A0A5K4ENJ7_SCHMA Loading...

DUF4139 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4ENJ7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,148 aa.

						>A0A5K4ENJ7_SCHMA|A0A5K4ENJ7
MSTTVGVSDITADQSEINRESYISYPSYEIDNTPSQSSFGHLNHLNHDEYQTRLNGGEDEYLPGDIKENISGNNNSNEDIPTNDDRSEYTNMKTEESYHDSTCPSHSEQELDQDILKNEHGKNELIPEQNMECLNIQNVENQQKLSFNQIKEDLEKKNVIGSLQPLRPEQYIMHHQAGLIKQQEMLVLNPQTGDVLSDQYSSHHQTNTITTGGTHHFARNITSTNSVVVPSGGNVSGPPVGSGTVAGQQKGSTIYPKTGQNPIDGGTNGGVGANSSGSAGGGPSKSGTLVGGGLDRSRQVYNMFECQMSQLTVFLDRALICRRIRPRFNASDITEVVFEHLSPAIDKDSIRVEIRGAATILDVSFSAKSLSGEEDTWSQCVNELLVELRQCRRRADNLVNRIIRTEKQRCVLETFADSLSRREDEILLGGSHYGHTTLNNIPNHTGVVDQVNNISSQGATLSGGTTPANAQMAATTAEHKCINDVTNPYDPKNVETLHKFLEIYKDEAERFDTVLMDTTEELEQVRTRIETLEKEVRDIELKQDEHLARELSVLVEPRETGQVEMLVSYVVNRCGWKPAYDIRIFNNDGTMKIVYYGMVQQATGEDWETRYMTLSTAQPGIGGTVPHLGIQRVHFRRDHSPAIPISRNAISSTSVTTGYSSGGMTSTTTIPASTGHQISGASSTGKNTRSCTKLGAFKRSNRTPGTNINEIDRVGSMDNEVKLLMLFPYISPDSSRQLQSVDKSNLNEKTSRLPSAGTTPTYSKRISANAAVFYQTPPLQRPDFTRGLNDNISYEMTDRLSEYYDNSTEYCSTLGRSDSMASTTLHSSLGRRNKLHPRSKSRETIRTITQRDGITPSGTLQRGGSIESTYATGLRSSSTRPISRRTLGSSMLFNSVTSQSPLLTNRTSNLMNSQPALLPTPQQPTPSVGTVATIQLEVPRPPAIIRCDNEPNRVTVGLLDLQPRYEYVTVPKRSLYAYLKATAVNNTEFSILAGPTNIYADNTFIGKSEIRAVAPGEEFNCHLGAENGIKILYRPLFKYREGTGSSGKNATMTFKQLIEVRNTFDRRVRLMVVDQVPVSAEDKIKVNLLEPTIKHPEKYDKNRPIRMNKFNNVEWDLDLGPGEIRELTLKYSVEHPINEDLDVSVSEN
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.6	Very low	30.5	Very low	241 Å²	241	137.1 Å²	137.1	100%	1.187	83%	0.829	S	S	*	*				0	140.5	0	-78.8	176.8	165.7	0	0	106.4
2	S	32.6	Very low	30.8	Very low	116 Å²	116	133.8 Å²	133.8	81%	0.811	83%	0.828	S	S	*	*			trans	61	153.3	-168	-63.7	0	0	0	0	114.7
3	T	32.9	Very low	30.9	Very low	133 Å²	133	133.2 Å²	133.2	82%	0.816	82%	0.815	S	S	*	*				-159.4	139.7	-52.9	7.1	0	0	0	0	107.4
4	T	32.6	Very low	30.9	Very low	138 Å²	138	135.3 Å²	135.3	85%	0.847	81%	0.812	S	S	*	*			trans	-65.1	136.1	174	-47	0	0	0	0	112.3
5	V	32.5	Very low	30.7	Very low	131 Å²	131	132.5 Å²	132.5	79%	0.794	80%	0.801	S	S	*	*			trans	-145.9	139.5	142.5	178.9	0	0	0	0	108.1	V7	V5-V7 HydrophobicContact CG1-CG2 3.88Å
6	G	28	Very low	30.6	Very low	72 Å²	72	134.4 Å²	134.4	74%	0.742	80%	0.799	S	S	*	*			trans	-133.9	126.5	164.2	0	0	0	0	0	109.8
