84Å; E496-V499 PolarHBondContact O-N 3.49Å; E496-T500 HydrophobicContact CG-CG2 4.14Å; E496-T500 WeakPolarHBondContact O-CB 3.29Å; E496-T500 WeakPolarHBondContact O-CG2 3.24Å; E496-T500 PolarHBondContact O-N 3.4Å; E496-T500 PolarHBondContact O-OG1 2.85Å
497	R	95.7	Very high	95.2	Very high	61 Å²	61	27.3 Å²	27.3	23%	0.23	14%	0.135	C	C	.	.	H	α-helix	trans	-59.4	-50.7	-175.9	-173.4	60.8	118.9	148	-19.8	111.6	D464 L467 L493 L494 L495 V499 T500 E501	D464-R497 IonicContact OD1-NH2 3.81Å; L467-R497 HydrophobicContact CD1-CB 4.09Å; L467-R497 HydrophobicContact CD1-CG 4.3Å; L467-R497 HydrophobicContact CD2-CB 4.3Å; L493-R497 WeakPolarHBondContact O-CB 3.36Å; L493-R497 PolarHBondContact O-N 2.92Å; L494-R497 PolarHBondContact O-N 3.5Å; L495-R497 VanDerWaalsContact C-N 3.3Å; L495-R497 PolarHBondContact O-N 3.07Å; R497-V499 PolarHBondContact O-N 3.42Å; R497-T500 PolarHBondContact O-OG1 3.31Å; R497-E501 VanDerWaalsContact CD-OE1 3.23Å; R497-E501 WeakPolarHBondContact CD-OE1 3.5Å; R497-E501 IonicContact CZ-OE1 2.87Å; R497-E501 IonicContact NE-OE1 2.74Å; R497-E501 IonicContact NH1-OE1 3.65Å; R497-E501 PolarHBondContact NH1-OE1 2.94Å; R497-E501 WeakPolarHBondContact O-CB 3.4Å; R497-E501 VanDerWaalsContact O-CG 3.3Å; R497-E501 WeakPolarHBondContact O-CG 3.48Å; R497-E501 PolarHBondContact O-N 2.75Å; R497-E501 VanDerWaalsContact O-N 3.11Å
498	Y	97.3	Very high	95.5	Very high	33 Å²	33	27 Å²	27	13%	0.129	13%	0.133	C	C	.	.	H	α-helix	trans	-66.4	-39.4	-179.8	-84.6	-116.2	0	0	0	112.1	L494 L495 E496 G502 R503 G504 R506 C507 H578	L494-Y498 WeakPolarHBondContact O-CD2 3.42Å; L494-Y498 PolarHBondContact O-N 3.17Å; L495-Y498 PolarHBondContact O-N 2.82Å; E496-Y498 PolarHBondContact O-N 2.84Å; Y498-G502 PolarHBondContact O-N 3.01Å; Y498-R503 HydrophobicContact CD1-CG 3.99Å; Y498-R503 VanDerWaalsContact CE1-NH1 3.32Å; Y498-R503 HydrophobicContact CG-CG 4.31Å; Y498-R503 CarbonylContact O-C 3.52Å; Y498-R503 VanDerWaalsContact O-C 3.24Å; Y498-R503 WeakPolarHBondContact O-CA 3.47Å; Y498-R503 WeakPolarHBondContact O-CG 3.13Å; Y498-R503 PolarHBondContact O-N 2.82Å; Y498-R503 PolarHBondContact OH-NH1 3.39Å; Y498-G504 PolarHBondContact O-N 2.78Å; Y498-R506 HydrophobicContact CD1-CB 4.25Å; Y498-R506 HydrophobicContact CE1-CB 4.31Å; Y498-C507 HydrophobicContact CD1-CB 3.77Å; Y498-C507 HydrophobicContact CD2-CB 4.43Å; Y498-C507 HydrophobicContact CG-CB 3.68Å; Y498-H578 AromaticContact CE2-CE1 3.69Å; Y498-H578 AromaticContact CZ-CE1 3.63Å; Y498-H578 PolarHBondContact OH-CE1 2.88Å
499	V	96.1	Very high	96	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-67.7	-44.9	-180	171.5	0	0	0	0	111.5	L440 L441 W444 L495 E496 R497 E501 G502	L440-V499 HydrophobicContact CB-CG1 4.18Å; L440-V499 HydrophobicContact CB-CG2 4Å; L440-V499 WeakPolarHBondContact O-CG1 3.17Å; L441-V499 HydrophobicContact CB-CG1 4.33Å; L441-V499 HydrophobicContact CD1-CG1 4.4Å; W444-V499 HydrophobicContact CB-CG1 3.62Å; W444-V499 HydrophobicContact CD2-CG1 4.43Å; W444-V499 HydrophobicContact CG-CG1 3.94Å; L495-V499 HydrophobicContact CD1-CG2 3.9Å; L495-V499 HydrophobicContact CG-CG2 4.19Å; L495-V499 WeakPolarHBondContact O-CB 3.43Å; L495-V499 WeakPolarHBondContact O-CG2 3.37Å; L495-V499 PolarHBondContact O-N 2.88Å; E496-V499 PolarHBondContact O-N 3.49Å; R497-V499 PolarHBondContact O-N 3.42Å; V499-E501 VanDerWaalsContact C-N 3.3Å; V499-E501 PolarHBondContact O-N 3.44Å; V499-G502 PolarHBondContact O-N 2.84Å; V499-G502 VanDerWaalsContact O-N 3.14Å
500	T	94.8	Very high	96.3	Very high	64 Å²	64	25.3 Å²	25.3	39%	0.393	12%	0.123	S	C	.	.	H	α-helix	trans	-69.6	-27.3	-179.4	51	0	0	0	0	112.9	E496 R497 G502	E496-T500 HydrophobicContact CG-CG2 4.14Å; E496-T500 WeakPolarHBondContact O-CB 3.29Å; E496-T500 WeakPolarHBondContact O-CG2 3.24Å; E496-T500 PolarHBondContact O-N 3.4Å; E496-T500 PolarHBondContact O-OG1 2.85Å; R497-T500 PolarHBondContact O-OG1 3.31Å; T500-G502 VanDerWaalsContact C-N 3.26Å; T500-G502 PolarHBondContact O-N 2.93Å
501	E	96	Very high	96.4	Very high	80 Å²	80	25.2 Å²	25.2	37%	0.374	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	7	172.7	-69.5	174.7	178.1	0	0	113.8	R497 V499 R503	R497-E501 VanDerWaalsContact CD-OE1 3.23Å; R497-E501 WeakPolarHBondContact CD-OE1 3.5Å; R497-E501 IonicContact CZ-OE1 2.87Å; R497-E501 IonicContact NE-OE1 2.74Å; R497-E501 IonicContact NH1-OE1 3.65Å; R497-E501 PolarHBondContact NH1-OE1 2.94Å; R497-E501 WeakPolarHBondContact O-CB 3.4Å; R497-E501 VanDerWaalsContact O-CG 3.3Å; R497-E501 WeakPolarHBondContact O-CG 3.48Å; R497-E501 PolarHBondContact O-N 2.75Å; R497-E501 VanDerWaalsContact O-N 3.11Å; V499-E501 VanDerWaalsContact C-N 3.3Å; V499-E501 PolarHBondContact O-N 3.44Å; E501-R503 VanDerWaalsContact C-N 3.28Å; E501-R503 HydrophobicContact CB-CG 4.08Å; E501-R503 PolarHBondContact O-N 2.97Å; E501-R503 IonicContact OE2-CZ 2.98Å; E501-R503 IonicContact OE2-NE 2.65Å; E501-R503 PolarHBondContact OE2-NE 3.4Å; E501-R503 IonicContact OE2-NH2 3.64Å; E501-R503 PolarHBondContact OE2-NH2 3.41Å
502	G	95.3	Very high	96.5	Very high	44 Å²	44	25.3 Å²	25.3	45%	0.454	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.2	14.9	176.3	0	0	0	0	0	114.7	S437 Y498 V499 T500	S437-G502 WeakPolarHBondContact CB-O 3.27Å; Y498-G502 PolarHBondContact O-N 3.01Å; V499-G502 PolarHBondContact O-N 2.84Å; V499-G502 VanDerWaalsContact O-N 3.14Å; T500-G502 VanDerWaalsContact C-N 3.26Å; T500-G502 PolarHBondContact O-N 2.93Å
503	R	96.1	Very high	96.4	Very high	56 Å²	56	25.2 Å²	25.2	21%	0.211	12%	0.123	C	C	.	.			trans	-121	25.1	-179.2	59.8	179.5	-178.2	136.2	-10.9	112.9	E471 Y498 E501 A505 R506	E471-R503 IonicContact OE1-CZ 3.41Å; E471-R503 IonicContact OE1-NH2 3.68Å; E471-R503 PolarHBondContact OE1-NH2 3.14Å; Y498-R503 HydrophobicContact CD1-CG 3.99Å; Y498-R503 VanDerWaalsContact CE1-NH1 3.32Å; Y498-R503 HydrophobicContact CG-CG 4.31Å; Y498-R503 CarbonylContact O-C 3.52Å; Y498-R503 VanDerWaalsContact O-C 3.24Å; Y498-R503 WeakPolarHBondContact O-CA 3.47Å; Y498-R503 WeakPolarHBondContact O-CG 3.13Å; Y498-R503 PolarHBondContact O-N 2.82Å; Y498-R503 PolarHBondContact OH-NH1 3.39Å; E501-R503 VanDerWaalsContact C-N 3.28Å; E501-R503 HydrophobicContact CB-CG 4.08Å; E501-R503 PolarHBondContact O-N 2.97Å; E501-R503 IonicContact OE2-CZ 2.98Å; E501-R503 IonicContact OE2-NE 2.65Å; E501-R503 PolarHBondContact OE2-NE 3.4Å; E501-R503 IonicContact OE2-NH2 3.64Å; E501-R503 PolarHBondContact OE2-NH2 3.41Å; R503-A505 PolarHBondContact O-N 3.39Å; R503-A505 VanDerWaalsContact O-N 3.15Å; R503-R506 WeakPolarHBondContact O-CB 3.32Å; R503-R506 PolarHBondContact O-N 3.21Å
504	G	96.3	Very high	96.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-54.5	-35.2	-173.6	0	0	0	0	0	114.2	S437 Y498 R506 C507 G553	S437-G504 PolarHBondContact OG-N 3.39Å; Y498-G504 PolarHBondContact O-N 2.78Å; G504-R506 PolarHBondContact O-N 3.41Å; G504-C507 WeakPolarHBondContact O-CB 3.25Å; G504-C507 PolarHBondContact O-N 3.28Å; G504-G553 VanDerWaalsContact O-CA 3.27Å; G504-G553 WeakPolarHBondContact O-CA 3.42Å; G504-G553 PolarHBondContact O-N 3.29Å
505	A	96.4	Very high	95.5	Very high	1 Å²	1	29 Å²	29	1%	0.008	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-64.6	-22.4	-179.5	0	0	0	0	0	113.4	L428 E433 L436 S437 R503 C507 G552	L428-A505 HydrophobicContact CD1-CB 4.08Å; E433-A505 HydrophobicContact CG-CB 3.85Å; E433-A505 WeakPolarHBondContact O-CB 3.33Å; L436-A505 HydrophobicContact CB-CB 3.71Å; S437-A505 VanDerWaalsContact OG-CB 3.26Å; S437-A505 WeakPolarHBondContact OG-CB 3.19Å; S437-A505 PolarHBondContact OG-N 2.9Å; R503-A505 PolarHBondContact O-N 3.39Å; R503-A505 VanDerWaalsContact O-N 3.15Å; A505-C507 VanDerWaalsContact C-N 3.32Å; A505-G552 WeakPolarHBondContact O-CA 3.47Å
506	R	95.5	Very high	95.1	Very high	143 Å²	143	31.9 Å²	31.9	54%	0.54	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-80.9	-8.5	175.2	-60.1	-170.5	178.2	173.8	8.2	113.6	E433 Y498 R503 G504 N508 S577	E433-R506 HydrophobicContact CG-CG 4.3Å; E433-R506 WeakPolarHBondContact OE1-CG 3.41Å; E433-R506 IonicContact OE1-CZ 2.91Å; E433-R506 IonicContact OE1-NE 2.95Å; E433-R506 PolarHBondContact OE1-NE 2.96Å; E433-R506 IonicContact OE1-NH2 3.86Å; E433-R506 PolarHBondContact OE1-NH2 2.93Å; E433-R506 IonicContact OE2-CZ 3.84Å; E433-R506 IonicContact OE2-NE 3.48Å; E433-R506 PolarHBondContact OE2-NE 2.89Å; E433-R506 IonicContact OE2-NH2 3.21Å; E433-R506 PolarHBondContact OE2-NH2 2.97Å; Y498-R506 HydrophobicContact CD1-CB 4.25Å; Y498-R506 HydrophobicContact CE1-CB 4.31Å; R503-R506 WeakPolarHBondContact O-CB 3.32Å; R503-R506 PolarHBondContact O-N 3.21Å; G504-R506 PolarHBondContact O-N 3.41Å; R506-N508 PolarHBondContact O-N 3.49Å; R506-S577 WeakPolarHBondContact O-CB 3.37Å; R506-S577 PolarHBondContact O-OG 2.92Å; R506-S577 VanDerWaalsContact O-OG 3.13Å
507	C	97.3	Very high	94.5	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.15	C	C	.	.			trans	-88.2	92.8	-178.7	-171.3	0	0	0	0	111.2	L495 Y498 G504 A505 G553 A554	L495-C507 HydrophobicContact CD1-CB 4.23Å; Y498-C507 HydrophobicContact CD1-CB 3.77Å; Y498-C507 HydrophobicContact CD2-CB 4.43Å; Y498-C507 HydrophobicContact CG-CB 3.68Å; G504-C507 WeakPolarHBondContact O-CB 3.25Å; G504-C507 PolarHBondContact O-N 3.28Å; A505-C507 VanDerWaalsContact C-N 3.32Å; C507-G553 CarbonylContact O-C 3.53Å; C507-G553 WeakPolarHBondContact O-CA 3.4Å; C507-G553 PolarHBondContact O-N 2.86Å; C507-A554 PolarHBondContact O-N 3.45Å
508	N	97.7	Very high	94	Very high	20 Å²	20	28.7 Å²	28.7	11%	0.107	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	109	174.7	-60.3	-45.7	0	0	0	108.6	I420 R506 G552 G553 A554 G575 V576 S577 H578	I420-N508 HydrophobicContact CD1-CB 4.19Å; I420-N508 HydrophobicContact CG1-CB 4.06Å; R506-N508 PolarHBondContact O-N 3.49Å; N508-G552 WeakPolarHBondContact OD1-CA 3.32Å; N508-G553 PolarHBondContact OD1-N 3.21Å; N508-A554 WeakPolarHBondContact CA-O 3.46Å; N508-A554 PolarHBondContact OD1-N 3.16Å; N508-G575 VanDerWaalsContact CB-O 3.31Å; N508-G575 WeakPolarHBondContact CB-O 3.19Å; N508-G575 PolarHBondContact ND2-O 3.16Å; N508-V576 WeakPolarHBondContact O-CG1 3.23Å; N508-S577 PolarHBondContact N-OG 2.93Å; N508-S577 PolarHBondContact O-N 2.85Å; N508-S577 PolarHBondContact O-OG 3.14Å; N508-H578 PolarHBondContact O-N 3.33Å
509	V	98.5	Very high	93.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	128.4	-172.3	-172.8	0	0	0	0	109.4	I511 A554 L555 L556 H578 I580	V509-I511 HydrophobicContact CB-CD1 4.13Å; V509-I511 HydrophobicContact CG1-CD1 3.65Å; V509-I511 HydrophobicContact CG1-CG1 3.9Å; V509-A554 PolarHBondContact N-O 3.38Å; V509-L555 HydrophobicContact CB-CD2 3.69Å; V509-L555 HydrophobicContact CG1-CD2 4.5Å; V509-L555 HydrophobicContact CG2-CD2 3.72Å; V509-L556 PolarHBondContact O-N 2.91Å; V509-H578 WeakPolarHBondContact CA-O 3.31Å; V509-H578 HydrophobicContact CB-CB 4.41Å; V509-H578 HydrophobicContact CG1-CB 4.01Å; V509-H578 HydrophobicContact CG2-CB 4.1Å; V509-I580 HydrophobicContact CG1-CD1 3.79Å; V509-I580 HydrophobicContact CG1-CG1 3.85Å
510	I	98.6	Very high	93.5	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	128.3	166.9	-61.1	179.2	0	0	0	108.2	P419 I420 L556 L563 V576 H578 V579 I580	P419-I510 HydrophobicContact CB-CD1 3.82Å; I420-I510 HydrophobicContact CD1-CD1 4.33Å; I420-I510 HydrophobicContact CD1-CG1 3.76Å; I510-L556 WeakPolarHBondContact CA-O 3.45Å; I510-L563 HydrophobicContact CD1-CD1 3.96Å; I510-L563 HydrophobicContact CG2-CD1 4.2Å; I510-L563 HydrophobicContact CG2-CD2 4.19Å; I510-V576 HydrophobicContact CD1-CG1 4.23Å; I510-V576 HydrophobicContact CD1-CG2 3.77Å; I510-V576 HydrophobicContact CG1-CG1 4.13Å; I510-V576 HydrophobicContact CG1-CG2 4.32Å; I510-H578 PolarHBondContact N-O 3.04Å; I510-V579 CarbonylContact O-C 3.59Å; I510-V579 WeakPolarHBondContact O-CA 3.45Å; I510-I580 PolarHBondContact O-N 2.87Å
511	I	98.4	Very high	93.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	114.3	178.5	-53	89.7	0	0	0	108.3	P491 V509 L555 L556 F557 C558 I580	P491-I511 HydrophobicContact CB-CD1 4.26Å; P491-I511 HydrophobicContact CB-CG1 4.34Å; P491-I511 HydrophobicContact CG-CD1 4.45Å; P491-I511 HydrophobicContact CG-CG1 4.01Å; V509-I511 HydrophobicContact CB-CD1 4.13Å; V509-I511 HydrophobicContact CG1-CD1 3.65Å; V509-I511 HydrophobicContact CG1-CG1 3.9Å; I511-L555 HydrophobicContact CD1-CB 4.34Å; I511-L556 PolarHBondContact N-O 2.85Å; I511-F557 HydrophobicContact CB-CD1 3.73Å; I511-F557 HydrophobicContact CB-CE1 3.83Å; I511-F557 HydrophobicContact CB-CG 4.32Å; I511-F557 HydrophobicContact CD1-CD2 4.43Å; I511-F557 HydrophobicContact CD1-CE1 4.29Å; I511-F557 HydrophobicContact CD1-CE2 4.2Å; I511-F557 HydrophobicContact CD1-CZ 4.12Å; I511-F557 HydrophobicContact CG1-CD1 4.39Å; I511-F557 HydrophobicContact CG1-CE1 4.08Å; I511-F557 HydrophobicContact CG1-CZ 4.32Å; I511-F557 HydrophobicContact CG2-CD1 3.78Å; I511-F557 HydrophobicContact CG2-CE1 3.7Å; I511-F557 CarbonylContact O-C 3.55Å; I511-F557 VanDerWaalsContact O-CA 3.3Å; I511-F557 WeakPolarHBondContact O-CA 3.41Å; I511-C558 PolarHBondContact O-N 3.2Å; I511-I580 CarbonylContact C-O 3.55Å; I511-I580 WeakPolarHBondContact CA-O 3.33Å; I511-I580 HydrophobicContact CB-CB 4.39Å; I511-I580 HydrophobicContact CG1-CB 4.1Å; I511-I580 HydrophobicContact CG1-CD1 4.03Å; I511-I580 HydrophobicContact CG1-CG1 4.31Å; I511-I580 HydrophobicContact CG2-CB 4.16Å; I511-I580 HydrophobicContact CG2-CG2 4.24Å
512	T	98	Very high	92.8	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.006	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	140.6	177.1	64.5	0	0	0	0	111.6	C558 L563 I580 V581 D582 L594	T512-C558 CarbonylContact C-O 3.52Å; T512-C558 VanDerWaalsContact CA-O 3.27Å; T512-C558 WeakPolarHBondContact CA-O 3.37Å; T512-L563 HydrophobicContact CG2-CB 3.92Å; T512-L563 HydrophobicContact CG2-CD2 3.46Å; T512-L563 VanDerWaalsContact CG2-CD2 3.46Å; T512-L563 HydrophobicContact CG2-CG 4.35Å; T512-I580 PolarHBondContact N-O 2.82Å; T512-V581 WeakPolarHBondContact OG1-CA 3.33Å; T512-D582 WeakPolarHBondContact O-CB 3.44Å; T512-D582 PolarHBondContact O-N 2.99Å; T512-L594 HydrophobicContact CG2-CD2 4.08Å
513	Q	94.2	Very high	92.7	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	141.1	169.7	-68.5	-70.9	-27.1	0	0	108.8	R515 A519 C558 T559 V560 D582	Q513-R515 VanDerWaalsContact C-N 3.27Å; Q513-R515 PolarHBondContact O-N 2.64Å; Q513-A519 HydrophobicContact CB-CB 4.04Å; Q513-A519 HydrophobicContact CG-CB 4.34Å; Q513-C558 PolarHBondContact N-O 2.76Å; Q513-T559 WeakPolarHBondContact O-CA 3.42Å; Q513-V560 PolarHBondContact O-N 3.11Å; Q513-D582 PolarHBondContact NE2-OD2 3.02Å
514	P	88.3	Confident	92.5	Very high	27 Å²	27	23.1 Å²	23.1	18%	0.175	11%	0.105	C	C	.	.	S	Bend	trans	-65.9	-34.4	178.1	24.1	-31.2	0	0	0	111.2	E583 E586	P514-E583 HydrophobicContact CG-CB 4.02Å; P514-E583 HydrophobicContact CG-CG 4.38Å; P514-E586 VanDerWaalsContact CG-OE1 3.27Å; P514-E586 WeakPolarHBondContact CG-OE1 3.39Å
515	R	85.7	Confident	92.1	Very high	61 Å²	61	29 Å²	29	23%	0.23	13%	0.128	C	C	.	.	S	Bend	trans	-107.1	138.2	-173.9	-59.3	174.4	-167.8	-95.9	-10.5	112.1	Q513 I517 S518 A519 E586 T759	Q513-R515 VanDerWaalsContact C-N 3.27Å; Q513-R515 PolarHBondContact O-N 2.64Å; R515-I517 VanDerWaalsContact C-N 3.34Å; R515-I517 HydrophobicContact CB-CG2 4.23Å; R515-I517 PolarHBondContact O-N 3.04Å; R515-S518 WeakPolarHBondContact O-CB 3.41Å; R515-S518 PolarHBondContact O-N 3.19Å; R515-A519 PolarHBondContact O-N 3.5Å; R515-A519 VanDerWaalsContact O-N 3.14Å; R515-E586 IonicContact CZ-OE2 2.66Å; R515-E586 IonicContact NE-OE1 3.25Å; R515-E586 IonicContact NE-OE2 3.99Å; R515-E586 PolarHBondContact NE-OE2 3.03Å; R515-E586 IonicContact NH2-OE2 2.93Å; R515-E586 PolarHBondContact NH2-OE2 3.49Å; R515-T759 PolarHBondContact NE-OG1 3.36Å
516	R	86.7	Confident	92	Very high	60 Å²	60	29 Å²	29	23%	0.226	13%	0.127	C	C	.	.	H	α-helix	trans	-56.3	-45.5	174.8	173	169.9	173.5	-157.1	-3.3	112.6	S518 A519 V520 V542 E545 T559 M733	R516-S518 PolarHBondContact O-N 3.41Å; R516-A519 PolarHBondContact O-N 3.43Å; R516-V520 WeakPolarHBondContact O-CG2 3.01Å; R516-V520 PolarHBondContact O-N 2.73Å; R516-V520 VanDerWaalsContact O-N 3.16Å; R516-V542 HydrophobicContact CB-CB 4.49Å; R516-V542 HydrophobicContact CG-CB 3.81Å; R516-V542 HydrophobicContact CG-CG1 4.04Å; R516-V542 HydrophobicContact CG-CG2 3.73Å; R516-E545 IonicContact CZ-OE2 3.85Å; R516-E545 IonicContact NE-OE2 3.15Å; R516-E545 IonicContact NH2-OE1 2.75Å; R516-E545 PolarHBondContact NH2-OE1 2.81Å; R516-E545 IonicContact NH2-OE2 2.78Å; R516-E545 PolarHBondContact NH2-OE2 3.48Å; R516-T559 HydrophobicContact CB-CG2 4.21Å; R516-M733 HydrophobicContact CG-CE 4.39Å
517	I	80.8	Confident	91.9	Very high	12 Å²	12	23.2 Å²	23.2	6%	0.062	11%	0.109	C	C	.	.	H	α-helix	trans	-57.5	-39.6	-178.7	-168.3	162.9	0	0	0	111.5	R515 V520 S521 M733 Q736 F740 I761	R515-I517 VanDerWaalsContact C-N 3.34Å; R515-I517 HydrophobicContact CB-CG2 4.23Å; R515-I517 PolarHBondContact O-N 3.04Å; I517-V520 PolarHBondContact O-N 3.37Å; I517-S521 WeakPolarHBondContact O-CB 3.29Å; I517-S521 PolarHBondContact O-N 2.79Å; I517-S521 PolarHBondContact O-OG 3.24Å; I517-M733 HydrophobicContact CB-CE 3.84Å; I517-M733 HydrophobicContact CB-SD 3.56Å; I517-M733 VanDerWaalsContact CB-SD 3.56Å; I517-M733 HydrophobicContact CD1-SD 3.95Å; I517-M733 HydrophobicContact CG1-CE 3.93Å; I517-M733 HydrophobicContact CG1-SD 3.84Å; I517-Q736 HydrophobicContact CD1-CB 4.29Å; I517-F740 HydrophobicContact CD1-CE2 4.08Å; I517-F740 HydrophobicContact CD1-CZ 4.17Å; I517-I761 HydrophobicContact CD1-CD1 4.22Å; I517-I761 HydrophobicContact CG2-CD1 4.1Å; I517-I761 HydrophobicContact CG2-CG1 3.99Å
518	S	86.4	Confident	91.5	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-71.9	-46.2	-177.6	-51.1	0	0	0	0	112	R515 R516 V520 S521 V522 S760	R515-S518 WeakPolarHBondContact O-CB 3.41Å; R515-S518 PolarHBondContact O-N 3.19Å; R516-S518 PolarHBondContact O-N 3.41Å; S518-V520 VanDerWaalsContact C-N 3.26Å; S518-V520 PolarHBondContact O-N 3.28Å; S518-S521 PolarHBondContact O-N 3.38Å; S518-S521 PolarHBondContact O-OG 2.77Å; S518-V522 WeakPolarHBondContact O-CB 3.34Å; S518-V522 WeakPolarHBondContact O-CG2 3.27Å; S518-V522 PolarHBondContact O-N 2.85Å; S518-S760 WeakPolarHBondContact OG-CB 3.32Å
519	A	91.7	Very high	91.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-53.8	-44.8	172.8	0	0	0	0	0	111.8	Q513 R515 R516 A523 V542	Q513-A519 HydrophobicContact CB-CB 4.04Å; Q513-A519 HydrophobicContact CG-CB 4.34Å; R515-A519 PolarHBondContact O-N 3.5Å; R515-A519 VanDerWaalsContact O-N 3.14Å; R516-A519 PolarHBondContact O-N 3.43Å; A519-A523 VanDerWaalsContact O-CB 3.24Å; A519-A523 WeakPolarHBondContact O-CB 3.27Å; A519-A523 PolarHBondContact O-N 2.85Å; A519-V542 HydrophobicContact CB-CG1 3.66Å
520	V	89.9	Confident	90.7	Very high	9 Å²	9	28.7 Å²	28.7	6%	0.055	13%	0.134	C	C	.	.	H	α-helix	trans	-71.3	-50.7	-179.7	179	0	0	0	0	111.8	R516 I517 S518 A523 Q524 F540 V542	R516-V520 WeakPolarHBondContact O-CG2 3.01Å; R516-V520 PolarHBondContact O-N 2.73Å; R516-V520 VanDerWaalsContact O-N 3.16Å; I517-V520 PolarHBondContact O-N 3.37Å; S518-V520 VanDerWaalsContact C-N 3.26Å; S518-V520 PolarHBondContact O-N 3.28Å; V520-A523 PolarHBondContact O-N 2.8Å; V520-Q524 VanDerWaalsContact O-CG 3.28Å; V520-Q524 WeakPolarHBondContact O-CG 3.26Å; V520-Q524 PolarHBondContact O-N 2.88Å; V520-F540 HydrophobicContact CG1-CE1 4.41Å; V520-F540 HydrophobicContact CG1-CE2 4.36Å; V520-F540 HydrophobicContact CG1-CZ 4.22Å; V520-F540 HydrophobicContact CG2-CD2 3.77Å; V520-F540 HydrophobicContact CG2-CE2 3.81Å; V520-F540 HydrophobicContact CG2-CG 4.39Å; V520-F540 HydrophobicContact CG2-CZ 4.47Å; V520-V542 HydrophobicContact CG2-CG1 4.15Å; V520-V542 HydrophobicContact CG2-CG2 4.12Å
521	S	86.4	Confident	90.3	Very high	30 Å²	30	28.9 Å²	28.9	21%	0.21	14%	0.135	C	C	.	.	H	α-helix	trans	-68.7	-38.8	-174.4	64.8	0	0	0	0	112.3	I517 S518 Q524 R525	I517-S521 WeakPolarHBondContact O-CB 3.29Å; I517-S521 PolarHBondContact O-N 2.79Å; I517-S521 PolarHBondContact O-OG 3.24Å; S518-S521 PolarHBondContact O-N 3.38Å; S518-S521 PolarHBondContact O-OG 2.77Å; S521-Q524 PolarHBondContact O-N 3.45Å; S521-R525 WeakPolarHBondContact O-CB 3.3Å; S521-R525 PolarHBondContact O-N 3.02Å
522	V	90.3	Very high	89.7	Confident	15 Å²	15	33.3 Å²	33.3	9%	0.091	16%	0.164	C	C	.	.	H	α-helix	trans	-66.7	-45.2	176.7	175.2	0	0	0	0	110.2	T487 S518 Q524 R525 V526 F557	T487-V522 HydrophobicContact CG2-CB 4.28Å; T487-V522 HydrophobicContact CG2-CG1 3.55Å; T487-V522 HydrophobicContact CG2-CG2 3.74Å; S518-V522 WeakPolarHBondContact O-CB 3.34Å; S518-V522 WeakPolarHBondContact O-CG2 3.27Å; S518-V522 PolarHBondContact O-N 2.85Å; V522-Q524 VanDerWaalsContact C-N 3.3Å; V522-Q524 PolarHBondContact O-N 2.84Å; V522-R525 WeakPolarHBondContact O-CB 3.46Å; V522-R525 PolarHBondContact O-N 3.04Å; V522-R525 VanDerWaalsContact O-N 3.14Å; V522-V526 HydrophobicContact CG1-CG2 4.17Å; V522-V526 WeakPolarHBondContact O-CG2 3.24Å; V522-V526 PolarHBondContact O-N 3.34Å; V522-F557 HydrophobicContact CB-CD1 4.29Å; V522-F557 HydrophobicContact CB-CE1 4.3Å; V522-F557 HydrophobicContact CG1-CD1 3.78Å; V522-F557 HydrophobicContact CG1-CE1 3.32Å; V522-F557 HydrophobicContact CG1-CZ 3.87Å
523	A	94.5	Very high	89.4	Confident	2 Å²	2	35 Å²	35	2%	0.017	18%	0.176	C	C	.	.	H	α-helix	trans	-58.6	-43.1	176.4	0	0	0	0	0	112.1	A519 V520 R525 V526 S527 V538 F540 F557	A519-A523 VanDerWaalsContact O-CB 3.24Å; A519-A523 WeakPolarHBondContact O-CB 3.27Å; A519-A523 PolarHBondContact O-N 2.85Å; V520-A523 PolarHBondContact O-N 2.8Å; A523-R525 VanDerWaalsContact C-N 3.35Å; A523-V526 PolarHBondContact O-N 2.8Å; A523-S527 WeakPolarHBondContact O-CB 3.27Å; A523-S527 PolarHBondContact O-N 2.63Å; A523-V538 HydrophobicContact CB-CG1 4.26Å; A523-V538 WeakPolarHBondContact O-CG1 3.4Å; A523-F540 HydrophobicContact CB-CB 3.77Å; A523-F540 HydrophobicContact CB-CD1 4.08Å; A523-F540 HydrophobicContact CB-CG 4.35Å; A523-F557 HydrophobicContact CB-CB 3.94Å; A523-F557 HydrophobicContact CB-CD2 3.68Å; A523-F557 HydrophobicContact CB-CE2 4.5Å; A523-F557 HydrophobicContact CB-CG 3.96Å
524	Q	91.7	Very high	89.3	Confident	104 Å²	104	35 Å²	35	49%	0.486	18%	0.176	S	C	.	.	H	α-helix	trans	-63	-42.3	176.1	-72.8	173.2	-5.9	0	0	111.8	V520 S521 V522 H528	V520-Q524 VanDerWaalsContact O-CG 3.28Å; V520-Q524 WeakPolarHBondContact O-CG 3.26Å; V520-Q524 PolarHBondContact O-N 2.88Å; S521-Q524 PolarHBondContact O-N 3.45Å; V522-Q524 VanDerWaalsContact C-N 3.3Å; V522-Q524 PolarHBondContact O-N 2.84Å; Q524-H528 WeakPolarHBondContact O-CB 3.31Å; Q524-H528 PolarHBondContact O-N 2.66Å
525	R	88	Confident	89.3	Confident	125 Å²	125	39 Å²	39	47%	0.472	19%	0.187	S	C	.	.	H	α-helix	trans	-63.1	-49.1	176.9	178.1	60.9	-176	-115.5	-5.6	111.8	T488 S521 V522 A523 H528 E529	T488-R525 HydrophobicContact CG2-CG 4.11Å; S521-R525 WeakPolarHBondContact O-CB 3.3Å; S521-R525 PolarHBondContact O-N 3.02Å; V522-R525 WeakPolarHBondContact O-CB 3.46Å; V522-R525 PolarHBondContact O-N 3.04Å; V522-R525 VanDerWaalsContact O-N 3.14Å; A523-R525 VanDerWaalsContact C-N 3.35Å; R525-H528 WeakPolarHBondContact O-CB 3.33Å; R525-H528 PolarHBondContact O-N 3.49Å; R525-E529 IonicContact CZ-OE1 2.62Å; R525-E529 IonicContact NE-OE1 3.9Å; R525-E529 PolarHBondContact NE-OE1 3.45Å; R525-E529 IonicContact NH2-OE1 3.66Å; R525-E529 PolarHBondContact NH2-OE1 3.21Å; R525-E529 WeakPolarHBondContact O-CG 3.42Å; R525-E529 PolarHBondContact O-N 3.05Å
526	V	92.9	Very high	89.6	Confident	0 Å²	0	45 Å²	45	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-65.5	-39.2	179	173.8	0	0	0	0	111.3	T488 Q492 V522 A523 H528 E529 L530 V538 L555 F557	T488-V526 HydrophobicContact CG2-CG2 4.22Å; Q492-V526 HydrophobicContact CG-CG1 3.77Å; V522-V526 HydrophobicContact CG1-CG2 4.17Å; V522-V526 WeakPolarHBondContact O-CG2 3.24Å; V522-V526 PolarHBondContact O-N 3.34Å; A523-V526 PolarHBondContact O-N 2.8Å; V526-H528 VanDerWaalsContact C-N 3.28Å; V526-H528 PolarHBondContact O-N 3.39Å; V526-E529 PolarHBondContact O-N 3.36Å; V526-L530 HydrophobicContact CG1-CD1 4.12Å; V526-L530 HydrophobicContact CG1-CG 4.44Å; V526-L530 WeakPolarHBondContact O-CB 3.28Å; V526-L530 WeakPolarHBondContact O-CG 3.32Å; V526-L530 PolarHBondContact O-N 3.2Å; V526-V538 HydrophobicContact CB-CG1 4.39Å; V526-V538 HydrophobicContact CG1-CG1 4.32Å; V526-V538 HydrophobicContact CG1-CG2 4.06Å; V526-L555 HydrophobicContact CG1-CD1 4.23Å; V526-F557 HydrophobicContact CB-CE2 4.22Å; V526-F557 HydrophobicContact CB-CZ 4.29Å; V526-F557 HydrophobicContact CG1-CE2 4.31Å; V526-F557 HydrophobicContact CG1-CZ 4.45Å; V526-F557 HydrophobicContact CG2-CE2 4.33Å; V526-F557 HydrophobicContact CG2-CZ 3.89Å
527	S	93.3	Very high	90.1	Very high	21 Å²	21	42.5 Å²	42.5	15%	0.147	20%	0.201	C	C	.	.	H	α-helix	trans	-60.5	-37	173.5	-173.2	0	0	0	0	112.3	A523 R535	A523-S527 WeakPolarHBondContact O-CB 3.27Å; A523-S527 PolarHBondContact O-N 2.63Å; S527-R535 WeakPolarHBondContact OG-CB 3.44Å; S527-R535 PolarHBondContact OG-O 3.06Å; S527-R535 VanDerWaalsContact OG-O 3.13Å
528	H	89.5	Confident	90.9	Very high	125 Å²	125	42.4 Å²	42.4	58%	0.579	20%	0.201	S	C	*	.	H	α-helix	trans	-72.1	-45.2	175.3	-179.6	71.9	0	0	0	112.2	Q524 R525 V526 L530 G531	Q524-H528 WeakPolarHBondContact O-CB 3.31Å; Q524-H528 PolarHBondContact O-N 2.66Å; R525-H528 WeakPolarHBondContact O-CB 3.33Å; R525-H528 PolarHBondContact O-N 3.49Å; V526-H528 VanDerWaalsContact C-N 3.28Å; V526-H528 PolarHBondContact O-N 3.39Å; H528-L530 PolarHBondContact O-N 3.36Å; H528-G531 PolarHBondContact O-N 3.16Å; H528-G531 VanDerWaalsContact O-N 3.1Å
529	E	89.1	Confident	91.4	Very high	11 Å²	11	42.5 Å²	42.5	5%	0.051	20%	0.202	C	C	.	.	H	α-helix	trans	-64.4	-36.5	179.6	-74.4	-177.8	178	0	0	113.3	R489 Q492 R525 V526 G531	R489-E529 IonicContact NH1-OE2 3.74Å; Q492-E529 PolarHBondContact NE2-OE2 3.32Å; R525-E529 IonicContact CZ-OE1 2.62Å; R525-E529 IonicContact NE-OE1 3.9Å; R525-E529 PolarHBondContact NE-OE1 3.45Å; R525-E529 IonicContact NH2-OE1 3.66Å; R525-E529 PolarHBondContact NH2-OE1 3.21Å; R525-E529 WeakPolarHBondContact O-CG 3.42Å; R525-E529 PolarHBondContact O-N 3.05Å; V526-E529 PolarHBondContact O-N 3.36Å; E529-G531 PolarHBondContact O-N 3.26Å
530	L	90.9	Very high	91.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-8.6	174.8	-75.6	178.2	0	0	0	113.7	W444 R447 Q492 L495 V526 H528 L534 V538 L555	W444-L530 HydrophobicContact CH2-CD2 4.19Å; W444-L530 HydrophobicContact CZ3-CD2 3.77Å; R447-L530 WeakPolarHBondContact CB-O 3.34Å; Q492-L530 HydrophobicContact CB-CD2 4.21Å; Q492-L530 HydrophobicContact CG-CD1 4.33Å; Q492-L530 HydrophobicContact CG-CD2 3.88Å; Q492-L530 HydrophobicContact CG-CG 4Å; L495-L530 HydrophobicContact CD2-CD1 4.1Å; V526-L530 HydrophobicContact CG1-CD1 4.12Å; V526-L530 HydrophobicContact CG1-CG 4.44Å; V526-L530 WeakPolarHBondContact O-CB 3.28Å; V526-L530 WeakPolarHBondContact O-CG 3.32Å; V526-L530 PolarHBondContact O-N 3.2Å; H528-L530 PolarHBondContact O-N 3.36Å; L530-L534 HydrophobicContact CB-CB 4.09Å; L530-V538 HydrophobicContact CD1-CG2 3.56Å; L530-L555 HydrophobicContact CD1-CD1 4.12Å
531	G	88.8	Confident	91.9	Very high	3 Å²	3	45.3 Å²	45.3	3%	0.031	21%	0.214	C	C	.	.			trans	77.6	171.9	177.3	0	0	0	0	0	115	H528 E529 S533 L534 R535	H528-G531 PolarHBondContact O-N 3.16Å; H528-G531 VanDerWaalsContact O-N 3.1Å; E529-G531 PolarHBondContact O-N 3.26Å; G531-S533 VanDerWaalsContact C-N 3.31Å; G531-S533 PolarHBondContact O-N 3.21Å; G531-L534 PolarHBondContact O-N 3.4Å; G531-R535 PolarHBondContact O-N 3Å; G531-R535 VanDerWaalsContact O-N 3.12Å
532	P	87.5	Confident	92.2	Very high	93 Å²	93	44.1 Å²	44.1	60%	0.604	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-30.9	-169.1	24.4	-34.1	0	0	0	114	R535	P532-R535 WeakPolarHBondContact O-CG 3.43Å
533	S	90.2	Very high	92.1	Very high	37 Å²	37	47.1 Å²	47.1	26%	0.259	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-33.5	-178.7	-56.6	0	0	0	0	113.2	R446 G531	R446-S533 PolarHBondContact O-OG 3.02Å; G531-S533 VanDerWaalsContact C-N 3.31Å; G531-S533 PolarHBondContact O-N 3.21Å
534	L	92	Very high	91.6	Very high	0 Å²	0	50 Å²	50	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109	0.8	-176.7	-75	166.1	0	0	0	113.3	L440 L443 W444 R447 L530 G531 R536 N537	L440-L534 HydrophobicContact CD2-CD2 4.29Å; L443-L534 HydrophobicContact CB-CD2 3.89Å; L443-L534 HydrophobicContact CB-CG 4.21Å; W444-L534 HydrophobicContact CB-CD1 4.38Å; W444-L534 HydrophobicContact CD2-CD1 4.27Å; W444-L534 HydrophobicContact CE3-CD1 3.4Å; W444-L534 HydrophobicContact CZ3-CD1 3.96Å; R447-L534 HydrophobicContact CB-CD1 4.18Å; L530-L534 HydrophobicContact CB-CB 4.09Å; G531-L534 PolarHBondContact O-N 3.4Å; L534-R536 PolarHBondContact O-N 3.05Å; L534-N537 VanDerWaalsContact O-CB 3.3Å; L534-N537 WeakPolarHBondContact O-CB 3.36Å; L534-N537 PolarHBondContact O-N 3.27Å
535	R	89.7	Confident	91.3	Very high	110 Å²	110	49 Å²	49	42%	0.415	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-55.3	-27.1	-176.8	81.6	-177.1	-61.4	-164.1	2.1	114.2	S527 G531 P532 N537	S527-R535 WeakPolarHBondContact OG-CB 3.44Å; S527-R535 PolarHBondContact OG-O 3.06Å; S527-R535 VanDerWaalsContact OG-O 3.13Å; G531-R535 PolarHBondContact O-N 3Å; G531-R535 VanDerWaalsContact O-N 3.12Å; P532-R535 WeakPolarHBondContact O-CG 3.43Å; R535-N537 VanDerWaalsContact C-N 3.33Å
536	R	92.4	Very high	91.5	Very high	187 Å²	187	46.5 Å²	46.5	71%	0.706	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-78.2	-16.6	-179.2	-65.8	-177.6	177.5	179.9	-0.5	113	L534 V538 P549 A550	L534-R536 PolarHBondContact O-N 3.05Å; R536-V538 VanDerWaalsContact C-N 3.26Å; R536-P549 WeakPolarHBondContact O-CA 3.24Å; R536-A550 PolarHBondContact O-N 3.13Å
537	N	95.9	Very high	91.6	Very high	9 Å²	9	52.6 Å²	52.6	5%	0.048	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-80.7	-10.5	175.4	-68.3	80.2	0	0	0	112.4	L440 L534 R535 P549 G552 G553 L555	L440-N537 VanDerWaalsContact CD2-ND2 3.28Å; L440-N537 WeakPolarHBondContact CD2-ND2 3.3Å; L534-N537 VanDerWaalsContact O-CB 3.3Å; L534-N537 WeakPolarHBondContact O-CB 3.36Å; L534-N537 PolarHBondContact O-N 3.27Å; R535-N537 VanDerWaalsContact C-N 3.33Å; N537-P549 VanDerWaalsContact C-CB 3.48Å; N537-P549 WeakPolarHBondContact O-CB 3.2Å; N537-G552 PolarHBondContact ND2-O 3.38Å; N537-G553 WeakPolarHBondContact CB-O 3.3Å; N537-G553 PolarHBondContact ND2-O 3.3Å; N537-L555 PolarHBondContact O-N 3.04Å
538	V	97.4	Very high	91.6	Very high	10 Å²	10	54.3 Å²	54.3	6%	0.061	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	126.2	175.8	-171	0	0	0	0	109.3	A523 V526 L530 R536 L555 F557	A523-V538 HydrophobicContact CB-CG1 4.26Å; A523-V538 WeakPolarHBondContact O-CG1 3.4Å; V526-V538 HydrophobicContact CB-CG1 4.39Å; V526-V538 HydrophobicContact CG1-CG1 4.32Å; V526-V538 HydrophobicContact CG1-CG2 4.06Å; L530-V538 HydrophobicContact CD1-CG2 3.56Å; R536-V538 VanDerWaalsContact C-N 3.26Å; V538-L555 WeakPolarHBondContact CA-O 3.49Å; V538-L555 HydrophobicContact CG2-CB 4.43Å; V538-L555 HydrophobicContact CG2-CD1 4.29Å; V538-F557 HydrophobicContact CG1-CD2 4.07Å; V538-F557 HydrophobicContact CG1-CE2 3.92Å
539	G	97.1	Very high	91.9	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.01	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	173.4	176.3	0	0	0	0	0	111.7	K547 L555 F557	G539-K547 CarbonylContact C-O 3.59Å; G539-K547 WeakPolarHBondContact CA-O 3.28Å; G539-L555 PolarHBondContact N-O 2.65Å; G539-F557 PolarHBondContact O-N 3.05Å
540	F	96.9	Very high	91.8	Very high	27 Å²	27	50.5 Å²	50.5	12%	0.118	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	154.8	170	65.9	-90.5	0	0	0	111.6	V520 A523 E545 K547 F557	V520-F540 HydrophobicContact CG1-CE1 4.41Å; V520-F540 HydrophobicContact CG1-CE2 4.36Å; V520-F540 HydrophobicContact CG1-CZ 4.22Å; V520-F540 HydrophobicContact CG2-CD2 3.77Å; V520-F540 HydrophobicContact CG2-CE2 3.81Å; V520-F540 HydrophobicContact CG2-CG 4.39Å; V520-F540 HydrophobicContact CG2-CZ 4.47Å; A523-F540 HydrophobicContact CB-CB 3.77Å; A523-F540 HydrophobicContact CB-CD1 4.08Å; A523-F540 HydrophobicContact CB-CG 4.35Å; F540-E545 HydrophobicContact CE2-CB 4.21Å; F540-K547 HydrophobicContact CD1-CB 4.27Å; F540-K547 HydrophobicContact CE1-CB 3.92Å; F540-K547 HydrophobicContact CE1-CD 4.2Å; F540-K547 HydrophobicContact CZ-CB 4.11Å; F540-K547 PolarHBondContact N-O 2.96Å; F540-K547 CarbonylContact O-C 3.55Å; F540-K547 PolarHBondContact O-N 3.02Å; F540-F557 CarbonylContact C-O 3.57Å; F540-F557 WeakPolarHBondContact CA-O 3.47Å; F540-F557 HydrophobicContact CB-CB 4.31Å; F540-F557 VanDerWaalsContact CB-O 3.32Å; F540-F557 WeakPolarHBondContact CB-O 3.32Å
541	Q	96.5	Very high	91.6	Very high	42 Å²	42	54.2 Å²	54.2	20%	0.196	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	119.4	171.7	-171.5	176.6	6.2	0	0	110.4	L556 F557 C558 T559 I562	Q541-L556 HydrophobicContact CB-CD1 4.04Å; Q541-F557 PolarHBondContact N-O 3.02Å; Q541-C558 HydrophobicContact CB-CB 4.38Å; Q541-C558 WeakPolarHBondContact O-CA 3.3Å; Q541-C558 WeakPolarHBondContact O-CB 3.46Å; Q541-T559 PolarHBondContact O-N 3.27Å; Q541-I562 HydrophobicContact CB-CG2 4.11Å; Q541-I562 HydrophobicContact CG-CD1 4.29Å; Q541-I562 HydrophobicContact CG-CG1 4.47Å; Q541-I562 HydrophobicContact CG-CG2 3.8Å
542	V	92.1	Very high	91.6	Very high	4 Å²	4	54.2 Å²	54.2	2%	0.024	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	170.3	177.5	-57.6	0	0	0	0	108.4	R516 A519 V520 L544 E545 T559	R516-V542 HydrophobicContact CB-CB 4.49Å; R516-V542 HydrophobicContact CG-CB 3.81Å; R516-V542 HydrophobicContact CG-CG1 4.04Å; R516-V542 HydrophobicContact CG-CG2 3.73Å; A519-V542 HydrophobicContact CB-CG1 3.66Å; V520-V542 HydrophobicContact CG2-CG1 4.15Å; V520-V542 HydrophobicContact CG2-CG2 4.12Å; V542-L544 PolarHBondContact O-N 3.24Å; V542-E545 HydrophobicContact CG2-CB 3.71Å; V542-E545 PolarHBondContact N-O 3.33Å; V542-E545 CarbonylContact O-C 3.59Å; V542-E545 PolarHBondContact O-N 3.01Å; V542-E545 VanDerWaalsContact O-N 3.13Å; V542-T559 HydrophobicContact CB-CG2 4.3Å; V542-T559 HydrophobicContact CG1-CG2 3.95Å
543	R	87.7	Confident	92	Very high	78 Å²	78	49.8 Å²	49.8	29%	0.294	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	127.3	178.5	-168.3	173.8	-178.1	157	3.9	110.5	E545 S901	R543-E545 PolarHBondContact O-N 3.29Å; R543-S901 PolarHBondContact NH1-O 3.45Å; R543-S901 PolarHBondContact NH2-O 2.87Å; R543-S901 VanDerWaalsContact NH2-O 3.12Å
544	L	84.5	Confident	92.4	Very high	64 Å²	64	48 Å²	48	34%	0.335	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.5	1.1	-177.4	-54.3	177.1	0	0	0	117.1	V542 F997 G1000 L1001 Q1004	V542-L544 PolarHBondContact O-N 3.24Å; L544-F997 HydrophobicContact CD1-CD2 3.85Å; L544-F997 HydrophobicContact CD1-CE2 3.63Å; L544-F997 HydrophobicContact CD1-CG 4.43Å; L544-F997 HydrophobicContact CD1-CZ 4.05Å; L544-G1000 WeakPolarHBondContact CD2-O 3.19Å; L544-L1001 HydrophobicContact CD1-CD2 4.05Å; L544-L1001 HydrophobicContact CD1-CG 4.15Å; L544-Q1004 HydrophobicContact CD2-CB 3.62Å; L544-Q1004 HydrophobicContact CD2-CG 4.15Å
545	E	86.2	Confident	92.7	Very high	83 Å²	83	48 Å²	48	39%	0.388	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	122.8	176.5	-80.7	176.1	-174	0	0	110.6	R516 F540 V542 R543	R516-E545 IonicContact CZ-OE2 3.85Å; R516-E545 IonicContact NE-OE2 3.15Å; R516-E545 IonicContact NH2-OE1 2.75Å; R516-E545 PolarHBondContact NH2-OE1 2.81Å; R516-E545 IonicContact NH2-OE2 2.78Å; R516-E545 PolarHBondContact NH2-OE2 3.48Å; F540-E545 HydrophobicContact CE2-CB 4.21Å; V542-E545 HydrophobicContact CG2-CB 3.71Å; V542-E545 PolarHBondContact N-O 3.33Å; V542-E545 CarbonylContact O-C 3.59Å; V542-E545 PolarHBondContact O-N 3.01Å; V542-E545 VanDerWaalsContact O-N 3.13Å; R543-E545 PolarHBondContact O-N 3.29Å
546	S	91.8	Very high	93.1	Very high	72 Å²	72	42.8 Å²	42.8	50%	0.503	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	127.8	-179.6	-169.6	0	0	0	0	110.1
547	K	94.2	Very high	93.4	Very high	127 Å²	127	33.9 Å²	33.9	55%	0.552	18%	0.175	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-137	76.7	169.5	-171.4	174.6	-178.1	172.5	0	107.4	G539 F540	G539-K547 CarbonylContact C-O 3.59Å; G539-K547 WeakPolarHBondContact CA-O 3.28Å; F540-K547 HydrophobicContact CD1-CB 4.27Å; F540-K547 HydrophobicContact CE1-CB 3.92Å; F540-K547 HydrophobicContact CE1-CD 4.2Å; F540-K547 HydrophobicContact CZ-CB 4.11Å; F540-K547 PolarHBondContact N-O 2.96Å; F540-K547 CarbonylContact O-C 3.55Å; F540-K547 PolarHBondContact O-N 3.02Å
548	P	93.9	Very high	93.5	Very high	58 Å²	58	33.5 Å²	33.5	38%	0.377	17%	0.173	S	C	.	.	P	Polyproline II helix	trans	-65.9	147.4	-176.5	27.8	-33.2	0	0	0	110.4
549	P	95.1	Very high	93.4	Very high	7 Å²	7	34 Å²	34	5%	0.045	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-71.5	167.8	173.7	32.4	-34.9	0	0	0	111.4	I420 R536 N537 A554 L556	I420-P549 HydrophobicContact CG2-CG 3.58Å; R536-P549 WeakPolarHBondContact O-CA 3.24Å; N537-P549 VanDerWaalsContact C-CB 3.48Å; N537-P549 WeakPolarHBondContact O-CB 3.2Å; P549-A554 HydrophobicContact CB-CB 4.17Å; P549-A554 HydrophobicContact CG-CB 3.7Å; P549-L556 HydrophobicContact CG-CB 4.31Å
550	A	88.2	Confident	93.4	Very high	48 Å²	48	34.1 Å²	34.1	40%	0.397	18%	0.177	S	C	.	.	P	Polyproline II helix	trans	-62.3	149.3	168.4	0	0	0	0	0	111.3	R536 A554	R536-A550 PolarHBondContact O-N 3.13Å; A550-A554 WeakPolarHBondContact O-CB 3.45Å
551	R	85.4	Confident	93.2	Very high	79 Å²	79	34.7 Å²	34.7	30%	0.298	19%	0.19	S	C	.	.	S	Bend	trans	-68.7	135.9	178.1	-177.9	173.8	168.6	-146.4	-10.9	110.7	T421 M426 P427 L428	T421-R551 HydrophobicContact CG2-CB 4.24Å; M426-R551 PolarHBondContact O-NH2 2.94Å; P427-R551 PolarHBondContact O-NH2 2.88Å; L428-R551 VanDerWaalsContact CD2-NH2 3.31Å
552	G	89.7	Confident	93.1	Very high	3 Å²	3	33.6 Å²	33.6	3%	0.031	19%	0.185	C	C	.	.	S	Bend	trans	80.5	121.1	-178.7	0	0	0	0	0	112.3	A505 N508 N537	A505-G552 WeakPolarHBondContact O-CA 3.47Å; N508-G552 WeakPolarHBondContact OD1-CA 3.32Å; N537-G552 PolarHBondContact ND2-O 3.38Å
553	G	95.9	Very high	93.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.184	C	C	.	.	S	Bend	trans	70.3	38.4	-174.2	0	0	0	0	0	112.3	G504 C507 N508 N537	G504-G553 VanDerWaalsContact O-CA 3.27Å; G504-G553 WeakPolarHBondContact O-CA 3.42Å; G504-G553 PolarHBondContact O-N 3.29Å; C507-G553 CarbonylContact O-C 3.53Å; C507-G553 WeakPolarHBondContact O-CA 3.4Å; C507-G553 PolarHBondContact O-N 2.86Å; N508-G553 PolarHBondContact OD1-N 3.21Å; N537-G553 WeakPolarHBondContact CB-O 3.3Å; N537-G553 PolarHBondContact ND2-O 3.3Å
554	A	97.4	Very high	93.7	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	137	-170.5	0	0	0	0	0	113.4	I420 C507 N508 V509 P549 A550	I420-A554 HydrophobicContact CD1-CB 4.43Å; I420-A554 HydrophobicContact CG1-CB 4.4Å; I420-A554 HydrophobicContact CG2-CB 3.53Å; C507-A554 PolarHBondContact O-N 3.45Å; N508-A554 WeakPolarHBondContact CA-O 3.46Å; N508-A554 PolarHBondContact OD1-N 3.16Å; V509-A554 PolarHBondContact N-O 3.38Å; P549-A554 HydrophobicContact CB-CB 4.17Å; P549-A554 HydrophobicContact CG-CB 3.7Å; A550-A554 WeakPolarHBondContact O-CB 3.45Å
555	L	98.4	Very high	94	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	106	168.1	-57.1	-176.9	0	0	0	108.9	P491 L495 V509 I511 V526 L530 N537 V538 G539 F557	P491-L555 HydrophobicContact CB-CD1 4.11Å; P491-L555 HydrophobicContact CB-CD2 4.24Å; L495-L555 HydrophobicContact CB-CD1 4.48Å; L495-L555 HydrophobicContact CB-CD2 4.37Å; L495-L555 HydrophobicContact CD2-CD1 4.06Å; L495-L555 HydrophobicContact CD2-CG 4.25Å; V509-L555 HydrophobicContact CB-CD2 3.69Å; V509-L555 HydrophobicContact CG1-CD2 4.5Å; V509-L555 HydrophobicContact CG2-CD2 3.72Å; I511-L555 HydrophobicContact CD1-CB 4.34Å; V526-L555 HydrophobicContact CG1-CD1 4.23Å; L530-L555 HydrophobicContact CD1-CD1 4.12Å; N537-L555 PolarHBondContact O-N 3.04Å; V538-L555 WeakPolarHBondContact CA-O 3.49Å; V538-L555 HydrophobicContact CG2-CB 4.43Å; V538-L555 HydrophobicContact CG2-CD1 4.29Å; G539-L555 PolarHBondContact N-O 2.65Å; L555-F557 HydrophobicContact CB-CE2 4.44Å
556	L	98.4	Very high	94.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	111.3	178.5	177.2	65.1	0	0	0	110.6	P419 I420 V509 I510 I511 Q541 P549	P419-L556 WeakPolarHBondContact O-CD2 3.46Å; I420-L556 HydrophobicContact CD1-CB 4.21Å; V509-L556 PolarHBondContact O-N 2.91Å; I510-L556 WeakPolarHBondContact CA-O 3.45Å; I511-L556 PolarHBondContact N-O 2.85Å; Q541-L556 HydrophobicContact CB-CD1 4.04Å; P549-L556 HydrophobicContact CG-CB 4.31Å
557	F	98.2	Very high	94.5	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	125.6	170.2	-68	-94.5	0	0	0	110.5	P491 I511 V522 A523 V526 V538 G539 F540 Q541 L555	P491-F557 HydrophobicContact CB-CZ 4.41Å; P491-F557 HydrophobicContact CG-CZ 4.19Å; I511-F557 HydrophobicContact CB-CD1 3.73Å; I511-F557 HydrophobicContact CB-CE1 3.83Å; I511-F557 HydrophobicContact CB-CG 4.32Å; I511-F557 HydrophobicContact CD1-CD2 4.43Å; I511-F557 HydrophobicContact CD1-CE1 4.29Å; I511-F557 HydrophobicContact CD1-CE2 4.2Å; I511-F557 HydrophobicContact CD1-CZ 4.12Å; I511-F557 HydrophobicContact CG1-CD1 4.39Å; I511-F557 HydrophobicContact CG1-CE1 4.08Å; I511-F557 HydrophobicContact CG1-CZ 4.32Å; I511-F557 HydrophobicContact CG2-CD1 3.78Å; I511-F557 HydrophobicContact CG2-CE1 3.7Å; I511-F557 CarbonylContact O-C 3.55Å; I511-F557 VanDerWaalsContact O-CA 3.3Å; I511-F557 WeakPolarHBondContact O-CA 3.41Å; V522-F557 HydrophobicContact CB-CD1 4.29Å; V522-F557 HydrophobicContact CB-CE1 4.3Å; V522-F557 HydrophobicContact CG1-CD1 3.78Å; V522-F557 HydrophobicContact CG1-CE1 3.32Å; V522-F557 HydrophobicContact CG1-CZ 3.87Å; A523-F557 HydrophobicContact CB-CB 3.94Å; A523-F557 HydrophobicContact CB-CD2 3.68Å; A523-F557 HydrophobicContact CB-CE2 4.5Å; A523-F557 HydrophobicContact CB-CG 3.96Å; V526-F557 HydrophobicContact CB-CE2 4.22Å; V526-F557 HydrophobicContact CB-CZ 4.29Å; V526-F557 HydrophobicContact CG1-CE2 4.31Å; V526-F557 HydrophobicContact CG1-CZ 4.45Å; V526-F557 HydrophobicContact CG2-CE2 4.33Å; V526-F557 HydrophobicContact CG2-CZ 3.89Å; V538-F557 HydrophobicContact CG1-CD2 4.07Å; V538-F557 HydrophobicContact CG1-CE2 3.92Å; G539-F557 PolarHBondContact O-N 3.05Å; F540-F557 CarbonylContact C-O 3.57Å; F540-F557 WeakPolarHBondContact CA-O 3.47Å; F540-F557 HydrophobicContact CB-CB 4.31Å; F540-F557 VanDerWaalsContact CB-O 3.32Å; F540-F557 WeakPolarHBondContact CB-O 3.32Å; Q541-F557 PolarHBondContact N-O 3.02Å; L555-F557 HydrophobicContact CB-CE2 4.44Å
558	C	97.7	Very high	94.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	163.5	-179.1	67.3	0	0	0	0	112.9	I511 T512 Q513 Q541 I562	I511-C558 PolarHBondContact O-N 3.2Å; T512-C558 CarbonylContact C-O 3.52Å; T512-C558 VanDerWaalsContact CA-O 3.27Å; T512-C558 WeakPolarHBondContact CA-O 3.37Å; Q513-C558 PolarHBondContact N-O 2.76Å; Q541-C558 HydrophobicContact CB-CB 4.38Å; Q541-C558 WeakPolarHBondContact O-CA 3.3Å; Q541-C558 WeakPolarHBondContact O-CB 3.46Å; C558-I562 HydrophobicContact CB-CB 4.06Å; C558-I562 HydrophobicContact CB-CG2 3.91Å
559	T	95.8	Very high	94.1	Very high	22 Å²	22	22.5 Å²	22.5	14%	0.135	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	150	166.9	47.5	0	0	0	0	110.4	Q513 R516 Q541 V542 G561 I562 L563	Q513-T559 WeakPolarHBondContact O-CA 3.42Å; R516-T559 HydrophobicContact CB-CG2 4.21Å; Q541-T559 PolarHBondContact O-N 3.27Å; V542-T559 HydrophobicContact CB-CG2 4.3Å; V542-T559 HydrophobicContact CG1-CG2 3.95Å; T559-G561 VanDerWaalsContact C-N 3.27Å; T559-G561 PolarHBondContact O-N 3.11Å; T559-I562 WeakPolarHBondContact O-CB 3.31Å; T559-I562 PolarHBondContact O-N 3.32Å; T559-I562 VanDerWaalsContact OG1-CG1 3.29Å; T559-I562 WeakPolarHBondContact OG1-CG1 3.4Å; T559-L563 PolarHBondContact O-N 3Å
560	V	96.6	Very high	94	Very high	3 Å²	3	22.1 Å²	22.1	2%	0.018	12%	0.124	C	C	.	.	H	α-helix	trans	-49.7	-45.7	179.7	-179.2	0	0	0	0	112.6	Q513 I562 L563 L564 N590 L594	Q513-V560 PolarHBondContact O-N 3.11Å; V560-I562 PolarHBondContact O-N 3.38Å; V560-I562 VanDerWaalsContact O-N 3.14Å; V560-L563 PolarHBondContact O-N 3.47Å; V560-L564 HydrophobicContact CG1-CD1 4.33Å; V560-L564 HydrophobicContact CG1-CG 4.4Å; V560-L564 PolarHBondContact O-N 3.4Å; V560-N590 HydrophobicContact CB-CB 4.28Å; V560-N590 HydrophobicContact CG1-CB 3.75Å; V560-N590 WeakPolarHBondContact CG1-O 3.43Å; V560-L594 HydrophobicContact CG1-CB 4.02Å; V560-L594 HydrophobicContact CG1-CD2 3.95Å
561	G	93.5	Very high	94.2	Very high	39 Å²	39	23.3 Å²	23.3	40%	0.402	13%	0.127	S	C	.	.	H	α-helix	trans	-60.6	-24	178.1	0	0	0	0	0	115.2	T559 R565	T559-G561 VanDerWaalsContact C-N 3.27Å; T559-G561 PolarHBondContact O-N 3.11Å; G561-R565 PolarHBondContact O-N 3.15Å; G561-R565 VanDerWaalsContact O-N 3.14Å
562	I	94.6	Very high	94.6	Very high	18 Å²	18	21 Å²	21	9%	0.092	12%	0.123	C	C	.	.	H	α-helix	trans	-74.3	-40.3	173.9	-66.4	-68.4	0	0	0	110.3	Q541 C558 T559 V560 R565 K566	Q541-I562 HydrophobicContact CB-CG2 4.11Å; Q541-I562 HydrophobicContact CG-CD1 4.29Å; Q541-I562 HydrophobicContact CG-CG1 4.47Å; Q541-I562 HydrophobicContact CG-CG2 3.8Å; C558-I562 HydrophobicContact CB-CB 4.06Å; C558-I562 HydrophobicContact CB-CG2 3.91Å; T559-I562 WeakPolarHBondContact O-CB 3.31Å; T559-I562 PolarHBondContact O-N 3.32Å; T559-I562 VanDerWaalsContact OG1-CG1 3.29Å; T559-I562 WeakPolarHBondContact OG1-CG1 3.4Å; V560-I562 PolarHBondContact O-N 3.38Å; V560-I562 VanDerWaalsContact O-N 3.14Å; I562-R565 PolarHBondContact O-N 2.92Å; I562-K566 HydrophobicContact CG2-CD 4.2Å; I562-K566 VanDerWaalsContact CG2-CE 3.5Å; I562-K566 WeakPolarHBondContact O-CG 3.37Å; I562-K566 PolarHBondContact O-N 2.85Å
563	L	97.4	Very high	94.9	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-67.4	-39.6	174.8	-178.8	54.5	0	0	0	111.4	I510 T512 T559 V560 R565 K566 L567 L573 V579 L594	I510-L563 HydrophobicContact CD1-CD1 3.96Å; I510-L563 HydrophobicContact CG2-CD1 4.2Å; I510-L563 HydrophobicContact CG2-CD2 4.19Å; T512-L563 HydrophobicContact CG2-CB 3.92Å; T512-L563 HydrophobicContact CG2-CD2 3.46Å; T512-L563 VanDerWaalsContact CG2-CD2 3.46Å; T512-L563 HydrophobicContact CG2-CG 4.35Å; T559-L563 PolarHBondContact O-N 3Å; V560-L563 PolarHBondContact O-N 3.47Å; L563-R565 VanDerWaalsContact C-N 3.32Å; L563-R565 PolarHBondContact O-N 2.99Å; L563-K566 HydrophobicContact CD1-CB 4.42Å; L563-K566 PolarHBondContact O-N 2.8Å; L563-K566 VanDerWaalsContact O-N 3.12Å; L563-L567 HydrophobicContact CG-CD1 4.42Å; L563-L567 PolarHBondContact O-N 3.49Å; L563-L573 HydrophobicContact CD1-CD1 4.11Å; L563-L573 HydrophobicContact CD1-CD2 4.08Å; L563-V579 HydrophobicContact CD2-CG1 3.87Å; L563-L594 HydrophobicContact CD2-CD1 3.9Å; L563-L594 HydrophobicContact CD2-CD2 3.88Å; L563-L594 HydrophobicContact CG-CD1 4.05Å
564	L	95.5	Very high	94.8	Very high	5 Å²	5	24.8 Å²	24.8	3%	0.026	14%	0.14	C	C	.	.	H	α-helix	trans	-56	-47.1	172.6	-68.2	177.4	0	0	0	111.2	V560 K566 L567 Q568 N590 F593 L594 L597 H849	V560-L564 HydrophobicContact CG1-CD1 4.33Å; V560-L564 HydrophobicContact CG1-CG 4.4Å; V560-L564 PolarHBondContact O-N 3.4Å; L564-K566 PolarHBondContact O-N 3.33Å; L564-L567 WeakPolarHBondContact O-CB 3.02Å; L564-L567 PolarHBondContact O-N 2.85Å; L564-Q568 PolarHBondContact O-N 3.04Å; L564-N590 HydrophobicContact CD1-CB 4.11Å; L564-F593 HydrophobicContact CD1-CD1 4.16Å; L564-F593 HydrophobicContact CD2-CD1 3.69Å; L564-F593 HydrophobicContact CD2-CE1 4.04Å; L564-L594 HydrophobicContact CD2-CB 3.98Å; L564-L594 HydrophobicContact CD2-CD1 3.95Å; L564-L597 HydrophobicContact CD2-CD1 3.79Å; L564-H849 PolarHBondContact O-CE1 3.04Å; L564-H849 PolarHBondContact O-NE2 2.74Å
565	R	91	Very high	94.6	Very high	100 Å²	100	25.9 Å²	25.9	38%	0.377	15%	0.152	S	C	.	.	H	α-helix	trans	-61.3	-40.7	174.8	-172.4	174.3	-62.6	178.1	1.7	113.1	G561 I562 L563 L567 Q568 S901	G561-R565 PolarHBondContact O-N 3.15Å; G561-R565 VanDerWaalsContact O-N 3.14Å; I562-R565 PolarHBondContact O-N 2.92Å; L563-R565 VanDerWaalsContact C-N 3.32Å; L563-R565 PolarHBondContact O-N 2.99Å; R565-L567 VanDerWaalsContact C-N 3.28Å; R565-L567 PolarHBondContact O-N 3.45Å; R565-Q568 WeakPolarHBondContact O-CB 3.48Å; R565-Q568 PolarHBondContact O-N 3.03Å; R565-Q568 VanDerWaalsContact O-N 3.09Å; R565-S901 PolarHBondContact NH2-OG 3.32Å
566	K	93.4	Very high	94.5	Very high	14 Å²	14	26.3 Å²	26.3	6%	0.061	15%	0.154	C	C	.	.	H	α-helix	trans	-63.5	-33.5	177.5	-71.9	168.4	-177.1	-66.2	0	112.6	P419 I562 L563 L564 Q568 S569 N570	P419-K566 HydrophobicContact CB-CD 4.4Å; P419-K566 VanDerWaalsContact O-CD 3.23Å; P419-K566 WeakPolarHBondContact O-CD 3.42Å; P419-K566 WeakPolarHBondContact O-CE 3.11Å; P419-K566 PolarHBondContact O-NZ 3.46Å; I562-K566 HydrophobicContact CG2-CD 4.2Å; I562-K566 VanDerWaalsContact CG2-CE 3.5Å; I562-K566 WeakPolarHBondContact O-CG 3.37Å; I562-K566 PolarHBondContact O-N 2.85Å; L563-K566 HydrophobicContact CD1-CB 4.42Å; L563-K566 PolarHBondContact O-N 2.8Å; L563-K566 VanDerWaalsContact O-N 3.12Å; L564-K566 PolarHBondContact O-N 3.33Å; K566-Q568 PolarHBondContact O-N 2.81Å; K566-S569 PolarHBondContact O-N 2.9Å; K566-S569 PolarHBondContact O-OG 3.27Å; K566-N570 PolarHBondContact O-N 2.9Å
567	L	94.6	Very high	94.5	Very high	8 Å²	8	27.2 Å²	27.2	4%	0.042	16%	0.16	C	C	.	.	H	α-helix	trans	-66.7	-18.8	174.5	-77.5	164.1	0	0	0	113.2	L563 L564 R565 P571 L573 L594 L597 L601	L563-L567 HydrophobicContact CG-CD1 4.42Å; L563-L567 PolarHBondContact O-N 3.49Å; L564-L567 WeakPolarHBondContact O-CB 3.02Å; L564-L567 PolarHBondContact O-N 2.85Å; R565-L567 VanDerWaalsContact C-N 3.28Å; R565-L567 PolarHBondContact O-N 3.45Å; L567-P571 VanDerWaalsContact O-CA 3.25Å; L567-P571 WeakPolarHBondContact O-CA 3.41Å; L567-L573 HydrophobicContact CD2-CD1 3.89Å; L567-L573 HydrophobicContact CD2-CD2 3.78Å; L567-L573 HydrophobicContact CD2-CG 3.56Å; L567-L573 HydrophobicContact CG-CD2 4.14Å; L567-L573 HydrophobicContact CG-CG 4.39Å; L567-L594 HydrophobicContact CD1-CD1 3.65Å; L567-L597 HydrophobicContact CD1-CB 4.27Å; L567-L597 HydrophobicContact CD1-CD1 3.93Å; L567-L601 HydrophobicContact CD2-CD2 4.02Å
568	Q	90.5	Very high	94.5	Very high	70 Å²	70	27.4 Å²	27.4	33%	0.327	16%	0.161	S	C	.	.	H	α-helix	trans	-74.7	-42.9	175.9	-59.9	172.5	-5.2	0	0	111.1	L564 R565 K566 I848 H849	L564-Q568 PolarHBondContact O-N 3.04Å; R565-Q568 WeakPolarHBondContact O-CB 3.48Å; R565-Q568 PolarHBondContact O-N 3.03Å; R565-Q568 VanDerWaalsContact O-N 3.09Å; K566-Q568 PolarHBondContact O-N 2.81Å; Q568-I848 HydrophobicContact CG-CG2 4.09Å; Q568-H849 WeakPolarHBondContact CG-CE1 3.05Å; Q568-H849 PolarHBondContact NE2-NE2 3.13Å
569	S	88.5	Confident	94.5	Very high	56 Å²	56	27.4 Å²	27.4	39%	0.392	16%	0.161	S	C	.	.	H	α-helix	trans	-89.6	-17	179.9	57.7	0	0	0	0	114.3	S417 K566	S417-S569 WeakPolarHBondContact CB-OG 3.12Å; K566-S569 PolarHBondContact O-N 2.9Å; K566-S569 PolarHBondContact O-OG 3.27Å
570	N	93.9	Very high	94.7	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.155	C	C	.	.			trans	-140.6	80	173.8	-168.5	-25.6	0	0	0	110.5	S417 P419 K566 S572 L573 E574	S417-N570 WeakPolarHBondContact O-CB 3.3Å; S417-N570 PolarHBondContact O-ND2 3.15Å; P419-N570 WeakPolarHBondContact CD-ND2 3.25Å; P419-N570 HydrophobicContact CG-CB 4.04Å; P419-N570 WeakPolarHBondContact CG-ND2 3.49Å; K566-N570 PolarHBondContact O-N 2.9Å; N570-S572 PolarHBondContact O-N 3.3Å; N570-S572 PolarHBondContact OD1-OG 3.46Å; N570-L573 PolarHBondContact O-N 3.17Å; N570-L573 WeakPolarHBondContact OD1-CA 3.43Å; N570-L573 PolarHBondContact OD1-N 2.88Å; N570-E574 PolarHBondContact ND2-O 3.36Å; N570-E574 PolarHBondContact OD1-N 2.77Å
571	P	92.6	Very high	94.7	Very high	72 Å²	72	26.2 Å²	26.2	47%	0.468	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-24.1	-174.6	-24.4	35.1	0	0	0	114.8	L567 L601	L567-P571 VanDerWaalsContact O-CA 3.25Å; L567-P571 WeakPolarHBondContact O-CA 3.41Å; P571-L601 WeakPolarHBondContact O-CD1 3.34Å
572	S	93.3	Very high	94.8	Very high	31 Å²	31	24.4 Å²	24.4	22%	0.217	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-8.5	176.7	56.6	0	0	0	0	113.4	N570 E574 N605	N570-S572 PolarHBondContact O-N 3.3Å; N570-S572 PolarHBondContact OD1-OG 3.46Å; S572-E574 PolarHBondContact O-N 2.92Å; S572-E574 PolarHBondContact OG-N 2.9Å; S572-N605 WeakPolarHBondContact O-CB 3.46Å; S572-N605 PolarHBondContact O-ND2 2.91Å
573	L	95.8	Very high	94.6	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.135	C	C	.	.			trans	47.1	42.9	-165.4	-64.3	-178.7	0	0	0	112.4	P419 L563 L567 N570 G575 V576 V579 L598 L601 L608	P419-L573 HydrophobicContact CB-CD2 4.17Å; P419-L573 HydrophobicContact CG-CD2 4.04Å; L563-L573 HydrophobicContact CD1-CD1 4.11Å; L563-L573 HydrophobicContact CD1-CD2 4.08Å; L567-L573 HydrophobicContact CD2-CD1 3.89Å; L567-L573 HydrophobicContact CD2-CD2 3.78Å; L567-L573 HydrophobicContact CD2-CG 3.56Å; L567-L573 HydrophobicContact CG-CD2 4.14Å; L567-L573 HydrophobicContact CG-CG 4.39Å; N570-L573 PolarHBondContact O-N 3.17Å; N570-L573 WeakPolarHBondContact OD1-CA 3.43Å; N570-L573 PolarHBondContact OD1-N 2.88Å; L573-G575 PolarHBondContact O-N 3.47Å; L573-V576 HydrophobicContact CB-CB 4.17Å; L573-V576 HydrophobicContact CB-CG2 4.16Å; L573-V576 WeakPolarHBondContact O-CB 3.47Å; L573-V576 PolarHBondContact O-N 2.89Å; L573-V579 HydrophobicContact CD1-CG2 3.74Å; L573-L598 HydrophobicContact CD1-CD2 4.46Å; L573-L601 HydrophobicContact CB-CD2 4.25Å; L573-L601 HydrophobicContact CD1-CD2 3.65Å; L573-L601 HydrophobicContact CG-CD2 3.85Å; L573-L608 HydrophobicContact CD1-CD2 4.3Å
574	E	93.4	Very high	94.4	Very high	83 Å²	83	24.4 Å²	24.4	39%	0.388	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	136.5	177.4	-162.2	176.5	162.2	0	0	110.8	L416 Y425 N570 S572 V576	L416-E574 HydrophobicContact CD1-CB 4.29Å; L416-E574 WeakPolarHBondContact CD1-OE2 3.45Å; Y425-E574 HydrophobicContact CE1-CB 4.23Å; Y425-E574 HydrophobicContact CE1-CG 3.7Å; N570-E574 PolarHBondContact ND2-O 3.36Å; N570-E574 PolarHBondContact OD1-N 2.77Å; S572-E574 PolarHBondContact O-N 2.92Å; S572-E574 PolarHBondContact OG-N 2.9Å; E574-V576 VanDerWaalsContact C-N 3.34Å
575	G	93.2	Very high	94.1	Very high	23 Å²	23	25.3 Å²	25.3	24%	0.237	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.6	-10.1	-173.7	0	0	0	0	0	115.6	N508 L573	N508-G575 VanDerWaalsContact CB-O 3.31Å; N508-G575 WeakPolarHBondContact CB-O 3.19Å; N508-G575 PolarHBondContact ND2-O 3.16Å; L573-G575 PolarHBondContact O-N 3.47Å
576	V	97.1	Very high	93.8	Very high	9 Å²	9	22 Å²	22	6%	0.055	13%	0.128	C	C	.	.			trans	-94.8	131.4	173.7	-176.1	0	0	0	0	109.3	P419 N508 I510 L573 E574 H578 V579 L608	P419-V576 HydrophobicContact CB-CG2 3.69Å; P419-V576 HydrophobicContact CG-CG2 3.84Å; N508-V576 WeakPolarHBondContact O-CG1 3.23Å; I510-V576 HydrophobicContact CD1-CG1 4.23Å; I510-V576 HydrophobicContact CD1-CG2 3.77Å; I510-V576 HydrophobicContact CG1-CG1 4.13Å; I510-V576 HydrophobicContact CG1-CG2 4.32Å; L573-V576 HydrophobicContact CB-CB 4.17Å; L573-V576 HydrophobicContact CB-CG2 4.16Å; L573-V576 WeakPolarHBondContact O-CB 3.47Å; L573-V576 PolarHBondContact O-N 2.89Å; E574-V576 VanDerWaalsContact C-N 3.34Å; V576-H578 VanDerWaalsContact CG1-O 3.26Å; V576-H578 WeakPolarHBondContact CG1-O 3.35Å; V576-V579 HydrophobicContact CG1-CG2 4.19Å; V576-L608 HydrophobicContact CB-CD1 4.1Å; V576-L608 HydrophobicContact CG1-CD1 3.87Å; V576-L608 WeakPolarHBondContact O-CD1 3.44Å
577	S	97.5	Very high	93.7	Very high	19 Å²	19	22.6 Å²	22.6	13%	0.133	13%	0.129	C	C	.	.			trans	-95.2	-32.8	176.3	57.8	0	0	0	0	112.9	R506 N508 R609	R506-S577 WeakPolarHBondContact O-CB 3.37Å; R506-S577 PolarHBondContact O-OG 2.92Å; R506-S577 VanDerWaalsContact O-OG 3.13Å; N508-S577 PolarHBondContact N-OG 2.93Å; N508-S577 PolarHBondContact O-N 2.85Å; N508-S577 PolarHBondContact O-OG 3.14Å; S577-R609 PolarHBondContact O-N 2.72Å
578	H	98.6	Very high	93.6	Very high	3 Å²	3	23.6 Å²	23.6	1%	0.014	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	141.2	-179.4	-53.4	73.5	0	0	0	111.9	Y498 N508 V509 I510 V576 R609	Y498-H578 AromaticContact CE2-CE1 3.69Å; Y498-H578 AromaticContact CZ-CE1 3.63Å; Y498-H578 PolarHBondContact OH-CE1 2.88Å; N508-H578 PolarHBondContact O-N 3.33Å; V509-H578 WeakPolarHBondContact CA-O 3.31Å; V509-H578 HydrophobicContact CB-CB 4.41Å; V509-H578 HydrophobicContact CG1-CB 4.01Å; V509-H578 HydrophobicContact CG2-CB 4.1Å; I510-H578 PolarHBondContact N-O 3.04Å; V576-H578 VanDerWaalsContact CG1-O 3.26Å; V576-H578 WeakPolarHBondContact CG1-O 3.35Å; H578-R609 CarbonylContact C-O 3.52Å; H578-R609 VanDerWaalsContact CA-O 3.25Å; H578-R609 WeakPolarHBondContact CA-O 3.41Å
579	V	98.7	Very high	93.8	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	127.6	162.7	174.7	0	0	0	0	108	I510 L563 L573 V576 V581 L598 L608 R609 L610 V611	I510-V579 CarbonylContact O-C 3.59Å; I510-V579 WeakPolarHBondContact O-CA 3.45Å; L563-V579 HydrophobicContact CD2-CG1 3.87Å; L573-V579 HydrophobicContact CD1-CG2 3.74Å; V576-V579 HydrophobicContact CG1-CG2 4.19Å; V579-V581 HydrophobicContact CG1-CG2 4.13Å; V579-L598 HydrophobicContact CG1-CD1 3.96Å; V579-L598 HydrophobicContact CG1-CD2 4.31Å; V579-L598 HydrophobicContact CG2-CD2 4.48Å; V579-L608 HydrophobicContact CG2-CD1 4.23Å; V579-L608 HydrophobicContact CG2-CD2 4.16Å; V579-R609 PolarHBondContact N-O 2.61Å; V579-L610 HydrophobicContact CB-CD1 4.2Å; V579-L610 HydrophobicContact CG1-CD1 4.1Å; V579-L610 WeakPolarHBondContact O-CA 3.29Å; V579-L610 WeakPolarHBondContact O-CD1 3.11Å; V579-V611 PolarHBondContact O-N 2.8Å
580	I	98.6	Very high	94	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	117.1	173.1	-53.4	-174.7	0	0	0	107.7	I490 P491 L494 V509 I510 I511 T512 V611 M613	I490-I580 HydrophobicContact CG2-CD1 4.25Å; P491-I580 HydrophobicContact CG-CD1 4.06Å; L494-I580 HydrophobicContact CD1-CD1 3.95Å; V509-I580 HydrophobicContact CG1-CD1 3.79Å; V509-I580 HydrophobicContact CG1-CG1 3.85Å; I510-I580 PolarHBondContact O-N 2.87Å; I511-I580 CarbonylContact C-O 3.55Å; I511-I580 WeakPolarHBondContact CA-O 3.33Å; I511-I580 HydrophobicContact CB-CB 4.39Å; I511-I580 HydrophobicContact CG1-CB 4.1Å; I511-I580 HydrophobicContact CG1-CD1 4.03Å; I511-I580 HydrophobicContact CG1-CG1 4.31Å; I511-I580 HydrophobicContact CG2-CB 4.16Å; I511-I580 HydrophobicContact CG2-CG2 4.24Å; T512-I580 PolarHBondContact N-O 2.82Å; I580-V611 CarbonylContact C-O 3.57Å; I580-V611 WeakPolarHBondContact CA-O 3.11Å; I580-V611 HydrophobicContact CB-CB 4.45Å; I580-V611 HydrophobicContact CG1-CB 4.07Å; I580-V611 HydrophobicContact CG1-CG2 4.34Å; I580-V611 HydrophobicContact CG2-CB 4.29Å; I580-V611 HydrophobicContact CG2-CG1 4.48Å; I580-M613 HydrophobicContact CG2-CE 3.36Å; I580-M613 HydrophobicContact CG2-CG 3.94Å; I580-M613 HydrophobicContact CG2-SD 3.76Å
581	V	97.7	Very high	94.1	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	101.6	171.2	-170.3	0	0	0	0	107.5	T512 V579 V584 T591 L594 L595 L598 L610 V611 L612 M613	T512-V581 WeakPolarHBondContact OG1-CA 3.33Å; V579-V581 HydrophobicContact CG1-CG2 4.13Å; V581-V584 HydrophobicContact CB-CG1 3.97Å; V581-V584 HydrophobicContact CG1-CG1 3.57Å; V581-V584 WeakPolarHBondContact O-CG1 3.41Å; V581-T591 HydrophobicContact CG1-CG2 3.76Å; V581-L594 HydrophobicContact CG2-CD2 4.09Å; V581-L595 HydrophobicContact CG2-CD2 4.33Å; V581-L598 HydrophobicContact CG2-CD1 3.69Å; V581-L610 HydrophobicContact CG2-CD1 3.96Å; V581-V611 PolarHBondContact N-O 3.31Å; V581-L612 HydrophobicContact CB-CD2 3.85Å; V581-L612 HydrophobicContact CG2-CD2 4.07Å; V581-M613 PolarHBondContact O-N 2.91Å
582	D	94.7	Very high	94.3	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.005	10%	0.099	C	C	.	.			trans	-82.4	159.4	177.8	-156.2	4.1	0	0	0	111.6	T487 T512 Q513 V584 M613	T487-D582 VanDerWaalsContact CB-OD2 3.22Å; T487-D582 WeakPolarHBondContact CB-OD2 3.34Å; T487-D582 WeakPolarHBondContact CG2-OD2 3.46Å; T487-D582 PolarHBondContact OG1-OD2 2.84Å; T512-D582 WeakPolarHBondContact O-CB 3.44Å; T512-D582 PolarHBondContact O-N 2.99Å; Q513-D582 PolarHBondContact NE2-OD2 3.02Å; D582-V584 PolarHBondContact O-N 3.28Å; D582-M613 HydrophobicContact CB-CE 3.64Å; D582-M613 WeakPolarHBondContact OD1-CB 3Å; D582-M613 VanDerWaalsContact OD1-CE 3.29Å; D582-M613 WeakPolarHBondContact OD1-CE 3.37Å; D582-M613 WeakPolarHBondContact OD2-CE 2.99Å
583	E	90.9	Very high	94.5	Very high	18 Å²	18	16.5 Å²	16.5	8%	0.084	9%	0.089	C	C	.	.			trans	54.9	34	174.6	-46.5	-74	-151.3	0	0	113.8	P514 H585 E586 M613 S760	P514-E583 HydrophobicContact CG-CB 4.02Å; P514-E583 HydrophobicContact CG-CG 4.38Å; E583-H585 PolarHBondContact O-N 2.87Å; E583-H585 IonicContact OE2-CE1 3.83Å; E583-H585 PolarHBondContact OE2-CE1 3.17Å; E583-H585 IonicContact OE2-ND1 2.88Å; E583-H585 IonicContact OE2-NE2 2.83Å; E583-E586 HydrophobicContact CB-CG 4.33Å; E583-E586 PolarHBondContact O-N 2.78Å; E583-M613 PolarHBondContact N-O 3.37Å; E583-M613 VanDerWaalsContact N-O 3.12Å; E583-S760 WeakPolarHBondContact CG-OG 3.38Å; E583-S760 PolarHBondContact OE1-OG 3.46Å
584	V	93.2	Very high	94.6	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.089	C	C	.	.	G	3₁₀ helix	trans	-58.1	-15.1	-177.8	-64.4	0	0	0	0	113.7	V581 D582 E586 R587 T591 L612 M613 F622	V581-V584 HydrophobicContact CB-CG1 3.97Å; V581-V584 HydrophobicContact CG1-CG1 3.57Å; V581-V584 WeakPolarHBondContact O-CG1 3.41Å; D582-V584 PolarHBondContact O-N 3.28Å; V584-E586 VanDerWaalsContact C-N 3.34Å; V584-R587 WeakPolarHBondContact O-CD 3.26Å; V584-R587 PolarHBondContact O-N 2.76Å; V584-T591 HydrophobicContact CG1-CG2 4.41Å; V584-L612 HydrophobicContact CG1-CB 4.29Å; V584-L612 HydrophobicContact CG1-CD2 4.26Å; V584-M613 WeakPolarHBondContact CG2-O 3.39Å; V584-M613 PolarHBondContact N-O 3.46Å; V584-F622 HydrophobicContact CB-CE1 4.29Å; V584-F622 HydrophobicContact CB-CE2 4.16Å; V584-F622 HydrophobicContact CB-CZ 3.86Å; V584-F622 HydrophobicContact CG2-CD2 4.03Å; V584-F622 HydrophobicContact CG2-CE1 4.45Å; V584-F622 HydrophobicContact CG2-CE2 3.61Å; V584-F622 HydrophobicContact CG2-CZ 3.85Å; V584-F622 WeakPolarHBondContact O-CZ 3.46Å