7	V	32.1	Very low	30.5	Very low	117 Å²	117	134.1 Å²	134.1	71%	0.709	79%	0.791	S	S	*	*			trans	-154.4	101.3	-177.7	171.6	0	0	0	0	103.9	V5	V5-V7 HydrophobicContact CG1-CG2 3.88Å
8	S	29	Very low	30.5	Very low	91 Å²	91	135.6 Å²	135.6	64%	0.636	80%	0.795	S	S	*	*				65.1	107.8	75.8	77.6	0	0	0	0	114.5
9	D	27.3	Very low	30.3	Very low	160 Å²	160	140.8 Å²	140.8	86%	0.856	80%	0.799	S	S	*	*			trans	37.2	105.7	153.2	-48.3	-23.2	0	0	0	119.6
10	I	31.6	Very low	30.3	Very low	170 Å²	170	143.6 Å²	143.6	87%	0.872	81%	0.805	S	S	*	*			trans	-134.1	116.1	150.4	-60.1	-177.8	0	0	0	108.8
11	T	26.9	Very low	30.2	Very low	139 Å²	139	142.2 Å²	142.2	85%	0.853	81%	0.805	S	S	*	*			trans	-102.5	119.8	173	51.2	0	0	0	0	111
12	A	33.6	Very low	30	Very low	98 Å²	98	141.5 Å²	141.5	81%	0.81	79%	0.791	S	S	*	*			trans	-168.5	157	155.6	0	0	0	0	0	110.4
13	D	31.8	Very low	29.9	Very low	125 Å²	125	142.6 Å²	142.6	67%	0.668	79%	0.786	S	S	*	*			cis	-174.3	123.7	-38.4	177.7	25.8	0	0	0	106.2
14	Q	31.2	Very low	29.6	Very low	163 Å²	163	141.4 Å²	141.4	76%	0.762	78%	0.783	S	S	*	*			trans	58.5	154.6	168	-80	165.4	92.3	0	0	117.8
15	S	27.6	Very low	29.4	Very low	94 Å²	94	142.9 Å²	142.9	66%	0.657	78%	0.775	S	S	*	*			cis	-162.3	174.3	-7.2	43.8	0	0	0	0	111.1
16	E	29.6	Very low	29.2	Very low	163 Å²	163	141 Å²	141	76%	0.762	77%	0.765	S	S	*	*			trans	85.3	115.3	157	-61.6	-158	136.8	0	0	121.6
17	I	28.6	Very low	29.1	Very low	129 Å²	129	141.8 Å²	141.8	66%	0.662	76%	0.759	S	S	*	*			trans	66.2	96.3	132	-53.4	166.4	0	0	0	117.8
18	N	31.2	Very low	29	Very low	161 Å²	161	145.7 Å²	145.7	86%	0.861	76%	0.763	S	S	*	*				-155.9	162.4	97.7	-105.2	-45.3	0	0	0	112.2
19	R	25.7	Very low	28.8	Very low	234 Å²	234	150.6 Å²	150.6	88%	0.883	78%	0.775	S	S	*	*			trans	-116.1	133.2	178.3	-71.3	175.9	173	147.3	-5.3	109.9
20	E	30.4	Very low	29	Very low	196 Å²	196	148.2 Å²	148.2	92%	0.916	76%	0.762	S	S	*	*			trans	-154.7	164.7	143.7	-115.4	154.7	-143	0	0	109.7
21	S	28.2	Very low	28.8	Very low	116 Å²	116	147.5 Å²	147.5	81%	0.811	76%	0.76	S	S	*	*			trans	-95.5	127	-147.2	50.1	0	0	0	0	115.8
22	Y	26.6	Very low	29	Very low	226 Å²	226	146.7 Å²	146.7	89%	0.886	75%	0.75	S	S	*	*			trans	-94.9	134.2	159.8	-98.1	-88.1	0	0	0	110.9
23	I	31.1	Very low	28.7	Very low	138 Å²	138	147.4 Å²	147.4	71%	0.708	75%	0.745	S	S	*	*			trans	-84.3	108.7	161.1	-64.7	176.4	0	0	0	107.6	Y25	I23-Y25 HydrophobicContact CG2-CD2 4.48Å; I23-Y25 HydrophobicContact CG2-CE2 4.12Å
24	S	26.3	Very low	28.4	Very low	108 Å²	108	147 Å²	147	76%	0.755	75%	0.749	S	S	*	*			trans	-92.3	108.1	175.4	57.8	0	0	0	0	110.7
25	Y	29.2	Very low	28.2	Very low	169 Å²	169	144.1 Å²	144.1	66%	0.663	75%	0.746	S	S	*	*			trans	-68.8	139	170.3	-71.7	-84.3	0	0	0	111	I23 S27	I23-Y25 HydrophobicContact CG2-CD2 4.48Å; I23-Y25 HydrophobicContact CG2-CE2 4.12Å; Y25-S27 PolarHBondContact O-N 3.33Å
26	P	28.2	Very low	28.1	Very low	93 Å²	93	148.6 Å²	148.6	60%	0.604	76%	0.757	S	S	*	*			trans	-77.4	121.8	177.4	30.1	-33.1	0	0	0	111.2	Y28	P26-Y28 HydrophobicContact CG-CE2 4.13Å; P26-Y28 WeakPolarHBondContact O-CD2 3.47Å; P26-Y28 PolarHBondContact O-N 3.12Å
27	S	25.9	Very low	27.9	Very low	88 Å²	88	145.4 Å²	145.4	62%	0.615	75%	0.753	S	S	*	*			trans	-63.1	113.1	171.5	-53.9	0	0	0	0	110.4	Y25 S734	Y25-S27 PolarHBondContact O-N 3.33Å; S27-S734 PolarHBondContact OG-OG 3.15Å; S27-S734 VanDerWaalsContact OG-OG 3.07Å
28	Y	29.8	Very low	27.8	Very low	199 Å²	199	143.9 Å²	143.9	78%	0.78	75%	0.753	S	S	*	*			trans	-85.4	111.7	170.5	-81.6	-90.7	0	0	0	110	P26 I30	P26-Y28 HydrophobicContact CG-CE2 4.13Å; P26-Y28 WeakPolarHBondContact O-CD2 3.47Å; P26-Y28 PolarHBondContact O-N 3.12Å; Y28-I30 PolarHBondContact O-N 2.69Å
29	E	24.7	Very low	27.6	Very low	193 Å²	193	144.3 Å²	144.3	90%	0.902	75%	0.748	S	S	*	*			trans	-61.6	125.7	163.7	-67.9	-179.2	134.7	0	0	109.5
30	I	31.6	Very low	27.5	Very low	111 Å²	111	135.8 Å²	135.8	57%	0.569	73%	0.733	S	S	*	*			trans	-125.4	117.4	164.2	-61.7	179.9	0	0	0	105.7	Y28 N32	Y28-I30 PolarHBondContact O-N 2.69Å; I30-N32 VanDerWaalsContact C-N 3.25Å; I30-N32 PolarHBondContact O-N 3.26Å
31	D	27.6	Very low	27.3	Very low	155 Å²	155	135.2 Å²	135.2	83%	0.829	73%	0.73	S	S	*	*			trans	-61.9	81.9	178.2	-86.6	-46.5	0	0	0	111.5
32	N	30.5	Very low	27.2	Very low	122 Å²	122	136.7 Å²	136.7	65%	0.652	73%	0.728	S	S	*	*			trans	-103.1	53	171.9	-77.4	-37.8	0	0	0	110.2	I30 P34	I30-N32 VanDerWaalsContact C-N 3.25Å; I30-N32 PolarHBondContact O-N 3.26Å; N32-P34 WeakPolarHBondContact O-CD 3.45Å