585	H	88.2	Confident	94.8	Very high	24 Å²	24	12.5 Å²	12.5	11%	0.111	7%	0.07	C	C	.	.	G	3₁₀ helix	trans	-78.3	-12.9	176.9	64.8	-96.9	0	0	0	115	E583 R587 A615 T616 Q801	E583-H585 PolarHBondContact O-N 2.87Å; E583-H585 IonicContact OE2-CE1 3.83Å; E583-H585 PolarHBondContact OE2-CE1 3.17Å; E583-H585 IonicContact OE2-ND1 2.88Å; E583-H585 IonicContact OE2-NE2 2.83Å; H585-R587 PolarHBondContact O-N 3.16Å; H585-A615 PolarHBondContact ND1-N 3.36Å; H585-A615 VanDerWaalsContact ND1-N 3.19Å; H585-T616 WeakPolarHBondContact CB-O 3.36Å; H585-Q801 PolarHBondContact CD2-NE2 3.39Å; H585-Q801 PolarHBondContact NE2-NE2 3.35Å
586	E	86.2	Confident	95	Very high	32 Å²	32	11.9 Å²	11.9	15%	0.15	6%	0.062	C	C	.	.	G	3₁₀ helix	trans	-65.2	-20.5	169.4	-74.5	-165	-138	0	0	111.3	P514 R515 E583 V584 D588 T759	P514-E586 VanDerWaalsContact CG-OE1 3.27Å; P514-E586 WeakPolarHBondContact CG-OE1 3.39Å; R515-E586 IonicContact CZ-OE2 2.66Å; R515-E586 IonicContact NE-OE1 3.25Å; R515-E586 IonicContact NE-OE2 3.99Å; R515-E586 PolarHBondContact NE-OE2 3.03Å; R515-E586 IonicContact NH2-OE2 2.93Å; R515-E586 PolarHBondContact NH2-OE2 3.49Å; E583-E586 HydrophobicContact CB-CG 4.33Å; E583-E586 PolarHBondContact O-N 2.78Å; V584-E586 VanDerWaalsContact C-N 3.34Å; E586-D588 PolarHBondContact O-N 3.27Å; E586-D588 VanDerWaalsContact O-N 3.17Å; E586-T759 HydrophobicContact CG-CG2 3.84Å; E586-T759 WeakPolarHBondContact OE1-CB 3.24Å; E586-T759 PolarHBondContact OE1-OG1 3.27Å; E586-T759 PolarHBondContact OE2-OG1 3.03Å
587	R	91.1	Very high	95	Very high	26 Å²	26	12 Å²	12	10%	0.098	6%	0.062	C	C	.	.			trans	52.2	34.6	-179.7	-59.7	-55.2	-55.4	-82.9	-3.1	113.3	V584 H585 D592 P832 E833 D864	V584-R587 WeakPolarHBondContact O-CD 3.26Å; V584-R587 PolarHBondContact O-N 2.76Å; H585-R587 PolarHBondContact O-N 3.16Å; R587-D592 IonicContact CZ-OD1 3.2Å; R587-D592 IonicContact CZ-OD2 2.69Å; R587-D592 IonicContact NE-OD1 3.9Å; R587-D592 PolarHBondContact NE-OD1 3.39Å; R587-D592 IonicContact NE-OD2 3.61Å; R587-D592 PolarHBondContact NE-OD2 2.83Å; R587-D592 IonicContact NH2-OD1 3.99Å; R587-D592 IonicContact NH2-OD2 2.82Å; R587-D592 PolarHBondContact NH2-OD2 2.84Å; R587-P832 HydrophobicContact CB-CB 4Å; R587-P832 HydrophobicContact CB-CG 4.35Å; R587-P832 HydrophobicContact CG-CG 4.41Å; R587-P832 VanDerWaalsContact CZ-CG 3.45Å; R587-E833 VanDerWaalsContact O-CG 3.31Å; R587-E833 WeakPolarHBondContact O-CG 3.3Å; R587-E833 PolarHBondContact O-N 2.98Å; R587-E833 VanDerWaalsContact O-N 3.07Å; R587-D864 IonicContact CZ-OD2 3.87Å; R587-D864 VanDerWaalsContact CZ-OD2 3.24Å; R587-D864 IonicContact NH1-OD2 3.71Å; R587-D864 PolarHBondContact NH1-OD2 3.16Å; R587-D864 IonicContact NH2-OD2 3.65Å; R587-D864 PolarHBondContact NH2-OD2 3.09Å
588	D	92.1	Very high	95	Very high	29 Å²	29	11.1 Å²	11.1	16%	0.155	6%	0.055	C	C	.	.			trans	-56.6	140.6	173	167.8	90.3	0	0	0	111.2	E586 N590 T591 D592	E586-D588 PolarHBondContact O-N 3.27Å; E586-D588 VanDerWaalsContact O-N 3.17Å; D588-N590 VanDerWaalsContact C-N 3.32Å; D588-N590 PolarHBondContact O-N 3.24Å; D588-N590 WeakPolarHBondContact OD2-CA 3.49Å; D588-N590 WeakPolarHBondContact OD2-CB 3.31Å; D588-N590 PolarHBondContact OD2-N 2.89Å; D588-T591 WeakPolarHBondContact O-CB 3.44Å; D588-T591 PolarHBondContact O-N 3.42Å; D588-T591 VanDerWaalsContact O-N 3.11Å; D588-T591 PolarHBondContact OD2-N 3.28Å; D588-T591 PolarHBondContact OD2-OG1 3.43Å; D588-D592 PolarHBondContact O-N 3.07Å
589	V	93.7	Very high	94.8	Very high	17 Å²	17	14.9 Å²	14.9	10%	0.103	7%	0.072	C	C	.	.	H	α-helix	trans	-61.4	-38	-173.4	68.4	0	0	0	0	112.9	F593 E833 I834 L842	V589-F593 WeakPolarHBondContact O-CB 3.46Å; V589-F593 PolarHBondContact O-N 3.28Å; V589-F593 VanDerWaalsContact O-N 3.11Å; V589-E833 HydrophobicContact CB-CB 3.92Å; V589-I834 HydrophobicContact CG2-CB 4.12Å; V589-I834 HydrophobicContact CG2-CG1 4.33Å; V589-L842 HydrophobicContact CG1-CD1 4.42Å; V589-L842 HydrophobicContact CG2-CD1 3.51Å; V589-L842 HydrophobicContact CG2-CD2 3.35Å; V589-L842 HydrophobicContact CG2-CG 4.04Å
590	N	94.6	Very high	94.6	Very high	58 Å²	58	16.2 Å²	16.2	31%	0.31	9%	0.086	S	C	.	.	H	α-helix	trans	-75.9	-32.3	178.6	-62.8	-65.6	0	0	0	111.2	V560 L564 D588 F593 L594	V560-N590 HydrophobicContact CB-CB 4.28Å; V560-N590 HydrophobicContact CG1-CB 3.75Å; V560-N590 WeakPolarHBondContact CG1-O 3.43Å; L564-N590 HydrophobicContact CD1-CB 4.11Å; D588-N590 VanDerWaalsContact C-N 3.32Å; D588-N590 PolarHBondContact O-N 3.24Å; D588-N590 WeakPolarHBondContact OD2-CA 3.49Å; D588-N590 WeakPolarHBondContact OD2-CB 3.31Å; D588-N590 PolarHBondContact OD2-N 2.89Å; N590-F593 PolarHBondContact O-N 3.46Å; N590-L594 VanDerWaalsContact O-CB 3.3Å; N590-L594 WeakPolarHBondContact O-CB 3.49Å; N590-L594 PolarHBondContact O-N 2.69Å
591	T	95.8	Very high	94.4	Very high	3 Å²	3	16.4 Å²	16.4	2%	0.018	9%	0.087	C	C	.	.	H	α-helix	trans	-62	-50.6	173.7	-58.9	0	0	0	0	110.3	V581 V584 D588 F593 L594 L595	V581-T591 HydrophobicContact CG1-CG2 3.76Å; V584-T591 HydrophobicContact CG1-CG2 4.41Å; D588-T591 WeakPolarHBondContact O-CB 3.44Å; D588-T591 PolarHBondContact O-N 3.42Å; D588-T591 VanDerWaalsContact O-N 3.11Å; D588-T591 PolarHBondContact OD2-N 3.28Å; D588-T591 PolarHBondContact OD2-OG1 3.43Å; T591-F593 VanDerWaalsContact C-N 3.31Å; T591-F593 PolarHBondContact O-N 2.89Å; T591-L594 WeakPolarHBondContact O-CB 3.27Å; T591-L594 PolarHBondContact O-N 2.92Å; T591-L594 VanDerWaalsContact O-N 3.15Å; T591-L595 WeakPolarHBondContact O-CG 3.26Å; T591-L595 PolarHBondContact O-N 3.47Å
592	D	95.7	Very high	94.3	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-61	-40.7	178	-84.4	12.8	0	0	0	111.3	R587 D588 L595 I596	R587-D592 IonicContact CZ-OD1 3.2Å; R587-D592 IonicContact CZ-OD2 2.69Å; R587-D592 IonicContact NE-OD1 3.9Å; R587-D592 PolarHBondContact NE-OD1 3.39Å; R587-D592 IonicContact NE-OD2 3.61Å; R587-D592 PolarHBondContact NE-OD2 2.83Å; R587-D592 IonicContact NH2-OD1 3.99Å; R587-D592 IonicContact NH2-OD2 2.82Å; R587-D592 PolarHBondContact NH2-OD2 2.84Å; D588-D592 PolarHBondContact O-N 3.07Å; D592-L595 PolarHBondContact O-N 3.33Å; D592-I596 PolarHBondContact O-N 3.1Å
593	F	97.2	Very high	94.1	Very high	1 Å²	1	28.2 Å²	28.2	0%	0.004	13%	0.133	C	C	.	.	H	α-helix	trans	-61.1	-45	173.4	-174.5	-84	0	0	0	112.4	L564 V589 N590 T591 L595 I596 L597 L842 Q845 A846 H849 F858 L859	L564-F593 HydrophobicContact CD1-CD1 4.16Å; L564-F593 HydrophobicContact CD2-CD1 3.69Å; L564-F593 HydrophobicContact CD2-CE1 4.04Å; V589-F593 WeakPolarHBondContact O-CB 3.46Å; V589-F593 PolarHBondContact O-N 3.28Å; V589-F593 VanDerWaalsContact O-N 3.11Å; N590-F593 PolarHBondContact O-N 3.46Å; T591-F593 VanDerWaalsContact C-N 3.31Å; T591-F593 PolarHBondContact O-N 2.89Å; F593-L595 VanDerWaalsContact C-N 3.29Å; F593-L595 PolarHBondContact O-N 3.33Å; F593-I596 WeakPolarHBondContact O-CB 3.27Å; F593-I596 PolarHBondContact O-N 2.94Å; F593-I596 VanDerWaalsContact O-N 3.16Å; F593-L597 HydrophobicContact CD1-CD1 4.22Å; F593-L597 HydrophobicContact CD1-CG 4.48Å; F593-L597 HydrophobicContact CE1-CD1 3.71Å; F593-L597 HydrophobicContact CE1-CG 4.11Å; F593-L597 PolarHBondContact O-N 2.95Å; F593-L842 HydrophobicContact CD2-CD2 4.37Å; F593-L842 HydrophobicContact CD2-CG 3.98Å; F593-L842 WeakPolarHBondContact CE2-O 3.27Å; F593-Q845 HydrophobicContact CE1-CB 4.02Å; F593-Q845 HydrophobicContact CE2-CB 3.91Å; F593-Q845 HydrophobicContact CZ-CB 3.53Å; F593-A846 HydrophobicContact CE2-CB 4.04Å; F593-A846 HydrophobicContact CZ-CB 4.42Å; F593-H849 AromaticContact CE1-CD2 3.96Å; F593-F858 AromaticContact CD2-CE1 3.72Å; F593-F858 HydrophobicContact CD2-CE1 3.72Å; F593-F858 HydrophobicContact CD2-CZ 4.44Å; F593-F858 HydrophobicContact CE1-CZ 4.36Å; F593-F858 HydrophobicContact CE2-CD1 4.1Å; F593-F858 AromaticContact CE2-CE1 3.27Å; F593-F858 HydrophobicContact CE2-CE1 3.27Å; F593-F858 AromaticContact CE2-CZ 3.88Å; F593-F858 HydrophobicContact CE2-CZ 3.88Å; F593-F858 HydrophobicContact CG-CE1 4.5Å; F593-F858 AromaticContact CZ-CE1 3.7Å; F593-F858 HydrophobicContact CZ-CE1 3.7Å; F593-F858 AromaticContact CZ-CZ 3.8Å; F593-F858 HydrophobicContact CZ-CZ 3.8Å; F593-L859 HydrophobicContact CD2-CD2 4.39Å
594	L	97.8	Very high	94.2	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-59	-40.1	175.7	173.7	66.1	0	0	0	111.3	T512 V560 L563 L564 L567 V581 N590 T591 I596 L597 L598	T512-L594 HydrophobicContact CG2-CD2 4.08Å; V560-L594 HydrophobicContact CG1-CB 4.02Å; V560-L594 HydrophobicContact CG1-CD2 3.95Å; L563-L594 HydrophobicContact CD2-CD1 3.9Å; L563-L594 HydrophobicContact CD2-CD2 3.88Å; L563-L594 HydrophobicContact CG-CD1 4.05Å; L564-L594 HydrophobicContact CD2-CB 3.98Å; L564-L594 HydrophobicContact CD2-CD1 3.95Å; L567-L594 HydrophobicContact CD1-CD1 3.65Å; V581-L594 HydrophobicContact CG2-CD2 4.09Å; N590-L594 VanDerWaalsContact O-CB 3.3Å; N590-L594 WeakPolarHBondContact O-CB 3.49Å; N590-L594 PolarHBondContact O-N 2.69Å; T591-L594 WeakPolarHBondContact O-CB 3.27Å; T591-L594 PolarHBondContact O-N 2.92Å; T591-L594 VanDerWaalsContact O-N 3.15Å; L594-I596 VanDerWaalsContact C-N 3.26Å; L594-I596 PolarHBondContact O-N 3.39Å; L594-L597 PolarHBondContact O-N 2.94Å; L594-L597 VanDerWaalsContact O-N 3.15Å; L594-L598 HydrophobicContact CD1-CD1 3.94Å; L594-L598 HydrophobicContact CD1-CD2 4.29Å; L594-L598 HydrophobicContact CD1-CG 3.83Å; L594-L598 HydrophobicContact CD2-CD1 4.07Å; L594-L598 HydrophobicContact CG-CD1 3.66Å; L594-L598 HydrophobicContact CG-CG 4.01Å; L594-L598 WeakPolarHBondContact O-CG 3.42Å; L594-L598 PolarHBondContact O-N 3.41Å
595	L	97.6	Very high	94.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.4	-30.5	178.4	-65.9	179.5	0	0	0	112.8	V581 T591 D592 F593 K599 L612 F622 Y625 F626 V863	V581-L595 HydrophobicContact CG2-CD2 4.33Å; T591-L595 WeakPolarHBondContact O-CG 3.26Å; T591-L595 PolarHBondContact O-N 3.47Å; D592-L595 PolarHBondContact O-N 3.33Å; F593-L595 VanDerWaalsContact C-N 3.29Å; F593-L595 PolarHBondContact O-N 3.33Å; L595-K599 VanDerWaalsContact O-CB 3.3Å; L595-K599 WeakPolarHBondContact O-CB 3.35Å; L595-K599 PolarHBondContact O-N 2.98Å; L595-L612 HydrophobicContact CD2-CD2 3.64Å; L595-F622 HydrophobicContact CD1-CD1 4.2Å; L595-F622 HydrophobicContact CD1-CE1 3.79Å; L595-Y625 HydrophobicContact CB-CE1 4.39Å; L595-F626 HydrophobicContact CB-CZ 4.38Å; L595-F626 HydrophobicContact CD2-CE2 4.19Å; L595-F626 HydrophobicContact CD2-CZ 4.12Å; L595-V863 HydrophobicContact CD1-CG2 4.06Å
596	I	97.1	Very high	94.6	Very high	10 Å²	10	37.2 Å²	37.2	5%	0.051	19%	0.186	C	C	.	.	H	α-helix	trans	-63.3	-50.1	172.1	-58.1	168.9	0	0	0	109.8	D592 F593 L594 K599 G600 F858 K861 A862	D592-I596 PolarHBondContact O-N 3.1Å; F593-I596 WeakPolarHBondContact O-CB 3.27Å; F593-I596 PolarHBondContact O-N 2.94Å; F593-I596 VanDerWaalsContact O-N 3.16Å; L594-I596 VanDerWaalsContact C-N 3.26Å; L594-I596 PolarHBondContact O-N 3.39Å; I596-K599 PolarHBondContact O-N 2.7Å; I596-G600 PolarHBondContact O-N 3.08Å; I596-F858 HydrophobicContact CB-CE1 4.22Å; I596-F858 HydrophobicContact CB-CZ 3.99Å; I596-F858 HydrophobicContact CD1-CD1 4.27Å; I596-F858 HydrophobicContact CD1-CE1 3.78Å; I596-F858 HydrophobicContact CD1-CZ 4.42Å; I596-F858 HydrophobicContact CG2-CD1 4.42Å; I596-F858 HydrophobicContact CG2-CD2 4.31Å; I596-F858 HydrophobicContact CG2-CE1 3.88Å; I596-F858 HydrophobicContact CG2-CE2 3.77Å; I596-F858 HydrophobicContact CG2-CZ 3.53Å; I596-K861 HydrophobicContact CG2-CB 3.99Å; I596-A862 HydrophobicContact CD1-CB 3.9Å; I596-A862 HydrophobicContact CG1-CB 4.37Å
597	L	97.2	Very high	95	Very high	11 Å²	11	39.2 Å²	39.2	6%	0.058	21%	0.208	C	C	.	.	H	α-helix	trans	-63	-47.1	180	-65.3	-176.9	0	0	0	111.6	L564 L567 F593 L594 K599 G600 L601 H849 M850 F858	L564-L597 HydrophobicContact CD2-CD1 3.79Å; L567-L597 HydrophobicContact CD1-CB 4.27Å; L567-L597 HydrophobicContact CD1-CD1 3.93Å; F593-L597 HydrophobicContact CD1-CD1 4.22Å; F593-L597 HydrophobicContact CD1-CG 4.48Å; F593-L597 HydrophobicContact CE1-CD1 3.71Å; F593-L597 HydrophobicContact CE1-CG 4.11Å; F593-L597 PolarHBondContact O-N 2.95Å; L594-L597 PolarHBondContact O-N 2.94Å; L594-L597 VanDerWaalsContact O-N 3.15Å; L597-K599 VanDerWaalsContact C-N 3.3Å; L597-K599 PolarHBondContact O-N 3.1Å; L597-G600 PolarHBondContact O-N 3.04Å; L597-G600 VanDerWaalsContact O-N 3.11Å; L597-L601 WeakPolarHBondContact O-CB 3.35Å; L597-L601 PolarHBondContact O-N 3.12Å; L597-H849 HydrophobicContact CD1-CB 4.34Å; L597-H849 HydrophobicContact CD2-CB 3.89Å; L597-M850 HydrophobicContact CD2-CE 4.21Å; L597-F858 HydrophobicContact CD2-CE2 3.69Å; L597-F858 HydrophobicContact CD2-CZ 3.63Å; L597-F858 HydrophobicContact CG-CZ 4.17Å
598	L	97.5	Very high	95.3	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.3	-35.4	-179.7	-68.7	176.6	0	0	0	112.2	L573 V579 V581 L594 L601 Q602 L610	L573-L598 HydrophobicContact CD1-CD2 4.46Å; V579-L598 HydrophobicContact CG1-CD1 3.96Å; V579-L598 HydrophobicContact CG1-CD2 4.31Å; V579-L598 HydrophobicContact CG2-CD2 4.48Å; V581-L598 HydrophobicContact CG2-CD1 3.69Å; L594-L598 HydrophobicContact CD1-CD1 3.94Å; L594-L598 HydrophobicContact CD1-CD2 4.29Å; L594-L598 HydrophobicContact CD1-CG 3.83Å; L594-L598 HydrophobicContact CD2-CD1 4.07Å; L594-L598 HydrophobicContact CG-CD1 3.66Å; L594-L598 HydrophobicContact CG-CG 4.01Å; L594-L598 WeakPolarHBondContact O-CG 3.42Å; L594-L598 PolarHBondContact O-N 3.41Å; L598-L601 HydrophobicContact CD2-CD2 3.91Å; L598-L601 WeakPolarHBondContact O-CB 3.25Å; L598-L601 PolarHBondContact O-N 2.89Å; L598-Q602 WeakPolarHBondContact O-CG 3.36Å; L598-Q602 PolarHBondContact O-N 2.94Å; L598-Q602 VanDerWaalsContact O-N 3.16Å; L598-L610 HydrophobicContact CB-CD2 4.1Å; L598-L610 HydrophobicContact CD1-CD1 3.75Å; L598-L610 HydrophobicContact CD1-CD2 4.41Å
599	K	96.1	Very high	95.6	Very high	82 Å²	82	39.4 Å²	39.4	36%	0.357	21%	0.207	S	C	.	.	H	α-helix	trans	-64.1	-39.9	173.6	-175.1	171	175	175.8	0	112.3	L595 I596 L597 Y625 F626	L595-K599 VanDerWaalsContact O-CB 3.3Å; L595-K599 WeakPolarHBondContact O-CB 3.35Å; L595-K599 PolarHBondContact O-N 2.98Å; I596-K599 PolarHBondContact O-N 2.7Å; L597-K599 VanDerWaalsContact C-N 3.3Å; L597-K599 PolarHBondContact O-N 3.1Å; K599-Y625 HydrophobicContact CB-CE1 4.46Å; K599-Y625 HydrophobicContact CD-CD1 4.35Å; K599-Y625 HydrophobicContact CD-CE1 3.68Å; K599-Y625 HydrophobicContact CD-CE2 4.08Å; K599-Y625 VanDerWaalsContact CE-O 3.29Å; K599-Y625 WeakPolarHBondContact CE-O 3.18Å; K599-Y625 PolarHBondContact NZ-O 3.42Å; K599-F626 HydrophobicContact CB-CD1 4.34Å; K599-F626 HydrophobicContact CB-CE1 3.66Å; K599-F626 HydrophobicContact CB-CZ 4.32Å; K599-F626 HydrophobicContact CG-CD1 4.3Å; K599-F626 HydrophobicContact CG-CE1 4.11Å
600	G	93.1	Very high	95.9	Very high	29 Å²	29	38.7 Å²	38.7	30%	0.299	20%	0.202	S	C	.	.	H	α-helix	trans	-66	-41	171.8	0	0	0	0	0	112.3	I596 L597 Q602 R603	I596-G600 PolarHBondContact O-N 3.08Å; L597-G600 PolarHBondContact O-N 3.04Å; L597-G600 VanDerWaalsContact O-N 3.11Å; G600-Q602 VanDerWaalsContact C-N 3.26Å; G600-Q602 PolarHBondContact O-N 3.49Å; G600-R603 WeakPolarHBondContact O-CB 3.46Å; G600-R603 PolarHBondContact O-N 3.36Å; G600-R603 VanDerWaalsContact O-N 3.08Å
601	L	95.1	Very high	96.1	Very high	4 Å²	4	36 Å²	36	2%	0.021	19%	0.188	C	C	.	.	H	α-helix	trans	-60.6	-31.7	-178.4	-174.2	56.3	0	0	0	113.4	L567 P571 L573 L597 L598 R603 L604 N605 L608	L567-L601 HydrophobicContact CD2-CD2 4.02Å; P571-L601 WeakPolarHBondContact O-CD1 3.34Å; L573-L601 HydrophobicContact CB-CD2 4.25Å; L573-L601 HydrophobicContact CD1-CD2 3.65Å; L573-L601 HydrophobicContact CG-CD2 3.85Å; L597-L601 WeakPolarHBondContact O-CB 3.35Å; L597-L601 PolarHBondContact O-N 3.12Å; L598-L601 HydrophobicContact CD2-CD2 3.91Å; L598-L601 WeakPolarHBondContact O-CB 3.25Å; L598-L601 PolarHBondContact O-N 2.89Å; L601-R603 PolarHBondContact O-N 2.97Å; L601-L604 HydrophobicContact CD1-CB 4.13Å; L601-L604 HydrophobicContact CD1-CD1 4.49Å; L601-L604 PolarHBondContact O-N 2.66Å; L601-N605 HydrophobicContact CD1-CB 4.32Å; L601-N605 PolarHBondContact O-N 3.35Å; L601-L608 HydrophobicContact CD2-CD2 3.52Å; L601-L608 HydrophobicContact CG-CD2 4.04Å
602	Q	94.4	Very high	96.1	Very high	29 Å²	29	35.8 Å²	35.8	14%	0.136	19%	0.187	C	C	.	.	H	α-helix	trans	-55.8	-24	175.1	-69.5	-61.8	-57.6	0	0	113.5	V475 L598 G600 P606 L608	V475-Q602 HydrophobicContact CG2-CG 4.37Å; L598-Q602 WeakPolarHBondContact O-CG 3.36Å; L598-Q602 PolarHBondContact O-N 2.94Å; L598-Q602 VanDerWaalsContact O-N 3.16Å; G600-Q602 VanDerWaalsContact C-N 3.26Å; G600-Q602 PolarHBondContact O-N 3.49Å; Q602-P606 WeakPolarHBondContact O-CA 3.24Å; Q602-L608 PolarHBondContact NE2-O 2.82Å; Q602-L608 PolarHBondContact OE1-O 3.34Å
603	R	91.8	Very high	96.1	Very high	220 Å²	220	35.8 Å²	35.8	83%	0.83	19%	0.187	S	C	*	.	H	α-helix	trans	-84.1	-33.9	174.6	-59.3	179	-175.6	174.9	-1.1	112.8	G600 L601	G600-R603 WeakPolarHBondContact O-CB 3.46Å; G600-R603 PolarHBondContact O-N 3.36Å; G600-R603 VanDerWaalsContact O-N 3.08Å; L601-R603 PolarHBondContact O-N 2.97Å
604	L	92.1	Very high	95.8	Very high	118 Å²	118	35.8 Å²	35.8	62%	0.618	19%	0.187	S	C	*	.	H	α-helix	trans	-80.5	-34	-179.2	-65.7	171.6	0	0	0	111.9	L601	L601-L604 HydrophobicContact CD1-CB 4.13Å; L601-L604 HydrophobicContact CD1-CD1 4.49Å; L601-L604 PolarHBondContact O-N 2.66Å
605	N	95.6	Very high	94.9	Very high	26 Å²	26	36 Å²	36	14%	0.139	19%	0.189	C	C	.	.			trans	-134.2	82.6	177.4	-174.5	-5.7	0	0	0	110.4	S572 L601 A607 L608	S572-N605 WeakPolarHBondContact O-CB 3.46Å; S572-N605 PolarHBondContact O-ND2 2.91Å; L601-N605 HydrophobicContact CD1-CB 4.32Å; L601-N605 PolarHBondContact O-N 3.35Å; N605-A607 PolarHBondContact O-N 3.18Å; N605-A607 PolarHBondContact OD1-N 2.86Å; N605-L608 HydrophobicContact CB-CB 4.31Å; N605-L608 WeakPolarHBondContact O-CB 3.49Å; N605-L608 PolarHBondContact O-N 2.87Å; N605-L608 PolarHBondContact OD1-N 3.44Å
606	P	94.9	Very high	93.6	Very high	87 Å²	87	37 Å²	37	57%	0.565	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-15.3	-179.9	-21.4	33.9	0	0	0	114.6	Q602 R609	Q602-P606 WeakPolarHBondContact O-CA 3.24Å; P606-R609 PolarHBondContact O-NH1 3.26Å
607	A	95	Very high	92.3	Very high	74 Å²	74	37.8 Å²	37.8	61%	0.612	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-23.1	177.1	0	0	0	0	0	112.2	N605 R609	N605-A607 PolarHBondContact O-N 3.18Å; N605-A607 PolarHBondContact OD1-N 2.86Å; A607-R609 PolarHBondContact O-N 2.82Å
608	L	97.7	Very high	91.5	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.215	C	C	.	.			trans	-67.7	125	-179.4	-172	74.3	0	0	0	111.1	L573 V576 V579 L601 Q602 N605	L573-L608 HydrophobicContact CD1-CD2 4.3Å; V576-L608 HydrophobicContact CB-CD1 4.1Å; V576-L608 HydrophobicContact CG1-CD1 3.87Å; V576-L608 WeakPolarHBondContact O-CD1 3.44Å; V579-L608 HydrophobicContact CG2-CD1 4.23Å; V579-L608 HydrophobicContact CG2-CD2 4.16Å; L601-L608 HydrophobicContact CD2-CD2 3.52Å; L601-L608 HydrophobicContact CG-CD2 4.04Å; Q602-L608 PolarHBondContact NE2-O 2.82Å; Q602-L608 PolarHBondContact OE1-O 3.34Å; N605-L608 HydrophobicContact CB-CB 4.31Å; N605-L608 WeakPolarHBondContact O-CB 3.49Å; N605-L608 PolarHBondContact O-N 2.87Å; N605-L608 PolarHBondContact OD1-N 3.44Å
609	R	98.4	Very high	91	Very high	59 Å²	59	40.3 Å²	40.3	22%	0.223	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	130	174.6	-61.3	-57.8	-174.1	-120.9	4.4	111.4	I470 E471 H473 S577 H578 V579 P606 A607	I470-R609 HydrophobicContact CG2-CB 4.07Å; I470-R609 HydrophobicContact CG2-CG 4.39Å; I470-R609 WeakPolarHBondContact O-CD 3.48Å; I470-R609 PolarHBondContact O-NE 3.36Å; E471-R609 PolarHBondContact O-NE 3.29Å; E471-R609 PolarHBondContact O-NH2 3.08Å; H473-R609 WeakPolarHBondContact O-CD 3.27Å; S577-R609 PolarHBondContact O-N 2.72Å; H578-R609 CarbonylContact C-O 3.52Å; H578-R609 VanDerWaalsContact CA-O 3.25Å; H578-R609 WeakPolarHBondContact CA-O 3.41Å; V579-R609 PolarHBondContact N-O 2.61Å; P606-R609 PolarHBondContact O-NH1 3.26Å; A607-R609 PolarHBondContact O-N 2.82Å
610	L	98.5	Very high	90.8	Very high	2 Å²	2	41 Å²	41	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	125.5	178.5	178.3	58.4	0	0	0	110.8	P474 V475 V476 V579 V581 L598 L612 F626	P474-L610 PolarHBondContact O-N 2.87Å; V475-L610 CarbonylContact C-O 3.57Å; V475-L610 VanDerWaalsContact CA-O 3.27Å; V475-L610 WeakPolarHBondContact CA-O 3.24Å; V475-L610 HydrophobicContact CB-CB 4.47Å; V475-L610 HydrophobicContact CG1-CB 4.2Å; V475-L610 HydrophobicContact CG1-CD2 4.05Å; V475-L610 HydrophobicContact CG1-CG 4.09Å; V475-L610 HydrophobicContact CG2-CB 4.15Å; V475-L610 HydrophobicContact CG2-CD2 4.26Å; V476-L610 PolarHBondContact N-O 2.84Å; V579-L610 HydrophobicContact CB-CD1 4.2Å; V579-L610 HydrophobicContact CG1-CD1 4.1Å; V579-L610 WeakPolarHBondContact O-CA 3.29Å; V579-L610 WeakPolarHBondContact O-CD1 3.11Å; V581-L610 HydrophobicContact CG2-CD1 3.96Å; L598-L610 HydrophobicContact CB-CD2 4.1Å; L598-L610 HydrophobicContact CD1-CD1 3.75Å; L598-L610 HydrophobicContact CD1-CD2 4.41Å; L610-L612 HydrophobicContact CD1-CD2 3.92Å; L610-L612 HydrophobicContact CD2-CD2 4.15Å; L610-L612 HydrophobicContact CG-CD2 3.93Å; L610-L612 HydrophobicContact CG-CG 4.43Å; L610-F626 HydrophobicContact CD2-CD1 4.42Å; L610-F626 HydrophobicContact CD2-CE1 3.69Å; L610-F626 HydrophobicContact CD2-CE2 4.42Å; L610-F626 HydrophobicContact CD2-CZ 3.7Å
611	V	98.4	Very high	90.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	123.3	175.1	-173.1	0	0	0	0	109.1	I470 V476 I478 V579 I580 V581 M613	I470-V611 HydrophobicContact CD1-CG2 3.79Å; I470-V611 HydrophobicContact CG1-CG2 3.93Å; I470-V611 HydrophobicContact CG2-CG2 4.21Å; V476-V611 WeakPolarHBondContact O-CA 3.32Å; I478-V611 HydrophobicContact CD1-CG1 3.6Å; I478-V611 HydrophobicContact CG1-CG1 4.08Å; V579-V611 PolarHBondContact O-N 2.8Å; I580-V611 CarbonylContact C-O 3.57Å; I580-V611 WeakPolarHBondContact CA-O 3.11Å; I580-V611 HydrophobicContact CB-CB 4.45Å; I580-V611 HydrophobicContact CG1-CB 4.07Å; I580-V611 HydrophobicContact CG1-CG2 4.34Å; I580-V611 HydrophobicContact CG2-CB 4.29Å; I580-V611 HydrophobicContact CG2-CG1 4.48Å; V581-V611 PolarHBondContact N-O 3.31Å; V611-M613 HydrophobicContact CG1-CG 4.05Å
612	L	97.6	Very high	90.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	119.5	174.9	-53.6	-177.9	0	0	0	108.7	V475 V476 V477 I478 V581 V584 L595 L610 F622 F626	V475-L612 HydrophobicContact CG1-CD1 4.45Å; V475-L612 HydrophobicContact CG1-CG 4.49Å; V476-L612 PolarHBondContact O-N 2.85Å; V477-L612 CarbonylContact C-O 3.56Å; V477-L612 WeakPolarHBondContact CA-O 3.32Å; V477-L612 HydrophobicContact CG2-CB 4.32Å; V477-L612 HydrophobicContact CG2-CD1 4.25Å; I478-L612 PolarHBondContact N-O 2.74Å; V581-L612 HydrophobicContact CB-CD2 3.85Å; V581-L612 HydrophobicContact CG2-CD2 4.07Å; V584-L612 HydrophobicContact CG1-CB 4.29Å; V584-L612 HydrophobicContact CG1-CD2 4.26Å; L595-L612 HydrophobicContact CD2-CD2 3.64Å; L610-L612 HydrophobicContact CD1-CD2 3.92Å; L610-L612 HydrophobicContact CD2-CD2 4.15Å; L610-L612 HydrophobicContact CG-CD2 3.93Å; L610-L612 HydrophobicContact CG-CG 4.43Å; L612-F622 HydrophobicContact CD1-CB 4.17Å; L612-F622 HydrophobicContact CD1-CD1 4.45Å; L612-F626 HydrophobicContact CD1-CD2 3.7Å; L612-F626 HydrophobicContact CD1-CE2 3.52Å; L612-F626 HydrophobicContact CD1-CZ 4.49Å
613	M	94.9	Very high	90.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	130.7	-179.3	-57.4	-170.4	-54.6	0	0	111	I478 K486 I490 I580 V581 D582 E583 V584 V611	I478-M613 WeakPolarHBondContact O-CA 3.44Å; K486-M613 HydrophobicContact CB-SD 3.99Å; I490-M613 HydrophobicContact CB-SD 4.28Å; I490-M613 HydrophobicContact CD1-SD 3.59Å; I490-M613 VanDerWaalsContact CD1-SD 3.59Å; I490-M613 HydrophobicContact CG2-SD 4.46Å; I580-M613 HydrophobicContact CG2-CE 3.36Å; I580-M613 HydrophobicContact CG2-CG 3.94Å; I580-M613 HydrophobicContact CG2-SD 3.76Å; V581-M613 PolarHBondContact O-N 2.91Å; D582-M613 HydrophobicContact CB-CE 3.64Å; D582-M613 WeakPolarHBondContact OD1-CB 3Å; D582-M613 VanDerWaalsContact OD1-CE 3.29Å; D582-M613 WeakPolarHBondContact OD1-CE 3.37Å; D582-M613 WeakPolarHBondContact OD2-CE 2.99Å; E583-M613 PolarHBondContact N-O 3.37Å; E583-M613 VanDerWaalsContact N-O 3.12Å; V584-M613 WeakPolarHBondContact CG2-O 3.39Å; V584-M613 PolarHBondContact N-O 3.46Å; V611-M613 HydrophobicContact CG1-CG 4.05Å
614	S	90.1	Very high	91	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	139	-176	177.1	0	0	0	0	111.1	I478 S479 G480 K486 T616 N619	I478-S614 PolarHBondContact O-N 2.81Å; S479-S614 WeakPolarHBondContact CA-O 3.44Å; G480-S614 PolarHBondContact N-O 2.65Å; G480-S614 VanDerWaalsContact N-O 3.1Å; K486-S614 WeakPolarHBondContact CE-O 3.32Å; S614-T616 PolarHBondContact OG-O 2.91Å; S614-N619 WeakPolarHBondContact CB-OD1 3.26Å; S614-N619 PolarHBondContact OG-OD1 2.78Å
615	A	80.4	Confident	91.1	Very high	5 Å²	5	35.4 Å²	35.4	4%	0.041	19%	0.185	C	C	.	.	S	Bend	trans	-94.5	-35.5	174.5	0	0	0	0	0	113	G480 T482 H585	G480-A615 VanDerWaalsContact O-CA 3.26Å; G480-A615 WeakPolarHBondContact O-CA 3.28Å; T482-A615 HydrophobicContact CG2-CB 3.8Å; H585-A615 PolarHBondContact ND1-N 3.36Å; H585-A615 VanDerWaalsContact ND1-N 3.19Å
616	T	70.2	Confident	91.2	Very high	22 Å²	22	35.4 Å²	35.4	14%	0.135	18%	0.184	C	C	.	.	S	Bend	trans	-148.3	141.5	-176.9	56.8	0	0	0	0	107.3	H585 S614 I800 Q801	H585-T616 WeakPolarHBondContact CB-O 3.36Å; S614-T616 PolarHBondContact OG-O 2.91Å; T616-I800 HydrophobicContact CG2-CG2 4.27Å; T616-Q801 HydrophobicContact CG2-CG 3.74Å; T616-Q801 PolarHBondContact OG1-NE2 3.44Å
617	G	69.5	Low	91.1	Very high	25 Å²	25	34.8 Å²	34.8	26%	0.258	19%	0.193	S	C	.	.	S	Bend	trans	144.9	174.5	174.8	0	0	0	0	0	114.4	N619 F829	G617-N619 PolarHBondContact O-N 3.41Å; G617-F829 VanDerWaalsContact CA-CE1 3.48Å
618	D	79.3	Confident	91.1	Very high	49 Å²	49	33.7 Å²	33.7	26%	0.262	19%	0.189	S	C	.	.			trans	-76.5	74	173.3	-172.2	-4.4	0	0	0	110	E620 R621 R624 F829	D618-E620 PolarHBondContact O-N 2.84Å; D618-R621 HydrophobicContact CB-CB 3.99Å; D618-R621 VanDerWaalsContact CG-CB 3.43Å; D618-R621 VanDerWaalsContact O-CB 3.25Å; D618-R621 WeakPolarHBondContact O-CB 3.3Å; D618-R621 PolarHBondContact O-N 2.96Å; D618-R621 PolarHBondContact OD1-N 2.78Å; D618-R621 WeakPolarHBondContact OD2-CB 3.41Å; D618-R621 IonicContact OD2-NE 3.81Å; D618-R621 PolarHBondContact OD2-NE 2.89Å; D618-R624 IonicContact OD1-NH2 2.8Å; D618-R624 IonicContact OD2-NH2 3.68Å; D618-F829 HydrophobicContact CB-CE2 4.32Å
619	N	88.7	Confident	91	Very high	16 Å²	16	34.4 Å²	34.4	9%	0.086	19%	0.194	C	C	.	.	H	α-helix	trans	-59.1	-30	178.5	-57.7	-49.9	0	0	0	112.3	V477 S479 S614 G617 R621 F622 S623 V631	V477-N619 HydrophobicContact CG1-CB 4.07Å; S479-N619 WeakPolarHBondContact CB-ND2 3.46Å; S479-N619 PolarHBondContact OG-ND2 2.88Å; S614-N619 WeakPolarHBondContact CB-OD1 3.26Å; S614-N619 PolarHBondContact OG-OD1 2.78Å; G617-N619 PolarHBondContact O-N 3.41Å; N619-R621 PolarHBondContact O-N 3.4Å; N619-F622 PolarHBondContact O-N 3.45Å; N619-S623 PolarHBondContact O-N 3.12Å; N619-V631 HydrophobicContact CB-CG1 3.95Å
620	E	90.9	Very high	91	Very high	95 Å²	95	33.3 Å²	33.3	44%	0.444	19%	0.194	S	C	.	.	H	α-helix	trans	-65	-30.8	175.3	-62.7	-57.8	151.1	0	0	111.6	D618 R624	D618-E620 PolarHBondContact O-N 2.84Å; E620-R624 WeakPolarHBondContact O-CB 3.47Å; E620-R624 VanDerWaalsContact O-CG 3.25Å; E620-R624 WeakPolarHBondContact O-CG 3.41Å; E620-R624 PolarHBondContact O-N 3.04Å; E620-R624 PolarHBondContact O-NE 3.11Å; E620-R624 VanDerWaalsContact O-NE 3.1Å
621	R	91.9	Very high	90.8	Very high	86 Å²	86	35 Å²	35	33%	0.325	20%	0.204	S	C	.	.	H	α-helix	trans	-64.7	-44.3	171.9	-176.2	-179.7	-74.3	-149.6	-14	111.7	D618 N619 R624 Y625 V863 D864	D618-R621 HydrophobicContact CB-CB 3.99Å; D618-R621 VanDerWaalsContact CG-CB 3.43Å; D618-R621 VanDerWaalsContact O-CB 3.25Å; D618-R621 WeakPolarHBondContact O-CB 3.3Å; D618-R621 PolarHBondContact O-N 2.96Å; D618-R621 PolarHBondContact OD1-N 2.78Å; D618-R621 WeakPolarHBondContact OD2-CB 3.41Å; D618-R621 IonicContact OD2-NE 3.81Å; D618-R621 PolarHBondContact OD2-NE 2.89Å; N619-R621 PolarHBondContact O-N 3.4Å; R621-R624 PolarHBondContact O-N 3.08Å; R621-Y625 VanDerWaalsContact O-CB 3.24Å; R621-Y625 WeakPolarHBondContact O-CB 3.26Å; R621-Y625 PolarHBondContact O-N 3.14Å; R621-V863 HydrophobicContact CG-CG1 3.89Å; R621-D864 IonicContact CZ-OD1 3.63Å; R621-D864 IonicContact CZ-OD2 2.69Å; R621-D864 IonicContact NH1-OD1 2.63Å; R621-D864 PolarHBondContact NH1-OD1 2.82Å; R621-D864 IonicContact NH1-OD2 3.81Å; R621-D864 PolarHBondContact NH1-OD2 3.47Å
622	F	94.4	Very high	90.7	Very high	5 Å²	5	35.8 Å²	35.8	2%	0.022	21%	0.209	C	C	.	.	H	α-helix	trans	-65.5	-42.1	175.3	-68.4	-65.2	0	0	0	111.9	V477 V584 L595 L612 N619 Y625 F626 V863	V477-F622 HydrophobicContact CG2-CB 4.06Å; V584-F622 HydrophobicContact CB-CE1 4.29Å; V584-F622 HydrophobicContact CB-CE2 4.16Å; V584-F622 HydrophobicContact CB-CZ 3.86Å; V584-F622 HydrophobicContact CG2-CD2 4.03Å; V584-F622 HydrophobicContact CG2-CE1 4.45Å; V584-F622 HydrophobicContact CG2-CE2 3.61Å; V584-F622 HydrophobicContact CG2-CZ 3.85Å; V584-F622 WeakPolarHBondContact O-CZ 3.46Å; L595-F622 HydrophobicContact CD1-CD1 4.2Å; L595-F622 HydrophobicContact CD1-CE1 3.79Å; L612-F622 HydrophobicContact CD1-CB 4.17Å; L612-F622 HydrophobicContact CD1-CD1 4.45Å; N619-F622 PolarHBondContact O-N 3.45Å; F622-Y625 PolarHBondContact O-N 2.81Å; F622-F626 WeakPolarHBondContact O-CD2 3.23Å; F622-F626 PolarHBondContact O-N 2.9Å; F622-V863 HydrophobicContact CD1-CG2 4.36Å; F622-V863 HydrophobicContact CE1-CG1 4.44Å; F622-V863 HydrophobicContact CE1-CG2 4.19Å
623	S	95.9	Very high	90.4	Very high	8 Å²	8	42.6 Å²	42.6	6%	0.056	24%	0.238	C	C	.	.	H	α-helix	trans	-55.6	-55.2	173.9	173.3	0	0	0	0	111.2	N619 Y625 F626 G627 G628 C629	N619-S623 PolarHBondContact O-N 3.12Å; S623-Y625 VanDerWaalsContact C-N 3.32Å; S623-Y625 PolarHBondContact O-N 3.37Å; S623-F626 CarbonylContact O-C 3.56Å; S623-F626 PolarHBondContact O-N 3.3Å; S623-F626 VanDerWaalsContact O-N 3.13Å; S623-G627 PolarHBondContact O-N 3.1Å; S623-G628 WeakPolarHBondContact O-CA 3.27Å; S623-G628 PolarHBondContact O-N 3.18Å; S623-G628 VanDerWaalsContact OG-C 3.31Å; S623-G628 WeakPolarHBondContact OG-CA 3.43Å; S623-C629 WeakPolarHBondContact CB-O 3.34Å; S623-C629 PolarHBondContact O-N 3.19Å; S623-C629 PolarHBondContact OG-N 2.78Å; S623-C629 PolarHBondContact OG-O 3.04Å
624	R	96.1	Very high	90	Very high	156 Å²	156	42.7 Å²	42.7	59%	0.589	24%	0.239	S	C	*	.	H	α-helix	trans	-57.7	-43.2	177.2	-75.1	178.6	-70.5	146.4	-7.2	112.4	D618 E620 R621 F626 G627	D618-R624 IonicContact OD1-NH2 2.8Å; D618-R624 IonicContact OD2-NH2 3.68Å; E620-R624 WeakPolarHBondContact O-CB 3.47Å; E620-R624 VanDerWaalsContact O-CG 3.25Å; E620-R624 WeakPolarHBondContact O-CG 3.41Å; E620-R624 PolarHBondContact O-N 3.04Å; E620-R624 PolarHBondContact O-NE 3.11Å; E620-R624 VanDerWaalsContact O-NE 3.1Å; R621-R624 PolarHBondContact O-N 3.08Å; R624-F626 PolarHBondContact O-N 2.98Å; R624-G627 PolarHBondContact O-N 3.15Å
625	Y	95.6	Very high	89.2	Confident	29 Å²	29	46.5 Å²	46.5	11%	0.114	26%	0.263	C	S	.	.	H	α-helix	trans	-59.9	-35.6	179	176.4	-102.1	0	0	0	112.4	L595 K599 R621 F622 S623 K861 V863	L595-Y625 HydrophobicContact CB-CE1 4.39Å; K599-Y625 HydrophobicContact CB-CE1 4.46Å; K599-Y625 HydrophobicContact CD-CD1 4.35Å; K599-Y625 HydrophobicContact CD-CE1 3.68Å; K599-Y625 HydrophobicContact CD-CE2 4.08Å; K599-Y625 VanDerWaalsContact CE-O 3.29Å; K599-Y625 WeakPolarHBondContact CE-O 3.18Å; K599-Y625 PolarHBondContact NZ-O 3.42Å; R621-Y625 VanDerWaalsContact O-CB 3.24Å; R621-Y625 WeakPolarHBondContact O-CB 3.26Å; R621-Y625 PolarHBondContact O-N 3.14Å; F622-Y625 PolarHBondContact O-N 2.81Å; S623-Y625 VanDerWaalsContact C-N 3.32Å; S623-Y625 PolarHBondContact O-N 3.37Å; Y625-K861 WeakPolarHBondContact CE2-O 3.08Å; Y625-K861 PolarHBondContact OH-O 2.92Å; Y625-V863 HydrophobicContact CD1-CG2 3.84Å; Y625-V863 HydrophobicContact CD2-CB 4.49Å; Y625-V863 HydrophobicContact CD2-CG2 4.1Å; Y625-V863 HydrophobicContact CE1-CG2 3.95Å; Y625-V863 HydrophobicContact CE2-CG2 4.21Å; Y625-V863 HydrophobicContact CG-CG2 3.92Å
626	F	96.2	Very high	88.5	Confident	26 Å²	26	47.4 Å²	47.4	11%	0.114	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	23	174.4	-75.3	-79.5	0	0	0	114	V475 L595 K599 L610 L612 F622 S623 R624 C629	V475-F626 HydrophobicContact CB-CB 4.29Å; V475-F626 HydrophobicContact CB-CG 4.47Å; V475-F626 HydrophobicContact CG1-CB 4.03Å; V475-F626 HydrophobicContact CG1-CD1 4.19Å; V475-F626 HydrophobicContact CG1-CD2 4.22Å; V475-F626 HydrophobicContact CG1-CG 3.9Å; V475-F626 HydrophobicContact CG2-CB 4.31Å; V475-F626 HydrophobicContact CG2-CD1 3.85Å; V475-F626 HydrophobicContact CG2-CE1 4.5Å; V475-F626 HydrophobicContact CG2-CG 4.26Å; L595-F626 HydrophobicContact CB-CZ 4.38Å; L595-F626 HydrophobicContact CD2-CE2 4.19Å; L595-F626 HydrophobicContact CD2-CZ 4.12Å; K599-F626 HydrophobicContact CB-CD1 4.34Å; K599-F626 HydrophobicContact CB-CE1 3.66Å; K599-F626 HydrophobicContact CB-CZ 4.32Å; K599-F626 HydrophobicContact CG-CD1 4.3Å; K599-F626 HydrophobicContact CG-CE1 4.11Å; L610-F626 HydrophobicContact CD2-CD1 4.42Å; L610-F626 HydrophobicContact CD2-CE1 3.69Å; L610-F626 HydrophobicContact CD2-CE2 4.42Å; L610-F626 HydrophobicContact CD2-CZ 3.7Å; L612-F626 HydrophobicContact CD1-CD2 3.7Å; L612-F626 HydrophobicContact CD1-CE2 3.52Å; L612-F626 HydrophobicContact CD1-CZ 4.49Å; F622-F626 WeakPolarHBondContact O-CD2 3.23Å; F622-F626 PolarHBondContact O-N 2.9Å; S623-F626 CarbonylContact O-C 3.56Å; S623-F626 PolarHBondContact O-N 3.3Å; S623-F626 VanDerWaalsContact O-N 3.13Å; R624-F626 PolarHBondContact O-N 2.98Å; F626-C629 HydrophobicContact CB-CB 4.47Å
627	G	94.4	Very high	88.3	Confident	74 Å²	74	53 Å²	53	76%	0.763	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	27.5	172.2	0	0	0	0	0	115	S623 R624	S623-G627 PolarHBondContact O-N 3.1Å; R624-G627 PolarHBondContact O-N 3.15Å
628	G	94.5	Very high	88.3	Confident	51 Å²	51	54 Å²	54	53%	0.526	29%	0.294	S	S	.	.	S	Bend	trans	81.3	33.8	179.3	0	0	0	0	0	113.6	S623	S623-G628 WeakPolarHBondContact O-CA 3.27Å; S623-G628 PolarHBondContact O-N 3.18Å; S623-G628 VanDerWaalsContact OG-C 3.31Å; S623-G628 WeakPolarHBondContact OG-CA 3.43Å
629	C	96.1	Very high	88.3	Confident	15 Å²	15	56.1 Å²	56.1	10%	0.101	30%	0.299	C	S	.	.			trans	-65	153.7	-179.9	72.7	0	0	0	0	112.4	V475 S623 F626	V475-C629 HydrophobicContact CB-CB 4.05Å; V475-C629 HydrophobicContact CG1-CB 4.46Å; V475-C629 WeakPolarHBondContact O-CB 2.92Å; S623-C629 WeakPolarHBondContact CB-O 3.34Å; S623-C629 PolarHBondContact O-N 3.19Å; S623-C629 PolarHBondContact OG-N 2.78Å; S623-C629 PolarHBondContact OG-O 3.04Å; F626-C629 HydrophobicContact CB-CB 4.47Å
630	P	97	Very high	88.1	Confident	36 Å²	36	59.6 Å²	59.6	23%	0.234	32%	0.323	C	S	.	.			trans	-63.5	140.5	-173.7	25.8	-35.7	0	0	0	112.4	H473 V476 V477	H473-P630 HydrophobicContact CB-CG 4.07Å; V476-P630 HydrophobicContact CG1-CG 4.43Å; V476-P630 HydrophobicContact CG2-CG 4.08Å; V477-P630 PolarHBondContact N-O 3.11Å
631	V	95.7	Very high	88	Confident	36 Å²	36	56.3 Å²	56.3	22%	0.218	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	109.7	172.7	-174.5	0	0	0	0	109	V477 N619	V477-V631 HydrophobicContact CB-CG1 4.42Å; V477-V631 HydrophobicContact CB-CG2 4.16Å; V477-V631 HydrophobicContact CG1-CG1 4.32Å; V477-V631 CarbonylContact O-C 3.52Å; V477-V631 WeakPolarHBondContact O-CA 3.5Å; N619-V631 HydrophobicContact CB-CG1 3.95Å
632	I	94.4	Very high	88.2	Confident	18 Å²	18	58.1 Å²	58.1	9%	0.092	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	118.3	174.8	-53.4	176.9	0	0	0	108.4	I466 A469 V476 V477 S479	I466-I632 HydrophobicContact CB-CD1 4.48Å; I466-I632 HydrophobicContact CG1-CD1 4.15Å; I466-I632 HydrophobicContact CG1-CG2 4.11Å; A469-I632 HydrophobicContact CB-CD1 3.44Å; A469-I632 VanDerWaalsContact CB-CD1 3.44Å; A469-I632 HydrophobicContact CB-CG1 4.36Å; V476-I632 HydrophobicContact CG1-CD1 3.81Å; V476-I632 HydrophobicContact CG1-CG1 4.08Å; V477-I632 PolarHBondContact O-N 2.95Å; S479-I632 PolarHBondContact N-O 3.28Å
633	K	91.5	Very high	88.3	Confident	142 Å²	142	60.4 Å²	60.4	62%	0.617	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	113.2	173.3	-65.9	-179.8	-176.4	174	0	108.8	S479 P635	S479-K633 CarbonylContact O-C 3.56Å; S479-K633 WeakPolarHBondContact O-CA 3.5Å; K633-P635 WeakPolarHBondContact O-CD 3.14Å
634	V	86.7	Confident	88.4	Confident	3 Å²	3	60.7 Å²	60.7	2%	0.018	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	105.5	168.7	179.3	0	0	0	0	106.6	P458 V459 I466 I478 S479 G480 C484 G636	P458-V634 WeakPolarHBondContact O-CG1 3.43Å; V459-V634 HydrophobicContact CB-CG1 4.01Å; V459-V634 HydrophobicContact CG2-CG1 4.35Å; V459-V634 HydrophobicContact CG2-CG2 4.25Å; I466-V634 HydrophobicContact CD1-CG2 3.97Å; I478-V634 HydrophobicContact CG2-CG2 3.96Å; S479-V634 PolarHBondContact O-N 2.8Å; G480-V634 WeakPolarHBondContact CA-O 3.41Å; C484-V634 HydrophobicContact CB-CG1 4.32Å; V634-G636 PolarHBondContact O-N 2.82Å; V634-G636 VanDerWaalsContact O-N 3.16Å
635	P	74.7	Confident	88.3	Confident	79 Å²	79	54.3 Å²	54.3	51%	0.513	31%	0.307	S	S	.	.			trans	-58.7	122.8	175.3	25.2	-31.3	0	0	0	108.5	P458 H462 K633	P458-P635 VanDerWaalsContact CB-O 3.23Å; P458-P635 WeakPolarHBondContact CB-O 3.28Å; H462-P635 VanDerWaalsContact NE2-CD 3.3Å; H462-P635 WeakPolarHBondContact NE2-CD 3.36Å; K633-P635 WeakPolarHBondContact O-CD 3.14Å
636	G	66	Low	88.2	Confident	24 Å²	24	53.9 Å²	53.9	25%	0.247	31%	0.306	C	S	.	.			trans	-78.7	145.5	169.8	0	0	0	0	0	110	V634	V634-G636 PolarHBondContact O-N 2.82Å; V634-G636 VanDerWaalsContact O-N 3.16Å
637	F	65.9	Low	87.9	Confident	140 Å²	140	56.1 Å²	56.1	61%	0.614	32%	0.317	S	S	*	.			trans	-99.2	107.8	154.9	-178.9	-97.2	0	0	0	106.9	P458 Y639	P458-F637 HydrophobicContact CG-CB 4.41Å; F637-Y639 AromaticContact CE1-CD1 3.89Å; F637-Y639 HydrophobicContact CE1-CD1 3.89Å; F637-Y639 HydrophobicContact CE1-CD2 4.16Å; F637-Y639 AromaticContact CE1-CE1 3.98Å; F637-Y639 HydrophobicContact CE1-CE1 3.98Å; F637-Y639 HydrophobicContact CE1-CE2 4.25Å; F637-Y639 AromaticContact CE1-CG 3.98Å; F637-Y639 HydrophobicContact CE1-CG 3.98Å; F637-Y639 HydrophobicContact CZ-CD1 4.47Å
638	M	68.8	Low	87.9	Confident	45 Å²	45	54.7 Å²	54.7	22%	0.222	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-93.3	136.3	159.9	-72.3	-170	-66.7	0	0	107.5
639	Y	78.7	Confident	87.9	Confident	94 Å²	94	52.2 Å²	52.2	37%	0.369	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-59.6	147.3	165.9	-69.6	-93.2	0	0	0	109.1	F637 V641 G807 C809 Q810 S811	F637-Y639 AromaticContact CE1-CD1 3.89Å; F637-Y639 HydrophobicContact CE1-CD1 3.89Å; F637-Y639 HydrophobicContact CE1-CD2 4.16Å; F637-Y639 AromaticContact CE1-CE1 3.98Å; F637-Y639 HydrophobicContact CE1-CE1 3.98Å; F637-Y639 HydrophobicContact CE1-CE2 4.25Å; F637-Y639 AromaticContact CE1-CG 3.98Å; F637-Y639 HydrophobicContact CE1-CG 3.98Å; F637-Y639 HydrophobicContact CZ-CD1 4.47Å; Y639-V641 PolarHBondContact O-N 3.22Å; Y639-G807 PolarHBondContact N-O 2.94Å; Y639-C809 VanDerWaalsContact CE2-C 3.41Å; Y639-C809 VanDerWaalsContact CE2-O 3.26Å; Y639-C809 WeakPolarHBondContact CE2-O 3.47Å; Y639-Q810 VanDerWaalsContact CB-O 3.3Å; Y639-Q810 WeakPolarHBondContact CB-O 2.85Å; Y639-Q810 VanDerWaalsContact CG-C 3.4Å; Y639-S811 VanDerWaalsContact CB-N 3.29Å
640	P	84.7	Confident	87.6	Confident	89 Å²	89	53.3 Å²	53.3	58%	0.578	27%	0.271	S	S	*	.	P	Polyproline II helix	trans	-58.4	129.1	-177.5	22.5	-32.5	0	0	0	110.6	S811 G812	P640-S811 WeakPolarHBondContact CD-OG 3.09Å; P640-S811 WeakPolarHBondContact CG-OG 3.08Å; P640-S811 WeakPolarHBondContact O-CA 3.39Å; P640-S811 WeakPolarHBondContact O-CB 3.28Å; P640-G812 PolarHBondContact O-N 3.32Å; P640-G812 VanDerWaalsContact O-N 3.16Å
641	V	89.9	Confident	87.2	Confident	27 Å²	27	54.6 Å²	54.6	16%	0.164	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	117.9	173.9	-177.8	0	0	0	0	108.2	Y639 E643 R803 A806 G812 A814	Y639-V641 PolarHBondContact O-N 3.22Å; V641-E643 PolarHBondContact O-N 3.16Å; V641-R803 HydrophobicContact CB-CG 4.13Å; V641-R803 HydrophobicContact CG1-CG 3.77Å; V641-A806 HydrophobicContact CG1-CB 4.22Å; V641-A806 HydrophobicContact CG2-CB 4.38Å; V641-G812 CarbonylContact C-O 3.27Å; V641-G812 VanDerWaalsContact CA-O 3.3Å; V641-G812 WeakPolarHBondContact CA-O 3.28Å; V641-A814 HydrophobicContact CG1-CB 3.7Å
642	K	95.8	Very high	86.8	Confident	123 Å²	123	57 Å²	57	54%	0.535	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	120.5	175.7	-171.6	175.7	-173.3	173.8	0	109.5	G812 F813 A814	K642-G812 PolarHBondContact N-O 2.89Å; K642-F813 HydrophobicContact CB-CD1 3.83Å; K642-F813 HydrophobicContact CB-CE1 4.13Å; K642-F813 HydrophobicContact CD-CD1 4.27Å; K642-F813 HydrophobicContact CD-CE1 4.06Å; K642-F813 HydrophobicContact CG-CD1 4.47Å; K642-F813 WeakPolarHBondContact O-CA 3.17Å; K642-A814 PolarHBondContact O-N 3.18Å
643	E	96.3	Very high	86.5	Confident	54 Å²	54	57.6 Å²	57.6	25%	0.252	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	134	-177.9	-57.9	-171.6	-133	0	0	111.3	V641 Y645 R803 A814 H816	V641-E643 PolarHBondContact O-N 3.16Å; E643-Y645 HydrophobicContact CB-CE2 3.96Å; E643-Y645 PolarHBondContact OE2-OH 2.9Å; E643-R803 HydrophobicContact CG-CG 4.4Å; E643-R803 WeakPolarHBondContact OE1-CD 3.34Å; E643-R803 IonicContact OE1-CZ 3.69Å; E643-R803 IonicContact OE1-NE 2.84Å; E643-R803 IonicContact OE1-NH1 2.83Å; E643-R803 PolarHBondContact OE1-NH1 3.34Å; E643-A814 CarbonylContact C-O 3.42Å; E643-A814 WeakPolarHBondContact CA-O 3.36Å; E643-A814 HydrophobicContact CG-CB 4.46Å; E643-H816 IonicContact OE2-CD2 2.66Å; E643-H816 IonicContact OE2-NE2 3.87Å; E643-H816 PolarHBondContact OE2-NE2 3.36Å
644	H	96.7	Very high	85.9	Confident	14 Å²	14	52.2 Å²	52.2	7%	0.065	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	119.9	174.8	-70.1	-61.8	0	0	0	108.4	D648 I649 K652 A814 Y815 H816	H644-D648 HydrophobicContact CB-CB 4.24Å; H644-I649 HydrophobicContact CB-CG1 4.14Å; H644-K652 WeakPolarHBondContact CE1-CE 3.48Å; H644-K652 WeakPolarHBondContact ND1-CE 3.43Å; H644-A814 PolarHBondContact N-O 2.85Å; H644-Y815 HydrophobicContact CB-CD1 3.75Å; H644-Y815 HydrophobicContact CB-CE1 4.22Å; H644-Y815 AromaticContact CD2-CD1 3.93Å; H644-Y815 AromaticContact CD2-CE1 3.52Å; H644-Y815 CarbonylContact O-C 3.6Å; H644-Y815 WeakPolarHBondContact O-CA 3.48Å; H644-H816 PolarHBondContact O-N 3.15Å
645	Y	95.8	Very high	84.5	Confident	22 Å²	22	60.4 Å²	60.4	9%	0.086	32%	0.316	C	S	.	.			trans	-93.4	171.8	177.3	-70.1	-97	0	0	0	110.6	E643 E647 D648 I649 H816 F818 R820 L823	E643-Y645 HydrophobicContact CB-CE2 3.96Å; E643-Y645 PolarHBondContact OE2-OH 2.9Å; Y645-E647 PolarHBondContact O-N 3.24Å; Y645-E647 VanDerWaalsContact O-N 3.12Å; Y645-D648 PolarHBondContact N-OD2 3.33Å; Y645-D648 WeakPolarHBondContact O-CA 3.49Å; Y645-D648 WeakPolarHBondContact O-CB 3.43Å; Y645-D648 PolarHBondContact O-N 2.98Å; Y645-I649 WeakPolarHBondContact O-CG1 3.38Å; Y645-I649 PolarHBondContact O-N 2.83Å; Y645-H816 CarbonylContact C-O 3.57Å; Y645-H816 HydrophobicContact CD1-CB 4.07Å; Y645-H816 HydrophobicContact CE1-CB 4.33Å; Y645-H816 AromaticContact CE1-CD2 3.63Å; Y645-H816 AromaticContact CE2-CD2 3.99Å; Y645-H816 AromaticContact CZ-CD2 3.59Å; Y645-F818 HydrophobicContact CD1-CE2 4.48Å; Y645-F818 HydrophobicContact CE1-CE2 4.25Å; Y645-R820 HydrophobicContact CD1-CB 4.41Å; Y645-R820 HydrophobicContact CD1-CG 3.62Å; Y645-R820 HydrophobicContact CD2-CG 3.68Å; Y645-R820 HydrophobicContact CE1-CG 4.03Å; Y645-R820 HydrophobicContact CE2-CG 4.1Å; Y645-R820 HydrophobicContact CG-CG 3.43Å; Y645-R820 VanDerWaalsContact CG-CG 3.43Å; Y645-L823 HydrophobicContact CE1-CB 4.4Å; Y645-L823 HydrophobicContact CE1-CD2 3.84Å; Y645-L823 VanDerWaalsContact OH-CD2 3.3Å; Y645-L823 WeakPolarHBondContact OH-CD2 3.37Å
646	L	92.6	Very high	83.5	Confident	20 Å²	20	65.6 Å²	65.6	11%	0.105	33%	0.333	C	S	.	.	H	α-helix	trans	-49.8	-43.8	-173.9	-177.3	61.8	0	0	0	112.9	D648 I649 L650 L677 H816 F818	L646-D648 VanDerWaalsContact C-N 3.33Å; L646-D648 PolarHBondContact O-N 2.87Å; L646-I649 PolarHBondContact O-N 3.33Å; L646-L650 HydrophobicContact CD1-CD1 4.14Å; L646-L650 HydrophobicContact CD1-CD2 4.5Å; L646-L650 HydrophobicContact CD1-CG 4.07Å; L646-L650 HydrophobicContact CG-CD1 3.99Å; L646-L650 HydrophobicContact CG-CG 4.34Å; L646-L650 WeakPolarHBondContact O-CB 3.48Å; L646-L650 VanDerWaalsContact O-CG 3.28Å; L646-L650 WeakPolarHBondContact O-CG 3.33Å; L646-L650 PolarHBondContact O-N 3.21Å; L646-L677 HydrophobicContact CD1-CD2 3.79Å; L646-H816 PolarHBondContact N-O 3.06Å; L646-F818 VanDerWaalsContact CB-C 3.46Å; L646-F818 PolarHBondContact N-O 3.41Å
647	E	90.8	Very high	83.2	Confident	73 Å²	73	70.8 Å²	70.8	34%	0.341	35%	0.351	S	S	.	.	H	α-helix	trans	-60.5	-37.5	176.1	57.3	-87.7	-160.8	0	0	113.8	Y645 A651 P819 R820	Y645-E647 PolarHBondContact O-N 3.24Å; Y645-E647 VanDerWaalsContact O-N 3.12Å; E647-A651 WeakPolarHBondContact O-CB 3.45Å; E647-A651 PolarHBondContact O-N 2.62Å; E647-P819 VanDerWaalsContact OE2-CA 3.28Å; E647-P819 WeakPolarHBondContact OE2-CA 3.43Å; E647-R820 WeakPolarHBondContact OE1-CD 3.47Å; E647-R820 VanDerWaalsContact OE1-CG 3.25Å; E647-R820 WeakPolarHBondContact OE1-CG 3.15Å; E647-R820 IonicContact OE1-CZ 3.39Å; E647-R820 IonicContact OE1-NE 3.99Å; E647-R820 IonicContact OE1-NH1 3.7Å; E647-R820 PolarHBondContact OE1-NH1 3.32Å
648	D	93.9	Very high	83.1	Confident	43 Å²	43	65.9 Å²	65.9	23%	0.23	33%	0.328	C	S	.	.	H	α-helix	trans	-73.6	-37.5	177.9	-51.3	-41.7	0	0	0	110.6	H644 Y645 L646 K652 R820	H644-D648 HydrophobicContact CB-CB 4.24Å; Y645-D648 PolarHBondContact N-OD2 3.33Å; Y645-D648 WeakPolarHBondContact O-CA 3.49Å; Y645-D648 WeakPolarHBondContact O-CB 3.43Å; Y645-D648 PolarHBondContact O-N 2.98Å; L646-D648 VanDerWaalsContact C-N 3.33Å; L646-D648 PolarHBondContact O-N 2.87Å; D648-K652 VanDerWaalsContact O-CG 3.3Å; D648-K652 WeakPolarHBondContact O-CG 3.48Å; D648-K652 PolarHBondContact O-N 3.04Å; D648-K652 VanDerWaalsContact O-N 3.09Å; D648-R820 IonicContact OD1-CZ 3.29Å; D648-R820 IonicContact OD1-NH1 2.65Å; D648-R820 PolarHBondContact OD1-NH1 3.29Å; D648-R820 IonicContact OD1-NH2 3.04Å; D648-R820 IonicContact OD2-CZ 3.66Å; D648-R820 IonicContact OD2-NH1 3.88Å; D648-R820 PolarHBondContact OD2-NH1 3.4Å; D648-R820 IonicContact OD2-NH2 3.62Å; D648-R820 PolarHBondContact OD2-NH2 3.28Å
649	I	93.2	Very high	82.1	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-67	-50.4	179.5	-66.8	167	0	0	0	110.3	H644 Y645 L646 A651 K652 L653 L681 Y815 H816 L817	H644-I649 HydrophobicContact CB-CG1 4.14Å; Y645-I649 WeakPolarHBondContact O-CG1 3.38Å; Y645-I649 PolarHBondContact O-N 2.83Å; L646-I649 PolarHBondContact O-N 3.33Å; I649-A651 PolarHBondContact O-N 3.16Å; I649-K652 WeakPolarHBondContact O-CA 3.24Å; I649-K652 WeakPolarHBondContact O-CB 3.47Å; I649-K652 PolarHBondContact O-N 3.5Å; I649-L653 HydrophobicContact CG2-CD1 3.88Å; I649-L653 HydrophobicContact CG2-CG 4.33Å; I649-L653 WeakPolarHBondContact O-CG 3.39Å; I649-L653 PolarHBondContact O-N 3.07Å; I649-L681 HydrophobicContact CD1-CD2 4.22Å; I649-L681 HydrophobicContact CG2-CD1 4.04Å; I649-L681 HydrophobicContact CG2-CD2 4.31Å; I649-Y815 HydrophobicContact CG1-CD1 4.25Å; I649-H816 WeakPolarHBondContact CD1-O 3.24Å; I649-L817 HydrophobicContact CD1-CD2 4.05Å
650	L	90.3	Very high	80.8	Confident	38 Å²	38	70 Å²	70	20%	0.199	36%	0.358	C	S	.	.	H	α-helix	trans	-60.8	-36.7	177.7	-68	174.9	0	0	0	111.6	L646 K652 G654 Y658 L677	L646-L650 HydrophobicContact CD1-CD1 4.14Å; L646-L650 HydrophobicContact CD1-CD2 4.5Å; L646-L650 HydrophobicContact CD1-CG 4.07Å; L646-L650 HydrophobicContact CG-CD1 3.99Å; L646-L650 HydrophobicContact CG-CG 4.34Å; L646-L650 WeakPolarHBondContact O-CB 3.48Å; L646-L650 VanDerWaalsContact O-CG 3.28Å; L646-L650 WeakPolarHBondContact O-CG 3.33Å; L646-L650 PolarHBondContact O-N 3.21Å; L650-K652 VanDerWaalsContact C-N 3.34Å; L650-K652 PolarHBondContact O-N 2.77Å; L650-G654 CarbonylContact O-C 3.44Å; L650-G654 PolarHBondContact O-N 2.97Å; L650-Y658 HydrophobicContact CD2-CD2 3.85Å; L650-Y658 HydrophobicContact CD2-CE2 4.47Å; L650-Y658 HydrophobicContact CD2-CG 4.15Å; L650-L677 HydrophobicContact CD2-CD1 4Å
651	A	88.7	Confident	79.2	Confident	62 Å²	62	73.2 Å²	73.2	51%	0.512	36%	0.359	S	S	.	.	H	α-helix	trans	-64.3	-36.9	173.5	0	0	0	0	0	112.6	E647 I649	E647-A651 WeakPolarHBondContact O-CB 3.45Å; E647-A651 PolarHBondContact O-N 2.62Å; I649-A651 PolarHBondContact O-N 3.16Å
652	K	88.1	Confident	77.4	Confident	88 Å²	88	75.6 Å²	75.6	38%	0.383	37%	0.368	S	S	.	.	H	α-helix	trans	-73.4	-38.1	177.8	-76.7	167.4	169.9	-72.1	0	113.8	H644 D648 I649 L650 H684	H644-K652 WeakPolarHBondContact CE1-CE 3.48Å; H644-K652 WeakPolarHBondContact ND1-CE 3.43Å; D648-K652 VanDerWaalsContact O-CG 3.3Å; D648-K652 WeakPolarHBondContact O-CG 3.48Å; D648-K652 PolarHBondContact O-N 3.04Å; D648-K652 VanDerWaalsContact O-N 3.09Å; I649-K652 WeakPolarHBondContact O-CA 3.24Å; I649-K652 WeakPolarHBondContact O-CB 3.47Å; I649-K652 PolarHBondContact O-N 3.5Å; L650-K652 VanDerWaalsContact C-N 3.34Å; L650-K652 PolarHBondContact O-N 2.77Å; K652-H684 PolarHBondContact O-CE1 3.31Å
653	L	87.8	Confident	75	Confident	29 Å²	29	79.6 Å²	79.6	15%	0.152	38%	0.38	C	S	.	.	H	α-helix	trans	-74.7	-27.9	178.3	-66	177.5	0	0	0	112	I649 Y658 L677 D680 H684	I649-L653 HydrophobicContact CG2-CD1 3.88Å; I649-L653 HydrophobicContact CG2-CG 4.33Å; I649-L653 WeakPolarHBondContact O-CG 3.39Å; I649-L653 PolarHBondContact O-N 3.07Å; L653-Y658 HydrophobicContact CB-CE2 4.27Å; L653-Y658 HydrophobicContact CD1-CE2 3.98Å; L653-L677 HydrophobicContact CD1-CD1 3.6Å; L653-D680 HydrophobicContact CD1-CB 4.47Å; L653-H684 HydrophobicContact CD2-CB 3.57Å
654	G	79.2	Confident	72.4	Confident	29 Å²	29	83.2 Å²	83.2	30%	0.299	40%	0.396	S	S	.	.			trans	107.4	125.3	178.4	0	0	0	0	0	111.5	L650 H656 Q657	L650-G654 CarbonylContact O-C 3.44Å; L650-G654 PolarHBondContact O-N 2.97Å; G654-H656 PolarHBondContact O-N 3.14Å; G654-Q657 PolarHBondContact O-N 3.14Å
655	K	56.8	Low	69.8	Low	176 Å²	176	87.4 Å²	87.4	77%	0.765	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-15.7	-170.3	-68.4	-177.4	178.2	177	0	115.7
656	H	54.7	Low	67.2	Low	188 Å²	188	94.6 Å²	94.6	87%	0.87	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-14.9	-171.6	-65.6	-68.7	0	0	0	114.8	G654	G654-H656 PolarHBondContact O-N 3.14Å
657	Q	58.4	Low	65.2	Low	133 Å²	133	96.3 Å²	96.3	62%	0.621	46%	0.464	S	S	*	.	S	Bend	trans	-84.1	-27.4	-179.3	-90.9	174.6	-6.7	0	0	114	G654 P659	G654-Q657 PolarHBondContact O-N 3.14Å; Q657-P659 WeakPolarHBondContact O-CD 3.36Å
658	Y	64.2	Low	63.3	Low	37 Å²	37	98.6 Å²	98.6	15%	0.145	48%	0.475	C	S	.	.	S	Bend	trans	-118.6	82	179.7	-51.1	-85.2	0	0	0	109.7	L650 L653 L677 D680	L650-Y658 HydrophobicContact CD2-CD2 3.85Å; L650-Y658 HydrophobicContact CD2-CE2 4.47Å; L650-Y658 HydrophobicContact CD2-CG 4.15Å; L653-Y658 HydrophobicContact CB-CE2 4.27Å; L653-Y658 HydrophobicContact CD1-CE2 3.98Å; Y658-L677 HydrophobicContact CE1-CB 4.11Å; Y658-L677 HydrophobicContact CE1-CD1 4.11Å; Y658-L677 HydrophobicContact CE2-CD1 3.97Å; Y658-D680 WeakPolarHBondContact OH-CB 3.13Å; Y658-D680 VanDerWaalsContact OH-CG 3.23Å; Y658-D680 PolarHBondContact OH-OD2 2.76Å
659	P	48.5	Very low	61.9	Low	95 Å²	95	103 Å²	103	62%	0.617	50%	0.498	S	S	*	.			trans	-60	142.9	175.6	25.6	-31.8	0	0	0	109.5	Q657 R661	Q657-P659 WeakPolarHBondContact O-CD 3.36Å; P659-R661 PolarHBondContact O-N 3.01Å
660	H	50.2	Low	60.6	Low	130 Å²	130	107.4 Å²	107.4	60%	0.602	52%	0.519	S	S	*	.	S	Bend	trans	-1.8	-5	172.7	-66.2	-83	0	0	0	124.2	H662 R663	H660-H662 PolarHBondContact O-N 3.39Å; H660-H662 VanDerWaalsContact O-N 3.13Å; H660-R663 PolarHBondContact O-N 2.7Å
661	R	52.4	Low	59.8	Low	156 Å²	156	107.5 Å²	107.5	59%	0.589	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-45.6	-40.1	169.3	-113	-179.3	178	-179.8	-2.1	111.5	E214 P659 R663 H665	E214-R661 IonicContact OE1-NH2 2.67Å; E214-R661 PolarHBondContact OE1-NH2 3.02Å; P659-R661 PolarHBondContact O-N 3.01Å; R661-R663 PolarHBondContact O-N 3.47Å; R661-H665 PolarHBondContact O-CD2 3.41Å; R661-H665 PolarHBondContact O-N 3.12Å
662	H	51.2	Low	59.2	Low	77 Å²	77	108.2 Å²	108.2	36%	0.356	53%	0.528	S	S	.	.	G	3₁₀ helix	trans	-80.3	-11	-179.1	-58.5	-61.8	0	0	0	116.3	H660 D674	H660-H662 PolarHBondContact O-N 3.39Å; H660-H662 VanDerWaalsContact O-N 3.13Å; H662-D674 IonicContact CE1-OD2 2.75Å; H662-D674 IonicContact NE2-OD2 2.73Å
663	R	44.9	Very low	59.1	Low	207 Å²	207	105.8 Å²	105.8	78%	0.781	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-93.1	-19.7	176.6	-98.6	-174.2	-178.4	-178.9	-0.8	113.6	H660 R661	H660-R663 PolarHBondContact O-N 2.7Å; R661-R663 PolarHBondContact O-N 3.47Å
664	H	41	Very low	59.2	Low	130 Å²	130	106.8 Å²	106.8	60%	0.602	52%	0.524	S	S	*	.			trans	-127.5	16	-170.2	-73.7	-72.1	0	0	0	114.8	E666	H664-E666 PolarHBondContact O-N 3.38Å
665	H	44	Very low	59.8	Low	103 Å²	103	106.9 Å²	106.9	48%	0.477	52%	0.518	S	S	.	.			trans	-69.2	86.1	161.3	-99.6	-88.9	0	0	0	108.1	R661 S667 E670	R661-H665 PolarHBondContact O-CD2 3.41Å; R661-H665 PolarHBondContact O-N 3.12Å; H665-S667 PolarHBondContact O-N 2.67Å; H665-E670 IonicContact CE1-OE2 3.86Å; H665-E670 PolarHBondContact CE1-OE2 3.07Å; H665-E670 IonicContact ND1-OE2 3.3Å; H665-E670 PolarHBondContact ND1-OE2 2.84Å
666	E	40.6	Very low	61.5	Low	172 Å²	172	102.3 Å²	102.3	80%	0.804	50%	0.501	S	S	*	.			trans	-66	-10.5	-179.2	-74.5	176.3	164.1	0	0	112.9	H664 E668	H664-E666 PolarHBondContact O-N 3.38Å; E666-E668 VanDerWaalsContact C-N 3.31Å; E666-E668 PolarHBondContact O-N 2.71Å
667	S	49.3	Very low	63.3	Low	56 Å²	56	93.6 Å²	93.6	39%	0.392	46%	0.462	S	S	.	.			trans	-76.7	81.4	162	45.6	0	0	0	0	109.5	H665 D669 E670	H665-S667 PolarHBondContact O-N 2.67Å; S667-D669 PolarHBondContact O-N 2.82Å; S667-E670 PolarHBondContact O-N 2.92Å; S667-E670 PolarHBondContact OG-OE2 2.83Å
668	E	52.8	Low	65	Low	122 Å²	122	87.3 Å²	87.3	57%	0.57	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-11.5	176.7	-70.8	-163.2	141.4	0	0	114.3	E666 R822 K825	E666-E668 VanDerWaalsContact C-N 3.31Å; E666-E668 PolarHBondContact O-N 2.71Å; E668-R822 PolarHBondContact O-NH1 2.75Å; E668-R822 PolarHBondContact O-NH2 3.04Å; E668-K825 IonicContact OE1-NZ 3.75Å; E668-K825 PolarHBondContact OE1-NZ 2.86Å; E668-K825 IonicContact OE2-NZ 3.72Å; E668-K825 PolarHBondContact OE2-NZ 3.19Å
669	D	62.8	Low	66.5	Low	134 Å²	134	85.8 Å²	85.8	72%	0.717	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	1.6	-179.9	-76.9	-30.7	0	0	0	115.8	S667 C671	S667-D669 PolarHBondContact O-N 2.82Å; D669-C671 PolarHBondContact O-N 2.82Å; D669-C671 PolarHBondContact O-SG 2.9Å
670	E	66.4	Low	68.7	Low	94 Å²	94	83.9 Å²	83.9	44%	0.439	41%	0.411	S	S	.	.			trans	-69.9	122.5	-177	-159.6	168.1	-174.9	0	0	112.1	H665 S667 A672	H665-E670 IonicContact CE1-OE2 3.86Å; H665-E670 PolarHBondContact CE1-OE2 3.07Å; H665-E670 IonicContact ND1-OE2 3.3Å; H665-E670 PolarHBondContact ND1-OE2 2.84Å; S667-E670 PolarHBondContact O-N 2.92Å; S667-E670 PolarHBondContact OG-OE2 2.83Å; E670-A672 HydrophobicContact CG-CB 4.48Å; E670-A672 PolarHBondContact O-N 3.37Å
671	C	72.8	Confident	70.8	Confident	40 Å²	40	77.8 Å²	77.8	27%	0.27	38%	0.383	S	S	.	.			trans	-99	52.2	-175	-66.1	0	0	0	0	111.8	D669 L774 T791 W793	D669-C671 PolarHBondContact O-N 2.82Å; D669-C671 PolarHBondContact O-SG 2.9Å; C671-L774 HydrophobicContact CB-CD2 3.93Å; C671-T791 HydrophobicContact CB-CG2 4.13Å; C671-T791 WeakPolarHBondContact CB-O 3.31Å; C671-W793 PolarHBondContact SG-NE1 3.37Å; C671-W793 VanDerWaalsContact SG-NE1 3.37Å
672	A	77	Confident	72.9	Confident	76 Å²	76	70.4 Å²	70.4	63%	0.628	36%	0.356	S	S	*	.			trans	-99.8	137.7	178.8	0	0	0	0	0	111.6	E670	E670-A672 HydrophobicContact CG-CB 4.48Å; E670-A672 PolarHBondContact O-N 3.37Å
673	L	86.3	Confident	74.9	Confident	38 Å²	38	68.9 Å²	68.9	20%	0.199	35%	0.35	C	S	.	.			trans	-109.5	123.8	179.1	-179.5	63	0	0	0	110.8	L675 V678 L698 P699 E703 L774 L817	L673-L675 HydrophobicContact CD2-CD2 4.03Å; L673-L675 HydrophobicContact CG-CD2 4.15Å; L673-L675 PolarHBondContact O-N 3.37Å; L673-V678 HydrophobicContact CD1-CG2 3.96Å; L673-V678 HydrophobicContact CD2-CG2 4.25Å; L673-V678 HydrophobicContact CG-CG2 4.22Å; L673-L698 HydrophobicContact CD2-CD2 3.73Å; L673-P699 HydrophobicContact CD2-CG 4.15Å; L673-E703 HydrophobicContact CD2-CB 4.4Å; L673-E703 HydrophobicContact CD2-CG 4.48Å; L673-L774 HydrophobicContact CB-CD1 4.19Å; L673-L817 HydrophobicContact CD1-CD1 4.13Å
674	D	89.3	Confident	77.3	Confident	49 Å²	49	60.6 Å²	60.6	26%	0.262	32%	0.32	S	S	.	.			trans	-77.1	110.6	170.6	-173.6	-23.7	0	0	0	110.2	H662 D676 L677 V678	H662-D674 IonicContact CE1-OD2 2.75Å; H662-D674 IonicContact NE2-OD2 2.73Å; D674-D676 WeakPolarHBondContact OD1-CA 3.37Å; D674-D676 WeakPolarHBondContact OD1-CB 3.45Å; D674-D676 PolarHBondContact OD1-N 3.23Å; D674-L677 HydrophobicContact CB-CB 3.85Å; D674-L677 PolarHBondContact OD1-N 3.38Å; D674-V678 WeakPolarHBondContact O-CG2 3.42Å; D674-V678 PolarHBondContact O-N 2.77Å
675	L	92.5	Very high	79.9	Confident	31 Å²	31	54.4 Å²	54.4	16%	0.162	29%	0.291	C	S	.	.	H	α-helix	trans	-75.2	-29.1	-179.1	-53.6	-174.3	0	0	0	112.6	L673 V678 T679 E703 V707	L673-L675 HydrophobicContact CD2-CD2 4.03Å; L673-L675 HydrophobicContact CG-CD2 4.15Å; L673-L675 PolarHBondContact O-N 3.37Å; L675-V678 PolarHBondContact O-N 3.03Å; L675-T679 PolarHBondContact O-N 2.8Å; L675-T679 PolarHBondContact O-OG1 2.83Å; L675-E703 HydrophobicContact CD2-CB 3.99Å; L675-E703 HydrophobicContact CD2-CG 4.26Å; L675-V707 HydrophobicContact CB-CG2 4.31Å; L675-V707 HydrophobicContact CD2-CG2 4.09Å
676	D	91.7	Very high	82.2	Confident	80 Å²	80	51.1 Å²	51.1	43%	0.428	28%	0.277	S	S	.	.	H	α-helix	trans	-68.8	-42.6	177.3	-65.5	-44	0	0	0	109.3	D674 V678 T679 D680 R710	D674-D676 WeakPolarHBondContact OD1-CA 3.37Å; D674-D676 WeakPolarHBondContact OD1-CB 3.45Å; D674-D676 PolarHBondContact OD1-N 3.23Å; D676-V678 VanDerWaalsContact C-N 3.34Å; D676-V678 PolarHBondContact O-N 2.9Å; D676-T679 PolarHBondContact O-N 3.2Å; D676-T679 VanDerWaalsContact O-N 3.16Å; D676-D680 WeakPolarHBondContact O-CB 3.49Å; D676-D680 VanDerWaalsContact O-CG 3.3Å; D676-D680 PolarHBondContact O-N 3.13Å; D676-R710 WeakPolarHBondContact OD1-CD 3.47Å; D676-R710 IonicContact OD1-CZ 3.37Å; D676-R710 IonicContact OD1-NE 2.73Å; D676-R710 PolarHBondContact OD1-NE 3.41Å; D676-R710 IonicContact OD1-NH2 3.08Å
677	L	92.2	Very high	84.6	Confident	6 Å²	6	46.8 Å²	46.8	3%	0.031	27%	0.271	C	S	.	.	H	α-helix	trans	-58.3	-42.5	173.3	-179.5	62.5	0	0	0	112.9	L646 L650 L653 Y658 D674 L681 L817	L646-L677 HydrophobicContact CD1-CD2 3.79Å; L650-L677 HydrophobicContact CD2-CD1 4Å; L653-L677 HydrophobicContact CD1-CD1 3.6Å; Y658-L677 HydrophobicContact CE1-CB 4.11Å; Y658-L677 HydrophobicContact CE1-CD1 4.11Å; Y658-L677 HydrophobicContact CE2-CD1 3.97Å; D674-L677 HydrophobicContact CB-CB 3.85Å; D674-L677 PolarHBondContact OD1-N 3.38Å; L677-L681 VanDerWaalsContact O-CB 3.29Å; L677-L681 WeakPolarHBondContact O-CB 3.38Å; L677-L681 PolarHBondContact O-N 3.43Å; L677-L817 HydrophobicContact CD2-CD2 4.11Å; L677-L817 HydrophobicContact CG-CD2 4.13Å
678	V	95.3	Very high	86.6	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61.8	-48.1	175.4	177.9	0	0	0	0	110.3	L673 D674 L675 D676 L681 V682 L698 V707 L817	L673-V678 HydrophobicContact CD1-CG2 3.96Å; L673-V678 HydrophobicContact CD2-CG2 4.25Å; L673-V678 HydrophobicContact CG-CG2 4.22Å; D674-V678 WeakPolarHBondContact O-CG2 3.42Å; D674-V678 PolarHBondContact O-N 2.77Å; L675-V678 PolarHBondContact O-N 3.03Å; D676-V678 VanDerWaalsContact C-N 3.34Å; D676-V678 PolarHBondContact O-N 2.9Å; V678-L681 PolarHBondContact O-N 3.16Å; V678-V682 WeakPolarHBondContact O-CG2 3.35Å; V678-V682 PolarHBondContact O-N 2.86Å; V678-L698 HydrophobicContact CG1-CD2 4.24Å; V678-L698 HydrophobicContact CG2-CD2 4.31Å; V678-V707 HydrophobicContact CB-CG2 3.93Å; V678-V707 HydrophobicContact CG1-CB 4.47Å; V678-V707 HydrophobicContact CG1-CG1 3.84Å; V678-V707 HydrophobicContact CG1-CG2 3.73Å; V678-V707 HydrophobicContact CG2-CG2 4.48Å; V678-L817 HydrophobicContact CB-CD1 4.38Å; V678-L817 HydrophobicContact CG2-CD1 3.41Å; V678-L817 VanDerWaalsContact CG2-CD1 3.41Å
679	T	95.2	Very high	88.4	Confident	6 Å²	6	48.6 Å²	48.6	4%	0.037	27%	0.27	C	S	.	.	H	α-helix	trans	-60.8	-49.6	-179.3	-68.5	0	0	0	0	111.2	L675 D676 L681 V682 L683 R710 L711	L675-T679 PolarHBondContact O-N 2.8Å; L675-T679 PolarHBondContact O-OG1 2.83Å; D676-T679 PolarHBondContact O-N 3.2Å; D676-T679 VanDerWaalsContact O-N 3.16Å; T679-L681 VanDerWaalsContact C-N 3.3Å; T679-L681 PolarHBondContact O-N 3.07Å; T679-V682 PolarHBondContact O-N 3.37Å; T679-V682 VanDerWaalsContact O-N 3.13Å; T679-L683 HydrophobicContact CG2-CD1 3.98Å; T679-L683 HydrophobicContact CG2-CG 4.42Å; T679-L683 WeakPolarHBondContact O-CG 3.33Å; T679-L683 PolarHBondContact O-N 3.46Å; T679-R710 HydrophobicContact CG2-CB 3.87Å; T679-R710 VanDerWaalsContact OG1-CB 3.32Å; T679-R710 WeakPolarHBondContact OG1-CB 3.38Å; T679-L711 HydrophobicContact CG2-CD2 3.99Å; T679-L711 HydrophobicContact CG2-CG 4.29Å
680	D	93.8	Very high	89.8	Confident	54 Å²	54	47.7 Å²	47.7	29%	0.289	26%	0.262	S	S	.	.	H	α-helix	trans	-63.9	-36.8	-178.5	-70.2	-29.1	0	0	0	111.8	L653 Y658 D676 L683 H684	L653-D680 HydrophobicContact CD1-CB 4.47Å; Y658-D680 WeakPolarHBondContact OH-CB 3.13Å; Y658-D680 VanDerWaalsContact OH-CG 3.23Å; Y658-D680 PolarHBondContact OH-OD2 2.76Å; D676-D680 WeakPolarHBondContact O-CB 3.49Å; D676-D680 VanDerWaalsContact O-CG 3.3Å; D676-D680 PolarHBondContact O-N 3.13Å; D680-L683 PolarHBondContact O-N 3.02Å; D680-H684 VanDerWaalsContact O-CB 3.31Å; D680-H684 WeakPolarHBondContact O-CB 3.36Å; D680-H684 PolarHBondContact O-N 3.15Å
681	L	95.6	Very high	90.9	Very high	3 Å²	3	48 Å²	48	2%	0.016	27%	0.272	C	S	.	.	H	α-helix	trans	-63.5	-45	172.1	175.8	60	0	0	0	112.1	I649 L677 V678 T679 L683 H684 I685 V770 Y815 L817	I649-L681 HydrophobicContact CD1-CD2 4.22Å; I649-L681 HydrophobicContact CG2-CD1 4.04Å; I649-L681 HydrophobicContact CG2-CD2 4.31Å; L677-L681 VanDerWaalsContact O-CB 3.29Å; L677-L681 WeakPolarHBondContact O-CB 3.38Å; L677-L681 PolarHBondContact O-N 3.43Å; V678-L681 PolarHBondContact O-N 3.16Å; T679-L681 VanDerWaalsContact C-N 3.3Å; T679-L681 PolarHBondContact O-N 3.07Å; L681-L683 VanDerWaalsContact C-N 3.33Å; L681-L683 PolarHBondContact O-N 3.03Å; L681-H684 WeakPolarHBondContact O-CB 3.41Å; L681-H684 PolarHBondContact O-N 3.39Å; L681-I685 HydrophobicContact CD1-CD1 3.91Å; L681-I685 HydrophobicContact CD1-CG1 4.08Å; L681-I685 HydrophobicContact CG-CD1 3.9Å; L681-I685 HydrophobicContact CG-CG1 4.49Å; L681-I685 VanDerWaalsContact O-CG1 3.27Å; L681-I685 WeakPolarHBondContact O-CG1 3.19Å; L681-I685 PolarHBondContact O-N 3.26Å; L681-V770 HydrophobicContact CD2-CB 4.5Å; L681-V770 HydrophobicContact CD2-CG1 3.75Å; L681-V770 HydrophobicContact CD2-CG2 4.01Å; L681-V770 HydrophobicContact CG-CG2 4.35Å; L681-Y815 HydrophobicContact CD1-CD1 3.89Å; L681-Y815 HydrophobicContact CD1-CE1 4.36Å; L681-Y815 HydrophobicContact CD1-CG 4.23Å; L681-Y815 HydrophobicContact CD2-CG 4.31Å; L681-L817 HydrophobicContact CD2-CD2 3.71Å
682	V	96.2	Very high	91.8	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.006	27%	0.272	C	S	.	.	H	α-helix	trans	-61.6	-43.1	177.4	170.4	0	0	0	0	110.8	V678 T679 H684 I685 D686 I694 L711 I750 V770	V678-V682 WeakPolarHBondContact O-CG2 3.35Å; V678-V682 PolarHBondContact O-N 2.86Å; T679-V682 PolarHBondContact O-N 3.37Å; T679-V682 VanDerWaalsContact O-N 3.13Å; V682-H684 VanDerWaalsContact C-N 3.35Å; V682-I685 PolarHBondContact O-N 3.01Å; V682-D686 WeakPolarHBondContact O-CB 3.02Å; V682-D686 PolarHBondContact O-N 2.74Å; V682-I694 HydrophobicContact CG1-CD1 4.16Å; V682-I694 HydrophobicContact CG2-CG2 4.49Å; V682-L711 HydrophobicContact CB-CD2 4Å; V682-L711 HydrophobicContact CG1-CD1 4.11Å; V682-L711 HydrophobicContact CG1-CD2 3.64Å; V682-I750 HydrophobicContact CG1-CD1 3.91Å; V682-I750 HydrophobicContact CG1-CG2 4.24Å; V682-V770 HydrophobicContact CG2-CG2 4.49Å
683	L	94.1	Very high	92.6	Very high	45 Å²	45	43.9 Å²	43.9	24%	0.236	24%	0.243	C	C	.	.	H	α-helix	trans	-65	-37.8	176.1	-66.4	173.6	0	0	0	112	T679 D680 L681 D686 A687 L711 A714 L715	T679-L683 HydrophobicContact CG2-CD1 3.98Å; T679-L683 HydrophobicContact CG2-CG 4.42Å; T679-L683 WeakPolarHBondContact O-CG 3.33Å; T679-L683 PolarHBondContact O-N 3.46Å; D680-L683 PolarHBondContact O-N 3.02Å; L681-L683 VanDerWaalsContact C-N 3.33Å; L681-L683 PolarHBondContact O-N 3.03Å; L683-D686 PolarHBondContact O-N 3.03Å; L683-A687 WeakPolarHBondContact O-CB 3.35Å; L683-A687 PolarHBondContact O-N 2.88Å; L683-L711 HydrophobicContact CD2-CD2 4.07Å; L683-L711 HydrophobicContact CG-CD2 4.15Å; L683-A714 HydrophobicContact CD1-CB 3.76Å; L683-A714 HydrophobicContact CD2-CB 4.46Å; L683-L715 HydrophobicContact CD2-CD2 3.58Å; L683-L715 HydrophobicContact CD2-CG 4.12Å
684	H	94.4	Very high	93.1	Very high	32 Å²	32	42 Å²	42	15%	0.148	23%	0.234	C	C	.	.	H	α-helix	trans	-63.9	-45.8	174.3	-178.2	97.5	0	0	0	112.1	K652 L653 D680 L681 V682 D686 A687 R688	K652-H684 PolarHBondContact O-CE1 3.31Å; L653-H684 HydrophobicContact CD2-CB 3.57Å; D680-H684 VanDerWaalsContact O-CB 3.31Å; D680-H684 WeakPolarHBondContact O-CB 3.36Å; D680-H684 PolarHBondContact O-N 3.15Å; L681-H684 WeakPolarHBondContact O-CB 3.41Å; L681-H684 PolarHBondContact O-N 3.39Å; V682-H684 VanDerWaalsContact C-N 3.35Å; H684-D686 VanDerWaalsContact C-N 3.29Å; H684-D686 PolarHBondContact O-N 3.48Å; H684-A687 PolarHBondContact O-N 2.99Å; H684-R688 PolarHBondContact O-N 3.44Å
685	I	95.2	Very high	93.4	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.3	-41.1	175.8	-66.9	164.7	0	0	0	109.9	L681 V682 A687 G689 I694 R748 H768 V770 Y815	L681-I685 HydrophobicContact CD1-CD1 3.91Å; L681-I685 HydrophobicContact CD1-CG1 4.08Å; L681-I685 HydrophobicContact CG-CD1 3.9Å; L681-I685 HydrophobicContact CG-CG1 4.49Å; L681-I685 VanDerWaalsContact O-CG1 3.27Å; L681-I685 WeakPolarHBondContact O-CG1 3.19Å; L681-I685 PolarHBondContact O-N 3.26Å; V682-I685 PolarHBondContact O-N 3.01Å; I685-A687 PolarHBondContact O-N 3.4Å; I685-G689 WeakPolarHBondContact O-CA 3.14Å; I685-G689 PolarHBondContact O-N 3.25Å; I685-I694 HydrophobicContact CB-CD1 4.12Å; I685-I694 HydrophobicContact CG2-CD1 3.65Å; I685-I694 HydrophobicContact CG2-CG1 4.03Å; I685-R748 PolarHBondContact O-NH2 2.96Å; I685-H768 HydrophobicContact CG2-CB 3.95Å; I685-H768 VanDerWaalsContact CG2-CG 3.47Å; I685-V770 HydrophobicContact CD1-CG2 3.77Å; I685-Y815 HydrophobicContact CD1-CD2 3.57Å; I685-Y815 HydrophobicContact CD1-CE1 4.48Å; I685-Y815 HydrophobicContact CD1-CE2 3.48Å; I685-Y815 VanDerWaalsContact CD1-CE2 3.48Å; I685-Y815 HydrophobicContact CD1-CG 4.13Å; I685-Y815 HydrophobicContact CG1-CD2 4.35Å; I685-Y815 HydrophobicContact CG1-CE1 4.36Å; I685-Y815 HydrophobicContact CG1-CE2 3.82Å
686	D	92.5	Very high	93.6	Very high	34 Å²	34	38.4 Å²	38.4	18%	0.182	21%	0.214	C	C	.	.	H	α-helix	trans	-60.7	-47	177.6	-174.8	56.4	0	0	0	112	V682 L683 H684 Y722 R748	V682-D686 WeakPolarHBondContact O-CB 3.02Å; V682-D686 PolarHBondContact O-N 2.74Å; L683-D686 PolarHBondContact O-N 3.03Å; H684-D686 VanDerWaalsContact C-N 3.29Å; H684-D686 PolarHBondContact O-N 3.48Å; D686-Y722 WeakPolarHBondContact OD2-CE1 3.4Å; D686-Y722 PolarHBondContact OD2-OH 3.22Å; D686-R748 PolarHBondContact O-NH2 3.21Å; D686-R748 WeakPolarHBondContact OD1-CG 3.47Å; D686-R748 IonicContact OD1-CZ 3.72Å; D686-R748 IonicContact OD1-NE 3.83Å; D686-R748 PolarHBondContact OD1-NE 3.36Å; D686-R748 IonicContact OD1-NH2 2.8Å
687	A	91.5	Very high	93.9	Very high	81 Å²	81	34.6 Å²	34.6	67%	0.669	19%	0.194	S	C	*	.	H	α-helix	trans	-75.5	-31.5	-175.8	0	0	0	0	0	114.4	L683 H684 I685	L683-A687 WeakPolarHBondContact O-CB 3.35Å; L683-A687 PolarHBondContact O-N 2.88Å; H684-A687 PolarHBondContact O-N 2.99Å; I685-A687 PolarHBondContact O-N 3.4Å
688	R	91.9	Very high	94.1	Very high	195 Å²	195	34.4 Å²	34.4	74%	0.736	19%	0.193	S	C	*	.	H	α-helix	trans	-128.8	-12.3	-169.9	-60.1	-172	-179.1	-174.5	2	115.1	H684	H684-R688 PolarHBondContact O-N 3.44Å
689	G	90.6	Very high	93.9	Very high	21 Å²	21	34.7 Å²	34.7	22%	0.216	20%	0.195	C	C	.	.	S	Bend	trans	-85.9	156.7	-178.8	0	0	0	0	0	112.7	I685 R748	I685-G689 WeakPolarHBondContact O-CA 3.14Å; I685-G689 PolarHBondContact O-N 3.25Å; G689-R748 PolarHBondContact O-NH2 3.49Å
690	E	91.6	Very high	93.6	Very high	115 Å²	115	34.5 Å²	34.5	54%	0.537	19%	0.194	S	C	.	.	P	Polyproline II helix	trans	-52.1	154.2	176.7	-65.7	-61.2	150.3	0	0	113	R748 H768 F813	E690-R748 PolarHBondContact O-NH1 3.46Å; E690-H768 PolarHBondContact O-NE2 2.92Å; E690-F813 HydrophobicContact CB-CE2 4.04Å; E690-F813 HydrophobicContact CG-CE2 3.63Å; E690-F813 HydrophobicContact CG-CZ 3.88Å
691	P	89.9	Confident	93.1	Very high	101 Å²	101	33.4 Å²	33.4	66%	0.656	19%	0.186	S	C	*	.	S	Bend	trans	-57.5	147.2	173.8	-22.8	33.7	0	0	0	112.6
692	G	90.9	Very high	92.6	Very high	27 Å²	27	39.2 Å²	39.2	28%	0.278	21%	0.213	S	C	.	.	S	Bend	trans	133.2	169.9	-179.9	0	0	0	0	0	113.3	R748	G692-R748 WeakPolarHBondContact O-CD 3.23Å; G692-R748 PolarHBondContact O-NH1 3.46Å
693	G	93.6	Very high	92.4	Very high	2 Å²	2	40.5 Å²	40.5	2%	0.021	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	152.1	179.9	0	0	0	0	0	113.1	K749 D765 V767 H768	G693-K749 CarbonylContact C-O 3.57Å; G693-K749 VanDerWaalsContact CA-O 3.32Å; G693-K749 WeakPolarHBondContact CA-O 3.48Å; G693-D765 WeakPolarHBondContact CA-O 3.35Å; G693-D765 PolarHBondContact N-O 3.02Å; G693-V767 PolarHBondContact O-N 3.3Å; G693-H768 PolarHBondContact O-N 2.88Å; G693-H768 VanDerWaalsContact O-N 3.1Å
694	I	96.3	Very high	92.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	130.6	177	-51.3	176.5	0	0	0	108.2	V682 I685 R748 K749 I750 V751 H768 V770	V682-I694 HydrophobicContact CG1-CD1 4.16Å; V682-I694 HydrophobicContact CG2-CG2 4.49Å; I685-I694 HydrophobicContact CB-CD1 4.12Å; I685-I694 HydrophobicContact CG2-CD1 3.65Å; I685-I694 HydrophobicContact CG2-CG1 4.03Å; I694-R748 HydrophobicContact CD1-CG 4.4Å; I694-K749 PolarHBondContact N-O 2.84Å; I694-I750 HydrophobicContact CD1-CG1 4.38Å; I694-I750 CarbonylContact O-C 3.6Å; I694-I750 WeakPolarHBondContact O-CA 3.4Å; I694-V751 PolarHBondContact O-N 3.18Å; I694-H768 CarbonylContact C-O 3.55Å; I694-H768 WeakPolarHBondContact CA-O 3.19Å; I694-H768 HydrophobicContact CB-CB 4.44Å; I694-H768 HydrophobicContact CG1-CB 4.15Å; I694-H768 HydrophobicContact CG2-CB 4.29Å; I694-V770 HydrophobicContact CG2-CG2 4.2Å
695	L	95.8	Very high	91.9	Very high	3 Å²	3	39.2 Å²	39.2	2%	0.016	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	118.6	174.2	173.4	61.8	0	0	0	109.7	F697 V751 A753 A757 I766 H768 V769 V770 R805	L695-F697 HydrophobicContact CD2-CE1 4.49Å; L695-F697 HydrophobicContact CD2-CE2 3.78Å; L695-F697 HydrophobicContact CD2-CZ 3.67Å; L695-F697 HydrophobicContact CG-CE2 4.07Å; L695-F697 HydrophobicContact CG-CZ 4.24Å; L695-V751 CarbonylContact C-O 3.59Å; L695-V751 WeakPolarHBondContact CA-O 3.37Å; L695-V751 HydrophobicContact CD1-CB 3.75Å; L695-V751 HydrophobicContact CD1-CG1 3.56Å; L695-A753 HydrophobicContact CD1-CB 3.86Å; L695-A757 HydrophobicContact CD1-CB 4.04Å; L695-A757 HydrophobicContact CD2-CB 4.26Å; L695-I766 HydrophobicContact CB-CD1 3.97Å; L695-I766 HydrophobicContact CB-CG1 4.12Å; L695-I766 HydrophobicContact CB-CG2 3.74Å; L695-H768 PolarHBondContact N-O 2.98Å; L695-V769 CarbonylContact O-C 3.54Å; L695-V769 WeakPolarHBondContact O-CA 3.46Å; L695-V770 PolarHBondContact O-N 3.35Å; L695-R805 HydrophobicContact CD2-CB 3.97Å; L695-R805 HydrophobicContact CD2-CG 4.14Å
696	C	97.5	Very high	91.8	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	123.5	177.3	-53.5	0	0	0	0	110.3	L698 V751 L752 A753 V770	C696-L698 HydrophobicContact CB-CD1 4.49Å; C696-L698 HydrophobicContact CB-CG 4.32Å; C696-V751 PolarHBondContact N-O 3.33Å; C696-L752 HydrophobicContact CB-CD2 3.73Å; C696-A753 PolarHBondContact O-N 2.89Å; C696-A753 VanDerWaalsContact O-O 3.07Å; C696-V770 CarbonylContact C-O 3.54Å; C696-V770 VanDerWaalsContact CA-O 3.3Å; C696-V770 WeakPolarHBondContact CA-O 3.43Å; C696-V770 HydrophobicContact CB-CB 4.26Å
697	F	97.2	Very high	91.9	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	111.4	170.8	-70.8	-78.5	0	0	0	110.3	L695 A753 A757 E758 V769 V770 S772 R802 R805	L695-F697 HydrophobicContact CD2-CE1 4.49Å; L695-F697 HydrophobicContact CD2-CE2 3.78Å; L695-F697 HydrophobicContact CD2-CZ 3.67Å; L695-F697 HydrophobicContact CG-CE2 4.07Å; L695-F697 HydrophobicContact CG-CZ 4.24Å; F697-A753 CarbonylContact C-O 3.57Å; F697-A753 WeakPolarHBondContact CA-O 3.24Å; F697-A757 HydrophobicContact CE1-CB 3.91Å; F697-A757 HydrophobicContact CZ-CB 4.36Å; F697-E758 HydrophobicContact CE1-CB 4Å; F697-V769 HydrophobicContact CD2-CG1 3.88Å; F697-V769 HydrophobicContact CE2-CG1 3.84Å; F697-V770 PolarHBondContact N-O 2.97Å; F697-S772 VanDerWaalsContact O-CB 3.3Å; F697-S772 WeakPolarHBondContact O-CB 3.43Å; F697-S772 PolarHBondContact O-N 3.41Å; F697-S772 PolarHBondContact O-OG 3.27Å; F697-R802 HydrophobicContact CD1-CG 4.07Å; F697-R802 HydrophobicContact CD2-CB 3.76Å; F697-R802 HydrophobicContact CD2-CG 3.69Å; F697-R802 HydrophobicContact CE1-CG 3.99Å; F697-R802 HydrophobicContact CE2-CB 3.54Å; F697-R802 HydrophobicContact CE2-CG 3.61Å; F697-R802 HydrophobicContact CG-CB 4.47Å; F697-R802 HydrophobicContact CG-CG 3.92Å; F697-R802 HydrophobicContact CZ-CB 4.1Å; F697-R802 HydrophobicContact CZ-CG 3.76Å; F697-R805 HydrophobicContact CE2-CG 4.29Å; F697-R805 HydrophobicContact CZ-CG 3.95Å
698	L	96.2	Very high	91.9	Very high	3 Å²	3	35 Å²	35	2%	0.016	18%	0.179	C	C	.	.			trans	-119.2	149.7	-175.7	-61.6	174.5	0	0	0	111.1	L673 V678 C696 G700 E703 I704 V707 L752 A753 T754	L673-L698 HydrophobicContact CD2-CD2 3.73Å; V678-L698 HydrophobicContact CG1-CD2 4.24Å; V678-L698 HydrophobicContact CG2-CD2 4.31Å; C696-L698 HydrophobicContact CB-CD1 4.49Å; C696-L698 HydrophobicContact CB-CG 4.32Å; L698-G700 VanDerWaalsContact C-N 3.32Å; L698-G700 PolarHBondContact O-N 3.41Å; L698-E703 HydrophobicContact CB-CB 4.28Å; L698-I704 HydrophobicContact CB-CG1 3.93Å; L698-I704 HydrophobicContact CD1-CB 4.35Å; L698-I704 HydrophobicContact CD1-CG1 3.86Å; L698-I704 HydrophobicContact CG-CG1 4.49Å; L698-V707 HydrophobicContact CD1-CB 4.22Å; L698-V707 HydrophobicContact CD1-CG2 4.07Å; L698-V707 HydrophobicContact CD2-CG2 4.41Å; L698-L752 HydrophobicContact CD1-CB 4.25Å; L698-L752 HydrophobicContact CD1-CD2 4.35Å; L698-A753 PolarHBondContact N-O 3.1Å; L698-T754 WeakPolarHBondContact O-CA 3.33Å
699	P	92	Very high	91.8	Very high	6 Å²	6	30.7 Å²	30.7	4%	0.039	17%	0.167	C	C	.	.	S	Bend	trans	-59.8	-38.4	-173.6	-26.7	33.5	0	0	0	114.7	L673 E703 L774 K776 T791	L673-P699 HydrophobicContact CD2-CG 4.15Å; P699-E703 HydrophobicContact CB-CG 4.34Å; P699-E703 HydrophobicContact CG-CG 4.16Å; P699-L774 HydrophobicContact CG-CB 3.79Å; P699-L774 HydrophobicContact CG-CD1 4.48Å; P699-K776 HydrophobicContact CB-CG 4.29Å; P699-K776 WeakPolarHBondContact O-CG 3.48Å; P699-K776 PolarHBondContact O-N 3.01Å; P699-T791 HydrophobicContact CB-CG2 4.08Å; P699-T791 HydrophobicContact CG-CG2 4.28Å
700	G	88.1	Confident	92	Very high	2 Å²	2	33.4 Å²	33.4	2%	0.021	17%	0.171	C	C	.	.	S	Bend	trans	-169.3	-167.6	-175	0	0	0	0	0	113.1	L698 E703 I704	L698-G700 VanDerWaalsContact C-N 3.32Å; L698-G700 PolarHBondContact O-N 3.41Å; G700-E703 WeakPolarHBondContact CA-OE2 3.33Å; G700-E703 PolarHBondContact N-OE2 3.04Å; G700-E703 PolarHBondContact O-N 3.44Å; G700-E703 VanDerWaalsContact O-OE2 3.08Å; G700-I704 VanDerWaalsContact O-CG1 3.28Å; G700-I704 WeakPolarHBondContact O-CG1 3.29Å; G700-I704 PolarHBondContact O-N 2.84Å
701	W	83.8	Confident	92	Very high	30 Å²	30	28 Å²	28	11%	0.114	15%	0.145	C	C	.	.	H	α-helix	trans	-67.3	-38.4	-172.6	-175.6	-101.3	0	0	0	114.7	E703 I704 K705 P726 H728 I731 L938 Q939	W701-E703 VanDerWaalsContact C-N 3.27Å; W701-E703 PolarHBondContact O-N 3.32Å; W701-I704 HydrophobicContact CE3-CG2 4.44Å; W701-I704 HydrophobicContact CZ3-CG2 4.47Å; W701-I704 PolarHBondContact O-N 3.25Å; W701-K705 HydrophobicContact CD2-CG 4.24Å; W701-K705 HydrophobicContact CZ2-CD 4.17Å; W701-K705 HydrophobicContact CZ2-CG 4.01Å; W701-K705 WeakPolarHBondContact O-CB 3.37Å; W701-K705 PolarHBondContact O-N 2.8Å; W701-P726 HydrophobicContact CH2-CB 4.38Å; W701-P726 HydrophobicContact CZ3-CB 4.14Å; W701-H728 HydrophobicContact CE3-CB 3.8Å; W701-H728 HydrophobicContact CZ3-CB 4.02Å; W701-I731 HydrophobicContact CH2-CD1 4.2Å; W701-I731 HydrophobicContact CH2-CG1 4.38Å; W701-I731 HydrophobicContact CZ3-CD1 3.73Å; W701-I731 HydrophobicContact CZ3-CG1 4.03Å; W701-L938 HydrophobicContact CB-CD1 3.94Å; W701-L938 HydrophobicContact CD2-CB 4.42Å; W701-L938 HydrophobicContact CD2-CD1 3.89Å; W701-L938 HydrophobicContact CG-CB 4Å; W701-L938 HydrophobicContact CG-CD1 3.57Å; W701-L938 HydrophobicContact CG-CG 4.34Å; W701-L938 VanDerWaalsContact NE1-CB 3.25Å; W701-Q939 HydrophobicContact CZ2-CG 3.72Å
702	Q	84.1	Confident	92	Very high	126 Å²	126	26.6 Å²	26.6	59%	0.589	13%	0.13	S	C	*	.	H	α-helix	trans	-63	-40.8	-179	-178.9	172.4	-8.4	0	0	110.4	K705 G706	Q702-K705 PolarHBondContact O-N 2.77Å; Q702-G706 PolarHBondContact O-N 3.06Å
703	E	92.4	Very high	92	Very high	28 Å²	28	31.5 Å²	31.5	13%	0.131	15%	0.146	C	C	.	.	H	α-helix	trans	-70.5	-44.2	177.7	-56	79	-172.4	0	0	110.6	L673 L675 L698 P699 G700 W701 K705 G706 V707 K776	L673-E703 HydrophobicContact CD2-CB 4.4Å; L673-E703 HydrophobicContact CD2-CG 4.48Å; L675-E703 HydrophobicContact CD2-CB 3.99Å; L675-E703 HydrophobicContact CD2-CG 4.26Å; L698-E703 HydrophobicContact CB-CB 4.28Å; P699-E703 HydrophobicContact CB-CG 4.34Å; P699-E703 HydrophobicContact CG-CG 4.16Å; G700-E703 WeakPolarHBondContact CA-OE2 3.33Å; G700-E703 PolarHBondContact N-OE2 3.04Å; G700-E703 PolarHBondContact O-N 3.44Å; G700-E703 VanDerWaalsContact O-OE2 3.08Å; W701-E703 VanDerWaalsContact C-N 3.27Å; W701-E703 PolarHBondContact O-N 3.32Å; E703-K705 VanDerWaalsContact C-N 3.31Å; E703-K705 PolarHBondContact O-N 3.23Å; E703-G706 PolarHBondContact O-N 3.19Å; E703-V707 WeakPolarHBondContact O-CG2 3.31Å; E703-V707 PolarHBondContact O-N 3.44Å; E703-K776 IonicContact OE1-NZ 3.77Å; E703-K776 PolarHBondContact OE1-NZ 3.42Å; E703-K776 IonicContact OE2-NZ 3.02Å; E703-K776 PolarHBondContact OE2-NZ 2.65Å
704	I	91.9	Very high	91.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-54.4	-47.4	172.6	-72.6	166.9	0	0	0	111.1	L698 G700 W701 Q708 P726 H728 L752 T754	L698-I704 HydrophobicContact CB-CG1 3.93Å; L698-I704 HydrophobicContact CD1-CB 4.35Å; L698-I704 HydrophobicContact CD1-CG1 3.86Å; L698-I704 HydrophobicContact CG-CG1 4.49Å; G700-I704 VanDerWaalsContact O-CG1 3.28Å; G700-I704 WeakPolarHBondContact O-CG1 3.29Å; G700-I704 PolarHBondContact O-N 2.84Å; W701-I704 HydrophobicContact CE3-CG2 4.44Å; W701-I704 HydrophobicContact CZ3-CG2 4.47Å; W701-I704 PolarHBondContact O-N 3.25Å; I704-Q708 VanDerWaalsContact O-CB 3.25Å; I704-Q708 WeakPolarHBondContact O-CB 3.14Å; I704-Q708 PolarHBondContact O-N 2.75Å; I704-P726 HydrophobicContact CG2-CB 3.62Å; I704-H728 HydrophobicContact CD1-CB 4.39Å; I704-L752 HydrophobicContact CG1-CB 4.39Å; I704-L752 HydrophobicContact CG2-CB 3.93Å; I704-T754 HydrophobicContact CD1-CG2 3.79Å
705	K	87.7	Confident	91.1	Very high	49 Å²	49	35.1 Å²	35.1	21%	0.213	17%	0.173	C	C	.	.	H	α-helix	trans	-71.6	-41	-179.2	-78.9	-71	171.1	-176	0	112.9	W701 Q702 E703 V707 Q708 Q709 Q939	W701-K705 HydrophobicContact CD2-CG 4.24Å; W701-K705 HydrophobicContact CZ2-CD 4.17Å; W701-K705 HydrophobicContact CZ2-CG 4.01Å; W701-K705 WeakPolarHBondContact O-CB 3.37Å; W701-K705 PolarHBondContact O-N 2.8Å; Q702-K705 PolarHBondContact O-N 2.77Å; E703-K705 VanDerWaalsContact C-N 3.31Å; E703-K705 PolarHBondContact O-N 3.23Å; K705-V707 VanDerWaalsContact C-N 3.29Å; K705-V707 PolarHBondContact O-N 2.85Å; K705-Q708 PolarHBondContact O-N 3.21Å; K705-Q709 WeakPolarHBondContact O-CB 3.21Å; K705-Q709 PolarHBondContact O-N 3.12Å; K705-Q939 HydrophobicContact CD-CG 4.49Å; K705-Q939 VanDerWaalsContact CE-CD 3.42Å; K705-Q939 VanDerWaalsContact NZ-CD 3.34Å
706	G	91.1	Very high	90.2	Very high	9 Å²	9	36.8 Å²	36.8	9%	0.093	19%	0.191	C	C	.	.	H	α-helix	trans	-61.7	-39.1	178	0	0	0	0	0	112.2	Q702 E703 R710	Q702-G706 PolarHBondContact O-N 3.06Å; E703-G706 PolarHBondContact O-N 3.19Å; G706-R710 WeakPolarHBondContact O-CB 3.31Å; G706-R710 WeakPolarHBondContact O-CD 3.15Å; G706-R710 VanDerWaalsContact O-CG 3.22Å; G706-R710 WeakPolarHBondContact O-CG 3.44Å; G706-R710 PolarHBondContact O-N 2.91Å; G706-R710 PolarHBondContact O-NH1 3.38Å
707	V	95.1	Very high	88.8	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-71.7	-43.8	173.2	175.2	0	0	0	0	111.2	L675 V678 L698 E703 K705 Q709 R710 L711 L752	L675-V707 HydrophobicContact CB-CG2 4.31Å; L675-V707 HydrophobicContact CD2-CG2 4.09Å; V678-V707 HydrophobicContact CB-CG2 3.93Å; V678-V707 HydrophobicContact CG1-CB 4.47Å; V678-V707 HydrophobicContact CG1-CG1 3.84Å; V678-V707 HydrophobicContact CG1-CG2 3.73Å; V678-V707 HydrophobicContact CG2-CG2 4.48Å; L698-V707 HydrophobicContact CD1-CB 4.22Å; L698-V707 HydrophobicContact CD1-CG2 4.07Å; L698-V707 HydrophobicContact CD2-CG2 4.41Å; E703-V707 WeakPolarHBondContact O-CG2 3.31Å; E703-V707 PolarHBondContact O-N 3.44Å; K705-V707 VanDerWaalsContact C-N 3.29Å; K705-V707 PolarHBondContact O-N 2.85Å; V707-Q709 PolarHBondContact O-N 3.42Å; V707-R710 PolarHBondContact O-N 3.01Å; V707-L711 HydrophobicContact CG1-CD1 3.81Å; V707-L711 HydrophobicContact CG1-CG 4.28Å; V707-L711 WeakPolarHBondContact O-CB 3.23Å; V707-L711 VanDerWaalsContact O-CG 3.29Å; V707-L711 WeakPolarHBondContact O-CG 3.38Å; V707-L711 PolarHBondContact O-N 2.91Å; V707-L752 HydrophobicContact CB-CD1 4.44Å; V707-L752 HydrophobicContact CG1-CD1 4.19Å; V707-L752 HydrophobicContact CG1-CD2 3.98Å
708	Q	92.1	Very high	87.7	Confident	17 Å²	17	50.7 Å²	50.7	8%	0.079	26%	0.258	C	S	.	.	H	α-helix	trans	-56.6	-49.2	177.6	179.9	171.7	31.8	0	0	111.6	I704 K705 L711 Q712 I724 L752	I704-Q708 VanDerWaalsContact O-CB 3.25Å; I704-Q708 WeakPolarHBondContact O-CB 3.14Å; I704-Q708 PolarHBondContact O-N 2.75Å; K705-Q708 PolarHBondContact O-N 3.21Å; Q708-L711 PolarHBondContact O-N 3Å; Q708-Q712 WeakPolarHBondContact O-CG 3.46Å; Q708-Q712 PolarHBondContact O-N 3.07Å; Q708-I724 HydrophobicContact CG-CG2 4.06Å; Q708-L752 HydrophobicContact CB-CD1 3.76Å
709	Q	90.3	Very high	86.4	Confident	106 Å²	106	55.3 Å²	55.3	50%	0.495	28%	0.28	S	S	.	.	H	α-helix	trans	-61.1	-50.3	-179.7	178.8	-179.7	-2.9	0	0	111	K705 V707 L711 Q712 E713	K705-Q709 WeakPolarHBondContact O-CB 3.21Å; K705-Q709 PolarHBondContact O-N 3.12Å; V707-Q709 PolarHBondContact O-N 3.42Å; Q709-L711 VanDerWaalsContact C-N 3.3Å; Q709-L711 PolarHBondContact O-N 2.88Å; Q709-Q712 PolarHBondContact O-N 3.42Å; Q709-Q712 VanDerWaalsContact O-N 3.13Å; Q709-E713 HydrophobicContact CG-CG 4.41Å; Q709-E713 VanDerWaalsContact CG-OE1 3.26Å; Q709-E713 WeakPolarHBondContact CG-OE1 3.14Å; Q709-E713 PolarHBondContact NE2-OE1 3.01Å; Q709-E713 WeakPolarHBondContact O-CB 3.31Å; Q709-E713 WeakPolarHBondContact O-CG 3.25Å; Q709-E713 PolarHBondContact O-N 2.89Å
710	R	93.3	Very high	85.8	Confident	78 Å²	78	60 Å²	60	29%	0.294	31%	0.313	S	S	.	.	H	α-helix	trans	-59.1	-40.1	178.1	-74.6	169.6	169	74.6	-1.9	112.4	D676 T679 G706 V707 A714	D676-R710 WeakPolarHBondContact OD1-CD 3.47Å; D676-R710 IonicContact OD1-CZ 3.37Å; D676-R710 IonicContact OD1-NE 2.73Å; D676-R710 PolarHBondContact OD1-NE 3.41Å; D676-R710 IonicContact OD1-NH2 3.08Å; T679-R710 HydrophobicContact CG2-CB 3.87Å; T679-R710 VanDerWaalsContact OG1-CB 3.32Å; T679-R710 WeakPolarHBondContact OG1-CB 3.38Å; G706-R710 WeakPolarHBondContact O-CB 3.31Å; G706-R710 WeakPolarHBondContact O-CD 3.15Å; G706-R710 VanDerWaalsContact O-CG 3.22Å; G706-R710 WeakPolarHBondContact O-CG 3.44Å; G706-R710 PolarHBondContact O-N 2.91Å; G706-R710 PolarHBondContact O-NH1 3.38Å; V707-R710 PolarHBondContact O-N 3.01Å; R710-A714 VanDerWaalsContact O-CB 3.26Å; R710-A714 WeakPolarHBondContact O-CB 3.27Å; R710-A714 PolarHBondContact O-N 3.42Å
711	L	93.4	Very high	85.8	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-63.5	-47.1	174	-73.9	170.1	0	0	0	111.4	T679 V682 L683 V707 Q708 Q709 E713 A714 L715 I724 I750	T679-L711 HydrophobicContact CG2-CD2 3.99Å; T679-L711 HydrophobicContact CG2-CG 4.29Å; V682-L711 HydrophobicContact CB-CD2 4Å; V682-L711 HydrophobicContact CG1-CD1 4.11Å; V682-L711 HydrophobicContact CG1-CD2 3.64Å; L683-L711 HydrophobicContact CD2-CD2 4.07Å; L683-L711 HydrophobicContact CG-CD2 4.15Å; V707-L711 HydrophobicContact CG1-CD1 3.81Å; V707-L711 HydrophobicContact CG1-CG 4.28Å; V707-L711 WeakPolarHBondContact O-CB 3.23Å; V707-L711 VanDerWaalsContact O-CG 3.29Å; V707-L711 WeakPolarHBondContact O-CG 3.38Å; V707-L711 PolarHBondContact O-N 2.91Å; Q708-L711 PolarHBondContact O-N 3Å; Q709-L711 VanDerWaalsContact C-N 3.3Å; Q709-L711 PolarHBondContact O-N 2.88Å; L711-E713 VanDerWaalsContact C-N 3.32Å; L711-E713 PolarHBondContact O-N 3.41Å; L711-A714 PolarHBondContact O-N 3.31Å; L711-L715 HydrophobicContact CB-CD1 4.29Å; L711-L715 WeakPolarHBondContact O-CB 3.3Å; L711-L715 WeakPolarHBondContact O-CD1 3.47Å; L711-L715 WeakPolarHBondContact O-CG 3.33Å; L711-L715 PolarHBondContact O-N 2.95Å; L711-I724 HydrophobicContact CB-CD1 4.05Å; L711-I750 HydrophobicContact CD1-CG2 4.21Å
712	Q	89.9	Confident	86.2	Confident	73 Å²	73	65.9 Å²	65.9	34%	0.341	34%	0.338	S	S	.	.	H	α-helix	trans	-62.1	-40.6	178.6	-72.1	178.2	-59	0	0	112.1	Q708 Q709 G716 E719 I724	Q708-Q712 WeakPolarHBondContact O-CG 3.46Å; Q708-Q712 PolarHBondContact O-N 3.07Å; Q709-Q712 PolarHBondContact O-N 3.42Å; Q709-Q712 VanDerWaalsContact O-N 3.13Å; Q712-G716 PolarHBondContact O-N 3.43Å; Q712-E719 PolarHBondContact NE2-OE1 2.93Å; Q712-I724 HydrophobicContact CG-CD1 4.07Å
713	E	89.3	Confident	86.5	Confident	130 Å²	130	62.7 Å²	62.7	61%	0.607	32%	0.324	S	S	*	.	H	α-helix	trans	-64.5	-44.8	175.6	-72.1	173.4	-173.2	0	0	112	Q709 L711	Q709-E713 HydrophobicContact CG-CG 4.41Å; Q709-E713 VanDerWaalsContact CG-OE1 3.26Å; Q709-E713 WeakPolarHBondContact CG-OE1 3.14Å; Q709-E713 PolarHBondContact NE2-OE1 3.01Å; Q709-E713 WeakPolarHBondContact O-CB 3.31Å; Q709-E713 WeakPolarHBondContact O-CG 3.25Å; Q709-E713 PolarHBondContact O-N 2.89Å; L711-E713 VanDerWaalsContact C-N 3.32Å; L711-E713 PolarHBondContact O-N 3.41Å
714	A	87.2	Confident	86.4	Confident	61 Å²	61	62.4 Å²	62.4	50%	0.504	32%	0.324	S	S	.	.	H	α-helix	trans	-70.4	-34.9	179.5	0	0	0	0	0	113.2	L683 R710 L711	L683-A714 HydrophobicContact CD1-CB 3.76Å; L683-A714 HydrophobicContact CD2-CB 4.46Å; R710-A714 VanDerWaalsContact O-CB 3.26Å; R710-A714 WeakPolarHBondContact O-CB 3.27Å; R710-A714 PolarHBondContact O-N 3.42Å; L711-A714 PolarHBondContact O-N 3.31Å
715	L	85.1	Confident	86.3	Confident	17 Å²	17	63.7 Å²	63.7	9%	0.089	33%	0.33	C	S	.	.	H	α-helix	trans	-82.4	-25.4	-177.7	-64.6	170.3	0	0	0	112.7	L683 L711 M717 H718 Y722 I724	L683-L715 HydrophobicContact CD2-CD2 3.58Å; L683-L715 HydrophobicContact CD2-CG 4.12Å; L711-L715 HydrophobicContact CB-CD1 4.29Å; L711-L715 WeakPolarHBondContact O-CB 3.3Å; L711-L715 WeakPolarHBondContact O-CD1 3.47Å; L711-L715 WeakPolarHBondContact O-CG 3.33Å; L711-L715 PolarHBondContact O-N 2.95Å; L715-M717 PolarHBondContact O-N 3.48Å; L715-H718 WeakPolarHBondContact O-CB 3.33Å; L715-H718 PolarHBondContact O-N 2.9Å; L715-Y722 HydrophobicContact CB-CD2 4.3Å; L715-Y722 HydrophobicContact CB-CE2 4.28Å; L715-Y722 HydrophobicContact CD1-CD1 4.08Å; L715-Y722 HydrophobicContact CD1-CD2 3.77Å; L715-Y722 HydrophobicContact CD1-CE1 4.38Å; L715-Y722 HydrophobicContact CD1-CE2 4.1Å; L715-Y722 HydrophobicContact CD1-CG 3.76Å; L715-Y722 HydrophobicContact CD2-CD2 4.11Å; L715-Y722 HydrophobicContact CD2-CE1 4.04Å; L715-Y722 HydrophobicContact CD2-CE2 3.54Å; L715-Y722 VanDerWaalsContact CD2-CZ 3.49Å; L715-Y722 HydrophobicContact CG-CD2 4.26Å; L715-Y722 HydrophobicContact CG-CE2 4.16Å; L715-I724 HydrophobicContact CD1-CD1 4.18Å
716	G	77.1	Confident	86.4	Confident	38 Å²	38	63 Å²	63	39%	0.392	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	49	-121.3	170.6	0	0	0	0	0	114.2	Q712 H718 E719	Q712-G716 PolarHBondContact O-N 3.43Å; G716-H718 PolarHBondContact O-N 2.91Å; G716-H718 VanDerWaalsContact O-N 3.13Å; G716-E719 PolarHBondContact O-N 3.03Å
717	M	67.2	Low	86	Confident	185 Å²	185	62.7 Å²	62.7	91%	0.911	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-67	-10.6	-177	-63.5	-68.6	151.4	0	0	114.3	L715	L715-M717 PolarHBondContact O-N 3.48Å
718	H	74.3	Confident	85.5	Confident	106 Å²	106	64 Å²	64	49%	0.491	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-92.3	9.8	179.4	-64.1	-52.6	0	0	0	113.6	L715 G716 S720 K721 Y722	L715-H718 WeakPolarHBondContact O-CB 3.33Å; L715-H718 PolarHBondContact O-N 2.9Å; G716-H718 PolarHBondContact O-N 2.91Å; G716-H718 VanDerWaalsContact O-N 3.13Å; H718-S720 PolarHBondContact O-N 3.31Å; H718-K721 WeakPolarHBondContact O-CB 3.46Å; H718-K721 PolarHBondContact O-N 2.9Å; H718-Y722 HydrophobicContact CB-CE2 4.05Å; H718-Y722 WeakPolarHBondContact O-CD2 3.45Å; H718-Y722 WeakPolarHBondContact O-CE2 3.45Å
719	E	69.1	Low	84.6	Confident	101 Å²	101	66.5 Å²	66.5	47%	0.472	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-51.1	-32.7	-177.6	-167.7	173.3	-158.9	0	0	113.6	Q712 G716 K721 Y722	Q712-E719 PolarHBondContact NE2-OE1 2.93Å; G716-E719 PolarHBondContact O-N 3.03Å; E719-K721 PolarHBondContact O-N 3.48Å; E719-K721 VanDerWaalsContact O-N 3.14Å; E719-Y722 PolarHBondContact O-N 2.96Å; E719-Y722 VanDerWaalsContact O-O 3.09Å
720	S	79.4	Confident	83.4	Confident	105 Å²	105	65.5 Å²	65.5	73%	0.734	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-64.3	-16.4	177.2	59.6	0	0	0	0	115	H718 Y722	H718-S720 PolarHBondContact O-N 3.31Å; S720-Y722 VanDerWaalsContact C-N 3.3Å
721	K	88.3	Confident	82.2	Confident	113 Å²	113	62.9 Å²	62.9	49%	0.491	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-84.9	-3	173.4	-64.4	-175.6	176.7	179.8	0	113.1	H718 E719 V747 R748	H718-K721 WeakPolarHBondContact O-CB 3.46Å; H718-K721 PolarHBondContact O-N 2.9Å; E719-K721 PolarHBondContact O-N 3.48Å; E719-K721 VanDerWaalsContact O-N 3.14Å; K721-V747 CarbonylContact O-C 3.51Å; K721-V747 VanDerWaalsContact O-CA 3.25Å; K721-V747 WeakPolarHBondContact O-CA 3.38Å; K721-R748 PolarHBondContact O-N 3.3Å
722	Y	90.9	Very high	80.7	Confident	42 Å²	42	63.9 Å²	63.9	17%	0.165	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	137.5	-172.8	-57.4	-81.3	0	0	0	111.3	D686 L715 H718 E719 S720 R748 I750	D686-Y722 WeakPolarHBondContact OD2-CE1 3.4Å; D686-Y722 PolarHBondContact OD2-OH 3.22Å; L715-Y722 HydrophobicContact CB-CD2 4.3Å; L715-Y722 HydrophobicContact CB-CE2 4.28Å; L715-Y722 HydrophobicContact CD1-CD1 4.08Å; L715-Y722 HydrophobicContact CD1-CD2 3.77Å; L715-Y722 HydrophobicContact CD1-CE1 4.38Å; L715-Y722 HydrophobicContact CD1-CE2 4.1Å; L715-Y722 HydrophobicContact CD1-CG 3.76Å; L715-Y722 HydrophobicContact CD2-CD2 4.11Å; L715-Y722 HydrophobicContact CD2-CE1 4.04Å; L715-Y722 HydrophobicContact CD2-CE2 3.54Å; L715-Y722 VanDerWaalsContact CD2-CZ 3.49Å; L715-Y722 HydrophobicContact CG-CD2 4.26Å; L715-Y722 HydrophobicContact CG-CE2 4.16Å; H718-Y722 HydrophobicContact CB-CE2 4.05Å; H718-Y722 WeakPolarHBondContact O-CD2 3.45Å; H718-Y722 WeakPolarHBondContact O-CE2 3.45Å; E719-Y722 PolarHBondContact O-N 2.96Å; E719-Y722 VanDerWaalsContact O-O 3.09Å; S720-Y722 VanDerWaalsContact C-N 3.3Å; Y722-R748 CarbonylContact C-O 3.57Å; Y722-R748 WeakPolarHBondContact CA-O 3.32Å; Y722-R748 HydrophobicContact CD1-CB 3.91Å; Y722-R748 HydrophobicContact CD1-CG 4.46Å; Y722-R748 HydrophobicContact CE1-CB 4.12Å; Y722-I750 HydrophobicContact CD1-CD1 4.09Å
723	L	91	Very high	79.5	Confident	58 Å²	58	62.7 Å²	62.7	30%	0.304	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	92.3	171	179.8	61.6	0	0	0	108.4	L725 P743 V747 R748 K749 I750	L723-L725 HydrophobicContact CD1-CD2 3.83Å; L723-L725 HydrophobicContact CD1-CG 4.27Å; L723-L725 HydrophobicContact CD2-CD1 4.12Å; L723-L725 HydrophobicContact CD2-CG 4.48Å; L723-L725 HydrophobicContact CG-CD1 4.11Å; L723-L725 HydrophobicContact CG-CD2 4.04Å; L723-L725 HydrophobicContact CG-CG 3.92Å; L723-P743 HydrophobicContact CD2-CB 4.43Å; L723-V747 HydrophobicContact CB-CG1 3.85Å; L723-R748 PolarHBondContact N-O 3.19Å; L723-K749 HydrophobicContact CD2-CG 4.41Å; L723-K749 WeakPolarHBondContact O-CA 3.42Å; L723-I750 PolarHBondContact O-N 3.44Å
724	I	91.3	Very high	78.3	Confident	23 Å²	23	62.2 Å²	62.2	12%	0.118	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	113	-179.2	-53.1	174.7	0	0	0	109.6	Q708 L711 Q712 L715 I750 L752	Q708-I724 HydrophobicContact CG-CG2 4.06Å; L711-I724 HydrophobicContact CB-CD1 4.05Å; Q712-I724 HydrophobicContact CG-CD1 4.07Å; L715-I724 HydrophobicContact CD1-CD1 4.18Å; I724-I750 CarbonylContact C-O 3.55Å; I724-I750 WeakPolarHBondContact CA-O 3.35Å; I724-I750 HydrophobicContact CG1-CB 4.35Å; I724-I750 HydrophobicContact CG1-CD1 4.35Å; I724-L752 HydrophobicContact CG2-CD1 3.94Å; I724-L752 HydrophobicContact CG2-CG 4.38Å
725	L	90	Very high	77.3	Confident	27 Å²	27	63.3 Å²	63.3	14%	0.141	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	103.6	-174.1	-61.7	177.4	0	0	0	110.6	L723 A738 K749 I750 V751 L752	L723-L725 HydrophobicContact CD1-CD2 3.83Å; L723-L725 HydrophobicContact CD1-CG 4.27Å; L723-L725 HydrophobicContact CD2-CD1 4.12Å; L723-L725 HydrophobicContact CD2-CG 4.48Å; L723-L725 HydrophobicContact CG-CD1 4.11Å; L723-L725 HydrophobicContact CG-CD2 4.04Å; L723-L725 HydrophobicContact CG-CG 3.92Å; L725-A738 HydrophobicContact CD2-CB 4.41Å; L725-K749 HydrophobicContact CD1-CG 4.39Å; L725-I750 PolarHBondContact N-O 3.11Å; L725-V751 WeakPolarHBondContact O-CA 3.14Å; L725-L752 PolarHBondContact O-N 3.34Å
726	P	88.5	Confident	76.5	Confident	33 Å²	33	63.1 Å²	63.1	21%	0.214	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	139.3	168.3	29.9	-33.1	0	0	0	110.2	W701 I704 I731 L752	W701-P726 HydrophobicContact CH2-CB 4.38Å; W701-P726 HydrophobicContact CZ3-CB 4.14Å; I704-P726 HydrophobicContact CG2-CB 3.62Å; P726-I731 VanDerWaalsContact C-CD1 3.46Å; P726-I731 HydrophobicContact CB-CD1 4.2Å; P726-I731 HydrophobicContact CG-CD1 4.41Å; P726-I731 WeakPolarHBondContact O-CD1 3.34Å; P726-L752 CarbonylContact C-O 3.53Å; P726-L752 WeakPolarHBondContact CA-O 3.33Å
727	V	84.4	Confident	76.3	Confident	3 Å²	3	66 Å²	66	2%	0.018	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	115.8	179.8	-169.1	0	0	0	0	109.5	Q736 I739 V751 L752 A753 T754 I756	V727-Q736 HydrophobicContact CG1-CG 4.44Å; V727-I739 HydrophobicContact CG2-CD1 3.92Å; V727-I739 HydrophobicContact CG2-CG1 4.35Å; V727-V751 HydrophobicContact CG2-CG1 3.58Å; V727-L752 PolarHBondContact N-O 3.03Å; V727-A753 HydrophobicContact CB-CB 3.9Å; V727-A753 VanDerWaalsContact O-CA 3.3Å; V727-A753 WeakPolarHBondContact O-CA 3.34Å; V727-T754 PolarHBondContact O-N 3.44Å; V727-I756 HydrophobicContact CB-CG2 4.38Å; V727-I756 HydrophobicContact CG1-CG2 3.66Å
728	H	83.3	Confident	76.7	Confident	27 Å²	27	58.6 Å²	58.6	13%	0.125	31%	0.309	C	S	.	.			trans	-149.2	153.3	-177.4	-176.2	-80.9	0	0	0	108.9	W701 I704 N730 I731 Q736 T754	W701-H728 HydrophobicContact CE3-CB 3.8Å; W701-H728 HydrophobicContact CZ3-CB 4.02Å; I704-H728 HydrophobicContact CD1-CB 4.39Å; H728-N730 PolarHBondContact ND1-N 2.83Å; H728-N730 PolarHBondContact O-N 3.31Å; H728-N730 VanDerWaalsContact O-N 3.16Å; H728-I731 HydrophobicContact CB-CD1 4.1Å; H728-I731 HydrophobicContact CB-CG1 4.08Å; H728-I731 VanDerWaalsContact O-CB 3.3Å; H728-I731 WeakPolarHBondContact O-CB 3.41Å; H728-I731 PolarHBondContact O-N 3.48Å; H728-Q736 PolarHBondContact O-NE2 2.86Å; H728-T754 VanDerWaalsContact CD2-CG2 3.44Å; H728-T754 WeakPolarHBondContact CD2-CG2 3.39Å
729	S	72.9	Confident	77	Confident	71 Å²	71	53.7 Å²	53.7	50%	0.497	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-37	-178	53.8	0	0	0	0	113.9	I731	S729-I731 VanDerWaalsContact C-N 3.27Å; S729-I731 PolarHBondContact O-N 3.01Å
730	N	66.3	Low	77.6	Confident	84 Å²	84	52.2 Å²	52.2	45%	0.449	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-18.5	176.2	-65.7	-1.1	0	0	0	114	H728 R931	H728-N730 PolarHBondContact ND1-N 2.83Å; H728-N730 PolarHBondContact O-N 3.31Å; H728-N730 VanDerWaalsContact O-N 3.16Å; N730-R931 PolarHBondContact O-NH1 2.74Å; N730-R931 PolarHBondContact O-NH2 3.38Å
731	I	68	Low	77.7	Confident	23 Å²	23	53.4 Å²	53.4	12%	0.118	27%	0.273	C	S	.	.	S	Bend	trans	-70.6	132	178.4	-59.3	178.4	0	0	0	109.2	W701 P726 H728 S729 D735 Q736	W701-I731 HydrophobicContact CH2-CD1 4.2Å; W701-I731 HydrophobicContact CH2-CG1 4.38Å; W701-I731 HydrophobicContact CZ3-CD1 3.73Å; W701-I731 HydrophobicContact CZ3-CG1 4.03Å; P726-I731 VanDerWaalsContact C-CD1 3.46Å; P726-I731 HydrophobicContact CB-CD1 4.2Å; P726-I731 HydrophobicContact CG-CD1 4.41Å; P726-I731 WeakPolarHBondContact O-CD1 3.34Å; H728-I731 HydrophobicContact CB-CD1 4.1Å; H728-I731 HydrophobicContact CB-CG1 4.08Å; H728-I731 VanDerWaalsContact O-CB 3.3Å; H728-I731 WeakPolarHBondContact O-CB 3.41Å; H728-I731 PolarHBondContact O-N 3.48Å; S729-I731 VanDerWaalsContact C-N 3.27Å; S729-I731 PolarHBondContact O-N 3.01Å; I731-D735 HydrophobicContact CG2-CB 3.81Å; I731-Q736 HydrophobicContact CB-CG 4.18Å; I731-Q736 HydrophobicContact CG2-CG 4.01Å; I731-Q736 PolarHBondContact O-NE2 2.93Å
732	P	61.5	Low	77.4	Confident	22 Å²	22	56 Å²	56	14%	0.143	29%	0.286	C	S	.	.			trans	-55.1	141.8	177.4	-24.8	34.5	0	0	0	113.4	M734 D735 Q736 Y991	P732-M734 VanDerWaalsContact C-N 3.26Å; P732-M734 PolarHBondContact O-N 3.44Å; P732-D735 PolarHBondContact O-N 3.14Å; P732-Q736 PolarHBondContact O-N 3.22Å; P732-Y991 HydrophobicContact CB-CE1 3.67Å; P732-Y991 WeakPolarHBondContact CB-OH 3.33Å; P732-Y991 HydrophobicContact CG-CD1 3.84Å; P732-Y991 HydrophobicContact CG-CE1 2.96Å; P732-Y991 HydrophobicContact CG-CE2 4.44Å; P732-Y991 VanDerWaalsContact CG-OH 3.23Å; P732-Y991 WeakPolarHBondContact CG-OH 3.15Å
733	M	65.2	Low	77.1	Confident	48 Å²	48	55.3 Å²	55.3	24%	0.236	29%	0.287	C	S	.	.	H	α-helix	trans	-52.9	-39.1	179.9	-81.4	-81.7	-73.4	0	0	113.8	R516 I517 D735 Q736 K737	R516-M733 HydrophobicContact CG-CE 4.39Å; I517-M733 HydrophobicContact CB-CE 3.84Å; I517-M733 HydrophobicContact CB-SD 3.56Å; I517-M733 VanDerWaalsContact CB-SD 3.56Å; I517-M733 HydrophobicContact CD1-SD 3.95Å; I517-M733 HydrophobicContact CG1-CE 3.93Å; I517-M733 HydrophobicContact CG1-SD 3.84Å; M733-D735 VanDerWaalsContact C-N 3.33Å; M733-D735 PolarHBondContact O-N 3.41Å; M733-Q736 PolarHBondContact O-N 3.23Å; M733-K737 WeakPolarHBondContact O-CG 3.31Å; M733-K737 PolarHBondContact O-N 3.18Å
734	M	63.2	Low	76.9	Confident	120 Å²	120	56.8 Å²	56.8	59%	0.591	30%	0.3	S	S	*	.	H	α-helix	trans	-64.4	-38.9	179.1	-72.7	-156.8	-122.1	0	0	112.2	P732 K737	P732-M734 VanDerWaalsContact C-N 3.26Å; P732-M734 PolarHBondContact O-N 3.44Å; M734-K737 WeakPolarHBondContact O-CB 3.24Å; M734-K737 PolarHBondContact O-N 2.84Å
735	D	65.5	Low	76.5	Confident	83 Å²	83	64.6 Å²	64.6	44%	0.444	34%	0.341	S	S	.	.	H	α-helix	trans	-73.3	-36.8	178.4	-59.5	-21.6	0	0	0	110.3	I731 P732 M733 K737 A738 Y991	I731-D735 HydrophobicContact CG2-CB 3.81Å; P732-D735 PolarHBondContact O-N 3.14Å; M733-D735 VanDerWaalsContact C-N 3.33Å; M733-D735 PolarHBondContact O-N 3.41Å; D735-K737 PolarHBondContact O-N 2.81Å; D735-A738 VanDerWaalsContact O-CB 3.26Å; D735-A738 WeakPolarHBondContact O-CB 3.32Å; D735-A738 PolarHBondContact O-N 2.8Å; D735-A738 VanDerWaalsContact O-N 3.14Å; D735-Y991 PolarHBondContact OD2-OH 3.47Å
736	Q	70.2	Confident	76.3	Confident	13 Å²	13	66.8 Å²	66.8	6%	0.061	37%	0.371	C	S	.	.	H	α-helix	trans	-61.2	-30	172	-65.7	-172.8	23.8	0	0	112.2	I517 V727 H728 I731 P732 M733 A738 I739	I517-Q736 HydrophobicContact CD1-CB 4.29Å; V727-Q736 HydrophobicContact CG1-CG 4.44Å; H728-Q736 PolarHBondContact O-NE2 2.86Å; I731-Q736 HydrophobicContact CB-CG 4.18Å; I731-Q736 HydrophobicContact CG2-CG 4.01Å; I731-Q736 PolarHBondContact O-NE2 2.93Å; P732-Q736 PolarHBondContact O-N 3.22Å; M733-Q736 PolarHBondContact O-N 3.23Å; Q736-A738 PolarHBondContact O-N 2.9Å; Q736-A738 VanDerWaalsContact O-N 3.16Å; Q736-I739 VanDerWaalsContact O-CB 3.23Å; Q736-I739 WeakPolarHBondContact O-CB 3.49Å; Q736-I739 WeakPolarHBondContact O-CG2 3.35Å; Q736-I739 PolarHBondContact O-N 3.33Å
737	K	72.2	Confident	76.5	Confident	99 Å²	99	66.8 Å²	66.8	43%	0.43	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-62.2	-22.1	177.2	-73.8	177.2	-177.5	-178.5	0	113.4	M733 M734 D735 I739 F740	M733-K737 WeakPolarHBondContact O-CG 3.31Å; M733-K737 PolarHBondContact O-N 3.18Å; M734-K737 WeakPolarHBondContact O-CB 3.24Å; M734-K737 PolarHBondContact O-N 2.84Å; D735-K737 PolarHBondContact O-N 2.81Å; K737-I739 PolarHBondContact O-N 3.27Å; K737-F740 HydrophobicContact CB-CD2 4.43Å; K737-F740 PolarHBondContact O-N 3.42Å
738	A	75.8	Confident	76.9	Confident	30 Å²	30	68.1 Å²	68.1	25%	0.248	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-59.3	-26.1	174.1	0	0	0	0	0	111.9	L725 D735 Q736 F740 Q741	L725-A738 HydrophobicContact CD2-CB 4.41Å; D735-A738 VanDerWaalsContact O-CB 3.26Å; D735-A738 WeakPolarHBondContact O-CB 3.32Å; D735-A738 PolarHBondContact O-N 2.8Å; D735-A738 VanDerWaalsContact O-N 3.14Å; Q736-A738 PolarHBondContact O-N 2.9Å; Q736-A738 VanDerWaalsContact O-N 3.16Å; A738-F740 PolarHBondContact O-N 3.14Å; A738-Q741 PolarHBondContact O-N 2.84Å; A738-Q741 VanDerWaalsContact O-N 3.15Å
739	I	80.2	Confident	77.4	Confident	2 Å²	2	66.9 Å²	66.9	1%	0.01	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-60.3	-25.2	175.6	-152.8	-172.5	0	0	0	112.9	V727 Q736 K737 K749 V751 I761 V763	V727-I739 HydrophobicContact CG2-CD1 3.92Å; V727-I739 HydrophobicContact CG2-CG1 4.35Å; Q736-I739 VanDerWaalsContact O-CB 3.23Å; Q736-I739 WeakPolarHBondContact O-CB 3.49Å; Q736-I739 WeakPolarHBondContact O-CG2 3.35Å; Q736-I739 PolarHBondContact O-N 3.33Å; K737-I739 PolarHBondContact O-N 3.27Å; I739-K749 WeakPolarHBondContact O-CE 3.5Å; I739-K749 PolarHBondContact O-NZ 3.04Å; I739-V751 HydrophobicContact CD1-CG1 3.79Å; I739-V751 HydrophobicContact CG1-CG1 3.99Å; I739-V751 HydrophobicContact CG1-CG2 4.04Å; I739-I761 HydrophobicContact CD1-CG2 4.14Å; I739-I761 HydrophobicContact CG2-CG2 4.22Å; I739-V763 HydrophobicContact CD1-CG2 3.42Å; I739-V763 VanDerWaalsContact CD1-CG2 3.42Å; I739-V763 HydrophobicContact CG1-CG1 4.4Å; I739-V763 HydrophobicContact CG1-CG2 3.66Å; I739-V763 HydrophobicContact CG2-CG2 4.33Å; I739-V763 WeakPolarHBondContact O-CG1 3.37Å
740	F	81.1	Confident	78.5	Confident	71 Å²	71	63.6 Å²	63.6	31%	0.311	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-88.8	-13	-178.2	-56.8	-65.2	0	0	0	112.9	I517 K737 A738 I761 T762	I517-F740 HydrophobicContact CD1-CE2 4.08Å; I517-F740 HydrophobicContact CD1-CZ 4.17Å; K737-F740 HydrophobicContact CB-CD2 4.43Å; K737-F740 PolarHBondContact O-N 3.42Å; A738-F740 PolarHBondContact O-N 3.14Å; F740-I761 HydrophobicContact CE1-CG2 3.65Å; F740-I761 HydrophobicContact CZ-CG2 3.78Å; F740-T762 WeakPolarHBondContact CD1-O 3.37Å
741	Q	81.9	Confident	79.8	Confident	130 Å²	130	59.6 Å²	59.6	61%	0.607	32%	0.324	S	S	*	.	S	Bend	trans	-77.6	135.8	179.6	-62.3	179.5	12.4	0	0	109.7	A738 K749	A738-Q741 PolarHBondContact O-N 2.84Å; A738-Q741 VanDerWaalsContact O-N 3.15Å; Q741-K749 PolarHBondContact O-NZ 3.03Å
742	Q	81.8	Confident	81.1	Confident	166 Å²	166	58.5 Å²	58.5	78%	0.776	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-71.2	135.1	172.4	-166.9	169.9	4.3	0	0	108.8
743	P	85.4	Confident	82.6	Confident	29 Å²	29	57.5 Å²	57.5	19%	0.188	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-65.9	153.1	179.2	28.2	-36	0	0	0	110.6	L723 V747 K749 D765	L723-P743 HydrophobicContact CD2-CB 4.43Å; P743-V747 HydrophobicContact CB-CB 4.26Å; P743-V747 HydrophobicContact CB-CG1 4.29Å; P743-K749 HydrophobicContact CB-CB 4.19Å; P743-K749 HydrophobicContact CG-CB 4Å; P743-K749 HydrophobicContact CG-CD 4.5Å; P743-D765 WeakPolarHBondContact CD-OD2 3.22Å
744	P	85.7	Confident	83.9	Confident	89 Å²	89	55.6 Å²	55.6	58%	0.578	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-54.7	155.8	169.1	-23	33.3	0	0	0	112.1	G746 V747	P744-G746 PolarHBondContact O-N 3.2Å; P744-V747 HydrophobicContact CB-CB 4.49Å; P744-V747 HydrophobicContact CB-CG2 3.98Å; P744-V747 HydrophobicContact CG-CG2 4.34Å; P744-V747 WeakPolarHBondContact O-CB 3.26Å; P744-V747 PolarHBondContact O-N 3.04Å
745	L	84.2	Confident	85	Confident	186 Å²	186	52.6 Å²	52.6	97%	0.974	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	131.8	-179.7	-146.3	100.9	0	0	0	110.9	V747	L745-V747 VanDerWaalsContact C-N 3.28Å; L745-V747 PolarHBondContact O-N 3.01Å
746	G	85.8	Confident	85.7	Confident	74 Å²	74	49.2 Å²	49.2	76%	0.763	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	1.8	-178	0	0	0	0	0	115.3	P744	P744-G746 PolarHBondContact O-N 3.2Å
747	V	91.5	Very high	86.3	Confident	33 Å²	33	48.6 Å²	48.6	20%	0.2	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-98.1	124.4	174.9	177.3	0	0	0	0	110.2	K721 L723 P743 P744 L745	K721-V747 CarbonylContact O-C 3.51Å; K721-V747 VanDerWaalsContact O-CA 3.25Å; K721-V747 WeakPolarHBondContact O-CA 3.38Å; L723-V747 HydrophobicContact CB-CG1 3.85Å; P743-V747 HydrophobicContact CB-CB 4.26Å; P743-V747 HydrophobicContact CB-CG1 4.29Å; P744-V747 HydrophobicContact CB-CB 4.49Å; P744-V747 HydrophobicContact CB-CG2 3.98Å; P744-V747 HydrophobicContact CG-CG2 4.34Å; P744-V747 WeakPolarHBondContact O-CB 3.26Å; P744-V747 PolarHBondContact O-N 3.04Å; L745-V747 VanDerWaalsContact C-N 3.28Å; L745-V747 PolarHBondContact O-N 3.01Å
748	R	93.6	Very high	86.7	Confident	31 Å²	31	44.3 Å²	44.3	12%	0.117	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	122.4	173.5	-178.9	81.6	85.7	176.5	3.8	109.3	I685 D686 G689 E690 G692 I694 K721 Y722 L723 I750	I685-R748 PolarHBondContact O-NH2 2.96Å; D686-R748 PolarHBondContact O-NH2 3.21Å; D686-R748 WeakPolarHBondContact OD1-CG 3.47Å; D686-R748 IonicContact OD1-CZ 3.72Å; D686-R748 IonicContact OD1-NE 3.83Å; D686-R748 PolarHBondContact OD1-NE 3.36Å; D686-R748 IonicContact OD1-NH2 2.8Å; G689-R748 PolarHBondContact O-NH2 3.49Å; E690-R748 PolarHBondContact O-NH1 3.46Å; G692-R748 WeakPolarHBondContact O-CD 3.23Å; G692-R748 PolarHBondContact O-NH1 3.46Å; I694-R748 HydrophobicContact CD1-CG 4.4Å; K721-R748 PolarHBondContact O-N 3.3Å; Y722-R748 CarbonylContact C-O 3.57Å; Y722-R748 WeakPolarHBondContact CA-O 3.32Å; Y722-R748 HydrophobicContact CD1-CB 3.91Å; Y722-R748 HydrophobicContact CD1-CG 4.46Å; Y722-R748 HydrophobicContact CE1-CB 4.12Å; L723-R748 PolarHBondContact N-O 3.19Å; R748-I750 HydrophobicContact CG-CG1 4.23Å
749	K	94.2	Very high	86.4	Confident	1 Å²	1	43.1 Å²	43.1	0%	0.004	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	129.6	174.1	-177.4	179.1	175.5	-178.2	0	110.7	G693 I694 L723 L725 I739 Q741 P743 V751 D765	G693-K749 CarbonylContact C-O 3.57Å; G693-K749 VanDerWaalsContact CA-O 3.32Å; G693-K749 WeakPolarHBondContact CA-O 3.48Å; I694-K749 PolarHBondContact N-O 2.84Å; L723-K749 HydrophobicContact CD2-CG 4.41Å; L723-K749 WeakPolarHBondContact O-CA 3.42Å; L725-K749 HydrophobicContact CD1-CG 4.39Å; I739-K749 WeakPolarHBondContact O-CE 3.5Å; I739-K749 PolarHBondContact O-NZ 3.04Å; Q741-K749 PolarHBondContact O-NZ 3.03Å; P743-K749 HydrophobicContact CB-CB 4.19Å; P743-K749 HydrophobicContact CG-CB 4Å; P743-K749 HydrophobicContact CG-CD 4.5Å; K749-V751 HydrophobicContact CD-CG2 4.48Å; K749-V751 HydrophobicContact CG-CG2 4.12Å; K749-D765 WeakPolarHBondContact CD-OD2 3.24Å; K749-D765 IonicContact NZ-OD1 3.9Å; K749-D765 PolarHBondContact NZ-OD1 2.97Å; K749-D765 IonicContact NZ-OD2 2.61Å; K749-D765 PolarHBondContact NZ-OD2 3.24Å
750	I	95.1	Very high	85.8	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	110.2	179.2	-56.7	172.1	0	0	0	107.5	V682 I694 L711 Y722 L723 I724 L725 R748 L752	V682-I750 HydrophobicContact CG1-CD1 3.91Å; V682-I750 HydrophobicContact CG1-CG2 4.24Å; I694-I750 HydrophobicContact CD1-CG1 4.38Å; I694-I750 CarbonylContact O-C 3.6Å; I694-I750 WeakPolarHBondContact O-CA 3.4Å; L711-I750 HydrophobicContact CD1-CG2 4.21Å; Y722-I750 HydrophobicContact CD1-CD1 4.09Å; L723-I750 PolarHBondContact O-N 3.44Å; I724-I750 CarbonylContact C-O 3.55Å; I724-I750 WeakPolarHBondContact CA-O 3.35Å; I724-I750 HydrophobicContact CG1-CB 4.35Å; I724-I750 HydrophobicContact CG1-CD1 4.35Å; L725-I750 PolarHBondContact N-O 3.11Å; R748-I750 HydrophobicContact CG-CG1 4.23Å; I750-L752 HydrophobicContact CG2-CD2 3.92Å; I750-L752 HydrophobicContact CG2-CG 4.39Å
751	V	94.4	Very high	85.2	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	121.8	179.4	-176.5	0	0	0	0	108.7	I694 L695 C696 L725 V727 I739 K749 A753 I766	I694-V751 PolarHBondContact O-N 3.18Å; L695-V751 CarbonylContact C-O 3.59Å; L695-V751 WeakPolarHBondContact CA-O 3.37Å; L695-V751 HydrophobicContact CD1-CB 3.75Å; L695-V751 HydrophobicContact CD1-CG1 3.56Å; C696-V751 PolarHBondContact N-O 3.33Å; L725-V751 WeakPolarHBondContact O-CA 3.14Å; V727-V751 HydrophobicContact CG2-CG1 3.58Å; I739-V751 HydrophobicContact CD1-CG1 3.79Å; I739-V751 HydrophobicContact CG1-CG1 3.99Å; I739-V751 HydrophobicContact CG1-CG2 4.04Å; K749-V751 HydrophobicContact CD-CG2 4.48Å; K749-V751 HydrophobicContact CG-CG2 4.12Å; V751-A753 HydrophobicContact CG1-CB 4.31Å; V751-I766 HydrophobicContact CG2-CD1 4.24Å
752	L	95.1	Very high	84.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	103.2	177.8	-55.8	178.7	0	0	0	108.2	C696 L698 I704 V707 Q708 I724 L725 P726 V727 I750	C696-L752 HydrophobicContact CB-CD2 3.73Å; L698-L752 HydrophobicContact CD1-CB 4.25Å; L698-L752 HydrophobicContact CD1-CD2 4.35Å; I704-L752 HydrophobicContact CG1-CB 4.39Å; I704-L752 HydrophobicContact CG2-CB 3.93Å; V707-L752 HydrophobicContact CB-CD1 4.44Å; V707-L752 HydrophobicContact CG1-CD1 4.19Å; V707-L752 HydrophobicContact CG1-CD2 3.98Å; Q708-L752 HydrophobicContact CB-CD1 3.76Å; I724-L752 HydrophobicContact CG2-CD1 3.94Å; I724-L752 HydrophobicContact CG2-CG 4.38Å; L725-L752 PolarHBondContact O-N 3.34Å; P726-L752 CarbonylContact C-O 3.53Å; P726-L752 WeakPolarHBondContact CA-O 3.33Å; V727-L752 PolarHBondContact N-O 3.03Å; I750-L752 HydrophobicContact CG2-CD2 3.92Å; I750-L752 HydrophobicContact CG2-CG 4.39Å
753	A	92.9	Very high	84.3	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	150.8	-167.5	0	0	0	0	0	113.4	L695 C696 F697 L698 V727 V751 A757	L695-A753 HydrophobicContact CD1-CB 3.86Å; C696-A753 PolarHBondContact O-N 2.89Å; C696-A753 VanDerWaalsContact O-O 3.07Å; F697-A753 CarbonylContact C-O 3.57Å; F697-A753 WeakPolarHBondContact CA-O 3.24Å; L698-A753 PolarHBondContact N-O 3.1Å; V727-A753 HydrophobicContact CB-CB 3.9Å; V727-A753 VanDerWaalsContact O-CA 3.3Å; V727-A753 WeakPolarHBondContact O-CA 3.34Å; V751-A753 HydrophobicContact CG1-CB 4.31Å; A753-A757 HydrophobicContact CB-CB 3.6Å
754	T	91.3	Very high	84	Confident	9 Å²	9	33.4 Å²	33.4	6%	0.055	20%	0.203	C	C	.	.			trans	-78.9	-169	160.1	65.6	0	0	0	0	110.7	L698 I704 V727 H728 I756 A757	L698-T754 WeakPolarHBondContact O-CA 3.33Å; I704-T754 HydrophobicContact CD1-CG2 3.79Å; V727-T754 PolarHBondContact O-N 3.44Å; H728-T754 VanDerWaalsContact CD2-CG2 3.44Å; H728-T754 WeakPolarHBondContact CD2-CG2 3.39Å; T754-I756 PolarHBondContact O-N 2.86Å; T754-A757 PolarHBondContact O-N 2.85Å
755	N	86.8	Confident	84.1	Confident	56 Å²	56	30.4 Å²	30.4	30%	0.299	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-53.6	-9.5	170.6	67	-19.5	0	0	0	114.7	A757 E758	N755-A757 PolarHBondContact O-N 3.3Å; N755-E758 HydrophobicContact CB-CB 4.49Å; N755-E758 WeakPolarHBondContact O-CB 3.49Å; N755-E758 PolarHBondContact O-N 3.02Å
756	I	80.9	Confident	84.4	Confident	12 Å²	12	21.9 Å²	21.9	6%	0.062	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-57.3	-29.4	173.2	-168.5	167	0	0	0	113.7	V727 T754 E758 I761	V727-I756 HydrophobicContact CB-CG2 4.38Å; V727-I756 HydrophobicContact CG1-CG2 3.66Å; T754-I756 PolarHBondContact O-N 2.86Å; I756-E758 VanDerWaalsContact C-N 3.32Å; I756-I761 HydrophobicContact CG1-CD1 3.85Å; I756-I761 VanDerWaalsContact O-CD1 3.24Å; I756-I761 WeakPolarHBondContact O-CD1 3.32Å
757	A	83	Confident	84.8	Confident	1 Å²	1	18.5 Å²	18.5	1%	0.008	10%	0.102	C	C	.	.	G	3₁₀ helix	trans	-86.5	-3.1	176.6	0	0	0	0	0	113.4	L695 F697 A753 T754 N755 R805	L695-A757 HydrophobicContact CD1-CB 4.04Å; L695-A757 HydrophobicContact CD2-CB 4.26Å; F697-A757 HydrophobicContact CE1-CB 3.91Å; F697-A757 HydrophobicContact CZ-CB 4.36Å; A753-A757 HydrophobicContact CB-CB 3.6Å; T754-A757 PolarHBondContact O-N 2.85Å; N755-A757 PolarHBondContact O-N 3.3Å; A757-R805 PolarHBondContact O-NE 3.38Å; A757-R805 PolarHBondContact O-NH1 3.24Å
758	E	80.7	Confident	85.1	Confident	9 Å²	9	17 Å²	17	4%	0.042	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-36.1	-170.5	-171.4	176.7	142.8	0	0	113.4	F697 N755 I756 N798 Q801 R802 R805	F697-E758 HydrophobicContact CE1-CB 4Å; N755-E758 HydrophobicContact CB-CB 4.49Å; N755-E758 WeakPolarHBondContact O-CB 3.49Å; N755-E758 PolarHBondContact O-N 3.02Å; I756-E758 VanDerWaalsContact C-N 3.32Å; E758-N798 WeakPolarHBondContact OE1-CA 3.38Å; E758-N798 WeakPolarHBondContact OE1-CB 3.25Å; E758-N798 PolarHBondContact OE1-ND2 3.39Å; E758-Q801 HydrophobicContact CG-CB 4.11Å; E758-Q801 PolarHBondContact O-OE1 2.75Å; E758-R802 HydrophobicContact CG-CG 3.91Å; E758-R802 IonicContact OE2-CZ 3.4Å; E758-R802 IonicContact OE2-NE 2.96Å; E758-R802 PolarHBondContact OE2-NE 3.31Å; E758-R802 IonicContact OE2-NH2 2.9Å; E758-R802 PolarHBondContact OE2-NH2 3.38Å; E758-R805 VanDerWaalsContact C-CZ 3.44Å; E758-R805 PolarHBondContact O-NE 3.29Å; E758-R805 PolarHBondContact O-NH2 3.2Å
759	T	69.8	Low	85.2	Confident	5 Å²	5	15.5 Å²	15.5	3%	0.031	9%	0.087	C	C	.	.	S	Bend	trans	-124.7	148.4	177.1	54.4	0	0	0	0	110.9	R515 E586 I761 R805	R515-T759 PolarHBondContact NE-OG1 3.36Å; E586-T759 HydrophobicContact CG-CG2 3.84Å; E586-T759 WeakPolarHBondContact OE1-CB 3.24Å; E586-T759 PolarHBondContact OE1-OG1 3.27Å; E586-T759 PolarHBondContact OE2-OG1 3.03Å; T759-I761 PolarHBondContact O-N 3.33Å; T759-R805 VanDerWaalsContact N-NH2 3.18Å
760	S	65.8	Low	85.4	Confident	13 Å²	13	15.5 Å²	15.5	9%	0.091	9%	0.087	C	C	.	.	S	Bend	trans	58.7	-13	165.8	-35	0	0	0	0	120.7	S518 E583	S518-S760 WeakPolarHBondContact OG-CB 3.32Å; E583-S760 WeakPolarHBondContact CG-OG 3.38Å; E583-S760 PolarHBondContact OE1-OG 3.46Å
761	I	69.3	Low	85.5	Confident	2 Å²	2	15.4 Å²	15.4	1%	0.01	9%	0.087	C	C	.	.			trans	-89.2	110.4	168.9	-62.9	-171.9	0	0	0	108.4	I517 I739 F740 I756 T759 V763 R805	I517-I761 HydrophobicContact CD1-CD1 4.22Å; I517-I761 HydrophobicContact CG2-CD1 4.1Å; I517-I761 HydrophobicContact CG2-CG1 3.99Å; I739-I761 HydrophobicContact CD1-CG2 4.14Å; I739-I761 HydrophobicContact CG2-CG2 4.22Å; F740-I761 HydrophobicContact CE1-CG2 3.65Å; F740-I761 HydrophobicContact CZ-CG2 3.78Å; I756-I761 HydrophobicContact CG1-CD1 3.85Å; I756-I761 VanDerWaalsContact O-CD1 3.24Å; I756-I761 WeakPolarHBondContact O-CD1 3.32Å; T759-I761 PolarHBondContact O-N 3.33Å; I761-V763 HydrophobicContact CG2-CG2 4Å; I761-R805 PolarHBondContact O-NH1 3.29Å
762	T	68	Low	85.6	Confident	72 Å²	72	15.5 Å²	15.5	44%	0.442	9%	0.088	S	C	.	.			trans	-94.7	104.8	-179.8	52.5	0	0	0	0	111.2	F740	F740-T762 WeakPolarHBondContact CD1-O 3.37Å
763	V	77.9	Confident	85.6	Confident	12 Å²	12	15.5 Å²	15.5	7%	0.073	9%	0.088	C	C	.	.			trans	-101.7	106.9	173.4	-170.5	0	0	0	0	108	I739 I761 D765 I766	I739-V763 HydrophobicContact CD1-CG2 3.42Å; I739-V763 VanDerWaalsContact CD1-CG2 3.42Å; I739-V763 HydrophobicContact CG1-CG1 4.4Å; I739-V763 HydrophobicContact CG1-CG2 3.66Å; I739-V763 HydrophobicContact CG2-CG2 4.33Å; I739-V763 WeakPolarHBondContact O-CG1 3.37Å; I761-V763 HydrophobicContact CG2-CG2 4Å; V763-D765 VanDerWaalsContact C-N 3.31Å; V763-D765 WeakPolarHBondContact CG1-OD1 3.48Å; V763-D765 PolarHBondContact O-N 3.44Å; V763-I766 HydrophobicContact CB-CG1 3.79Å; V763-I766 HydrophobicContact CG1-CD1 3.85Å; V763-I766 HydrophobicContact CG1-CG1 3.57Å
764	N	78.1	Confident	85.7	Confident	95 Å²	95	15.6 Å²	15.6	51%	0.508	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-18.5	-167.1	-62.1	-18.3	0	0	0	113.8
765	D	87.3	Confident	85.8	Confident	26 Å²	26	15.4 Å²	15.4	14%	0.139	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	8.6	-172.1	60.6	-27.5	0	0	0	114.1	G693 P743 K749 V763	G693-D765 WeakPolarHBondContact CA-O 3.35Å; G693-D765 PolarHBondContact N-O 3.02Å; P743-D765 WeakPolarHBondContact CD-OD2 3.22Å; K749-D765 WeakPolarHBondContact CD-OD2 3.24Å; K749-D765 IonicContact NZ-OD1 3.9Å; K749-D765 PolarHBondContact NZ-OD1 2.97Å; K749-D765 IonicContact NZ-OD2 2.61Å; K749-D765 PolarHBondContact NZ-OD2 3.24Å; V763-D765 VanDerWaalsContact C-N 3.31Å; V763-D765 WeakPolarHBondContact CG1-OD1 3.48Å; V763-D765 PolarHBondContact O-N 3.44Å
766	I	91.2	Very high	85.8	Confident	6 Å²	6	15.5 Å²	15.5	3%	0.031	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	127.8	175.6	-58.9	-53.9	0	0	0	110.6	L695 V751 V763 H768 V769	L695-I766 HydrophobicContact CB-CD1 3.97Å; L695-I766 HydrophobicContact CB-CG1 4.12Å; L695-I766 HydrophobicContact CB-CG2 3.74Å; V751-I766 HydrophobicContact CG2-CD1 4.24Å; V763-I766 HydrophobicContact CB-CG1 3.79Å; V763-I766 HydrophobicContact CG1-CD1 3.85Å; V763-I766 HydrophobicContact CG1-CG1 3.57Å; I766-H768 WeakPolarHBondContact CG2-O 3.35Å; I766-V769 HydrophobicContact CG2-CG2 4.1Å
767	V	94.3	Very high	86.1	Confident	4 Å²	4	15.5 Å²	15.5	2%	0.024	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	-27.6	175.6	176.8	0	0	0	0	111.2	G693 A806 Q810 G812 F813	G693-V767 PolarHBondContact O-N 3.3Å; V767-A806 WeakPolarHBondContact O-CB 3.48Å; V767-Q810 HydrophobicContact CG2-CG 4.11Å; V767-G812 CarbonylContact O-C 3.59Å; V767-G812 VanDerWaalsContact O-CA 3.22Å; V767-G812 WeakPolarHBondContact O-CA 3.44Å; V767-F813 HydrophobicContact CG1-CD2 4.32Å; V767-F813 PolarHBondContact O-N 3.16Å
768	H	97.1	Very high	86.2	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	127.1	-178.5	-54.6	-82.4	0	0	0	109.8	I685 E690 G693 I694 L695 I766 F813 Y815	I685-H768 HydrophobicContact CG2-CB 3.95Å; I685-H768 VanDerWaalsContact CG2-CG 3.47Å; E690-H768 PolarHBondContact O-NE2 2.92Å; G693-H768 PolarHBondContact O-N 2.88Å; G693-H768 VanDerWaalsContact O-N 3.1Å; I694-H768 CarbonylContact C-O 3.55Å; I694-H768 WeakPolarHBondContact CA-O 3.19Å; I694-H768 HydrophobicContact CB-CB 4.44Å; I694-H768 HydrophobicContact CG1-CB 4.15Å; I694-H768 HydrophobicContact CG2-CB 4.29Å; L695-H768 PolarHBondContact N-O 2.98Å; I766-H768 WeakPolarHBondContact CG2-O 3.35Å; H768-F813 CarbonylContact C-O 3.56Å; H768-F813 WeakPolarHBondContact CA-O 3.44Å; H768-F813 AromaticContact CE1-CD2 3.52Å; H768-F813 AromaticContact ND1-CD2 3.6Å; H768-F813 AromaticContact ND1-CG 3.97Å; H768-Y815 HydrophobicContact CB-CE2 4.33Å; H768-Y815 AromaticContact ND1-CE2 3.84Å
769	V	96.6	Very high	86.5	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	127.7	171	168.7	0	0	0	0	108.7	L695 F697 I766 R805 A806 F813 A814 Y815	L695-V769 CarbonylContact O-C 3.54Å; L695-V769 WeakPolarHBondContact O-CA 3.46Å; F697-V769 HydrophobicContact CD2-CG1 3.88Å; F697-V769 HydrophobicContact CE2-CG1 3.84Å; I766-V769 HydrophobicContact CG2-CG2 4.1Å; V769-R805 HydrophobicContact CG2-CB 3.83Å; V769-A806 HydrophobicContact CB-CB 4.39Å; V769-A806 HydrophobicContact CG2-CB 3.8Å; V769-F813 PolarHBondContact N-O 3.45Å; V769-A814 CarbonylContact O-C 3.58Å; V769-A814 WeakPolarHBondContact O-CA 3.37Å; V769-Y815 WeakPolarHBondContact O-CD2 3.46Å; V769-Y815 PolarHBondContact O-N 2.95Å
770	V	97.9	Very high	87.2	Confident	2 Å²	2	25.7 Å²	25.7	1%	0.012	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	116.9	168.3	179.2	0	0	0	0	107.4	L681 V682 I685 I694 L695 C696 F697 Y815 L817	L681-V770 HydrophobicContact CD2-CB 4.5Å; L681-V770 HydrophobicContact CD2-CG1 3.75Å; L681-V770 HydrophobicContact CD2-CG2 4.01Å; L681-V770 HydrophobicContact CG-CG2 4.35Å; V682-V770 HydrophobicContact CG2-CG2 4.49Å; I685-V770 HydrophobicContact CD1-CG2 3.77Å; I694-V770 HydrophobicContact CG2-CG2 4.2Å; L695-V770 PolarHBondContact O-N 3.35Å; C696-V770 CarbonylContact C-O 3.54Å; C696-V770 VanDerWaalsContact CA-O 3.3Å; C696-V770 WeakPolarHBondContact CA-O 3.43Å; C696-V770 HydrophobicContact CB-CB 4.26Å; F697-V770 PolarHBondContact N-O 2.97Å; V770-Y815 CarbonylContact C-O 3.44Å; V770-Y815 WeakPolarHBondContact CA-O 3.41Å; V770-L817 HydrophobicContact CG1-CD1 3.98Å; V770-L817 HydrophobicContact CG1-CG 4.27Å
771	D	97.4	Very high	87.9	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	116.4	-178.3	-168	-0.1	0	0	0	110.4	G773 R802 Y815 L817	D771-G773 PolarHBondContact O-N 3.14Å; D771-G773 PolarHBondContact OD1-N 3.38Å; D771-R802 VanDerWaalsContact CG-CD 3.45Å; D771-R802 WeakPolarHBondContact OD1-CD 3.4Å; D771-R802 IonicContact OD1-CZ 3.51Å; D771-R802 IonicContact OD1-NE 3.5Å; D771-R802 IonicContact OD1-NH1 2.9Å; D771-R802 PolarHBondContact OD1-NH1 3.02Å; D771-R802 WeakPolarHBondContact OD2-CD 3.35Å; D771-Y815 PolarHBondContact N-O 3.42Å; D771-L817 PolarHBondContact O-N 3.37Å
772	S	96.3	Very high	88.2	Confident	2 Å²	2	30.2 Å²	30.2	1%	0.014	15%	0.148	C	C	.	.			trans	-67.2	-18.4	172.4	57.9	0	0	0	0	113.1	F697 L774	F697-S772 VanDerWaalsContact O-CB 3.3Å; F697-S772 WeakPolarHBondContact O-CB 3.43Å; F697-S772 PolarHBondContact O-N 3.41Å; F697-S772 PolarHBondContact O-OG 3.27Å; S772-L774 PolarHBondContact O-N 2.84Å; S772-L774 PolarHBondContact OG-N 3.05Å; S772-L774 PolarHBondContact OG-O 3.26Å
773	G	95.4	Very high	88.5	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.166	C	C	.	.	S	Bend	trans	71.9	3.8	-171.3	0	0	0	0	0	113.9	D771 W793 V794 F818	D771-G773 PolarHBondContact O-N 3.14Å; D771-G773 PolarHBondContact OD1-N 3.38Å; G773-W793 WeakPolarHBondContact O-CA 3.38Å; G773-W793 VanDerWaalsContact O-CE3 3.23Å; G773-V794 PolarHBondContact O-N 3.44Å; G773-F818 VanDerWaalsContact CA-CD1 3.49Å
774	L	94.8	Very high	88.3	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	152.2	-175.2	-64.4	173.8	0	0	0	110.7	C671 L673 P699 S772 T791 V792 W793 R802	C671-L774 HydrophobicContact CB-CD2 3.93Å; L673-L774 HydrophobicContact CB-CD1 4.19Å; P699-L774 HydrophobicContact CG-CB 3.79Å; P699-L774 HydrophobicContact CG-CD1 4.48Å; S772-L774 PolarHBondContact O-N 2.84Å; S772-L774 PolarHBondContact OG-N 3.05Å; S772-L774 PolarHBondContact OG-O 3.26Å; L774-T791 HydrophobicContact CB-CG2 4.07Å; L774-T791 HydrophobicContact CD1-CG2 4.27Å; L774-T791 HydrophobicContact CD2-CG2 4.34Å; L774-T791 HydrophobicContact CG-CG2 4.46Å; L774-V792 WeakPolarHBondContact CA-O 3.48Å; L774-W793 HydrophobicContact CD2-CD2 3.58Å; L774-W793 HydrophobicContact CD2-CE3 3.65Å; L774-W793 HydrophobicContact CD2-CG 4.1Å; L774-W793 HydrophobicContact CD2-CH2 4.11Å; L774-W793 HydrophobicContact CD2-CZ2 4.03Å; L774-W793 HydrophobicContact CD2-CZ3 3.91Å; L774-W793 HydrophobicContact CG-CE3 4.25Å; L774-W793 HydrophobicContact CG-CH2 4.4Å; L774-W793 HydrophobicContact CG-CZ3 4.13Å; L774-R802 PolarHBondContact O-NH1 2.91Å
775	H	92.5	Very high	88.2	Confident	5 Å²	5	37.2 Å²	37.2	2%	0.023	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	165.9	163.8	68.7	-138	0	0	0	110.8	E777 T791 V792 V794	H775-E777 IonicContact NE2-OE2 3.11Å; H775-T791 CarbonylContact O-C 3.54Å; H775-T791 WeakPolarHBondContact O-CA 3.31Å; H775-V792 PolarHBondContact N-O 3.26Å; H775-V792 PolarHBondContact O-N 3.4Å; H775-V794 HydrophobicContact CB-CG1 4.07Å; H775-V794 VanDerWaalsContact ND1-CG1 3.26Å; H775-V794 WeakPolarHBondContact ND1-CG1 3.41Å