33	T	26.2	Very low	27.2	Very low	113 Å²	113	133 Å²	133	69%	0.693	72%	0.723	S	S	*	*			trans	-74.5	108.6	155.9	53.9	0	0	0	0	108.3	S35	T33-S35 PolarHBondContact O-N 2.84Å; T33-S35 VanDerWaalsContact O-N 3.12Å
34	P	26	Very low	27	Very low	116 Å²	116	134.2 Å²	134.2	75%	0.753	73%	0.726	S	S	*	*			trans	-59.3	117.9	151	28	-32.2	0	0	0	105.7	N32 Q36	N32-P34 WeakPolarHBondContact O-CD 3.45Å; P34-Q36 PolarHBondContact O-N 3.4Å
35	S	27.3	Very low	27.1	Very low	102 Å²	102	136.9 Å²	136.9	71%	0.713	73%	0.731	S	S	*	*			trans	-59.9	125.4	179.7	45.7	0	0	0	0	108.8	T33 S37	T33-S35 PolarHBondContact O-N 2.84Å; T33-S35 VanDerWaalsContact O-N 3.12Å; S35-S37 VanDerWaalsContact C-N 3.28Å; S35-S37 PolarHBondContact O-N 3.28Å
36	Q	25	Very low	27.2	Very low	188 Å²	188	135.8 Å²	135.8	88%	0.879	74%	0.737	S	S	*	*			trans	-66.6	91.7	173.2	-72.5	-171.9	-4.4	0	0	108.8	P34 S38	P34-Q36 PolarHBondContact O-N 3.4Å; Q36-S38 VanDerWaalsContact C-N 3.26Å; Q36-S38 PolarHBondContact O-N 2.73Å
37	S	26	Very low	27.1	Very low	97 Å²	97	139.4 Å²	139.4	68%	0.678	75%	0.745	S	S	*	*			trans	-68.7	90.2	164.8	45.2	0	0	0	0	107.9	S35 F39	S35-S37 VanDerWaalsContact C-N 3.28Å; S35-S37 PolarHBondContact O-N 3.28Å; S37-F39 PolarHBondContact O-N 3.46Å
38	S	26.6	Very low	27.4	Very low	96 Å²	96	141.6 Å²	141.6	67%	0.671	75%	0.75	S	S	*	*			trans	-69.6	86.2	-167.3	58.7	0	0	0	0	112.8	Q36 G40	Q36-S38 VanDerWaalsContact C-N 3.26Å; Q36-S38 PolarHBondContact O-N 2.73Å; S38-G40 PolarHBondContact O-N 2.95Å
39	F	25.8	Very low	27.6	Very low	170 Å²	170	140 Å²	140	75%	0.746	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	70.9	160.5	-84.5	-88.1	0	0	0	109.6	S37	S37-F39 PolarHBondContact O-N 3.46Å
40	G	24.8	Very low	27.9	Very low	55 Å²	55	140.4 Å²	140.4	57%	0.567	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-165.6	-20.5	-163.6	0	0	0	0	0	120.2	S38	S38-G40 PolarHBondContact O-N 2.95Å
41	H	25.9	Very low	27.8	Very low	184 Å²	184	142.9 Å²	142.9	85%	0.852	75%	0.753	S	S	*	*			trans	-171	105.8	168.5	-112.3	61.7	0	0	0	113
42	L	26.1	Very low	28	Very low	147 Å²	147	140.7 Å²	140.7	77%	0.77	75%	0.746	S	S	*	*			trans	-166.6	65	152.3	-116.2	162.7	0	0	0	112.2
43	N	25.8	Very low	27.9	Very low	148 Å²	148	146.1 Å²	146.1	79%	0.791	76%	0.757	S	S	*	*			trans	-73.9	143.9	154.9	-81.5	-33.9	0	0	0	108.6
44	H	27.5	Very low	28	Very low	165 Å²	165	147.5 Å²	147.5	76%	0.764	76%	0.759	S	S	*	*			trans	65.5	93.2	177.4	-51.9	-70.9	0	0	0	116.7
45	L	28.2	Very low	28.1	Very low	164 Å²	164	149.2 Å²	149.2	86%	0.859	76%	0.762	S	S	*	*				-130.1	146.2	126	-97.7	166.4	0	0	0	107.7
46	N	31	Very low	28.2	Very low	146 Å²	146	148.2 Å²	148.2	78%	0.781	77%	0.768	S	S	*	*			trans	-84.5	156.4	-165.4	-67.3	-14.2	0	0	0	113.1
47	H	27.3	Very low	28.4	Very low	168 Å²	168	142.6 Å²	142.6	78%	0.778	76%	0.76	S	S	*	*			trans	-69.2	167.4	151.5	-108.9	-108.6	0	0	0	111.3
48	D	31.9	Very low	28.5	Very low	135 Å²	135	146.8 Å²	146.8	72%	0.722	77%	0.769	S	S	*	*			trans	73.4	104.6	167.6	-54.5	-20.5	0	0	0	119.4
49	E	33.5	Very low	28.9	Very low	164 Å²	164	149.3 Å²	149.3	77%	0.766	78%	0.775	S	S	*	*			trans	170.2	138.4	133.8	-96.2	-173.6	170.8	0	0	107.7
50	Y	31.9	Very low	29	Very low	203 Å²	203	148.8 Å²	148.8	80%	0.796	78%	0.775	S	S	*	*			cis	-144.1	167.7	11	-123.1	-76.2	0	0	0	112
51	Q	29.5	Very low	29.4	Very low	163 Å²	163	156.3 Å²	156.3	76%	0.762	79%	0.788	S	S	*	*			trans	-95.7	158.3	-179.2	-73.1	-167.8	1.4	0	0	116.7
52	T	30.3	Very low	29.6	Very low	108 Å²	108	155 Å²	155	66%	0.663	79%	0.786	S	S	*	*			trans	62.7	120.1	144.2	50.5	0	0	0	0	122.5
53	R	29.8	Very low	29.9	Very low	236 Å²	236	153.9 Å²	153.9	89%	0.891	79%	0.788	S	S	*	*				179.9	121.6	111.7	-91.4	161.3	-170.1	-151.4	3	107.9
54	L	27.8	Very low	30.2	Very low	143 Å²	143	150.1 Å²	150.1	75%	0.749	78%	0.784	S	S	*	*				68.3	116.9	66.8	-75.6	175.7	0	0	0	115.8
55	N	29	Very low	30.4	Very low	152 Å²	152	150.3 Å²	150.3	81%	0.813	79%	0.79	S	S	*	*			trans	75.1	114.5	154.7	-58	-1	0	0	0	121.1
56	G	28.2	Very low	30.3	Very low	81 Å²	81	149.6 Å²	149.6	84%	0.835	79%	0.786	S	S	*	*				118.1	135.8	108.3	0	0	0	0	0	118.8
57	G	29.1	Very low	30.3	Very low	69 Å²	69	151 Å²	151	71%	0.711	79%	0.785	S	S	*	*			trans	85.5	114.5	175.2	0	0	0	0	0	112.8
58	E	29	Very low	30.4	Very low	186 Å²	186	150.1 Å²	150.1	87%	0.869	78%	0.781	S	S	*	*			cis	93.6	158.3	40.5	-64.1	-179.5	148.9	0	0	113.8