776	K	88.7	Confident	87.9	Confident	59 Å²	59	36.7 Å²	36.7	26%	0.257	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	123.1	167.6	-72.2	179.2	-174.2	173.4	0	110.1	P699 E703 L789 E790	P699-K776 HydrophobicContact CB-CG 4.29Å; P699-K776 WeakPolarHBondContact O-CG 3.48Å; P699-K776 PolarHBondContact O-N 3.01Å; E703-K776 IonicContact OE1-NZ 3.77Å; E703-K776 PolarHBondContact OE1-NZ 3.42Å; E703-K776 IonicContact OE2-NZ 3.02Å; E703-K776 PolarHBondContact OE2-NZ 2.65Å; K776-L789 HydrophobicContact CB-CD1 3.87Å; K776-L789 HydrophobicContact CB-CD2 4.18Å; K776-L789 HydrophobicContact CB-CG 3.9Å; K776-L789 HydrophobicContact CD-CD2 4.14Å; K776-L789 HydrophobicContact CD-CG 4.49Å; K776-L789 HydrophobicContact CG-CG 4.48Å; K776-E790 CarbonylContact C-O 3.36Å; K776-E790 WeakPolarHBondContact CA-O 3.43Å
777	E	87	Confident	87.5	Confident	12 Å²	12	37.4 Å²	37.4	6%	0.056	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	132	179.9	-172.6	172.8	73.6	0	0	110.2	H775 R779 E790 V792 Q830 R836	H775-E777 IonicContact NE2-OE2 3.11Å; E777-R779 HydrophobicContact CG-CG 4.47Å; E777-R779 IonicContact OE1-CZ 3.42Å; E777-R779 IonicContact OE1-NE 3.88Å; E777-R779 PolarHBondContact OE1-NE 3.49Å; E777-R779 VanDerWaalsContact OE1-NE 3.07Å; E777-R779 IonicContact OE1-NH2 2.94Å; E777-R779 PolarHBondContact OE1-NH2 3.04Å; E777-E790 PolarHBondContact N-O 2.98Å; E777-E790 PolarHBondContact O-N 3.18Å; E777-V792 HydrophobicContact CB-CG2 3.67Å; E777-Q830 PolarHBondContact OE2-NE2 3.06Å; E777-R836 IonicContact OE2-CZ 3.44Å; E777-R836 IonicContact OE2-NE 3.22Å; E777-R836 PolarHBondContact OE2-NE 2.87Å
778	E	85.3	Confident	86.8	Confident	82 Å²	82	37.7 Å²	37.7	38%	0.383	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	127.8	171.2	-174.4	175.2	-174.4	0	0	110	S787 C788 L789 R836	E778-S787 VanDerWaalsContact OE1-CB 3.27Å; E778-S787 WeakPolarHBondContact OE1-CB 3.44Å; E778-S787 PolarHBondContact OE1-OG 3.33Å; E778-C788 WeakPolarHBondContact CA-O 3.28Å; E778-L789 HydrophobicContact CB-CD1 4.47Å; E778-R836 PolarHBondContact O-NH1 3.48Å
779	R	86.3	Confident	86.1	Confident	94 Å²	94	41.8 Å²	41.8	36%	0.355	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	152	176.3	-68.7	176.5	175.1	-176	-8.4	109.9	E777 S787 C788 E790 R836	E777-R779 HydrophobicContact CG-CG 4.47Å; E777-R779 IonicContact OE1-CZ 3.42Å; E777-R779 IonicContact OE1-NE 3.88Å; E777-R779 PolarHBondContact OE1-NE 3.49Å; E777-R779 VanDerWaalsContact OE1-NE 3.07Å; E777-R779 IonicContact OE1-NH2 2.94Å; E777-R779 PolarHBondContact OE1-NH2 3.04Å; R779-S787 CarbonylContact O-C 3.51Å; R779-S787 VanDerWaalsContact O-CA 3.27Å; R779-S787 WeakPolarHBondContact O-CA 3.46Å; R779-C788 PolarHBondContact N-O 3.41Å; R779-C788 PolarHBondContact O-N 2.81Å; R779-E790 WeakPolarHBondContact CD-OE2 3.46Å; R779-E790 IonicContact CZ-OE2 3.53Å; R779-E790 IonicContact NE-OE2 3.72Å; R779-E790 IonicContact NH1-OE2 2.69Å; R779-E790 PolarHBondContact NH1-OE2 2.93Å; R779-R836 CarbonylContact C-O 3.56Å; R779-R836 VanDerWaalsContact C-O 3.24Å; R779-R836 VanDerWaalsContact CA-O 3.25Å; R779-R836 WeakPolarHBondContact CA-O 3.35Å
780	Y	84.2	Confident	85.5	Confident	53 Å²	53	45.5 Å²	45.5	21%	0.208	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	120.8	-179.8	-173	-112.9	0	0	0	110.7	L782 K785 R836 P838	Y780-L782 HydrophobicContact CD1-CD2 3.99Å; Y780-L782 HydrophobicContact CD1-CG 4.47Å; Y780-L782 HydrophobicContact CE1-CD2 3.85Å; Y780-K785 WeakPolarHBondContact OH-CA 3.4Å; Y780-K785 PolarHBondContact OH-O 3.06Å; Y780-R836 WeakPolarHBondContact CB-O 3.45Å; Y780-R836 PolarHBondContact N-O 3.37Å; Y780-P838 HydrophobicContact CD2-CB 4.21Å; Y780-P838 HydrophobicContact CD2-CG 3.55Å; Y780-P838 HydrophobicContact CE2-CB 4.16Å; Y780-P838 HydrophobicContact CE2-CG 3.81Å; Y780-P838 HydrophobicContact CG-CG 4.15Å
781	D	80.4	Confident	85	Confident	40 Å²	40	47.5 Å²	47.5	21%	0.214	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	106	177.1	-176.2	-10.8	0	0	0	109.9	K783 T784 K785 V786 K1104	D781-K783 PolarHBondContact O-N 3.22Å; D781-K783 WeakPolarHBondContact OD1-CA 3.4Å; D781-K783 VanDerWaalsContact OD1-CB 3.24Å; D781-K783 WeakPolarHBondContact OD1-CB 3.3Å; D781-K783 PolarHBondContact OD1-N 2.89Å; D781-T784 WeakPolarHBondContact CB-OG1 3.49Å; D781-T784 VanDerWaalsContact CG-OG1 3.26Å; D781-T784 PolarHBondContact O-N 3.23Å; D781-T784 PolarHBondContact OD1-N 3.41Å; D781-T784 PolarHBondContact OD2-OG1 2.91Å; D781-K785 VanDerWaalsContact O-CA 3.29Å; D781-K785 WeakPolarHBondContact O-CA 3.49Å; D781-K785 PolarHBondContact O-N 3.14Å; D781-V786 PolarHBondContact N-O 3.27Å; D781-V786 VanDerWaalsContact N-O 3.07Å; D781-K1104 IonicContact OD2-NZ 3.55Å; D781-K1104 PolarHBondContact OD2-NZ 3.21Å
782	L	75.1	Confident	84.7	Confident	69 Å²	69	48.2 Å²	48.2	36%	0.361	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-24.4	177.6	-68.9	169.6	0	0	0	113.4	Y780 A870	Y780-L782 HydrophobicContact CD1-CD2 3.99Å; Y780-L782 HydrophobicContact CD1-CG 4.47Å; Y780-L782 HydrophobicContact CE1-CD2 3.85Å; L782-A870 HydrophobicContact CD1-CB 4.38Å; L782-A870 HydrophobicContact CD2-CB 3.84Å
783	K	75.6	Confident	84.6	Confident	190 Å²	190	50.7 Å²	50.7	83%	0.826	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-45.4	179	-175	-179.1	177.9	-179.8	0	111.2	D781	D781-K783 PolarHBondContact O-N 3.22Å; D781-K783 WeakPolarHBondContact OD1-CA 3.4Å; D781-K783 VanDerWaalsContact OD1-CB 3.24Å; D781-K783 WeakPolarHBondContact OD1-CB 3.3Å; D781-K783 PolarHBondContact OD1-N 2.89Å
784	T	73.3	Confident	84.5	Confident	33 Å²	33	50.7 Å²	50.7	20%	0.202	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-7.8	-178.9	53.5	0	0	0	0	113.4	D781 V786	D781-T784 WeakPolarHBondContact CB-OG1 3.49Å; D781-T784 VanDerWaalsContact CG-OG1 3.26Å; D781-T784 PolarHBondContact O-N 3.23Å; D781-T784 PolarHBondContact OD1-N 3.41Å; D781-T784 PolarHBondContact OD2-OG1 2.91Å; T784-V786 PolarHBondContact O-N 2.83Å; T784-V786 WeakPolarHBondContact OG1-CG2 3.47Å
785	K	76.3	Confident	84.5	Confident	104 Å²	104	50.8 Å²	50.8	45%	0.452	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	34.1	-175.8	-53	-166.8	-173.4	-160.3	0	113.8	Y780 D781 E873	Y780-K785 WeakPolarHBondContact OH-CA 3.4Å; Y780-K785 PolarHBondContact OH-O 3.06Å; D781-K785 VanDerWaalsContact O-CA 3.29Å; D781-K785 WeakPolarHBondContact O-CA 3.49Å; D781-K785 PolarHBondContact O-N 3.14Å; K785-E873 VanDerWaalsContact CE-OE2 3.28Å; K785-E873 WeakPolarHBondContact CE-OE2 3.34Å; K785-E873 IonicContact NZ-OE2 3.58Å; K785-E873 PolarHBondContact NZ-OE2 2.59Å
786	V	79.9	Confident	84.5	Confident	14 Å²	14	55.4 Å²	55.4	9%	0.085	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	150.1	-179.3	-67	0	0	0	0	111.2	D781 T784 A1102 K1104 V1109	D781-V786 PolarHBondContact N-O 3.27Å; D781-V786 VanDerWaalsContact N-O 3.07Å; T784-V786 PolarHBondContact O-N 2.83Å; T784-V786 WeakPolarHBondContact OG1-CG2 3.47Å; V786-A1102 HydrophobicContact CG1-CB 3.78Å; V786-K1104 HydrophobicContact CG2-CB 3.81Å; V786-V1109 HydrophobicContact CG1-CG1 4.08Å; V786-V1109 HydrophobicContact CG2-CG1 4.24Å; V786-V1109 HydrophobicContact CG2-CG2 4Å
787	S	82.5	Confident	84.5	Confident	22 Å²	22	53.1 Å²	53.1	15%	0.154	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	141.7	170.9	-61	0	0	0	0	110.8	E778 R779 V1103 K1104	E778-S787 VanDerWaalsContact OE1-CB 3.27Å; E778-S787 WeakPolarHBondContact OE1-CB 3.44Å; E778-S787 PolarHBondContact OE1-OG 3.33Å; R779-S787 CarbonylContact O-C 3.51Å; R779-S787 VanDerWaalsContact O-CA 3.27Å; R779-S787 WeakPolarHBondContact O-CA 3.46Å; S787-V1103 CarbonylContact O-C 3.58Å; S787-V1103 VanDerWaalsContact O-CA 3.31Å; S787-V1103 WeakPolarHBondContact O-CA 3.44Å; S787-K1104 PolarHBondContact O-N 3.48Å
788	C	81	Confident	84.7	Confident	9 Å²	9	53.1 Å²	53.1	6%	0.061	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	151.6	162.1	59.2	0	0	0	0	109.8	E778 R779 E790 K1104	E778-C788 WeakPolarHBondContact CA-O 3.28Å; R779-C788 PolarHBondContact N-O 3.41Å; R779-C788 PolarHBondContact O-N 2.81Å; C788-E790 HydrophobicContact CB-CG 4.38Å; C788-E790 PolarHBondContact SG-OE1 3.21Å; C788-E790 VanDerWaalsContact SG-OE1 3.4Å; C788-K1104 WeakPolarHBondContact CA-O 3.37Å; C788-K1104 HydrophobicContact CB-CB 4.05Å; C788-K1104 VanDerWaalsContact CB-O 3.24Å; C788-K1104 WeakPolarHBondContact CB-O 3.26Å
789	L	81.4	Confident	85.1	Confident	87 Å²	87	49.4 Å²	49.4	46%	0.455	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	102.9	172.7	-175.1	70.5	0	0	0	107.3	K776 E778	K776-L789 HydrophobicContact CB-CD1 3.87Å; K776-L789 HydrophobicContact CB-CD2 4.18Å; K776-L789 HydrophobicContact CB-CG 3.9Å; K776-L789 HydrophobicContact CD-CD2 4.14Å; K776-L789 HydrophobicContact CD-CG 4.49Å; K776-L789 HydrophobicContact CG-CG 4.48Å; E778-L789 HydrophobicContact CB-CD1 4.47Å
790	E	84.1	Confident	85.2	Confident	78 Å²	78	48.3 Å²	48.3	36%	0.364	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	140	-174	-70.4	177.3	178.4	0	0	110.4	K776 E777 R779 C788 V792	K776-E790 CarbonylContact C-O 3.36Å; K776-E790 WeakPolarHBondContact CA-O 3.43Å; E777-E790 PolarHBondContact N-O 2.98Å; E777-E790 PolarHBondContact O-N 3.18Å; R779-E790 WeakPolarHBondContact CD-OE2 3.46Å; R779-E790 IonicContact CZ-OE2 3.53Å; R779-E790 IonicContact NE-OE2 3.72Å; R779-E790 IonicContact NH1-OE2 2.69Å; R779-E790 PolarHBondContact NH1-OE2 2.93Å; C788-E790 HydrophobicContact CB-CG 4.38Å; C788-E790 PolarHBondContact SG-OE1 3.21Å; C788-E790 VanDerWaalsContact SG-OE1 3.4Å; E790-V792 HydrophobicContact CB-CG1 4.14Å
791	T	88.6	Confident	85.3	Confident	43 Å²	43	46 Å²	46	26%	0.264	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	121.4	167.9	-56.9	0	0	0	0	108.3	C671 P699 L774 H775	C671-T791 HydrophobicContact CB-CG2 4.13Å; C671-T791 WeakPolarHBondContact CB-O 3.31Å; P699-T791 HydrophobicContact CB-CG2 4.08Å; P699-T791 HydrophobicContact CG-CG2 4.28Å; L774-T791 HydrophobicContact CB-CG2 4.07Å; L774-T791 HydrophobicContact CD1-CG2 4.27Å; L774-T791 HydrophobicContact CD2-CG2 4.34Å; L774-T791 HydrophobicContact CG-CG2 4.46Å; H775-T791 CarbonylContact O-C 3.54Å; H775-T791 WeakPolarHBondContact O-CA 3.31Å
792	V	90.6	Very high	85.8	Confident	16 Å²	16	44.1 Å²	44.1	10%	0.097	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	158.5	-176.6	-60.5	0	0	0	0	111	L774 H775 E777 E790	L774-V792 WeakPolarHBondContact CA-O 3.48Å; H775-V792 PolarHBondContact N-O 3.26Å; H775-V792 PolarHBondContact O-N 3.4Å; E777-V792 HydrophobicContact CB-CG2 3.67Å; E790-V792 HydrophobicContact CB-CG1 4.14Å
793	W	93.8	Very high	86.5	Confident	53 Å²	53	43.6 Å²	43.6	20%	0.201	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	137.2	169.1	-67.2	99	0	0	0	111	C671 G773 L774 F818 R822 M826	C671-W793 PolarHBondContact SG-NE1 3.37Å; C671-W793 VanDerWaalsContact SG-NE1 3.37Å; G773-W793 WeakPolarHBondContact O-CA 3.38Å; G773-W793 VanDerWaalsContact O-CE3 3.23Å; L774-W793 HydrophobicContact CD2-CD2 3.58Å; L774-W793 HydrophobicContact CD2-CE3 3.65Å; L774-W793 HydrophobicContact CD2-CG 4.1Å; L774-W793 HydrophobicContact CD2-CH2 4.11Å; L774-W793 HydrophobicContact CD2-CZ2 4.03Å; L774-W793 HydrophobicContact CD2-CZ3 3.91Å; L774-W793 HydrophobicContact CG-CE3 4.25Å; L774-W793 HydrophobicContact CG-CH2 4.4Å; L774-W793 HydrophobicContact CG-CZ3 4.13Å; W793-F818 HydrophobicContact CH2-CB 4.03Å; W793-F818 HydrophobicContact CZ3-CB 3.71Å; W793-F818 HydrophobicContact CZ3-CD1 4.16Å; W793-F818 HydrophobicContact CZ3-CG 4.13Å; W793-R822 HydrophobicContact CD2-CG 4.26Å; W793-R822 HydrophobicContact CE3-CG 4Å; W793-R822 HydrophobicContact CH2-CG 4.31Å; W793-R822 VanDerWaalsContact CZ2-CZ 3.42Å; W793-R822 HydrophobicContact CZ3-CG 4.04Å; W793-R822 VanDerWaalsContact NE1-CZ 3.27Å; W793-M826 HydrophobicContact CD2-CE 4.32Å; W793-M826 HydrophobicContact CE3-CE 3.46Å; W793-M826 VanDerWaalsContact CE3-CE 3.46Å; W793-M826 HydrophobicContact CZ3-CE 4.06Å
794	V	94	Very high	86.9	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.006	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-73.5	163.4	176	-52.2	0	0	0	0	111.4	G773 H775 N798 V799 M826	G773-V794 PolarHBondContact O-N 3.44Å; H775-V794 HydrophobicContact CB-CG1 4.07Å; H775-V794 VanDerWaalsContact ND1-CG1 3.26Å; H775-V794 WeakPolarHBondContact ND1-CG1 3.41Å; V794-N798 HydrophobicContact CB-CB 3.76Å; V794-N798 HydrophobicContact CG2-CB 3.97Å; V794-V799 HydrophobicContact CG2-CG2 3.64Å; V794-M826 VanDerWaalsContact O-SD 3.41Å
795	S	93.4	Very high	87.5	Confident	3 Å²	3	33.4 Å²	33.4	2%	0.021	16%	0.16	C	C	.	.	P	Polyproline II helix	trans	-76.3	161.1	173.1	75.6	0	0	0	0	111.8	A797 N798 V799 V827 Q830	S795-A797 PolarHBondContact O-N 3.47Å; S795-A797 PolarHBondContact OG-N 3.4Å; S795-N798 VanDerWaalsContact CB-OD1 3.3Å; S795-N798 WeakPolarHBondContact CB-OD1 3.39Å; S795-N798 PolarHBondContact N-OD1 3.13Å; S795-N798 WeakPolarHBondContact O-CB 3.39Å; S795-N798 PolarHBondContact O-N 2.95Å; S795-N798 VanDerWaalsContact OG-CG 3.28Å; S795-N798 PolarHBondContact OG-N 3.2Å; S795-N798 PolarHBondContact OG-OD1 3.39Å; S795-V799 PolarHBondContact O-N 2.91Å; S795-V799 VanDerWaalsContact O-N 3.13Å; S795-V827 CarbonylContact C-O 3.53Å; S795-V827 VanDerWaalsContact CA-O 3.24Å; S795-V827 WeakPolarHBondContact CA-O 3.31Å; S795-V827 VanDerWaalsContact CB-O 3.29Å; S795-V827 WeakPolarHBondContact CB-O 3.4Å; S795-Q830 PolarHBondContact OG-N 2.87Å
796	R	93.5	Very high	88.1	Confident	101 Å²	101	28.5 Å²	28.5	38%	0.381	14%	0.139	S	C	.	.	H	α-helix	trans	-57.3	-36.1	173.4	-63.2	-174	-175.3	166.5	4.3	112.2	N798 V799 I800 L823 E824 M826 V827	R796-N798 VanDerWaalsContact C-N 3.33Å; R796-N798 PolarHBondContact O-N 3.32Å; R796-V799 PolarHBondContact O-N 3.05Å; R796-I800 WeakPolarHBondContact O-CG1 3.47Å; R796-I800 PolarHBondContact O-N 3.09Å; R796-L823 HydrophobicContact CG-CD1 4.04Å; R796-L823 PolarHBondContact NE-O 3.47Å; R796-E824 VanDerWaalsContact NH2-C 3.3Å; R796-E824 PolarHBondContact NH2-O 3.25Å; R796-M826 HydrophobicContact CG-CB 3.97Å; R796-M826 PolarHBondContact NE-O 2.84Å; R796-V827 PolarHBondContact N-O 3.28Å
797	A	89	Confident	88	Confident	11 Å²	11	27.8 Å²	27.8	9%	0.091	14%	0.135	C	C	.	.	H	α-helix	trans	-61.2	-41.1	174.5	0	0	0	0	0	112.1	S795 I800 Q801 P828 F829	S795-A797 PolarHBondContact O-N 3.47Å; S795-A797 PolarHBondContact OG-N 3.4Å; A797-I800 PolarHBondContact O-N 2.59Å; A797-Q801 WeakPolarHBondContact O-CG 3.45Å; A797-Q801 PolarHBondContact O-N 2.98Å; A797-P828 WeakPolarHBondContact CB-O 3.43Å; A797-P828 PolarHBondContact N-O 3.49Å; A797-P828 VanDerWaalsContact N-O 3.14Å; A797-F829 HydrophobicContact CB-CD1 3.86Å; A797-F829 HydrophobicContact CB-CE1 4.31Å
798	N	91	Very high	87.5	Confident	13 Å²	13	29.2 Å²	29.2	7%	0.07	14%	0.137	C	C	.	.	H	α-helix	trans	-62.8	-44.4	175.8	-58	116.5	0	0	0	111	E758 V794 S795 R796 I800 Q801 R802	E758-N798 WeakPolarHBondContact OE1-CA 3.38Å; E758-N798 WeakPolarHBondContact OE1-CB 3.25Å; E758-N798 PolarHBondContact OE1-ND2 3.39Å; V794-N798 HydrophobicContact CB-CB 3.76Å; V794-N798 HydrophobicContact CG2-CB 3.97Å; S795-N798 VanDerWaalsContact CB-OD1 3.3Å; S795-N798 WeakPolarHBondContact CB-OD1 3.39Å; S795-N798 PolarHBondContact N-OD1 3.13Å; S795-N798 WeakPolarHBondContact O-CB 3.39Å; S795-N798 PolarHBondContact O-N 2.95Å; S795-N798 VanDerWaalsContact OG-CG 3.28Å; S795-N798 PolarHBondContact OG-N 3.2Å; S795-N798 PolarHBondContact OG-OD1 3.39Å; R796-N798 VanDerWaalsContact C-N 3.33Å; R796-N798 PolarHBondContact O-N 3.32Å; N798-I800 VanDerWaalsContact C-N 3.31Å; N798-I800 PolarHBondContact O-N 3.42Å; N798-Q801 WeakPolarHBondContact O-CB 3.32Å; N798-Q801 PolarHBondContact O-N 2.8Å; N798-Q801 VanDerWaalsContact O-N 3.12Å; N798-R802 WeakPolarHBondContact O-CB 3.24Å; N798-R802 VanDerWaalsContact O-CG 3.3Å; N798-R802 WeakPolarHBondContact O-CG 3.41Å; N798-R802 PolarHBondContact O-N 3.25Å
799	V	92.9	Very high	87	Confident	4 Å²	4	31.9 Å²	31.9	2%	0.024	16%	0.155	C	C	.	.	H	α-helix	trans	-57.4	-44.3	176.5	179.4	0	0	0	0	111.1	V794 S795 R796 Q801 R802 R803 F818 L823 M826	V794-V799 HydrophobicContact CG2-CG2 3.64Å; S795-V799 PolarHBondContact O-N 2.91Å; S795-V799 VanDerWaalsContact O-N 3.13Å; R796-V799 PolarHBondContact O-N 3.05Å; V799-Q801 VanDerWaalsContact C-N 3.33Å; V799-Q801 PolarHBondContact O-N 3.44Å; V799-R802 PolarHBondContact O-N 3.41Å; V799-R803 VanDerWaalsContact O-CB 3.27Å; V799-R803 WeakPolarHBondContact O-CB 3.25Å; V799-R803 PolarHBondContact O-N 3.02Å; V799-F818 HydrophobicContact CG1-CZ 4.04Å; V799-F818 HydrophobicContact CG2-CZ 3.87Å; V799-L823 HydrophobicContact CB-CD1 4.32Å; V799-L823 HydrophobicContact CG1-CD1 4.27Å; V799-L823 HydrophobicContact CG2-CD1 4.1Å; V799-M826 HydrophobicContact CG2-SD 3.93Å
800	I	88.3	Confident	87	Confident	70 Å²	70	32 Å²	32	36%	0.359	15%	0.153	S	C	.	.	H	α-helix	trans	-60.4	-42.8	177.1	-70	166	0	0	0	111	T616 R796 A797 N798 G804	T616-I800 HydrophobicContact CG2-CG2 4.27Å; R796-I800 WeakPolarHBondContact O-CG1 3.47Å; R796-I800 PolarHBondContact O-N 3.09Å; A797-I800 PolarHBondContact O-N 2.59Å; N798-I800 VanDerWaalsContact C-N 3.31Å; N798-I800 PolarHBondContact O-N 3.42Å; I800-G804 PolarHBondContact O-N 2.99Å
801	Q	86.1	Confident	87.2	Confident	6 Å²	6	31.3 Å²	31.3	3%	0.028	16%	0.157	C	C	.	.	H	α-helix	trans	-66.5	-43.5	177.2	-70.8	-166.2	30.7	0	0	113.2	H585 T616 E758 A797 N798 V799 G804 R805	H585-Q801 PolarHBondContact CD2-NE2 3.39Å; H585-Q801 PolarHBondContact NE2-NE2 3.35Å; T616-Q801 HydrophobicContact CG2-CG 3.74Å; T616-Q801 PolarHBondContact OG1-NE2 3.44Å; E758-Q801 HydrophobicContact CG-CB 4.11Å; E758-Q801 PolarHBondContact O-OE1 2.75Å; A797-Q801 WeakPolarHBondContact O-CG 3.45Å; A797-Q801 PolarHBondContact O-N 2.98Å; N798-Q801 WeakPolarHBondContact O-CB 3.32Å; N798-Q801 PolarHBondContact O-N 2.8Å; N798-Q801 VanDerWaalsContact O-N 3.12Å; V799-Q801 VanDerWaalsContact C-N 3.33Å; V799-Q801 PolarHBondContact O-N 3.44Å; Q801-G804 PolarHBondContact O-N 2.86Å; Q801-R805 PolarHBondContact O-N 3.47Å
802	R	91.3	Very high	87.5	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.1	-49.7	177.7	-70.9	179.3	179.2	-163	-1.2	110.7	F697 E758 D771 L774 N798 V799 G804 R805	F697-R802 HydrophobicContact CD1-CG 4.07Å; F697-R802 HydrophobicContact CD2-CB 3.76Å; F697-R802 HydrophobicContact CD2-CG 3.69Å; F697-R802 HydrophobicContact CE1-CG 3.99Å; F697-R802 HydrophobicContact CE2-CB 3.54Å; F697-R802 HydrophobicContact CE2-CG 3.61Å; F697-R802 HydrophobicContact CG-CB 4.47Å; F697-R802 HydrophobicContact CG-CG 3.92Å; F697-R802 HydrophobicContact CZ-CB 4.1Å; F697-R802 HydrophobicContact CZ-CG 3.76Å; E758-R802 HydrophobicContact CG-CG 3.91Å; E758-R802 IonicContact OE2-CZ 3.4Å; E758-R802 IonicContact OE2-NE 2.96Å; E758-R802 PolarHBondContact OE2-NE 3.31Å; E758-R802 IonicContact OE2-NH2 2.9Å; E758-R802 PolarHBondContact OE2-NH2 3.38Å; D771-R802 VanDerWaalsContact CG-CD 3.45Å; D771-R802 WeakPolarHBondContact OD1-CD 3.4Å; D771-R802 IonicContact OD1-CZ 3.51Å; D771-R802 IonicContact OD1-NE 3.5Å; D771-R802 IonicContact OD1-NH1 2.9Å; D771-R802 PolarHBondContact OD1-NH1 3.02Å; D771-R802 WeakPolarHBondContact OD2-CD 3.35Å; L774-R802 PolarHBondContact O-NH1 2.91Å; N798-R802 WeakPolarHBondContact O-CB 3.24Å; N798-R802 VanDerWaalsContact O-CG 3.3Å; N798-R802 WeakPolarHBondContact O-CG 3.41Å; N798-R802 PolarHBondContact O-N 3.25Å; V799-R802 PolarHBondContact O-N 3.41Å; R802-G804 VanDerWaalsContact C-N 3.26Å; R802-G804 PolarHBondContact O-N 3.41Å; R802-R805 VanDerWaalsContact O-CB 3.31Å; R802-R805 WeakPolarHBondContact O-CB 3.43Å; R802-R805 WeakPolarHBondContact O-CG 3.38Å; R802-R805 PolarHBondContact O-N 2.82Å
803	R	90.5	Very high	87.7	Confident	57 Å²	57	30.8 Å²	30.8	22%	0.215	15%	0.151	C	C	.	.	H	α-helix	trans	-53.8	-44	171.7	179.8	-164.1	68.5	-178.5	-0.5	111.7	V641 E643 V799 R805 A806 A814	V641-R803 HydrophobicContact CB-CG 4.13Å; V641-R803 HydrophobicContact CG1-CG 3.77Å; E643-R803 HydrophobicContact CG-CG 4.4Å; E643-R803 WeakPolarHBondContact OE1-CD 3.34Å; E643-R803 IonicContact OE1-CZ 3.69Å; E643-R803 IonicContact OE1-NE 2.84Å; E643-R803 IonicContact OE1-NH1 2.83Å; E643-R803 PolarHBondContact OE1-NH1 3.34Å; V799-R803 VanDerWaalsContact O-CB 3.27Å; V799-R803 WeakPolarHBondContact O-CB 3.25Å; V799-R803 PolarHBondContact O-N 3.02Å; R803-R805 PolarHBondContact O-N 3.37Å; R803-A806 PolarHBondContact O-N 2.93Å; R803-A806 VanDerWaalsContact O-N 3.15Å; R803-A814 HydrophobicContact CB-CB 4.2Å; R803-A814 HydrophobicContact CG-CB 3.76Å
804	G	84.5	Confident	87.9	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-16.2	178.8	0	0	0	0	0	114	I800 Q801 R802 A806 G807 R808	I800-G804 PolarHBondContact O-N 2.99Å; Q801-G804 PolarHBondContact O-N 2.86Å; R802-G804 VanDerWaalsContact C-N 3.26Å; R802-G804 PolarHBondContact O-N 3.41Å; G804-A806 VanDerWaalsContact C-N 3.34Å; G804-A806 PolarHBondContact O-N 3.12Å; G804-G807 PolarHBondContact O-N 2.93Å; G804-R808 WeakPolarHBondContact O-CG 3.39Å
805	R	85.8	Confident	88.1	Confident	9 Å²	9	28.8 Å²	28.8	3%	0.034	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-25.2	177.5	-55.7	-39.2	-168.7	120.8	-25.2	114	L695 F697 A757 E758 T759 I761 V769 Q801 R802 R803 R808	L695-R805 HydrophobicContact CD2-CB 3.97Å; L695-R805 HydrophobicContact CD2-CG 4.14Å; F697-R805 HydrophobicContact CE2-CG 4.29Å; F697-R805 HydrophobicContact CZ-CG 3.95Å; A757-R805 PolarHBondContact O-NE 3.38Å; A757-R805 PolarHBondContact O-NH1 3.24Å; E758-R805 VanDerWaalsContact C-CZ 3.44Å; E758-R805 PolarHBondContact O-NE 3.29Å; E758-R805 PolarHBondContact O-NH2 3.2Å; T759-R805 VanDerWaalsContact N-NH2 3.18Å; I761-R805 PolarHBondContact O-NH1 3.29Å; V769-R805 HydrophobicContact CG2-CB 3.83Å; Q801-R805 PolarHBondContact O-N 3.47Å; R802-R805 VanDerWaalsContact O-CB 3.31Å; R802-R805 WeakPolarHBondContact O-CB 3.43Å; R802-R805 WeakPolarHBondContact O-CG 3.38Å; R802-R805 PolarHBondContact O-N 2.82Å; R803-R805 PolarHBondContact O-N 3.37Å; R805-R808 VanDerWaalsContact NE-NH2 3.18Å
806	A	87.1	Confident	88.3	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.008	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-24.3	174.1	0	0	0	0	0	113.5	V641 V767 V769 R803 G804 Q810	V641-A806 HydrophobicContact CG1-CB 4.22Å; V641-A806 HydrophobicContact CG2-CB 4.38Å; V767-A806 WeakPolarHBondContact O-CB 3.48Å; V769-A806 HydrophobicContact CB-CB 4.39Å; V769-A806 HydrophobicContact CG2-CB 3.8Å; R803-A806 PolarHBondContact O-N 2.93Å; R803-A806 VanDerWaalsContact O-N 3.15Å; G804-A806 VanDerWaalsContact C-N 3.34Å; G804-A806 PolarHBondContact O-N 3.12Å; A806-Q810 VanDerWaalsContact O-O 3.05Å
807	G	78.1	Confident	88.3	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.128	C	C	.	.	S	Bend	trans	-99.5	12.1	-171.6	0	0	0	0	0	115.7	Y639 G804	Y639-G807 PolarHBondContact N-O 2.94Å; G804-G807 PolarHBondContact O-N 2.93Å
808	R	72.6	Confident	88.6	Confident	51 Å²	51	24 Å²	24	19%	0.192	12%	0.123	C	C	.	.	S	Bend	trans	-78.4	-50.6	-171.8	-90	168.4	-177.6	-159.6	2.8	114.3	T482 G804 R805	T482-R808 PolarHBondContact OG1-NE 2.88Å; T482-R808 PolarHBondContact OG1-NH2 2.91Å; G804-R808 WeakPolarHBondContact O-CG 3.39Å; R805-R808 VanDerWaalsContact NE-NH2 3.18Å
809	C	71.1	Confident	88.6	Confident	65 Å²	65	25.3 Å²	25.3	44%	0.439	13%	0.132	S	C	.	.	S	Bend	trans	-105.6	-22.7	-173.7	-63.7	0	0	0	0	112.7	Y639	Y639-C809 VanDerWaalsContact CE2-C 3.41Å; Y639-C809 VanDerWaalsContact CE2-O 3.26Å; Y639-C809 WeakPolarHBondContact CE2-O 3.47Å
810	Q	80.9	Confident	88.7	Confident	91 Å²	91	29.8 Å²	29.8	43%	0.425	15%	0.149	S	C	.	.	S	Bend	trans	-160.7	169.9	-178.2	58.6	-169.8	-24.8	0	0	109.6	Y639 V767 A806	Y639-Q810 VanDerWaalsContact CB-O 3.3Å; Y639-Q810 WeakPolarHBondContact CB-O 2.85Å; Y639-Q810 VanDerWaalsContact CG-C 3.4Å; V767-Q810 HydrophobicContact CG2-CG 4.11Å; A806-Q810 VanDerWaalsContact O-O 3.05Å
811	S	88.9	Confident	88.9	Confident	63 Å²	63	29.6 Å²	29.6	44%	0.441	15%	0.154	S	C	.	.			trans	-60.3	146.9	173.4	-55.2	0	0	0	0	110.5	Y639 P640	Y639-S811 VanDerWaalsContact CB-N 3.29Å; P640-S811 WeakPolarHBondContact CD-OG 3.09Å; P640-S811 WeakPolarHBondContact CG-OG 3.08Å; P640-S811 WeakPolarHBondContact O-CA 3.39Å; P640-S811 WeakPolarHBondContact O-CB 3.28Å
812	G	93.3	Very high	89.2	Confident	3 Å²	3	31.2 Å²	31.2	3%	0.031	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	-169.4	-173.6	0	0	0	0	0	114	P640 V641 K642 V767	P640-G812 PolarHBondContact O-N 3.32Å; P640-G812 VanDerWaalsContact O-N 3.16Å; V641-G812 CarbonylContact C-O 3.27Å; V641-G812 VanDerWaalsContact CA-O 3.3Å; V641-G812 WeakPolarHBondContact CA-O 3.28Å; K642-G812 PolarHBondContact N-O 2.89Å; V767-G812 CarbonylContact O-C 3.59Å; V767-G812 VanDerWaalsContact O-CA 3.22Å; V767-G812 WeakPolarHBondContact O-CA 3.44Å
813	F	96.9	Very high	89.3	Confident	45 Å²	45	33 Å²	33	20%	0.197	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	138.1	-176.1	-56.9	-96.4	0	0	0	110	K642 E690 V767 H768 V769 Y815	K642-F813 HydrophobicContact CB-CD1 3.83Å; K642-F813 HydrophobicContact CB-CE1 4.13Å; K642-F813 HydrophobicContact CD-CD1 4.27Å; K642-F813 HydrophobicContact CD-CE1 4.06Å; K642-F813 HydrophobicContact CG-CD1 4.47Å; K642-F813 WeakPolarHBondContact O-CA 3.17Å; E690-F813 HydrophobicContact CB-CE2 4.04Å; E690-F813 HydrophobicContact CG-CE2 3.63Å; E690-F813 HydrophobicContact CG-CZ 3.88Å; V767-F813 HydrophobicContact CG1-CD2 4.32Å; V767-F813 PolarHBondContact O-N 3.16Å; H768-F813 CarbonylContact C-O 3.56Å; H768-F813 WeakPolarHBondContact CA-O 3.44Å; H768-F813 AromaticContact CE1-CD2 3.52Å; H768-F813 AromaticContact ND1-CD2 3.6Å; H768-F813 AromaticContact ND1-CG 3.97Å; V769-F813 PolarHBondContact N-O 3.45Å; F813-Y815 HydrophobicContact CB-CD2 4.31Å; F813-Y815 HydrophobicContact CB-CE2 3.47Å; F813-Y815 VanDerWaalsContact CB-CE2 3.47Å; F813-Y815 HydrophobicContact CG-CE2 4.46Å
814	A	96.7	Very high	89.5	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	127.1	172.2	0	0	0	0	0	109.4	V641 K642 E643 H644 V769 R803	V641-A814 HydrophobicContact CG1-CB 3.7Å; K642-A814 PolarHBondContact O-N 3.18Å; E643-A814 CarbonylContact C-O 3.42Å; E643-A814 WeakPolarHBondContact CA-O 3.36Å; E643-A814 HydrophobicContact CG-CB 4.46Å; H644-A814 PolarHBondContact N-O 2.85Å; V769-A814 CarbonylContact O-C 3.58Å; V769-A814 WeakPolarHBondContact O-CA 3.37Å; R803-A814 HydrophobicContact CB-CB 4.2Å; R803-A814 HydrophobicContact CG-CB 3.76Å
815	Y	98	Very high	89.8	Confident	11 Å²	11	42.6 Å²	42.6	4%	0.043	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	105.9	-178.1	-58	-93.3	0	0	0	108.4	H644 I649 L681 I685 H768 V769 V770 D771 F813	H644-Y815 HydrophobicContact CB-CD1 3.75Å; H644-Y815 HydrophobicContact CB-CE1 4.22Å; H644-Y815 AromaticContact CD2-CD1 3.93Å; H644-Y815 AromaticContact CD2-CE1 3.52Å; H644-Y815 CarbonylContact O-C 3.6Å; H644-Y815 WeakPolarHBondContact O-CA 3.48Å; I649-Y815 HydrophobicContact CG1-CD1 4.25Å; L681-Y815 HydrophobicContact CD1-CD1 3.89Å; L681-Y815 HydrophobicContact CD1-CE1 4.36Å; L681-Y815 HydrophobicContact CD1-CG 4.23Å; L681-Y815 HydrophobicContact CD2-CG 4.31Å; I685-Y815 HydrophobicContact CD1-CD2 3.57Å; I685-Y815 HydrophobicContact CD1-CE1 4.48Å; I685-Y815 HydrophobicContact CD1-CE2 3.48Å; I685-Y815 VanDerWaalsContact CD1-CE2 3.48Å; I685-Y815 HydrophobicContact CD1-CG 4.13Å; I685-Y815 HydrophobicContact CG1-CD2 4.35Å; I685-Y815 HydrophobicContact CG1-CE1 4.36Å; I685-Y815 HydrophobicContact CG1-CE2 3.82Å; H768-Y815 HydrophobicContact CB-CE2 4.33Å; H768-Y815 AromaticContact ND1-CE2 3.84Å; V769-Y815 WeakPolarHBondContact O-CD2 3.46Å; V769-Y815 PolarHBondContact O-N 2.95Å; V770-Y815 CarbonylContact C-O 3.44Å; V770-Y815 WeakPolarHBondContact CA-O 3.41Å; D771-Y815 PolarHBondContact N-O 3.42Å; F813-Y815 HydrophobicContact CB-CD2 4.31Å; F813-Y815 HydrophobicContact CB-CE2 3.47Å; F813-Y815 VanDerWaalsContact CB-CE2 3.47Å; F813-Y815 HydrophobicContact CG-CE2 4.46Å
816	H	97.3	Very high	90.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	116.2	-177.1	-56.9	-56.8	0	0	0	109.7	E643 H644 Y645 L646 I649 F818	E643-H816 IonicContact OE2-CD2 2.66Å; E643-H816 IonicContact OE2-NE2 3.87Å; E643-H816 PolarHBondContact OE2-NE2 3.36Å; H644-H816 PolarHBondContact O-N 3.15Å; Y645-H816 CarbonylContact C-O 3.57Å; Y645-H816 HydrophobicContact CD1-CB 4.07Å; Y645-H816 HydrophobicContact CE1-CB 4.33Å; Y645-H816 AromaticContact CE1-CD2 3.63Å; Y645-H816 AromaticContact CE2-CD2 3.99Å; Y645-H816 AromaticContact CZ-CD2 3.59Å; L646-H816 PolarHBondContact N-O 3.06Å; I649-H816 WeakPolarHBondContact CD1-O 3.24Å; H816-F818 HydrophobicContact CB-CD1 4.17Å; H816-F818 HydrophobicContact CB-CD2 4.35Å; H816-F818 HydrophobicContact CB-CE1 3.74Å; H816-F818 HydrophobicContact CB-CE2 3.94Å; H816-F818 HydrophobicContact CB-CG 4.47Å; H816-F818 HydrophobicContact CB-CZ 3.63Å; H816-F818 AromaticContact CG-CZ 3.84Å; H816-F818 AromaticContact ND1-CZ 3.86Å; H816-F818 PolarHBondContact O-N 2.9Å
817	L	95	Very high	90.5	Very high	16 Å²	16	46.3 Å²	46.3	8%	0.084	24%	0.237	C	C	.	.	S	Bend	trans	-78.9	29.9	-179	-61.2	176.8	0	0	0	113.1	I649 L673 L677 V678 L681 V770 D771	I649-L817 HydrophobicContact CD1-CD2 4.05Å; L673-L817 HydrophobicContact CD1-CD1 4.13Å; L677-L817 HydrophobicContact CD2-CD2 4.11Å; L677-L817 HydrophobicContact CG-CD2 4.13Å; V678-L817 HydrophobicContact CB-CD1 4.38Å; V678-L817 HydrophobicContact CG2-CD1 3.41Å; V678-L817 VanDerWaalsContact CG2-CD1 3.41Å; L681-L817 HydrophobicContact CD2-CD2 3.71Å; V770-L817 HydrophobicContact CG1-CD1 3.98Å; V770-L817 HydrophobicContact CG1-CG 4.27Å; D771-L817 PolarHBondContact O-N 3.37Å
818	F	93.9	Very high	91.1	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.26	C	S	.	.	S	Bend	trans	-139.7	152	175.7	51.8	-92.4	0	0	0	109.6	Y645 L646 G773 W793 V799 H816 R822 L823 M826	Y645-F818 HydrophobicContact CD1-CE2 4.48Å; Y645-F818 HydrophobicContact CE1-CE2 4.25Å; L646-F818 VanDerWaalsContact CB-C 3.46Å; L646-F818 PolarHBondContact N-O 3.41Å; G773-F818 VanDerWaalsContact CA-CD1 3.49Å; W793-F818 HydrophobicContact CH2-CB 4.03Å; W793-F818 HydrophobicContact CZ3-CB 3.71Å; W793-F818 HydrophobicContact CZ3-CD1 4.16Å; W793-F818 HydrophobicContact CZ3-CG 4.13Å; V799-F818 HydrophobicContact CG1-CZ 4.04Å; V799-F818 HydrophobicContact CG2-CZ 3.87Å; H816-F818 HydrophobicContact CB-CD1 4.17Å; H816-F818 HydrophobicContact CB-CD2 4.35Å; H816-F818 HydrophobicContact CB-CE1 3.74Å; H816-F818 HydrophobicContact CB-CE2 3.94Å; H816-F818 HydrophobicContact CB-CG 4.47Å; H816-F818 HydrophobicContact CB-CZ 3.63Å; H816-F818 AromaticContact CG-CZ 3.84Å; H816-F818 AromaticContact ND1-CZ 3.86Å; H816-F818 PolarHBondContact O-N 2.9Å; F818-R822 HydrophobicContact CB-CB 4.12Å; F818-R822 HydrophobicContact CB-CG 3.99Å; F818-R822 HydrophobicContact CD2-CB 4.3Å; F818-R822 HydrophobicContact CD2-CG 4.23Å; F818-R822 HydrophobicContact CG-CG 4.34Å; F818-L823 HydrophobicContact CE2-CB 4.13Å; F818-L823 HydrophobicContact CE2-CD1 4.3Å; F818-M826 HydrophobicContact CD1-CE 4.14Å; F818-M826 HydrophobicContact CD2-CE 3.78Å; F818-M826 HydrophobicContact CE1-CE 4.14Å; F818-M826 HydrophobicContact CE2-CE 3.78Å; F818-M826 HydrophobicContact CE2-SD 4.42Å; F818-M826 HydrophobicContact CG-CE 3.96Å; F818-M826 HydrophobicContact CZ-CE 3.96Å
819	P	92.4	Very high	92	Very high	39 Å²	39	52.3 Å²	52.3	25%	0.253	27%	0.272	S	S	.	.			trans	-73.3	160.3	-178.6	29.9	-34.7	0	0	0	111.9	E647 S821 R822 L823	E647-P819 VanDerWaalsContact OE2-CA 3.28Å; E647-P819 WeakPolarHBondContact OE2-CA 3.43Å; P819-S821 PolarHBondContact O-N 2.99Å; P819-R822 HydrophobicContact CG-CB 3.95Å; P819-R822 VanDerWaalsContact O-CB 3.31Å; P819-R822 WeakPolarHBondContact O-CB 3.44Å; P819-R822 PolarHBondContact O-N 2.99Å; P819-L823 PolarHBondContact O-N 3.41Å
820	R	93.6	Very high	92.8	Very high	99 Å²	99	51.4 Å²	51.4	37%	0.374	26%	0.262	S	S	.	.	H	α-helix	trans	-55.2	-39	174.4	-72.8	173.9	179.5	93.5	0.7	112.9	Y645 E647 D648 R822 L823 E824	Y645-R820 HydrophobicContact CD1-CB 4.41Å; Y645-R820 HydrophobicContact CD1-CG 3.62Å; Y645-R820 HydrophobicContact CD2-CG 3.68Å; Y645-R820 HydrophobicContact CE1-CG 4.03Å; Y645-R820 HydrophobicContact CE2-CG 4.1Å; Y645-R820 HydrophobicContact CG-CG 3.43Å; Y645-R820 VanDerWaalsContact CG-CG 3.43Å; E647-R820 WeakPolarHBondContact OE1-CD 3.47Å; E647-R820 VanDerWaalsContact OE1-CG 3.25Å; E647-R820 WeakPolarHBondContact OE1-CG 3.15Å; E647-R820 IonicContact OE1-CZ 3.39Å; E647-R820 IonicContact OE1-NE 3.99Å; E647-R820 IonicContact OE1-NH1 3.7Å; E647-R820 PolarHBondContact OE1-NH1 3.32Å; D648-R820 IonicContact OD1-CZ 3.29Å; D648-R820 IonicContact OD1-NH1 2.65Å; D648-R820 PolarHBondContact OD1-NH1 3.29Å; D648-R820 IonicContact OD1-NH2 3.04Å; D648-R820 IonicContact OD2-CZ 3.66Å; D648-R820 IonicContact OD2-NH1 3.88Å; D648-R820 PolarHBondContact OD2-NH1 3.4Å; D648-R820 IonicContact OD2-NH2 3.62Å; D648-R820 PolarHBondContact OD2-NH2 3.28Å; R820-R822 PolarHBondContact O-N 3.2Å; R820-L823 WeakPolarHBondContact O-CB 3.44Å; R820-L823 PolarHBondContact O-N 2.86Å; R820-E824 PolarHBondContact O-N 3.16Å
821	S	92.1	Very high	93.3	Very high	66 Å²	66	50.5 Å²	50.5	46%	0.462	26%	0.262	S	S	.	.	H	α-helix	trans	-59.9	-29	175.9	57.2	0	0	0	0	113.3	P819 K825	P819-S821 PolarHBondContact O-N 2.99Å; S821-K825 PolarHBondContact O-N 2.96Å
822	R	93.3	Very high	93.4	Very high	40 Å²	40	48 Å²	48	15%	0.151	24%	0.244	C	C	.	.	H	α-helix	trans	-69.4	-45.7	172.7	172.4	66.8	68.2	170.4	2.2	110.9	E668 W793 F818 P819 R820 E824 K825 M826	E668-R822 PolarHBondContact O-NH1 2.75Å; E668-R822 PolarHBondContact O-NH2 3.04Å; W793-R822 HydrophobicContact CD2-CG 4.26Å; W793-R822 HydrophobicContact CE3-CG 4Å; W793-R822 HydrophobicContact CH2-CG 4.31Å; W793-R822 VanDerWaalsContact CZ2-CZ 3.42Å; W793-R822 HydrophobicContact CZ3-CG 4.04Å; W793-R822 VanDerWaalsContact NE1-CZ 3.27Å; F818-R822 HydrophobicContact CB-CB 4.12Å; F818-R822 HydrophobicContact CB-CG 3.99Å; F818-R822 HydrophobicContact CD2-CB 4.3Å; F818-R822 HydrophobicContact CD2-CG 4.23Å; F818-R822 HydrophobicContact CG-CG 4.34Å; P819-R822 HydrophobicContact CG-CB 3.95Å; P819-R822 VanDerWaalsContact O-CB 3.31Å; P819-R822 WeakPolarHBondContact O-CB 3.44Å; P819-R822 PolarHBondContact O-N 2.99Å; R820-R822 PolarHBondContact O-N 3.2Å; R822-E824 PolarHBondContact O-N 3.03Å; R822-K825 WeakPolarHBondContact O-CA 3.39Å; R822-K825 PolarHBondContact O-N 2.83Å; R822-M826 HydrophobicContact CG-CE 3.58Å; R822-M826 HydrophobicContact CG-CG 4.39Å; R822-M826 WeakPolarHBondContact O-CG 3.39Å; R822-M826 PolarHBondContact O-N 2.81Å
823	L	94.2	Very high	93.4	Very high	36 Å²	36	50.2 Å²	50.2	19%	0.188	25%	0.254	C	S	.	.	H	α-helix	trans	-57.2	-38	179.2	-178.3	64.9	0	0	0	111.2	Y645 R796 V799 F818 P819 R820 K825 M826	Y645-L823 HydrophobicContact CE1-CB 4.4Å; Y645-L823 HydrophobicContact CE1-CD2 3.84Å; Y645-L823 VanDerWaalsContact OH-CD2 3.3Å; Y645-L823 WeakPolarHBondContact OH-CD2 3.37Å; R796-L823 HydrophobicContact CG-CD1 4.04Å; R796-L823 PolarHBondContact NE-O 3.47Å; V799-L823 HydrophobicContact CB-CD1 4.32Å; V799-L823 HydrophobicContact CG1-CD1 4.27Å; V799-L823 HydrophobicContact CG2-CD1 4.1Å; F818-L823 HydrophobicContact CE2-CB 4.13Å; F818-L823 HydrophobicContact CE2-CD1 4.3Å; P819-L823 PolarHBondContact O-N 3.41Å; R820-L823 WeakPolarHBondContact O-CB 3.44Å; R820-L823 PolarHBondContact O-N 2.86Å; L823-K825 VanDerWaalsContact C-N 3.26Å; L823-K825 PolarHBondContact O-N 2.96Å; L823-M826 HydrophobicContact CD1-SD 3.99Å; L823-M826 PolarHBondContact O-N 3.1Å
824	E	93.1	Very high	93.3	Very high	137 Å²	137	48.1 Å²	48.1	64%	0.64	25%	0.245	S	C	*	.	H	α-helix	trans	-65.9	-25.1	175.1	-68.2	172.5	-172.9	0	0	113.4	R796 R820 R822	R796-E824 VanDerWaalsContact NH2-C 3.3Å; R796-E824 PolarHBondContact NH2-O 3.25Å; R820-E824 PolarHBondContact O-N 3.16Å; R822-E824 PolarHBondContact O-N 3.03Å
825	K	92.1	Very high	93.1	Very high	122 Å²	122	51.8 Å²	51.8	53%	0.53	26%	0.264	S	S	.	.	H	α-helix	trans	-91.8	-18.6	175.6	-67.1	177.9	-179.4	-178.8	0	113.6	E668 S821 R822 L823	E668-K825 IonicContact OE1-NZ 3.75Å; E668-K825 PolarHBondContact OE1-NZ 2.86Å; E668-K825 IonicContact OE2-NZ 3.72Å; E668-K825 PolarHBondContact OE2-NZ 3.19Å; S821-K825 PolarHBondContact O-N 2.96Å; R822-K825 WeakPolarHBondContact O-CA 3.39Å; R822-K825 PolarHBondContact O-N 2.83Å; L823-K825 VanDerWaalsContact C-N 3.26Å; L823-K825 PolarHBondContact O-N 2.96Å
826	M	93.9	Very high	92.8	Very high	9 Å²	9	52.5 Å²	52.5	4%	0.044	27%	0.267	C	S	.	.	S	Bend	trans	-61.7	141.8	177.7	-71.2	178.2	-178.8	0	0	111.7	W793 V794 R796 V799 F818 R822 L823	W793-M826 HydrophobicContact CD2-CE 4.32Å; W793-M826 HydrophobicContact CE3-CE 3.46Å; W793-M826 VanDerWaalsContact CE3-CE 3.46Å; W793-M826 HydrophobicContact CZ3-CE 4.06Å; V794-M826 VanDerWaalsContact O-SD 3.41Å; R796-M826 HydrophobicContact CG-CB 3.97Å; R796-M826 PolarHBondContact NE-O 2.84Å; V799-M826 HydrophobicContact CG2-SD 3.93Å; F818-M826 HydrophobicContact CD1-CE 4.14Å; F818-M826 HydrophobicContact CD2-CE 3.78Å; F818-M826 HydrophobicContact CE1-CE 4.14Å; F818-M826 HydrophobicContact CE2-CE 3.78Å; F818-M826 HydrophobicContact CE2-SD 4.42Å; F818-M826 HydrophobicContact CG-CE 3.96Å; F818-M826 HydrophobicContact CZ-CE 3.96Å; R822-M826 HydrophobicContact CG-CE 3.58Å; R822-M826 HydrophobicContact CG-CG 4.39Å; R822-M826 WeakPolarHBondContact O-CG 3.39Å; R822-M826 PolarHBondContact O-N 2.81Å; L823-M826 HydrophobicContact CD1-SD 3.99Å; L823-M826 PolarHBondContact O-N 3.1Å
827	V	92.7	Very high	92.4	Very high	80 Å²	80	53.5 Å²	53.5	49%	0.485	27%	0.273	S	S	.	.			trans	-61.8	146.7	176.1	-64.4	0	0	0	0	110.9	S795 R796 F829	S795-V827 CarbonylContact C-O 3.53Å; S795-V827 VanDerWaalsContact CA-O 3.24Å; S795-V827 WeakPolarHBondContact CA-O 3.31Å; S795-V827 VanDerWaalsContact CB-O 3.29Å; S795-V827 WeakPolarHBondContact CB-O 3.4Å; R796-V827 PolarHBondContact N-O 3.28Å; V827-F829 WeakPolarHBondContact CG2-O 3.27Å; V827-F829 PolarHBondContact O-N 3.05Å
828	P	92	Very high	92.2	Very high	75 Å²	75	54.1 Å²	54.1	49%	0.487	28%	0.278	S	S	.	.	S	Bend	trans	-62.6	-40.7	-178.1	-24.7	34.6	0	0	0	113.5	A797	A797-P828 WeakPolarHBondContact CB-O 3.43Å; A797-P828 PolarHBondContact N-O 3.49Å; A797-P828 VanDerWaalsContact N-O 3.14Å
829	F	90.1	Very high	92.2	Very high	101 Å²	101	54.3 Å²	54.3	44%	0.443	28%	0.279	S	S	.	.	S	Bend	trans	-136.1	152.5	-176.2	-52.8	-68.6	0	0	0	110.2	G617 D618 A797 V827	G617-F829 VanDerWaalsContact CA-CE1 3.48Å; D618-F829 HydrophobicContact CB-CE2 4.32Å; A797-F829 HydrophobicContact CB-CD1 3.86Å; A797-F829 HydrophobicContact CB-CE1 4.31Å; V827-F829 WeakPolarHBondContact CG2-O 3.27Å; V827-F829 PolarHBondContact O-N 3.05Å
830	Q	88.3	Confident	92.3	Very high	47 Å²	47	53 Å²	53	22%	0.22	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-67	147.8	175.7	-171.6	172.5	2.1	0	0	111.1	E777 S795	E777-Q830 PolarHBondContact OE2-NE2 3.06Å; S795-Q830 PolarHBondContact OG-N 2.87Å
831	V	90.9	Very high	92.3	Very high	72 Å²	72	51.4 Å²	51.4	44%	0.436	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-68	127.6	172.2	-178.8	0	0	0	0	109.2	L835 R836	V831-L835 HydrophobicContact CG1-CB 4.09Å; V831-L835 HydrophobicContact CG1-CD1 4.21Å; V831-R836 PolarHBondContact O-NE 2.88Å
832	P	92.7	Very high	92.4	Very high	10 Å²	10	48.6 Å²	48.6	7%	0.065	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-55.9	143.9	-179.7	-27.1	35.4	0	0	0	113.4	R587 I834 L835 D864	R587-P832 HydrophobicContact CB-CB 4Å; R587-P832 HydrophobicContact CB-CG 4.35Å; R587-P832 HydrophobicContact CG-CG 4.41Å; R587-P832 VanDerWaalsContact CZ-CG 3.45Å; P832-I834 VanDerWaalsContact C-N 3.27Å; P832-I834 HydrophobicContact CB-CG2 4.08Å; P832-I834 PolarHBondContact O-N 3.12Å; P832-L835 HydrophobicContact CB-CG 4.32Å; P832-L835 HydrophobicContact CG-CD1 4.33Å; P832-L835 PolarHBondContact O-N 3.4Å; P832-D864 HydrophobicContact CG-CB 4.33Å
833	E	92.7	Very high	92.5	Very high	50 Å²	50	46.7 Å²	46.7	23%	0.234	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-61.1	-37	-175.2	-55.6	-144.3	137.2	0	0	112.6	R587 V589 L835 R836 T837	R587-E833 VanDerWaalsContact O-CG 3.31Å; R587-E833 WeakPolarHBondContact O-CG 3.3Å; R587-E833 PolarHBondContact O-N 2.98Å; R587-E833 VanDerWaalsContact O-N 3.07Å; V589-E833 HydrophobicContact CB-CB 3.92Å; E833-L835 PolarHBondContact O-N 2.86Å; E833-R836 WeakPolarHBondContact O-CG 3.35Å; E833-R836 PolarHBondContact O-N 2.82Å; E833-R836 IonicContact OE1-CZ 2.79Å; E833-R836 IonicContact OE1-NH1 3.71Å; E833-R836 IonicContact OE1-NH2 3.82Å; E833-R836 PolarHBondContact OE1-NH2 2.89Å; E833-T837 HydrophobicContact CB-CG2 4.47Å; E833-T837 PolarHBondContact O-N 2.99Å; E833-T837 PolarHBondContact O-OG1 3.42Å
834	I	94.2	Very high	92.6	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-57.4	-20.1	177.4	-164.2	168.2	0	0	0	113.6	V589 P832 L839 L842 L859 A862 P866	V589-I834 HydrophobicContact CG2-CB 4.12Å; V589-I834 HydrophobicContact CG2-CG1 4.33Å; P832-I834 VanDerWaalsContact C-N 3.27Å; P832-I834 HydrophobicContact CB-CG2 4.08Å; P832-I834 PolarHBondContact O-N 3.12Å; I834-L839 HydrophobicContact CG1-CD2 4.16Å; I834-L842 HydrophobicContact CD1-CD2 3.87Å; I834-L842 HydrophobicContact CG1-CD2 3.89Å; I834-L859 HydrophobicContact CD1-CD2 4.47Å; I834-A862 HydrophobicContact CD1-CB 3.97Å; I834-P866 HydrophobicContact CG1-CG 4.47Å
835	L	93.9	Very high	92.6	Very high	76 Å²	76	41.1 Å²	41.1	40%	0.398	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-92.6	-7.3	178	-54.6	-174.1	0	0	0	113.5	V831 P832 E833 D864 S865 P866	V831-L835 HydrophobicContact CG1-CB 4.09Å; V831-L835 HydrophobicContact CG1-CD1 4.21Å; P832-L835 HydrophobicContact CB-CG 4.32Å; P832-L835 HydrophobicContact CG-CD1 4.33Å; P832-L835 PolarHBondContact O-N 3.4Å; E833-L835 PolarHBondContact O-N 2.86Å; L835-D864 HydrophobicContact CD1-CB 4.18Å; L835-D864 HydrophobicContact CD2-CB 4.38Å; L835-S865 WeakPolarHBondContact CD2-O 3.08Å; L835-P866 HydrophobicContact CD2-CB 4.37Å
836	R	91.3	Very high	92.8	Very high	26 Å²	26	35.3 Å²	35.3	10%	0.098	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.8	-6.6	-169.9	58.9	176.9	-177.7	75.5	-4.2	115	E777 E778 R779 Y780 V831 E833	E777-R836 IonicContact OE2-CZ 3.44Å; E777-R836 IonicContact OE2-NE 3.22Å; E777-R836 PolarHBondContact OE2-NE 2.87Å; E778-R836 PolarHBondContact O-NH1 3.48Å; R779-R836 CarbonylContact C-O 3.56Å; R779-R836 VanDerWaalsContact C-O 3.24Å; R779-R836 VanDerWaalsContact CA-O 3.25Å; R779-R836 WeakPolarHBondContact CA-O 3.35Å; Y780-R836 WeakPolarHBondContact CB-O 3.45Å; Y780-R836 PolarHBondContact N-O 3.37Å; V831-R836 PolarHBondContact O-NE 2.88Å; E833-R836 WeakPolarHBondContact O-CG 3.35Å; E833-R836 PolarHBondContact O-N 2.82Å; E833-R836 IonicContact OE1-CZ 2.79Å; E833-R836 IonicContact OE1-NH1 3.71Å; E833-R836 IonicContact OE1-NH2 3.82Å; E833-R836 PolarHBondContact OE1-NH2 2.89Å
837	T	89.4	Confident	92.8	Very high	21 Å²	21	35.1 Å²	35.1	13%	0.129	19%	0.188	C	C	.	.	S	Bend	trans	-107.2	159	176.5	60.8	0	0	0	0	112.2	E833	E833-T837 HydrophobicContact CB-CG2 4.47Å; E833-T837 PolarHBondContact O-N 2.99Å; E833-T837 PolarHBondContact O-OG1 3.42Å
838	P	90.4	Very high	92.8	Very high	30 Å²	30	33.1 Å²	33.1	20%	0.195	17%	0.174	C	C	.	.			trans	-55.7	146.2	168.1	-15.1	23.8	0	0	0	111.9	Y780 E840	Y780-P838 HydrophobicContact CD2-CB 4.21Å; Y780-P838 HydrophobicContact CD2-CG 3.55Å; Y780-P838 HydrophobicContact CE2-CB 4.16Å; Y780-P838 HydrophobicContact CE2-CG 3.81Å; Y780-P838 HydrophobicContact CG-CG 4.15Å; P838-E840 WeakPolarHBondContact CB-OE1 3.47Å; P838-E840 WeakPolarHBondContact CB-OE2 3.45Å
839	L	93.7	Very high	92.8	Very high	4 Å²	4	30.9 Å²	30.9	2%	0.021	16%	0.157	C	C	.	.			trans	-109	-5.2	-170.7	-63.5	179.6	0	0	0	114.2	I834 N841 L842 V843 P866 A870 V871 A874	I834-L839 HydrophobicContact CG1-CD2 4.16Å; L839-N841 VanDerWaalsContact C-N 3.3Å; L839-N841 PolarHBondContact O-N 3.34Å; L839-L842 HydrophobicContact CD2-CD2 4.09Å; L839-L842 CarbonylContact O-C 3.4Å; L839-L842 WeakPolarHBondContact O-CA 3.32Å; L839-L842 WeakPolarHBondContact O-CB 3.31Å; L839-L842 PolarHBondContact O-N 3.32Å; L839-V843 WeakPolarHBondContact O-CG2 3.38Å; L839-V843 PolarHBondContact O-N 3.29Å; L839-P866 HydrophobicContact CD1-CB 3.73Å; L839-P866 HydrophobicContact CD1-CG 4.12Å; L839-A870 HydrophobicContact CD1-CB 4.05Å; L839-V871 HydrophobicContact CD1-CG2 3.83Å; L839-A874 HydrophobicContact CB-CB 3.86Å
840	E	94	Very high	92.9	Very high	12 Å²	12	28.1 Å²	28.1	6%	0.056	15%	0.146	C	C	.	.	H	α-helix	trans	-54.7	-40.7	-177.4	45.9	-92.6	-152.4	0	0	113.5	P838 L842 V843 L844 A874 L877 L878 R905	P838-E840 WeakPolarHBondContact CB-OE1 3.47Å; P838-E840 WeakPolarHBondContact CB-OE2 3.45Å; E840-L842 VanDerWaalsContact C-N 3.34Å; E840-L842 PolarHBondContact O-N 3.38Å; E840-V843 PolarHBondContact O-N 3.43Å; E840-L844 WeakPolarHBondContact O-CB 3.08Å; E840-L844 PolarHBondContact O-N 3.46Å; E840-A874 HydrophobicContact CB-CB 4.36Å; E840-L877 HydrophobicContact CB-CD2 4.21Å; E840-L877 HydrophobicContact CG-CD2 4.09Å; E840-L878 HydrophobicContact CB-CD2 4.2Å; E840-L878 HydrophobicContact CB-CG 4.2Å; E840-R905 IonicContact OE1-NH2 3.68Å
841	N	92.9	Very high	93.1	Very high	64 Å²	64	28.9 Å²	28.9	34%	0.342	16%	0.155	S	C	.	.	H	α-helix	trans	-63.4	-40.4	173.7	-80.7	-58.1	0	0	0	112.1	L839 L844 Q845 P904	L839-N841 VanDerWaalsContact C-N 3.3Å; L839-N841 PolarHBondContact O-N 3.34Å; N841-L844 PolarHBondContact O-N 2.78Å; N841-Q845 VanDerWaalsContact O-CG 3.31Å; N841-Q845 WeakPolarHBondContact O-CG 3.47Å; N841-Q845 PolarHBondContact O-N 3.35Å; N841-P904 WeakPolarHBondContact OD1-CD 3.5Å
842	L	94	Very high	93.1	Very high	8 Å²	8	30.7 Å²	30.7	4%	0.042	16%	0.159	C	C	.	.	H	α-helix	trans	-70	-40.3	179.6	-100.7	67.1	0	0	0	111.9	V589 F593 I834 L839 E840 L844 Q845 A846 L859	V589-L842 HydrophobicContact CG1-CD1 4.42Å; V589-L842 HydrophobicContact CG2-CD1 3.51Å; V589-L842 HydrophobicContact CG2-CD2 3.35Å; V589-L842 HydrophobicContact CG2-CG 4.04Å; F593-L842 HydrophobicContact CD2-CD2 4.37Å; F593-L842 HydrophobicContact CD2-CG 3.98Å; F593-L842 WeakPolarHBondContact CE2-O 3.27Å; I834-L842 HydrophobicContact CD1-CD2 3.87Å; I834-L842 HydrophobicContact CG1-CD2 3.89Å; L839-L842 HydrophobicContact CD2-CD2 4.09Å; L839-L842 CarbonylContact O-C 3.4Å; L839-L842 WeakPolarHBondContact O-CA 3.32Å; L839-L842 WeakPolarHBondContact O-CB 3.31Å; L839-L842 PolarHBondContact O-N 3.32Å; E840-L842 VanDerWaalsContact C-N 3.34Å; E840-L842 PolarHBondContact O-N 3.38Å; L842-L844 VanDerWaalsContact C-N 3.35Å; L842-Q845 PolarHBondContact O-N 2.86Å; L842-A846 WeakPolarHBondContact O-CB 3.42Å; L842-A846 PolarHBondContact O-N 2.71Å; L842-L859 HydrophobicContact CD2-CD2 4.26Å
843	V	96.6	Very high	93.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61.4	-46.6	174.7	173.5	0	0	0	0	109.9	L839 E840 Q845 A846 K847 A855 L859 V871 A874 V875 L878 L884	L839-V843 WeakPolarHBondContact O-CG2 3.38Å; L839-V843 PolarHBondContact O-N 3.29Å; E840-V843 PolarHBondContact O-N 3.43Å; V843-Q845 PolarHBondContact O-N 2.52Å; V843-A846 WeakPolarHBondContact O-CB 3.44Å; V843-A846 PolarHBondContact O-N 3.13Å; V843-K847 WeakPolarHBondContact O-CG 3.32Å; V843-K847 PolarHBondContact O-N 3.25Å; V843-A855 HydrophobicContact CB-CB 4.45Å; V843-A855 HydrophobicContact CG1-CB 3.75Å; V843-A855 HydrophobicContact CG2-CB 4.07Å; V843-L859 HydrophobicContact CG2-CD1 4.15Å; V843-V871 HydrophobicContact CG2-CG1 4.36Å; V843-A874 HydrophobicContact CG2-CB 3.86Å; V843-V875 HydrophobicContact CG1-CG2 3.86Å; V843-V875 HydrophobicContact CG2-CG2 4.42Å; V843-L878 HydrophobicContact CB-CD1 3.76Å; V843-L878 HydrophobicContact CG1-CD1 3.51Å; V843-L884 HydrophobicContact CG1-CD1 4.03Å
844	L	95.6	Very high	93.4	Very high	8 Å²	8	32.4 Å²	32.4	4%	0.042	17%	0.168	C	C	.	.	H	α-helix	trans	-58.7	-47.3	175.1	177.9	55.6	0	0	0	111.5	E840 N841 L842 A846 K847 I848 L878 V883 L890 P904	E840-L844 WeakPolarHBondContact O-CB 3.08Å; E840-L844 PolarHBondContact O-N 3.46Å; N841-L844 PolarHBondContact O-N 2.78Å; L842-L844 VanDerWaalsContact C-N 3.35Å; L844-A846 VanDerWaalsContact C-N 3.33Å; L844-A846 PolarHBondContact O-N 3.06Å; L844-K847 PolarHBondContact O-N 2.93Å; L844-I848 HydrophobicContact CD1-CD1 4.17Å; L844-I848 HydrophobicContact CD1-CG1 4.36Å; L844-I848 HydrophobicContact CG-CD1 4.05Å; L844-I848 VanDerWaalsContact O-CG1 3.31Å; L844-I848 WeakPolarHBondContact O-CG1 3.41Å; L844-I848 PolarHBondContact O-N 3.36Å; L844-L878 HydrophobicContact CB-CD1 4.34Å; L844-V883 HydrophobicContact CD1-CG1 3.84Å; L844-L890 HydrophobicContact CD1-CD2 3.58Å; L844-P904 HydrophobicContact CD2-CB 4.44Å; L844-P904 HydrophobicContact CD2-CG 4.02Å
845	Q	93.7	Very high	93.5	Very high	47 Å²	47	32.3 Å²	32.3	22%	0.22	17%	0.168	C	C	.	.	H	α-helix	trans	-60.6	-40.6	175.7	-69.8	-60	-47	0	0	112.2	F593 N841 L842 V843 K847 I848 H849	F593-Q845 HydrophobicContact CE1-CB 4.02Å; F593-Q845 HydrophobicContact CE2-CB 3.91Å; F593-Q845 HydrophobicContact CZ-CB 3.53Å; N841-Q845 VanDerWaalsContact O-CG 3.31Å; N841-Q845 WeakPolarHBondContact O-CG 3.47Å; N841-Q845 PolarHBondContact O-N 3.35Å; L842-Q845 PolarHBondContact O-N 2.86Å; V843-Q845 PolarHBondContact O-N 2.52Å; Q845-K847 VanDerWaalsContact C-N 3.29Å; Q845-K847 PolarHBondContact O-N 3.21Å; Q845-I848 PolarHBondContact O-N 2.86Å; Q845-H849 PolarHBondContact O-CD2 3.32Å; Q845-H849 VanDerWaalsContact O-CD2 3.26Å; Q845-H849 PolarHBondContact O-N 3.24Å
846	A	95.5	Very high	93.6	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.008	16%	0.16	C	C	.	.	H	α-helix	trans	-58.7	-43.6	176.3	0	0	0	0	0	110.8	F593 L842 V843 L844 H849 M850 F858	F593-A846 HydrophobicContact CE2-CB 4.04Å; F593-A846 HydrophobicContact CZ-CB 4.42Å; L842-A846 WeakPolarHBondContact O-CB 3.42Å; L842-A846 PolarHBondContact O-N 2.71Å; V843-A846 WeakPolarHBondContact O-CB 3.44Å; V843-A846 PolarHBondContact O-N 3.13Å; L844-A846 VanDerWaalsContact C-N 3.33Å; L844-A846 PolarHBondContact O-N 3.06Å; A846-H849 PolarHBondContact O-N 2.9Å; A846-M850 CarbonylContact O-C 3.43Å; A846-M850 WeakPolarHBondContact O-CA 3.21Å; A846-M850 PolarHBondContact O-N 3.42Å; A846-F858 HydrophobicContact CB-CB 4.2Å; A846-F858 HydrophobicContact CB-CD1 3.52Å; A846-F858 HydrophobicContact CB-CE1 4.03Å; A846-F858 HydrophobicContact CB-CG 3.82Å
847	K	95.2	Very high	93.9	Very high	5 Å²	5	34.2 Å²	34.2	2%	0.022	18%	0.179	C	C	.	.	H	α-helix	trans	-70.5	-28.4	178.4	-64.5	-48.7	-44.9	-157.5	0	113.9	V843 L844 Q845 P851 K853 L884 E888 L890	V843-K847 WeakPolarHBondContact O-CG 3.32Å; V843-K847 PolarHBondContact O-N 3.25Å; L844-K847 PolarHBondContact O-N 2.93Å; Q845-K847 VanDerWaalsContact C-N 3.29Å; Q845-K847 PolarHBondContact O-N 3.21Å; K847-P851 WeakPolarHBondContact CE-O 3.48Å; K847-P851 PolarHBondContact NZ-O 2.96Å; K847-P851 VanDerWaalsContact O-CA 3.31Å; K847-P851 WeakPolarHBondContact O-CA 3.45Å; K847-P851 WeakPolarHBondContact O-CB 3.33Å; K847-K853 PolarHBondContact NZ-O 3.07Å; K847-L884 HydrophobicContact CB-CD2 4.36Å; K847-L884 HydrophobicContact CG-CD1 4.34Å; K847-L884 HydrophobicContact CG-CD2 3.96Å; K847-E888 HydrophobicContact CD-CB 4.41Å; K847-E888 WeakPolarHBondContact CD-O 3.24Å; K847-E888 WeakPolarHBondContact CE-O 3.45Å; K847-E888 PolarHBondContact NZ-O 2.81Å; K847-L890 HydrophobicContact CB-CD2 4.38Å; K847-L890 HydrophobicContact CB-CG 4.27Å
848	I	91.9	Very high	94.2	Very high	38 Å²	38	33.5 Å²	33.5	20%	0.195	17%	0.174	C	C	.	.	H	α-helix	trans	-69.9	-43.8	172.4	-66.7	165.9	0	0	0	110.7	Q568 L844 Q845 L890 A898	Q568-I848 HydrophobicContact CG-CG2 4.09Å; L844-I848 HydrophobicContact CD1-CD1 4.17Å; L844-I848 HydrophobicContact CD1-CG1 4.36Å; L844-I848 HydrophobicContact CG-CD1 4.05Å; L844-I848 VanDerWaalsContact O-CG1 3.31Å; L844-I848 WeakPolarHBondContact O-CG1 3.41Å; L844-I848 PolarHBondContact O-N 3.36Å; Q845-I848 PolarHBondContact O-N 2.86Å; I848-L890 HydrophobicContact CG1-CD1 4.25Å; I848-A898 HydrophobicContact CD1-CB 3.57Å; I848-A898 HydrophobicContact CG1-CB 3.7Å
849	H	92.1	Very high	94.5	Very high	28 Å²	28	32.1 Å²	32.1	13%	0.13	17%	0.165	C	C	.	.	H	α-helix	trans	-85	-31.6	-173.9	-79.6	-77.4	0	0	0	114.7	L564 Q568 F593 L597 Q845 A846	L564-H849 PolarHBondContact O-CE1 3.04Å; L564-H849 PolarHBondContact O-NE2 2.74Å; Q568-H849 WeakPolarHBondContact CG-CE1 3.05Å; Q568-H849 PolarHBondContact NE2-NE2 3.13Å; F593-H849 AromaticContact CE1-CD2 3.96Å; L597-H849 HydrophobicContact CD1-CB 4.34Å; L597-H849 HydrophobicContact CD2-CB 3.89Å; Q845-H849 PolarHBondContact O-CD2 3.32Å; Q845-H849 VanDerWaalsContact O-CD2 3.26Å; Q845-H849 PolarHBondContact O-N 3.24Å; A846-H849 PolarHBondContact O-N 2.9Å
850	M	92.8	Very high	94.7	Very high	42 Å²	42	34.9 Å²	34.9	21%	0.207	18%	0.184	C	C	.	.			trans	-140.6	67.4	-176.2	-65.6	-76.1	167.9	0	0	109.4	L597 A846 E852 K853 F858	L597-M850 HydrophobicContact CD2-CE 4.21Å; A846-M850 CarbonylContact O-C 3.43Å; A846-M850 WeakPolarHBondContact O-CA 3.21Å; A846-M850 PolarHBondContact O-N 3.42Å; M850-E852 WeakPolarHBondContact CA-OE2 3.47Å; M850-E852 PolarHBondContact O-N 3.12Å; M850-E852 VanDerWaalsContact O-N 3.08Å; M850-K853 PolarHBondContact O-N 3.05Å; M850-K853 VanDerWaalsContact O-N 3.14Å; M850-K853 PolarHBondContact SD-NZ 3.5Å; M850-K853 VanDerWaalsContact SD-NZ 3.38Å; M850-F858 HydrophobicContact CB-CD2 3.94Å; M850-F858 HydrophobicContact CB-CE2 4.22Å; M850-F858 HydrophobicContact CG-CD2 3.79Å; M850-F858 HydrophobicContact CG-CE2 3.64Å
851	P	91.7	Very high	94.8	Very high	64 Å²	64	38.9 Å²	38.9	42%	0.416	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-23.5	-174.2	24.3	-34.6	0	0	0	113.6	K847	K847-P851 WeakPolarHBondContact CE-O 3.48Å; K847-P851 PolarHBondContact NZ-O 2.96Å; K847-P851 VanDerWaalsContact O-CA 3.31Å; K847-P851 WeakPolarHBondContact O-CA 3.45Å; K847-P851 WeakPolarHBondContact O-CB 3.33Å
852	E	91.6	Very high	94.9	Very high	110 Å²	110	36.2 Å²	36.2	51%	0.514	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-18	-178.8	78.9	-67.5	166.1	0	0	114.5	M850	M850-E852 WeakPolarHBondContact CA-OE2 3.47Å; M850-E852 PolarHBondContact O-N 3.12Å; M850-E852 VanDerWaalsContact O-N 3.08Å
853	K	93.8	Very high	94.9	Very high	49 Å²	49	36.8 Å²	36.8	21%	0.213	19%	0.192	C	C	.	.	S	Bend	trans	-97.6	150.5	179.8	-62.7	-169.8	-175.4	74	0	111.2	K847 M850 E857	K847-K853 PolarHBondContact NZ-O 3.07Å; M850-K853 PolarHBondContact O-N 3.05Å; M850-K853 VanDerWaalsContact O-N 3.14Å; M850-K853 PolarHBondContact SD-NZ 3.5Å; M850-K853 VanDerWaalsContact SD-NZ 3.38Å; K853-E857 HydrophobicContact CB-CB 4.41Å
854	T	96.5	Very high	94.8	Very high	46 Å²	46	38.4 Å²	38.4	28%	0.282	20%	0.2	S	C	.	.			trans	-70.9	157.9	166.6	67.8	0	0	0	0	110.6	V856 E857 F858 E888	T854-V856 VanDerWaalsContact C-N 3.25Å; T854-V856 PolarHBondContact O-N 2.76Å; T854-E857 PolarHBondContact N-OE2 2.93Å; T854-E857 PolarHBondContact O-N 2.87Å; T854-E857 WeakPolarHBondContact OG1-CB 3.39Å; T854-E857 VanDerWaalsContact OG1-CD 3.32Å; T854-E857 WeakPolarHBondContact OG1-CG 3.45Å; T854-E857 PolarHBondContact OG1-N 2.84Å; T854-E857 VanDerWaalsContact OG1-N 3.14Å; T854-F858 PolarHBondContact O-N 3.21Å; T854-E888 WeakPolarHBondContact CA-OE2 3.4Å; T854-E888 WeakPolarHBondContact CB-OE2 3.18Å
855	A	96.4	Very high	94.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-56.9	-41.9	176.2	0	0	0	0	0	111.5	V843 F858 L859 V871 V875 E888	V843-A855 HydrophobicContact CB-CB 4.45Å; V843-A855 HydrophobicContact CG1-CB 3.75Å; V843-A855 HydrophobicContact CG2-CB 4.07Å; A855-F858 PolarHBondContact O-N 2.89Å; A855-L859 WeakPolarHBondContact O-CB 3.21Å; A855-L859 WeakPolarHBondContact O-CG 3.44Å; A855-L859 PolarHBondContact O-N 3.28Å; A855-V871 HydrophobicContact CB-CG1 3.78Å; A855-V875 HydrophobicContact CB-CG2 3.6Å; A855-E888 PolarHBondContact N-OE2 3.5Å
856	V	97	Very high	94.8	Very high	39 Å²	39	38.9 Å²	38.9	24%	0.236	21%	0.21	C	C	.	.	H	α-helix	trans	-65.5	-46.3	177.6	176.8	0	0	0	0	111.2	T854 F858 S860 I868 V871	T854-V856 VanDerWaalsContact C-N 3.25Å; T854-V856 PolarHBondContact O-N 2.76Å; V856-F858 VanDerWaalsContact C-N 3.27Å; V856-F858 PolarHBondContact O-N 2.77Å; V856-S860 WeakPolarHBondContact O-CB 3.5Å; V856-S860 PolarHBondContact O-N 3.35Å; V856-S860 PolarHBondContact O-OG 2.83Å; V856-I868 HydrophobicContact CG1-CG2 4.35Å; V856-I868 HydrophobicContact CG2-CG2 4.27Å; V856-V871 HydrophobicContact CG2-CB 4.23Å; V856-V871 HydrophobicContact CG2-CG1 3.74Å
857	E	96.5	Very high	94.6	Very high	103 Å²	103	43.3 Å²	43.3	48%	0.481	23%	0.233	S	C	.	.	H	α-helix	trans	-63.3	-32.6	177.3	-76.5	169.7	-177.6	0	0	113.2	K853 T854 S860 K861	K853-E857 HydrophobicContact CB-CB 4.41Å; T854-E857 PolarHBondContact N-OE2 2.93Å; T854-E857 PolarHBondContact O-N 2.87Å; T854-E857 WeakPolarHBondContact OG1-CB 3.39Å; T854-E857 VanDerWaalsContact OG1-CD 3.32Å; T854-E857 WeakPolarHBondContact OG1-CG 3.45Å; T854-E857 PolarHBondContact OG1-N 2.84Å; T854-E857 VanDerWaalsContact OG1-N 3.14Å; E857-S860 PolarHBondContact O-OG 3.36Å; E857-K861 WeakPolarHBondContact O-CE 3.42Å
858	F	96.6	Very high	94.5	Very high	6 Å²	6	47.6 Å²	47.6	3%	0.026	26%	0.255	C	S	.	.	H	α-helix	trans	-75.6	-54.7	176.3	-176.3	-87.4	0	0	0	111.2	F593 I596 L597 A846 M850 T854 A855 V856 S860 K861	F593-F858 AromaticContact CD2-CE1 3.72Å; F593-F858 HydrophobicContact CD2-CE1 3.72Å; F593-F858 HydrophobicContact CD2-CZ 4.44Å; F593-F858 HydrophobicContact CE1-CZ 4.36Å; F593-F858 HydrophobicContact CE2-CD1 4.1Å; F593-F858 AromaticContact CE2-CE1 3.27Å; F593-F858 HydrophobicContact CE2-CE1 3.27Å; F593-F858 AromaticContact CE2-CZ 3.88Å; F593-F858 HydrophobicContact CE2-CZ 3.88Å; F593-F858 HydrophobicContact CG-CE1 4.5Å; F593-F858 AromaticContact CZ-CE1 3.7Å; F593-F858 HydrophobicContact CZ-CE1 3.7Å; F593-F858 AromaticContact CZ-CZ 3.8Å; F593-F858 HydrophobicContact CZ-CZ 3.8Å; I596-F858 HydrophobicContact CB-CE1 4.22Å; I596-F858 HydrophobicContact CB-CZ 3.99Å; I596-F858 HydrophobicContact CD1-CD1 4.27Å; I596-F858 HydrophobicContact CD1-CE1 3.78Å; I596-F858 HydrophobicContact CD1-CZ 4.42Å; I596-F858 HydrophobicContact CG2-CD1 4.42Å; I596-F858 HydrophobicContact CG2-CD2 4.31Å; I596-F858 HydrophobicContact CG2-CE1 3.88Å; I596-F858 HydrophobicContact CG2-CE2 3.77Å; I596-F858 HydrophobicContact CG2-CZ 3.53Å; L597-F858 HydrophobicContact CD2-CE2 3.69Å; L597-F858 HydrophobicContact CD2-CZ 3.63Å; L597-F858 HydrophobicContact CG-CZ 4.17Å; A846-F858 HydrophobicContact CB-CB 4.2Å; A846-F858 HydrophobicContact CB-CD1 3.52Å; A846-F858 HydrophobicContact CB-CE1 4.03Å; A846-F858 HydrophobicContact CB-CG 3.82Å; M850-F858 HydrophobicContact CB-CD2 3.94Å; M850-F858 HydrophobicContact CB-CE2 4.22Å; M850-F858 HydrophobicContact CG-CD2 3.79Å; M850-F858 HydrophobicContact CG-CE2 3.64Å; T854-F858 PolarHBondContact O-N 3.21Å; A855-F858 PolarHBondContact O-N 2.89Å; V856-F858 VanDerWaalsContact C-N 3.27Å; V856-F858 PolarHBondContact O-N 2.77Å; F858-S860 VanDerWaalsContact C-N 3.33Å; F858-S860 PolarHBondContact O-N 3.37Å; F858-K861 WeakPolarHBondContact O-CB 3.31Å; F858-K861 PolarHBondContact O-N 2.9Å; F858-K861 VanDerWaalsContact O-N 3.15Å
859	L	97.1	Very high	94.6	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-72.5	-23.7	-173.8	-67.4	174.8	0	0	0	113.3	F593 I834 L842 V843 A855 K861 A862 P866 V871	F593-L859 HydrophobicContact CD2-CD2 4.39Å; I834-L859 HydrophobicContact CD1-CD2 4.47Å; L842-L859 HydrophobicContact CD2-CD2 4.26Å; V843-L859 HydrophobicContact CG2-CD1 4.15Å; A855-L859 WeakPolarHBondContact O-CB 3.21Å; A855-L859 WeakPolarHBondContact O-CG 3.44Å; A855-L859 PolarHBondContact O-N 3.28Å; L859-K861 PolarHBondContact O-N 3.11Å; L859-K861 VanDerWaalsContact O-N 3.11Å; L859-A862 VanDerWaalsContact O-CB 3.23Å; L859-A862 WeakPolarHBondContact O-CB 3.26Å; L859-A862 PolarHBondContact O-N 3.34Å; L859-P866 HydrophobicContact CB-CG 3.94Å; L859-P866 HydrophobicContact CD1-CG 4.48Å; L859-V871 HydrophobicContact CB-CG2 4.46Å; L859-V871 HydrophobicContact CD1-CG1 3.95Å; L859-V871 HydrophobicContact CD1-CG2 3.86Å
860	S	96.6	Very high	94.6	Very high	61 Å²	61	52.5 Å²	52.5	43%	0.427	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-16	170.8	57	0	0	0	0	113.7	V856 E857 F858 A862	V856-S860 WeakPolarHBondContact O-CB 3.5Å; V856-S860 PolarHBondContact O-N 3.35Å; V856-S860 PolarHBondContact O-OG 2.83Å; E857-S860 PolarHBondContact O-OG 3.36Å; F858-S860 VanDerWaalsContact C-N 3.33Å; F858-S860 PolarHBondContact O-N 3.37Å; S860-A862 VanDerWaalsContact C-N 3.34Å
861	K	96.1	Very high	94.8	Very high	97 Å²	97	50.7 Å²	50.7	42%	0.422	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-1.6	174.6	-61.6	172.7	-176.7	164.6	0	113.1	I596 Y625 E857 F858 L859	I596-K861 HydrophobicContact CG2-CB 3.99Å; Y625-K861 WeakPolarHBondContact CE2-O 3.08Å; Y625-K861 PolarHBondContact OH-O 2.92Å; E857-K861 WeakPolarHBondContact O-CE 3.42Å; F858-K861 WeakPolarHBondContact O-CB 3.31Å; F858-K861 PolarHBondContact O-N 2.9Å; F858-K861 VanDerWaalsContact O-N 3.15Å; L859-K861 PolarHBondContact O-N 3.11Å; L859-K861 VanDerWaalsContact O-N 3.11Å
862	A	95.9	Very high	94.9	Very high	7 Å²	7	50.8 Å²	50.8	6%	0.058	27%	0.267	C	S	.	.	S	Bend	trans	-58.4	159	173	0	0	0	0	0	111.3	I596 I834 L859 S860 D864	I596-A862 HydrophobicContact CD1-CB 3.9Å; I596-A862 HydrophobicContact CG1-CB 4.37Å; I834-A862 HydrophobicContact CD1-CB 3.97Å; L859-A862 VanDerWaalsContact O-CB 3.23Å; L859-A862 WeakPolarHBondContact O-CB 3.26Å; L859-A862 PolarHBondContact O-N 3.34Å; S860-A862 VanDerWaalsContact C-N 3.34Å; A862-D864 WeakPolarHBondContact CB-O 3.14Å; A862-D864 PolarHBondContact O-N 3.42Å
863	V	93.8	Very high	95	Very high	21 Å²	21	48.5 Å²	48.5	13%	0.127	26%	0.256	C	S	.	.	S	Bend	trans	-56.5	-42.6	174.8	178.1	0	0	0	0	110.7	L595 R621 F622 Y625	L595-V863 HydrophobicContact CD1-CG2 4.06Å; R621-V863 HydrophobicContact CG-CG1 3.89Å; F622-V863 HydrophobicContact CD1-CG2 4.36Å; F622-V863 HydrophobicContact CE1-CG1 4.44Å; F622-V863 HydrophobicContact CE1-CG2 4.19Å; Y625-V863 HydrophobicContact CD1-CG2 3.84Å; Y625-V863 HydrophobicContact CD2-CB 4.49Å; Y625-V863 HydrophobicContact CD2-CG2 4.1Å; Y625-V863 HydrophobicContact CE1-CG2 3.95Å; Y625-V863 HydrophobicContact CE2-CG2 4.21Å; Y625-V863 HydrophobicContact CG-CG2 3.92Å
864	D	94.1	Very high	95	Very high	33 Å²	33	46.2 Å²	46.2	18%	0.176	25%	0.247	C	C	.	.	S	Bend	trans	-121.6	110.3	167.6	-71.5	-80.5	0	0	0	107.6	R587 R621 P832 L835 A862	R587-D864 IonicContact CZ-OD2 3.87Å; R587-D864 VanDerWaalsContact CZ-OD2 3.24Å; R587-D864 IonicContact NH1-OD2 3.71Å; R587-D864 PolarHBondContact NH1-OD2 3.16Å; R587-D864 IonicContact NH2-OD2 3.65Å; R587-D864 PolarHBondContact NH2-OD2 3.09Å; R621-D864 IonicContact CZ-OD1 3.63Å; R621-D864 IonicContact CZ-OD2 2.69Å; R621-D864 IonicContact NH1-OD1 2.63Å; R621-D864 PolarHBondContact NH1-OD1 2.82Å; R621-D864 IonicContact NH1-OD2 3.81Å; R621-D864 PolarHBondContact NH1-OD2 3.47Å; P832-D864 HydrophobicContact CG-CB 4.33Å; L835-D864 HydrophobicContact CD1-CB 4.18Å; L835-D864 HydrophobicContact CD2-CB 4.38Å; A862-D864 WeakPolarHBondContact CB-O 3.14Å; A862-D864 PolarHBondContact O-N 3.42Å
865	S	94.1	Very high	95.1	Very high	60 Å²	60	44.3 Å²	44.3	42%	0.42	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-63.5	130.3	179.6	178.3	0	0	0	0	110.2	L835	L835-S865 WeakPolarHBondContact CD2-O 3.08Å
866	P	94.4	Very high	95	Very high	6 Å²	6	48 Å²	48	4%	0.039	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-63.2	161.3	170.3	27.4	-32.9	0	0	0	111.4	I834 L835 L839 L859 I868 V871	I834-P866 HydrophobicContact CG1-CG 4.47Å; L835-P866 HydrophobicContact CD2-CB 4.37Å; L839-P866 HydrophobicContact CD1-CB 3.73Å; L839-P866 HydrophobicContact CD1-CG 4.12Å; L859-P866 HydrophobicContact CB-CG 3.94Å; L859-P866 HydrophobicContact CD1-CG 4.48Å; P866-I868 PolarHBondContact O-N 3.34Å; P866-V871 HydrophobicContact CB-CG2 4.18Å; P866-V871 HydrophobicContact CG-CG2 3.69Å
867	N	91.7	Very high	94.7	Very high	94 Å²	94	47.5 Å²	47.5	50%	0.503	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-60.6	127.1	171.5	-176.6	-22.8	0	0	0	109.2	K869 A870 V871	N867-K869 PolarHBondContact O-N 3.29Å; N867-K869 WeakPolarHBondContact OD1-CB 3.47Å; N867-K869 PolarHBondContact OD1-N 3.04Å; N867-A870 HydrophobicContact CB-CB 4.31Å; N867-A870 WeakPolarHBondContact O-CA 3.36Å; N867-A870 WeakPolarHBondContact O-CB 3.39Å; N867-A870 PolarHBondContact O-N 3.39Å; N867-V871 PolarHBondContact O-N 3.45Å
868	I	94.7	Very high	94.7	Very high	94 Å²	94	42.6 Å²	42.6	48%	0.482	23%	0.227	S	C	.	.	H	α-helix	trans	-53	-40.9	179.7	-60.5	172.2	0	0	0	110.8	V856 P866 A870 V871 D872	V856-I868 HydrophobicContact CG1-CG2 4.35Å; V856-I868 HydrophobicContact CG2-CG2 4.27Å; P866-I868 PolarHBondContact O-N 3.34Å; I868-A870 VanDerWaalsContact C-N 3.27Å; I868-A870 PolarHBondContact O-N 2.94Å; I868-V871 WeakPolarHBondContact O-CB 3.26Å; I868-V871 PolarHBondContact O-N 3.34Å; I868-D872 VanDerWaalsContact O-CG 3.3Å; I868-D872 PolarHBondContact O-N 3.4Å
869	K	92.2	Very high	94.7	Very high	150 Å²	150	45.2 Å²	45.2	65%	0.652	24%	0.239	S	C	*	.	H	α-helix	trans	-60	-36	177	-64.2	-174.4	178.6	-176.5	0	112.9	N867 V871 E873	N867-K869 PolarHBondContact O-N 3.29Å; N867-K869 WeakPolarHBondContact OD1-CB 3.47Å; N867-K869 PolarHBondContact OD1-N 3.04Å; K869-V871 VanDerWaalsContact C-N 3.35Å; K869-E873 WeakPolarHBondContact O-CB 3.44Å; K869-E873 VanDerWaalsContact O-CG 3.24Å; K869-E873 WeakPolarHBondContact O-CG 3.39Å; K869-E873 PolarHBondContact O-N 2.9Å
870	A	92.8	Very high	94.4	Very high	20 Å²	20	48.3 Å²	48.3	17%	0.165	25%	0.254	C	S	.	.	H	α-helix	trans	-70.3	-35.2	177.4	0	0	0	0	0	111.6	L782 L839 N867 I868 A874	L782-A870 HydrophobicContact CD1-CB 4.38Å; L782-A870 HydrophobicContact CD2-CB 3.84Å; L839-A870 HydrophobicContact CD1-CB 4.05Å; N867-A870 HydrophobicContact CB-CB 4.31Å; N867-A870 WeakPolarHBondContact O-CA 3.36Å; N867-A870 WeakPolarHBondContact O-CB 3.39Å; N867-A870 PolarHBondContact O-N 3.39Å; I868-A870 VanDerWaalsContact C-N 3.27Å; I868-A870 PolarHBondContact O-N 2.94Å; A870-A874 PolarHBondContact O-N 3.26Å
871	V	96.3	Very high	94.2	Very high	3 Å²	3	45.5 Å²	45.5	2%	0.018	23%	0.234	C	C	.	.	H	α-helix	trans	-67.3	-47.5	173.8	-178.3	0	0	0	0	110.3	L839 V843 A855 V856 L859 P866 N867 I868 K869 E873 A874 V875	L839-V871 HydrophobicContact CD1-CG2 3.83Å; V843-V871 HydrophobicContact CG2-CG1 4.36Å; A855-V871 HydrophobicContact CB-CG1 3.78Å; V856-V871 HydrophobicContact CG2-CB 4.23Å; V856-V871 HydrophobicContact CG2-CG1 3.74Å; L859-V871 HydrophobicContact CB-CG2 4.46Å; L859-V871 HydrophobicContact CD1-CG1 3.95Å; L859-V871 HydrophobicContact CD1-CG2 3.86Å; P866-V871 HydrophobicContact CB-CG2 4.18Å; P866-V871 HydrophobicContact CG-CG2 3.69Å; N867-V871 PolarHBondContact O-N 3.45Å; I868-V871 WeakPolarHBondContact O-CB 3.26Å; I868-V871 PolarHBondContact O-N 3.34Å; K869-V871 VanDerWaalsContact C-N 3.35Å; V871-E873 VanDerWaalsContact C-N 3.33Å; V871-E873 PolarHBondContact O-N 2.81Å; V871-A874 WeakPolarHBondContact O-CB 3.35Å; V871-A874 PolarHBondContact O-N 3.2Å; V871-A874 VanDerWaalsContact O-N 3.14Å; V871-V875 HydrophobicContact CG1-CG2 4.5Å; V871-V875 WeakPolarHBondContact O-CG2 3.4Å; V871-V875 PolarHBondContact O-N 2.77Å
872	D	95.5	Very high	94	Very high	66 Å²	66	42.1 Å²	42.1	35%	0.353	23%	0.226	S	C	.	.	H	α-helix	trans	-59.7	-43	178.9	-66.3	-21.1	0	0	0	111.4	I868 A874 V875 I876	I868-D872 VanDerWaalsContact O-CG 3.3Å; I868-D872 PolarHBondContact O-N 3.4Å; D872-A874 VanDerWaalsContact C-N 3.33Å; D872-A874 PolarHBondContact O-N 2.9Å; D872-V875 PolarHBondContact O-N 3.33Å; D872-I876 WeakPolarHBondContact O-CB 3.33Å; D872-I876 VanDerWaalsContact O-CG1 3.23Å; D872-I876 WeakPolarHBondContact O-CG1 3.49Å; D872-I876 PolarHBondContact O-N 3.36Å
873	E	92.2	Very high	94	Very high	62 Å²	62	41.8 Å²	41.8	29%	0.29	22%	0.224	S	C	.	.	H	α-helix	trans	-62.7	-38.4	176	-74.1	-65.5	152.6	0	0	112.7	K785 K869 V871 I876 L877	K785-E873 VanDerWaalsContact CE-OE2 3.28Å; K785-E873 WeakPolarHBondContact CE-OE2 3.34Å; K785-E873 IonicContact NZ-OE2 3.58Å; K785-E873 PolarHBondContact NZ-OE2 2.59Å; K869-E873 WeakPolarHBondContact O-CB 3.44Å; K869-E873 VanDerWaalsContact O-CG 3.24Å; K869-E873 WeakPolarHBondContact O-CG 3.39Å; K869-E873 PolarHBondContact O-N 2.9Å; V871-E873 VanDerWaalsContact C-N 3.33Å; V871-E873 PolarHBondContact O-N 2.81Å; E873-I876 PolarHBondContact O-N 2.77Å; E873-L877 WeakPolarHBondContact O-CB 3.18Å; E873-L877 PolarHBondContact O-N 2.82Å
874	A	94.7	Very high	94.1	Very high	2 Å²	2	41 Å²	41	2%	0.017	22%	0.219	C	C	.	.	H	α-helix	trans	-66.7	-39.4	174.3	0	0	0	0	0	112	L839 E840 V843 A870 V871 D872 L877 L878	L839-A874 HydrophobicContact CB-CB 3.86Å; E840-A874 HydrophobicContact CB-CB 4.36Å; V843-A874 HydrophobicContact CG2-CB 3.86Å; A870-A874 PolarHBondContact O-N 3.26Å; V871-A874 WeakPolarHBondContact O-CB 3.35Å; V871-A874 PolarHBondContact O-N 3.2Å; V871-A874 VanDerWaalsContact O-N 3.14Å; D872-A874 VanDerWaalsContact C-N 3.33Å; D872-A874 PolarHBondContact O-N 2.9Å; A874-L877 PolarHBondContact O-N 3.36Å; A874-L878 WeakPolarHBondContact O-CG 3.39Å; A874-L878 PolarHBondContact O-N 3.17Å
875	V	97.5	Very high	94.2	Very high	6 Å²	6	41.8 Å²	41.8	4%	0.036	22%	0.223	C	C	.	.	H	α-helix	trans	-63	-48.5	173.3	171.4	0	0	0	0	110.5	V843 A855 V871 D872 L877 L878 Q879 E888	V843-V875 HydrophobicContact CG1-CG2 3.86Å; V843-V875 HydrophobicContact CG2-CG2 4.42Å; A855-V875 HydrophobicContact CB-CG2 3.6Å; V871-V875 HydrophobicContact CG1-CG2 4.5Å; V871-V875 WeakPolarHBondContact O-CG2 3.4Å; V871-V875 PolarHBondContact O-N 2.77Å; D872-V875 PolarHBondContact O-N 3.33Å; V875-L877 VanDerWaalsContact C-N 3.3Å; V875-L877 PolarHBondContact O-N 2.63Å; V875-L878 PolarHBondContact O-N 3.24Å; V875-L878 VanDerWaalsContact O-N 3.16Å; V875-Q879 HydrophobicContact CG1-CG 4.36Å; V875-Q879 WeakPolarHBondContact O-CG 3.42Å; V875-Q879 PolarHBondContact O-N 3.38Å; V875-E888 HydrophobicContact CG1-CG 3.9Å
876	I	94.3	Very high	94.2	Very high	77 Å²	77	46.7 Å²	46.7	40%	0.395	24%	0.239	S	C	.	.	H	α-helix	trans	-57.7	-44.5	177.9	-70.9	164.5	0	0	0	110.4	D872 E873 Q879 E880	D872-I876 WeakPolarHBondContact O-CB 3.33Å; D872-I876 VanDerWaalsContact O-CG1 3.23Å; D872-I876 WeakPolarHBondContact O-CG1 3.49Å; D872-I876 PolarHBondContact O-N 3.36Å; E873-I876 PolarHBondContact O-N 2.77Å; I876-Q879 PolarHBondContact O-N 3.14Å; I876-E880 WeakPolarHBondContact O-CB 3.37Å; I876-E880 PolarHBondContact O-N 2.76Å
877	L	92.4	Very high	94.2	Very high	28 Å²	28	55.8 Å²	55.8	15%	0.147	27%	0.273	C	S	.	.	H	α-helix	trans	-60.9	-47.1	176.5	176.2	64.1	0	0	0	111.6	E840 E873 A874 V875 Q879 E880 I881	E840-L877 HydrophobicContact CB-CD2 4.21Å; E840-L877 HydrophobicContact CG-CD2 4.09Å; E873-L877 WeakPolarHBondContact O-CB 3.18Å; E873-L877 PolarHBondContact O-N 2.82Å; A874-L877 PolarHBondContact O-N 3.36Å; V875-L877 VanDerWaalsContact C-N 3.3Å; V875-L877 PolarHBondContact O-N 2.63Å; L877-Q879 VanDerWaalsContact C-N 3.26Å; L877-Q879 PolarHBondContact O-N 3.48Å; L877-E880 PolarHBondContact O-N 3.43Å; L877-I881 HydrophobicContact CD1-CG2 4.19Å; L877-I881 WeakPolarHBondContact O-CG1 3.42Å; L877-I881 PolarHBondContact O-N 3.21Å
878	L	96.2	Very high	94.4	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64.1	-31.8	178.5	-72.1	177.5	0	0	0	112.6	E840 V843 L844 A874 V875 I881 G882 V883 L884 P904	E840-L878 HydrophobicContact CB-CD2 4.2Å; E840-L878 HydrophobicContact CB-CG 4.2Å; V843-L878 HydrophobicContact CB-CD1 3.76Å; V843-L878 HydrophobicContact CG1-CD1 3.51Å; L844-L878 HydrophobicContact CB-CD1 4.34Å; A874-L878 WeakPolarHBondContact O-CG 3.39Å; A874-L878 PolarHBondContact O-N 3.17Å; V875-L878 PolarHBondContact O-N 3.24Å; V875-L878 VanDerWaalsContact O-N 3.16Å; L878-I881 HydrophobicContact CD2-CD1 4.15Å; L878-G882 PolarHBondContact O-N 2.93Å; L878-V883 HydrophobicContact CB-CB 4.29Å; L878-V883 HydrophobicContact CD2-CB 4.1Å; L878-V883 HydrophobicContact CD2-CG1 4.13Å; L878-V883 HydrophobicContact CD2-CG2 4.14Å; L878-V883 WeakPolarHBondContact O-CB 3.29Å; L878-V883 PolarHBondContact O-N 2.99Å; L878-L884 HydrophobicContact CB-CB 4.38Å; L878-L884 HydrophobicContact CB-CD1 3.81Å; L878-L884 HydrophobicContact CB-CG 3.91Å; L878-L884 HydrophobicContact CD1-CD1 3.76Å; L878-L884 HydrophobicContact CD1-CG 4.3Å; L878-L884 HydrophobicContact CG-CD1 4.49Å; L878-L884 PolarHBondContact O-N 3.19Å; L878-L884 VanDerWaalsContact O-N 3.16Å; L878-P904 HydrophobicContact CD2-CB 3.91Å; L878-P904 HydrophobicContact CD2-CG 3.87Å
879	Q	95.3	Very high	94.5	Very high	61 Å²	61	53.7 Å²	53.7	29%	0.285	25%	0.253	S	S	.	.	H	α-helix	trans	-70.8	-44.4	171.4	-71.2	172.4	-18.6	0	0	111.6	V875 I876 L877 I881 G882 L884 D885	V875-Q879 HydrophobicContact CG1-CG 4.36Å; V875-Q879 WeakPolarHBondContact O-CG 3.42Å; V875-Q879 PolarHBondContact O-N 3.38Å; I876-Q879 PolarHBondContact O-N 3.14Å; L877-Q879 VanDerWaalsContact C-N 3.26Å; L877-Q879 PolarHBondContact O-N 3.48Å; Q879-I881 VanDerWaalsContact C-N 3.29Å; Q879-I881 PolarHBondContact O-N 3.04Å; Q879-G882 PolarHBondContact O-N 3.46Å; Q879-L884 WeakPolarHBondContact CA-O 3.41Å; Q879-L884 HydrophobicContact CG-CB 3.96Å; Q879-D885 WeakPolarHBondContact CG-O 3.4Å; Q879-D885 PolarHBondContact NE2-O 2.81Å
880	E	90.7	Very high	94.6	Very high	67 Å²	67	48 Å²	48	31%	0.313	23%	0.23	S	C	.	.	H	α-helix	trans	-60.8	-36.9	178.5	-174.8	174.5	-158.7	0	0	111.8	I876 L877 G882 K1074	I876-E880 WeakPolarHBondContact O-CB 3.37Å; I876-E880 PolarHBondContact O-N 2.76Å; L877-E880 PolarHBondContact O-N 3.43Å; E880-G882 VanDerWaalsContact C-N 3.32Å; E880-K1074 IonicContact OE1-NZ 3.44Å; E880-K1074 PolarHBondContact OE1-NZ 2.75Å
881	I	92.9	Very high	94.7	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.01	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	1.8	176	71.7	178.3	0	0	0	113.8	L877 L878 Q879 V883 P904 R905 K908 Y1047	L877-I881 HydrophobicContact CD1-CG2 4.19Å; L877-I881 WeakPolarHBondContact O-CG1 3.42Å; L877-I881 PolarHBondContact O-N 3.21Å; L878-I881 HydrophobicContact CD2-CD1 4.15Å; Q879-I881 VanDerWaalsContact C-N 3.29Å; Q879-I881 PolarHBondContact O-N 3.04Å; I881-V883 HydrophobicContact CD1-CG2 3.75Å; I881-V883 HydrophobicContact CG1-CB 4.41Å; I881-V883 HydrophobicContact CG1-CG2 3.67Å; I881-P904 HydrophobicContact CD1-CB 3.85Å; I881-R905 HydrophobicContact CD1-CG 4.16Å; I881-K908 PolarHBondContact O-NZ 2.99Å; I881-Y1047 WeakPolarHBondContact CG2-O 3.27Å
882	G	93.3	Very high	94.5	Very high	26 Å²	26	50.5 Å²	50.5	27%	0.268	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	14	173.7	0	0	0	0	0	115.8	L878 Q879 E880 T891	L878-G882 PolarHBondContact O-N 2.93Å; Q879-G882 PolarHBondContact O-N 3.46Å; E880-G882 VanDerWaalsContact C-N 3.32Å; G882-T891 WeakPolarHBondContact O-CG2 3.31Å; G882-T891 PolarHBondContact O-OG1 3.48Å
883	V	95.3	Very high	94.5	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.231	C	C	.	.	S	Bend	trans	-74.6	-41.2	175.9	173.8	0	0	0	0	110.9	L844 L878 I881 L890 T891 G894 L897 P904	L844-V883 HydrophobicContact CD1-CG1 3.84Å; L878-V883 HydrophobicContact CB-CB 4.29Å; L878-V883 HydrophobicContact CD2-CB 4.1Å; L878-V883 HydrophobicContact CD2-CG1 4.13Å; L878-V883 HydrophobicContact CD2-CG2 4.14Å; L878-V883 WeakPolarHBondContact O-CB 3.29Å; L878-V883 PolarHBondContact O-N 2.99Å; I881-V883 HydrophobicContact CD1-CG2 3.75Å; I881-V883 HydrophobicContact CG1-CB 4.41Å; I881-V883 HydrophobicContact CG1-CG2 3.67Å; V883-L890 HydrophobicContact CG1-CD2 4.24Å; V883-T891 PolarHBondContact O-N 3.45Å; V883-T891 PolarHBondContact O-OG1 2.99Å; V883-G894 WeakPolarHBondContact O-CA 3.42Å; V883-L897 HydrophobicContact CB-CD1 4.5Å; V883-L897 HydrophobicContact CG2-CD1 3.47Å; V883-L897 VanDerWaalsContact CG2-CD1 3.47Å; V883-P904 HydrophobicContact CG2-CB 4.37Å
884	L	96.5	Very high	94.6	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.021	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-114.1	147.9	179.4	-62.5	-178.8	0	0	0	111	V843 K847 L878 Q879 Y889 L890	V843-L884 HydrophobicContact CG1-CD1 4.03Å; K847-L884 HydrophobicContact CB-CD2 4.36Å; K847-L884 HydrophobicContact CG-CD1 4.34Å; K847-L884 HydrophobicContact CG-CD2 3.96Å; L878-L884 HydrophobicContact CB-CB 4.38Å; L878-L884 HydrophobicContact CB-CD1 3.81Å; L878-L884 HydrophobicContact CB-CG 3.91Å; L878-L884 HydrophobicContact CD1-CD1 3.76Å; L878-L884 HydrophobicContact CD1-CG 4.3Å; L878-L884 HydrophobicContact CG-CD1 4.49Å; L878-L884 PolarHBondContact O-N 3.19Å; L878-L884 VanDerWaalsContact O-N 3.16Å; Q879-L884 WeakPolarHBondContact CA-O 3.41Å; Q879-L884 HydrophobicContact CG-CB 3.96Å; L884-Y889 WeakPolarHBondContact CA-O 3.2Å; L884-L890 HydrophobicContact CD2-CD2 3.81Å; L884-L890 HydrophobicContact CD2-CG 4.34Å
885	D	95.2	Very high	94.5	Very high	49 Å²	49	46.9 Å²	46.9	26%	0.262	22%	0.224	S	C	.	.			trans	-83.4	179.1	167.6	74.7	6.8	0	0	0	111.6	Q879 R887 E888 Y889 T891	Q879-D885 WeakPolarHBondContact CG-O 3.4Å; Q879-D885 PolarHBondContact NE2-O 2.81Å; D885-R887 PolarHBondContact O-N 3.5Å; D885-R887 VanDerWaalsContact O-N 3.09Å; D885-R887 VanDerWaalsContact OD1-C 3.24Å; D885-R887 VanDerWaalsContact OD1-CA 3.28Å; D885-R887 WeakPolarHBondContact OD1-CA 3.36Å; D885-R887 WeakPolarHBondContact OD1-CB 3.42Å; D885-R887 PolarHBondContact OD1-N 2.7Å; D885-E888 PolarHBondContact O-N 3.1Å; D885-E888 PolarHBondContact OD1-N 3.39Å; D885-Y889 PolarHBondContact N-O 2.97Å; D885-Y889 PolarHBondContact OD1-N 3.44Å; D885-T891 HydrophobicContact CB-CG2 4.19Å
886	Q	94.3	Very high	94.2	Very high	163 Å²	163	47.2 Å²	47.2	76%	0.762	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-12.6	179.3	-62.3	84.5	10.5	0	0	113.8
887	R	94.6	Very high	94.1	Very high	198 Å²	198	43.6 Å²	43.6	75%	0.747	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.5	9.7	177.1	-62.8	179	179	-178.6	-0.6	112.2	D885 Y889	D885-R887 PolarHBondContact O-N 3.5Å; D885-R887 VanDerWaalsContact O-N 3.09Å; D885-R887 VanDerWaalsContact OD1-C 3.24Å; D885-R887 VanDerWaalsContact OD1-CA 3.28Å; D885-R887 WeakPolarHBondContact OD1-CA 3.36Å; D885-R887 WeakPolarHBondContact OD1-CB 3.42Å; D885-R887 PolarHBondContact OD1-N 2.7Å; R887-Y889 HydrophobicContact CB-CD2 3.65Å; R887-Y889 HydrophobicContact CB-CE2 3.85Å; R887-Y889 PolarHBondContact O-N 3.26Å
888	E	95.7	Very high	94	Very high	27 Å²	27	43 Å²	43	13%	0.126	21%	0.205	C	C	.	.	S	Bend	trans	63	20.2	-176.1	-50.7	-177.4	-170.4	0	0	114.7	K847 T854 A855 V875 D885	K847-E888 HydrophobicContact CD-CB 4.41Å; K847-E888 WeakPolarHBondContact CD-O 3.24Å; K847-E888 WeakPolarHBondContact CE-O 3.45Å; K847-E888 PolarHBondContact NZ-O 2.81Å; T854-E888 WeakPolarHBondContact CA-OE2 3.4Å; T854-E888 WeakPolarHBondContact CB-OE2 3.18Å; A855-E888 PolarHBondContact N-OE2 3.5Å; V875-E888 HydrophobicContact CG1-CG 3.9Å; D885-E888 PolarHBondContact O-N 3.1Å; D885-E888 PolarHBondContact OD1-N 3.39Å
889	Y	96.1	Very high	93.7	Very high	116 Å²	116	45.4 Å²	45.4	46%	0.455	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-81.5	147.7	169	-65.9	-67.6	0	0	0	110.4	L884 D885 R887 T891	L884-Y889 WeakPolarHBondContact CA-O 3.2Å; D885-Y889 PolarHBondContact N-O 2.97Å; D885-Y889 PolarHBondContact OD1-N 3.44Å; R887-Y889 HydrophobicContact CB-CD2 3.65Å; R887-Y889 HydrophobicContact CB-CE2 3.85Å; R887-Y889 PolarHBondContact O-N 3.26Å; Y889-T891 PolarHBondContact O-N 3.21Å
890	L	94.5	Very high	93.5	Very high	31 Å²	31	42.8 Å²	42.8	16%	0.162	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-62.4	120.8	171.9	-69.8	168.9	0	0	0	109	L844 K847 I848 V883 L884 Q895	L844-L890 HydrophobicContact CD1-CD2 3.58Å; K847-L890 HydrophobicContact CB-CD2 4.38Å; K847-L890 HydrophobicContact CB-CG 4.27Å; I848-L890 HydrophobicContact CG1-CD1 4.25Å; V883-L890 HydrophobicContact CG1-CD2 4.24Å; L884-L890 HydrophobicContact CD2-CD2 3.81Å; L884-L890 HydrophobicContact CD2-CG 4.34Å; L890-Q895 HydrophobicContact CB-CG 3.92Å
891	T	95.1	Very high	93.1	Very high	37 Å²	37	41 Å²	41	23%	0.227	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-67.3	170.1	169.1	69.6	0	0	0	0	109.7	G882 V883 D885 Y889 L893 G894 Q895	G882-T891 WeakPolarHBondContact O-CG2 3.31Å; G882-T891 PolarHBondContact O-OG1 3.48Å; V883-T891 PolarHBondContact O-N 3.45Å; V883-T891 PolarHBondContact O-OG1 2.99Å; D885-T891 HydrophobicContact CB-CG2 4.19Å; Y889-T891 PolarHBondContact O-N 3.21Å; T891-L893 PolarHBondContact O-N 3.39Å; T891-L893 PolarHBondContact OG1-N 3.49Å; T891-G894 CarbonylContact O-C 3.4Å; T891-G894 WeakPolarHBondContact O-CA 3.2Å; T891-G894 PolarHBondContact O-N 3.39Å; T891-G894 PolarHBondContact OG1-N 3.03Å; T891-Q895 WeakPolarHBondContact O-CB 3.27Å; T891-Q895 VanDerWaalsContact O-CG 3.22Å; T891-Q895 WeakPolarHBondContact O-CG 3.38Å; T891-Q895 PolarHBondContact O-N 3.08Å
892	T	92.6	Very high	93	Very high	39 Å²	39	42.1 Å²	42.1	24%	0.239	21%	0.207	C	C	.	.	H	α-helix	trans	-56.2	-35.9	172.6	-43.6	0	0	0	0	112.1	Q895 R896 L1176	T892-Q895 WeakPolarHBondContact O-CB 3.43Å; T892-R896 WeakPolarHBondContact O-CG 3.41Å; T892-R896 PolarHBondContact O-N 2.91Å; T892-L1176 HydrophobicContact CG2-CB 3.85Å; T892-L1176 WeakPolarHBondContact CG2-O 3.46Å
893	L	94.7	Very high	92.9	Very high	18 Å²	18	42 Å²	42	9%	0.094	20%	0.2	C	C	.	.	H	α-helix	trans	-63.9	-50.2	171.5	175.1	61.4	0	0	0	110.9	T891 Q895 R896 L897 K908 V911 L1176	T891-L893 PolarHBondContact O-N 3.39Å; T891-L893 PolarHBondContact OG1-N 3.49Å; L893-Q895 PolarHBondContact O-N 3.34Å; L893-R896 PolarHBondContact O-N 3.37Å; L893-R896 VanDerWaalsContact O-N 3.1Å; L893-L897 HydrophobicContact CD1-CD1 3.95Å; L893-L897 HydrophobicContact CD1-CG 4.13Å; L893-L897 HydrophobicContact CD2-CD1 4.35Å; L893-L897 HydrophobicContact CG-CD1 3.7Å; L893-L897 HydrophobicContact CG-CG 4.32Å; L893-L897 VanDerWaalsContact O-CG 3.23Å; L893-L897 WeakPolarHBondContact O-CG 3.35Å; L893-L897 PolarHBondContact O-N 3.08Å; L893-K908 HydrophobicContact CD2-CD 4.3Å; L893-K908 HydrophobicContact CD2-CG 4.31Å; L893-V911 HydrophobicContact CD1-CB 4.31Å; L893-V911 HydrophobicContact CD1-CG1 3.9Å; L893-L1176 HydrophobicContact CB-CD1 3.99Å; L893-L1176 HydrophobicContact CD1-CD1 4.38Å; L893-L1176 HydrophobicContact CD1-CD2 4.25Å
894	G	94.6	Very high	92.9	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-57.8	-36.4	178.4	0	0	0	0	0	113.5	V883 T891 L897 A898	V883-G894 WeakPolarHBondContact O-CA 3.42Å; T891-G894 CarbonylContact O-C 3.4Å; T891-G894 WeakPolarHBondContact O-CA 3.2Å; T891-G894 PolarHBondContact O-N 3.39Å; T891-G894 PolarHBondContact OG1-N 3.03Å; G894-L897 PolarHBondContact O-N 2.67Å; G894-A898 PolarHBondContact O-N 2.88Å
895	Q	92.2	Very high	92.8	Very high	35 Å²	35	43.6 Å²	43.6	16%	0.164	21%	0.206	C	C	.	.	H	α-helix	trans	-61.3	-46.7	173.8	-73.6	179.5	2.4	0	0	112	L409 L890 T891 T892 L893 L897 A898 H899	L409-Q895 VanDerWaalsContact CD1-CA 3.47Å; L409-Q895 HydrophobicContact CD1-CB 3.25Å; L409-Q895 HydrophobicContact CD1-CG 3.37Å; L890-Q895 HydrophobicContact CB-CG 3.92Å; T891-Q895 WeakPolarHBondContact O-CB 3.27Å; T891-Q895 VanDerWaalsContact O-CG 3.22Å; T891-Q895 WeakPolarHBondContact O-CG 3.38Å; T891-Q895 PolarHBondContact O-N 3.08Å; T892-Q895 WeakPolarHBondContact O-CB 3.43Å; L893-Q895 PolarHBondContact O-N 3.34Å; Q895-L897 VanDerWaalsContact C-N 3.34Å; Q895-L897 PolarHBondContact O-N 3.39Å; Q895-A898 PolarHBondContact O-N 3.13Å; Q895-H899 PolarHBondContact O-CD2 3.28Å
896	R	91.9	Very high	92.8	Very high	13 Å²	13	41.4 Å²	41.4	5%	0.049	19%	0.194	C	C	.	.	H	α-helix	trans	-62.5	-42.3	173.4	-57.7	-53.3	-179.9	-175.6	-4.1	111.6	T892 L893 A898 H899 V911 A1012 L1176 S1178	T892-R896 WeakPolarHBondContact O-CG 3.41Å; T892-R896 PolarHBondContact O-N 2.91Å; L893-R896 PolarHBondContact O-N 3.37Å; L893-R896 VanDerWaalsContact O-N 3.1Å; R896-A898 VanDerWaalsContact C-N 3.32Å; R896-A898 PolarHBondContact O-N 2.84Å; R896-H899 PolarHBondContact O-N 3.23Å; R896-V911 HydrophobicContact CB-CG1 4.39Å; R896-V911 HydrophobicContact CB-CG2 4.18Å; R896-A1012 WeakPolarHBondContact CD-O 3.25Å; R896-A1012 PolarHBondContact NH1-O 2.83Å; R896-L1176 HydrophobicContact CG-CD2 3.75Å; R896-L1176 PolarHBondContact NE-O 3.11Å; R896-L1176 VanDerWaalsContact NE-O 3.15Å; R896-L1176 PolarHBondContact NH2-O 2.98Å; R896-S1178 PolarHBondContact NH2-O 2.86Å
897	L	92.6	Very high	92.9	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-65	-33.6	-178.4	-67.6	171	0	0	0	113.3	V883 L893 G894 Q895 H899 I900 A907 K908 V911	V883-L897 HydrophobicContact CB-CD1 4.5Å; V883-L897 HydrophobicContact CG2-CD1 3.47Å; V883-L897 VanDerWaalsContact CG2-CD1 3.47Å; L893-L897 HydrophobicContact CD1-CD1 3.95Å; L893-L897 HydrophobicContact CD1-CG 4.13Å; L893-L897 HydrophobicContact CD2-CD1 4.35Å; L893-L897 HydrophobicContact CG-CD1 3.7Å; L893-L897 HydrophobicContact CG-CG 4.32Å; L893-L897 VanDerWaalsContact O-CG 3.23Å; L893-L897 WeakPolarHBondContact O-CG 3.35Å; L893-L897 PolarHBondContact O-N 3.08Å; G894-L897 PolarHBondContact O-N 2.67Å; Q895-L897 VanDerWaalsContact C-N 3.34Å; Q895-L897 PolarHBondContact O-N 3.39Å; L897-H899 PolarHBondContact O-N 3.11Å; L897-H899 VanDerWaalsContact O-N 3.13Å; L897-I900 PolarHBondContact O-N 3.03Å; L897-A907 HydrophobicContact CB-CB 4.48Å; L897-A907 HydrophobicContact CD2-CB 3.34Å; L897-A907 VanDerWaalsContact CD2-O 3.28Å; L897-A907 WeakPolarHBondContact CD2-O 3.41Å; L897-A907 HydrophobicContact CG-CB 4.49Å; L897-K908 HydrophobicContact CD1-CB 4.32Å; L897-K908 VanDerWaalsContact CD2-CA 3.45Å; L897-K908 HydrophobicContact CD2-CB 4.12Å; L897-V911 HydrophobicContact CD2-CB 4.47Å; L897-V911 HydrophobicContact CD2-CG2 3.6Å; L897-V911 HydrophobicContact CG-CG2 4.23Å
898	A	90.5	Very high	93.1	Very high	15 Å²	15	24.3 Å²	24.3	12%	0.124	12%	0.123	C	C	.	.	H	α-helix	trans	-56.2	-29.5	-179.7	0	0	0	0	0	113.5	I848 G894 Q895 R896 I900	I848-A898 HydrophobicContact CD1-CB 3.57Å; I848-A898 HydrophobicContact CG1-CB 3.7Å; G894-A898 PolarHBondContact O-N 2.88Å; Q895-A898 PolarHBondContact O-N 3.13Å; R896-A898 VanDerWaalsContact C-N 3.32Å; R896-A898 PolarHBondContact O-N 2.84Å; A898-I900 VanDerWaalsContact C-N 3.35Å
899	H	88.8	Confident	93.2	Very high	52 Å²	52	23 Å²	23	24%	0.241	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-23.7	175.5	-67.2	-83.5	0	0	0	113	Q895 R896 L897 S901 N1008 A1012	Q895-H899 PolarHBondContact O-CD2 3.28Å; R896-H899 PolarHBondContact O-N 3.23Å; L897-H899 PolarHBondContact O-N 3.11Å; L897-H899 VanDerWaalsContact O-N 3.13Å; H899-S901 PolarHBondContact O-N 2.84Å; H899-N1008 WeakPolarHBondContact O-CB 3.24Å; H899-A1012 HydrophobicContact CB-CB 4.07Å
900	I	91.1	Very high	93.2	Very high	5 Å²	5	17.5 Å²	17.5	3%	0.026	10%	0.095	C	C	.	.	S	Bend	trans	-95.4	102.6	-172	-49.5	176.1	0	0	0	110.4	L897 A898 T902 A907 I910 V911 F1005 N1008 I1009	L897-I900 PolarHBondContact O-N 3.03Å; A898-I900 VanDerWaalsContact C-N 3.35Å; I900-T902 VanDerWaalsContact C-N 3.33Å; I900-T902 HydrophobicContact CG2-CG2 3.98Å; I900-T902 PolarHBondContact O-N 2.99Å; I900-A907 HydrophobicContact CB-CB 4Å; I900-A907 HydrophobicContact CG2-CB 4.07Å; I900-I910 HydrophobicContact CD1-CB 4.3Å; I900-I910 HydrophobicContact CD1-CG2 3.89Å; I900-I910 HydrophobicContact CG2-CD1 4.04Å; I900-V911 HydrophobicContact CD1-CG2 3.62Å; I900-F1005 HydrophobicContact CG2-CD1 4.18Å; I900-N1008 HydrophobicContact CG1-CB 4.41Å; I900-I1009 HydrophobicContact CD1-CG1 4.44Å
901	S	83.1	Confident	93.4	Very high	30 Å²	30	16 Å²	16	21%	0.21	9%	0.087	C	C	.	.			trans	-72.7	70.4	-177.9	53.1	0	0	0	0	116.5	R543 R565 H899 Q1004 N1008	R543-S901 PolarHBondContact NH1-O 3.45Å; R543-S901 PolarHBondContact NH2-O 2.87Å; R543-S901 VanDerWaalsContact NH2-O 3.12Å; R565-S901 PolarHBondContact NH2-OG 3.32Å; H899-S901 PolarHBondContact O-N 2.84Å; S901-Q1004 PolarHBondContact OG-NE2 2.98Å; S901-N1008 PolarHBondContact OG-ND2 2.97Å
902	T	89.9	Confident	93.5	Very high	26 Å²	26	14.6 Å²	14.6	16%	0.16	8%	0.078	C	C	.	.	S	Bend	trans	-152.8	-177.3	174.2	-165.9	0	0	0	0	111	I900 L906 A907 V926 F1005	I900-T902 VanDerWaalsContact C-N 3.33Å; I900-T902 HydrophobicContact CG2-CG2 3.98Å; I900-T902 PolarHBondContact O-N 2.99Å; T902-L906 HydrophobicContact CG2-CB 3.94Å; T902-A907 HydrophobicContact CG2-CB 3.78Å; T902-V926 HydrophobicContact CG2-CG1 4.29Å; T902-F1005 HydrophobicContact CG2-CE1 4.48Å
903	D	91.9	Very high	93.8	Very high	22 Å²	22	12.7 Å²	12.7	12%	0.118	7%	0.067	C	C	.	.			trans	-54.5	139.6	174.3	179.1	-78.5	0	0	0	110.9	R905 L906 A907 F1100	D903-R905 PolarHBondContact O-N 3.16Å; D903-R905 VanDerWaalsContact O-N 3.13Å; D903-R905 VanDerWaalsContact OD1-CB 3.26Å; D903-R905 WeakPolarHBondContact OD1-CB 3.24Å; D903-R905 IonicContact OD1-CZ 3.71Å; D903-R905 PolarHBondContact OD1-N 3.28Å; D903-R905 IonicContact OD1-NE 3.21Å; D903-R905 PolarHBondContact OD1-NE 2.82Å; D903-R905 VanDerWaalsContact OD1-NE 3.11Å; D903-R905 IonicContact OD1-NH2 3.51Å; D903-R905 IonicContact OD2-CZ 3.4Å; D903-R905 IonicContact OD2-NE 3.24Å; D903-R905 IonicContact OD2-NH2 2.65Å; D903-R905 PolarHBondContact OD2-NH2 2.98Å; D903-L906 HydrophobicContact CB-CB 4.4Å; D903-L906 HydrophobicContact CB-CD1 4.3Å; D903-L906 HydrophobicContact CB-CG 4.23Å; D903-L906 PolarHBondContact O-N 3.48Å; D903-A907 WeakPolarHBondContact O-CB 3.28Å; D903-A907 PolarHBondContact O-N 2.91Å; D903-F1100 HydrophobicContact CB-CE2 4.08Å; D903-F1100 HydrophobicContact CB-CZ 4.07Å
904	P	94.7	Very high	93.9	Very high	2 Å²	2	11.9 Å²	11.9	1%	0.013	6%	0.063	C	C	.	.	H	α-helix	trans	-57.3	-33.3	-174.3	-26.6	36.4	0	0	0	113.6	N841 L844 L878 I881 V883 K908	N841-P904 WeakPolarHBondContact OD1-CD 3.5Å; L844-P904 HydrophobicContact CD2-CB 4.44Å; L844-P904 HydrophobicContact CD2-CG 4.02Å; L878-P904 HydrophobicContact CD2-CB 3.91Å; L878-P904 HydrophobicContact CD2-CG 3.87Å; I881-P904 HydrophobicContact CD1-CB 3.85Å; V883-P904 HydrophobicContact CG2-CB 4.37Å; P904-K908 VanDerWaalsContact O-CB 3.31Å; P904-K908 WeakPolarHBondContact O-CB 3.41Å; P904-K908 PolarHBondContact O-N 3.46Å
905	R	95	Very high	94	Very high	37 Å²	37	12.1 Å²	12.1	14%	0.14	6%	0.064	C	C	.	.	H	α-helix	trans	-71.3	-40.9	177.4	-66	165.9	-72.8	-153.3	-11.2	111.9	E840 I881 D903 K908 A909 G1045 L1046	E840-R905 IonicContact OE1-NH2 3.68Å; I881-R905 HydrophobicContact CD1-CG 4.16Å; D903-R905 PolarHBondContact O-N 3.16Å; D903-R905 VanDerWaalsContact O-N 3.13Å; D903-R905 VanDerWaalsContact OD1-CB 3.26Å; D903-R905 WeakPolarHBondContact OD1-CB 3.24Å; D903-R905 IonicContact OD1-CZ 3.71Å; D903-R905 PolarHBondContact OD1-N 3.28Å; D903-R905 IonicContact OD1-NE 3.21Å; D903-R905 PolarHBondContact OD1-NE 2.82Å; D903-R905 VanDerWaalsContact OD1-NE 3.11Å; D903-R905 IonicContact OD1-NH2 3.51Å; D903-R905 IonicContact OD2-CZ 3.4Å; D903-R905 IonicContact OD2-NE 3.24Å; D903-R905 IonicContact OD2-NH2 2.65Å; D903-R905 PolarHBondContact OD2-NH2 2.98Å; R905-K908 WeakPolarHBondContact O-CB 3.42Å; R905-K908 PolarHBondContact O-N 2.91Å; R905-A909 PolarHBondContact O-N 3.09Å; R905-G1045 CarbonylContact C-O 3.56Å; R905-G1045 WeakPolarHBondContact CA-O 3.34Å; R905-G1045 WeakPolarHBondContact CB-O 3.14Å; R905-G1045 CarbonylContact O-C 3.55Å; R905-G1045 VanDerWaalsContact O-O 3.05Å; R905-L1046 HydrophobicContact CB-CD2 4.1Å
906	L	95.9	Very high	94.3	Very high	3 Å²	3	10.8 Å²	10.8	2%	0.016	6%	0.057	C	C	.	.	H	α-helix	trans	-68.9	-39.5	175	-64.6	-176.7	0	0	0	111.6	T902 D903 K908 A909 I910 V926 L929 L1046 F1100	T902-L906 HydrophobicContact CG2-CB 3.94Å; D903-L906 HydrophobicContact CB-CB 4.4Å; D903-L906 HydrophobicContact CB-CD1 4.3Å; D903-L906 HydrophobicContact CB-CG 4.23Å; D903-L906 PolarHBondContact O-N 3.48Å; L906-K908 VanDerWaalsContact C-N 3.27Å; L906-K908 PolarHBondContact O-N 3.44Å; L906-A909 WeakPolarHBondContact O-CB 3.35Å; L906-A909 PolarHBondContact O-N 3.02Å; L906-I910 WeakPolarHBondContact O-CG1 3.39Å; L906-I910 PolarHBondContact O-N 3.34Å; L906-V926 HydrophobicContact CB-CG1 4.06Å; L906-V926 HydrophobicContact CB-CG2 3.95Å; L906-V926 HydrophobicContact CD1-CG1 4.18Å; L906-V926 HydrophobicContact CD2-CG2 4.16Å; L906-V926 HydrophobicContact CG-CG2 4.47Å; L906-L929 HydrophobicContact CD1-CD1 4.49Å; L906-L929 HydrophobicContact CD2-CD1 3.75Å; L906-L1046 HydrophobicContact CD2-CD2 3.77Å; L906-F1100 HydrophobicContact CD1-CD1 4.3Å; L906-F1100 HydrophobicContact CD1-CD2 4.23Å; L906-F1100 HydrophobicContact CD1-CE1 3.78Å; L906-F1100 HydrophobicContact CD1-CE2 3.69Å; L906-F1100 HydrophobicContact CD1-CZ 3.45Å; L906-F1100 VanDerWaalsContact CD1-CZ 3.45Å; L906-F1100 HydrophobicContact CD2-CD1 4.49Å; L906-F1100 HydrophobicContact CD2-CD2 3.65Å; L906-F1100 HydrophobicContact CD2-CE2 3.87Å; L906-F1100 HydrophobicContact CD2-CG 4.01Å; L906-F1100 HydrophobicContact CD2-CZ 4.4Å; L906-F1100 HydrophobicContact CG-CD2 3.87Å; L906-F1100 HydrophobicContact CG-CE1 4.46Å; L906-F1100 HydrophobicContact CG-CE2 3.51Å; L906-F1100 HydrophobicContact CG-CG 4.49Å; L906-F1100 HydrophobicContact CG-CZ 3.86Å
907	A	96.4	Very high	94.6	Very high	1 Å²	1	11.1 Å²	11.1	1%	0.008	6%	0.059	C	C	.	.	H	α-helix	trans	-60.3	-41.9	172.9	0	0	0	0	0	110.1	L897 I900 T902 D903 I910 V911	L897-A907 HydrophobicContact CB-CB 4.48Å; L897-A907 HydrophobicContact CD2-CB 3.34Å; L897-A907 VanDerWaalsContact CD2-O 3.28Å; L897-A907 WeakPolarHBondContact CD2-O 3.41Å; L897-A907 HydrophobicContact CG-CB 4.49Å; I900-A907 HydrophobicContact CB-CB 4Å; I900-A907 HydrophobicContact CG2-CB 4.07Å; T902-A907 HydrophobicContact CG2-CB 3.78Å; D903-A907 WeakPolarHBondContact O-CB 3.28Å; D903-A907 PolarHBondContact O-N 2.91Å; A907-I910 WeakPolarHBondContact O-CB 3.19Å; A907-I910 PolarHBondContact O-N 2.66Å; A907-I910 VanDerWaalsContact O-N 3.15Å; A907-V911 WeakPolarHBondContact O-CG2 3.28Å; A907-V911 PolarHBondContact O-N 3.16Å
908	K	97.3	Very high	94.8	Very high	1 Å²	1	11.1 Å²	11.1	0%	0.004	6%	0.058	C	C	.	.	H	α-helix	trans	-62.5	-43.6	175.8	-176	-178.3	173.5	175.5	0	111.9	I881 L893 L897 P904 R905 L906 I910 V911 L912 D1127	I881-K908 PolarHBondContact O-NZ 2.99Å; L893-K908 HydrophobicContact CD2-CD 4.3Å; L893-K908 HydrophobicContact CD2-CG 4.31Å; L897-K908 HydrophobicContact CD1-CB 4.32Å; L897-K908 VanDerWaalsContact CD2-CA 3.45Å; L897-K908 HydrophobicContact CD2-CB 4.12Å; P904-K908 VanDerWaalsContact O-CB 3.31Å; P904-K908 WeakPolarHBondContact O-CB 3.41Å; P904-K908 PolarHBondContact O-N 3.46Å; R905-K908 WeakPolarHBondContact O-CB 3.42Å; R905-K908 PolarHBondContact O-N 2.91Å; L906-K908 VanDerWaalsContact C-N 3.27Å; L906-K908 PolarHBondContact O-N 3.44Å; K908-I910 VanDerWaalsContact C-N 3.26Å; K908-I910 PolarHBondContact O-N 3.15Å; K908-V911 PolarHBondContact O-N 3.12Å; K908-L912 HydrophobicContact CG-CD1 4.01Å; K908-L912 HydrophobicContact CG-CG 4.3Å; K908-L912 WeakPolarHBondContact O-CB 3.23Å; K908-L912 VanDerWaalsContact O-CG 3.3Å; K908-L912 WeakPolarHBondContact O-CG 3.46Å; K908-L912 PolarHBondContact O-N 3.47Å; K908-D1127 VanDerWaalsContact CE-OD2 3.23Å; K908-D1127 WeakPolarHBondContact CE-OD2 3.38Å; K908-D1127 IonicContact NZ-OD2 3.44Å; K908-D1127 PolarHBondContact NZ-OD2 3.07Å
909	A	97.6	Very high	95.2	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-56.5	-41.3	173.7	0	0	0	0	0	111.8	R905 L906 A913 L922 L1042	R905-A909 PolarHBondContact O-N 3.09Å; L906-A909 WeakPolarHBondContact O-CB 3.35Å; L906-A909 PolarHBondContact O-N 3.02Å; A909-A913 WeakPolarHBondContact O-CB 3.44Å; A909-A913 PolarHBondContact O-N 3.43Å; A909-L922 HydrophobicContact CB-CD1 4.33Å; A909-L1042 HydrophobicContact CB-CD1 4.38Å
910	I	97.5	Very high	95.6	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-65.1	-48.2	176.5	-70.7	169.3	0	0	0	111.8	I900 L906 A907 K908 L912 A913 A914 L919 L923 V926 F1005 I1009	I900-I910 HydrophobicContact CD1-CB 4.3Å; I900-I910 HydrophobicContact CD1-CG2 3.89Å; I900-I910 HydrophobicContact CG2-CD1 4.04Å; L906-I910 WeakPolarHBondContact O-CG1 3.39Å; L906-I910 PolarHBondContact O-N 3.34Å; A907-I910 WeakPolarHBondContact O-CB 3.19Å; A907-I910 PolarHBondContact O-N 2.66Å; A907-I910 VanDerWaalsContact O-N 3.15Å; K908-I910 VanDerWaalsContact C-N 3.26Å; K908-I910 PolarHBondContact O-N 3.15Å; I910-L912 VanDerWaalsContact C-N 3.34Å; I910-L912 PolarHBondContact O-N 3.11Å; I910-A913 PolarHBondContact O-N 3Å; I910-A914 PolarHBondContact O-N 3.49Å; I910-L919 HydrophobicContact CG2-CD1 4.09Å; I910-L923 HydrophobicContact CD1-CD2 4.18Å; I910-L923 HydrophobicContact CG1-CD2 4.32Å; I910-L923 HydrophobicContact CG2-CD2 4.37Å; I910-V926 HydrophobicContact CD1-CB 4.07Å; I910-V926 HydrophobicContact CD1-CG1 3.87Å; I910-V926 HydrophobicContact CD1-CG2 3.94Å; I910-V926 HydrophobicContact CG1-CB 4.48Å; I910-V926 HydrophobicContact CG1-CG2 3.91Å; I910-F1005 HydrophobicContact CD1-CG 4.46Å; I910-I1009 HydrophobicContact CG2-CD1 3.36Å; I910-I1009 HydrophobicContact CG2-CG1 3.56Å
911	V	97.3	Very high	95.9	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-59.5	-48.2	179.7	175.2	0	0	0	0	110.4	L893 R896 L897 I900 A907 K908 A913 A914 I915 L1014 L1176	L893-V911 HydrophobicContact CD1-CB 4.31Å; L893-V911 HydrophobicContact CD1-CG1 3.9Å; R896-V911 HydrophobicContact CB-CG1 4.39Å; R896-V911 HydrophobicContact CB-CG2 4.18Å; L897-V911 HydrophobicContact CD2-CB 4.47Å; L897-V911 HydrophobicContact CD2-CG2 3.6Å; L897-V911 HydrophobicContact CG-CG2 4.23Å; I900-V911 HydrophobicContact CD1-CG2 3.62Å; A907-V911 WeakPolarHBondContact O-CG2 3.28Å; A907-V911 PolarHBondContact O-N 3.16Å; K908-V911 PolarHBondContact O-N 3.12Å; V911-A913 VanDerWaalsContact C-N 3.33Å; V911-A913 PolarHBondContact O-N 2.88Å; V911-A914 PolarHBondContact O-N 3.2Å; V911-I915 HydrophobicContact CG1-CD1 4.19Å; V911-I915 WeakPolarHBondContact O-CG1 3.49Å; V911-I915 PolarHBondContact O-N 3.49Å; V911-L1014 HydrophobicContact CB-CD1 4.15Å; V911-L1014 HydrophobicContact CG1-CD1 4Å; V911-L1014 HydrophobicContact CG1-CD2 4.22Å; V911-L1014 HydrophobicContact CG2-CD1 3.83Å; V911-L1176 HydrophobicContact CG1-CD2 3.73Å
912	L	97.8	Very high	96.7	Very high	6 Å²	6	8.1 Å²	8.1	3%	0.031	4%	0.039	C	C	.	.	H	α-helix	trans	-62.5	-41.4	176.8	-65	177.2	0	0	0	110.9	K908 I910 A914 I915 F916 V1041 A1044 V1172	K908-L912 HydrophobicContact CG-CD1 4.01Å; K908-L912 HydrophobicContact CG-CG 4.3Å; K908-L912 WeakPolarHBondContact O-CB 3.23Å; K908-L912 VanDerWaalsContact O-CG 3.3Å; K908-L912 WeakPolarHBondContact O-CG 3.46Å; K908-L912 PolarHBondContact O-N 3.47Å; I910-L912 VanDerWaalsContact C-N 3.34Å; I910-L912 PolarHBondContact O-N 3.11Å; L912-A914 VanDerWaalsContact C-N 3.28Å; L912-A914 PolarHBondContact O-N 3.21Å; L912-I915 PolarHBondContact O-N 2.95Å; L912-F916 HydrophobicContact CB-CD2 4.22Å; L912-F916 HydrophobicContact CD2-CE2 4.27Å; L912-F916 WeakPolarHBondContact O-CB 3.35Å; L912-F916 VanDerWaalsContact O-CD2 3.27Å; L912-F916 WeakPolarHBondContact O-CD2 3.44Å; L912-F916 PolarHBondContact O-N 2.9Å; L912-V1041 HydrophobicContact CB-CG1 3.78Å; L912-A1044 HydrophobicContact CD1-CB 3.8Å; L912-V1172 HydrophobicContact CD2-CG1 4.16Å
913	A	98.3	Very high	97	Very high	0 Å²	0	6.9 Å²	6.9	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-62	-33.6	178.7	0	0	0	0	0	113.5	A909 I910 V911 R917 C918 L919 L922 V1041	A909-A913 WeakPolarHBondContact O-CB 3.44Å; A909-A913 PolarHBondContact O-N 3.43Å; I910-A913 PolarHBondContact O-N 3Å; V911-A913 VanDerWaalsContact C-N 3.33Å; V911-A913 PolarHBondContact O-N 2.88Å; A913-R917 PolarHBondContact O-N 3.42Å; A913-C918 PolarHBondContact O-N 3.42Å; A913-L919 HydrophobicContact CB-CD1 4.12Å; A913-L919 PolarHBondContact O-N 3.08Å; A913-L922 HydrophobicContact CB-CB 3.69Å; A913-L922 HydrophobicContact CB-CD2 4.16Å; A913-L922 HydrophobicContact CB-CG 3.72Å; A913-V1041 HydrophobicContact CB-CG1 4.05Å
914	A	97.1	Very high	97.3	Very high	1 Å²	1	5.9 Å²	5.9	1%	0.008	3%	0.026	C	C	.	.	H	α-helix	trans	-64.8	-45	171.2	0	0	0	0	0	111.7	I910 V911 L912 R917 L919 L1014 L1180	I910-A914 PolarHBondContact O-N 3.49Å; V911-A914 PolarHBondContact O-N 3.2Å; L912-A914 VanDerWaalsContact C-N 3.28Å; L912-A914 PolarHBondContact O-N 3.21Å; A914-R917 PolarHBondContact O-N 2.76Å; A914-L919 HydrophobicContact CB-CD1 4.29Å; A914-L919 HydrophobicContact CB-CD2 4.25Å; A914-L1014 HydrophobicContact CB-CB 4.07Å; A914-L1180 HydrophobicContact CB-CD2 4.44Å
915	I	97	Very high	97.5	Very high	4 Å²	4	5.9 Å²	5.9	2%	0.021	3%	0.026	C	C	.	.	H	α-helix	trans	-66.8	-44.6	179.9	-63.8	174	0	0	0	111.6	V911 L912 R917 M1171 V1172 L1176 L1180	V911-I915 HydrophobicContact CG1-CD1 4.19Å; V911-I915 WeakPolarHBondContact O-CG1 3.49Å; V911-I915 PolarHBondContact O-N 3.49Å; L912-I915 PolarHBondContact O-N 2.95Å; I915-R917 PolarHBondContact O-N 3.44Å; I915-M1171 HydrophobicContact CG2-CE 4.17Å; I915-V1172 HydrophobicContact CD1-CG1 4.21Å; I915-V1172 HydrophobicContact CG2-CG2 4.19Å; I915-L1176 HydrophobicContact CD1-CD2 3.93Å; I915-L1176 HydrophobicContact CD1-CG 4Å; I915-L1180 HydrophobicContact CG1-CD2 4.42Å
916	F	98.1	Very high	97.6	Very high	7 Å²	7	4.1 Å²	4.1	3%	0.031	2%	0.019	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	7.2	177.9	-75	-87.3	0	0	0	113.2	L912 C918 L1037 V1041 L1125 L1168 M1171 V1172 L1195 L1198	L912-F916 HydrophobicContact CB-CD2 4.22Å; L912-F916 HydrophobicContact CD2-CE2 4.27Å; L912-F916 WeakPolarHBondContact O-CB 3.35Å; L912-F916 VanDerWaalsContact O-CD2 3.27Å; L912-F916 WeakPolarHBondContact O-CD2 3.44Å; L912-F916 PolarHBondContact O-N 2.9Å; F916-C918 VanDerWaalsContact C-N 3.31Å; F916-C918 PolarHBondContact O-N 2.94Å; F916-L1037 HydrophobicContact CD1-CD1 4.25Å; F916-V1041 HydrophobicContact CB-CG2 3.65Å; F916-V1041 HydrophobicContact CD1-CG2 4.27Å; F916-V1041 HydrophobicContact CD2-CG2 4.06Å; F916-V1041 HydrophobicContact CG-CG2 3.74Å; F916-L1125 HydrophobicContact CD1-CD2 4.36Å; F916-L1125 HydrophobicContact CE1-CD2 3.44Å; F916-L1125 VanDerWaalsContact CE1-CD2 3.44Å; F916-L1125 HydrophobicContact CE2-CD2 4.49Å; F916-L1125 HydrophobicContact CZ-CD2 3.53Å; F916-L1168 HydrophobicContact CE1-CD2 4.1Å; F916-M1171 HydrophobicContact CD1-CE 4.08Å; F916-M1171 HydrophobicContact CE1-CE 3.7Å; F916-M1171 HydrophobicContact CE2-CE 4.41Å; F916-M1171 HydrophobicContact CZ-CE 3.87Å; F916-V1172 HydrophobicContact CE2-CG2 3.71Å; F916-V1172 HydrophobicContact CZ-CG2 3.94Å; F916-L1195 HydrophobicContact CB-CD2 4.37Å; F916-L1195 HydrophobicContact CD1-CD2 3.48Å; F916-L1195 VanDerWaalsContact CD1-CD2 3.48Å; F916-L1195 HydrophobicContact CE1-CD2 4.13Å; F916-L1195 HydrophobicContact CG-CD2 4.26Å; F916-L1198 HydrophobicContact CD1-CD2 3.88Å; F916-L1198 HydrophobicContact CE1-CD2 3.71Å
917	R	97.8	Very high	97.6	Very high	21 Å²	21	4 Å²	4	8%	0.079	2%	0.019	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	38.9	172.8	-61.1	-178.6	-171.3	177.1	7.1	114.4	A913 A914 I915 Q1027 C1028 N1029 E1030 Y1031 Q1188 L1195	A913-R917 PolarHBondContact O-N 3.42Å; A914-R917 PolarHBondContact O-N 2.76Å; I915-R917 PolarHBondContact O-N 3.44Å; R917-Q1027 VanDerWaalsContact CB-O 3.25Å; R917-Q1027 WeakPolarHBondContact CB-O 3.28Å; R917-Q1027 WeakPolarHBondContact CD-O 3.45Å; R917-Q1027 VanDerWaalsContact CG-O 3.26Å; R917-Q1027 WeakPolarHBondContact CG-O 3.34Å; R917-C1028 CarbonylContact C-O 3.49Å; R917-C1028 WeakPolarHBondContact CA-O 3.31Å; R917-N1029 CarbonylContact O-C 3.54Å; R917-N1029 WeakPolarHBondContact O-CA 3.42Å; R917-E1030 HydrophobicContact CB-CB 4.19Å; R917-E1030 VanDerWaalsContact CD-OE2 3.28Å; R917-E1030 WeakPolarHBondContact CD-OE2 3.44Å; R917-E1030 IonicContact CZ-OE2 3.6Å; R917-E1030 IonicContact NE-OE2 3.39Å; R917-E1030 IonicContact NH1-OE2 3.99Å; R917-E1030 PolarHBondContact NH1-OE2 3.23Å; R917-E1030 PolarHBondContact O-N 2.96Å; R917-E1030 VanDerWaalsContact O-N 3.16Å; R917-Y1031 HydrophobicContact CB-CD2 3.93Å; R917-Y1031 PolarHBondContact O-N 3.49Å; R917-Q1188 PolarHBondContact NH2-O 3.22Å; R917-L1195 HydrophobicContact CB-CD1 4.25Å; R917-L1195 HydrophobicContact CG-CD1 3.87Å
918	C	97.8	Very high	97.5	Very high	0 Å²	0	4 Å²	4	0%	0	2%	0.019	C	C	.	.			trans	-132.2	42	175.7	56.3	0	0	0	0	111.4	A913 F916 P921 C1028 V1038	A913-C918 PolarHBondContact O-N 3.42Å; F916-C918 VanDerWaalsContact C-N 3.31Å; F916-C918 PolarHBondContact O-N 2.94Å; C918-P921 WeakPolarHBondContact O-CD 3.46Å; C918-C1028 PolarHBondContact N-O 3.36Å; C918-V1038 HydrophobicContact CB-CG2 3.96Å
919	L	98.2	Very high	97.3	Very high	0 Å²	0	5.4 Å²	5.4	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-68.7	-47.9	-164.6	179.7	57.5	0	0	0	114.4	I910 A913 A914 L922 L923 I1009 V1015 C1021 C1028 N1029	I910-L919 HydrophobicContact CG2-CD1 4.09Å; A913-L919 HydrophobicContact CB-CD1 4.12Å; A913-L919 PolarHBondContact O-N 3.08Å; A914-L919 HydrophobicContact CB-CD1 4.29Å; A914-L919 HydrophobicContact CB-CD2 4.25Å; L919-L922 PolarHBondContact O-N 3.04Å; L919-L922 VanDerWaalsContact O-N 3.09Å; L919-L923 HydrophobicContact CD1-CD1 4.25Å; L919-L923 HydrophobicContact CD1-CG 4.01Å; L919-L923 HydrophobicContact CD2-CD1 4.41Å; L919-L923 HydrophobicContact CG-CD1 3.93Å; L919-L923 HydrophobicContact CG-CG 4.19Å; L919-L923 PolarHBondContact O-N 3.21Å; L919-I1009 HydrophobicContact CD1-CD1 4.01Å; L919-I1009 HydrophobicContact CD2-CD1 4.26Å; L919-I1009 HydrophobicContact CD2-CG2 4.31Å; L919-V1015 HydrophobicContact CD2-CG1 3.99Å; L919-C1021 HydrophobicContact CD2-CB 4.07Å; L919-C1028 HydrophobicContact CB-CB 4.41Å; L919-C1028 WeakPolarHBondContact CB-O 3.26Å; L919-C1028 HydrophobicContact CD2-CB 4.32Å; L919-C1028 PolarHBondContact N-O 3.24Å; L919-N1029 PolarHBondContact N-OD1 3.47Å
920	H	98	Very high	96.8	Very high	34 Å²	34	8.2 Å²	8.2	16%	0.157	4%	0.044	C	C	.	.	H	α-helix	trans	-57.1	-48.8	-171.1	-178.5	-108.3	0	0	0	113.8	L922 L923 V924 C1021 N1029	H920-L922 VanDerWaalsContact C-N 3.26Å; H920-L922 PolarHBondContact O-N 2.9Å; H920-L923 WeakPolarHBondContact O-CB 3.23Å; H920-L923 PolarHBondContact O-N 2.81Å; H920-V924 PolarHBondContact O-N 3.5Å; H920-V924 VanDerWaalsContact O-N 3.11Å; H920-C1021 WeakPolarHBondContact CB-O 3.42Å; H920-N1029 WeakPolarHBondContact CB-OD1 3.48Å; H920-N1029 PolarHBondContact N-OD1 2.9Å
921	P	98.2	Very high	96.3	Very high	5 Å²	5	10.6 Å²	10.6	3%	0.032	5%	0.053	C	C	.	.	H	α-helix	trans	-55.1	-40.2	175.5	-25.7	33.7	0	0	0	113.1	C918 V924 V925 V963 S1032 V1038	C918-P921 WeakPolarHBondContact O-CD 3.46Å; P921-V924 WeakPolarHBondContact O-CB 3.45Å; P921-V924 PolarHBondContact O-N 3.39Å; P921-V925 VanDerWaalsContact O-CG2 3.31Å; P921-V925 WeakPolarHBondContact O-CG2 3.47Å; P921-V925 PolarHBondContact O-N 3.17Å; P921-V963 HydrophobicContact CB-CG1 4.17Å; P921-V963 HydrophobicContact CB-CG2 3.98Å; P921-S1032 WeakPolarHBondContact CG-O 3.33Å; P921-V1038 HydrophobicContact CB-CG1 3.99Å; P921-V1038 HydrophobicContact CB-CG2 4.24Å; P921-V1038 HydrophobicContact CG-CG2 4.15Å
922	L	98.1	Very high	95.8	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-72.4	-34.6	-178.7	-86.8	-59.1	0	0	0	112.2	A909 A913 L919 H920 V924 V925 V926 V1038 L1042	A909-L922 HydrophobicContact CB-CD1 4.33Å; A913-L922 HydrophobicContact CB-CB 3.69Å; A913-L922 HydrophobicContact CB-CD2 4.16Å; A913-L922 HydrophobicContact CB-CG 3.72Å; L919-L922 PolarHBondContact O-N 3.04Å; L919-L922 VanDerWaalsContact O-N 3.09Å; H920-L922 VanDerWaalsContact C-N 3.26Å; H920-L922 PolarHBondContact O-N 2.9Å; L922-V924 VanDerWaalsContact C-N 3.3Å; L922-V924 PolarHBondContact O-N 3.47Å; L922-V925 PolarHBondContact O-N 2.71Å; L922-V926 WeakPolarHBondContact O-CB 3.15Å; L922-V926 WeakPolarHBondContact O-CG2 3.37Å; L922-V926 PolarHBondContact O-N 3.42Å; L922-V1038 HydrophobicContact CD2-CB 4.4Å; L922-V1038 HydrophobicContact CD2-CG1 3.7Å; L922-L1042 HydrophobicContact CD1-CB 3.77Å; L922-L1042 HydrophobicContact CD1-CD1 3.6Å; L922-L1042 HydrophobicContact CD1-CG 4.21Å
923	L	97.7	Very high	95.5	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-59.8	-42.4	170.9	-78.2	177.5	0	0	0	111.9	I910 L919 H920 S927 I1002 F1005 I1009 C1021	I910-L923 HydrophobicContact CD1-CD2 4.18Å; I910-L923 HydrophobicContact CG1-CD2 4.32Å; I910-L923 HydrophobicContact CG2-CD2 4.37Å; L919-L923 HydrophobicContact CD1-CD1 4.25Å; L919-L923 HydrophobicContact CD1-CG 4.01Å; L919-L923 HydrophobicContact CD2-CD1 4.41Å; L919-L923 HydrophobicContact CG-CD1 3.93Å; L919-L923 HydrophobicContact CG-CG 4.19Å; L919-L923 PolarHBondContact O-N 3.21Å; H920-L923 WeakPolarHBondContact O-CB 3.23Å; H920-L923 PolarHBondContact O-N 2.81Å; L923-S927 VanDerWaalsContact O-CB 3.26Å; L923-S927 WeakPolarHBondContact O-CB 3.5Å; L923-S927 PolarHBondContact O-N 2.95Å; L923-S927 PolarHBondContact O-OG 2.88Å; L923-I1002 HydrophobicContact CB-CG2 4.46Å; L923-I1002 HydrophobicContact CD1-CG2 4.48Å; L923-F1005 HydrophobicContact CD2-CB 3.48Å; L923-F1005 VanDerWaalsContact CD2-CB 3.48Å; L923-F1005 HydrophobicContact CD2-CD2 4.38Å; L923-F1005 HydrophobicContact CD2-CG 4.3Å; L923-I1009 HydrophobicContact CD1-CD1 4.17Å; L923-I1009 HydrophobicContact CD2-CD1 3.59Å; L923-I1009 HydrophobicContact CG-CD1 4.26Å; L923-C1021 HydrophobicContact CD1-CB 3.72Å
924	V	98.2	Very high	95	Very high	2 Å²	2	13.2 Å²	13.2	1%	0.012	7%	0.066	C	C	.	.	H	α-helix	trans	-64	-48.6	175	175.7	0	0	0	0	110.5	H920 P921 L922 V926 S927 C928 V963 V966 I1002	H920-V924 PolarHBondContact O-N 3.5Å; H920-V924 VanDerWaalsContact O-N 3.11Å; P921-V924 WeakPolarHBondContact O-CB 3.45Å; P921-V924 PolarHBondContact O-N 3.39Å; L922-V924 VanDerWaalsContact C-N 3.3Å; L922-V924 PolarHBondContact O-N 3.47Å; V924-V926 PolarHBondContact O-N 3.02Å; V924-S927 PolarHBondContact O-N 2.87Å; V924-C928 WeakPolarHBondContact O-CB 3.21Å; V924-C928 PolarHBondContact O-N 3.05Å; V924-C928 PolarHBondContact O-SG 3.17Å; V924-C928 VanDerWaalsContact O-SG 3.35Å; V924-V963 HydrophobicContact CB-CG2 4.48Å; V924-V963 HydrophobicContact CG1-CG2 4.46Å; V924-V966 HydrophobicContact CG1-CB 3.75Å; V924-V966 HydrophobicContact CG1-CG1 4.18Å; V924-V966 HydrophobicContact CG1-CG2 3.69Å; V924-V966 HydrophobicContact CG2-CG1 4.34Å; V924-I1002 HydrophobicContact CG2-CD1 3.86Å
925	V	97.8	Very high	93.8	Very high	1 Å²	1	14.5 Å²	14.5	1%	0.006	8%	0.075	C	C	.	.	H	α-helix	trans	-56.5	-52.4	178.9	168.5	0	0	0	0	111.4	P921 L922 S927 C928 L929 H959 V963 L1042	P921-V925 VanDerWaalsContact O-CG2 3.31Å; P921-V925 WeakPolarHBondContact O-CG2 3.47Å; P921-V925 PolarHBondContact O-N 3.17Å; L922-V925 PolarHBondContact O-N 2.71Å; V925-S927 VanDerWaalsContact C-N 3.28Å; V925-S927 PolarHBondContact O-N 3.41Å; V925-C928 PolarHBondContact O-N 3.26Å; V925-L929 HydrophobicContact CG1-CD1 3.85Å; V925-L929 HydrophobicContact CG1-CG 4.34Å; V925-L929 WeakPolarHBondContact O-CG 3.47Å; V925-L929 PolarHBondContact O-N 2.86Å; V925-H959 HydrophobicContact CG1-CB 4.01Å; V925-H959 HydrophobicContact CG2-CB 3.87Å; V925-H959 WeakPolarHBondContact CG2-O 3.11Å; V925-V963 HydrophobicContact CG2-CG2 3.72Å; V925-L1042 HydrophobicContact CG1-CD1 4.13Å; V925-L1042 HydrophobicContact CG1-CD2 4.37Å
926	V	96.7	Very high	92.3	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-61.8	-38.6	-179.8	172.2	0	0	0	0	111.5	T902 L906 I910 L922 V924 L929 T930 F1005	T902-V926 HydrophobicContact CG2-CG1 4.29Å; L906-V926 HydrophobicContact CB-CG1 4.06Å; L906-V926 HydrophobicContact CB-CG2 3.95Å; L906-V926 HydrophobicContact CD1-CG1 4.18Å; L906-V926 HydrophobicContact CD2-CG2 4.16Å; L906-V926 HydrophobicContact CG-CG2 4.47Å; I910-V926 HydrophobicContact CD1-CB 4.07Å; I910-V926 HydrophobicContact CD1-CG1 3.87Å; I910-V926 HydrophobicContact CD1-CG2 3.94Å; I910-V926 HydrophobicContact CG1-CB 4.48Å; I910-V926 HydrophobicContact CG1-CG2 3.91Å; L922-V926 WeakPolarHBondContact O-CB 3.15Å; L922-V926 WeakPolarHBondContact O-CG2 3.37Å; L922-V926 PolarHBondContact O-N 3.42Å; V924-V926 PolarHBondContact O-N 3.02Å; V926-L929 PolarHBondContact O-N 3.17Å; V926-T930 PolarHBondContact O-N 3.15Å; V926-T930 PolarHBondContact O-OG1 3.45Å; V926-F1005 HydrophobicContact CG1-CE2 3.89Å; V926-F1005 HydrophobicContact CG1-CZ 4.03Å
927	S	96.3	Very high	90.4	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-67	-40.6	177.2	-59.3	0	0	0	0	112.1	L923 V924 V925 T930 R931 I1002	L923-S927 VanDerWaalsContact O-CB 3.26Å; L923-S927 WeakPolarHBondContact O-CB 3.5Å; L923-S927 PolarHBondContact O-N 2.95Å; L923-S927 PolarHBondContact O-OG 2.88Å; V924-S927 PolarHBondContact O-N 2.87Å; V925-S927 VanDerWaalsContact C-N 3.28Å; V925-S927 PolarHBondContact O-N 3.41Å; S927-T930 WeakPolarHBondContact O-CB 3.48Å; S927-T930 PolarHBondContact O-N 3.04Å; S927-R931 PolarHBondContact O-N 3.48Å; S927-I1002 WeakPolarHBondContact OG-CG1 3.35Å
928	C	94.9	Very high	88.6	Confident	3 Å²	3	18.9 Å²	18.9	2%	0.02	11%	0.106	C	C	.	.	H	α-helix	trans	-70.6	-34.3	176.4	-72.9	0	0	0	0	113.1	V924 V925 T930 R931 D932 F962	V924-C928 WeakPolarHBondContact O-CB 3.21Å; V924-C928 PolarHBondContact O-N 3.05Å; V924-C928 PolarHBondContact O-SG 3.17Å; V924-C928 VanDerWaalsContact O-SG 3.35Å; V925-C928 PolarHBondContact O-N 3.26Å; C928-T930 VanDerWaalsContact C-N 3.28Å; C928-R931 CarbonylContact C-O 3.24Å; C928-R931 WeakPolarHBondContact CA-O 3.5Å; C928-R931 CarbonylContact O-C 3.58Å; C928-R931 PolarHBondContact O-N 2.81Å; C928-D932 PolarHBondContact O-N 2.91Å; C928-F962 HydrophobicContact CB-CB 3.81Å; C928-F962 HydrophobicContact CB-CD1 4.04Å; C928-F962 HydrophobicContact CB-CD2 3.8Å; C928-F962 HydrophobicContact CB-CE2 4.35Å; C928-F962 HydrophobicContact CB-CG 3.64Å
929	L	92.1	Very high	86.8	Confident	29 Å²	29	23.1 Å²	23.1	15%	0.152	13%	0.126	C	C	.	.	H	α-helix	trans	-67.6	-30.7	171.7	-70.7	173.4	0	0	0	111.7	L906 V925 V926 F962 F1100	L906-L929 HydrophobicContact CD1-CD1 4.49Å; L906-L929 HydrophobicContact CD2-CD1 3.75Å; V925-L929 HydrophobicContact CG1-CD1 3.85Å; V925-L929 HydrophobicContact CG1-CG 4.34Å; V925-L929 WeakPolarHBondContact O-CG 3.47Å; V925-L929 PolarHBondContact O-N 2.86Å; V926-L929 PolarHBondContact O-N 3.17Å; L929-F962 HydrophobicContact CD2-CE2 4.05Å; L929-F1100 HydrophobicContact CB-CD1 4.24Å; L929-F1100 HydrophobicContact CD1-CB 3.99Å; L929-F1100 HydrophobicContact CD1-CD1 3.95Å; L929-F1100 HydrophobicContact CD1-CG 4.06Å; L929-F1100 HydrophobicContact CD2-CB 4.48Å; L929-F1100 HydrophobicContact CD2-CD1 4.19Å; L929-F1100 HydrophobicContact CG-CD1 4.36Å
930	T	87.7	Confident	85.3	Confident	60 Å²	60	26 Å²	26	37%	0.368	14%	0.141	S	C	.	.	H	α-helix	trans	-76.3	-37.5	173.4	-54.9	0	0	0	0	111.9	V926 S927 C928 L1001	V926-T930 PolarHBondContact O-N 3.15Å; V926-T930 PolarHBondContact O-OG1 3.45Å; S927-T930 WeakPolarHBondContact O-CB 3.48Å; S927-T930 PolarHBondContact O-N 3.04Å; C928-T930 VanDerWaalsContact C-N 3.28Å; T930-L1001 HydrophobicContact CG2-CD1 3.79Å
931	R	86.4	Confident	84.2	Confident	50 Å²	50	30.2 Å²	30.2	19%	0.189	16%	0.156	C	C	.	.	S	Bend	trans	-140.7	115.8	178.6	-178.4	68	-178.3	178.6	6.3	110.7	N730 S927 C928 S994 F997 I998	N730-R931 PolarHBondContact O-NH1 2.74Å; N730-R931 PolarHBondContact O-NH2 3.38Å; S927-R931 PolarHBondContact O-N 3.48Å; C928-R931 CarbonylContact C-O 3.24Å; C928-R931 WeakPolarHBondContact CA-O 3.5Å; C928-R931 CarbonylContact O-C 3.58Å; C928-R931 PolarHBondContact O-N 2.81Å; R931-S994 PolarHBondContact NE-OG 3.15Å; R931-S994 VanDerWaalsContact NE-OG 3.1Å; R931-S994 PolarHBondContact NH2-OG 3.28Å; R931-F997 HydrophobicContact CB-CD1 3.76Å; R931-F997 HydrophobicContact CB-CE1 4.1Å; R931-F997 HydrophobicContact CG-CD1 3.77Å; R931-F997 HydrophobicContact CG-CE1 4.42Å; R931-I998 HydrophobicContact CB-CG1 4.2Å; R931-I998 HydrophobicContact CG-CG1 4.42Å; R931-I998 WeakPolarHBondContact O-CD1 3.11Å
932	D	87.7	Confident	83.3	Confident	54 Å²	54	33.1 Å²	33.1	29%	0.289	18%	0.181	S	C	.	.			trans	-59.8	124.4	176.9	-169.5	-16.5	0	0	0	111.7	C928 F934 S937 S994	C928-D932 PolarHBondContact O-N 2.91Å; D932-F934 VanDerWaalsContact C-N 3.34Å; D932-F934 WeakPolarHBondContact OD1-CB 3.5Å; D932-F934 WeakPolarHBondContact OD1-CD2 3.33Å; D932-F934 PolarHBondContact OD1-N 3.04Å; D932-S937 WeakPolarHBondContact OD2-CB 3.44Å; D932-S937 PolarHBondContact OD2-OG 3.11Å; D932-S994 WeakPolarHBondContact O-CB 3.28Å; D932-S994 PolarHBondContact O-OG 2.9Å
933	P	90.9	Very high	82.7	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.202	C	C	.	.			trans	-74.4	-22	177.5	29.4	-35.1	0	0	0	113.4	F962 L990 Y991 L995 I998	P933-F962 HydrophobicContact CG-CD1 3.95Å; P933-F962 HydrophobicContact CG-CE1 4.28Å; P933-L990 HydrophobicContact CB-CD2 4.19Å; P933-Y991 PolarHBondContact O-N 3.27Å; P933-L995 HydrophobicContact CB-CD2 4Å; P933-I998 HydrophobicContact CB-CD1 3.63Å; P933-I998 HydrophobicContact CG-CD1 4.39Å
934	F	88.4	Confident	82.1	Confident	7 Å²	7	37.8 Å²	37.8	3%	0.031	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-78.5	133.8	-174.2	-63	-79	0	0	0	111.7	D932 V944 V947 K948 L951 F962 N988 L989 L990	D932-F934 VanDerWaalsContact C-N 3.34Å; D932-F934 WeakPolarHBondContact OD1-CB 3.5Å; D932-F934 WeakPolarHBondContact OD1-CD2 3.33Å; D932-F934 PolarHBondContact OD1-N 3.04Å; F934-V944 HydrophobicContact CB-CG1 3.86Å; F934-V944 HydrophobicContact CB-CG2 4.23Å; F934-V944 HydrophobicContact CD1-CG1 3.99Å; F934-V944 HydrophobicContact CD2-CG1 4.01Å; F934-V944 HydrophobicContact CG-CG1 3.67Å; F934-V947 HydrophobicContact CE1-CG1 3.92Å; F934-K948 HydrophobicContact CE2-CD 4.3Å; F934-K948 HydrophobicContact CE2-CG 3.81Å; F934-K948 HydrophobicContact CZ-CG 3.75Å; F934-L951 HydrophobicContact CE1-CD1 4.11Å; F934-L951 HydrophobicContact CZ-CD1 3.99Å; F934-F962 HydrophobicContact CD2-CE1 4.31Å; F934-F962 AromaticContact CE2-CD1 3.95Å; F934-F962 HydrophobicContact CE2-CD1 3.95Å; F934-F962 AromaticContact CE2-CE1 3.81Å; F934-F962 HydrophobicContact CE2-CE1 3.81Å; F934-N988 WeakPolarHBondContact CD1-O 3.12Å; F934-L989 CarbonylContact C-O 3.57Å; F934-L989 WeakPolarHBondContact CA-O 3.33Å; F934-L990 HydrophobicContact CD1-CD2 3.65Å; F934-L990 HydrophobicContact CE1-CD2 3.69Å; F934-L990 HydrophobicContact CG-CD2 4.31Å; F934-L990 HydrophobicContact CZ-CD2 4.38Å
935	S	72.8	Confident	81.4	Confident	28 Å²	28	39.5 Å²	39.5	20%	0.196	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	135	171.3	71.7	0	0	0	0	110.1	S937 L989	S935-S937 PolarHBondContact O-N 2.93Å; S935-L989 WeakPolarHBondContact CB-O 3.43Å; S935-L989 PolarHBondContact N-O 3.05Å; S935-L989 VanDerWaalsContact OG-C 3.3Å; S935-L989 PolarHBondContact OG-O 2.74Å
936	S	65.6	Low	81	Confident	53 Å²	53	46.5 Å²	46.5	37%	0.371	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	38.8	171.9	-59.8	0	0	0	0	113.1	L938 Q939 N940	S936-L938 CarbonylContact O-C 3.58Å; S936-L938 PolarHBondContact O-N 3.32Å; S936-Q939 WeakPolarHBondContact O-CA 3.36Å; S936-Q939 PolarHBondContact O-N 3.24Å; S936-Q939 PolarHBondContact OG-NE2 2.85Å; S936-N940 PolarHBondContact O-N 3.45Å
937	S	57.8	Low	80.7	Confident	25 Å²	25	47.2 Å²	47.2	18%	0.175	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-17.5	-178.7	62.4	0	0	0	0	112.9	D932 S935 R941	D932-S937 WeakPolarHBondContact OD2-CB 3.44Å; D932-S937 PolarHBondContact OD2-OG 3.11Å; S935-S937 PolarHBondContact O-N 2.93Å; S937-R941 WeakPolarHBondContact O-CG 3.48Å
938	L	60	Low	80.4	Confident	45 Å²	45	48.3 Å²	48.3	24%	0.236	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-29.5	170.8	-62.1	169.4	0	0	0	114.9	W701 S936 R941	W701-L938 HydrophobicContact CB-CD1 3.94Å; W701-L938 HydrophobicContact CD2-CB 4.42Å; W701-L938 HydrophobicContact CD2-CD1 3.89Å; W701-L938 HydrophobicContact CG-CB 4Å; W701-L938 HydrophobicContact CG-CD1 3.57Å; W701-L938 HydrophobicContact CG-CG 4.34Å; W701-L938 VanDerWaalsContact NE1-CB 3.25Å; S936-L938 CarbonylContact O-C 3.58Å; S936-L938 PolarHBondContact O-N 3.32Å; L938-R941 VanDerWaalsContact CD2-NH2 3.34Å
939	Q	59.7	Low	80.1	Confident	90 Å²	90	50.4 Å²	50.4	42%	0.421	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-43.3	-179.6	-47.9	-177.9	34.2	0	0	111.7	W701 K705 S936	W701-Q939 HydrophobicContact CZ2-CG 3.72Å; K705-Q939 HydrophobicContact CD-CG 4.49Å; K705-Q939 VanDerWaalsContact CE-CD 3.42Å; K705-Q939 VanDerWaalsContact NZ-CD 3.34Å; S936-Q939 WeakPolarHBondContact O-CA 3.36Å; S936-Q939 PolarHBondContact O-N 3.24Å; S936-Q939 PolarHBondContact OG-NE2 2.85Å
940	N	67.2	Low	80	Confident	59 Å²	59	54.8 Å²	54.8	32%	0.316	29%	0.292	S	S	.	.	S	Bend	trans	-111.1	38.4	-173.1	-66.2	15.5	0	0	0	111.3	S936 A942 E943 V944	S936-N940 PolarHBondContact O-N 3.45Å; N940-A942 VanDerWaalsContact C-N 3.3Å; N940-A942 PolarHBondContact O-N 2.81Å; N940-E943 HydrophobicContact CB-CB 4.2Å; N940-E943 HydrophobicContact CB-CG 4.45Å; N940-E943 WeakPolarHBondContact CB-OE2 3.39Å; N940-E943 PolarHBondContact ND2-OE2 3.37Å; N940-E943 PolarHBondContact O-N 3.23Å; N940-V944 WeakPolarHBondContact O-CG2 3.35Å; N940-V944 PolarHBondContact O-N 3.34Å
941	R	74.2	Confident	80.3	Confident	123 Å²	123	52.8 Å²	52.8	46%	0.464	28%	0.279	S	S	.	.	H	α-helix	trans	-44.9	-53.8	-175.4	-80.3	-178.5	179.4	179.2	3.4	112.3	S937 L938 E943 V944 D945	S937-R941 WeakPolarHBondContact O-CG 3.48Å; L938-R941 VanDerWaalsContact CD2-NH2 3.34Å; R941-E943 VanDerWaalsContact C-N 3.28Å; R941-E943 PolarHBondContact O-N 3.45Å; R941-V944 PolarHBondContact O-N 3.22Å; R941-D945 WeakPolarHBondContact O-CB 3.44Å; R941-D945 PolarHBondContact O-N 3.14Å; R941-D945 VanDerWaalsContact O-OD2 3.09Å
942	A	79.8	Confident	80.4	Confident	67 Å²	67	50.7 Å²	50.7	55%	0.554	27%	0.272	S	S	*	.	H	α-helix	trans	-64.6	-27.4	-178.2	0	0	0	0	0	114.3	N940 K946	N940-A942 VanDerWaalsContact C-N 3.3Å; N940-A942 PolarHBondContact O-N 2.81Å; A942-K946 VanDerWaalsContact O-CG 3.3Å; A942-K946 WeakPolarHBondContact O-CG 3.25Å; A942-K946 PolarHBondContact O-N 3.42Å
943	E	84.5	Confident	80.4	Confident	95 Å²	95	54.2 Å²	54.2	44%	0.444	29%	0.287	S	S	.	.	H	α-helix	trans	-81.4	-41.6	175.6	-57.1	178.2	160.9	0	0	110.7	N940 R941 D945 K946 V947 L989	N940-E943 HydrophobicContact CB-CB 4.2Å; N940-E943 HydrophobicContact CB-CG 4.45Å; N940-E943 WeakPolarHBondContact CB-OE2 3.39Å; N940-E943 PolarHBondContact ND2-OE2 3.37Å; N940-E943 PolarHBondContact O-N 3.23Å; R941-E943 VanDerWaalsContact C-N 3.28Å; R941-E943 PolarHBondContact O-N 3.45Å; E943-D945 VanDerWaalsContact C-N 3.28Å; E943-D945 PolarHBondContact O-N 2.99Å; E943-K946 WeakPolarHBondContact O-CB 3.46Å; E943-K946 PolarHBondContact O-N 3.22Å; E943-K946 VanDerWaalsContact O-N 3.14Å; E943-V947 WeakPolarHBondContact O-CG2 3.43Å; E943-V947 PolarHBondContact O-N 3.43Å; E943-L989 HydrophobicContact CB-CD1 3.62Å
944	V	85.7	Confident	80.1	Confident	2 Å²	2	59.7 Å²	59.7	1%	0.012	32%	0.316	C	S	.	.	H	α-helix	trans	-59.9	-40.4	172.9	172.1	0	0	0	0	110.7	F934 N940 R941 K946 V947 K948 L989	F934-V944 HydrophobicContact CB-CG1 3.86Å; F934-V944 HydrophobicContact CB-CG2 4.23Å; F934-V944 HydrophobicContact CD1-CG1 3.99Å; F934-V944 HydrophobicContact CD2-CG1 4.01Å; F934-V944 HydrophobicContact CG-CG1 3.67Å; N940-V944 WeakPolarHBondContact O-CG2 3.35Å; N940-V944 PolarHBondContact O-N 3.34Å; R941-V944 PolarHBondContact O-N 3.22Å; V944-K946 VanDerWaalsContact C-N 3.32Å; V944-K946 PolarHBondContact O-N 3.48Å; V944-V947 PolarHBondContact O-N 3.22Å; V944-K948 HydrophobicContact CG1-CD 4.29Å; V944-K948 HydrophobicContact CG1-CG 4.42Å; V944-K948 WeakPolarHBondContact O-CB 3.31Å; V944-K948 WeakPolarHBondContact O-CG 3.35Å; V944-K948 PolarHBondContact O-N 3Å; V944-L989 HydrophobicContact CG2-CB 4.4Å; V944-L989 HydrophobicContact CG2-CD1 4.02Å
945	D	84.4	Confident	80.1	Confident	38 Å²	38	59.6 Å²	59.6	20%	0.203	32%	0.316	C	S	.	.	H	α-helix	trans	-65.1	-36.2	177.1	-64	-24.7	0	0	0	111.4	R941 E943 A949	R941-D945 WeakPolarHBondContact O-CB 3.44Å; R941-D945 PolarHBondContact O-N 3.14Å; R941-D945 VanDerWaalsContact O-OD2 3.09Å; E943-D945 VanDerWaalsContact C-N 3.28Å; E943-D945 PolarHBondContact O-N 2.99Å; D945-A949 WeakPolarHBondContact O-CB 3.4Å; D945-A949 PolarHBondContact O-N 2.88Å
946	K	87.8	Confident	81	Confident	148 Å²	148	58.8 Å²	58.8	64%	0.643	31%	0.312	S	S	*	.	H	α-helix	trans	-66.2	-42.4	172	-72.2	169	-172.8	172.4	0	112.1	A942 E943 V944 A949 L950	A942-K946 VanDerWaalsContact O-CG 3.3Å; A942-K946 WeakPolarHBondContact O-CG 3.25Å; A942-K946 PolarHBondContact O-N 3.42Å; E943-K946 WeakPolarHBondContact O-CB 3.46Å; E943-K946 PolarHBondContact O-N 3.22Å; E943-K946 VanDerWaalsContact O-N 3.14Å; V944-K946 VanDerWaalsContact C-N 3.32Å; V944-K946 PolarHBondContact O-N 3.48Å; K946-A949 PolarHBondContact O-N 3.1Å; K946-L950 PolarHBondContact O-N 2.82Å