59	D	33.9	Very low	30.3	Very low	148 Å²	148	150.8 Å²	150.8	79%	0.791	79%	0.785	S	S	*	*			trans	65.6	98.2	-174.3	-54	-15.2	0	0	0	115.7
60	E	29.5	Very low	30	Very low	159 Å²	159	149.1 Å²	149.1	74%	0.743	78%	0.78	S	S	*	*				72.7	108.7	73.1	-71	-159.1	157	0	0	115.4
61	Y	32.9	Very low	29.8	Very low	214 Å²	214	145.4 Å²	145.4	84%	0.839	78%	0.783	S	S	*	*				-167.2	167.8	96.5	-120.3	-93.7	0	0	0	113.1
62	L	29.2	Very low	29.8	Very low	155 Å²	155	141.3 Å²	141.3	81%	0.812	79%	0.785	S	S	*	*			trans	-95.6	161.4	-165.9	-76.8	166.7	0	0	0	115.2
63	P	33.1	Very low	29.7	Very low	125 Å²	125	142.9 Å²	142.9	81%	0.812	79%	0.79	S	S	*	*			trans	-84.5	165.7	-175.2	35.2	-37.6	0	0	0	114.4
64	G	31.7	Very low	29.7	Very low	68 Å²	68	137.5 Å²	137.5	70%	0.701	78%	0.779	S	S	*	*			trans	-160.1	105	176.6	0	0	0	0	0	116.3
65	D	31.6	Very low	29.8	Very low	169 Å²	169	137.5 Å²	137.5	90%	0.904	78%	0.779	S	S	*	*			trans	67.8	161.8	145.7	-61.7	-38.1	0	0	0	123.9
66	I	27	Very low	29.9	Very low	150 Å²	150	134.8 Å²	134.8	77%	0.769	77%	0.773	S	S	*	*			trans	-146.5	160.3	-153.5	-75.4	171.8	0	0	0	110.4
67	K	29.7	Very low	30.1	Very low	175 Å²	175	137 Å²	137	76%	0.761	77%	0.765	S	S	*	*			trans	93.7	122.3	177.3	-74.4	130.1	-178.3	178.6	0	115.1
68	E	30.2	Very low	30.3	Very low	149 Å²	149	141.3 Å²	141.3	70%	0.696	77%	0.767	S	S	*	*			cis	90	116.3	47.1	-77.9	-171.5	128.2	0	0	113.6
69	N	29.3	Very low	30.7	Very low	149 Å²	149	140.3 Å²	140.3	80%	0.797	77%	0.767	S	S	*	*			trans	-178.1	115.4	138	-93.6	-57.3	0	0	0	106.5
70	I	28.4	Very low	30.6	Very low	129 Å²	129	140.1 Å²	140.1	66%	0.662	77%	0.765	S	S	*	*				99.3	130.4	51.6	-76.9	174	0	0	0	112.7
71	S	27.6	Very low	31	Very low	125 Å²	125	138.7 Å²	138.7	87%	0.874	77%	0.769	S	S	*	*			trans	76.5	136.1	170.6	76.2	0	0	0	0	118.7
72	G	29	Very low	31	Very low	78 Å²	78	134 Å²	134	80%	0.804	76%	0.763	S	S	*	*			trans	159.6	50.7	177	0	0	0	0	0	119.3
73	N	28.7	Very low	31.4	Very low	141 Å²	141	134.1 Å²	134.1	75%	0.754	77%	0.765	S	S	*	*			trans	31.2	123.6	159	-89	4.2	0	0	0	123
74	N	28.9	Very low	31.5	Very low	123 Å²	123	134.4 Å²	134.4	66%	0.658	76%	0.759	S	S	*	*				65.6	117.1	124.6	-56.9	-4.9	0	0	0	123.2
75	N	30.3	Very low	31.8	Very low	142 Å²	142	139.2 Å²	139.2	76%	0.759	77%	0.769	S	S	*	*				95.5	133.8	126.9	-69.7	9.8	0	0	0	123.5