947	V	90.1	Very high	82.4	Confident	16 Å²	16	56.2 Å²	56.2	10%	0.097	29%	0.294	C	S	.	.	H	α-helix	trans	-64.3	-44.4	176.6	172.1	0	0	0	0	110.4	F934 E943 V944 A949 L950 L951 N988 L989	F934-V947 HydrophobicContact CE1-CG1 3.92Å; E943-V947 WeakPolarHBondContact O-CG2 3.43Å; E943-V947 PolarHBondContact O-N 3.43Å; V944-V947 PolarHBondContact O-N 3.22Å; V947-A949 VanDerWaalsContact C-N 3.33Å; V947-A949 PolarHBondContact O-N 3.33Å; V947-L950 WeakPolarHBondContact O-CB 3.49Å; V947-L950 PolarHBondContact O-N 3.09Å; V947-L950 VanDerWaalsContact O-N 3.16Å; V947-L951 HydrophobicContact CG1-CD1 3.7Å; V947-L951 HydrophobicContact CG1-CG 4.2Å; V947-L951 WeakPolarHBondContact O-CB 3.27Å; V947-L951 WeakPolarHBondContact O-CG 3.4Å; V947-L951 PolarHBondContact O-N 3.26Å; V947-N988 HydrophobicContact CG1-CB 4.22Å; V947-L989 HydrophobicContact CG2-CD1 3.99Å; V947-L989 HydrophobicContact CG2-CG 4.21Å
948	K	90.2	Very high	84.2	Confident	22 Å²	22	55.2 Å²	55.2	10%	0.096	29%	0.286	C	S	.	.	H	α-helix	trans	-58.5	-44	173.6	-75.9	177.5	177.3	178.8	0	111.8	F934 V944 L950 L951 S952 I1085	F934-K948 HydrophobicContact CE2-CD 4.3Å; F934-K948 HydrophobicContact CE2-CG 3.81Å; F934-K948 HydrophobicContact CZ-CG 3.75Å; V944-K948 HydrophobicContact CG1-CD 4.29Å; V944-K948 HydrophobicContact CG1-CG 4.42Å; V944-K948 WeakPolarHBondContact O-CB 3.31Å; V944-K948 WeakPolarHBondContact O-CG 3.35Å; V944-K948 PolarHBondContact O-N 3Å; K948-L950 VanDerWaalsContact C-N 3.34Å; K948-L950 PolarHBondContact O-N 3.4Å; K948-L951 PolarHBondContact O-N 3.38Å; K948-S952 WeakPolarHBondContact O-CB 3.37Å; K948-S952 PolarHBondContact O-N 3.37Å; K948-S952 PolarHBondContact O-OG 2.8Å; K948-I1085 HydrophobicContact CB-CG2 3.97Å
949	A	88.6	Confident	85.9	Confident	48 Å²	48	53.1 Å²	53.1	40%	0.397	28%	0.276	S	S	.	.	H	α-helix	trans	-60.1	-44.4	175.4	0	0	0	0	0	111.4	D945 K946 V947 S952 H953 I1085	D945-A949 WeakPolarHBondContact O-CB 3.4Å; D945-A949 PolarHBondContact O-N 2.88Å; K946-A949 PolarHBondContact O-N 3.1Å; V947-A949 VanDerWaalsContact C-N 3.33Å; V947-A949 PolarHBondContact O-N 3.33Å; A949-S952 PolarHBondContact O-N 2.74Å; A949-S952 PolarHBondContact O-OG 3.38Å; A949-H953 PolarHBondContact O-N 3.47Å; A949-I1085 HydrophobicContact CB-CG2 4.25Å
950	L	91.2	Very high	87.7	Confident	121 Å²	121	49.3 Å²	49.3	63%	0.634	26%	0.258	S	S	*	.	H	α-helix	trans	-61.2	-49.7	175.9	-178.3	64.4	0	0	0	112	K946 V947 K948 S952 H953	K946-L950 PolarHBondContact O-N 2.82Å; V947-L950 WeakPolarHBondContact O-CB 3.49Å; V947-L950 PolarHBondContact O-N 3.09Å; V947-L950 VanDerWaalsContact O-N 3.16Å; K948-L950 VanDerWaalsContact C-N 3.34Å; K948-L950 PolarHBondContact O-N 3.4Å; L950-S952 VanDerWaalsContact C-N 3.27Å; L950-S952 PolarHBondContact O-N 3.42Å; L950-H953 PolarHBondContact O-N 3.37Å; L950-H953 PolarHBondContact O-ND1 3.5Å; L950-H953 VanDerWaalsContact O-ND1 3.08Å
951	L	93.1	Very high	89	Confident	17 Å²	17	46.5 Å²	46.5	9%	0.089	24%	0.243	C	C	.	.	H	α-helix	trans	-65.1	-29.2	178.7	-72.5	169.9	0	0	0	112.3	F934 V947 K948 H953 A961 R964 A965	F934-L951 HydrophobicContact CE1-CD1 4.11Å; F934-L951 HydrophobicContact CZ-CD1 3.99Å; V947-L951 HydrophobicContact CG1-CD1 3.7Å; V947-L951 HydrophobicContact CG1-CG 4.2Å; V947-L951 WeakPolarHBondContact O-CB 3.27Å; V947-L951 WeakPolarHBondContact O-CG 3.4Å; V947-L951 PolarHBondContact O-N 3.26Å; K948-L951 PolarHBondContact O-N 3.38Å; L951-H953 PolarHBondContact O-N 2.74Å; L951-A961 HydrophobicContact CB-CB 4Å; L951-R964 HydrophobicContact CD2-CB 4.48Å; L951-R964 WeakPolarHBondContact O-CD 3.28Å; L951-R964 PolarHBondContact O-NH1 3.23Å; L951-A965 HydrophobicContact CD1-CB 3.92Å
952	S	89.8	Confident	90.1	Very high	7 Å²	7	41.3 Å²	41.3	5%	0.049	22%	0.224	C	C	.	.	H	α-helix	trans	-73.3	-14.8	178.8	76.9	0	0	0	0	113.5	K948 A949 L950 D954 S955 R964 I1085	K948-S952 WeakPolarHBondContact O-CB 3.37Å; K948-S952 PolarHBondContact O-N 3.37Å; K948-S952 PolarHBondContact O-OG 2.8Å; A949-S952 PolarHBondContact O-N 2.74Å; A949-S952 PolarHBondContact O-OG 3.38Å; L950-S952 VanDerWaalsContact C-N 3.27Å; L950-S952 PolarHBondContact O-N 3.42Å; S952-D954 PolarHBondContact O-N 3.47Å; S952-S955 WeakPolarHBondContact O-CB 3.29Å; S952-S955 PolarHBondContact O-N 3.3Å; S952-S955 PolarHBondContact O-OG 3.48Å; S952-R964 PolarHBondContact O-NH1 3.33Å; S952-I1085 WeakPolarHBondContact OG-CD1 3.47Å
953	H	85.9	Confident	90.9	Very high	128 Å²	128	39.3 Å²	39.3	59%	0.593	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	43.7	-125.5	-172.6	-58.5	-43.4	0	0	0	110.3	A949 L950 L951 R964	A949-H953 PolarHBondContact O-N 3.47Å; L950-H953 PolarHBondContact O-N 3.37Å; L950-H953 PolarHBondContact O-ND1 3.5Å; L950-H953 VanDerWaalsContact O-ND1 3.08Å; L951-H953 PolarHBondContact O-N 2.74Å; H953-R964 PolarHBondContact CD2-NH1 3.24Å
954	D	85.6	Confident	91.5	Very high	115 Å²	115	37 Å²	37	62%	0.615	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.8	11.5	176.5	-57	-28.4	0	0	0	114	S952 G956 R1093	S952-D954 PolarHBondContact O-N 3.47Å; D954-G956 PolarHBondContact O-N 3.12Å; D954-R1093 VanDerWaalsContact CB-CZ 3.48Å; D954-R1093 PolarHBondContact O-NE 3.01Å; D954-R1093 PolarHBondContact O-NH1 3.49Å; D954-R1093 VanDerWaalsContact O-NH1 3.11Å; D954-R1093 IonicContact OD2-NH2 2.75Å; D954-R1093 PolarHBondContact OD2-NH2 3.41Å
955	S	88.9	Confident	92	Very high	5 Å²	5	37 Å²	37	4%	0.035	19%	0.191	C	C	.	.	S	Bend	trans	-70.6	-21.1	-174.2	69	0	0	0	0	113.6	S952 S957 E1035 K1039	S952-S955 WeakPolarHBondContact O-CB 3.29Å; S952-S955 PolarHBondContact O-N 3.3Å; S952-S955 PolarHBondContact O-OG 3.48Å; S955-S957 PolarHBondContact O-N 3.41Å; S955-S957 PolarHBondContact OG-N 2.99Å; S955-E1035 WeakPolarHBondContact CB-OE2 3.29Å; S955-K1039 PolarHBondContact O-NZ 2.87Å; S955-K1039 VanDerWaalsContact O-NZ 3.16Å
956	G	90.8	Very high	92.5	Very high	10 Å²	10	35.1 Å²	35.1	10%	0.103	18%	0.182	C	C	.	.			trans	62.6	28.6	-174.9	0	0	0	0	0	113.4	D954 N1086 Q1116	D954-G956 PolarHBondContact O-N 3.12Å; G956-N1086 PolarHBondContact O-ND2 2.99Å; G956-N1086 PolarHBondContact O-OD1 3.23Å; G956-Q1116 WeakPolarHBondContact O-CG 3.41Å; G956-Q1116 PolarHBondContact O-N 3.16Å
957	S	95.2	Very high	92.8	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-129.4	114.6	-171.9	-179	0	0	0	0	113	S955 H959 L960 A961 S1115	S955-S957 PolarHBondContact O-N 3.41Å; S955-S957 PolarHBondContact OG-N 2.99Å; S957-H959 PolarHBondContact O-N 3.08Å; S957-L960 PolarHBondContact O-N 3.35Å; S957-L960 WeakPolarHBondContact OG-CG 3.22Å; S957-L960 PolarHBondContact OG-N 3.08Å; S957-L960 VanDerWaalsContact OG-N 3.09Å; S957-A961 PolarHBondContact O-N 3.31Å; S957-S1115 WeakPolarHBondContact CA-OG 3.27Å; S957-S1115 WeakPolarHBondContact CB-OG 3.42Å; S957-S1115 WeakPolarHBondContact OG-CB 3.49Å; S957-S1115 PolarHBondContact OG-OG 3.27Å
958	D	94.8	Very high	93	Very high	3 Å²	3	30 Å²	30	2%	0.016	17%	0.169	C	C	.	.	H	α-helix	trans	-61.3	-38.4	169.8	-69.8	-43.9	0	0	0	110.8	L960 A961 F962 T1084 I1085 S1114	D958-L960 PolarHBondContact O-N 3.02Å; D958-A961 VanDerWaalsContact O-CB 3.28Å; D958-A961 WeakPolarHBondContact O-CB 2.89Å; D958-A961 PolarHBondContact O-N 3.33Å; D958-A961 VanDerWaalsContact O-N 3.14Å; D958-F962 PolarHBondContact O-N 2.98Å; D958-T1084 WeakPolarHBondContact OD2-CA 3.35Å; D958-T1084 WeakPolarHBondContact OD2-CB 3.49Å; D958-T1084 PolarHBondContact OD2-OG1 2.74Å; D958-I1085 WeakPolarHBondContact OD1-CG1 2.94Å; D958-I1085 WeakPolarHBondContact OD1-CG2 3.12Å; D958-I1085 PolarHBondContact OD1-N 3.27Å; D958-S1114 PolarHBondContact N-O 2.84Å; D958-S1114 PolarHBondContact OD2-N 3.45Å
959	H	96.8	Very high	93.2	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.009	17%	0.168	C	C	.	.	H	α-helix	trans	-65.8	-38.9	-178.3	-59	104.9	0	0	0	112.3	V925 S957 A961 F962 V963 L1042 D1113 S1115	V925-H959 HydrophobicContact CG1-CB 4.01Å; V925-H959 HydrophobicContact CG2-CB 3.87Å; V925-H959 WeakPolarHBondContact CG2-O 3.11Å; S957-H959 PolarHBondContact O-N 3.08Å; H959-A961 VanDerWaalsContact C-N 3.31Å; H959-F962 WeakPolarHBondContact O-CB 3.4Å; H959-F962 PolarHBondContact O-N 2.79Å; H959-V963 PolarHBondContact O-N 3.15Å; H959-L1042 HydrophobicContact CB-CD2 3.67Å; H959-L1042 VanDerWaalsContact CG-CD2 3.44Å; H959-D1113 IonicContact CE1-OD2 3.5Å; H959-D1113 PolarHBondContact CE1-OD2 3.24Å; H959-D1113 IonicContact NE2-OD2 2.85Å; H959-D1113 PolarHBondContact NE2-OD2 2.98Å; H959-S1115 PolarHBondContact ND1-OG 3Å
960	L	97	Very high	93.3	Very high	9 Å²	9	29.5 Å²	29.5	5%	0.047	16%	0.158	C	C	.	.	H	α-helix	trans	-72.1	-26.4	174.1	-68	176.2	0	0	0	112.3	S957 D958 F962 V963 R964 E1035 V1038 K1039	S957-L960 PolarHBondContact O-N 3.35Å; S957-L960 WeakPolarHBondContact OG-CG 3.22Å; S957-L960 PolarHBondContact OG-N 3.08Å; S957-L960 VanDerWaalsContact OG-N 3.09Å; D958-L960 PolarHBondContact O-N 3.02Å; L960-F962 VanDerWaalsContact C-N 3.26Å; L960-F962 PolarHBondContact O-N 2.88Å; L960-V963 HydrophobicContact CD2-CG2 4.32Å; L960-V963 PolarHBondContact O-N 3.01Å; L960-R964 WeakPolarHBondContact O-CG 3.39Å; L960-R964 PolarHBondContact O-N 2.91Å; L960-E1035 HydrophobicContact CD1-CB 3.84Å; L960-E1035 HydrophobicContact CD1-CG 3.98Å; L960-V1038 HydrophobicContact CD2-CG1 3.77Å; L960-K1039 HydrophobicContact CD1-CD 3.9Å; L960-K1039 HydrophobicContact CD1-CG 4Å; L960-K1039 HydrophobicContact CG-CG 4.41Å
961	A	95.8	Very high	93.4	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62	-36.3	170.4	0	0	0	0	0	111.3	L951 S957 D958 H959 A965	L951-A961 HydrophobicContact CB-CB 4Å; S957-A961 PolarHBondContact O-N 3.31Å; D958-A961 VanDerWaalsContact O-CB 3.28Å; D958-A961 WeakPolarHBondContact O-CB 2.89Å; D958-A961 PolarHBondContact O-N 3.33Å; D958-A961 VanDerWaalsContact O-N 3.14Å; H959-A961 VanDerWaalsContact C-N 3.31Å; A961-A965 WeakPolarHBondContact O-CB 3.39Å; A961-A965 PolarHBondContact O-N 2.85Å
962	F	96.2	Very high	93.3	Very high	15 Å²	15	27.7 Å²	27.7	7%	0.066	15%	0.147	C	C	.	.	H	α-helix	trans	-64.1	-44.9	171.3	-63.5	-41.9	0	0	0	112.6	C928 L929 P933 F934 D958 H959 L960 R964 A965 V966	C928-F962 HydrophobicContact CB-CB 3.81Å; C928-F962 HydrophobicContact CB-CD1 4.04Å; C928-F962 HydrophobicContact CB-CD2 3.8Å; C928-F962 HydrophobicContact CB-CE2 4.35Å; C928-F962 HydrophobicContact CB-CG 3.64Å; L929-F962 HydrophobicContact CD2-CE2 4.05Å; P933-F962 HydrophobicContact CG-CD1 3.95Å; P933-F962 HydrophobicContact CG-CE1 4.28Å; F934-F962 HydrophobicContact CD2-CE1 4.31Å; F934-F962 AromaticContact CE2-CD1 3.95Å; F934-F962 HydrophobicContact CE2-CD1 3.95Å; F934-F962 AromaticContact CE2-CE1 3.81Å; F934-F962 HydrophobicContact CE2-CE1 3.81Å; D958-F962 PolarHBondContact O-N 2.98Å; H959-F962 WeakPolarHBondContact O-CB 3.4Å; H959-F962 PolarHBondContact O-N 2.79Å; L960-F962 VanDerWaalsContact C-N 3.26Å; L960-F962 PolarHBondContact O-N 2.88Å; F962-R964 VanDerWaalsContact C-N 3.3Å; F962-R964 PolarHBondContact O-N 3.38Å; F962-A965 PolarHBondContact O-N 2.8Å; F962-V966 WeakPolarHBondContact O-CG2 3.33Å; F962-V966 PolarHBondContact O-N 3.29Å; F962-V966 VanDerWaalsContact O-N 3.1Å
963	V	97.2	Very high	93.2	Very high	24 Å²	24	30.1 Å²	30.1	15%	0.145	16%	0.159	C	C	.	.	H	α-helix	trans	-57.1	-47.1	178.5	178.9	0	0	0	0	110.4	P921 V924 V925 H959 L960 V966 A967	P921-V963 HydrophobicContact CB-CG1 4.17Å; P921-V963 HydrophobicContact CB-CG2 3.98Å; V924-V963 HydrophobicContact CB-CG2 4.48Å; V924-V963 HydrophobicContact CG1-CG2 4.46Å; V925-V963 HydrophobicContact CG2-CG2 3.72Å; H959-V963 PolarHBondContact O-N 3.15Å; L960-V963 HydrophobicContact CD2-CG2 4.32Å; L960-V963 PolarHBondContact O-N 3.01Å; V963-V966 PolarHBondContact O-N 3.16Å; V963-A967 VanDerWaalsContact O-CB 3.29Å; V963-A967 WeakPolarHBondContact O-CB 3.46Å; V963-A967 PolarHBondContact O-N 2.88Å
964	R	96.4	Very high	93.3	Very high	48 Å²	48	31.7 Å²	31.7	18%	0.181	16%	0.16	C	C	.	.	H	α-helix	trans	-69.7	-37	-178.9	-68.2	166.9	-176.6	173.4	3	113.1	L951 S952 H953 L960 F962 V966 A967 G968 Y984 E1035	L951-R964 HydrophobicContact CD2-CB 4.48Å; L951-R964 WeakPolarHBondContact O-CD 3.28Å; L951-R964 PolarHBondContact O-NH1 3.23Å; S952-R964 PolarHBondContact O-NH1 3.33Å; H953-R964 PolarHBondContact CD2-NH1 3.24Å; L960-R964 WeakPolarHBondContact O-CG 3.39Å; L960-R964 PolarHBondContact O-N 2.91Å; F962-R964 VanDerWaalsContact C-N 3.3Å; F962-R964 PolarHBondContact O-N 3.38Å; R964-V966 VanDerWaalsContact C-N 3.33Å; R964-V966 PolarHBondContact O-N 2.97Å; R964-A967 PolarHBondContact O-N 3.16Å; R964-G968 PolarHBondContact O-N 3.03Å; R964-Y984 PolarHBondContact O-OH 3.05Å; R964-E1035 IonicContact CZ-OE1 3.91Å; R964-E1035 IonicContact NE-OE1 3.94Å; R964-E1035 VanDerWaalsContact NH2-CD 3.3Å; R964-E1035 IonicContact NH2-OE1 3.92Å; R964-E1035 PolarHBondContact NH2-OE1 2.7Å; R964-E1035 IonicContact NH2-OE2 3.07Å; R964-E1035 PolarHBondContact NH2-OE2 2.66Å
965	A	95.5	Very high	93.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.4	-43.8	173.8	0	0	0	0	0	112.1	L951 A961 F962 W969 Y984 L990	L951-A965 HydrophobicContact CD1-CB 3.92Å; A961-A965 WeakPolarHBondContact O-CB 3.39Å; A961-A965 PolarHBondContact O-N 2.85Å; F962-A965 PolarHBondContact O-N 2.8Å; A965-W969 PolarHBondContact O-N 3.19Å; A965-Y984 PolarHBondContact O-OH 3.33Å; A965-Y984 VanDerWaalsContact O-OH 3.09Å; A965-L990 HydrophobicContact CB-CD1 4.44Å; A965-L990 HydrophobicContact CB-CD2 4.16Å
966	V	95.7	Very high	92.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-75.1	-42.1	179.9	176.3	0	0	0	0	110.9	V924 F962 V963 R964 G968 W969 E970 L995 I998	V924-V966 HydrophobicContact CG1-CB 3.75Å; V924-V966 HydrophobicContact CG1-CG1 4.18Å; V924-V966 HydrophobicContact CG1-CG2 3.69Å; V924-V966 HydrophobicContact CG2-CG1 4.34Å; F962-V966 WeakPolarHBondContact O-CG2 3.33Å; F962-V966 PolarHBondContact O-N 3.29Å; F962-V966 VanDerWaalsContact O-N 3.1Å; V963-V966 PolarHBondContact O-N 3.16Å; R964-V966 VanDerWaalsContact C-N 3.33Å; R964-V966 PolarHBondContact O-N 2.97Å; V966-G968 PolarHBondContact O-N 3.2Å; V966-W969 WeakPolarHBondContact O-CB 3.33Å; V966-W969 PolarHBondContact O-N 3.32Å; V966-W969 VanDerWaalsContact O-N 3.12Å; V966-E970 HydrophobicContact CG1-CG 4.32Å; V966-E970 WeakPolarHBondContact O-CG 3.31Å; V966-E970 PolarHBondContact O-N 3.36Å; V966-L995 HydrophobicContact CG2-CD2 4.07Å; V966-I998 HydrophobicContact CG2-CG2 4.43Å
967	A	94.5	Very high	92.5	Very high	43 Å²	43	43.5 Å²	43.5	36%	0.355	20%	0.204	S	C	.	.	H	α-helix	trans	-59.2	-44.2	178.2	0	0	0	0	0	112.5	V963 R964 W969 E970 E971	V963-A967 VanDerWaalsContact O-CB 3.29Å; V963-A967 WeakPolarHBondContact O-CB 3.46Å; V963-A967 PolarHBondContact O-N 2.88Å; R964-A967 PolarHBondContact O-N 3.16Å; A967-W969 VanDerWaalsContact C-N 3.33Å; A967-W969 PolarHBondContact O-N 3.45Å; A967-E970 PolarHBondContact O-N 3.29Å; A967-E971 PolarHBondContact O-N 3.36Å
968	G	94	Very high	92.2	Very high	12 Å²	12	50 Å²	50	12%	0.124	23%	0.228	C	C	.	.	H	α-helix	trans	-67.5	-33.3	176.2	0	0	0	0	0	112.8	R964 V966 E971 V972 Y984	R964-G968 PolarHBondContact O-N 3.03Å; V966-G968 PolarHBondContact O-N 3.2Å; G968-E971 PolarHBondContact O-N 3.3Å; G968-V972 PolarHBondContact O-N 2.84Å; G968-V972 VanDerWaalsContact O-N 3.15Å; G968-Y984 VanDerWaalsContact C-CZ 3.4Å; G968-Y984 VanDerWaalsContact CA-OH 3.31Å; G968-Y984 WeakPolarHBondContact CA-OH 3.31Å
969	W	93.6	Very high	91.9	Very high	16 Å²	16	53.7 Å²	53.7	6%	0.061	25%	0.251	C	S	.	.	H	α-helix	trans	-64.8	-43.8	171.8	174.9	-117.4	0	0	0	112.4	A965 V966 A967 E971 V972 L973 R981 Y984 L985 L995 H999	A965-W969 PolarHBondContact O-N 3.19Å; V966-W969 WeakPolarHBondContact O-CB 3.33Å; V966-W969 PolarHBondContact O-N 3.32Å; V966-W969 VanDerWaalsContact O-N 3.12Å; A967-W969 VanDerWaalsContact C-N 3.33Å; A967-W969 PolarHBondContact O-N 3.45Å; W969-E971 VanDerWaalsContact C-N 3.25Å; W969-E971 PolarHBondContact O-N 2.92Å; W969-V972 HydrophobicContact CD2-CG2 4.4Å; W969-V972 HydrophobicContact CE3-CG2 3.55Å; W969-V972 HydrophobicContact CZ3-CG2 3.94Å; W969-V972 WeakPolarHBondContact O-CG2 3.34Å; W969-V972 PolarHBondContact O-N 3.42Å; W969-L973 HydrophobicContact CD2-CD1 4.39Å; W969-L973 HydrophobicContact CD2-CG 4.25Å; W969-L973 HydrophobicContact CG-CD1 4.49Å; W969-L973 HydrophobicContact CH2-CD2 4.1Å; W969-L973 HydrophobicContact CH2-CG 4.48Å; W969-L973 HydrophobicContact CZ2-CD1 4.17Å; W969-L973 HydrophobicContact CZ2-CD2 3.71Å; W969-L973 HydrophobicContact CZ2-CG 3.97Å; W969-L973 WeakPolarHBondContact O-CG 3.42Å; W969-L973 PolarHBondContact O-N 3.48Å; W969-R981 HydrophobicContact CH2-CB 4Å; W969-R981 HydrophobicContact CH2-CG 4.31Å; W969-R981 HydrophobicContact CZ3-CB 3.76Å; W969-R981 HydrophobicContact CZ3-CG 4.15Å; W969-Y984 HydrophobicContact CB-CD1 4.23Å; W969-Y984 HydrophobicContact CB-CE1 3.86Å; W969-Y984 HydrophobicContact CE3-CD1 4.07Å; W969-Y984 VanDerWaalsContact N-CE1 3.27Å; W969-L985 HydrophobicContact CD2-CD2 4.27Å; W969-L985 HydrophobicContact CE3-CD2 3.8Å; W969-L985 HydrophobicContact CE3-CG 4.03Å; W969-L985 HydrophobicContact CH2-CD1 3.78Å; W969-L985 HydrophobicContact CH2-CD2 4.08Å; W969-L985 HydrophobicContact CH2-CG 4.03Å; W969-L985 HydrophobicContact CZ3-CD1 3.78Å; W969-L985 HydrophobicContact CZ3-CD2 3.71Å; W969-L985 HydrophobicContact CZ3-CG 3.53Å; W969-L995 HydrophobicContact CB-CD1 4.26Å; W969-L995 HydrophobicContact CD2-CD1 3.85Å; W969-L995 HydrophobicContact CG-CD1 3.68Å; W969-L995 HydrophobicContact CG-CD2 4.46Å; W969-L995 HydrophobicContact CG-CG 4.5Å; W969-H999 AromaticContact CD1-CE1 3.95Å; W969-H999 AromaticContact CD1-NE2 3.96Å
970	E	92.2	Very high	91.6	Very high	44 Å²	44	55.2 Å²	55.2	21%	0.206	26%	0.261	C	S	.	.	H	α-helix	trans	-62.1	-34.4	175.5	-71.6	176.8	165.1	0	0	112.1	V966 A967 L973 R974 H999	V966-E970 HydrophobicContact CG1-CG 4.32Å; V966-E970 WeakPolarHBondContact O-CG 3.31Å; V966-E970 PolarHBondContact O-N 3.36Å; A967-E970 PolarHBondContact O-N 3.29Å; E970-L973 PolarHBondContact O-N 3.12Å; E970-R974 PolarHBondContact O-N 3.13Å; E970-H999 IonicContact OE1-NE2 2.75Å
971	E	91.6	Very high	91.2	Very high	89 Å²	89	57.9 Å²	57.9	42%	0.416	27%	0.271	S	S	.	.	H	α-helix	trans	-65.6	-51.4	175.9	-170.6	174	-171.9	0	0	112.6	A967 G968 W969 L973 R974 W975	A967-E971 PolarHBondContact O-N 3.36Å; G968-E971 PolarHBondContact O-N 3.3Å; W969-E971 VanDerWaalsContact C-N 3.25Å; W969-E971 PolarHBondContact O-N 2.92Å; E971-L973 PolarHBondContact O-N 3.13Å; E971-R974 WeakPolarHBondContact O-CB 3.44Å; E971-R974 PolarHBondContact O-N 3.43Å; E971-W975 HydrophobicContact CG-CZ2 4.03Å
972	V	91.6	Very high	90.9	Very high	11 Å²	11	61.9 Å²	61.9	7%	0.067	29%	0.29	C	S	.	.	H	α-helix	trans	-66.6	-23.1	177	-64.3	0	0	0	0	112.7	G968 W969 R974 R981 Y984	G968-V972 PolarHBondContact O-N 2.84Å; G968-V972 VanDerWaalsContact O-N 3.15Å; W969-V972 HydrophobicContact CD2-CG2 4.4Å; W969-V972 HydrophobicContact CE3-CG2 3.55Å; W969-V972 HydrophobicContact CZ3-CG2 3.94Å; W969-V972 WeakPolarHBondContact O-CG2 3.34Å; W969-V972 PolarHBondContact O-N 3.42Å; V972-R974 VanDerWaalsContact C-N 3.34Å; V972-R981 HydrophobicContact CB-CG 4.24Å; V972-R981 HydrophobicContact CG2-CG 4.19Å; V972-R981 WeakPolarHBondContact O-CG 3.41Å; V972-R981 PolarHBondContact O-NE 2.9Å; V972-Y984 HydrophobicContact CG1-CD2 4.29Å; V972-Y984 HydrophobicContact CG1-CG 4.27Å; V972-Y984 HydrophobicContact CG2-CD1 4.26Å; V972-Y984 HydrophobicContact CG2-CG 4.1Å
973	L	88.5	Confident	90.7	Very high	58 Å²	58	64.7 Å²	64.7	30%	0.304	31%	0.305	S	S	.	.	H	α-helix	trans	-65.7	-35.6	170.3	-79.5	177.3	0	0	0	112.3	W969 E970 E971 R981	W969-L973 HydrophobicContact CD2-CD1 4.39Å; W969-L973 HydrophobicContact CD2-CG 4.25Å; W969-L973 HydrophobicContact CG-CD1 4.49Å; W969-L973 HydrophobicContact CH2-CD2 4.1Å; W969-L973 HydrophobicContact CH2-CG 4.48Å; W969-L973 HydrophobicContact CZ2-CD1 4.17Å; W969-L973 HydrophobicContact CZ2-CD2 3.71Å; W969-L973 HydrophobicContact CZ2-CG 3.97Å; W969-L973 WeakPolarHBondContact O-CG 3.42Å; W969-L973 PolarHBondContact O-N 3.48Å; E970-L973 PolarHBondContact O-N 3.12Å; E971-L973 PolarHBondContact O-N 3.13Å; L973-R981 PolarHBondContact O-NH2 2.77Å
974	R	88.2	Confident	90.5	Very high	161 Å²	161	65.1 Å²	65.1	61%	0.608	31%	0.305	S	S	*	.	H	α-helix	trans	-67.3	-33.7	179.8	-71.6	-174.9	-74.7	-97.7	5.6	113.2	E970 E971 V972 Q976	E970-R974 PolarHBondContact O-N 3.13Å; E971-R974 WeakPolarHBondContact O-CB 3.44Å; E971-R974 PolarHBondContact O-N 3.43Å; V972-R974 VanDerWaalsContact C-N 3.34Å; R974-Q976 PolarHBondContact O-N 3.3Å
975	W	84.8	Confident	90.3	Very high	155 Å²	155	64.1 Å²	64.1	59%	0.587	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-8.8	-175.1	-61	-8.6	0	0	0	114.6	E971 D977	E971-W975 HydrophobicContact CG-CZ2 4.03Å; W975-D977 PolarHBondContact O-N 2.87Å
976	Q	76.1	Confident	90	Very high	164 Å²	164	71 Å²	71	77%	0.766	34%	0.335	S	S	*	.			trans	58.2	2.5	-178.5	-61.5	-172.5	-2.8	0	0	116.4	R974	R974-Q976 PolarHBondContact O-N 3.3Å
977	D	87.7	Confident	89.8	Confident	60 Å²	60	77.8 Å²	77.8	32%	0.321	37%	0.366	S	S	.	.			trans	-79.9	127.2	172.1	175.5	32.5	0	0	0	111.5	W975 T979 S980 R981	W975-D977 PolarHBondContact O-N 2.87Å; D977-T979 PolarHBondContact OD1-N 3.5Å; D977-T979 PolarHBondContact OD1-OG1 3.27Å; D977-S980 VanDerWaalsContact OD2-CB 3.24Å; D977-S980 WeakPolarHBondContact OD2-CB 3.2Å; D977-S980 PolarHBondContact OD2-N 3.12Å; D977-S980 PolarHBondContact OD2-OG 2.61Å; D977-R981 VanDerWaalsContact O-CD 3.25Å; D977-R981 WeakPolarHBondContact O-CD 3.46Å; D977-R981 VanDerWaalsContact O-CG 3.24Å; D977-R981 WeakPolarHBondContact O-CG 3.42Å
978	R	87.3	Confident	89.7	Confident	137 Å²	137	76.4 Å²	76.4	52%	0.517	35%	0.353	S	S	.	.	H	α-helix	trans	-71.7	-37	178.1	-175.3	176	173.3	-167.1	-5.4	112.2	R981 E982	R978-R981 PolarHBondContact O-N 3.16Å; R978-E982 IonicContact CZ-OE1 3.26Å; R978-E982 IonicContact NE-OE1 3.89Å; R978-E982 PolarHBondContact NE-OE1 2.9Å; R978-E982 IonicContact NH2-OE1 2.64Å; R978-E982 PolarHBondContact NH2-OE1 2.8Å; R978-E982 VanDerWaalsContact NH2-OE1 3.08Å; R978-E982 PolarHBondContact O-N 2.76Å
979	T	90.2	Very high	89.5	Confident	80 Å²	80	77.5 Å²	77.5	49%	0.491	36%	0.356	S	S	.	.	H	α-helix	trans	-67.3	-47.1	-175.2	-41.3	0	0	0	0	110.5	D977 R981 E982 N983	D977-T979 PolarHBondContact OD1-N 3.5Å; D977-T979 PolarHBondContact OD1-OG1 3.27Å; T979-R981 VanDerWaalsContact C-N 3.27Å; T979-R981 PolarHBondContact O-N 2.9Å; T979-E982 PolarHBondContact O-N 3.26Å; T979-N983 WeakPolarHBondContact O-CB 3.34Å; T979-N983 PolarHBondContact O-N 3.44Å; T979-N983 PolarHBondContact O-OD1 3.24Å
980	S	89.6	Confident	89.4	Confident	33 Å²	33	77.1 Å²	77.1	23%	0.231	36%	0.355	C	S	.	.	H	α-helix	trans	-58.3	-37.9	175.9	-61.6	0	0	0	0	112.7	D977 Y984	D977-S980 VanDerWaalsContact OD2-CB 3.24Å; D977-S980 WeakPolarHBondContact OD2-CB 3.2Å; D977-S980 PolarHBondContact OD2-N 3.12Å; D977-S980 PolarHBondContact OD2-OG 2.61Å; S980-Y984 WeakPolarHBondContact O-CB 3.36Å; S980-Y984 PolarHBondContact O-N 2.94Å
981	R	89	Confident	89.1	Confident	66 Å²	66	77.6 Å²	77.6	25%	0.249	36%	0.355	C	S	.	.	H	α-helix	trans	-66.5	-47.4	176	-68.7	164.5	-177.2	175.3	-11.8	111.7	W969 V972 L973 D977 R978 T979 Y984 L985	W969-R981 HydrophobicContact CH2-CB 4Å; W969-R981 HydrophobicContact CH2-CG 4.31Å; W969-R981 HydrophobicContact CZ3-CB 3.76Å; W969-R981 HydrophobicContact CZ3-CG 4.15Å; V972-R981 HydrophobicContact CB-CG 4.24Å; V972-R981 HydrophobicContact CG2-CG 4.19Å; V972-R981 WeakPolarHBondContact O-CG 3.41Å; V972-R981 PolarHBondContact O-NE 2.9Å; L973-R981 PolarHBondContact O-NH2 2.77Å; D977-R981 VanDerWaalsContact O-CD 3.25Å; D977-R981 WeakPolarHBondContact O-CD 3.46Å; D977-R981 VanDerWaalsContact O-CG 3.24Å; D977-R981 WeakPolarHBondContact O-CG 3.42Å; R978-R981 PolarHBondContact O-N 3.16Å; T979-R981 VanDerWaalsContact C-N 3.27Å; T979-R981 PolarHBondContact O-N 2.9Å; R981-Y984 PolarHBondContact O-N 2.93Å; R981-L985 VanDerWaalsContact O-CG 3.26Å; R981-L985 WeakPolarHBondContact O-CG 3.47Å; R981-L985 PolarHBondContact O-N 3.28Å
982	E	88.8	Confident	88.8	Confident	84 Å²	84	74.1 Å²	74.1	39%	0.393	34%	0.342	S	S	.	.	H	α-helix	trans	-62.5	-45	178.1	-72.2	174.7	-180	0	0	110.5	R978 T979 Y984 L985 E986	R978-E982 IonicContact CZ-OE1 3.26Å; R978-E982 IonicContact NE-OE1 3.89Å; R978-E982 PolarHBondContact NE-OE1 2.9Å; R978-E982 IonicContact NH2-OE1 2.64Å; R978-E982 PolarHBondContact NH2-OE1 2.8Å; R978-E982 VanDerWaalsContact NH2-OE1 3.08Å; R978-E982 PolarHBondContact O-N 2.76Å; T979-E982 PolarHBondContact O-N 3.26Å; E982-Y984 PolarHBondContact O-N 3.31Å; E982-L985 PolarHBondContact O-N 3.45Å; E982-E986 WeakPolarHBondContact O-CG 3.28Å; E982-E986 PolarHBondContact O-N 3.11Å
983	N	92.5	Very high	88.4	Confident	73 Å²	73	75.3 Å²	75.3	39%	0.39	35%	0.35	S	S	.	.	H	α-helix	trans	-59.6	-47.1	176.3	-67.9	-10.3	0	0	0	112.4	T979 L985 E986 E987	T979-N983 WeakPolarHBondContact O-CB 3.34Å; T979-N983 PolarHBondContact O-N 3.44Å; T979-N983 PolarHBondContact O-OD1 3.24Å; N983-L985 VanDerWaalsContact C-N 3.3Å; N983-L985 PolarHBondContact O-N 2.96Å; N983-E986 PolarHBondContact O-N 3.26Å; N983-E987 WeakPolarHBondContact O-CB 3.48Å; N983-E987 VanDerWaalsContact O-CG 3.31Å; N983-E987 WeakPolarHBondContact O-CG 3.37Å; N983-E987 PolarHBondContact O-N 2.84Å
984	Y	93.8	Very high	88.3	Confident	34 Å²	34	72.8 Å²	72.8	13%	0.133	34%	0.337	C	S	.	.	H	α-helix	trans	-62	-38.7	-179.5	-174.3	-91.7	0	0	0	112.5	R964 A965 G968 W969 V972 S980 R981 E982 N988 L990	R964-Y984 PolarHBondContact O-OH 3.05Å; A965-Y984 PolarHBondContact O-OH 3.33Å; A965-Y984 VanDerWaalsContact O-OH 3.09Å; G968-Y984 VanDerWaalsContact C-CZ 3.4Å; G968-Y984 VanDerWaalsContact CA-OH 3.31Å; G968-Y984 WeakPolarHBondContact CA-OH 3.31Å; W969-Y984 HydrophobicContact CB-CD1 4.23Å; W969-Y984 HydrophobicContact CB-CE1 3.86Å; W969-Y984 HydrophobicContact CE3-CD1 4.07Å; W969-Y984 VanDerWaalsContact N-CE1 3.27Å; V972-Y984 HydrophobicContact CG1-CD2 4.29Å; V972-Y984 HydrophobicContact CG1-CG 4.27Å; V972-Y984 HydrophobicContact CG2-CD1 4.26Å; V972-Y984 HydrophobicContact CG2-CG 4.1Å; S980-Y984 WeakPolarHBondContact O-CB 3.36Å; S980-Y984 PolarHBondContact O-N 2.94Å; R981-Y984 PolarHBondContact O-N 2.93Å; E982-Y984 PolarHBondContact O-N 3.31Å; Y984-N988 WeakPolarHBondContact CD2-ND2 3.45Å; Y984-N988 VanDerWaalsContact CE2-ND2 3.27Å; Y984-N988 WeakPolarHBondContact CE2-ND2 3.38Å; Y984-N988 WeakPolarHBondContact O-CB 3.39Å; Y984-N988 PolarHBondContact O-N 3.37Å; Y984-N988 VanDerWaalsContact O-N 3.14Å; Y984-N988 PolarHBondContact O-ND2 3.15Å; Y984-L990 HydrophobicContact CD1-CD1 3.99Å; Y984-L990 HydrophobicContact CE1-CD1 3.45Å; Y984-L990 VanDerWaalsContact CE1-CD1 3.45Å
985	L	91.5	Very high	88.5	Confident	27 Å²	27	65.1 Å²	65.1	14%	0.141	31%	0.308	C	S	.	.	H	α-helix	trans	-64.7	-44.5	175.6	-67.3	168.3	0	0	0	111.4	W969 R981 E982 N983 L989 L990 A992 L995	W969-L985 HydrophobicContact CD2-CD2 4.27Å; W969-L985 HydrophobicContact CE3-CD2 3.8Å; W969-L985 HydrophobicContact CE3-CG 4.03Å; W969-L985 HydrophobicContact CH2-CD1 3.78Å; W969-L985 HydrophobicContact CH2-CD2 4.08Å; W969-L985 HydrophobicContact CH2-CG 4.03Å; W969-L985 HydrophobicContact CZ3-CD1 3.78Å; W969-L985 HydrophobicContact CZ3-CD2 3.71Å; W969-L985 HydrophobicContact CZ3-CG 3.53Å; R981-L985 VanDerWaalsContact O-CG 3.26Å; R981-L985 WeakPolarHBondContact O-CG 3.47Å; R981-L985 PolarHBondContact O-N 3.28Å; E982-L985 PolarHBondContact O-N 3.45Å; N983-L985 VanDerWaalsContact C-N 3.3Å; N983-L985 PolarHBondContact O-N 2.96Å; L985-L989 CarbonylContact O-C 3.54Å; L985-L989 WeakPolarHBondContact O-CA 3.47Å; L985-L989 PolarHBondContact O-N 3.15Å; L985-L990 HydrophobicContact CD2-CB 3.83Å; L985-L990 PolarHBondContact O-N 2.97Å; L985-A992 HydrophobicContact CD1-CB 3.76Å; L985-A992 HydrophobicContact CD2-CB 4.14Å; L985-L995 HydrophobicContact CD2-CD1 3.59Å
986	E	89.4	Confident	88.8	Confident	144 Å²	144	64.1 Å²	64.1	67%	0.673	30%	0.304	S	S	*	.	H	α-helix	trans	-66.8	-47.2	179	-72	-176.9	-177.6	0	0	112	E982 N983 N988 L989	E982-E986 WeakPolarHBondContact O-CG 3.28Å; E982-E986 PolarHBondContact O-N 3.11Å; N983-E986 PolarHBondContact O-N 3.26Å; E986-N988 PolarHBondContact O-N 3.37Å; E986-L989 PolarHBondContact O-N 3.38Å
987	E	91.1	Very high	89.3	Confident	142 Å²	142	59 Å²	59	66%	0.664	28%	0.28	S	S	*	.	H	α-helix	trans	-62.9	-39.7	-178.7	-74.3	177.7	179.8	0	0	112.7	N983	N983-E987 WeakPolarHBondContact O-CB 3.48Å; N983-E987 VanDerWaalsContact O-CG 3.31Å; N983-E987 WeakPolarHBondContact O-CG 3.37Å; N983-E987 PolarHBondContact O-N 2.84Å
988	N	92.1	Very high	89.6	Confident	15 Å²	15	56.1 Å²	56.1	8%	0.08	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	8.6	-179.1	-63.2	-77.7	0	0	0	113.1	F934 V947 Y984 E986 L990	F934-N988 WeakPolarHBondContact CD1-O 3.12Å; V947-N988 HydrophobicContact CG1-CB 4.22Å; Y984-N988 WeakPolarHBondContact CD2-ND2 3.45Å; Y984-N988 VanDerWaalsContact CE2-ND2 3.27Å; Y984-N988 WeakPolarHBondContact CE2-ND2 3.38Å; Y984-N988 WeakPolarHBondContact O-CB 3.39Å; Y984-N988 PolarHBondContact O-N 3.37Å; Y984-N988 VanDerWaalsContact O-N 3.14Å; Y984-N988 PolarHBondContact O-ND2 3.15Å; E986-N988 PolarHBondContact O-N 3.37Å; N988-L990 HydrophobicContact CB-CD1 3.78Å; N988-L990 HydrophobicContact CB-CG 3.71Å; N988-L990 PolarHBondContact O-N 3.32Å
989	L	90.3	Very high	89.9	Confident	34 Å²	34	52.2 Å²	52.2	18%	0.178	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	40.5	-178.4	-56.7	175.7	0	0	0	112.4	F934 S935 E943 V944 V947 L985 E986	F934-L989 CarbonylContact C-O 3.57Å; F934-L989 WeakPolarHBondContact CA-O 3.33Å; S935-L989 WeakPolarHBondContact CB-O 3.43Å; S935-L989 PolarHBondContact N-O 3.05Å; S935-L989 VanDerWaalsContact OG-C 3.3Å; S935-L989 PolarHBondContact OG-O 2.74Å; E943-L989 HydrophobicContact CB-CD1 3.62Å; V944-L989 HydrophobicContact CG2-CB 4.4Å; V944-L989 HydrophobicContact CG2-CD1 4.02Å; V947-L989 HydrophobicContact CG2-CD1 3.99Å; V947-L989 HydrophobicContact CG2-CG 4.21Å; L985-L989 CarbonylContact O-C 3.54Å; L985-L989 WeakPolarHBondContact O-CA 3.47Å; L985-L989 PolarHBondContact O-N 3.15Å; E986-L989 PolarHBondContact O-N 3.38Å
990	L	91.2	Very high	90	Very high	8 Å²	8	49.4 Å²	49.4	4%	0.042	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-94.1	150.1	-176.6	-60.9	173.8	0	0	0	111.8	P933 F934 A965 Y984 L985 N988 L995	P933-L990 HydrophobicContact CB-CD2 4.19Å; F934-L990 HydrophobicContact CD1-CD2 3.65Å; F934-L990 HydrophobicContact CE1-CD2 3.69Å; F934-L990 HydrophobicContact CG-CD2 4.31Å; F934-L990 HydrophobicContact CZ-CD2 4.38Å; A965-L990 HydrophobicContact CB-CD1 4.44Å; A965-L990 HydrophobicContact CB-CD2 4.16Å; Y984-L990 HydrophobicContact CD1-CD1 3.99Å; Y984-L990 HydrophobicContact CE1-CD1 3.45Å; Y984-L990 VanDerWaalsContact CE1-CD1 3.45Å; L985-L990 HydrophobicContact CD2-CB 3.83Å; L985-L990 PolarHBondContact O-N 2.97Å; N988-L990 HydrophobicContact CB-CD1 3.78Å; N988-L990 HydrophobicContact CB-CG 3.71Å; N988-L990 PolarHBondContact O-N 3.32Å; L990-L995 HydrophobicContact CB-CD1 3.91Å; L990-L995 HydrophobicContact CD1-CD1 4.23Å
991	Y	85.5	Confident	90.3	Very high	54 Å²	54	47.8 Å²	47.8	21%	0.212	23%	0.228	C	C	.	.			trans	-108.6	108.3	179.8	-170.8	-110.7	0	0	0	111.9	P732 D735 P933 P993 S994 L995	P732-Y991 HydrophobicContact CB-CE1 3.67Å; P732-Y991 WeakPolarHBondContact CB-OH 3.33Å; P732-Y991 HydrophobicContact CG-CD1 3.84Å; P732-Y991 HydrophobicContact CG-CE1 2.96Å; P732-Y991 HydrophobicContact CG-CE2 4.44Å; P732-Y991 VanDerWaalsContact CG-OH 3.23Å; P732-Y991 WeakPolarHBondContact CG-OH 3.15Å; D735-Y991 PolarHBondContact OD2-OH 3.47Å; P933-Y991 PolarHBondContact O-N 3.27Å; Y991-P993 HydrophobicContact CD1-CB 4.14Å; Y991-P993 HydrophobicContact CD1-CG 4.09Å; Y991-P993 HydrophobicContact CE1-CB 3.45Å; Y991-P993 VanDerWaalsContact CE1-CB 3.45Å; Y991-P993 HydrophobicContact CE1-CG 3.32Å; Y991-P993 HydrophobicContact CE2-CG 4.17Å; Y991-P993 WeakPolarHBondContact OH-CG 3.28Å; Y991-S994 WeakPolarHBondContact O-CA 3.45Å; Y991-S994 WeakPolarHBondContact O-CB 3.41Å; Y991-S994 PolarHBondContact O-N 2.93Å; Y991-L995 PolarHBondContact O-N 2.97Å
992	A	86.1	Confident	90.6	Very high	17 Å²	17	45 Å²	45	14%	0.14	22%	0.217	C	C	.	.	H	α-helix	trans	-54.1	-41.7	-173	0	0	0	0	0	115	L985 S994 L995 R996	L985-A992 HydrophobicContact CD1-CB 3.76Å; L985-A992 HydrophobicContact CD2-CB 4.14Å; A992-S994 VanDerWaalsContact C-N 3.35Å; A992-S994 PolarHBondContact O-N 3.15Å; A992-L995 PolarHBondContact O-N 2.79Å; A992-R996 WeakPolarHBondContact O-CG 3.32Å; A992-R996 PolarHBondContact O-N 2.89Å
993	P	82.5	Confident	90.9	Very high	35 Å²	35	47.5 Å²	47.5	23%	0.227	23%	0.227	C	C	.	.	H	α-helix	trans	-66.9	-30.2	174.1	-17.1	27.8	0	0	0	114.3	Y991 F997	Y991-P993 HydrophobicContact CD1-CB 4.14Å; Y991-P993 HydrophobicContact CD1-CG 4.09Å; Y991-P993 HydrophobicContact CE1-CB 3.45Å; Y991-P993 VanDerWaalsContact CE1-CB 3.45Å; Y991-P993 HydrophobicContact CE1-CG 3.32Å; Y991-P993 HydrophobicContact CE2-CG 4.17Å; Y991-P993 WeakPolarHBondContact OH-CG 3.28Å; P993-F997 PolarHBondContact O-N 3.3Å; P993-F997 VanDerWaalsContact O-N 3.12Å
994	S	87.4	Confident	90.9	Very high	5 Å²	5	44.6 Å²	44.6	4%	0.035	21%	0.211	C	C	.	.	H	α-helix	trans	-65.7	-45	170.5	-79.7	0	0	0	0	110.4	R931 D932 Y991 A992 R996 F997 I998	R931-S994 PolarHBondContact NE-OG 3.15Å; R931-S994 VanDerWaalsContact NE-OG 3.1Å; R931-S994 PolarHBondContact NH2-OG 3.28Å; D932-S994 WeakPolarHBondContact O-CB 3.28Å; D932-S994 PolarHBondContact O-OG 2.9Å; Y991-S994 WeakPolarHBondContact O-CA 3.45Å; Y991-S994 WeakPolarHBondContact O-CB 3.41Å; Y991-S994 PolarHBondContact O-N 2.93Å; A992-S994 VanDerWaalsContact C-N 3.35Å; A992-S994 PolarHBondContact O-N 3.15Å; S994-R996 VanDerWaalsContact C-N 3.34Å; S994-R996 PolarHBondContact O-N 3.47Å; S994-F997 WeakPolarHBondContact O-CA 3.47Å; S994-F997 WeakPolarHBondContact O-CB 3.12Å; S994-F997 PolarHBondContact O-N 2.84Å; S994-F997 VanDerWaalsContact O-N 3.07Å; S994-I998 WeakPolarHBondContact O-CG1 3.46Å; S994-I998 PolarHBondContact O-N 2.79Å
995	L	92	Very high	91	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.1	-41.3	176.6	-71.4	165	0	0	0	112.5	P933 V966 W969 L985 L990 Y991 A992 F997 I998 H999	P933-L995 HydrophobicContact CB-CD2 4Å; V966-L995 HydrophobicContact CG2-CD2 4.07Å; W969-L995 HydrophobicContact CB-CD1 4.26Å; W969-L995 HydrophobicContact CD2-CD1 3.85Å; W969-L995 HydrophobicContact CG-CD1 3.68Å; W969-L995 HydrophobicContact CG-CD2 4.46Å; W969-L995 HydrophobicContact CG-CG 4.5Å; L985-L995 HydrophobicContact CD2-CD1 3.59Å; L990-L995 HydrophobicContact CB-CD1 3.91Å; L990-L995 HydrophobicContact CD1-CD1 4.23Å; Y991-L995 PolarHBondContact O-N 2.97Å; A992-L995 PolarHBondContact O-N 2.79Å; L995-F997 VanDerWaalsContact C-N 3.31Å; L995-F997 PolarHBondContact O-N 2.93Å; L995-I998 HydrophobicContact CD2-CD1 4.45Å; L995-I998 WeakPolarHBondContact O-CB 3.44Å; L995-I998 PolarHBondContact O-N 3.43Å; L995-H999 PolarHBondContact O-CD2 3.47Å; L995-H999 PolarHBondContact O-N 3.31Å
996	R	89.9	Confident	91.3	Very high	135 Å²	135	41.9 Å²	41.9	51%	0.509	20%	0.199	S	C	.	.	H	α-helix	trans	-61.7	-38.8	172.9	-72.6	-169.4	-66.2	-91.8	9.8	112.5	A992 S994 G1000	A992-R996 WeakPolarHBondContact O-CG 3.32Å; A992-R996 PolarHBondContact O-N 2.89Å; S994-R996 VanDerWaalsContact C-N 3.34Å; S994-R996 PolarHBondContact O-N 3.47Å; R996-G1000 PolarHBondContact O-N 3.18Å
997	F	87.7	Confident	91.5	Very high	56 Å²	56	39 Å²	39	25%	0.246	19%	0.186	C	C	.	.	H	α-helix	trans	-67	-41.2	175.4	-173.2	-96.2	0	0	0	111.6	L544 R931 P993 S994 L995 G1000 L1001	L544-F997 HydrophobicContact CD1-CD2 3.85Å; L544-F997 HydrophobicContact CD1-CE2 3.63Å; L544-F997 HydrophobicContact CD1-CG 4.43Å; L544-F997 HydrophobicContact CD1-CZ 4.05Å; R931-F997 HydrophobicContact CB-CD1 3.76Å; R931-F997 HydrophobicContact CB-CE1 4.1Å; R931-F997 HydrophobicContact CG-CD1 3.77Å; R931-F997 HydrophobicContact CG-CE1 4.42Å; P993-F997 PolarHBondContact O-N 3.3Å; P993-F997 VanDerWaalsContact O-N 3.12Å; S994-F997 WeakPolarHBondContact O-CA 3.47Å; S994-F997 WeakPolarHBondContact O-CB 3.12Å; S994-F997 PolarHBondContact O-N 2.84Å; S994-F997 VanDerWaalsContact O-N 3.07Å; L995-F997 VanDerWaalsContact C-N 3.31Å; L995-F997 PolarHBondContact O-N 2.93Å; F997-G1000 CarbonylContact O-C 3.56Å; F997-G1000 WeakPolarHBondContact O-CA 3.37Å; F997-G1000 PolarHBondContact O-N 3.02Å; F997-G1000 VanDerWaalsContact O-N 3.13Å; F997-L1001 HydrophobicContact CD1-CD1 3.94Å; F997-L1001 HydrophobicContact CD1-CG 4.11Å; F997-L1001 HydrophobicContact CE1-CD1 3.67Å; F997-L1001 HydrophobicContact CE1-CD2 4.13Å; F997-L1001 HydrophobicContact CE1-CG 3.85Å; F997-L1001 HydrophobicContact CZ-CD2 4.34Å; F997-L1001 HydrophobicContact CZ-CG 4.45Å; F997-L1001 PolarHBondContact O-N 3.23Å
998	I	93.4	Very high	91.6	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-59.2	-47.3	174.2	-70.6	162.5	0	0	0	110.6	R931 P933 V966 S994 L995 G1000 L1001 I1002	R931-I998 HydrophobicContact CB-CG1 4.2Å; R931-I998 HydrophobicContact CG-CG1 4.42Å; R931-I998 WeakPolarHBondContact O-CD1 3.11Å; P933-I998 HydrophobicContact CB-CD1 3.63Å; P933-I998 HydrophobicContact CG-CD1 4.39Å; V966-I998 HydrophobicContact CG2-CG2 4.43Å; S994-I998 WeakPolarHBondContact O-CG1 3.46Å; S994-I998 PolarHBondContact O-N 2.79Å; L995-I998 HydrophobicContact CD2-CD1 4.45Å; L995-I998 WeakPolarHBondContact O-CB 3.44Å; L995-I998 PolarHBondContact O-N 3.43Å; I998-G1000 VanDerWaalsContact C-N 3.26Å; I998-G1000 PolarHBondContact O-N 3.17Å; I998-L1001 WeakPolarHBondContact O-CB 3.29Å; I998-L1001 PolarHBondContact O-N 2.94Å; I998-I1002 HydrophobicContact CG2-CD1 4.1Å; I998-I1002 WeakPolarHBondContact O-CG1 3.5Å; I998-I1002 PolarHBondContact O-N 2.93Å
999	H	94.2	Very high	91.7	Very high	54 Å²	54	31.7 Å²	31.7	25%	0.25	15%	0.151	C	C	.	.	H	α-helix	trans	-59.7	-37.9	174.1	-71.9	-170.3	0	0	0	112.3	W969 E970 L995 I1002 K1003	W969-H999 AromaticContact CD1-CE1 3.95Å; W969-H999 AromaticContact CD1-NE2 3.96Å; E970-H999 IonicContact OE1-NE2 2.75Å; L995-H999 PolarHBondContact O-CD2 3.47Å; L995-H999 PolarHBondContact O-N 3.31Å; H999-I1002 PolarHBondContact O-N 2.95Å; H999-K1003 PolarHBondContact O-N 2.63Å
1000	G	93.2	Very high	91.9	Very high	21 Å²	21	35.3 Å²	35.3	22%	0.216	16%	0.164	C	C	.	.	H	α-helix	trans	-62.3	-41.9	172.9	0	0	0	0	0	112.7	L544 R996 F997 I998 K1003 Q1004	L544-G1000 WeakPolarHBondContact CD2-O 3.19Å; R996-G1000 PolarHBondContact O-N 3.18Å; F997-G1000 CarbonylContact O-C 3.56Å; F997-G1000 WeakPolarHBondContact O-CA 3.37Å; F997-G1000 PolarHBondContact O-N 3.02Å; F997-G1000 VanDerWaalsContact O-N 3.13Å; I998-G1000 VanDerWaalsContact C-N 3.26Å; I998-G1000 PolarHBondContact O-N 3.17Å; G1000-K1003 PolarHBondContact O-N 3.3Å; G1000-Q1004 PolarHBondContact O-N 3.38Å
1001	L	93.9	Very high	91.8	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.6	-44.9	174.5	-72.3	177.7	0	0	0	111.8	L544 T930 F997 I998 K1003 Q1004 F1005	L544-L1001 HydrophobicContact CD1-CD2 4.05Å; L544-L1001 HydrophobicContact CD1-CG 4.15Å; T930-L1001 HydrophobicContact CG2-CD1 3.79Å; F997-L1001 HydrophobicContact CD1-CD1 3.94Å; F997-L1001 HydrophobicContact CD1-CG 4.11Å; F997-L1001 HydrophobicContact CE1-CD1 3.67Å; F997-L1001 HydrophobicContact CE1-CD2 4.13Å; F997-L1001 HydrophobicContact CE1-CG 3.85Å; F997-L1001 HydrophobicContact CZ-CD2 4.34Å; F997-L1001 HydrophobicContact CZ-CG 4.45Å; F997-L1001 PolarHBondContact O-N 3.23Å; I998-L1001 WeakPolarHBondContact O-CB 3.29Å; I998-L1001 PolarHBondContact O-N 2.94Å; L1001-K1003 VanDerWaalsContact C-N 3.32Å; L1001-K1003 PolarHBondContact O-N 3.25Å; L1001-Q1004 PolarHBondContact O-N 3.14Å; L1001-F1005 HydrophobicContact CB-CD2 4.29Å; L1001-F1005 HydrophobicContact CB-CE2 3.96Å; L1001-F1005 WeakPolarHBondContact O-CD2 3.35Å; L1001-F1005 WeakPolarHBondContact O-CG 3.15Å; L1001-F1005 PolarHBondContact O-N 3.17Å
1002	I	96.4	Very high	92.1	Very high	6 Å²	6	37.5 Å²	37.5	3%	0.031	18%	0.175	C	C	.	.	H	α-helix	trans	-55.3	-50.6	175.9	-67.2	168.2	0	0	0	109.4	L923 V924 S927 I998 H999 Q1004 F1005 S1006 T1022	L923-I1002 HydrophobicContact CB-CG2 4.46Å; L923-I1002 HydrophobicContact CD1-CG2 4.48Å; V924-I1002 HydrophobicContact CG2-CD1 3.86Å; S927-I1002 WeakPolarHBondContact OG-CG1 3.35Å; I998-I1002 HydrophobicContact CG2-CD1 4.1Å; I998-I1002 WeakPolarHBondContact O-CG1 3.5Å; I998-I1002 PolarHBondContact O-N 2.93Å; H999-I1002 PolarHBondContact O-N 2.95Å; I1002-Q1004 PolarHBondContact O-N 3.32Å; I1002-F1005 PolarHBondContact O-N 2.79Å; I1002-S1006 PolarHBondContact O-N 2.85Å; I1002-S1006 PolarHBondContact O-OG 3.45Å; I1002-T1022 HydrophobicContact CG2-CG2 3.66Å
1003	K	95.2	Very high	92.5	Very high	137 Å²	137	40.3 Å²	40.3	60%	0.596	18%	0.184	S	C	*	.	H	α-helix	trans	-57.6	-46.1	177.1	-175.8	-178.6	175.6	-174.8	0	112.5	H999 G1000 L1001 F1005 S1006 E1007	H999-K1003 PolarHBondContact O-N 2.63Å; G1000-K1003 PolarHBondContact O-N 3.3Å; L1001-K1003 VanDerWaalsContact C-N 3.32Å; L1001-K1003 PolarHBondContact O-N 3.25Å; K1003-F1005 PolarHBondContact O-N 3.33Å; K1003-S1006 WeakPolarHBondContact O-CB 3.41Å; K1003-S1006 PolarHBondContact O-N 3.09Å; K1003-E1007 WeakPolarHBondContact CE-OE1 3.41Å; K1003-E1007 PolarHBondContact O-N 3.33Å
1004	Q	93.2	Very high	93.1	Very high	13 Å²	13	38.8 Å²	38.8	6%	0.061	17%	0.174	C	C	.	.	H	α-helix	trans	-63.5	-41.3	178.6	-171.2	-158.3	-28.1	0	0	111.7	L544 S901 G1000 L1001 I1002 S1006 E1007 N1008	L544-Q1004 HydrophobicContact CD2-CB 3.62Å; L544-Q1004 HydrophobicContact CD2-CG 4.15Å; S901-Q1004 PolarHBondContact OG-NE2 2.98Å; G1000-Q1004 PolarHBondContact O-N 3.38Å; L1001-Q1004 PolarHBondContact O-N 3.14Å; I1002-Q1004 PolarHBondContact O-N 3.32Å; Q1004-S1006 VanDerWaalsContact C-N 3.34Å; Q1004-E1007 PolarHBondContact O-N 3.14Å; Q1004-N1008 PolarHBondContact O-N 3.37Å; Q1004-N1008 PolarHBondContact O-ND2 3.16Å; Q1004-N1008 PolarHBondContact O-OD1 3.11Å
1005	F	95.7	Very high	93.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-66.3	-38.4	176.1	-66.1	-45.7	0	0	0	111.1	I900 T902 I910 L923 V926 L1001 I1002 K1003 E1007 N1008 I1009	I900-F1005 HydrophobicContact CG2-CD1 4.18Å; T902-F1005 HydrophobicContact CG2-CE1 4.48Å; I910-F1005 HydrophobicContact CD1-CG 4.46Å; L923-F1005 HydrophobicContact CD2-CB 3.48Å; L923-F1005 VanDerWaalsContact CD2-CB 3.48Å; L923-F1005 HydrophobicContact CD2-CD2 4.38Å; L923-F1005 HydrophobicContact CD2-CG 4.3Å; V926-F1005 HydrophobicContact CG1-CE2 3.89Å; V926-F1005 HydrophobicContact CG1-CZ 4.03Å; L1001-F1005 HydrophobicContact CB-CD2 4.29Å; L1001-F1005 HydrophobicContact CB-CE2 3.96Å; L1001-F1005 WeakPolarHBondContact O-CD2 3.35Å; L1001-F1005 WeakPolarHBondContact O-CG 3.15Å; L1001-F1005 PolarHBondContact O-N 3.17Å; I1002-F1005 PolarHBondContact O-N 2.79Å; K1003-F1005 PolarHBondContact O-N 3.33Å; F1005-E1007 VanDerWaalsContact C-N 3.3Å; F1005-E1007 PolarHBondContact O-N 3.36Å; F1005-N1008 PolarHBondContact O-N 3.37Å; F1005-N1008 VanDerWaalsContact O-N 3.15Å; F1005-I1009 WeakPolarHBondContact O-CB 3.34Å; F1005-I1009 VanDerWaalsContact O-CD1 3.32Å; F1005-I1009 WeakPolarHBondContact O-CD1 3.28Å; F1005-I1009 WeakPolarHBondContact O-CG1 3.34Å; F1005-I1009 PolarHBondContact O-N 3.36Å
1006	S	96.8	Very high	93.4	Very high	4 Å²	4	40.2 Å²	40.2	3%	0.028	19%	0.189	C	C	.	.	H	α-helix	trans	-58.4	-40	173	-56.2	0	0	0	0	112.9	I1002 K1003 Q1004 Y1010 P1018 C1021	I1002-S1006 PolarHBondContact O-N 2.85Å; I1002-S1006 PolarHBondContact O-OG 3.45Å; K1003-S1006 WeakPolarHBondContact O-CB 3.41Å; K1003-S1006 PolarHBondContact O-N 3.09Å; Q1004-S1006 VanDerWaalsContact C-N 3.34Å; S1006-Y1010 WeakPolarHBondContact O-CB 3.21Å; S1006-Y1010 PolarHBondContact O-N 3.26Å; S1006-Y1010 VanDerWaalsContact O-N 3.11Å; S1006-P1018 WeakPolarHBondContact CB-O 3.21Å; S1006-C1021 WeakPolarHBondContact OG-CB 3.47Å
1007	E	94.2	Very high	93.6	Very high	82 Å²	82	40 Å²	40	38%	0.383	19%	0.192	S	C	.	.	H	α-helix	trans	-63.7	-47.8	173	-70.1	167.9	-175.5	0	0	110.9	K1003 Q1004 F1005 I1009 Y1010 E1011 P1018	K1003-E1007 WeakPolarHBondContact CE-OE1 3.41Å; K1003-E1007 PolarHBondContact O-N 3.33Å; Q1004-E1007 PolarHBondContact O-N 3.14Å; F1005-E1007 VanDerWaalsContact C-N 3.3Å; F1005-E1007 PolarHBondContact O-N 3.36Å; E1007-I1009 VanDerWaalsContact C-N 3.33Å; E1007-I1009 PolarHBondContact O-N 2.97Å; E1007-Y1010 WeakPolarHBondContact O-CB 3.46Å; E1007-Y1010 PolarHBondContact O-N 2.78Å; E1007-E1011 WeakPolarHBondContact O-CG 3.49Å; E1007-E1011 PolarHBondContact O-N 3.26Å; E1007-P1018 HydrophobicContact CG-CB 4.49Å
1008	N	93.1	Very high	93.9	Very high	5 Å²	5	39.6 Å²	39.6	3%	0.027	20%	0.195	C	C	.	.	H	α-helix	trans	-61.8	-37.7	177.7	-58.4	-14	0	0	0	112.9	H899 I900 S901 Q1004 F1005 Y1010 E1011 A1012	H899-N1008 WeakPolarHBondContact O-CB 3.24Å; I900-N1008 HydrophobicContact CG1-CB 4.41Å; S901-N1008 PolarHBondContact OG-ND2 2.97Å; Q1004-N1008 PolarHBondContact O-N 3.37Å; Q1004-N1008 PolarHBondContact O-ND2 3.16Å; Q1004-N1008 PolarHBondContact O-OD1 3.11Å; F1005-N1008 PolarHBondContact O-N 3.37Å; F1005-N1008 VanDerWaalsContact O-N 3.15Å; N1008-Y1010 VanDerWaalsContact C-N 3.34Å; N1008-E1011 PolarHBondContact O-N 2.68Å; N1008-A1012 WeakPolarHBondContact O-CB 3.4Å; N1008-A1012 PolarHBondContact O-N 2.64Å
1009	I	94.7	Very high	94	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-69.3	-36.6	180	-68	160.5	0	0	0	110.4	I900 I910 L919 L923 F1005 E1007 A1012 F1013 L1014 V1015	I900-I1009 HydrophobicContact CD1-CG1 4.44Å; I910-I1009 HydrophobicContact CG2-CD1 3.36Å; I910-I1009 HydrophobicContact CG2-CG1 3.56Å; L919-I1009 HydrophobicContact CD1-CD1 4.01Å; L919-I1009 HydrophobicContact CD2-CD1 4.26Å; L919-I1009 HydrophobicContact CD2-CG2 4.31Å; L923-I1009 HydrophobicContact CD1-CD1 4.17Å; L923-I1009 HydrophobicContact CD2-CD1 3.59Å; L923-I1009 HydrophobicContact CG-CD1 4.26Å; F1005-I1009 WeakPolarHBondContact O-CB 3.34Å; F1005-I1009 VanDerWaalsContact O-CD1 3.32Å; F1005-I1009 WeakPolarHBondContact O-CD1 3.28Å; F1005-I1009 WeakPolarHBondContact O-CG1 3.34Å; F1005-I1009 PolarHBondContact O-N 3.36Å; E1007-I1009 VanDerWaalsContact C-N 3.33Å; E1007-I1009 PolarHBondContact O-N 2.97Å; I1009-A1012 CarbonylContact O-C 3.52Å; I1009-A1012 PolarHBondContact O-N 3.09Å; I1009-F1013 PolarHBondContact O-N 3.21Å; I1009-L1014 HydrophobicContact CG2-CB 3.6Å; I1009-L1014 HydrophobicContact CG2-CD1 4.28Å; I1009-L1014 PolarHBondContact O-N 3.01Å; I1009-V1015 HydrophobicContact CG2-CB 4.48Å; I1009-V1015 HydrophobicContact CG2-CG1 3.85Å; I1009-V1015 HydrophobicContact CG2-CG2 3.99Å
1010	Y	94.1	Very high	94.1	Very high	110 Å²	110	42.2 Å²	42.2	43%	0.431	22%	0.216	S	C	.	.	H	α-helix	trans	-64.1	-46.6	171.1	171.3	-107.4	0	0	0	111.3	S1006 E1007 N1008 A1012 F1013 V1015 G1016 P1018	S1006-Y1010 WeakPolarHBondContact O-CB 3.21Å; S1006-Y1010 PolarHBondContact O-N 3.26Å; S1006-Y1010 VanDerWaalsContact O-N 3.11Å; E1007-Y1010 WeakPolarHBondContact O-CB 3.46Å; E1007-Y1010 PolarHBondContact O-N 2.78Å; N1008-Y1010 VanDerWaalsContact C-N 3.34Å; Y1010-A1012 PolarHBondContact O-N 3.09Å; Y1010-F1013 WeakPolarHBondContact O-CA 3.44Å; Y1010-F1013 PolarHBondContact O-N 3.01Å; Y1010-V1015 WeakPolarHBondContact CD2-O 3.44Å; Y1010-G1016 VanDerWaalsContact CE2-O 3.27Å; Y1010-G1016 WeakPolarHBondContact CE2-O 3.47Å; Y1010-P1018 HydrophobicContact CD1-CG 4.09Å; Y1010-P1018 HydrophobicContact CG-CG 3.91Å
1011	E	89.4	Confident	94.2	Very high	107 Å²	107	41.2 Å²	41.2	50%	0.5	21%	0.206	S	C	.	.	H	α-helix	trans	-62.4	-27.2	173.7	-69.6	178.8	-179.1	0	0	112.7	E1007 N1008 F1013	E1007-E1011 WeakPolarHBondContact O-CG 3.49Å; E1007-E1011 PolarHBondContact O-N 3.26Å; N1008-E1011 PolarHBondContact O-N 2.68Å; E1011-F1013 VanDerWaalsContact O-CD2 3.29Å; E1011-F1013 WeakPolarHBondContact O-CD2 3.4Å; E1011-F1013 WeakPolarHBondContact O-CE2 3.27Å; E1011-F1013 PolarHBondContact O-N 3.05Å
1012	A	92.1	Very high	94.2	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	1.6	171.2	0	0	0	0	0	113.4	R896 H899 N1008 I1009 Y1010 L1014	R896-A1012 WeakPolarHBondContact CD-O 3.25Å; R896-A1012 PolarHBondContact NH1-O 2.83Å; H899-A1012 HydrophobicContact CB-CB 4.07Å; N1008-A1012 WeakPolarHBondContact O-CB 3.4Å; N1008-A1012 PolarHBondContact O-N 2.64Å; I1009-A1012 CarbonylContact O-C 3.52Å; I1009-A1012 PolarHBondContact O-N 3.09Å; Y1010-A1012 PolarHBondContact O-N 3.09Å; A1012-L1014 VanDerWaalsContact C-N 3.28Å; A1012-L1014 HydrophobicContact CB-CD1 3.93Å; A1012-L1014 HydrophobicContact CB-CG 4.13Å; A1012-L1014 PolarHBondContact O-N 2.94Å
1013	F	93.9	Very high	94.2	Very high	76 Å²	76	47.8 Å²	47.8	33%	0.333	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	31.9	-178.9	-48.4	-92.6	0	0	0	114.4	I1009 Y1010 E1011 E1179 L1180	I1009-F1013 PolarHBondContact O-N 3.21Å; Y1010-F1013 WeakPolarHBondContact O-CA 3.44Å; Y1010-F1013 PolarHBondContact O-N 3.01Å; E1011-F1013 VanDerWaalsContact O-CD2 3.29Å; E1011-F1013 WeakPolarHBondContact O-CD2 3.4Å; E1011-F1013 WeakPolarHBondContact O-CE2 3.27Å; E1011-F1013 PolarHBondContact O-N 3.05Å; F1013-E1179 HydrophobicContact CB-CB 4.04Å; F1013-E1179 HydrophobicContact CB-CG 4Å; F1013-E1179 HydrophobicContact CD1-CG 4.49Å; F1013-L1180 PolarHBondContact O-N 2.73Å
1014	L	94.2	Very high	94.1	Very high	3 Å²	3	46.7 Å²	46.7	2%	0.016	25%	0.25	C	C	.	.	S	Bend	trans	-98.6	-11.7	-179.8	-66.6	169.8	0	0	0	113	V911 A914 I1009 A1012 L1180	V911-L1014 HydrophobicContact CB-CD1 4.15Å; V911-L1014 HydrophobicContact CG1-CD1 4Å; V911-L1014 HydrophobicContact CG1-CD2 4.22Å; V911-L1014 HydrophobicContact CG2-CD1 3.83Å; A914-L1014 HydrophobicContact CB-CB 4.07Å; I1009-L1014 HydrophobicContact CG2-CB 3.6Å; I1009-L1014 HydrophobicContact CG2-CD1 4.28Å; I1009-L1014 PolarHBondContact O-N 3.01Å; A1012-L1014 VanDerWaalsContact C-N 3.28Å; A1012-L1014 HydrophobicContact CB-CD1 3.93Å; A1012-L1014 HydrophobicContact CB-CG 4.13Å; A1012-L1014 PolarHBondContact O-N 2.94Å; L1014-L1180 WeakPolarHBondContact O-CD2 3.44Å
1015	V	94.6	Very high	94.2	Very high	5 Å²	5	51 Å²	51	3%	0.03	28%	0.281	C	S	.	.	S	Bend	trans	-141.6	154.4	175.1	-65.1	0	0	0	0	109.9	L919 I1009 Y1010 K1017 C1028	L919-V1015 HydrophobicContact CD2-CG1 3.99Å; I1009-V1015 HydrophobicContact CG2-CB 4.48Å; I1009-V1015 HydrophobicContact CG2-CG1 3.85Å; I1009-V1015 HydrophobicContact CG2-CG2 3.99Å; Y1010-V1015 WeakPolarHBondContact CD2-O 3.44Å; V1015-K1017 WeakPolarHBondContact CG2-O 3.33Å; V1015-C1028 HydrophobicContact CG1-CB 4.27Å
1016	G	91.3	Very high	94.2	Very high	31 Å²	31	51.5 Å²	51.5	32%	0.32	29%	0.286	S	S	.	.	S	Bend	trans	-74.6	-31.3	178.6	0	0	0	0	0	113	Y1010	Y1010-G1016 VanDerWaalsContact CE2-O 3.27Å; Y1010-G1016 WeakPolarHBondContact CE2-O 3.47Å
1017	K	93.5	Very high	94	Very high	130 Å²	130	55.5 Å²	55.5	57%	0.565	30%	0.304	S	S	*	.	S	Bend	trans	-144.3	148.9	175.6	-59.8	176	-173.4	170.4	0	110.9	V1015 S1019 D1020	V1015-K1017 WeakPolarHBondContact CG2-O 3.33Å; K1017-S1019 PolarHBondContact O-N 3.29Å; K1017-S1019 VanDerWaalsContact O-N 3.17Å; K1017-D1020 PolarHBondContact N-OD2 2.63Å; K1017-D1020 WeakPolarHBondContact O-CB 3.45Å; K1017-D1020 PolarHBondContact O-N 2.87Å
1018	P	94.4	Very high	94	Very high	47 Å²	47	52.2 Å²	52.2	31%	0.305	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-56.6	-32.9	174.8	-25.8	33.7	0	0	0	113.7	S1006 E1007 Y1010 D1020 C1021	S1006-P1018 WeakPolarHBondContact CB-O 3.21Å; E1007-P1018 HydrophobicContact CG-CB 4.49Å; Y1010-P1018 HydrophobicContact CD1-CG 4.09Å; Y1010-P1018 HydrophobicContact CG-CG 3.91Å; P1018-D1020 PolarHBondContact O-N 3Å; P1018-C1021 WeakPolarHBondContact O-CB 3.43Å; P1018-C1021 PolarHBondContact O-N 2.99Å
1019	S	95.2	Very high	94.2	Very high	69 Å²	69	52.3 Å²	52.3	48%	0.483	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-63.9	-26.4	178.4	51.9	0	0	0	0	113.8	K1017 C1021 T1022 L1023	K1017-S1019 PolarHBondContact O-N 3.29Å; K1017-S1019 VanDerWaalsContact O-N 3.17Å; S1019-C1021 PolarHBondContact O-N 3.2Å; S1019-T1022 PolarHBondContact O-N 3.23Å; S1019-T1022 PolarHBondContact O-OG1 2.81Å; S1019-L1023 PolarHBondContact O-N 2.96Å
1020	D	96.2	Very high	94.4	Very high	40 Å²	40	56.9 Å²	56.9	21%	0.214	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-64.8	-30.8	-176.9	-61	-15.8	0	0	0	110.7	K1017 P1018 T1022 L1023 A1026 C1028 N1029	K1017-D1020 PolarHBondContact N-OD2 2.63Å; K1017-D1020 WeakPolarHBondContact O-CB 3.45Å; K1017-D1020 PolarHBondContact O-N 2.87Å; P1018-D1020 PolarHBondContact O-N 3Å; D1020-T1022 PolarHBondContact O-N 3.28Å; D1020-T1022 VanDerWaalsContact O-N 3.14Å; D1020-L1023 PolarHBondContact O-N 2.55Å; D1020-A1026 HydrophobicContact CB-CB 3.86Å; D1020-A1026 WeakPolarHBondContact O-CB 2.94Å; D1020-C1028 PolarHBondContact O-SG 2.85Å; D1020-N1029 PolarHBondContact O-ND2 3.37Å
1021	C	96.5	Very high	94.5	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-57.6	-30.3	180	-64.3	0	0	0	0	113.9	L919 H920 L923 S1006 P1018 S1019 N1029	L919-C1021 HydrophobicContact CD2-CB 4.07Å; H920-C1021 WeakPolarHBondContact CB-O 3.42Å; L923-C1021 HydrophobicContact CD1-CB 3.72Å; S1006-C1021 WeakPolarHBondContact OG-CB 3.47Å; P1018-C1021 WeakPolarHBondContact O-CB 3.43Å; P1018-C1021 PolarHBondContact O-N 2.99Å; S1019-C1021 PolarHBondContact O-N 3.2Å; C1021-N1029 PolarHBondContact O-ND2 3.1Å; C1021-N1029 VanDerWaalsContact O-ND2 3.14Å
1022	T	94.3	Very high	94.9	Very high	66 Å²	66	48.4 Å²	48.4	41%	0.405	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-109.9	-4.7	-178.7	55.8	0	0	0	0	113.2	I1002 S1019 D1020 P1024	I1002-T1022 HydrophobicContact CG2-CG2 3.66Å; S1019-T1022 PolarHBondContact O-N 3.23Å; S1019-T1022 PolarHBondContact O-OG1 2.81Å; D1020-T1022 PolarHBondContact O-N 3.28Å; D1020-T1022 VanDerWaalsContact O-N 3.14Å; T1022-P1024 WeakPolarHBondContact O-CD 3.35Å
1023	L	94.9	Very high	95	Very high	79 Å²	79	56.4 Å²	56.4	41%	0.414	32%	0.315	S	S	.	.			trans	-85.2	118.5	-177.7	-175.4	68.4	0	0	0	109.4	S1019 D1020 S1025 A1026 N1029	S1019-L1023 PolarHBondContact O-N 2.96Å; D1020-L1023 PolarHBondContact O-N 2.55Å; L1023-S1025 WeakPolarHBondContact CD2-OG 3.37Å; L1023-S1025 WeakPolarHBondContact CG-OG 3.44Å; L1023-S1025 PolarHBondContact O-N 2.97Å; L1023-A1026 HydrophobicContact CB-CB 4.09Å; L1023-A1026 HydrophobicContact CD2-CB 4.43Å; L1023-A1026 WeakPolarHBondContact O-CB 3.42Å; L1023-A1026 PolarHBondContact O-N 2.62Å; L1023-N1029 PolarHBondContact O-ND2 3.46Å
1024	P	93.2	Very high	95.2	Very high	113 Å²	113	54.8 Å²	54.8	73%	0.734	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-27.8	-178.8	-25.1	35.5	0	0	0	113.6	T1022 A1026	T1022-P1024 WeakPolarHBondContact O-CD 3.35Å; P1024-A1026 VanDerWaalsContact C-N 3.33Å
1025	S	94.9	Very high	95.2	Very high	103 Å²	103	58 Å²	58	72%	0.72	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-2.8	177.9	61.8	0	0	0	0	114.2	L1023	L1023-S1025 WeakPolarHBondContact CD2-OG 3.37Å; L1023-S1025 WeakPolarHBondContact CG-OG 3.44Å; L1023-S1025 PolarHBondContact O-N 2.97Å
1026	A	95.6	Very high	95.2	Very high	11 Å²	11	59.7 Å²	59.7	9%	0.091	33%	0.331	C	S	.	.	S	Bend	trans	-74.5	145.5	175.8	0	0	0	0	0	111.3	D1020 L1023 P1024 C1028 N1029	D1020-A1026 HydrophobicContact CB-CB 3.86Å; D1020-A1026 WeakPolarHBondContact O-CB 2.94Å; L1023-A1026 HydrophobicContact CB-CB 4.09Å; L1023-A1026 HydrophobicContact CD2-CB 4.43Å; L1023-A1026 WeakPolarHBondContact O-CB 3.42Å; L1023-A1026 PolarHBondContact O-N 2.62Å; P1024-A1026 VanDerWaalsContact C-N 3.33Å; A1026-C1028 PolarHBondContact O-N 3.31Å; A1026-N1029 PolarHBondContact O-N 3.41Å
1027	Q	93.8	Very high	95.5	Very high	88 Å²	88	58.3 Å²	58.3	41%	0.411	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-58.5	-34.9	-178.5	-172.9	-178.1	46.4	0	0	112.7	R917 N1029 E1030	R917-Q1027 VanDerWaalsContact CB-O 3.25Å; R917-Q1027 WeakPolarHBondContact CB-O 3.28Å; R917-Q1027 WeakPolarHBondContact CD-O 3.45Å; R917-Q1027 VanDerWaalsContact CG-O 3.26Å; R917-Q1027 WeakPolarHBondContact CG-O 3.34Å; Q1027-N1029 PolarHBondContact O-N 2.84Å; Q1027-N1029 VanDerWaalsContact O-N 3.08Å; Q1027-E1030 WeakPolarHBondContact O-CB 3.46Å; Q1027-E1030 PolarHBondContact O-N 2.88Å
1028	C	95	Very high	95.8	Very high	14 Å²	14	52.3 Å²	52.3	10%	0.095	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-67.2	-4.9	177.2	60.4	0	0	0	0	114.2	R917 C918 L919 V1015 D1020 A1026	R917-C1028 CarbonylContact C-O 3.49Å; R917-C1028 WeakPolarHBondContact CA-O 3.31Å; C918-C1028 PolarHBondContact N-O 3.36Å; L919-C1028 HydrophobicContact CB-CB 4.41Å; L919-C1028 WeakPolarHBondContact CB-O 3.26Å; L919-C1028 HydrophobicContact CD2-CB 4.32Å; L919-C1028 PolarHBondContact N-O 3.24Å; V1015-C1028 HydrophobicContact CG1-CB 4.27Å; D1020-C1028 PolarHBondContact O-SG 2.85Å; A1026-C1028 PolarHBondContact O-N 3.31Å
1029	N	97.1	Very high	95.9	Very high	7 Å²	7	50.3 Å²	50.3	4%	0.037	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-119.1	5.9	178.6	-70.3	-37.9	0	0	0	113.9	R917 L919 H920 D1020 C1021 L1023 A1026 Q1027 Y1031 S1032	R917-N1029 CarbonylContact O-C 3.54Å; R917-N1029 WeakPolarHBondContact O-CA 3.42Å; L919-N1029 PolarHBondContact N-OD1 3.47Å; H920-N1029 WeakPolarHBondContact CB-OD1 3.48Å; H920-N1029 PolarHBondContact N-OD1 2.9Å; D1020-N1029 PolarHBondContact O-ND2 3.37Å; C1021-N1029 PolarHBondContact O-ND2 3.1Å; C1021-N1029 VanDerWaalsContact O-ND2 3.14Å; L1023-N1029 PolarHBondContact O-ND2 3.46Å; A1026-N1029 PolarHBondContact O-N 3.41Å; Q1027-N1029 PolarHBondContact O-N 2.84Å; Q1027-N1029 VanDerWaalsContact O-N 3.08Å; N1029-Y1031 PolarHBondContact O-N 2.95Å; N1029-Y1031 VanDerWaalsContact O-N 3.09Å; N1029-S1032 WeakPolarHBondContact CA-OG 3.49Å; N1029-S1032 WeakPolarHBondContact CB-OG 3.47Å; N1029-S1032 VanDerWaalsContact O-CB 3.3Å; N1029-S1032 WeakPolarHBondContact O-CB 3.22Å; N1029-S1032 PolarHBondContact O-N 3.47Å; N1029-S1032 PolarHBondContact O-OG 3.25Å
1030	E	97.4	Very high	96	Very high	95 Å²	95	47 Å²	47	44%	0.444	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49	-37.5	-176.5	-173.2	-175.7	160.7	0	0	114.4	R917 Q1027	R917-E1030 HydrophobicContact CB-CB 4.19Å; R917-E1030 VanDerWaalsContact CD-OE2 3.28Å; R917-E1030 WeakPolarHBondContact CD-OE2 3.44Å; R917-E1030 IonicContact CZ-OE2 3.6Å; R917-E1030 IonicContact NE-OE2 3.39Å; R917-E1030 IonicContact NH1-OE2 3.99Å; R917-E1030 PolarHBondContact NH1-OE2 3.23Å; R917-E1030 PolarHBondContact O-N 2.96Å; R917-E1030 VanDerWaalsContact O-N 3.16Å; Q1027-E1030 WeakPolarHBondContact O-CB 3.46Å; Q1027-E1030 PolarHBondContact O-N 2.88Å
1031	Y	97.7	Very high	96.1	Very high	21 Å²	21	45.1 Å²	45.1	8%	0.082	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.6	24.3	-178.6	-58.2	-83.7	0	0	0	113.1	R917 N1029 E1033 E1034 L1037 G1192 L1195 A1196 A1199	R917-Y1031 HydrophobicContact CB-CD2 3.93Å; R917-Y1031 PolarHBondContact O-N 3.49Å; N1029-Y1031 PolarHBondContact O-N 2.95Å; N1029-Y1031 VanDerWaalsContact O-N 3.09Å; Y1031-E1033 PolarHBondContact O-N 3.22Å; Y1031-E1034 HydrophobicContact CD1-CG 3.97Å; Y1031-E1034 WeakPolarHBondContact O-CB 3.44Å; Y1031-E1034 PolarHBondContact O-N 3.29Å; Y1031-E1034 VanDerWaalsContact O-N 3.08Å; Y1031-L1037 HydrophobicContact CG-CD2 4.12Å; Y1031-G1192 PolarHBondContact OH-O 3.3Å; Y1031-L1195 HydrophobicContact CD2-CB 4.24Å; Y1031-L1195 HydrophobicContact CD2-CD1 4.48Å; Y1031-L1195 HydrophobicContact CE2-CB 3.62Å; Y1031-L1195 HydrophobicContact CE2-CD1 4.18Å; Y1031-A1196 PolarHBondContact OH-N 2.91Å; Y1031-A1199 HydrophobicContact CD1-CB 3.85Å; Y1031-A1199 HydrophobicContact CE1-CB 4.02Å
1032	S	97.2	Very high	96.2	Very high	18 Å²	18	45.2 Å²	45.2	13%	0.126	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-24.5	-178.9	-60.8	0	0	0	0	113.7	P921 N1029	P921-S1032 WeakPolarHBondContact CG-O 3.33Å; N1029-S1032 WeakPolarHBondContact CA-OG 3.49Å; N1029-S1032 WeakPolarHBondContact CB-OG 3.47Å; N1029-S1032 VanDerWaalsContact O-CB 3.3Å; N1029-S1032 WeakPolarHBondContact O-CB 3.22Å; N1029-S1032 PolarHBondContact O-N 3.47Å; N1029-S1032 PolarHBondContact O-OG 3.25Å
1033	E	95.1	Very high	96.3	Very high	168 Å²	168	42.1 Å²	42.1	79%	0.785	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-9.8	177.3	-58.7	-57	139.1	0	0	112.8	Y1031 E1035	Y1031-E1033 PolarHBondContact O-N 3.22Å; E1033-E1035 PolarHBondContact O-N 3.28Å
1034	E	96.3	Very high	96.4	Very high	42 Å²	42	38.4 Å²	38.4	20%	0.196	21%	0.206	C	C	.	.			trans	-80.1	85.3	177.9	-62.3	-61.3	148.6	0	0	110.5	Y1031 E1036 L1037 V1038 A1199 R1203	Y1031-E1034 HydrophobicContact CD1-CG 3.97Å; Y1031-E1034 WeakPolarHBondContact O-CB 3.44Å; Y1031-E1034 PolarHBondContact O-N 3.29Å; Y1031-E1034 VanDerWaalsContact O-N 3.08Å; E1034-E1036 VanDerWaalsContact C-N 3.31Å; E1034-E1036 PolarHBondContact O-N 2.83Å; E1034-L1037 HydrophobicContact CB-CB 3.88Å; E1034-L1037 WeakPolarHBondContact O-CA 3.23Å; E1034-L1037 WeakPolarHBondContact O-CB 3.39Å; E1034-L1037 PolarHBondContact O-N 3.4Å; E1034-V1038 PolarHBondContact O-N 2.93Å; E1034-A1199 HydrophobicContact CG-CB 4.05Å; E1034-R1203 VanDerWaalsContact CD-NH2 3.33Å; E1034-R1203 IonicContact OE1-CZ 2.71Å; E1034-R1203 IonicContact OE1-NE 3.43Å; E1034-R1203 PolarHBondContact OE1-NE 3.46Å; E1034-R1203 IonicContact OE1-NH2 2.73Å; E1034-R1203 PolarHBondContact OE1-NH2 3.05Å; E1034-R1203 IonicContact OE2-CZ 3.91Å; E1034-R1203 IonicContact OE2-NE 3.41Å; E1034-R1203 PolarHBondContact OE2-NE 3.19Å; E1034-R1203 IonicContact OE2-NH2 2.73Å; E1034-R1203 PolarHBondContact OE2-NH2 3.06Å
1035	E	95.2	Very high	96.6	Very high	71 Å²	71	33 Å²	33	33%	0.332	17%	0.171	S	C	.	.	H	α-helix	trans	-54.5	-40.4	-172.8	-65.1	-168.5	174.7	0	0	114.4	S955 L960 R964 E1033 L1037 V1038 K1039	S955-E1035 WeakPolarHBondContact CB-OE2 3.29Å; L960-E1035 HydrophobicContact CD1-CB 3.84Å; L960-E1035 HydrophobicContact CD1-CG 3.98Å; R964-E1035 IonicContact CZ-OE1 3.91Å; R964-E1035 IonicContact NE-OE1 3.94Å; R964-E1035 VanDerWaalsContact NH2-CD 3.3Å; R964-E1035 IonicContact NH2-OE1 3.92Å; R964-E1035 PolarHBondContact NH2-OE1 2.7Å; R964-E1035 IonicContact NH2-OE2 3.07Å; R964-E1035 PolarHBondContact NH2-OE2 2.66Å; E1033-E1035 PolarHBondContact O-N 3.28Å; E1035-L1037 VanDerWaalsContact C-N 3.33Å; E1035-V1038 PolarHBondContact O-N 3.44Å; E1035-K1039 WeakPolarHBondContact O-CB 3.22Å; E1035-K1039 VanDerWaalsContact O-CG 3.26Å; E1035-K1039 WeakPolarHBondContact O-CG 3.23Å; E1035-K1039 PolarHBondContact O-N 2.82Å
1036	E	95.4	Very high	96.6	Very high	41 Å²	41	28.1 Å²	28.1	19%	0.192	14%	0.136	C	C	.	.	H	α-helix	trans	-69.4	-32.5	178.7	-66.5	-57.1	148.6	0	0	112.1	E1034 K1039 G1040 L1202	E1034-E1036 VanDerWaalsContact C-N 3.31Å; E1034-E1036 PolarHBondContact O-N 2.83Å; E1036-K1039 VanDerWaalsContact CD-CE 3.41Å; E1036-K1039 VanDerWaalsContact OE1-CE 3.3Å; E1036-K1039 WeakPolarHBondContact OE1-CE 3.14Å; E1036-K1039 IonicContact OE1-NZ 3.68Å; E1036-K1039 PolarHBondContact OE1-NZ 3.2Å; E1036-K1039 WeakPolarHBondContact OE2-CE 3.42Å; E1036-K1039 IonicContact OE2-NZ 3.42Å; E1036-K1039 PolarHBondContact OE2-NZ 2.9Å; E1036-K1039 VanDerWaalsContact OE2-NZ 3.1Å; E1036-G1040 PolarHBondContact O-N 3.41Å; E1036-L1202 HydrophobicContact CB-CB 3.97Å
1037	L	97.5	Very high	96.5	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-69.7	-47.3	172.5	179.7	63	0	0	0	110.6	F916 Y1031 E1034 E1035 K1039 G1040 V1041 L1125 L1198 L1202	F916-L1037 HydrophobicContact CD1-CD1 4.25Å; Y1031-L1037 HydrophobicContact CG-CD2 4.12Å; E1034-L1037 HydrophobicContact CB-CB 3.88Å; E1034-L1037 WeakPolarHBondContact O-CA 3.23Å; E1034-L1037 WeakPolarHBondContact O-CB 3.39Å; E1034-L1037 PolarHBondContact O-N 3.4Å; E1035-L1037 VanDerWaalsContact C-N 3.33Å; L1037-K1039 VanDerWaalsContact C-N 3.31Å; L1037-K1039 PolarHBondContact O-N 3.22Å; L1037-G1040 CarbonylContact O-C 3.54Å; L1037-G1040 WeakPolarHBondContact O-CA 3.37Å; L1037-G1040 PolarHBondContact O-N 3.4Å; L1037-V1041 HydrophobicContact CD1-CG2 3.97Å; L1037-V1041 HydrophobicContact CG-CG2 4.27Å; L1037-V1041 WeakPolarHBondContact O-CG2 3.32Å; L1037-V1041 PolarHBondContact O-N 3.2Å; L1037-L1125 HydrophobicContact CD1-CD1 4.5Å; L1037-L1198 HydrophobicContact CD1-CD2 3.59Å; L1037-L1198 HydrophobicContact CD1-CG 4.1Å; L1037-L1202 HydrophobicContact CB-CD1 4.18Å; L1037-L1202 HydrophobicContact CD1-CD1 4.1Å
1038	V	98	Very high	96.4	Very high	4 Å²	4	24.7 Å²	24.7	2%	0.024	12%	0.12	C	C	.	.	H	α-helix	trans	-54.4	-47.8	176.2	166.5	0	0	0	0	111	C918 P921 L922 L960 E1034 E1035 V1041 L1042	C918-V1038 HydrophobicContact CB-CG2 3.96Å; P921-V1038 HydrophobicContact CB-CG1 3.99Å; P921-V1038 HydrophobicContact CB-CG2 4.24Å; P921-V1038 HydrophobicContact CG-CG2 4.15Å; L922-V1038 HydrophobicContact CD2-CB 4.4Å; L922-V1038 HydrophobicContact CD2-CG1 3.7Å; L960-V1038 HydrophobicContact CD2-CG1 3.77Å; E1034-V1038 PolarHBondContact O-N 2.93Å; E1035-V1038 PolarHBondContact O-N 3.44Å; V1038-V1041 PolarHBondContact O-N 2.88Å; V1038-L1042 WeakPolarHBondContact O-CB 3.29Å; V1038-L1042 PolarHBondContact O-N 2.77Å
1039	K	97.5	Very high	96.3	Very high	5 Å²	5	24.8 Å²	24.8	2%	0.022	12%	0.12	C	C	.	.	H	α-helix	trans	-65.8	-37.8	175.9	-69.2	-177.8	-55.9	166.8	0	112.3	S955 L960 E1035 E1036 L1037 M1043 Q1116	S955-K1039 PolarHBondContact O-NZ 2.87Å; S955-K1039 VanDerWaalsContact O-NZ 3.16Å; L960-K1039 HydrophobicContact CD1-CD 3.9Å; L960-K1039 HydrophobicContact CD1-CG 4Å; L960-K1039 HydrophobicContact CG-CG 4.41Å; E1035-K1039 WeakPolarHBondContact O-CB 3.22Å; E1035-K1039 VanDerWaalsContact O-CG 3.26Å; E1035-K1039 WeakPolarHBondContact O-CG 3.23Å; E1035-K1039 PolarHBondContact O-N 2.82Å; E1036-K1039 VanDerWaalsContact CD-CE 3.41Å; E1036-K1039 VanDerWaalsContact OE1-CE 3.3Å; E1036-K1039 WeakPolarHBondContact OE1-CE 3.14Å; E1036-K1039 IonicContact OE1-NZ 3.68Å; E1036-K1039 PolarHBondContact OE1-NZ 3.2Å; E1036-K1039 WeakPolarHBondContact OE2-CE 3.42Å; E1036-K1039 IonicContact OE2-NZ 3.42Å; E1036-K1039 PolarHBondContact OE2-NZ 2.9Å; E1036-K1039 VanDerWaalsContact OE2-NZ 3.1Å; L1037-K1039 VanDerWaalsContact C-N 3.31Å; L1037-K1039 PolarHBondContact O-N 3.22Å; K1039-M1043 VanDerWaalsContact O-CB 3.32Å; K1039-M1043 WeakPolarHBondContact O-CB 3.31Å; K1039-M1043 PolarHBondContact O-N 3.5Å; K1039-Q1116 VanDerWaalsContact CD-O 3.27Å; K1039-Q1116 WeakPolarHBondContact CD-O 3.43Å; K1039-Q1116 WeakPolarHBondContact CE-O 3.18Å; K1039-Q1116 PolarHBondContact NZ-O 3.08Å
1040	G	97.5	Very high	96.2	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-62.4	-46.4	175.5	0	0	0	0	0	113	E1036 L1037 M1043 A1044	E1036-G1040 PolarHBondContact O-N 3.41Å; L1037-G1040 CarbonylContact O-C 3.54Å; L1037-G1040 WeakPolarHBondContact O-CA 3.37Å; L1037-G1040 PolarHBondContact O-N 3.4Å; G1040-M1043 WeakPolarHBondContact O-CB 3.13Å; G1040-M1043 PolarHBondContact O-N 3.02Å; G1040-A1044 PolarHBondContact O-N 3.48Å
1041	V	98.4	Very high	96.1	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-69.6	-40.4	178.5	173.8	0	0	0	0	111.1	L912 A913 F916 L1037 V1038 M1043 A1044 G1045 L1125	L912-V1041 HydrophobicContact CB-CG1 3.78Å; A913-V1041 HydrophobicContact CB-CG1 4.05Å; F916-V1041 HydrophobicContact CB-CG2 3.65Å; F916-V1041 HydrophobicContact CD1-CG2 4.27Å; F916-V1041 HydrophobicContact CD2-CG2 4.06Å; F916-V1041 HydrophobicContact CG-CG2 3.74Å; L1037-V1041 HydrophobicContact CD1-CG2 3.97Å; L1037-V1041 HydrophobicContact CG-CG2 4.27Å; L1037-V1041 WeakPolarHBondContact O-CG2 3.32Å; L1037-V1041 PolarHBondContact O-N 3.2Å; V1038-V1041 PolarHBondContact O-N 2.88Å; V1041-M1043 VanDerWaalsContact C-N 3.3Å; V1041-M1043 PolarHBondContact O-N 3.37Å; V1041-A1044 PolarHBondContact O-N 2.79Å; V1041-G1045 PolarHBondContact O-N 3.29Å; V1041-L1125 HydrophobicContact CG2-CD1 4.29Å
1042	L	98.2	Very high	95.9	Very high	2 Å²	2	19.8 Å²	19.8	1%	0.01	10%	0.097	C	C	.	.	H	α-helix	trans	-56.3	-47.5	170.5	-179.7	61.3	0	0	0	110.9	A909 L922 V925 H959 V1038 A1044 G1045 L1046 T1098	A909-L1042 HydrophobicContact CB-CD1 4.38Å; L922-L1042 HydrophobicContact CD1-CB 3.77Å; L922-L1042 HydrophobicContact CD1-CD1 3.6Å; L922-L1042 HydrophobicContact CD1-CG 4.21Å; V925-L1042 HydrophobicContact CG1-CD1 4.13Å; V925-L1042 HydrophobicContact CG1-CD2 4.37Å; H959-L1042 HydrophobicContact CB-CD2 3.67Å; H959-L1042 VanDerWaalsContact CG-CD2 3.44Å; V1038-L1042 WeakPolarHBondContact O-CB 3.29Å; V1038-L1042 PolarHBondContact O-N 2.77Å; L1042-A1044 PolarHBondContact O-N 2.88Å; L1042-G1045 PolarHBondContact O-N 3.4Å; L1042-L1046 HydrophobicContact CD1-CD1 3.7Å; L1042-L1046 HydrophobicContact CD1-CG 4.07Å; L1042-L1046 HydrophobicContact CD2-CD1 4.49Å; L1042-L1046 HydrophobicContact CG-CD1 3.81Å; L1042-L1046 HydrophobicContact CG-CG 4.43Å; L1042-L1046 WeakPolarHBondContact O-CB 3.44Å; L1042-L1046 VanDerWaalsContact O-CG 3.28Å; L1042-L1046 WeakPolarHBondContact O-CG 3.44Å; L1042-L1046 PolarHBondContact O-N 3.03Å; L1042-T1098 HydrophobicContact CD2-CG2 4.47Å; L1042-T1098 HydrophobicContact CG-CG2 4.46Å
1043	M	97.2	Very high	95.5	Very high	1 Å²	1	19 Å²	19	1%	0.005	9%	0.091	C	C	.	.	H	α-helix	trans	-61.7	-42.1	177	-179.7	-77.8	-47.5	0	0	112.2	K1039 G1040 V1041 G1045 L1046 Y1047 L1050 T1098 V1117 A1121 V1122 T1126	K1039-M1043 VanDerWaalsContact O-CB 3.32Å; K1039-M1043 WeakPolarHBondContact O-CB 3.31Å; K1039-M1043 PolarHBondContact O-N 3.5Å; G1040-M1043 WeakPolarHBondContact O-CB 3.13Å; G1040-M1043 PolarHBondContact O-N 3.02Å; V1041-M1043 VanDerWaalsContact C-N 3.3Å; V1041-M1043 PolarHBondContact O-N 3.37Å; M1043-G1045 VanDerWaalsContact C-N 3.32Å; M1043-G1045 PolarHBondContact O-N 3.48Å; M1043-L1046 CarbonylContact O-C 3.52Å; M1043-L1046 PolarHBondContact O-N 2.94Å; M1043-Y1047 WeakPolarHBondContact O-CB 3.3Å; M1043-Y1047 PolarHBondContact O-N 2.89Å; M1043-Y1047 HydrophobicContact SD-CD2 4.29Å; M1043-L1050 HydrophobicContact CG-CD1 4.18Å; M1043-L1050 HydrophobicContact SD-CD1 4.45Å; M1043-T1098 HydrophobicContact CB-CG2 3.92Å; M1043-T1098 HydrophobicContact CG-CG2 4.48Å; M1043-V1117 HydrophobicContact CB-CG1 3.94Å; M1043-V1117 HydrophobicContact CB-CG2 3.84Å; M1043-V1117 HydrophobicContact CE-CG1 4.38Å; M1043-V1117 HydrophobicContact CG-CB 4.49Å; M1043-V1117 HydrophobicContact CG-CG1 4.07Å; M1043-V1117 HydrophobicContact CG-CG2 4.04Å; M1043-A1121 WeakPolarHBondContact CE-O 3.3Å; M1043-V1122 VanDerWaalsContact CE-CA 3.49Å; M1043-V1122 HydrophobicContact CE-CB 4.3Å; M1043-V1122 HydrophobicContact CE-CG2 4.22Å; M1043-V1122 HydrophobicContact SD-CG1 4.42Å; M1043-V1122 HydrophobicContact SD-CG2 4.43Å; M1043-T1126 HydrophobicContact CE-CG2 4.01Å; M1043-T1126 HydrophobicContact SD-CG2 3.77Å
1044	A	96.9	Very high	95.1	Very high	1 Å²	1	11.7 Å²	11.7	1%	0.008	6%	0.056	C	C	.	.	H	α-helix	trans	-62.3	-38.8	176.9	0	0	0	0	0	112.5	L912 G1040 V1041 L1042 L1125	L912-A1044 HydrophobicContact CD1-CB 3.8Å; G1040-A1044 PolarHBondContact O-N 3.48Å; V1041-A1044 PolarHBondContact O-N 2.79Å; L1042-A1044 PolarHBondContact O-N 2.88Å; A1044-L1125 HydrophobicContact CB-CB 3.82Å; A1044-L1125 VanDerWaalsContact CB-O 3.3Å; A1044-L1125 WeakPolarHBondContact CB-O 3.45Å
1045	G	96.6	Very high	94.4	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-68.9	-37.7	174	0	0	0	0	0	113.6	R905 V1041 L1042 M1043	R905-G1045 CarbonylContact C-O 3.56Å; R905-G1045 WeakPolarHBondContact CA-O 3.34Å; R905-G1045 WeakPolarHBondContact CB-O 3.14Å; R905-G1045 CarbonylContact O-C 3.55Å; R905-G1045 VanDerWaalsContact O-O 3.05Å; V1041-G1045 PolarHBondContact O-N 3.29Å; L1042-G1045 PolarHBondContact O-N 3.4Å; M1043-G1045 VanDerWaalsContact C-N 3.32Å; M1043-G1045 PolarHBondContact O-N 3.48Å
1046	L	95.6	Very high	93.6	Very high	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-83.8	-12.6	-180	-66.9	179.5	0	0	0	114.1	R905 L906 L1042 M1043 N1049 T1098 F1100	R905-L1046 HydrophobicContact CB-CD2 4.1Å; L906-L1046 HydrophobicContact CD2-CD2 3.77Å; L1042-L1046 HydrophobicContact CD1-CD1 3.7Å; L1042-L1046 HydrophobicContact CD1-CG 4.07Å; L1042-L1046 HydrophobicContact CD2-CD1 4.49Å; L1042-L1046 HydrophobicContact CG-CD1 3.81Å; L1042-L1046 HydrophobicContact CG-CG 4.43Å; L1042-L1046 WeakPolarHBondContact O-CB 3.44Å; L1042-L1046 VanDerWaalsContact O-CG 3.28Å; L1042-L1046 WeakPolarHBondContact O-CG 3.44Å; L1042-L1046 PolarHBondContact O-N 3.03Å; M1043-L1046 CarbonylContact O-C 3.52Å; M1043-L1046 PolarHBondContact O-N 2.94Å; L1046-N1049 HydrophobicContact CB-CB 4.37Å; L1046-N1049 WeakPolarHBondContact O-CB 3.36Å; L1046-N1049 VanDerWaalsContact O-CG 3.31Å; L1046-N1049 PolarHBondContact O-N 3.05Å; L1046-T1098 HydrophobicContact CD1-CG2 4.49Å; L1046-F1100 HydrophobicContact CD1-CB 4.28Å; L1046-F1100 HydrophobicContact CD2-CB 4.16Å; L1046-F1100 HydrophobicContact CD2-CD2 3.68Å; L1046-F1100 HydrophobicContact CD2-CG 4.34Å
1047	Y	93.8	Very high	92.9	Very high	7 Å²	7	7.9 Å²	7.9	3%	0.027	4%	0.038	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	131.8	178.4	-168.3	-95.3	0	0	0	110.1	I881 M1043 T1126 L1143 D1145	I881-Y1047 WeakPolarHBondContact CG2-O 3.27Å; M1043-Y1047 WeakPolarHBondContact O-CB 3.3Å; M1043-Y1047 PolarHBondContact O-N 2.89Å; M1043-Y1047 HydrophobicContact SD-CD2 4.29Å; Y1047-T1126 HydrophobicContact CD2-CG2 3.5Å; Y1047-T1126 VanDerWaalsContact CD2-CG2 3.5Å; Y1047-T1126 HydrophobicContact CE2-CG2 3.72Å; Y1047-T1126 HydrophobicContact CG-CG2 3.99Å; Y1047-L1143 HydrophobicContact CE2-CD1 4.41Å; Y1047-D1145 VanDerWaalsContact CE1-OD2 3.22Å; Y1047-D1145 WeakPolarHBondContact CE1-OD2 3.46Å; Y1047-D1145 VanDerWaalsContact CZ-OD2 3.27Å; Y1047-D1145 PolarHBondContact OH-OD1 3.48Å; Y1047-D1145 PolarHBondContact OH-OD2 3.44Å
1048	P	91	Very high	92	Very high	20 Å²	20	7.8 Å²	7.8	13%	0.13	4%	0.037	C	C	.	.	T	Hydrogen-bonded Turn	cis	-91.9	21	18.4	37.3	-38.4	0	0	0	116.5	L1050	P1048-L1050 PolarHBondContact O-N 2.92Å
1049	N	93.2	Very high	91	Very high	16 Å²	16	7.8 Å²	7.8	9%	0.086	4%	0.037	C	C	.	.			trans	-72.1	68.4	178.1	-65.2	-0.7	0	0	0	112.8	L1046 T1098 Y1099 F1100	L1046-N1049 HydrophobicContact CB-CB 4.37Å; L1046-N1049 WeakPolarHBondContact O-CB 3.36Å; L1046-N1049 VanDerWaalsContact O-CG 3.31Å; L1046-N1049 PolarHBondContact O-N 3.05Å; N1049-T1098 WeakPolarHBondContact O-CA 3.46Å; N1049-T1098 PolarHBondContact O-OG1 3.06Å; N1049-Y1099 HydrophobicContact CB-CD1 4.03Å; N1049-Y1099 HydrophobicContact CB-CD2 4.38Å; N1049-Y1099 HydrophobicContact CB-CE1 3.78Å; N1049-Y1099 HydrophobicContact CB-CE2 4.15Å; N1049-Y1099 HydrophobicContact CB-CG 4.33Å; N1049-Y1099 WeakPolarHBondContact CB-O 3.3Å; N1049-Y1099 PolarHBondContact ND2-O 2.94Å; N1049-F1100 PolarHBondContact ND2-O 3.2Å
1050	L	94.9	Very high	89.7	Confident	0 Å²	0	17.1 Å²	17.1	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	134.6	180	-173	72.8	0	0	0	110.9	M1043 P1048 T1073 W1096 V1122 L1148	M1043-L1050 HydrophobicContact CG-CD1 4.18Å; M1043-L1050 HydrophobicContact SD-CD1 4.45Å; P1048-L1050 PolarHBondContact O-N 2.92Å; L1050-T1073 WeakPolarHBondContact O-CA 3.43Å; L1050-W1096 HydrophobicContact CD1-CB 4.23Å; L1050-V1122 HydrophobicContact CD1-CG1 4.2Å; L1050-V1122 HydrophobicContact CD1-CG2 4.14Å; L1050-V1122 HydrophobicContact CD2-CG1 3.68Å; L1050-L1148 HydrophobicContact CB-CD1 4.18Å; L1050-L1148 HydrophobicContact CD2-CB 4.1Å; L1050-L1148 HydrophobicContact CD2-CD1 4.19Å; L1050-L1148 HydrophobicContact CG-CD1 4.39Å
1051	I	94.8	Very high	88.4	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	128.9	173.8	-62.5	162.2	0	0	0	108.6	Y1071 R1072 T1073 I1078 L1080 W1096 L1097 Y1099 V1111	I1051-Y1071 HydrophobicContact CG2-CD1 3.92Å; I1051-Y1071 HydrophobicContact CG2-CG 4.34Å; I1051-R1072 CarbonylContact C-O 3.51Å; I1051-R1072 WeakPolarHBondContact CA-O 3.22Å; I1051-T1073 HydrophobicContact CG1-CG2 3.88Å; I1051-I1078 HydrophobicContact CD1-CD1 4.02Å; I1051-I1078 HydrophobicContact CG1-CD1 4.35Å; I1051-I1078 HydrophobicContact CG1-CG1 4.45Å; I1051-L1080 HydrophobicContact CD1-CD2 4.12Å; I1051-W1096 VanDerWaalsContact O-CA 3.28Å; I1051-W1096 WeakPolarHBondContact O-CA 3.39Å; I1051-L1097 HydrophobicContact CB-CB 4.16Å; I1051-L1097 HydrophobicContact CD1-CB 4.32Å; I1051-L1097 HydrophobicContact CG2-CD1 4.34Å; I1051-L1097 PolarHBondContact N-O 3.26Å; I1051-L1097 PolarHBondContact O-N 3.49Å; I1051-Y1099 HydrophobicContact CD1-CD1 3.49Å; I1051-Y1099 VanDerWaalsContact CD1-CD1 3.49Å; I1051-Y1099 HydrophobicContact CD1-CE1 4Å; I1051-Y1099 HydrophobicContact CD1-CG 4.21Å; I1051-Y1099 HydrophobicContact CG1-CD1 3.62Å; I1051-Y1099 HydrophobicContact CG1-CE1 3.66Å; I1051-V1111 HydrophobicContact CD1-CG1 4.24Å; I1051-V1111 HydrophobicContact CD1-CG2 4.2Å
1052	Q	92.8	Very high	87.3	Confident	19 Å²	19	24 Å²	24	9%	0.089	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	125.6	163.2	-175	-174.9	53.8	0	0	109.3	R1054 R1072 L1148	Q1052-R1054 HydrophobicContact CG-CG 4.44Å; Q1052-R1072 PolarHBondContact N-O 3.08Å; Q1052-R1072 PolarHBondContact O-N 3.19Å; Q1052-L1148 HydrophobicContact CB-CB 4.4Å; Q1052-L1148 HydrophobicContact CB-CD2 3.99Å; Q1052-L1148 PolarHBondContact NE2-O 3.07Å
1053	V	90.4	Very high	86.5	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	127.9	172.6	-175.1	0	0	0	0	109.1	V1069 T1070 Y1071 L1092 R1095 L1097	V1053-V1069 HydrophobicContact CG1-CB 4.05Å; V1053-V1069 HydrophobicContact CG1-CG1 4.02Å; V1053-T1070 WeakPolarHBondContact CA-O 3.38Å; V1053-Y1071 HydrophobicContact CG1-CE1 4.46Å; V1053-Y1071 HydrophobicContact CG2-CD1 3.96Å; V1053-Y1071 HydrophobicContact CG2-CE1 4.03Å; V1053-L1092 HydrophobicContact CB-CD1 4.43Å; V1053-L1092 HydrophobicContact CG1-CD1 3.82Å; V1053-L1092 HydrophobicContact CG2-CD1 3.97Å; V1053-R1095 WeakPolarHBondContact CG2-O 3.26Å; V1053-R1095 PolarHBondContact N-O 3.05Å; V1053-L1097 HydrophobicContact CG2-CD1 3.16Å
1054	R	86.1	Confident	85.7	Confident	15 Å²	15	29 Å²	29	6%	0.057	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	153.2	173.6	-65	-176.1	177.4	-170.9	-2.7	110.4	D226 T228 Q365 Q1052 V1069 T1070	D226-R1054 IonicContact OD2-NH1 2.88Å; D226-R1054 PolarHBondContact OD2-NH1 2.57Å; D226-R1054 VanDerWaalsContact OD2-NH1 3.12Å; T228-R1054 PolarHBondContact OG1-NH1 2.94Å; Q365-R1054 HydrophobicContact CG-CB 4.47Å; Q1052-R1054 HydrophobicContact CG-CG 4.44Å; R1054-V1069 CarbonylContact O-C 3.5Å; R1054-V1069 VanDerWaalsContact O-CA 3.25Å; R1054-V1069 WeakPolarHBondContact O-CA 3.45Å; R1054-T1070 WeakPolarHBondContact CB-OG1 3.21Å; R1054-T1070 PolarHBondContact N-O 3.24Å; R1054-T1070 PolarHBondContact O-N 3.01Å
1055	Q	81.7	Confident	85	Confident	21 Å²	21	32.8 Å²	32.8	10%	0.098	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	147	175.3	-61.4	176	-19.4	0	0	110.9	L361 F1209	L361-Q1055 HydrophobicContact CD1-CB 4.21Å; L361-Q1055 WeakPolarHBondContact CD2-O 3.3Å; Q1055-F1209 HydrophobicContact CG-CE2 4.38Å; Q1055-F1209 HydrophobicContact CG-CZ 4.11Å
1056	G	78.2	Confident	84	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	88.8	137.5	-177.5	0	0	0	0	0	112.8	K1065 P1066 S1068 T1070	G1056-K1065 WeakPolarHBondContact CA-O 3.26Å; G1056-P1066 WeakPolarHBondContact CA-O 3.44Å; G1056-P1066 PolarHBondContact N-O 2.91Å; G1056-S1068 PolarHBondContact N-O 3.2Å; G1056-T1070 WeakPolarHBondContact O-CG2 3.37Å
1057	K	80.8	Confident	83.1	Confident	53 Å²	53	41.8 Å²	41.8	23%	0.23	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	152.3	165.5	86.2	-162.5	173.1	168.6	0	111.5	T224 K1065 S1068 T1070	T224-K1057 HydrophobicContact CG2-CD 3.99Å; T224-K1057 HydrophobicContact CG2-CG 4.3Å; K1057-K1065 HydrophobicContact CG-CB 4.25Å; K1057-K1065 HydrophobicContact CG-CD 4.45Å; K1057-K1065 PolarHBondContact N-O 3.3Å; K1057-K1065 PolarHBondContact O-N 3.36Å; K1057-S1068 WeakPolarHBondContact CB-OG 3.44Å; K1057-S1068 VanDerWaalsContact CD-OG 3.31Å; K1057-S1068 WeakPolarHBondContact CD-OG 3.49Å; K1057-S1068 WeakPolarHBondContact CG-OG 3.44Å; K1057-S1068 PolarHBondContact N-OG 3.04Å; K1057-S1068 VanDerWaalsContact N-OG 3.15Å; K1057-T1070 HydrophobicContact CB-CG2 3.61Å
1058	V	78.1	Confident	82.5	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	123.8	171.3	-177.1	0	0	0	0	108	T224 I225 F230 A351 L358 K1063 F1064	T224-V1058 WeakPolarHBondContact CA-O 3.42Å; I225-V1058 PolarHBondContact N-O 2.93Å; I225-V1058 PolarHBondContact O-N 2.94Å; F230-V1058 HydrophobicContact CB-CB 4.41Å; F230-V1058 HydrophobicContact CB-CG2 4.19Å; F230-V1058 HydrophobicContact CD1-CG2 4.21Å; F230-V1058 HydrophobicContact CD2-CB 4.17Å; F230-V1058 HydrophobicContact CD2-CG1 3.72Å; F230-V1058 HydrophobicContact CD2-CG2 4.42Å; F230-V1058 HydrophobicContact CE2-CG1 3.83Å; F230-V1058 HydrophobicContact CG-CB 4.21Å; F230-V1058 HydrophobicContact CG-CG1 4.15Å; F230-V1058 HydrophobicContact CG-CG2 4.01Å; F230-V1058 HydrophobicContact CZ-CG1 4.35Å; A351-V1058 HydrophobicContact CB-CG1 3.75Å; A351-V1058 HydrophobicContact CB-CG2 4.33Å; L358-V1058 HydrophobicContact CD1-CG2 4.43Å; L358-V1058 HydrophobicContact CD2-CG2 3.7Å; V1058-K1063 WeakPolarHBondContact CA-O 3.32Å; V1058-F1064 HydrophobicContact CG2-CD2 4.27Å
1059	T	76.9	Confident	82.2	Confident	4 Å²	4	43.3 Å²	43.3	3%	0.025	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	158.5	173.8	68.1	0	0	0	0	110.2	T224 Q1061 G1062 K1063 K1065	T224-T1059 HydrophobicContact CG2-CG2 4.43Å; T1059-Q1061 PolarHBondContact O-N 3.45Å; T1059-Q1061 VanDerWaalsContact O-N 3.16Å; T1059-G1062 WeakPolarHBondContact O-CA 3.2Å; T1059-G1062 PolarHBondContact O-N 3.05Å; T1059-K1063 HydrophobicContact CG2-CB 4.17Å; T1059-K1063 PolarHBondContact N-O 3.43Å; T1059-K1063 VanDerWaalsContact OG1-CB 3.24Å; T1059-K1063 WeakPolarHBondContact OG1-CB 3.26Å; T1059-K1063 PolarHBondContact OG1-N 2.77Å; T1059-K1065 HydrophobicContact CG2-CD 4.39Å
1060	R	69.7	Low	81.9	Confident	200 Å²	200	43 Å²	43	76%	0.755	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-32.6	172	-96.7	170.1	-173.8	-171.6	5.2	113.8	G223 G1062	G223-R1060 WeakPolarHBondContact O-CB 3.36Å; G223-R1060 WeakPolarHBondContact O-CG 3.44Å; G223-R1060 PolarHBondContact O-N 2.84Å; G223-R1060 VanDerWaalsContact O-N 3.07Å; R1060-G1062 PolarHBondContact O-N 2.94Å; R1060-G1062 VanDerWaalsContact O-N 3.15Å
1061	Q	71	Confident	81.7	Confident	141 Å²	141	43.9 Å²	43.9	66%	0.659	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.3	3.9	172.6	-63.7	172	3	0	0	113.7	E222 T1059	E222-Q1061 PolarHBondContact OE1-NE2 3.04Å; T1059-Q1061 PolarHBondContact O-N 3.45Å; T1059-Q1061 VanDerWaalsContact O-N 3.16Å
1062	G	75.6	Confident	81.4	Confident	5 Å²	5	47 Å²	47	5%	0.052	22%	0.22	C	C	.	.			trans	73.8	26.8	-179.6	0	0	0	0	0	114.1	H350 A351 T1059 R1060	H350-G1062 CarbonylContact C-O 3.53Å; H350-G1062 PolarHBondContact N-O 3.44Å; A351-G1062 VanDerWaalsContact CB-O 3.24Å; A351-G1062 WeakPolarHBondContact CB-O 3.34Å; A351-G1062 PolarHBondContact N-O 3.31Å; T1059-G1062 WeakPolarHBondContact O-CA 3.2Å; T1059-G1062 PolarHBondContact O-N 3.05Å; R1060-G1062 PolarHBondContact O-N 2.94Å; R1060-G1062 VanDerWaalsContact O-N 3.15Å
1063	K	80.3	Confident	81.3	Confident	98 Å²	98	46.2 Å²	46.2	43%	0.426	22%	0.216	S	C	.	.			trans	-86.9	117	174.3	-168.6	175.3	-178.3	172.1	0	111.1	V1058 T1059	V1058-K1063 WeakPolarHBondContact CA-O 3.32Å; T1059-K1063 HydrophobicContact CG2-CB 4.17Å; T1059-K1063 PolarHBondContact N-O 3.43Å; T1059-K1063 VanDerWaalsContact OG1-CB 3.24Å; T1059-K1063 WeakPolarHBondContact OG1-CB 3.26Å; T1059-K1063 PolarHBondContact OG1-N 2.77Å
1064	F	81.8	Confident	81.1	Confident	10 Å²	10	50.9 Å²	50.9	4%	0.044	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	126.7	175.2	174.9	-133.3	0	0	0	111	V227 H350 A351 N354 L358 L361 V1058 P1066	V227-F1064 HydrophobicContact CG2-CE2 4.03Å; H350-F1064 PolarHBondContact CE1-O 3.33Å; H350-F1064 PolarHBondContact ND1-N 3.2Å; A351-F1064 HydrophobicContact CB-CB 4.32Å; N354-F1064 HydrophobicContact CB-CD1 3.76Å; N354-F1064 HydrophobicContact CB-CE1 4.42Å; L358-F1064 HydrophobicContact CD1-CG 4.48Å; L358-F1064 HydrophobicContact CD2-CD1 4.45Å; L358-F1064 HydrophobicContact CD2-CD2 3.31Å; L358-F1064 HydrophobicContact CD2-CE1 4.48Å; L358-F1064 HydrophobicContact CD2-CE2 3.35Å; L358-F1064 HydrophobicContact CD2-CG 3.89Å; L358-F1064 HydrophobicContact CD2-CZ 3.95Å; L358-F1064 HydrophobicContact CG-CD1 4.21Å; L358-F1064 HydrophobicContact CG-CD2 3.95Å; L358-F1064 HydrophobicContact CG-CE1 4.28Å; L358-F1064 HydrophobicContact CG-CE2 4.03Å; L358-F1064 HydrophobicContact CG-CG 4.03Å; L358-F1064 HydrophobicContact CG-CZ 4.18Å; L361-F1064 HydrophobicContact CD2-CE2 3.9Å; L361-F1064 HydrophobicContact CD2-CZ 3.78Å; V1058-F1064 HydrophobicContact CG2-CD2 4.27Å; F1064-P1066 HydrophobicContact CE1-CB 3.91Å; F1064-P1066 HydrophobicContact CE1-CG 4.24Å; F1064-P1066 HydrophobicContact CE2-CB 4.23Å; F1064-P1066 HydrophobicContact CZ-CB 3.64Å; F1064-P1066 HydrophobicContact CZ-CG 4.4Å
1065	K	81.1	Confident	80.9	Confident	80 Å²	80	53.9 Å²	53.9	35%	0.348	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	95	176	-65	177.3	178.9	176	0	107.9	G1056 K1057 T1059 N1067 S1068	G1056-K1065 WeakPolarHBondContact CA-O 3.26Å; K1057-K1065 HydrophobicContact CG-CB 4.25Å; K1057-K1065 HydrophobicContact CG-CD 4.45Å; K1057-K1065 PolarHBondContact N-O 3.3Å; K1057-K1065 PolarHBondContact O-N 3.36Å; T1059-K1065 HydrophobicContact CG2-CD 4.39Å; K1065-N1067 PolarHBondContact O-N 3.1Å; K1065-S1068 WeakPolarHBondContact CB-OG 3.35Å; K1065-S1068 PolarHBondContact O-N 2.99Å; K1065-S1068 PolarHBondContact O-OG 3.1Å
1066	P	77.2	Confident	81	Confident	59 Å²	59	54.2 Å²	54.2	38%	0.383	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	-36.4	-175.4	21.9	-31.7	0	0	0	113.1	G1056 F1064 S1068	G1056-P1066 WeakPolarHBondContact CA-O 3.44Å; G1056-P1066 PolarHBondContact N-O 2.91Å; F1064-P1066 HydrophobicContact CE1-CB 3.91Å; F1064-P1066 HydrophobicContact CE1-CG 4.24Å; F1064-P1066 HydrophobicContact CE2-CB 4.23Å; F1064-P1066 HydrophobicContact CZ-CB 3.64Å; F1064-P1066 HydrophobicContact CZ-CG 4.4Å; P1066-S1068 VanDerWaalsContact C-N 3.28Å; P1066-S1068 PolarHBondContact O-N 2.7Å
1067	N	75.9	Confident	81.4	Confident	129 Å²	129	57.2 Å²	57.2	69%	0.69	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	8	-175.1	-60.9	-15.1	0	0	0	114	K1065	K1065-N1067 PolarHBondContact O-N 3.1Å
1068	S	81.6	Confident	81.9	Confident	21 Å²	21	55 Å²	55	15%	0.147	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	163.3	173.7	61	0	0	0	0	111.1	G1056 K1057 K1065 P1066	G1056-S1068 PolarHBondContact N-O 3.2Å; K1057-S1068 WeakPolarHBondContact CB-OG 3.44Å; K1057-S1068 VanDerWaalsContact CD-OG 3.31Å; K1057-S1068 WeakPolarHBondContact CD-OG 3.49Å; K1057-S1068 WeakPolarHBondContact CG-OG 3.44Å; K1057-S1068 PolarHBondContact N-OG 3.04Å; K1057-S1068 VanDerWaalsContact N-OG 3.15Å; K1065-S1068 WeakPolarHBondContact CB-OG 3.35Å; K1065-S1068 PolarHBondContact O-N 2.99Å; K1065-S1068 PolarHBondContact O-OG 3.1Å; P1066-S1068 VanDerWaalsContact C-N 3.28Å; P1066-S1068 PolarHBondContact O-N 2.7Å
1069	V	83.9	Confident	82.5	Confident	38 Å²	38	56.8 Å²	56.8	23%	0.23	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	150.3	176.6	-67.2	0	0	0	0	111.7	V1053 R1054 Y1071 M1211	V1053-V1069 HydrophobicContact CG1-CB 4.05Å; V1053-V1069 HydrophobicContact CG1-CG1 4.02Å; R1054-V1069 CarbonylContact O-C 3.5Å; R1054-V1069 VanDerWaalsContact O-CA 3.25Å; R1054-V1069 WeakPolarHBondContact O-CA 3.45Å; V1069-Y1071 HydrophobicContact CG2-CE2 4.05Å; V1069-Y1071 WeakPolarHBondContact CG2-OH 3.49Å; V1069-M1211 HydrophobicContact CG1-SD 3.83Å
1070	T	86.5	Confident	83.2	Confident	11 Å²	11	56.6 Å²	56.6	7%	0.067	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	150.7	169.5	53.8	0	0	0	0	108.9	D226 V1053 R1054 G1056 K1057	D226-T1070 PolarHBondContact OD1-OG1 3.04Å; V1053-T1070 WeakPolarHBondContact CA-O 3.38Å; R1054-T1070 WeakPolarHBondContact CB-OG1 3.21Å; R1054-T1070 PolarHBondContact N-O 3.24Å; R1054-T1070 PolarHBondContact O-N 3.01Å; G1056-T1070 WeakPolarHBondContact O-CG2 3.37Å; K1057-T1070 HydrophobicContact CB-CG2 3.61Å
1071	Y	91.4	Very high	84.1	Confident	17 Å²	17	49.4 Å²	49.4	7%	0.067	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	125.1	-177.1	-55.5	-84.1	0	0	0	108.8	I1051 V1053 V1069 N1077 I1078 L1080	I1051-Y1071 HydrophobicContact CG2-CD1 3.92Å; I1051-Y1071 HydrophobicContact CG2-CG 4.34Å; V1053-Y1071 HydrophobicContact CG1-CE1 4.46Å; V1053-Y1071 HydrophobicContact CG2-CD1 3.96Å; V1053-Y1071 HydrophobicContact CG2-CE1 4.03Å; V1069-Y1071 HydrophobicContact CG2-CE2 4.05Å; V1069-Y1071 WeakPolarHBondContact CG2-OH 3.49Å; Y1071-N1077 WeakPolarHBondContact O-CA 3.3Å; Y1071-I1078 VanDerWaalsContact CB-CD1 3.44Å; Y1071-I1078 HydrophobicContact CG-CD1 4.2Å; Y1071-I1078 PolarHBondContact O-N 3.41Å; Y1071-L1080 HydrophobicContact CD1-CD1 4.06Å; Y1071-L1080 HydrophobicContact CD1-CD2 4.44Å; Y1071-L1080 HydrophobicContact CD1-CG 4.02Å; Y1071-L1080 HydrophobicContact CD2-CG 4Å; Y1071-L1080 HydrophobicContact CE1-CD1 3.42Å; Y1071-L1080 VanDerWaalsContact CE1-CD1 3.42Å; Y1071-L1080 HydrophobicContact CE1-CG 3.81Å; Y1071-L1080 HydrophobicContact CE2-CB 4.37Å; Y1071-L1080 HydrophobicContact CE2-CD1 4.05Å; Y1071-L1080 HydrophobicContact CE2-CG 3.79Å; Y1071-L1080 HydrophobicContact CG-CG 4.11Å; Y1071-L1080 VanDerWaalsContact CZ-CD1 3.41Å
1072	R	89.5	Confident	84.7	Confident	65 Å²	65	49 Å²	49	25%	0.245	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	135.8	-176.1	176.7	176.5	168.1	149.2	-7.2	110.9	I1051 Q1052 D1147 L1148	I1051-R1072 CarbonylContact C-O 3.51Å; I1051-R1072 WeakPolarHBondContact CA-O 3.22Å; Q1052-R1072 PolarHBondContact N-O 3.08Å; Q1052-R1072 PolarHBondContact O-N 3.19Å; R1072-D1147 IonicContact NH2-OD1 3.4Å; R1072-D1147 IonicContact NH2-OD2 3.7Å; R1072-D1147 PolarHBondContact NH2-OD2 3.01Å; R1072-L1148 HydrophobicContact CG-CD2 4.26Å
1073	T	90.7	Very high	85.1	Confident	3 Å²	3	49.9 Å²	49.9	2%	0.018	26%	0.26	C	S	.	.			trans	-112.6	-179.5	171	67.5	0	0	0	0	109.9	L1050 I1051 S1075 G1076 I1078 Y1099	L1050-T1073 WeakPolarHBondContact O-CA 3.43Å; I1051-T1073 HydrophobicContact CG1-CG2 3.88Å; T1073-S1075 PolarHBondContact O-N 3.4Å; T1073-S1075 PolarHBondContact OG1-N 3.44Å; T1073-S1075 PolarHBondContact OG1-OG 3.13Å; T1073-G1076 PolarHBondContact N-O 3.47Å; T1073-G1076 PolarHBondContact O-N 3.41Å; T1073-G1076 PolarHBondContact OG1-N 3.3Å; T1073-G1076 PolarHBondContact OG1-O 3.34Å; T1073-G1076 VanDerWaalsContact OG1-O 3.09Å; T1073-I1078 HydrophobicContact CG2-CG1 3.89Å; T1073-I1078 HydrophobicContact CG2-CG2 3.9Å; T1073-Y1099 HydrophobicContact CG2-CE1 3.99Å
1074	K	85.4	Confident	85.6	Confident	99 Å²	99	45.4 Å²	45.4	43%	0.43	24%	0.241	S	C	.	.	S	Bend	trans	-61.7	-29.8	171.7	-172.9	175.7	178.6	174.8	0	112.1	E880 D1145 L1148	E880-K1074 IonicContact OE1-NZ 3.44Å; E880-K1074 PolarHBondContact OE1-NZ 2.75Å; K1074-D1145 WeakPolarHBondContact CE-O 3.18Å; K1074-D1145 PolarHBondContact NZ-O 3.24Å; K1074-D1145 IonicContact NZ-OD2 3.72Å; K1074-L1148 HydrophobicContact CB-CD1 4.43Å
1075	S	81.4	Confident	86	Confident	78 Å²	78	46.3 Å²	46.3	55%	0.545	25%	0.246	S	C	.	.	S	Bend	trans	-88.3	-14.6	-179	53.3	0	0	0	0	114.5	T1073	T1073-S1075 PolarHBondContact O-N 3.4Å; T1073-S1075 PolarHBondContact OG1-N 3.44Å; T1073-S1075 PolarHBondContact OG1-OG 3.13Å
1076	G	84	Confident	86.5	Confident	28 Å²	28	42.7 Å²	42.7	29%	0.289	23%	0.23	S	C	.	.			trans	143.6	-162.6	176.4	0	0	0	0	0	113.6	T1073	T1073-G1076 PolarHBondContact N-O 3.47Å; T1073-G1076 PolarHBondContact O-N 3.41Å; T1073-G1076 PolarHBondContact OG1-N 3.3Å; T1073-G1076 PolarHBondContact OG1-O 3.34Å; T1073-G1076 VanDerWaalsContact OG1-O 3.09Å
1077	N	87	Confident	87	Confident	63 Å²	63	43 Å²	43	34%	0.337	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	140.9	176.3	-64.6	-29.6	0	0	0	110.5	E229 Y1071	E229-N1077 PolarHBondContact OE2-ND2 2.72Å; Y1071-N1077 WeakPolarHBondContact O-CA 3.3Å
1078	I	90.5	Very high	87.1	Confident	7 Å²	7	44.7 Å²	44.7	4%	0.036	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	166.8	177.4	65.6	83	0	0	0	110.2	I1051 Y1071 T1073 L1080 V1109 V1111	I1051-I1078 HydrophobicContact CD1-CD1 4.02Å; I1051-I1078 HydrophobicContact CG1-CD1 4.35Å; I1051-I1078 HydrophobicContact CG1-CG1 4.45Å; Y1071-I1078 VanDerWaalsContact CB-CD1 3.44Å; Y1071-I1078 HydrophobicContact CG-CD1 4.2Å; Y1071-I1078 PolarHBondContact O-N 3.41Å; T1073-I1078 HydrophobicContact CG2-CG1 3.89Å; T1073-I1078 HydrophobicContact CG2-CG2 3.9Å; I1078-L1080 HydrophobicContact CD1-CD2 3.94Å; I1078-V1109 HydrophobicContact CG2-CB 4.14Å; I1078-V1109 HydrophobicContact CG2-CG1 3.93Å; I1078-V1111 HydrophobicContact CB-CG2 4.48Å; I1078-V1111 HydrophobicContact CD1-CB 4.26Å; I1078-V1111 HydrophobicContact CD1-CG2 3.76Å; I1078-V1111 HydrophobicContact CG1-CG2 4.17Å
1079	L	90.9	Very high	86.8	Confident	37 Å²	37	45.3 Å²	45.3	19%	0.194	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	140.3	173	-60.6	174.4	0	0	0	109.2	E221 V1109 F1110 V1111	E221-L1079 WeakPolarHBondContact OE2-CD1 3.3Å; L1079-V1109 PolarHBondContact N-O 3.35Å; L1079-F1110 HydrophobicContact CB-CD1 3.77Å; L1079-F1110 HydrophobicContact CB-CE1 3.8Å; L1079-F1110 HydrophobicContact CD1-CE1 3.93Å; L1079-F1110 HydrophobicContact CD1-CZ 4.13Å; L1079-F1110 HydrophobicContact CG-CE1 4.5Å; L1079-F1110 CarbonylContact O-C 3.55Å; L1079-F1110 VanDerWaalsContact O-CA 3.24Å; L1079-F1110 WeakPolarHBondContact O-CA 3.2Å; L1079-V1111 PolarHBondContact O-N 3.2Å
1080	L	91.2	Very high	86.1	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	132	168.8	-64.6	-169.2	0	0	0	108.9	I1051 Y1071 I1078 T1084 N1086 R1087 V1111	I1051-L1080 HydrophobicContact CD1-CD2 4.12Å; Y1071-L1080 HydrophobicContact CD1-CD1 4.06Å; Y1071-L1080 HydrophobicContact CD1-CD2 4.44Å; Y1071-L1080 HydrophobicContact CD1-CG 4.02Å; Y1071-L1080 HydrophobicContact CD2-CG 4Å; Y1071-L1080 HydrophobicContact CE1-CD1 3.42Å; Y1071-L1080 VanDerWaalsContact CE1-CD1 3.42Å; Y1071-L1080 HydrophobicContact CE1-CG 3.81Å; Y1071-L1080 HydrophobicContact CE2-CB 4.37Å; Y1071-L1080 HydrophobicContact CE2-CD1 4.05Å; Y1071-L1080 HydrophobicContact CE2-CG 3.79Å; Y1071-L1080 HydrophobicContact CG-CG 4.11Å; Y1071-L1080 VanDerWaalsContact CZ-CD1 3.41Å; I1078-L1080 HydrophobicContact CD1-CD2 3.94Å; L1080-T1084 HydrophobicContact CB-CG2 3.8Å; L1080-T1084 HydrophobicContact CD1-CG2 4.29Å; L1080-T1084 HydrophobicContact CD2-CG2 4.42Å; L1080-T1084 HydrophobicContact CG-CG2 4.39Å; L1080-N1086 HydrophobicContact CD1-CB 3.91Å; L1080-R1087 HydrophobicContact CB-CB 4.17Å; L1080-R1087 VanDerWaalsContact O-CD 3.26Å; L1080-R1087 WeakPolarHBondContact O-CD 3.22Å; L1080-R1087 PolarHBondContact O-NH1 2.78Å; L1080-V1111 HydrophobicContact CD2-CB 3.96Å; L1080-V1111 HydrophobicContact CD2-CG1 4.08Å
1081	H	88.4	Confident	85.6	Confident	48 Å²	48	55.8 Å²	55.8	22%	0.222	28%	0.281	C	S	.	.			trans	-74.5	157.3	174.2	-174.3	-103.2	0	0	0	110.5	S1083 T1084 F1110 V1111 R1112	H1081-S1083 VanDerWaalsContact ND1-CB 3.35Å; H1081-S1083 WeakPolarHBondContact ND1-CB 3.4Å; H1081-S1083 PolarHBondContact ND1-N 2.82Å; H1081-S1083 PolarHBondContact ND1-OG 3.15Å; H1081-S1083 PolarHBondContact O-N 3.49Å; H1081-T1084 WeakPolarHBondContact O-CG2 3.26Å; H1081-T1084 PolarHBondContact O-N 2.87Å; H1081-F1110 HydrophobicContact CB-CB 4.31Å; H1081-V1111 WeakPolarHBondContact CB-O 3.49Å; H1081-V1111 PolarHBondContact N-O 3.27Å; H1081-R1112 HydrophobicContact CB-CG 4.22Å
1082	K	84.5	Confident	85.1	Confident	134 Å²	134	55.1 Å²	55.1	58%	0.583	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-18.2	-179.8	-66.1	-179.5	-179.9	176	0	114	T1084	K1082-T1084 VanDerWaalsContact C-N 3.32Å; K1082-T1084 PolarHBondContact O-N 2.69Å
1083	S	83.9	Confident	84.7	Confident	22 Å²	22	58.4 Å²	58.4	15%	0.154	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-12	-179.8	59.7	0	0	0	0	115.4	H1081 R1112	H1081-S1083 VanDerWaalsContact ND1-CB 3.35Å; H1081-S1083 WeakPolarHBondContact ND1-CB 3.4Å; H1081-S1083 PolarHBondContact ND1-N 2.82Å; H1081-S1083 PolarHBondContact ND1-OG 3.15Å; H1081-S1083 PolarHBondContact O-N 3.49Å; S1083-R1112 PolarHBondContact OG-O 2.79Å
1084	T	90.8	Very high	84.5	Confident	4 Å²	4	58.4 Å²	58.4	3%	0.025	29%	0.291	C	S	.	.	S	Bend	trans	-96.7	134.5	175.2	175.6	0	0	0	0	110.1	D958 L1080 H1081 K1082 N1086 R1087 S1114	D958-T1084 WeakPolarHBondContact OD2-CA 3.35Å; D958-T1084 WeakPolarHBondContact OD2-CB 3.49Å; D958-T1084 PolarHBondContact OD2-OG1 2.74Å; L1080-T1084 HydrophobicContact CB-CG2 3.8Å; L1080-T1084 HydrophobicContact CD1-CG2 4.29Å; L1080-T1084 HydrophobicContact CD2-CG2 4.42Å; L1080-T1084 HydrophobicContact CG-CG2 4.39Å; H1081-T1084 WeakPolarHBondContact O-CG2 3.26Å; H1081-T1084 PolarHBondContact O-N 2.87Å; K1082-T1084 VanDerWaalsContact C-N 3.32Å; K1082-T1084 PolarHBondContact O-N 2.69Å; T1084-N1086 PolarHBondContact O-N 2.89Å; T1084-N1086 PolarHBondContact OG1-N 2.72Å; T1084-R1087 HydrophobicContact CG2-CB 4.24Å; T1084-R1087 WeakPolarHBondContact O-CB 3.43Å; T1084-R1087 PolarHBondContact O-N 3.35Å; T1084-R1087 VanDerWaalsContact O-N 3.12Å; T1084-S1114 PolarHBondContact OG1-OG 3.45Å
1085	I	89.7	Confident	84.7	Confident	30 Å²	30	55.9 Å²	55.9	15%	0.154	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-58.7	-23.3	178.3	65.2	-179.1	0	0	0	112.9	K948 A949 S952 D958 R1087	K948-I1085 HydrophobicContact CB-CG2 3.97Å; A949-I1085 HydrophobicContact CB-CG2 4.25Å; S952-I1085 WeakPolarHBondContact OG-CD1 3.47Å; D958-I1085 WeakPolarHBondContact OD1-CG1 2.94Å; D958-I1085 WeakPolarHBondContact OD1-CG2 3.12Å; D958-I1085 PolarHBondContact OD1-N 3.27Å; I1085-R1087 VanDerWaalsContact C-N 3.28Å; I1085-R1087 PolarHBondContact O-N 2.87Å
1086	N	91.8	Very high	85.3	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.016	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-79.7	-7.7	-177.2	-68.7	-49.1	0	0	0	113.5	G956 L1080 T1084 L1097 S1114 Q1116	G956-N1086 PolarHBondContact O-ND2 2.99Å; G956-N1086 PolarHBondContact O-OD1 3.23Å; L1080-N1086 HydrophobicContact CD1-CB 3.91Å; T1084-N1086 PolarHBondContact O-N 2.89Å; T1084-N1086 PolarHBondContact OG1-N 2.72Å; N1086-L1097 HydrophobicContact CB-CD2 3.84Å; N1086-S1114 WeakPolarHBondContact CB-OG 3.37Å; N1086-S1114 PolarHBondContact ND2-O 3.42Å; N1086-S1114 PolarHBondContact ND2-OG 3.2Å; N1086-Q1116 PolarHBondContact OD1-NE2 3.31Å
1087	R	87.7	Confident	85.9	Confident	67 Å²	67	51.1 Å²	51.1	25%	0.253	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-65.7	-43.3	177.7	173.7	57.8	178.9	-145	6.5	112.7	E221 L1080 T1084 I1085	E221-R1087 IonicContact OE1-CZ 2.74Å; E221-R1087 IonicContact OE1-NH1 3.81Å; E221-R1087 PolarHBondContact OE1-NH1 2.89Å; E221-R1087 IonicContact OE1-NH2 2.81Å; E221-R1087 PolarHBondContact OE1-NH2 2.92Å; L1080-R1087 HydrophobicContact CB-CB 4.17Å; L1080-R1087 VanDerWaalsContact O-CD 3.26Å; L1080-R1087 WeakPolarHBondContact O-CD 3.22Å; L1080-R1087 PolarHBondContact O-NH1 2.78Å; T1084-R1087 HydrophobicContact CG2-CB 4.24Å; T1084-R1087 WeakPolarHBondContact O-CB 3.43Å; T1084-R1087 PolarHBondContact O-N 3.35Å; T1084-R1087 VanDerWaalsContact O-N 3.12Å; I1085-R1087 VanDerWaalsContact C-N 3.28Å; I1085-R1087 PolarHBondContact O-N 2.87Å
1088	E	77.8	Confident	86.3	Confident	163 Å²	163	48.1 Å²	48.1	76%	0.762	22%	0.224	S	C	*	.	S	Bend	trans	-106.2	12.3	-178.4	-60.8	-168.1	170.3	0	0	112.7	T1090	E1088-T1090 PolarHBondContact O-N 2.79Å; E1088-T1090 VanDerWaalsContact O-N 3.11Å
1089	A	75.7	Confident	86.6	Confident	34 Å²	34	48.5 Å²	48.5	28%	0.281	23%	0.225	S	C	.	.			trans	-62.1	115.8	-179	0	0	0	0	0	111.2	R1091 L1092	A1089-R1091 PolarHBondContact O-N 2.97Å; A1089-L1092 HydrophobicContact CB-CD2 3.74Å; A1089-L1092 HydrophobicContact CB-CG 4.49Å
1090	T	69.3	Low	86.7	Confident	119 Å²	119	48.2 Å²	48.2	73%	0.73	22%	0.223	S	C	*	.	S	Bend	trans	-73.2	-15.8	179	59.4	0	0	0	0	113.6	E1088 M1211	E1088-T1090 PolarHBondContact O-N 2.79Å; E1088-T1090 VanDerWaalsContact O-N 3.11Å; T1090-M1211 WeakPolarHBondContact O-CE 3.29Å
1091	R	75.4	Confident	86.4	Confident	151 Å²	151	51.6 Å²	51.6	57%	0.57	24%	0.24	S	C	*	.			trans	-148	124.3	176	-165.5	178.9	-169.4	-160.9	2.1	108.7	A1089 D1210	A1089-R1091 PolarHBondContact O-N 2.97Å; R1091-D1210 IonicContact CZ-OD1 3.37Å; R1091-D1210 IonicContact CZ-OD2 2.66Å; R1091-D1210 IonicContact NE-OD1 3.71Å; R1091-D1210 PolarHBondContact NE-OD1 2.83Å; R1091-D1210 IonicContact NE-OD2 2.61Å; R1091-D1210 VanDerWaalsContact NH2-CG 3.34Å; R1091-D1210 IonicContact NH2-OD1 3.64Å; R1091-D1210 IonicContact NH2-OD2 3.41Å; R1091-D1210 PolarHBondContact NH2-OD2 3.11Å
1092	L	81.6	Confident	86.3	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.01	24%	0.236	C	C	.	.			trans	-99.8	128.4	171.9	-63.2	169.9	0	0	0	107.9	V1053 A1089 S1094 Q1116 F1209	V1053-L1092 HydrophobicContact CB-CD1 4.43Å; V1053-L1092 HydrophobicContact CG1-CD1 3.82Å; V1053-L1092 HydrophobicContact CG2-CD1 3.97Å; A1089-L1092 HydrophobicContact CB-CD2 3.74Å; A1089-L1092 HydrophobicContact CB-CG 4.49Å; L1092-S1094 VanDerWaalsContact C-N 3.33Å; L1092-Q1116 HydrophobicContact CD2-CG 4.32Å; L1092-F1209 HydrophobicContact CB-CD1 4.45Å; L1092-F1209 HydrophobicContact CB-CE1 4.39Å
1093	R	80.4	Confident	86.3	Confident	135 Å²	135	44.9 Å²	44.9	51%	0.509	22%	0.215	S	C	.	.	S	Bend	trans	-74.4	-27.8	177.4	-69	-177.7	170.2	-169.9	-5.4	111.9	D954 C1206	D954-R1093 VanDerWaalsContact CB-CZ 3.48Å; D954-R1093 PolarHBondContact O-NE 3.01Å; D954-R1093 PolarHBondContact O-NH1 3.49Å; D954-R1093 VanDerWaalsContact O-NH1 3.11Å; D954-R1093 IonicContact OD2-NH2 2.75Å; D954-R1093 PolarHBondContact OD2-NH2 3.41Å; R1093-C1206 WeakPolarHBondContact O-CB 3.17Å
1094	S	87.4	Confident	86.2	Confident	3 Å²	3	46.1 Å²	46.1	2%	0.021	22%	0.217	C	C	.	.			trans	-126.9	150.2	176.6	-178.5	0	0	0	0	111.5	L1092 W1096 V1117	L1092-S1094 VanDerWaalsContact C-N 3.33Å; S1094-W1096 PolarHBondContact OG-N 3.05Å; S1094-W1096 PolarHBondContact OG-O 2.96Å; S1094-V1117 VanDerWaalsContact CB-O 3.26Å; S1094-V1117 WeakPolarHBondContact CB-O 3.33Å; S1094-V1117 PolarHBondContact OG-O 2.86Å
1095	R	88.6	Confident	85.5	Confident	45 Å²	45	48.7 Å²	48.7	17%	0.17	24%	0.235	C	C	.	.	S	Bend	trans	-78	-8.5	168.9	-65.4	-173.2	-179.6	-164.9	-2.8	112.9	V1053 F1209	V1053-R1095 WeakPolarHBondContact CG2-O 3.26Å; V1053-R1095 PolarHBondContact N-O 3.05Å; R1095-F1209 HydrophobicContact CG-CB 4.29Å; R1095-F1209 HydrophobicContact CG-CD1 3.87Å; R1095-F1209 HydrophobicContact CG-CD2 3.52Å; R1095-F1209 HydrophobicContact CG-CE1 3.98Å; R1095-F1209 HydrophobicContact CG-CE2 3.62Å; R1095-F1209 HydrophobicContact CG-CG 3.62Å; R1095-F1209 HydrophobicContact CG-CZ 3.84Å
1096	W	94.3	Very high	84.7	Confident	6 Å²	6	53.3 Å²	53.3	2%	0.023	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	133.3	-173.6	-65.1	-83.3	0	0	0	110.8	C369 L1050 I1051 S1094 Q1116 V1117 P1119 V1122 L1148 L1149 L1151	C369-W1096 HydrophobicContact CB-CH2 3.93Å; L1050-W1096 HydrophobicContact CD1-CB 4.23Å; I1051-W1096 VanDerWaalsContact O-CA 3.28Å; I1051-W1096 WeakPolarHBondContact O-CA 3.39Å; S1094-W1096 PolarHBondContact OG-N 3.05Å; S1094-W1096 PolarHBondContact OG-O 2.96Å; W1096-Q1116 WeakPolarHBondContact O-CA 3.26Å; W1096-V1117 PolarHBondContact O-N 3.06Å; W1096-P1119 HydrophobicContact CE3-CB 3.77Å; W1096-P1119 HydrophobicContact CE3-CG 4.34Å; W1096-P1119 HydrophobicContact CH2-CB 4.16Å; W1096-P1119 HydrophobicContact CZ3-CB 3.51Å; W1096-P1119 HydrophobicContact CZ3-CG 4Å; W1096-V1122 HydrophobicContact CB-CG2 4.15Å; W1096-V1122 HydrophobicContact CG-CG2 4.37Å; W1096-L1148 PolarHBondContact NE1-O 2.84Å; W1096-L1149 HydrophobicContact CD2-CD1 4.12Å; W1096-L1149 VanDerWaalsContact CE2-CD1 3.46Å; W1096-L1149 HydrophobicContact CH2-CD1 4.1Å; W1096-L1149 HydrophobicContact CZ2-CD1 3.45Å; W1096-L1149 VanDerWaalsContact CZ2-CD1 3.45Å; W1096-L1151 HydrophobicContact CH2-CD2 3.9Å; W1096-L1151 HydrophobicContact CZ2-CD2 4.31Å
1097	L	96.2	Very high	83.7	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	149.9	173.2	-57.1	84	0	0	0	109.9	I1051 V1053 N1086 S1115 Q1116	I1051-L1097 HydrophobicContact CB-CB 4.16Å; I1051-L1097 HydrophobicContact CD1-CB 4.32Å; I1051-L1097 HydrophobicContact CG2-CD1 4.34Å; I1051-L1097 PolarHBondContact N-O 3.26Å; I1051-L1097 PolarHBondContact O-N 3.49Å; V1053-L1097 HydrophobicContact CG2-CD1 3.16Å; N1086-L1097 HydrophobicContact CB-CD2 3.84Å; L1097-S1115 CarbonylContact C-O 3.54Å; L1097-S1115 WeakPolarHBondContact CA-O 3.35Å; L1097-S1115 WeakPolarHBondContact CB-O 3.37Å; L1097-Q1116 HydrophobicContact CD2-CG 4.23Å; L1097-Q1116 HydrophobicContact CG-CG 4.18Å
1098	T	97.1	Very high	83.3	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	157	166	-169.4	0	0	0	0	110.4	L1042 M1043 L1046 N1049 S1114 S1115 V1117	L1042-T1098 HydrophobicContact CD2-CG2 4.47Å; L1042-T1098 HydrophobicContact CG-CG2 4.46Å; M1043-T1098 HydrophobicContact CB-CG2 3.92Å; M1043-T1098 HydrophobicContact CG-CG2 4.48Å; L1046-T1098 HydrophobicContact CD1-CG2 4.49Å; N1049-T1098 WeakPolarHBondContact O-CA 3.46Å; N1049-T1098 PolarHBondContact O-OG1 3.06Å; T1098-S1114 CarbonylContact O-C 3.5Å; T1098-S1114 VanDerWaalsContact O-CA 3.28Å; T1098-S1114 WeakPolarHBondContact O-CA 3.3Å; T1098-S1115 PolarHBondContact N-O 2.91Å; T1098-S1115 PolarHBondContact O-N 3.32Å; T1098-V1117 HydrophobicContact CG2-CG2 3.68Å
1099	Y	96.2	Very high	83.7	Confident	15 Å²	15	48.2 Å²	48.2	6%	0.059	26%	0.262	C	S	.	.			trans	-152	154.1	179.4	66.2	-79.8	0	0	0	111.5	N1049 I1051 T1073 A1102 V1111 D1113	N1049-Y1099 HydrophobicContact CB-CD1 4.03Å; N1049-Y1099 HydrophobicContact CB-CD2 4.38Å; N1049-Y1099 HydrophobicContact CB-CE1 3.78Å; N1049-Y1099 HydrophobicContact CB-CE2 4.15Å; N1049-Y1099 HydrophobicContact CB-CG 4.33Å; N1049-Y1099 WeakPolarHBondContact CB-O 3.3Å; N1049-Y1099 PolarHBondContact ND2-O 2.94Å; I1051-Y1099 HydrophobicContact CD1-CD1 3.49Å; I1051-Y1099 VanDerWaalsContact CD1-CD1 3.49Å; I1051-Y1099 HydrophobicContact CD1-CE1 4Å; I1051-Y1099 HydrophobicContact CD1-CG 4.21Å; I1051-Y1099 HydrophobicContact CG1-CD1 3.62Å; I1051-Y1099 HydrophobicContact CG1-CE1 3.66Å; T1073-Y1099 HydrophobicContact CG2-CE1 3.99Å; Y1099-A1102 HydrophobicContact CD2-CB 4.3Å; Y1099-A1102 HydrophobicContact CE2-CB 3.7Å; Y1099-V1111 VanDerWaalsContact CB-CG1 3.44Å; Y1099-V1111 HydrophobicContact CD1-CG2 4.39Å; Y1099-V1111 HydrophobicContact CD2-CG1 4.02Å; Y1099-V1111 HydrophobicContact CD2-CG2 3.82Å; Y1099-V1111 HydrophobicContact CE2-CG2 4.01Å; Y1099-V1111 HydrophobicContact CG-CG1 3.74Å; Y1099-V1111 HydrophobicContact CG-CG2 4.02Å; Y1099-D1113 WeakPolarHBondContact CB-O 3.41Å
1100	F	93.3	Very high	84.4	Confident	31 Å²	31	48.3 Å²	48.3	14%	0.136	26%	0.256	C	S	.	.	S	Bend	trans	-96.2	-53.1	173.4	177.6	-123.6	0	0	0	111.7	D903 L906 L929 L1046 N1049 D1113	D903-F1100 HydrophobicContact CB-CE2 4.08Å; D903-F1100 HydrophobicContact CB-CZ 4.07Å; L906-F1100 HydrophobicContact CD1-CD1 4.3Å; L906-F1100 HydrophobicContact CD1-CD2 4.23Å; L906-F1100 HydrophobicContact CD1-CE1 3.78Å; L906-F1100 HydrophobicContact CD1-CE2 3.69Å; L906-F1100 HydrophobicContact CD1-CZ 3.45Å; L906-F1100 VanDerWaalsContact CD1-CZ 3.45Å; L906-F1100 HydrophobicContact CD2-CD1 4.49Å; L906-F1100 HydrophobicContact CD2-CD2 3.65Å; L906-F1100 HydrophobicContact CD2-CE2 3.87Å; L906-F1100 HydrophobicContact CD2-CG 4.01Å; L906-F1100 HydrophobicContact CD2-CZ 4.4Å; L906-F1100 HydrophobicContact CG-CD2 3.87Å; L906-F1100 HydrophobicContact CG-CE1 4.46Å; L906-F1100 HydrophobicContact CG-CE2 3.51Å; L906-F1100 HydrophobicContact CG-CG 4.49Å; L906-F1100 HydrophobicContact CG-CZ 3.86Å; L929-F1100 HydrophobicContact CB-CD1 4.24Å; L929-F1100 HydrophobicContact CD1-CB 3.99Å; L929-F1100 HydrophobicContact CD1-CD1 3.95Å; L929-F1100 HydrophobicContact CD1-CG 4.06Å; L929-F1100 HydrophobicContact CD2-CB 4.48Å; L929-F1100 HydrophobicContact CD2-CD1 4.19Å; L929-F1100 HydrophobicContact CG-CD1 4.36Å; L1046-F1100 HydrophobicContact CD1-CB 4.28Å; L1046-F1100 HydrophobicContact CD2-CB 4.16Å; L1046-F1100 HydrophobicContact CD2-CD2 3.68Å; L1046-F1100 HydrophobicContact CD2-CG 4.34Å; N1049-F1100 PolarHBondContact ND2-O 3.2Å; F1100-D1113 WeakPolarHBondContact CB-OD2 3.19Å; F1100-D1113 PolarHBondContact N-OD2 3.09Å
1101	M	83.5	Confident	85.5	Confident	72 Å²	72	42.6 Å²	42.6	36%	0.355	22%	0.222	S	C	.	.			trans	-106.4	123.7	-174.2	-59.5	-169.8	-57	0	0	113.6	R1112 D1113	M1101-R1112 HydrophobicContact CE-CB 4.34Å; M1101-R1112 PolarHBondContact O-N 2.78Å; M1101-D1113 WeakPolarHBondContact CB-OD1 3.14Å; M1101-D1113 PolarHBondContact N-OD1 3.4Å; M1101-D1113 VanDerWaalsContact N-OD1 3.1Å
1102	A	87.9	Confident	86	Confident	17 Å²	17	40.3 Å²	40.3	14%	0.14	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	134.9	161.5	0	0	0	0	0	110.1	V786 Y1099 V1109 F1110 V1111	V786-A1102 HydrophobicContact CG1-CB 3.78Å; Y1099-A1102 HydrophobicContact CD2-CB 4.3Å; Y1099-A1102 HydrophobicContact CE2-CB 3.7Å; A1102-V1109 HydrophobicContact CB-CG1 3.99Å; A1102-F1110 CarbonylContact C-O 3.27Å; A1102-F1110 VanDerWaalsContact CA-O 3.32Å; A1102-F1110 WeakPolarHBondContact CA-O 3.42Å; A1102-V1111 HydrophobicContact CB-CG2 4.19Å
1103	V	84.4	Confident	86.5	Confident	23 Å²	23	40.7 Å²	40.7	14%	0.139	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	133.4	-179.7	-177.2	0	0	0	0	109.4	S787 F1110	S787-V1103 CarbonylContact O-C 3.58Å; S787-V1103 VanDerWaalsContact O-CA 3.31Å; S787-V1103 WeakPolarHBondContact O-CA 3.44Å; V1103-F1110 PolarHBondContact N-O 3.23Å; V1103-F1110 PolarHBondContact O-N 3.3Å
1104	K	81.8	Confident	87.2	Confident	49 Å²	49	34.2 Å²	34.2	21%	0.213	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	129.7	172.7	-178.7	176	175.7	-179.5	0	110.6	D781 V786 S787 C788 S1108 V1109	D781-K1104 IonicContact OD2-NZ 3.55Å; D781-K1104 PolarHBondContact OD2-NZ 3.21Å; V786-K1104 HydrophobicContact CG2-CB 3.81Å; S787-K1104 PolarHBondContact O-N 3.48Å; C788-K1104 WeakPolarHBondContact CA-O 3.37Å; C788-K1104 HydrophobicContact CB-CB 4.05Å; C788-K1104 VanDerWaalsContact CB-O 3.24Å; C788-K1104 WeakPolarHBondContact CB-O 3.26Å; K1104-S1108 CarbonylContact C-O 3.53Å; K1104-S1108 VanDerWaalsContact CA-O 3.3Å; K1104-S1108 WeakPolarHBondContact CA-O 3.34Å; K1104-V1109 HydrophobicContact CB-CG2 4.38Å
1105	S	75.9	Confident	87.6	Confident	57 Å²	57	34.1 Å²	34.1	40%	0.399	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	133.1	177.5	-166	0	0	0	0	109	G1107 S1108	S1105-G1107 PolarHBondContact O-N 3.06Å; S1105-G1107 VanDerWaalsContact O-N 3.14Å; S1105-S1108 PolarHBondContact N-O 3.45Å; S1105-S1108 PolarHBondContact O-N 2.96Å; S1105-S1108 VanDerWaalsContact O-O 3.11Å
1106	N	72.4	Confident	87.9	Confident	128 Å²	128	32.3 Å²	32.3	68%	0.684	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.4	40.3	178.8	-58.9	-3.5	0	0	0	113.5	S1108	N1106-S1108 VanDerWaalsContact C-N 3.3Å; N1106-S1108 PolarHBondContact O-N 3.26Å
1107	G	71.4	Confident	88	Confident	64 Å²	64	32 Å²	32	66%	0.66	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.3	-12.6	178.7	0	0	0	0	0	116.1	S1105	S1105-G1107 PolarHBondContact O-N 3.06Å; S1105-G1107 VanDerWaalsContact O-N 3.14Å
1108	S	79.3	Confident	87.8	Confident	40 Å²	40	32.2 Å²	32.2	28%	0.28	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	149.4	-179.8	-68.9	0	0	0	0	112.1	K1104 S1105 N1106	K1104-S1108 CarbonylContact C-O 3.53Å; K1104-S1108 VanDerWaalsContact CA-O 3.3Å; K1104-S1108 WeakPolarHBondContact CA-O 3.34Å; S1105-S1108 PolarHBondContact N-O 3.45Å; S1105-S1108 PolarHBondContact O-N 2.96Å; S1105-S1108 VanDerWaalsContact O-O 3.11Å; N1106-S1108 VanDerWaalsContact C-N 3.3Å; N1106-S1108 PolarHBondContact O-N 3.26Å
1109	V	86.6	Confident	87.6	Confident	21 Å²	21	32.6 Å²	32.6	13%	0.127	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	122.5	177.2	-178.4	0	0	0	0	109.7	V786 I1078 L1079 A1102 K1104	V786-V1109 HydrophobicContact CG1-CG1 4.08Å; V786-V1109 HydrophobicContact CG2-CG1 4.24Å; V786-V1109 HydrophobicContact CG2-CG2 4Å; I1078-V1109 HydrophobicContact CG2-CB 4.14Å; I1078-V1109 HydrophobicContact CG2-CG1 3.93Å; L1079-V1109 PolarHBondContact N-O 3.35Å; A1102-V1109 HydrophobicContact CB-CG1 3.99Å; K1104-V1109 HydrophobicContact CB-CG2 4.38Å
1110	F	89.6	Confident	87.5	Confident	36 Å²	36	32.3 Å²	32.3	16%	0.158	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131.4	-177.6	-67.2	-84.9	0	0	0	112.1	E221 L1079 H1081 A1102 V1103	E221-F1110 VanDerWaalsContact OE2-CE1 3.32Å; E221-F1110 WeakPolarHBondContact OE2-CE1 3.42Å; L1079-F1110 HydrophobicContact CB-CD1 3.77Å; L1079-F1110 HydrophobicContact CB-CE1 3.8Å; L1079-F1110 HydrophobicContact CD1-CE1 3.93Å; L1079-F1110 HydrophobicContact CD1-CZ 4.13Å; L1079-F1110 HydrophobicContact CG-CE1 4.5Å; L1079-F1110 CarbonylContact O-C 3.55Å; L1079-F1110 VanDerWaalsContact O-CA 3.24Å; L1079-F1110 WeakPolarHBondContact O-CA 3.2Å; H1081-F1110 HydrophobicContact CB-CB 4.31Å; A1102-F1110 CarbonylContact C-O 3.27Å; A1102-F1110 VanDerWaalsContact CA-O 3.32Å; A1102-F1110 WeakPolarHBondContact CA-O 3.42Å; V1103-F1110 PolarHBondContact N-O 3.23Å; V1103-F1110 PolarHBondContact O-N 3.3Å
1111	V	91.5	Very high	87.6	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	123.5	172.3	169	0	0	0	0	109.5	I1051 I1078 L1079 L1080 H1081 Y1099 A1102 D1113	I1051-V1111 HydrophobicContact CD1-CG1 4.24Å; I1051-V1111 HydrophobicContact CD1-CG2 4.2Å; I1078-V1111 HydrophobicContact CB-CG2 4.48Å; I1078-V1111 HydrophobicContact CD1-CB 4.26Å; I1078-V1111 HydrophobicContact CD1-CG2 3.76Å; I1078-V1111 HydrophobicContact CG1-CG2 4.17Å; L1079-V1111 PolarHBondContact O-N 3.2Å; L1080-V1111 HydrophobicContact CD2-CB 3.96Å; L1080-V1111 HydrophobicContact CD2-CG1 4.08Å; H1081-V1111 WeakPolarHBondContact CB-O 3.49Å; H1081-V1111 PolarHBondContact N-O 3.27Å; Y1099-V1111 VanDerWaalsContact CB-CG1 3.44Å; Y1099-V1111 HydrophobicContact CD1-CG2 4.39Å; Y1099-V1111 HydrophobicContact CD2-CG1 4.02Å; Y1099-V1111 HydrophobicContact CD2-CG2 3.82Å; Y1099-V1111 HydrophobicContact CE2-CG2 4.01Å; Y1099-V1111 HydrophobicContact CG-CG1 3.74Å; Y1099-V1111 HydrophobicContact CG-CG2 4.02Å; A1102-V1111 HydrophobicContact CB-CG2 4.19Å; V1111-D1113 WeakPolarHBondContact CG1-O 3.39Å
1112	R	86.5	Confident	88.1	Confident	103 Å²	103	27.4 Å²	27.4	39%	0.389	16%	0.161	S	C	.	.			trans	-90.3	-28.8	-172.5	-74.6	-173.1	173.5	174	2.6	114.7	H1081 S1083 M1101	H1081-R1112 HydrophobicContact CB-CG 4.22Å; S1083-R1112 PolarHBondContact OG-O 2.79Å; M1101-R1112 HydrophobicContact CE-CB 4.34Å; M1101-R1112 PolarHBondContact O-N 2.78Å
1113	D	91.9	Very high	88.4	Confident	9 Å²	9	26.6 Å²	26.6	5%	0.048	16%	0.155	C	C	.	.			trans	-130.5	141.4	-179.3	57	-82.1	0	0	0	109.1	H959 Y1099 F1100 M1101 V1111	H959-D1113 IonicContact CE1-OD2 3.5Å; H959-D1113 PolarHBondContact CE1-OD2 3.24Å; H959-D1113 IonicContact NE2-OD2 2.85Å; H959-D1113 PolarHBondContact NE2-OD2 2.98Å; Y1099-D1113 WeakPolarHBondContact CB-O 3.41Å; F1100-D1113 WeakPolarHBondContact CB-OD2 3.19Å; F1100-D1113 PolarHBondContact N-OD2 3.09Å; M1101-D1113 WeakPolarHBondContact CB-OD1 3.14Å; M1101-D1113 PolarHBondContact N-OD1 3.4Å; M1101-D1113 VanDerWaalsContact N-OD1 3.1Å; V1111-D1113 WeakPolarHBondContact CG1-O 3.39Å
1114	S	95.6	Very high	89	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.149	C	C	.	.			trans	-154.3	151.7	175.9	72.5	0	0	0	0	113.9	D958 T1084 N1086 T1098	D958-S1114 PolarHBondContact N-O 2.84Å; D958-S1114 PolarHBondContact OD2-N 3.45Å; T1084-S1114 PolarHBondContact OG1-OG 3.45Å; N1086-S1114 WeakPolarHBondContact CB-OG 3.37Å; N1086-S1114 PolarHBondContact ND2-O 3.42Å; N1086-S1114 PolarHBondContact ND2-OG 3.2Å; T1098-S1114 CarbonylContact O-C 3.5Å; T1098-S1114 VanDerWaalsContact O-CA 3.28Å; T1098-S1114 WeakPolarHBondContact O-CA 3.3Å
1115	S	96.5	Very high	89.6	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	132.1	172.8	-67.8	0	0	0	0	111.7	S957 H959 L1097 T1098 V1117	S957-S1115 WeakPolarHBondContact CA-OG 3.27Å; S957-S1115 WeakPolarHBondContact CB-OG 3.42Å; S957-S1115 WeakPolarHBondContact OG-CB 3.49Å; S957-S1115 PolarHBondContact OG-OG 3.27Å; H959-S1115 PolarHBondContact ND1-OG 3Å; L1097-S1115 CarbonylContact C-O 3.54Å; L1097-S1115 WeakPolarHBondContact CA-O 3.35Å; L1097-S1115 WeakPolarHBondContact CB-O 3.37Å; T1098-S1115 PolarHBondContact N-O 2.91Å; T1098-S1115 PolarHBondContact O-N 3.32Å; S1115-V1117 WeakPolarHBondContact O-CG2 3.33Å
1116	Q	95	Very high	90.3	Very high	8 Å²	8	21.3 Å²	21.3	4%	0.037	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	127.5	173	-64.3	177.1	44.9	0	0	110.8	G956 K1039 N1086 L1092 W1096 L1097	G956-Q1116 WeakPolarHBondContact O-CG 3.41Å; G956-Q1116 PolarHBondContact O-N 3.16Å; K1039-Q1116 VanDerWaalsContact CD-O 3.27Å; K1039-Q1116 WeakPolarHBondContact CD-O 3.43Å; K1039-Q1116 WeakPolarHBondContact CE-O 3.18Å; K1039-Q1116 PolarHBondContact NZ-O 3.08Å; N1086-Q1116 PolarHBondContact OD1-NE2 3.31Å; L1092-Q1116 HydrophobicContact CD2-CG 4.32Å; W1096-Q1116 WeakPolarHBondContact O-CA 3.26Å; L1097-Q1116 HydrophobicContact CD2-CG 4.23Å; L1097-Q1116 HydrophobicContact CG-CG 4.18Å
1117	V	94.7	Very high	90.7	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.114	C	C	.	.			trans	-117.7	136	-172.5	-174.2	0	0	0	0	110.7	M1043 S1094 W1096 T1098 S1115 A1121 V1122	M1043-V1117 HydrophobicContact CB-CG1 3.94Å; M1043-V1117 HydrophobicContact CB-CG2 3.84Å; M1043-V1117 HydrophobicContact CE-CG1 4.38Å; M1043-V1117 HydrophobicContact CG-CB 4.49Å; M1043-V1117 HydrophobicContact CG-CG1 4.07Å; M1043-V1117 HydrophobicContact CG-CG2 4.04Å; S1094-V1117 VanDerWaalsContact CB-O 3.26Å; S1094-V1117 WeakPolarHBondContact CB-O 3.33Å; S1094-V1117 PolarHBondContact OG-O 2.86Å; W1096-V1117 PolarHBondContact O-N 3.06Å; T1098-V1117 HydrophobicContact CG2-CG2 3.68Å; S1115-V1117 WeakPolarHBondContact O-CG2 3.33Å; V1117-A1121 HydrophobicContact CG1-CB 4.04Å; V1117-V1122 HydrophobicContact CB-CG2 4.38Å; V1117-V1122 HydrophobicContact CG1-CG2 3.95Å
1118	H	93.5	Very high	91.1	Very high	4 Å²	4	17.1 Å²	17.1	2%	0.019	9%	0.09	C	C	.	.			trans	-58.7	134.6	175.5	-166.3	-74.9	0	0	0	112.2	L1120 A1121 V1122 L1202 G1204 C1206	H1118-L1120 VanDerWaalsContact C-N 3.31Å; H1118-L1120 WeakPolarHBondContact ND1-CB 3.48Å; H1118-L1120 PolarHBondContact ND1-N 2.83Å; H1118-L1120 PolarHBondContact O-N 2.98Å; H1118-A1121 HydrophobicContact CB-CB 4.25Å; H1118-A1121 WeakPolarHBondContact O-CB 3.4Å; H1118-A1121 PolarHBondContact O-N 3.5Å; H1118-V1122 PolarHBondContact O-N 3.5Å; H1118-L1202 HydrophobicContact CB-CD2 4.2Å; H1118-G1204 PolarHBondContact NE2-O 3.21Å; H1118-C1206 PolarHBondContact CD2-SG 2.95Å
1119	P	92.5	Very high	91.3	Very high	8 Å²	8	21.5 Å²	21.5	5%	0.052	11%	0.11	C	C	.	.	H	α-helix	trans	-56.2	-40.3	-179.5	14.7	-27.2	0	0	0	114.2	W1096 A1121 V1122 L1123 L1151 C1206	W1096-P1119 HydrophobicContact CE3-CB 3.77Å; W1096-P1119 HydrophobicContact CE3-CG 4.34Å; W1096-P1119 HydrophobicContact CH2-CB 4.16Å; W1096-P1119 HydrophobicContact CZ3-CB 3.51Å; W1096-P1119 HydrophobicContact CZ3-CG 4Å; P1119-A1121 VanDerWaalsContact C-N 3.3Å; P1119-A1121 PolarHBondContact O-N 3.35Å; P1119-V1122 WeakPolarHBondContact O-CB 3.44Å; P1119-V1122 PolarHBondContact O-N 2.85Å; P1119-L1123 PolarHBondContact O-N 2.66Å; P1119-L1151 HydrophobicContact CB-CD1 4.39Å; P1119-L1151 HydrophobicContact CB-CD2 4.18Å; P1119-C1206 WeakPolarHBondContact CG-O 3.44Å
1120	L	94.1	Very high	91.5	Very high	8 Å²	8	22 Å²	22	4%	0.042	11%	0.113	C	C	.	.	H	α-helix	trans	-64.8	-31.9	175.7	-66.3	177.5	0	0	0	112.7	I371 V373 H1118 V1122 L1123 L1124 L1161 L1201 L1202	I371-L1120 HydrophobicContact CD1-CD2 3.91Å; I371-L1120 HydrophobicContact CG2-CD1 4.4Å; I371-L1120 HydrophobicContact CG2-CD2 3.84Å; I371-L1120 HydrophobicContact CG2-CG 4.39Å; V373-L1120 HydrophobicContact CG2-CD1 4.38Å; H1118-L1120 VanDerWaalsContact C-N 3.31Å; H1118-L1120 WeakPolarHBondContact ND1-CB 3.48Å; H1118-L1120 PolarHBondContact ND1-N 2.83Å; H1118-L1120 PolarHBondContact O-N 2.98Å; L1120-V1122 VanDerWaalsContact C-N 3.33Å; L1120-L1123 HydrophobicContact CD2-CD2 4.3Å; L1120-L1123 PolarHBondContact O-N 3.41Å; L1120-L1124 HydrophobicContact CB-CD1 4.32Å; L1120-L1124 WeakPolarHBondContact O-CB 3.48Å; L1120-L1124 WeakPolarHBondContact O-CG 3.25Å; L1120-L1124 PolarHBondContact O-N 3.08Å; L1120-L1161 HydrophobicContact CD2-CD1 3.87Å; L1120-L1161 HydrophobicContact CD2-CD2 4.31Å; L1120-L1201 HydrophobicContact CD1-CD1 3.79Å; L1120-L1201 HydrophobicContact CD1-CD2 4.16Å; L1120-L1201 HydrophobicContact CD1-CG 3.76Å; L1120-L1202 HydrophobicContact CB-CD2 4Å
1121	A	95.3	Very high	91.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-66.5	-39.6	173.7	0	0	0	0	0	110.9	M1043 V1117 H1118 P1119 L1124 L1125 L1202	M1043-A1121 WeakPolarHBondContact CE-O 3.3Å; V1117-A1121 HydrophobicContact CG1-CB 4.04Å; H1118-A1121 HydrophobicContact CB-CB 4.25Å; H1118-A1121 WeakPolarHBondContact O-CB 3.4Å; H1118-A1121 PolarHBondContact O-N 3.5Å; P1119-A1121 VanDerWaalsContact C-N 3.3Å; P1119-A1121 PolarHBondContact O-N 3.35Å; A1121-L1124 PolarHBondContact O-N 3.01Å; A1121-L1125 HydrophobicContact CB-CD1 4.22Å; A1121-L1125 VanDerWaalsContact O-CB 3.3Å; A1121-L1125 WeakPolarHBondContact O-CB 3.46Å; A1121-L1125 WeakPolarHBondContact O-CG 3.42Å; A1121-L1125 PolarHBondContact O-N 3.19Å; A1121-L1202 HydrophobicContact CB-CD1 4.3Å; A1121-L1202 HydrophobicContact CB-CD2 3.93Å
1122	V	94.4	Very high	91.6	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-60.8	-44.6	172.5	-169.3	0	0	0	0	111.3	M1043 L1050 W1096 V1117 H1118 P1119 L1120 T1126 L1143 L1149	M1043-V1122 VanDerWaalsContact CE-CA 3.49Å; M1043-V1122 HydrophobicContact CE-CB 4.3Å; M1043-V1122 HydrophobicContact CE-CG2 4.22Å; M1043-V1122 HydrophobicContact SD-CG1 4.42Å; M1043-V1122 HydrophobicContact SD-CG2 4.43Å; L1050-V1122 HydrophobicContact CD1-CG1 4.2Å; L1050-V1122 HydrophobicContact CD1-CG2 4.14Å; L1050-V1122 HydrophobicContact CD2-CG1 3.68Å; W1096-V1122 HydrophobicContact CB-CG2 4.15Å; W1096-V1122 HydrophobicContact CG-CG2 4.37Å; V1117-V1122 HydrophobicContact CB-CG2 4.38Å; V1117-V1122 HydrophobicContact CG1-CG2 3.95Å; H1118-V1122 PolarHBondContact O-N 3.5Å; P1119-V1122 WeakPolarHBondContact O-CB 3.44Å; P1119-V1122 PolarHBondContact O-N 2.85Å; L1120-V1122 VanDerWaalsContact C-N 3.33Å; V1122-T1126 HydrophobicContact CG1-CG2 4.24Å; V1122-T1126 WeakPolarHBondContact O-CG2 3.39Å; V1122-T1126 PolarHBondContact O-OG1 3.28Å; V1122-L1143 HydrophobicContact CG1-CD1 4.23Å; V1122-L1149 HydrophobicContact CB-CD1 4.45Å; V1122-L1149 HydrophobicContact CB-CD2 4.09Å; V1122-L1149 HydrophobicContact CG1-CB 4.49Å; V1122-L1149 HydrophobicContact CG1-CD1 4.46Å; V1122-L1149 HydrophobicContact CG1-CD2 3.87Å
1123	L	94.5	Very high	91.8	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-66.5	-39.1	178.9	177.9	63.2	0	0	0	113.1	I371 P1119 L1120 V1130 I1141 L1149 L1151 L1161 R1165	I371-L1123 HydrophobicContact CD1-CD2 4.44Å; P1119-L1123 PolarHBondContact O-N 2.66Å; L1120-L1123 HydrophobicContact CD2-CD2 4.3Å; L1120-L1123 PolarHBondContact O-N 3.41Å; L1123-V1130 HydrophobicContact CD1-CG1 4.02Å; L1123-I1141 HydrophobicContact CD1-CD1 3.67Å; L1123-I1141 HydrophobicContact CD1-CG1 3.77Å; L1123-I1141 HydrophobicContact CD1-CG2 4.13Å; L1123-I1141 HydrophobicContact CD2-CD1 4.26Å; L1123-I1141 HydrophobicContact CD2-CG2 4.06Å; L1123-I1141 HydrophobicContact CG-CD1 4.49Å; L1123-L1149 HydrophobicContact CB-CD2 4Å; L1123-L1149 HydrophobicContact CD1-CD2 4.4Å; L1123-L1151 HydrophobicContact CB-CD1 4.11Å; L1123-L1151 HydrophobicContact CD2-CD1 4.14Å; L1123-L1161 HydrophobicContact CD2-CB 4.36Å; L1123-L1161 HydrophobicContact CD2-CD1 4.22Å; L1123-R1165 VanDerWaalsContact O-CD 3.31Å; L1123-R1165 WeakPolarHBondContact O-CD 3.34Å; L1123-R1165 PolarHBondContact O-NE 2.91Å; L1123-R1165 PolarHBondContact O-NH1 3.48Å
1124	L	95.2	Very high	91.8	Very high	4 Å²	4	35.8 Å²	35.8	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-94.9	-29	-166.6	-66.5	173.4	0	0	0	113.5	L1120 A1121 L1161 F1164 R1165 L1168 L1198 L1201	L1120-L1124 HydrophobicContact CB-CD1 4.32Å; L1120-L1124 WeakPolarHBondContact O-CB 3.48Å; L1120-L1124 WeakPolarHBondContact O-CG 3.25Å; L1120-L1124 PolarHBondContact O-N 3.08Å; A1121-L1124 PolarHBondContact O-N 3.01Å; L1124-L1161 HydrophobicContact CD2-CD2 4.49Å; L1124-L1161 WeakPolarHBondContact CD2-O 3.37Å; L1124-F1164 HydrophobicContact CD1-CD1 4.01Å; L1124-F1164 HydrophobicContact CD1-CE1 4.23Å; L1124-F1164 HydrophobicContact CD2-CD1 4.1Å; L1124-R1165 HydrophobicContact CD2-CB 3.91Å; L1124-R1165 PolarHBondContact O-NH1 3.35Å; L1124-L1168 HydrophobicContact CB-CD1 4.05Å; L1124-L1198 HydrophobicContact CD1-CD1 3.92Å; L1124-L1201 HydrophobicContact CD1-CD2 3.59Å
1125	L	95.7	Very high	91.5	Very high	10 Å²	10	40.9 Å²	40.9	5%	0.052	20%	0.204	C	C	.	.	H	α-helix	trans	-108.3	-11.3	-169.6	-54.1	-179.6	0	0	0	115	F916 L1037 V1041 A1044 A1121 L1168 L1198	F916-L1125 HydrophobicContact CD1-CD2 4.36Å; F916-L1125 HydrophobicContact CE1-CD2 3.44Å; F916-L1125 VanDerWaalsContact CE1-CD2 3.44Å; F916-L1125 HydrophobicContact CE2-CD2 4.49Å; F916-L1125 HydrophobicContact CZ-CD2 3.53Å; L1037-L1125 HydrophobicContact CD1-CD1 4.5Å; V1041-L1125 HydrophobicContact CG2-CD1 4.29Å; A1044-L1125 HydrophobicContact CB-CB 3.82Å; A1044-L1125 VanDerWaalsContact CB-O 3.3Å; A1044-L1125 WeakPolarHBondContact CB-O 3.45Å; A1121-L1125 HydrophobicContact CB-CD1 4.22Å; A1121-L1125 VanDerWaalsContact O-CB 3.3Å; A1121-L1125 WeakPolarHBondContact O-CB 3.46Å; A1121-L1125 WeakPolarHBondContact O-CG 3.42Å; A1121-L1125 PolarHBondContact O-N 3.19Å; L1125-L1168 HydrophobicContact CD2-CD1 4.26Å; L1125-L1198 HydrophobicContact CD2-CD2 3.99Å
1126	T	89.9	Confident	90.9	Very high	4 Å²	4	43.6 Å²	43.6	3%	0.025	23%	0.232	C	C	.	.			trans	-69.3	154.2	173.1	50.1	0	0	0	0	110.6	M1043 Y1047 V1122 L1143 R1165	M1043-T1126 HydrophobicContact CE-CG2 4.01Å; M1043-T1126 HydrophobicContact SD-CG2 3.77Å; Y1047-T1126 HydrophobicContact CD2-CG2 3.5Å; Y1047-T1126 VanDerWaalsContact CD2-CG2 3.5Å; Y1047-T1126 HydrophobicContact CE2-CG2 3.72Å; Y1047-T1126 HydrophobicContact CG-CG2 3.99Å; V1122-T1126 HydrophobicContact CG1-CG2 4.24Å; V1122-T1126 WeakPolarHBondContact O-CG2 3.39Å; V1122-T1126 PolarHBondContact O-OG1 3.28Å; T1126-L1143 WeakPolarHBondContact OG1-CD2 3.37Å; T1126-R1165 PolarHBondContact O-NH1 3.32Å; T1126-R1165 PolarHBondContact O-NH2 2.98Å; T1126-R1165 PolarHBondContact OG1-NH2 3.19Å
1127	D	80.2	Confident	90.6	Very high	88 Å²	88	53.4 Å²	53.4	47%	0.471	27%	0.268	S	S	.	.			trans	-87.6	-11.6	-179.9	-60.2	-43.9	0	0	0	113.6	K908	K908-D1127 VanDerWaalsContact CE-OD2 3.23Å; K908-D1127 WeakPolarHBondContact CE-OD2 3.38Å; K908-D1127 IonicContact NZ-OD2 3.44Å; K908-D1127 PolarHBondContact NZ-OD2 3.07Å
1128	G	80.3	Confident	90.4	Very high	15 Å²	15	61.3 Å²	61.3	16%	0.155	30%	0.298	C	S	.	.	S	Bend	trans	-67	147.3	-177.3	0	0	0	0	0	113.5	R1165	G1128-R1165 PolarHBondContact O-NH2 2.84Å
1129	D	84.8	Confident	90.3	Very high	133 Å²	133	61.2 Å²	61.2	71%	0.711	30%	0.298	S	S	*	.			trans	-60.1	158.9	172.1	-82.1	-38.6	0	0	0	111.7	S1144	D1129-S1144 WeakPolarHBondContact CB-OG 3.29Å; D1129-S1144 WeakPolarHBondContact O-CB 3.24Å; D1129-S1144 PolarHBondContact O-N 3.45Å; D1129-S1144 PolarHBondContact O-OG 2.99Å
1130	V	90.1	Very high	90.3	Very high	32 Å²	32	63 Å²	63	19%	0.194	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	135.8	176.2	-67	0	0	0	0	111.7	L1123 I1141 S1142 L1143 S1144 R1162	L1123-V1130 HydrophobicContact CD1-CG1 4.02Å; V1130-I1141 HydrophobicContact CB-CD1 4.13Å; V1130-I1141 HydrophobicContact CB-CG1 4.02Å; V1130-I1141 HydrophobicContact CG1-CD1 4.44Å; V1130-I1141 HydrophobicContact CG1-CG1 4.41Å; V1130-I1141 HydrophobicContact CG2-CD1 4.1Å; V1130-I1141 HydrophobicContact CG2-CG1 4.49Å; V1130-S1142 CarbonylContact C-O 3.58Å; V1130-S1142 VanDerWaalsContact CA-O 3.26Å; V1130-S1142 WeakPolarHBondContact CA-O 3.39Å; V1130-L1143 HydrophobicContact CG1-CD2 4.31Å; V1130-S1144 PolarHBondContact N-OG 3.23Å; V1130-R1162 HydrophobicContact CG2-CG 4.5Å
1131	H	90.8	Very high	90.2	Very high	112 Å²	112	62.7 Å²	62.7	52%	0.519	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	132.3	170.5	-71.2	-49.2	0	0	0	110.2	I1141 S1142 S1144	H1131-I1141 WeakPolarHBondContact O-CA 3.26Å; H1131-S1142 PolarHBondContact N-O 2.9Å; H1131-S1142 PolarHBondContact O-N 2.61Å; H1131-S1144 PolarHBondContact CD2-OG 2.96Å; H1131-S1144 VanDerWaalsContact CD2-OG 3.3Å; H1131-S1144 PolarHBondContact N-OG 2.91Å; H1131-S1144 WeakPolarHBondContact NE2-CB 3.41Å; H1131-S1144 PolarHBondContact NE2-OG 3.25Å
1132	I	91.5	Very high	90	Very high	49 Å²	49	64.1 Å²	64.1	25%	0.251	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	133.6	176.6	-59.8	-179.9	0	0	0	109.1	D1134 A1139 T1140 I1141 V1158 R1162	I1132-D1134 HydrophobicContact CG2-CB 4.34Å; I1132-A1139 HydrophobicContact CG2-CB 4.26Å; I1132-T1140 WeakPolarHBondContact CA-O 3.25Å; I1132-I1141 HydrophobicContact CD1-CD1 3.99Å; I1132-I1141 HydrophobicContact CG1-CB 4.33Å; I1132-I1141 HydrophobicContact CG1-CD1 3.95Å; I1132-I1141 HydrophobicContact CG1-CG1 3.94Å; I1132-V1158 HydrophobicContact CD1-CG1 4.05Å; I1132-V1158 HydrophobicContact CG1-CG1 4.38Å; I1132-V1158 HydrophobicContact CG2-CG1 4.09Å; I1132-R1162 HydrophobicContact CD1-CB 3.97Å; I1132-R1162 HydrophobicContact CD1-CG 4.11Å
1133	R	91.5	Very high	89.8	Confident	203 Å²	203	64.3 Å²	64.3	77%	0.766	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.4	118.2	166.1	-60.5	177.5	176.5	161.9	-1	107.1	A1139 T1140	R1133-A1139 CarbonylContact O-C 3.4Å; R1133-A1139 WeakPolarHBondContact O-CA 3.11Å; R1133-T1140 PolarHBondContact N-O 2.99Å; R1133-T1140 PolarHBondContact O-N 3.4Å
1134	D	91.9	Very high	89.4	Confident	72 Å²	72	66.2 Å²	66.2	39%	0.385	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	122.6	-174.3	-171.3	-6.4	0	0	0	108.8	I1132 G1136 A1139 S1155 R1159	I1132-D1134 HydrophobicContact CG2-CB 4.34Å; D1134-G1136 VanDerWaalsContact C-N 3.35Å; D1134-G1136 WeakPolarHBondContact OD1-CA 3.26Å; D1134-G1136 PolarHBondContact OD1-N 3.48Å; D1134-A1139 HydrophobicContact CB-CB 3.99Å; D1134-S1155 VanDerWaalsContact OD1-CB 3.24Å; D1134-S1155 WeakPolarHBondContact OD1-CB 3.19Å; D1134-S1155 PolarHBondContact OD1-OG 3.36Å; D1134-S1155 WeakPolarHBondContact OD2-CB 3.34Å; D1134-R1159 IonicContact OD2-NH1 3.93Å; D1134-R1159 PolarHBondContact OD2-NH1 2.96Å
1135	D	89.3	Confident	88.8	Confident	107 Å²	107	68.2 Å²	68.2	57%	0.572	34%	0.342	S	S	*	.			trans	-93.4	4.1	175.6	72.1	22.5	0	0	0	112.8	R1137 R1138	D1135-R1137 VanDerWaalsContact C-N 3.35Å; D1135-R1137 WeakPolarHBondContact OD1-CA 3.31Å; D1135-R1137 PolarHBondContact OD1-N 2.97Å; D1135-R1138 VanDerWaalsContact CG-O 3.31Å; D1135-R1138 PolarHBondContact N-O 3.32Å; D1135-R1138 PolarHBondContact OD1-N 3.47Å; D1135-R1138 VanDerWaalsContact OD1-O 3.1Å
1136	G	84.4	Confident	88.3	Confident	57 Å²	57	68.3 Å²	68.3	59%	0.588	34%	0.344	S	S	*	.	S	Bend	trans	92.3	-22.3	-177.3	0	0	0	0	0	114.1	D1134 S1155	D1134-G1136 VanDerWaalsContact C-N 3.35Å; D1134-G1136 WeakPolarHBondContact OD1-CA 3.26Å; D1134-G1136 PolarHBondContact OD1-N 3.48Å; G1136-S1155 VanDerWaalsContact C-OG 3.27Å; G1136-S1155 PolarHBondContact O-OG 3.06Å
1137	R	87.3	Confident	88	Confident	215 Å²	215	71.2 Å²	71.2	81%	0.811	36%	0.359	S	S	*	.	S	Bend	trans	-111.6	-43.8	174.4	-66.8	-176.3	179.6	-177.8	0.3	112	D1135 D1154 S1155	D1135-R1137 VanDerWaalsContact C-N 3.35Å; D1135-R1137 WeakPolarHBondContact OD1-CA 3.31Å; D1135-R1137 PolarHBondContact OD1-N 2.97Å; R1137-D1154 WeakPolarHBondContact O-CA 3.41Å; R1137-S1155 PolarHBondContact N-OG 3.3Å; R1137-S1155 PolarHBondContact O-N 2.92Å; R1137-S1155 VanDerWaalsContact O-N 3.13Å; R1137-S1155 PolarHBondContact O-OG 2.99Å
1138	R	90.4	Very high	88.5	Confident	166 Å²	166	67.1 Å²	67.1	63%	0.626	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.3	144.7	177.3	-67.8	-175.6	-65.1	-168.9	-1.6	109.6	D1135 G1153 S1155	D1135-R1138 VanDerWaalsContact CG-O 3.31Å; D1135-R1138 PolarHBondContact N-O 3.32Å; D1135-R1138 PolarHBondContact OD1-N 3.47Å; D1135-R1138 VanDerWaalsContact OD1-O 3.1Å; R1138-G1153 WeakPolarHBondContact CA-O 3.5Å; R1138-S1155 PolarHBondContact N-OG 3.27Å
1139	A	93.1	Very high	89	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.008	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	143.6	173.1	0	0	0	0	0	110.5	I1132 R1133 D1134 E1152 G1153 V1158	I1132-A1139 HydrophobicContact CG2-CB 4.26Å; R1133-A1139 CarbonylContact O-C 3.4Å; R1133-A1139 WeakPolarHBondContact O-CA 3.11Å; D1134-A1139 HydrophobicContact CB-CB 3.99Å; A1139-E1152 WeakPolarHBondContact O-CA 3.44Å; A1139-G1153 PolarHBondContact N-O 2.94Å; A1139-G1153 PolarHBondContact O-N 3.41Å; A1139-V1158 HydrophobicContact CB-CB 3.76Å; A1139-V1158 HydrophobicContact CB-CG1 3.8Å; A1139-V1158 HydrophobicContact CB-CG2 3.91Å
1140	T	91.8	Very high	89.2	Confident	47 Å²	47	65.2 Å²	65.2	29%	0.288	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	135.5	170.3	64	0	0	0	0	109.2	P368 I1132 R1133 L1151 E1152	P368-T1140 HydrophobicContact CG-CG2 3.99Å; I1132-T1140 WeakPolarHBondContact CA-O 3.25Å; R1133-T1140 PolarHBondContact N-O 2.99Å; R1133-T1140 PolarHBondContact O-N 3.4Å; T1140-L1151 CarbonylContact C-O 3.24Å; T1140-L1151 VanDerWaalsContact CA-O 3.26Å; T1140-L1151 WeakPolarHBondContact CA-O 3.5Å; T1140-E1152 HydrophobicContact CG2-CB 4.09Å
1141	I	92.4	Very high	89.3	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	134.5	176.7	-169.9	161.3	0	0	0	110.2	L1123 V1130 H1131 I1132 L1151 V1158	L1123-I1141 HydrophobicContact CD1-CD1 3.67Å; L1123-I1141 HydrophobicContact CD1-CG1 3.77Å; L1123-I1141 HydrophobicContact CD1-CG2 4.13Å; L1123-I1141 HydrophobicContact CD2-CD1 4.26Å; L1123-I1141 HydrophobicContact CD2-CG2 4.06Å; L1123-I1141 HydrophobicContact CG-CD1 4.49Å; V1130-I1141 HydrophobicContact CB-CD1 4.13Å; V1130-I1141 HydrophobicContact CB-CG1 4.02Å; V1130-I1141 HydrophobicContact CG1-CD1 4.44Å; V1130-I1141 HydrophobicContact CG1-CG1 4.41Å; V1130-I1141 HydrophobicContact CG2-CD1 4.1Å; V1130-I1141 HydrophobicContact CG2-CG1 4.49Å; H1131-I1141 WeakPolarHBondContact O-CA 3.26Å; I1132-I1141 HydrophobicContact CD1-CD1 3.99Å; I1132-I1141 HydrophobicContact CG1-CB 4.33Å; I1132-I1141 HydrophobicContact CG1-CD1 3.95Å; I1132-I1141 HydrophobicContact CG1-CG1 3.94Å; I1141-L1151 HydrophobicContact CG2-CB 3.9Å; I1141-L1151 PolarHBondContact N-O 3.49Å; I1141-L1151 PolarHBondContact O-N 3.42Å; I1141-V1158 HydrophobicContact CB-CG1 3.99Å; I1141-V1158 HydrophobicContact CD1-CG1 4.28Å; I1141-V1158 HydrophobicContact CG2-CG1 4.41Å
1142	S	91.6	Very high	89.3	Confident	29 Å²	29	60.9 Å²	60.9	20%	0.203	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	157.5	177.4	64.6	0	0	0	0	111.2	V1130 H1131 L1149	V1130-S1142 CarbonylContact C-O 3.58Å; V1130-S1142 VanDerWaalsContact CA-O 3.26Å; V1130-S1142 WeakPolarHBondContact CA-O 3.39Å; H1131-S1142 PolarHBondContact N-O 2.9Å; H1131-S1142 PolarHBondContact O-N 2.61Å; S1142-L1149 WeakPolarHBondContact CA-O 3.42Å; S1142-L1149 WeakPolarHBondContact CB-O 3.44Å
1143	L	89.4	Confident	89.3	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.021	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	145.3	168.2	-59.4	173.9	0	0	0	109.3	Y1047 V1122 T1126 V1130 S1146 L1149	Y1047-L1143 HydrophobicContact CE2-CD1 4.41Å; V1122-L1143 HydrophobicContact CG1-CD1 4.23Å; T1126-L1143 WeakPolarHBondContact OG1-CD2 3.37Å; V1130-L1143 HydrophobicContact CG1-CD2 4.31Å; L1143-S1146 VanDerWaalsContact O-O 3.07Å; L1143-L1149 HydrophobicContact CD1-CB 3.88Å; L1143-L1149 HydrophobicContact CD1-CD2 4.23Å; L1143-L1149 HydrophobicContact CD2-CD2 4.32Å; L1143-L1149 HydrophobicContact CG-CB 4.02Å; L1143-L1149 HydrophobicContact CG-CD2 4.02Å
1144	S	84.9	Confident	89.4	Confident	41 Å²	41	52.6 Å²	52.6	29%	0.287	27%	0.267	S	S	.	.	S	Bend	trans	-84.4	-26.9	-176.9	-53.2	0	0	0	0	112.3	D1129 V1130 H1131	D1129-S1144 WeakPolarHBondContact CB-OG 3.29Å; D1129-S1144 WeakPolarHBondContact O-CB 3.24Å; D1129-S1144 PolarHBondContact O-N 3.45Å; D1129-S1144 PolarHBondContact O-OG 2.99Å; V1130-S1144 PolarHBondContact N-OG 3.23Å; H1131-S1144 PolarHBondContact CD2-OG 2.96Å; H1131-S1144 VanDerWaalsContact CD2-OG 3.3Å; H1131-S1144 PolarHBondContact N-OG 2.91Å; H1131-S1144 WeakPolarHBondContact NE2-CB 3.41Å; H1131-S1144 PolarHBondContact NE2-OG 3.25Å
1145	D	84.6	Confident	89.5	Confident	47 Å²	47	49.4 Å²	49.4	25%	0.251	25%	0.25	S	C	.	.	S	Bend	trans	-96.4	-8.2	-176.9	69.8	-38	0	0	0	113.5	Y1047 K1074	Y1047-D1145 VanDerWaalsContact CE1-OD2 3.22Å; Y1047-D1145 WeakPolarHBondContact CE1-OD2 3.46Å; Y1047-D1145 VanDerWaalsContact CZ-OD2 3.27Å; Y1047-D1145 PolarHBondContact OH-OD1 3.48Å; Y1047-D1145 PolarHBondContact OH-OD2 3.44Å; K1074-D1145 WeakPolarHBondContact CE-O 3.18Å; K1074-D1145 PolarHBondContact NZ-O 3.24Å; K1074-D1145 IonicContact NZ-OD2 3.72Å
1146	S	83.8	Confident	89.7	Confident	12 Å²	12	47.6 Å²	47.6	8%	0.084	24%	0.235	C	C	.	.			trans	-150	150.2	174.4	83.5	0	0	0	0	113.6	L1143 L1148	L1143-S1146 VanDerWaalsContact O-O 3.07Å; S1146-L1148 VanDerWaalsContact C-N 3.3Å
1147	D	84.5	Confident	90.1	Very high	65 Å²	65	45 Å²	45	35%	0.348	21%	0.208	S	C	.	.	S	Bend	trans	-89.8	7.7	173.9	73.2	-26.9	0	0	0	113.5	R1072 L1149	R1072-D1147 IonicContact NH2-OD1 3.4Å; R1072-D1147 IonicContact NH2-OD2 3.7Å; R1072-D1147 PolarHBondContact NH2-OD2 3.01Å; D1147-L1149 VanDerWaalsContact C-N 3.34Å; D1147-L1149 PolarHBondContact O-N 3.36Å
1148	L	89.4	Confident	90.5	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.01	17%	0.169	C	C	.	.	S	Bend	trans	-73.1	-24.7	-173.7	-61.4	178	0	0	0	113.3	L1050 Q1052 R1072 K1074 W1096 S1146	L1050-L1148 HydrophobicContact CB-CD1 4.18Å; L1050-L1148 HydrophobicContact CD2-CB 4.1Å; L1050-L1148 HydrophobicContact CD2-CD1 4.19Å; L1050-L1148 HydrophobicContact CG-CD1 4.39Å; Q1052-L1148 HydrophobicContact CB-CB 4.4Å; Q1052-L1148 HydrophobicContact CB-CD2 3.99Å; Q1052-L1148 PolarHBondContact NE2-O 3.07Å; R1072-L1148 HydrophobicContact CG-CD2 4.26Å; K1074-L1148 HydrophobicContact CB-CD1 4.43Å; W1096-L1148 PolarHBondContact NE1-O 2.84Å; S1146-L1148 VanDerWaalsContact C-N 3.3Å
1149	L	91	Very high	90.6	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.159	C	C	.	.			trans	-122.2	118.4	178.1	-175.3	74.7	0	0	0	110	W1096 V1122 L1123 S1142 L1143 D1147 L1151	W1096-L1149 HydrophobicContact CD2-CD1 4.12Å; W1096-L1149 VanDerWaalsContact CE2-CD1 3.46Å; W1096-L1149 HydrophobicContact CH2-CD1 4.1Å; W1096-L1149 HydrophobicContact CZ2-CD1 3.45Å; W1096-L1149 VanDerWaalsContact CZ2-CD1 3.45Å; V1122-L1149 HydrophobicContact CB-CD1 4.45Å; V1122-L1149 HydrophobicContact CB-CD2 4.09Å; V1122-L1149 HydrophobicContact CG1-CB 4.49Å; V1122-L1149 HydrophobicContact CG1-CD1 4.46Å; V1122-L1149 HydrophobicContact CG1-CD2 3.87Å; L1123-L1149 HydrophobicContact CB-CD2 4Å; L1123-L1149 HydrophobicContact CD1-CD2 4.4Å; S1142-L1149 WeakPolarHBondContact CA-O 3.42Å; S1142-L1149 WeakPolarHBondContact CB-O 3.44Å; L1143-L1149 HydrophobicContact CD1-CB 3.88Å; L1143-L1149 HydrophobicContact CD1-CD2 4.23Å; L1143-L1149 HydrophobicContact CD2-CD2 4.32Å; L1143-L1149 HydrophobicContact CG-CB 4.02Å; L1143-L1149 HydrophobicContact CG-CD2 4.02Å; D1147-L1149 VanDerWaalsContact C-N 3.34Å; D1147-L1149 PolarHBondContact O-N 3.36Å; L1149-L1151 HydrophobicContact CD1-CD1 4.01Å; L1149-L1151 HydrophobicContact CD1-CD2 3.72Å; L1149-L1151 HydrophobicContact CD1-CG 3.81Å; L1149-L1151 HydrophobicContact CD2-CD1 4.21Å; L1149-L1151 HydrophobicContact CD2-CG 4.46Å; L1149-L1151 HydrophobicContact CG-CD1 4.25Å; L1149-L1151 HydrophobicContact CG-CD2 4.41Å; L1149-L1151 HydrophobicContact CG-CG 4.01Å
1150	R	89.6	Confident	90.6	Very high	107 Å²	107	32.4 Å²	32.4	40%	0.404	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	121	166.3	-63.9	-173.5	-166.5	155	4.2	108.6	P368 C369	P368-R1150 WeakPolarHBondContact CA-O 3.28Å; P368-R1150 HydrophobicContact CB-CB 4.26Å; C369-R1150 PolarHBondContact N-O 3.32Å
1151	L	91.4	Very high	90.7	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	153.6	-179.6	-53.1	178.1	0	0	0	109.9	C369 I371 W1096 P1119 L1123 T1140 I1141 L1149	C369-L1151 HydrophobicContact CB-CD2 3.77Å; C369-L1151 CarbonylContact O-C 3.6Å; C369-L1151 VanDerWaalsContact O-CA 3.24Å; C369-L1151 WeakPolarHBondContact O-CA 3.33Å; I371-L1151 HydrophobicContact CD1-CB 3.5Å; I371-L1151 HydrophobicContact CD1-CD1 3.46Å; I371-L1151 VanDerWaalsContact CD1-CD1 3.46Å; I371-L1151 HydrophobicContact CD1-CG 4.05Å; I371-L1151 HydrophobicContact CG1-CB 3.66Å; I371-L1151 HydrophobicContact CG1-CD1 3.95Å; I371-L1151 HydrophobicContact CG1-CD2 4.39Å; I371-L1151 HydrophobicContact CG1-CG 4.21Å; W1096-L1151 HydrophobicContact CH2-CD2 3.9Å; W1096-L1151 HydrophobicContact CZ2-CD2 4.31Å; P1119-L1151 HydrophobicContact CB-CD1 4.39Å; P1119-L1151 HydrophobicContact CB-CD2 4.18Å; L1123-L1151 HydrophobicContact CB-CD1 4.11Å; L1123-L1151 HydrophobicContact CD2-CD1 4.14Å; T1140-L1151 CarbonylContact C-O 3.24Å; T1140-L1151 VanDerWaalsContact CA-O 3.26Å; T1140-L1151 WeakPolarHBondContact CA-O 3.5Å; I1141-L1151 HydrophobicContact CG2-CB 3.9Å; I1141-L1151 PolarHBondContact N-O 3.49Å; I1141-L1151 PolarHBondContact O-N 3.42Å; L1149-L1151 HydrophobicContact CD1-CD1 4.01Å; L1149-L1151 HydrophobicContact CD1-CD2 3.72Å; L1149-L1151 HydrophobicContact CD1-CG 3.81Å; L1149-L1151 HydrophobicContact CD2-CD1 4.21Å; L1149-L1151 HydrophobicContact CD2-CG 4.46Å; L1149-L1151 HydrophobicContact CG-CD1 4.25Å; L1149-L1151 HydrophobicContact CG-CD2 4.41Å; L1149-L1151 HydrophobicContact CG-CG 4.01Å
1152	E	91.8	Very high	90.7	Very high	53 Å²	53	33.5 Å²	33.5	25%	0.248	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	150.1	175.2	63.7	178.7	-159.5	0	0	111.5	P368 C369 T370 I371 A1139 T1140	P368-E1152 HydrophobicContact CB-CB 3.76Å; P368-E1152 HydrophobicContact CB-CG 3.89Å; P368-E1152 HydrophobicContact CG-CB 4.42Å; C369-E1152 PolarHBondContact O-N 3.41Å; T370-E1152 CarbonylContact C-O 3.47Å; T370-E1152 WeakPolarHBondContact CA-O 3.24Å; T370-E1152 HydrophobicContact CG2-CG 4.3Å; T370-E1152 PolarHBondContact OG1-OE1 2.79Å; I371-E1152 PolarHBondContact N-O 2.8Å; A1139-E1152 WeakPolarHBondContact O-CA 3.44Å; T1140-E1152 HydrophobicContact CG2-CB 4.09Å
1153	G	91.4	Very high	90.8	Very high	8 Å²	8	35.1 Å²	35.1	8%	0.082	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	-177.8	175.1	0	0	0	0	0	110.5	R1138 A1139	R1138-G1153 WeakPolarHBondContact CA-O 3.5Å; A1139-G1153 PolarHBondContact N-O 2.94Å; A1139-G1153 PolarHBondContact O-N 3.41Å
1154	D	93.3	Very high	91.1	Very high	71 Å²	71	35 Å²	35	38%	0.38	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	152.5	166.9	68.1	92.1	0	0	0	110.4	R1137 R1156 T1157 V1158	R1137-D1154 WeakPolarHBondContact O-CA 3.41Å; D1154-R1156 PolarHBondContact O-N 3.22Å; D1154-R1156 WeakPolarHBondContact OD1-CA 3.45Å; D1154-R1156 WeakPolarHBondContact OD1-CB 3.31Å; D1154-R1156 PolarHBondContact OD1-N 3.24Å; D1154-R1156 VanDerWaalsContact OD1-N 3.12Å; D1154-T1157 VanDerWaalsContact CG-OG1 3.28Å; D1154-T1157 PolarHBondContact O-N 3.36Å; D1154-T1157 PolarHBondContact OD1-N 2.87Å; D1154-T1157 PolarHBondContact OD1-OG1 3.48Å; D1154-T1157 WeakPolarHBondContact OD2-CB 3.47Å; D1154-T1157 PolarHBondContact OD2-OG1 3.19Å; D1154-V1158 PolarHBondContact O-N 3.42Å; D1154-V1158 VanDerWaalsContact O-N 3.11Å
1155	S	93.3	Very high	91.6	Very high	4 Å²	4	34.3 Å²	34.3	3%	0.028	15%	0.154	C	C	.	.	H	α-helix	trans	-60.6	-29.8	-174.4	-54.2	0	0	0	0	113.2	D1134 G1136 R1137 R1138 R1159	D1134-S1155 VanDerWaalsContact OD1-CB 3.24Å; D1134-S1155 WeakPolarHBondContact OD1-CB 3.19Å; D1134-S1155 PolarHBondContact OD1-OG 3.36Å; D1134-S1155 WeakPolarHBondContact OD2-CB 3.34Å; G1136-S1155 VanDerWaalsContact C-OG 3.27Å; G1136-S1155 PolarHBondContact O-OG 3.06Å; R1137-S1155 PolarHBondContact N-OG 3.3Å; R1137-S1155 PolarHBondContact O-N 2.92Å; R1137-S1155 VanDerWaalsContact O-N 3.13Å; R1137-S1155 PolarHBondContact O-OG 2.99Å; R1138-S1155 PolarHBondContact N-OG 3.27Å; S1155-R1159 WeakPolarHBondContact O-CB 3.44Å; S1155-R1159 VanDerWaalsContact O-CG 3.28Å; S1155-R1159 WeakPolarHBondContact O-CG 3.43Å; S1155-R1159 PolarHBondContact O-N 3.5Å; S1155-R1159 VanDerWaalsContact O-N 3.13Å
1156	R	93.9	Very high	92	Very high	69 Å²	69	36.9 Å²	36.9	26%	0.26	16%	0.161	S	C	.	.	H	α-helix	trans	-69	-50.4	176.9	171.3	176.7	172.1	-117.2	7.2	110.6	E375 E382 D1154 V1158 R1159 L1160	E375-R1156 VanDerWaalsContact CD-NH1 3.29Å; E375-R1156 IonicContact OE1-CZ 3.18Å; E375-R1156 IonicContact OE1-NH1 3Å; E375-R1156 PolarHBondContact OE1-NH1 3.29Å; E375-R1156 IonicContact OE1-NH2 3.05Å; E375-R1156 PolarHBondContact OE1-NH2 2.9Å; E375-R1156 VanDerWaalsContact OE1-NH2 3.11Å; E375-R1156 IonicContact OE2-CZ 3.11Å; E375-R1156 IonicContact OE2-NH1 2.98Å; E375-R1156 PolarHBondContact OE2-NH1 3.14Å; E382-R1156 IonicContact OE1-NE 3.49Å; E382-R1156 IonicContact OE2-CZ 2.83Å; E382-R1156 IonicContact OE2-NE 2.66Å; E382-R1156 IonicContact OE2-NH2 3.52Å; E382-R1156 PolarHBondContact OE2-NH2 3.15Å; D1154-R1156 PolarHBondContact O-N 3.22Å; D1154-R1156 WeakPolarHBondContact OD1-CA 3.45Å; D1154-R1156 WeakPolarHBondContact OD1-CB 3.31Å; D1154-R1156 PolarHBondContact OD1-N 3.24Å; D1154-R1156 VanDerWaalsContact OD1-N 3.12Å; R1156-V1158 VanDerWaalsContact C-N 3.34Å; R1156-V1158 PolarHBondContact O-N 3.41Å; R1156-R1159 PolarHBondContact O-N 2.73Å; R1156-L1160 HydrophobicContact CG-CD1 3.98Å; R1156-L1160 HydrophobicContact CG-CG 4.5Å; R1156-L1160 WeakPolarHBondContact O-CG 3.38Å; R1156-L1160 PolarHBondContact O-N 3.17Å
1157	T	94	Very high	92.6	Very high	3 Å²	3	36.6 Å²	36.6	2%	0.018	16%	0.159	C	C	.	.	H	α-helix	trans	-56	-47.8	177.8	-65.5	0	0	0	0	111.6	V373 L378 D1154 R1159 L1160 L1161	V373-T1157 HydrophobicContact CB-CG2 4.34Å; V373-T1157 HydrophobicContact CG2-CG2 3.92Å; L378-T1157 WeakPolarHBondContact CD1-OG1 3.45Å; L378-T1157 HydrophobicContact CD2-CG2 4.2Å; D1154-T1157 VanDerWaalsContact CG-OG1 3.28Å; D1154-T1157 PolarHBondContact O-N 3.36Å; D1154-T1157 PolarHBondContact OD1-N 2.87Å; D1154-T1157 PolarHBondContact OD1-OG1 3.48Å; D1154-T1157 WeakPolarHBondContact OD2-CB 3.47Å; D1154-T1157 PolarHBondContact OD2-OG1 3.19Å; T1157-R1159 PolarHBondContact O-N 3.49Å; T1157-L1160 PolarHBondContact O-N 3.35Å; T1157-L1161 HydrophobicContact CG2-CD1 3.96Å; T1157-L1161 HydrophobicContact CG2-CG 4.41Å; T1157-L1161 WeakPolarHBondContact O-CG 3.43Å; T1157-L1161 PolarHBondContact O-N 3.3Å
1158	V	94.1	Very high	93.1	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.006	14%	0.143	C	C	.	.	H	α-helix	trans	-65.8	-39.2	-178.5	173.1	0	0	0	0	112.2	I1132 A1139 I1141 D1154 R1156 R1162	I1132-V1158 HydrophobicContact CD1-CG1 4.05Å; I1132-V1158 HydrophobicContact CG1-CG1 4.38Å; I1132-V1158 HydrophobicContact CG2-CG1 4.09Å; A1139-V1158 HydrophobicContact CB-CB 3.76Å; A1139-V1158 HydrophobicContact CB-CG1 3.8Å; A1139-V1158 HydrophobicContact CB-CG2 3.91Å; I1141-V1158 HydrophobicContact CB-CG1 3.99Å; I1141-V1158 HydrophobicContact CD1-CG1 4.28Å; I1141-V1158 HydrophobicContact CG2-CG1 4.41Å; D1154-V1158 PolarHBondContact O-N 3.42Å; D1154-V1158 VanDerWaalsContact O-N 3.11Å; R1156-V1158 VanDerWaalsContact C-N 3.34Å; R1156-V1158 PolarHBondContact O-N 3.41Å; V1158-R1162 PolarHBondContact O-N 2.84Å
1159	R	92.5	Very high	93.3	Very high	106 Å²	106	35.5 Å²	35.5	40%	0.4	16%	0.163	S	C	.	.	H	α-helix	trans	-63.1	-47.2	174.4	-76.6	-171.6	-55.5	-102.2	4.1	112	D1134 S1155 R1156 T1157 L1161 R1162 E1163	D1134-R1159 IonicContact OD2-NH1 3.93Å; D1134-R1159 PolarHBondContact OD2-NH1 2.96Å; S1155-R1159 WeakPolarHBondContact O-CB 3.44Å; S1155-R1159 VanDerWaalsContact O-CG 3.28Å; S1155-R1159 WeakPolarHBondContact O-CG 3.43Å; S1155-R1159 PolarHBondContact O-N 3.5Å; S1155-R1159 VanDerWaalsContact O-N 3.13Å; R1156-R1159 PolarHBondContact O-N 2.73Å; T1157-R1159 PolarHBondContact O-N 3.49Å; R1159-L1161 PolarHBondContact O-N 3.11Å; R1159-R1162 WeakPolarHBondContact O-CB 3.32Å; R1159-R1162 PolarHBondContact O-N 2.97Å; R1159-E1163 PolarHBondContact O-N 3.15Å
1160	L	94.1	Very high	93.3	Very high	10 Å²	10	38.8 Å²	38.8	5%	0.052	18%	0.175	C	C	.	.	H	α-helix	trans	-61.1	-42.8	178	-72.5	173.7	0	0	0	111.6	L378 I381 E382 L385 R1156 T1157 R1162 E1163 F1164	L378-L1160 HydrophobicContact CB-CD1 4.34Å; L378-L1160 HydrophobicContact CD2-CD1 4.11Å; I381-L1160 HydrophobicContact CG2-CB 4.4Å; E382-L1160 HydrophobicContact CB-CD1 4.28Å; E382-L1160 HydrophobicContact CB-CD2 3.9Å; E382-L1160 HydrophobicContact CG-CD2 4.13Å; L385-L1160 HydrophobicContact CD1-CD2 4.09Å; R1156-L1160 HydrophobicContact CG-CD1 3.98Å; R1156-L1160 HydrophobicContact CG-CG 4.5Å; R1156-L1160 WeakPolarHBondContact O-CG 3.38Å; R1156-L1160 PolarHBondContact O-N 3.17Å; T1157-L1160 PolarHBondContact O-N 3.35Å; L1160-R1162 VanDerWaalsContact C-N 3.34Å; L1160-R1162 PolarHBondContact O-N 3.41Å; L1160-E1163 PolarHBondContact O-N 3.06Å; L1160-F1164 VanDerWaalsContact O-CB 3.28Å; L1160-F1164 WeakPolarHBondContact O-CB 3.28Å; L1160-F1164 PolarHBondContact O-N 3.41Å
1161	L	94.3	Very high	93.5	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-63.7	-37.3	176.4	-71	174.8	0	0	0	112.6	I371 V373 L1120 L1123 L1124 T1157 R1159 R1165 L1201	I371-L1161 HydrophobicContact CD1-CD1 4.01Å; V373-L1161 HydrophobicContact CG2-CD1 4.42Å; L1120-L1161 HydrophobicContact CD2-CD1 3.87Å; L1120-L1161 HydrophobicContact CD2-CD2 4.31Å; L1123-L1161 HydrophobicContact CD2-CB 4.36Å; L1123-L1161 HydrophobicContact CD2-CD1 4.22Å; L1124-L1161 HydrophobicContact CD2-CD2 4.49Å; L1124-L1161 WeakPolarHBondContact CD2-O 3.37Å; T1157-L1161 HydrophobicContact CG2-CD1 3.96Å; T1157-L1161 HydrophobicContact CG2-CG 4.41Å; T1157-L1161 WeakPolarHBondContact O-CG 3.43Å; T1157-L1161 PolarHBondContact O-N 3.3Å; R1159-L1161 PolarHBondContact O-N 3.11Å; L1161-R1165 WeakPolarHBondContact O-CB 3.35Å; L1161-R1165 PolarHBondContact O-N 2.81Å; L1161-L1201 HydrophobicContact CD2-CD2 3.98Å
1162	R	92.6	Very high	93.7	Very high	70 Å²	70	35 Å²	35	26%	0.264	16%	0.164	S	C	.	.	H	α-helix	trans	-63.1	-46.3	173.7	179	-170.3	59.5	-173.2	4.7	111.3	V1130 I1132 V1158 R1159 L1160 F1164 R1165 R1166	V1130-R1162 HydrophobicContact CG2-CG 4.5Å; I1132-R1162 HydrophobicContact CD1-CB 3.97Å; I1132-R1162 HydrophobicContact CD1-CG 4.11Å; V1158-R1162 PolarHBondContact O-N 2.84Å; R1159-R1162 WeakPolarHBondContact O-CB 3.32Å; R1159-R1162 PolarHBondContact O-N 2.97Å; L1160-R1162 VanDerWaalsContact C-N 3.34Å; L1160-R1162 PolarHBondContact O-N 3.41Å; R1162-F1164 VanDerWaalsContact C-N 3.34Å; R1162-R1165 WeakPolarHBondContact O-CB 3.32Å; R1162-R1165 PolarHBondContact O-N 3.06Å; R1162-R1166 WeakPolarHBondContact O-CG 3.46Å; R1162-R1166 PolarHBondContact O-N 2.91Å
1163	E	93.6	Very high	93.6	Very high	64 Å²	64	37.1 Å²	37.1	30%	0.299	17%	0.173	S	C	.	.	H	α-helix	trans	-67	-39.1	179.9	-72.8	170	-163.5	0	0	111.3	L385 R1159 L1160 R1165 R1166 A1167	L385-E1163 HydrophobicContact CD1-CB 3.6Å; L385-E1163 HydrophobicContact CD2-CB 4.16Å; R1159-E1163 PolarHBondContact O-N 3.15Å; L1160-E1163 PolarHBondContact O-N 3.06Å; E1163-R1165 PolarHBondContact O-N 3.21Å; E1163-R1166 PolarHBondContact O-N 3.28Å; E1163-R1166 VanDerWaalsContact O-N 3.15Å; E1163-A1167 PolarHBondContact O-N 3.5Å
1164	F	95.7	Very high	93.6	Very high	0 Å²	0	42 Å²	42	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-60.4	-43.7	172.4	-165.5	-111.8	0	0	0	112.2	I381 L1124 L1160 R1162 R1166 A1167 L1168 L1194 L1197 L1198 L1201	I381-F1164 HydrophobicContact CG1-CD2 4.2Å; I381-F1164 HydrophobicContact CG1-CE2 4.19Å; I381-F1164 HydrophobicContact CG2-CB 4.14Å; I381-F1164 HydrophobicContact CG2-CD2 3.82Å; I381-F1164 HydrophobicContact CG2-CG 4.22Å; L1124-F1164 HydrophobicContact CD1-CD1 4.01Å; L1124-F1164 HydrophobicContact CD1-CE1 4.23Å; L1124-F1164 HydrophobicContact CD2-CD1 4.1Å; L1160-F1164 VanDerWaalsContact O-CB 3.28Å; L1160-F1164 WeakPolarHBondContact O-CB 3.28Å; L1160-F1164 PolarHBondContact O-N 3.41Å; R1162-F1164 VanDerWaalsContact C-N 3.34Å; F1164-R1166 VanDerWaalsContact C-N 3.32Å; F1164-R1166 PolarHBondContact O-N 3.03Å; F1164-A1167 WeakPolarHBondContact O-CB 3.47Å; F1164-A1167 PolarHBondContact O-N 3Å; F1164-L1168 HydrophobicContact CD1-CD1 4.01Å; F1164-L1168 HydrophobicContact CE1-CD1 3.94Å; F1164-L1168 HydrophobicContact CE1-CG 4.47Å; F1164-L1168 WeakPolarHBondContact O-CG 3.39Å; F1164-L1168 PolarHBondContact O-N 2.88Å; F1164-L1194 HydrophobicContact CD2-CD1 3.81Å; F1164-L1194 HydrophobicContact CE2-CD1 3.24Å; F1164-L1194 HydrophobicContact CZ-CD1 3.69Å; F1164-L1197 HydrophobicContact CE2-CB 3.97Å; F1164-L1197 HydrophobicContact CE2-CD1 4.32Å; F1164-L1197 HydrophobicContact CZ-CB 3.9Å; F1164-L1198 HydrophobicContact CE1-CB 4.11Å; F1164-L1198 HydrophobicContact CE1-CD1 4.11Å; F1164-L1198 HydrophobicContact CZ-CB 4.08Å; F1164-L1201 HydrophobicContact CD1-CD2 4.44Å; F1164-L1201 HydrophobicContact CE1-CD2 4.26Å
1165	R	94.7	Very high	93.6	Very high	27 Å²	27	38.7 Å²	38.7	10%	0.102	17%	0.172	C	C	.	.	H	α-helix	trans	-57.2	-43.5	172.1	178.3	176.5	-179.6	74.1	-25.2	112.1	L1123 L1124 T1126 G1128 L1161 R1162 E1163 L1168 G1169	L1123-R1165 VanDerWaalsContact O-CD 3.31Å; L1123-R1165 WeakPolarHBondContact O-CD 3.34Å; L1123-R1165 PolarHBondContact O-NE 2.91Å; L1123-R1165 PolarHBondContact O-NH1 3.48Å; L1124-R1165 HydrophobicContact CD2-CB 3.91Å; L1124-R1165 PolarHBondContact O-NH1 3.35Å; T1126-R1165 PolarHBondContact O-NH1 3.32Å; T1126-R1165 PolarHBondContact O-NH2 2.98Å; T1126-R1165 PolarHBondContact OG1-NH2 3.19Å; G1128-R1165 PolarHBondContact O-NH2 2.84Å; L1161-R1165 WeakPolarHBondContact O-CB 3.35Å; L1161-R1165 PolarHBondContact O-N 2.81Å; R1162-R1165 WeakPolarHBondContact O-CB 3.32Å; R1162-R1165 PolarHBondContact O-N 3.06Å; E1163-R1165 PolarHBondContact O-N 3.21Å; R1165-L1168 PolarHBondContact O-N 3.44Å; R1165-G1169 PolarHBondContact O-N 3.27Å
1166	R	93.1	Very high	93.5	Very high	102 Å²	102	39.1 Å²	39.1	39%	0.385	17%	0.174	S	C	.	.	H	α-helix	trans	-66.3	-38.5	177.3	-67.2	175	173.7	173.9	-5.1	111.8	V390 R1162 E1163 F1164 L1168 G1169 R1170	V390-R1166 HydrophobicContact CB-CB 4.47Å; V390-R1166 HydrophobicContact CG1-CB 3.52Å; R1162-R1166 WeakPolarHBondContact O-CG 3.46Å; R1162-R1166 PolarHBondContact O-N 2.91Å; E1163-R1166 PolarHBondContact O-N 3.28Å; E1163-R1166 VanDerWaalsContact O-N 3.15Å; F1164-R1166 VanDerWaalsContact C-N 3.32Å; F1164-R1166 PolarHBondContact O-N 3.03Å; R1166-L1168 VanDerWaalsContact C-N 3.34Å; R1166-L1168 PolarHBondContact O-N 3.21Å; R1166-G1169 PolarHBondContact O-N 2.88Å; R1166-R1170 WeakPolarHBondContact O-CG 3.41Å; R1166-R1170 PolarHBondContact O-N 2.93Å
1167	A	95.3	Very high	93.2	Very high	5 Å²	5	43.2 Å²	43.2	4%	0.041	19%	0.189	C	C	.	.	H	α-helix	trans	-59.9	-44.2	173.6	0	0	0	0	0	111.5	F384 L385 V390 E1163 F1164 R1170 M1171 L1194	F384-A1167 HydrophobicContact CE1-CB 4.33Å; L385-A1167 HydrophobicContact CD2-CB 4.16Å; V390-A1167 HydrophobicContact CG2-CB 3.78Å; E1163-A1167 PolarHBondContact O-N 3.5Å; F1164-A1167 WeakPolarHBondContact O-CB 3.47Å; F1164-A1167 PolarHBondContact O-N 3Å; A1167-R1170 PolarHBondContact O-N 3.16Å; A1167-M1171 PolarHBondContact O-N 3.02Å; A1167-L1194 HydrophobicContact CB-CD1 4.21Å; A1167-L1194 HydrophobicContact CB-CD2 4.17Å
1168	L	96	Very high	92.7	Very high	4 Å²	4	44.9 Å²	44.9	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-62.1	-42.4	174.5	-68.1	169.3	0	0	0	112.1	F916 L1124 L1125 F1164 R1165 R1166 R1170 M1171 V1172 L1194 L1198	F916-L1168 HydrophobicContact CE1-CD2 4.1Å; L1124-L1168 HydrophobicContact CB-CD1 4.05Å; L1125-L1168 HydrophobicContact CD2-CD1 4.26Å; F1164-L1168 HydrophobicContact CD1-CD1 4.01Å; F1164-L1168 HydrophobicContact CE1-CD1 3.94Å; F1164-L1168 HydrophobicContact CE1-CG 4.47Å; F1164-L1168 WeakPolarHBondContact O-CG 3.39Å; F1164-L1168 PolarHBondContact O-N 2.88Å; R1165-L1168 PolarHBondContact O-N 3.44Å; R1166-L1168 VanDerWaalsContact C-N 3.34Å; R1166-L1168 PolarHBondContact O-N 3.21Å; L1168-R1170 PolarHBondContact O-N 2.8Å; L1168-M1171 HydrophobicContact CD2-CE 4.02Å; L1168-M1171 WeakPolarHBondContact O-CB 3.43Å; L1168-M1171 PolarHBondContact O-N 3.38Å; L1168-V1172 WeakPolarHBondContact O-CG2 3.47Å; L1168-V1172 PolarHBondContact O-N 3.35Å; L1168-L1194 HydrophobicContact CD2-CD1 4.07Å; L1168-L1194 HydrophobicContact CD2-CD2 3.87Å; L1168-L1194 HydrophobicContact CD2-CG 3.71Å; L1168-L1194 HydrophobicContact CG-CD1 4.38Å; L1168-L1194 HydrophobicContact CG-CD2 4.4Å; L1168-L1194 HydrophobicContact CG-CG 4.45Å; L1168-L1198 HydrophobicContact CD1-CD1 4.26Å; L1168-L1198 HydrophobicContact CD1-CD2 4.36Å; L1168-L1198 HydrophobicContact CD2-CD2 4.08Å
1169	G	93.2	Very high	92.3	Very high	41 Å²	41	48.1 Å²	48.1	42%	0.423	22%	0.216	S	C	.	.	H	α-helix	trans	-59	-45.3	174.6	0	0	0	0	0	112.6	R1165 R1166 M1171 V1172 E1173	R1165-G1169 PolarHBondContact O-N 3.27Å; R1166-G1169 PolarHBondContact O-N 2.88Å; G1169-M1171 VanDerWaalsContact C-N 3.35Å; G1169-M1171 PolarHBondContact O-N 3.36Å; G1169-V1172 PolarHBondContact O-N 3.03Å; G1169-E1173 PolarHBondContact O-N 3.27Å
1170	R	91.6	Very high	92	Very high	69 Å²	69	44.2 Å²	44.2	26%	0.26	20%	0.203	S	C	.	.	H	α-helix	trans	-62.4	-40.5	175.1	-70.1	-165.8	-54.4	-173.9	1.4	112.6	Y388 P389 R1166 A1167 L1168 E1173 R1174	Y388-R1170 PolarHBondContact O-NH2 3.11Å; P389-R1170 PolarHBondContact O-NH1 3.4Å; P389-R1170 PolarHBondContact O-NH2 2.94Å; R1166-R1170 WeakPolarHBondContact O-CG 3.41Å; R1166-R1170 PolarHBondContact O-N 2.93Å; A1167-R1170 PolarHBondContact O-N 3.16Å; L1168-R1170 PolarHBondContact O-N 2.8Å; R1170-E1173 PolarHBondContact O-N 3.4Å; R1170-R1174 VanDerWaalsContact O-CB 3.25Å; R1170-R1174 WeakPolarHBondContact O-CB 3.42Å; R1170-R1174 PolarHBondContact O-N 3.25Å
1171	M	94.6	Very high	91.6	Very high	4 Å²	4	46 Å²	46	2%	0.02	22%	0.219	C	C	.	.	H	α-helix	trans	-58.1	-50.2	175.2	176.3	-170.8	74.9	0	0	110.6	I915 F916 A1167 L1168 G1169 R1174 S1175 H1191 L1194 L1195	I915-M1171 HydrophobicContact CG2-CE 4.17Å; F916-M1171 HydrophobicContact CD1-CE 4.08Å; F916-M1171 HydrophobicContact CE1-CE 3.7Å; F916-M1171 HydrophobicContact CE2-CE 4.41Å; F916-M1171 HydrophobicContact CZ-CE 3.87Å; A1167-M1171 PolarHBondContact O-N 3.02Å; L1168-M1171 HydrophobicContact CD2-CE 4.02Å; L1168-M1171 WeakPolarHBondContact O-CB 3.43Å; L1168-M1171 PolarHBondContact O-N 3.38Å; G1169-M1171 VanDerWaalsContact C-N 3.35Å; G1169-M1171 PolarHBondContact O-N 3.36Å; M1171-R1174 PolarHBondContact O-N 2.94Å; M1171-S1175 VanDerWaalsContact O-CB 3.26Å; M1171-S1175 WeakPolarHBondContact O-CB 3.49Å; M1171-S1175 PolarHBondContact O-N 2.95Å; M1171-S1175 PolarHBondContact O-OG 3.45Å; M1171-H1191 HydrophobicContact CG-CB 4.25Å; M1171-H1191 HydrophobicContact SD-CB 4.13Å; M1171-L1194 HydrophobicContact CB-CD2 3.98Å; M1171-L1194 HydrophobicContact CG-CD2 4.48Å; M1171-L1194 HydrophobicContact SD-CD2 3.98Å; M1171-L1194 HydrophobicContact SD-CG 4.49Å; M1171-L1195 HydrophobicContact CE-CD2 3.85Å; M1171-L1195 HydrophobicContact CE-CG 4.46Å; M1171-L1195 HydrophobicContact SD-CD2 4.08Å; M1171-L1195 HydrophobicContact SD-CG 4.05Å
1172	V	94.3	Very high	91.2	Very high	23 Å²	23	49.1 Å²	49.1	14%	0.139	25%	0.245	C	C	.	.	H	α-helix	trans	-59.7	-49.3	178.8	172.9	0	0	0	0	110.9	L912 I915 F916 L1168 G1169 R1174 S1175 L1176	L912-V1172 HydrophobicContact CD2-CG1 4.16Å; I915-V1172 HydrophobicContact CD1-CG1 4.21Å; I915-V1172 HydrophobicContact CG2-CG2 4.19Å; F916-V1172 HydrophobicContact CE2-CG2 3.71Å; F916-V1172 HydrophobicContact CZ-CG2 3.94Å; L1168-V1172 WeakPolarHBondContact O-CG2 3.47Å; L1168-V1172 PolarHBondContact O-N 3.35Å; G1169-V1172 PolarHBondContact O-N 3.03Å; V1172-R1174 PolarHBondContact O-N 3.01Å; V1172-S1175 PolarHBondContact O-N 3.48Å; V1172-L1176 HydrophobicContact CG1-CD1 3.92Å; V1172-L1176 HydrophobicContact CG1-CG 4.44Å; V1172-L1176 VanDerWaalsContact O-CG 3.3Å; V1172-L1176 WeakPolarHBondContact O-CG 3.24Å; V1172-L1176 PolarHBondContact O-N 3.3Å
1173	E	90.4	Very high	91	Very high	97 Å²	97	46.4 Å²	46.4	45%	0.453	24%	0.235	S	C	.	.	H	α-helix	trans	-60.3	-45.7	179.9	-178	173.1	-154.1	0	0	112.2	G1169 R1170 S1175 L1176 R1177	G1169-E1173 PolarHBondContact O-N 3.27Å; R1170-E1173 PolarHBondContact O-N 3.4Å; E1173-S1175 VanDerWaalsContact C-N 3.34Å; E1173-S1175 PolarHBondContact O-N 2.95Å; E1173-L1176 PolarHBondContact O-N 3.36Å; E1173-R1177 WeakPolarHBondContact O-CG 3.39Å; E1173-R1177 PolarHBondContact O-N 2.98Å; E1173-R1177 IonicContact OE1-CZ 2.93Å; E1173-R1177 IonicContact OE1-NE 3.55Å; E1173-R1177 IonicContact OE1-NH2 3.9Å; E1173-R1177 PolarHBondContact OE1-NH2 2.73Å
1174	R	90.6	Very high	90.9	Very high	111 Å²	111	46.9 Å²	46.9	42%	0.419	24%	0.244	S	C	.	.	H	α-helix	trans	-62.9	-42.3	177.7	-169.3	176	-167.8	171.3	8.3	111.6	R1170 M1171 V1172 L1176 R1177 L1183 V1187 E1190	R1170-R1174 VanDerWaalsContact O-CB 3.25Å; R1170-R1174 WeakPolarHBondContact O-CB 3.42Å; R1170-R1174 PolarHBondContact O-N 3.25Å; M1171-R1174 PolarHBondContact O-N 2.94Å; V1172-R1174 PolarHBondContact O-N 3.01Å; R1174-L1176 VanDerWaalsContact C-N 3.29Å; R1174-L1176 PolarHBondContact O-N 3.46Å; R1174-R1177 PolarHBondContact O-N 2.71Å; R1174-L1183 HydrophobicContact CG-CD2 4.5Å; R1174-V1187 HydrophobicContact CG-CG1 4.49Å; R1174-E1190 IonicContact NH1-OE2 2.88Å; R1174-E1190 PolarHBondContact NH1-OE2 2.97Å
1175	S	93.1	Very high	90.6	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.007	28%	0.277	C	S	.	.	H	α-helix	trans	-64.2	-30.1	176.3	-81.5	0	0	0	0	113.6	M1171 V1172 E1173 L1180 H1191	M1171-S1175 VanDerWaalsContact O-CB 3.26Å; M1171-S1175 WeakPolarHBondContact O-CB 3.49Å; M1171-S1175 PolarHBondContact O-N 2.95Å; M1171-S1175 PolarHBondContact O-OG 3.45Å; V1172-S1175 PolarHBondContact O-N 3.48Å; E1173-S1175 VanDerWaalsContact C-N 3.34Å; E1173-S1175 PolarHBondContact O-N 2.95Å; S1175-L1180 WeakPolarHBondContact OG-CD1 3.28Å; S1175-H1191 PolarHBondContact OG-CE1 3.13Å
1176	L	91.4	Very high	90.5	Very high	14 Å²	14	55.6 Å²	55.6	7%	0.073	30%	0.298	C	S	.	.	H	α-helix	trans	-78.6	-33.4	178.5	-72.3	171.3	0	0	0	112.8	T892 L893 R896 V911 I915 V1172 E1173 R1174 S1178	T892-L1176 HydrophobicContact CG2-CB 3.85Å; T892-L1176 WeakPolarHBondContact CG2-O 3.46Å; L893-L1176 HydrophobicContact CB-CD1 3.99Å; L893-L1176 HydrophobicContact CD1-CD1 4.38Å; L893-L1176 HydrophobicContact CD1-CD2 4.25Å; R896-L1176 HydrophobicContact CG-CD2 3.75Å; R896-L1176 PolarHBondContact NE-O 3.11Å; R896-L1176 VanDerWaalsContact NE-O 3.15Å; R896-L1176 PolarHBondContact NH2-O 2.98Å; V911-L1176 HydrophobicContact CG1-CD2 3.73Å; I915-L1176 HydrophobicContact CD1-CD2 3.93Å; I915-L1176 HydrophobicContact CD1-CG 4Å; V1172-L1176 HydrophobicContact CG1-CD1 3.92Å; V1172-L1176 HydrophobicContact CG1-CG 4.44Å; V1172-L1176 VanDerWaalsContact O-CG 3.3Å; V1172-L1176 WeakPolarHBondContact O-CG 3.24Å; V1172-L1176 PolarHBondContact O-N 3.3Å; E1173-L1176 PolarHBondContact O-N 3.36Å; R1174-L1176 VanDerWaalsContact C-N 3.29Å; R1174-L1176 PolarHBondContact O-N 3.46Å; L1176-S1178 PolarHBondContact O-N 3.42Å
1177	R	88.2	Confident	90.4	Very high	155 Å²	155	50.8 Å²	50.8	59%	0.585	28%	0.28	S	S	*	.	H	α-helix	trans	-73.7	-21.3	-174.8	-73.1	177.5	-177.6	-170.1	0.3	114.5	E1173 R1174	E1173-R1177 WeakPolarHBondContact O-CG 3.39Å; E1173-R1177 PolarHBondContact O-N 2.98Å; E1173-R1177 IonicContact OE1-CZ 2.93Å; E1173-R1177 IonicContact OE1-NE 3.55Å; E1173-R1177 IonicContact OE1-NH2 3.9Å; E1173-R1177 PolarHBondContact OE1-NH2 2.73Å; R1174-R1177 PolarHBondContact O-N 2.71Å
1178	S	82.6	Confident	90.3	Very high	37 Å²	37	52.3 Å²	52.3	26%	0.259	29%	0.286	S	S	.	.	S	Bend	trans	-123.8	168.9	178.4	62.4	0	0	0	0	111.2	R896 L1176 L1180 L1183	R896-S1178 PolarHBondContact NH2-O 2.86Å; L1176-S1178 PolarHBondContact O-N 3.42Å; S1178-L1180 PolarHBondContact O-N 2.92Å; S1178-L1183 WeakPolarHBondContact OG-CD2 3.29Å
1179	E	87	Confident	90.1	Very high	70 Å²	70	58 Å²	58	33%	0.327	31%	0.313	S	S	.	.			trans	-62.5	126.1	163.8	173.7	170.2	-172.6	0	0	109.5	F1013 A1181 A1182 L1183	F1013-E1179 HydrophobicContact CB-CB 4.04Å; F1013-E1179 HydrophobicContact CB-CG 4Å; F1013-E1179 HydrophobicContact CD1-CG 4.49Å; E1179-A1181 VanDerWaalsContact C-N 3.31Å; E1179-A1181 PolarHBondContact O-N 3.32Å; E1179-A1182 HydrophobicContact CB-CB 3.94Å; E1179-A1182 HydrophobicContact CG-CB 4.01Å; E1179-A1182 PolarHBondContact O-N 2.89Å; E1179-A1182 VanDerWaalsContact O-N 3.07Å; E1179-L1183 PolarHBondContact O-N 3.46Å
1180	L	86.2	Confident	90.2	Very high	24 Å²	24	57.5 Å²	57.5	13%	0.126	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-64.7	-38.7	-169.7	-171.7	63.1	0	0	0	111.7	A914 I915 F1013 L1014 S1175 S1178 A1182 L1183	A914-L1180 HydrophobicContact CB-CD2 4.44Å; I915-L1180 HydrophobicContact CG1-CD2 4.42Å; F1013-L1180 PolarHBondContact O-N 2.73Å; L1014-L1180 WeakPolarHBondContact O-CD2 3.44Å; S1175-L1180 WeakPolarHBondContact OG-CD1 3.28Å; S1178-L1180 PolarHBondContact O-N 2.92Å; L1180-A1182 VanDerWaalsContact C-N 3.25Å; L1180-A1182 PolarHBondContact O-N 3.25Å; L1180-L1183 HydrophobicContact CD1-CD1 3.75Å; L1180-L1183 PolarHBondContact O-N 2.86Å
1181	A	84.4	Confident	90.4	Very high	47 Å²	47	54.6 Å²	54.6	39%	0.388	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-70.9	-20.2	177.7	0	0	0	0	0	113.3	E1179	E1179-A1181 VanDerWaalsContact C-N 3.31Å; E1179-A1181 PolarHBondContact O-N 3.32Å
1182	A	86.4	Confident	90.5	Very high	67 Å²	67	55 Å²	55	55%	0.554	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-95.8	3.8	-178.4	0	0	0	0	0	113.5	E1179 L1180	E1179-A1182 HydrophobicContact CB-CB 3.94Å; E1179-A1182 HydrophobicContact CG-CB 4.01Å; E1179-A1182 PolarHBondContact O-N 2.89Å; E1179-A1182 VanDerWaalsContact O-N 3.07Å; L1180-A1182 VanDerWaalsContact C-N 3.25Å; L1180-A1182 PolarHBondContact O-N 3.25Å
1183	L	89.2	Confident	90.6	Very high	12 Å²	12	58.3 Å²	58.3	6%	0.063	31%	0.308	C	S	.	.	S	Bend	trans	-58.3	140.7	177.3	-80.7	175.8	0	0	0	111.4	R1174 S1178 E1179 L1180 V1187 Q1188	R1174-L1183 HydrophobicContact CG-CD2 4.5Å; S1178-L1183 WeakPolarHBondContact OG-CD2 3.29Å; E1179-L1183 PolarHBondContact O-N 3.46Å; L1180-L1183 HydrophobicContact CD1-CD1 3.75Å; L1180-L1183 PolarHBondContact O-N 2.86Å; L1183-V1187 HydrophobicContact CD1-CG1 4.38Å; L1183-V1187 HydrophobicContact CD2-CG1 4.18Å; L1183-Q1188 HydrophobicContact CB-CG 3.93Å; L1183-Q1188 PolarHBondContact O-NE2 3.32Å
1184	P	91.1	Very high	90.9	Very high	75 Å²	75	53.8 Å²	53.8	49%	0.487	29%	0.287	S	S	.	.			trans	-58.6	145.9	176.6	-20.3	29.7	0	0	0	112.1	S1186 V1187 Q1188	P1184-S1186 VanDerWaalsContact C-N 3.26Å; P1184-S1186 PolarHBondContact O-N 2.82Å; P1184-S1186 VanDerWaalsContact O-N 3.16Å; P1184-V1187 HydrophobicContact CB-CG2 4.04Å; P1184-V1187 HydrophobicContact CG-CG2 4.08Å; P1184-V1187 WeakPolarHBondContact O-CA 3.45Å; P1184-V1187 VanDerWaalsContact O-CB 3.32Å; P1184-V1187 WeakPolarHBondContact O-CB 3.38Å; P1184-V1187 PolarHBondContact O-N 2.96Å; P1184-Q1188 PolarHBondContact O-N 3.28Å
1185	L	90.2	Very high	91.2	Very high	132 Å²	132	48.5 Å²	48.5	69%	0.691	27%	0.267	S	S	*	.	H	α-helix	trans	-54.3	-38.7	-176.3	-72.8	168.6	0	0	0	113.6	V1187 Q1188 Q1189	L1185-V1187 VanDerWaalsContact C-N 3.27Å; L1185-V1187 PolarHBondContact O-N 3.47Å; L1185-Q1188 PolarHBondContact O-N 3.47Å; L1185-Q1189 VanDerWaalsContact O-CG 3.31Å; L1185-Q1189 WeakPolarHBondContact O-CG 3.46Å; L1185-Q1189 PolarHBondContact O-N 3.35Å
1186	S	91.4	Very high	91.4	Very high	77 Å²	77	50.4 Å²	50.4	54%	0.538	28%	0.283	S	S	.	.	H	α-helix	trans	-60.1	-38.4	176.7	52.4	0	0	0	0	112.5	P1184 E1190	P1184-S1186 VanDerWaalsContact C-N 3.26Å; P1184-S1186 PolarHBondContact O-N 2.82Å; P1184-S1186 VanDerWaalsContact O-N 3.16Å; S1186-E1190 PolarHBondContact O-N 2.55Å
1187	V	92.2	Very high	91.7	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.006	28%	0.284	C	S	.	.	H	α-helix	trans	-72.4	-42	177.6	-173.5	0	0	0	0	110.7	R1174 L1183 P1184 L1185 Q1189 E1190 H1191	R1174-V1187 HydrophobicContact CG-CG1 4.49Å; L1183-V1187 HydrophobicContact CD1-CG1 4.38Å; L1183-V1187 HydrophobicContact CD2-CG1 4.18Å; P1184-V1187 HydrophobicContact CB-CG2 4.04Å; P1184-V1187 HydrophobicContact CG-CG2 4.08Å; P1184-V1187 WeakPolarHBondContact O-CA 3.45Å; P1184-V1187 VanDerWaalsContact O-CB 3.32Å; P1184-V1187 WeakPolarHBondContact O-CB 3.38Å; P1184-V1187 PolarHBondContact O-N 2.96Å; L1185-V1187 VanDerWaalsContact C-N 3.27Å; L1185-V1187 PolarHBondContact O-N 3.47Å; V1187-Q1189 PolarHBondContact O-N 3.36Å; V1187-E1190 PolarHBondContact O-N 3.43Å; V1187-H1191 WeakPolarHBondContact CG1-NE2 3.49Å; V1187-H1191 WeakPolarHBondContact O-CB 3.36Å; V1187-H1191 PolarHBondContact O-CD2 3.38Å; V1187-H1191 VanDerWaalsContact O-CG 3.25Å; V1187-H1191 PolarHBondContact O-N 3.13Å
1188	Q	91.5	Very high	92.1	Very high	37 Å²	37	43.2 Å²	43.2	17%	0.173	26%	0.256	C	S	.	.	H	α-helix	trans	-61.9	-36	176.3	-63.3	-172.2	15.7	0	0	112.1	R917 L1183 P1184 L1185 G1192	R917-Q1188 PolarHBondContact NH2-O 3.22Å; L1183-Q1188 HydrophobicContact CB-CG 3.93Å; L1183-Q1188 PolarHBondContact O-NE2 3.32Å; P1184-Q1188 PolarHBondContact O-N 3.28Å; L1185-Q1188 PolarHBondContact O-N 3.47Å; Q1188-G1192 PolarHBondContact O-N 3.27Å
1189	Q	93.5	Very high	92.8	Very high	123 Å²	123	41.5 Å²	41.5	58%	0.575	24%	0.244	S	C	*	.	H	α-helix	trans	-68.6	-45.7	174.2	-73.8	174.6	-1.2	0	0	111.9	L1185 V1187 G1192 Q1193	L1185-Q1189 VanDerWaalsContact O-CG 3.31Å; L1185-Q1189 WeakPolarHBondContact O-CG 3.46Å; L1185-Q1189 PolarHBondContact O-N 3.35Å; V1187-Q1189 PolarHBondContact O-N 3.36Å; Q1189-G1192 PolarHBondContact O-N 2.61Å; Q1189-Q1193 WeakPolarHBondContact O-CG 3.21Å; Q1189-Q1193 PolarHBondContact O-N 2.98Å
1190	E	95.2	Very high	93.2	Very high	32 Å²	32	40.8 Å²	40.8	15%	0.15	24%	0.241	C	C	.	.	H	α-helix	trans	-55.4	-51.5	173.4	178.9	-172.8	168.2	0	0	110.8	F384 Y388 R1174 S1186 V1187 G1192 Q1193 L1194	F384-E1190 HydrophobicContact CE2-CG 4.44Å; F384-E1190 HydrophobicContact CZ-CG 4.15Å; Y388-E1190 HydrophobicContact CD1-CB 4.47Å; Y388-E1190 HydrophobicContact CD1-CG 3.8Å; Y388-E1190 HydrophobicContact CD2-CG 4.17Å; Y388-E1190 HydrophobicContact CE1-CB 3.98Å; Y388-E1190 HydrophobicContact CE1-CG 3.81Å; Y388-E1190 HydrophobicContact CE2-CB 4.44Å; Y388-E1190 HydrophobicContact CE2-CG 4.17Å; Y388-E1190 HydrophobicContact CG-CG 3.98Å; R1174-E1190 IonicContact NH1-OE2 2.88Å; R1174-E1190 PolarHBondContact NH1-OE2 2.97Å; S1186-E1190 PolarHBondContact O-N 2.55Å; V1187-E1190 PolarHBondContact O-N 3.43Å; E1190-G1192 VanDerWaalsContact C-N 3.32Å; E1190-G1192 PolarHBondContact O-N 3.46Å; E1190-Q1193 PolarHBondContact O-N 3.02Å; E1190-L1194 WeakPolarHBondContact O-CB 3.34Å; E1190-L1194 PolarHBondContact O-N 2.87Å
1191	H	95.1	Very high	93.6	Very high	7 Å²	7	39.8 Å²	39.8	3%	0.032	24%	0.235	C	C	.	.	H	α-helix	trans	-61.3	-40.5	178.6	-68.2	-163.8	0	0	0	111.5	M1171 S1175 V1187 L1194 L1195	M1171-H1191 HydrophobicContact CG-CB 4.25Å; M1171-H1191 HydrophobicContact SD-CB 4.13Å; S1175-H1191 PolarHBondContact OG-CE1 3.13Å; V1187-H1191 WeakPolarHBondContact CG1-NE2 3.49Å; V1187-H1191 WeakPolarHBondContact O-CB 3.36Å; V1187-H1191 PolarHBondContact O-CD2 3.38Å; V1187-H1191 VanDerWaalsContact O-CG 3.25Å; V1187-H1191 PolarHBondContact O-N 3.13Å; H1191-L1194 PolarHBondContact O-N 3.22Å; H1191-L1195 WeakPolarHBondContact O-CB 3.44Å; H1191-L1195 VanDerWaalsContact O-CG 3.29Å; H1191-L1195 WeakPolarHBondContact O-CG 3.44Å; H1191-L1195 PolarHBondContact O-N 2.87Å
1192	G	95.9	Very high	94	Very high	13 Å²	13	37.7 Å²	37.7	13%	0.134	22%	0.218	C	C	.	.	H	α-helix	trans	-62	-45.6	177	0	0	0	0	0	112.8	Y1031 Q1188 Q1189 E1190 L1194 L1195 A1196	Y1031-G1192 PolarHBondContact OH-O 3.3Å; Q1188-G1192 PolarHBondContact O-N 3.27Å; Q1189-G1192 PolarHBondContact O-N 2.61Å; E1190-G1192 VanDerWaalsContact C-N 3.32Å; E1190-G1192 PolarHBondContact O-N 3.46Å; G1192-L1194 VanDerWaalsContact C-N 3.34Å; G1192-L1194 PolarHBondContact O-N 3.12Å; G1192-L1195 PolarHBondContact O-N 3.49Å; G1192-A1196 WeakPolarHBondContact O-CB 3.31Å; G1192-A1196 PolarHBondContact O-N 3.4Å
1193	Q	96.9	Very high	94.1	Very high	93 Å²	93	41.9 Å²	41.9	44%	0.435	22%	0.219	S	C	.	.	H	α-helix	trans	-62.8	-42	176	-69.7	178	38.5	0	0	111.7	F384 Q1189 E1190 A1196 L1197	F384-Q1193 HydrophobicContact CD2-CB 4.06Å; F384-Q1193 HydrophobicContact CE2-CB 3.94Å; Q1189-Q1193 WeakPolarHBondContact O-CG 3.21Å; Q1189-Q1193 PolarHBondContact O-N 2.98Å; E1190-Q1193 PolarHBondContact O-N 3.02Å; Q1193-A1196 PolarHBondContact O-N 3.28Å; Q1193-L1197 WeakPolarHBondContact O-CG 3.4Å; Q1193-L1197 PolarHBondContact O-N 3.28Å; Q1193-L1197 VanDerWaalsContact O-N 3.11Å
1194	L	97.2	Very high	93.6	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-62.8	-45.3	178.9	-177.3	55.6	0	0	0	112.2	F384 F1164 A1167 L1168 M1171 E1190 H1191 G1192 L1197 L1198	F384-L1194 HydrophobicContact CD1-CD1 4.31Å; F384-L1194 HydrophobicContact CE1-CB 4.36Å; F384-L1194 HydrophobicContact CE1-CD1 3.74Å; F384-L1194 HydrophobicContact CE1-CG 4.45Å; F384-L1194 HydrophobicContact CE2-CB 4.07Å; F384-L1194 HydrophobicContact CZ-CB 3.73Å; F384-L1194 HydrophobicContact CZ-CD1 4.01Å; F384-L1194 HydrophobicContact CZ-CD2 4.39Å; F384-L1194 HydrophobicContact CZ-CG 4.25Å; F1164-L1194 HydrophobicContact CD2-CD1 3.81Å; F1164-L1194 HydrophobicContact CE2-CD1 3.24Å; F1164-L1194 HydrophobicContact CZ-CD1 3.69Å; A1167-L1194 HydrophobicContact CB-CD1 4.21Å; A1167-L1194 HydrophobicContact CB-CD2 4.17Å; L1168-L1194 HydrophobicContact CD2-CD1 4.07Å; L1168-L1194 HydrophobicContact CD2-CD2 3.87Å; L1168-L1194 HydrophobicContact CD2-CG 3.71Å; L1168-L1194 HydrophobicContact CG-CD1 4.38Å; L1168-L1194 HydrophobicContact CG-CD2 4.4Å; L1168-L1194 HydrophobicContact CG-CG 4.45Å; M1171-L1194 HydrophobicContact CB-CD2 3.98Å; M1171-L1194 HydrophobicContact CG-CD2 4.48Å; M1171-L1194 HydrophobicContact SD-CD2 3.98Å; M1171-L1194 HydrophobicContact SD-CG 4.49Å; E1190-L1194 WeakPolarHBondContact O-CB 3.34Å; E1190-L1194 PolarHBondContact O-N 2.87Å; H1191-L1194 PolarHBondContact O-N 3.22Å; G1192-L1194 VanDerWaalsContact C-N 3.34Å; G1192-L1194 PolarHBondContact O-N 3.12Å; L1194-L1197 PolarHBondContact O-N 3.18Å; L1194-L1198 PolarHBondContact O-N 3.48Å
1195	L	97.8	Very high	92.6	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67	-38.9	177.5	-70	174.7	0	0	0	112.3	F916 R917 Y1031 M1171 H1191 G1192 L1197 L1198 A1199	F916-L1195 HydrophobicContact CB-CD2 4.37Å; F916-L1195 HydrophobicContact CD1-CD2 3.48Å; F916-L1195 VanDerWaalsContact CD1-CD2 3.48Å; F916-L1195 HydrophobicContact CE1-CD2 4.13Å; F916-L1195 HydrophobicContact CG-CD2 4.26Å; R917-L1195 HydrophobicContact CB-CD1 4.25Å; R917-L1195 HydrophobicContact CG-CD1 3.87Å; Y1031-L1195 HydrophobicContact CD2-CB 4.24Å; Y1031-L1195 HydrophobicContact CD2-CD1 4.48Å; Y1031-L1195 HydrophobicContact CE2-CB 3.62Å; Y1031-L1195 HydrophobicContact CE2-CD1 4.18Å; M1171-L1195 HydrophobicContact CE-CD2 3.85Å; M1171-L1195 HydrophobicContact CE-CG 4.46Å; M1171-L1195 HydrophobicContact SD-CD2 4.08Å; M1171-L1195 HydrophobicContact SD-CG 4.05Å; H1191-L1195 WeakPolarHBondContact O-CB 3.44Å; H1191-L1195 VanDerWaalsContact O-CG 3.29Å; H1191-L1195 WeakPolarHBondContact O-CG 3.44Å; H1191-L1195 PolarHBondContact O-N 2.87Å; G1192-L1195 PolarHBondContact O-N 3.49Å; L1195-L1197 VanDerWaalsContact C-N 3.31Å; L1195-L1197 PolarHBondContact O-N 3.26Å; L1195-L1198 HydrophobicContact CD2-CD2 4.43Å; L1195-L1198 PolarHBondContact O-N 2.87Å; L1195-A1199 WeakPolarHBondContact O-CB 3.22Å; L1195-A1199 PolarHBondContact O-N 3.46Å
1196	A	97.2	Very high	91.4	Very high	41 Å²	41	38.6 Å²	38.6	34%	0.339	21%	0.21	S	C	.	.	H	α-helix	trans	-59.7	-42.5	174.9	0	0	0	0	0	111.8	Y1031 G1192 Q1193 A1199 E1200	Y1031-A1196 PolarHBondContact OH-N 2.91Å; G1192-A1196 WeakPolarHBondContact O-CB 3.31Å; G1192-A1196 PolarHBondContact O-N 3.4Å; Q1193-A1196 PolarHBondContact O-N 3.28Å; A1196-A1199 PolarHBondContact O-N 3.13Å; A1196-E1200 WeakPolarHBondContact O-CB 3.49Å; A1196-E1200 PolarHBondContact O-N 3.18Å
1197	L	97	Very high	89.8	Confident	17 Å²	17	36.5 Å²	36.5	9%	0.089	20%	0.201	C	C	.	.	H	α-helix	trans	-65.8	-39.9	175	-68.7	175.2	0	0	0	112.3	K380 F384 F1164 Q1193 L1194 L1195 E1200 L1201	K380-L1197 HydrophobicContact CB-CD2 3.52Å; K380-L1197 HydrophobicContact CD-CD2 4.02Å; K380-L1197 HydrophobicContact CG-CD2 4.38Å; F384-L1197 HydrophobicContact CB-CD1 3.59Å; F384-L1197 HydrophobicContact CD2-CD1 4.19Å; F384-L1197 HydrophobicContact CG-CD1 3.88Å; F1164-L1197 HydrophobicContact CE2-CB 3.97Å; F1164-L1197 HydrophobicContact CE2-CD1 4.32Å; F1164-L1197 HydrophobicContact CZ-CB 3.9Å; Q1193-L1197 WeakPolarHBondContact O-CG 3.4Å; Q1193-L1197 PolarHBondContact O-N 3.28Å; Q1193-L1197 VanDerWaalsContact O-N 3.11Å; L1194-L1197 PolarHBondContact O-N 3.18Å; L1195-L1197 VanDerWaalsContact C-N 3.31Å; L1195-L1197 PolarHBondContact O-N 3.26Å; L1197-E1200 PolarHBondContact O-N 2.94Å; L1197-L1201 VanDerWaalsContact O-CB 3.24Å; L1197-L1201 WeakPolarHBondContact O-CB 3.41Å; L1197-L1201 PolarHBondContact O-N 3.02Å
1198	L	97.3	Very high	87.8	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.3	-46.5	176.5	175.6	63.8	0	0	0	111.1	F916 L1037 L1124 L1125 F1164 L1168 L1194 L1195 L1201 L1202	F916-L1198 HydrophobicContact CD1-CD2 3.88Å; F916-L1198 HydrophobicContact CE1-CD2 3.71Å; L1037-L1198 HydrophobicContact CD1-CD2 3.59Å; L1037-L1198 HydrophobicContact CD1-CG 4.1Å; L1124-L1198 HydrophobicContact CD1-CD1 3.92Å; L1125-L1198 HydrophobicContact CD2-CD2 3.99Å; F1164-L1198 HydrophobicContact CE1-CB 4.11Å; F1164-L1198 HydrophobicContact CE1-CD1 4.11Å; F1164-L1198 HydrophobicContact CZ-CB 4.08Å; L1168-L1198 HydrophobicContact CD1-CD1 4.26Å; L1168-L1198 HydrophobicContact CD1-CD2 4.36Å; L1168-L1198 HydrophobicContact CD2-CD2 4.08Å; L1194-L1198 PolarHBondContact O-N 3.48Å; L1195-L1198 HydrophobicContact CD2-CD2 4.43Å; L1195-L1198 PolarHBondContact O-N 2.87Å; L1198-L1201 WeakPolarHBondContact O-CB 3.38Å; L1198-L1201 PolarHBondContact O-N 3.32Å; L1198-L1202 HydrophobicContact CD1-CD1 4.03Å; L1198-L1202 HydrophobicContact CD1-CG 4.11Å; L1198-L1202 HydrophobicContact CG-CD1 4.2Å; L1198-L1202 WeakPolarHBondContact O-CG 3.36Å; L1198-L1202 PolarHBondContact O-N 3.09Å
1199	A	96.2	Very high	85.9	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.008	23%	0.232	C	C	.	.	H	α-helix	trans	-60	-47.8	176.2	0	0	0	0	0	111.2	Y1031 E1034 L1195 A1196 L1201 L1202 R1203	Y1031-A1199 HydrophobicContact CD1-CB 3.85Å; Y1031-A1199 HydrophobicContact CE1-CB 4.02Å; E1034-A1199 HydrophobicContact CG-CB 4.05Å; L1195-A1199 WeakPolarHBondContact O-CB 3.22Å; L1195-A1199 PolarHBondContact O-N 3.46Å; A1196-A1199 PolarHBondContact O-N 3.13Å; A1199-L1201 VanDerWaalsContact C-N 3.3Å; A1199-L1201 PolarHBondContact O-N 2.95Å; A1199-L1202 PolarHBondContact O-N 3.07Å; A1199-R1203 WeakPolarHBondContact O-CG 3.42Å; A1199-R1203 PolarHBondContact O-N 3.3Å; A1199-R1203 VanDerWaalsContact O-N 3.11Å
1200	E	95	Very high	83.8	Confident	55 Å²	55	36.9 Å²	36.9	26%	0.257	22%	0.216	S	C	.	.	H	α-helix	trans	-59.3	-40.5	176.7	-169.2	178.3	174.3	0	0	112.2	I377 K380 A1196 L1197 R1203	I377-E1200 HydrophobicContact CD1-CG 4.03Å; I377-E1200 HydrophobicContact CG1-CG 4.21Å; K380-E1200 IonicContact NZ-OE1 3.55Å; K380-E1200 PolarHBondContact NZ-OE1 3.26Å; K380-E1200 IonicContact NZ-OE2 2.74Å; K380-E1200 PolarHBondContact NZ-OE2 3.37Å; A1196-E1200 WeakPolarHBondContact O-CB 3.49Å; A1196-E1200 PolarHBondContact O-N 3.18Å; L1197-E1200 PolarHBondContact O-N 2.94Å; E1200-R1203 PolarHBondContact O-N 2.87Å
1201	L	94.3	Very high	81.5	Confident	3 Å²	3	37.2 Å²	37.2	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-64.4	-41.6	177.2	-177.9	65.4	0	0	0	112.4	V373 I377 I381 L1120 L1124 L1161 F1164 L1197 L1198 A1199 G1204	V373-L1201 HydrophobicContact CB-CD1 4.41Å; V373-L1201 HydrophobicContact CG1-CD1 3.49Å; V373-L1201 VanDerWaalsContact CG1-CD1 3.49Å; V373-L1201 HydrophobicContact CG2-CD1 4.04Å; I377-L1201 HydrophobicContact CG2-CB 4.37Å; I377-L1201 HydrophobicContact CG2-CD1 4.05Å; I381-L1201 HydrophobicContact CD1-CD1 4.5Å; I381-L1201 HydrophobicContact CD1-CD2 4.35Å; L1120-L1201 HydrophobicContact CD1-CD1 3.79Å; L1120-L1201 HydrophobicContact CD1-CD2 4.16Å; L1120-L1201 HydrophobicContact CD1-CG 3.76Å; L1124-L1201 HydrophobicContact CD1-CD2 3.59Å; L1161-L1201 HydrophobicContact CD2-CD2 3.98Å; F1164-L1201 HydrophobicContact CD1-CD2 4.44Å; F1164-L1201 HydrophobicContact CE1-CD2 4.26Å; L1197-L1201 VanDerWaalsContact O-CB 3.24Å; L1197-L1201 WeakPolarHBondContact O-CB 3.41Å; L1197-L1201 PolarHBondContact O-N 3.02Å; L1198-L1201 WeakPolarHBondContact O-CB 3.38Å; L1198-L1201 PolarHBondContact O-N 3.32Å; A1199-L1201 VanDerWaalsContact C-N 3.3Å; A1199-L1201 PolarHBondContact O-N 2.95Å; L1201-G1204 PolarHBondContact O-N 2.83Å
1202	L	93.9	Very high	78.8	Confident	3 Å²	3	45.8 Å²	45.8	2%	0.016	25%	0.25	C	C	.	.	H	α-helix	trans	-76.5	-19.3	-178.4	-66.8	-178.5	0	0	0	113.9	E1036 L1037 H1118 L1120 A1121 L1198 A1199 G1204	E1036-L1202 HydrophobicContact CB-CB 3.97Å; L1037-L1202 HydrophobicContact CB-CD1 4.18Å; L1037-L1202 HydrophobicContact CD1-CD1 4.1Å; H1118-L1202 HydrophobicContact CB-CD2 4.2Å; L1120-L1202 HydrophobicContact CB-CD2 4Å; A1121-L1202 HydrophobicContact CB-CD1 4.3Å; A1121-L1202 HydrophobicContact CB-CD2 3.93Å; L1198-L1202 HydrophobicContact CD1-CD1 4.03Å; L1198-L1202 HydrophobicContact CD1-CG 4.11Å; L1198-L1202 HydrophobicContact CG-CD1 4.2Å; L1198-L1202 WeakPolarHBondContact O-CG 3.36Å; L1198-L1202 PolarHBondContact O-N 3.09Å; A1199-L1202 PolarHBondContact O-N 3.07Å; L1202-G1204 PolarHBondContact O-N 3.39Å
1203	R	89.2	Confident	76.2	Confident	156 Å²	156	51.7 Å²	51.7	59%	0.589	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-15.1	168.7	-69.1	177.9	-160.9	147.1	-2.8	112.9	E1034 A1199 E1200	E1034-R1203 VanDerWaalsContact CD-NH2 3.33Å; E1034-R1203 IonicContact OE1-CZ 2.71Å; E1034-R1203 IonicContact OE1-NE 3.43Å; E1034-R1203 PolarHBondContact OE1-NE 3.46Å; E1034-R1203 IonicContact OE1-NH2 2.73Å; E1034-R1203 PolarHBondContact OE1-NH2 3.05Å; E1034-R1203 IonicContact OE2-CZ 3.91Å; E1034-R1203 IonicContact OE2-NE 3.41Å; E1034-R1203 PolarHBondContact OE2-NE 3.19Å; E1034-R1203 IonicContact OE2-NH2 2.73Å; E1034-R1203 PolarHBondContact OE2-NH2 3.06Å; A1199-R1203 WeakPolarHBondContact O-CG 3.42Å; A1199-R1203 PolarHBondContact O-N 3.3Å; A1199-R1203 VanDerWaalsContact O-N 3.11Å; E1200-R1203 PolarHBondContact O-N 2.87Å
1204	G	77.6	Confident	73.4	Confident	19 Å²	19	51.3 Å²	51.3	20%	0.196	28%	0.276	C	S	.	.	S	Bend	trans	-60.4	161.3	174.7	0	0	0	0	0	112.8	H1118 L1201 L1202 C1206	H1118-G1204 PolarHBondContact NE2-O 3.21Å; L1201-G1204 PolarHBondContact O-N 2.83Å; L1202-G1204 PolarHBondContact O-N 3.39Å; G1204-C1206 PolarHBondContact O-N 2.74Å
1205	P	70.6	Confident	70.4	Confident	102 Å²	102	54.1 Å²	54.1	66%	0.662	30%	0.299	S	S	*	.			trans	-64.6	138.3	175.8	27.2	-32.6	0	0	0	110.5	G1207	P1205-G1207 PolarHBondContact O-N 2.87Å
1206	C	64.4	Low	67.3	Low	28 Å²	28	61.7 Å²	61.7	19%	0.189	34%	0.34	C	S	.	.			trans	-59.1	-0.8	175.1	-79.1	0	0	0	0	114.9	R1093 H1118 P1119 G1204	R1093-C1206 WeakPolarHBondContact O-CB 3.17Å; H1118-C1206 PolarHBondContact CD2-SG 2.95Å; P1119-C1206 WeakPolarHBondContact CG-O 3.44Å; G1204-C1206 PolarHBondContact O-N 2.74Å
1207	G	58	Low	64	Low	33 Å²	33	69.1 Å²	69.1	34%	0.34	37%	0.374	S	S	.	.			trans	85.4	159.8	-162.7	0	0	0	0	0	112.3	P1205 F1209	P1205-G1207 PolarHBondContact O-N 2.87Å; G1207-F1209 PolarHBondContact O-N 3.43Å
1208	S	50.2	Low	62.3	Low	109 Å²	109	71.7 Å²	71.7	76%	0.762	39%	0.388	S	S	*	.			trans	-74.8	90.9	-177.3	63.6	0	0	0	0	111.9
1209	F	51.6	Low	60.5	Low	18 Å²	18	75.5 Å²	75.5	8%	0.079	41%	0.408	C	S	.	.			trans	-102.8	77.6	161.5	-167.9	-117.9	0	0	0	109.3	Q1055 L1092 R1095 G1207 M1211	Q1055-F1209 HydrophobicContact CG-CE2 4.38Å; Q1055-F1209 HydrophobicContact CG-CZ 4.11Å; L1092-F1209 HydrophobicContact CB-CD1 4.45Å; L1092-F1209 HydrophobicContact CB-CE1 4.39Å; R1095-F1209 HydrophobicContact CG-CB 4.29Å; R1095-F1209 HydrophobicContact CG-CD1 3.87Å; R1095-F1209 HydrophobicContact CG-CD2 3.52Å; R1095-F1209 HydrophobicContact CG-CE1 3.98Å; R1095-F1209 HydrophobicContact CG-CE2 3.62Å; R1095-F1209 HydrophobicContact CG-CG 3.62Å; R1095-F1209 HydrophobicContact CG-CZ 3.84Å; G1207-F1209 PolarHBondContact O-N 3.43Å; F1209-M1211 HydrophobicContact CE1-CG 4.07Å; F1209-M1211 HydrophobicContact CZ-CG 4.46Å
1210	D	49.2	Very low	58.5	Low	43 Å²	43	79.6 Å²	79.6	23%	0.23	43%	0.431	C	S	.	.			trans	-99.5	108.6	173.2	-149.1	-20	0	0	0	109.6	R1091 R1212 K1213	R1091-D1210 IonicContact CZ-OD1 3.37Å; R1091-D1210 IonicContact CZ-OD2 2.66Å; R1091-D1210 IonicContact NE-OD1 3.71Å; R1091-D1210 PolarHBondContact NE-OD1 2.83Å; R1091-D1210 IonicContact NE-OD2 2.61Å; R1091-D1210 VanDerWaalsContact NH2-CG 3.34Å; R1091-D1210 IonicContact NH2-OD1 3.64Å; R1091-D1210 IonicContact NH2-OD2 3.41Å; R1091-D1210 PolarHBondContact NH2-OD2 3.11Å; D1210-R1212 PolarHBondContact O-N 2.68Å; D1210-K1213 HydrophobicContact CB-CB 4.16Å; D1210-K1213 HydrophobicContact CB-CD 4.22Å; D1210-K1213 HydrophobicContact CB-CG 3.94Å; D1210-K1213 PolarHBondContact O-N 2.9Å; D1210-K1213 VanDerWaalsContact O-N 3.1Å
1211	M	46.4	Very low	56.3	Low	38 Å²	38	81.1 Å²	81.1	19%	0.187	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-16.5	-180	-63.8	-158.2	-66.2	0	0	113.4	V1069 T1090 F1209	V1069-M1211 HydrophobicContact CG1-SD 3.83Å; T1090-M1211 WeakPolarHBondContact O-CE 3.29Å; F1209-M1211 HydrophobicContact CE1-CG 4.07Å; F1209-M1211 HydrophobicContact CZ-CG 4.46Å
1212	R	39.8	Very low	54	Low	187 Å²	187	85.9 Å²	85.9	71%	0.706	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-16.3	178.6	-68.9	-172	-175.2	176.3	4.5	115.1	D1210 T1214 A1215	D1210-R1212 PolarHBondContact O-N 2.68Å; R1212-T1214 PolarHBondContact O-N 2.98Å; R1212-A1215 PolarHBondContact O-N 3.11Å; R1212-A1215 VanDerWaalsContact O-N 3.08Å
1213	K	39.9	Very low	51.3	Low	138 Å²	138	91.5 Å²	91.5	60%	0.6	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-6.6	-175.5	-91	-169.9	175.5	-169.1	0	114.2	D1210	D1210-K1213 HydrophobicContact CB-CB 4.16Å; D1210-K1213 HydrophobicContact CB-CD 4.22Å; D1210-K1213 HydrophobicContact CB-CG 3.94Å; D1210-K1213 PolarHBondContact O-N 2.9Å; D1210-K1213 VanDerWaalsContact O-N 3.1Å
1214	T	38.7	Very low	48.6	Very low	84 Å²	84	86.9 Å²	86.9	52%	0.515	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	5.2	175.5	51	0	0	0	0	114.1	R1212	R1212-T1214 PolarHBondContact O-N 2.98Å
1215	A	34.1	Very low	46.4	Very low	61 Å²	61	92.1 Å²	92.1	50%	0.504	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-19.5	178.2	0	0	0	0	0	113.8	R1212	R1212-A1215 PolarHBondContact O-N 3.11Å; R1212-A1215 VanDerWaalsContact O-N 3.08Å
1216	D	32.6	Very low	44.4	Very low	160 Å²	160	91.3 Å²	91.3	86%	0.856	50%	0.501	S	S	*	.			trans	-98.5	-10.7	175	-79.4	-20.9	0	0	0	113
1217	D	27.6	Very low	42.5	Very low	196 Å²	196	97 Å²	97	100%	1.048	53%	0.53	S	S	*	.			trans	-97.9	0	165.7	-74.9	-18.2	0	0	0	109

Retrieved 1,217 of 1,217 residues in 2108.7 ms (Link to these results)

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