76	S	31.1	Very low	31.9	Very low	96 Å²	96	139.9 Å²	139.9	67%	0.671	76%	0.759	S	S	*	*			trans	72.9	119.2	140.8	57.5	0	0	0	0	122.3
77	N	32.2	Very low	32.2	Very low	127 Å²	127	138 Å²	138	68%	0.679	76%	0.759	S	S	*	*			trans	66	152.4	132.4	-63.5	40.6	0	0	0	118.6
78	E	33.8	Very low	32.4	Very low	160 Å²	160	136 Å²	136	75%	0.748	75%	0.752	S	S	*	*			cis	-162.5	171.3	-15.8	-115.4	164.3	166.4	0	0	107.2
79	D	36.1	Very low	32.5	Very low	164 Å²	164	140.1 Å²	140.1	88%	0.877	76%	0.763	S	S	*	*			trans	-170.5	122.7	140.5	-109.3	-26.1	0	0	0	112.9
80	I	32.5	Very low	32.7	Very low	144 Å²	144	138.3 Å²	138.3	74%	0.738	76%	0.758	S	S	*	*			trans	-147.5	132.1	167.9	-57.6	177.8	0	0	0	107.6
81	P	37.3	Very low	32.8	Very low	130 Å²	130	139.2 Å²	139.2	84%	0.844	76%	0.764	S	S	*	*			trans	-91.3	135.8	167.5	33.7	-30.3	0	0	0	112.2
82	T	32.9	Very low	32.9	Very low	115 Å²	115	142.3 Å²	142.3	71%	0.706	77%	0.767	S	S	*	*			trans	-115.2	164.6	-178.8	49.9	0	0	0	0	113
83	N	37.3	Very low	32.9	Very low	158 Å²	158	147.7 Å²	147.7	85%	0.845	77%	0.768	S	S	*	*			trans	-158.6	105.6	145.8	-85.8	-35.6	0	0	0	105.3
84	D	35.5	Very low	33	Very low	131 Å²	131	147.5 Å²	147.5	70%	0.701	77%	0.772	S	S	*	*				60.1	111.4	79.8	-97.2	-19.2	0	0	0	114.9
85	D	38.1	Very low	33	Very low	168 Å²	168	149.7 Å²	149.7	90%	0.898	78%	0.778	S	S	*	*				-157.1	162.8	111.1	-128.4	-33.6	0	0	0	111.9
86	R	33.1	Very low	33.1	Very low	184 Å²	184	151.8 Å²	151.8	69%	0.694	78%	0.783	S	S	*	*			trans	-121.2	148.3	-160.9	-67.4	165.1	81.5	146.2	-0.3	116.7	E88	R86-E88 IonicContact CZ-OE1 3.95Å; R86-E88 IonicContact NE-OE1 3.65Å; R86-E88 PolarHBondContact NE-OE1 3.44Å; R86-E88 IonicContact NH2-OE1 2.85Å; R86-E88 PolarHBondContact NH2-OE1 3.37Å
87	S	35.1	Very low	33	Very low	110 Å²	110	152 Å²	152	77%	0.769	79%	0.785	S	S	*	*				171	106.9	124.9	58.6	0	0	0	0	110.4
88	E	32.8	Very low	32.8	Very low	133 Å²	133	155.6 Å²	155.6	62%	0.621	79%	0.791	S	S	*	*				63	107.8	78.6	-73.6	-176	-148.7	0	0	116.1	R86	R86-E88 IonicContact CZ-OE1 3.95Å; R86-E88 IonicContact NE-OE1 3.65Å; R86-E88 PolarHBondContact NE-OE1 3.44Å; R86-E88 IonicContact NH2-OE1 2.85Å; R86-E88 PolarHBondContact NH2-OE1 3.37Å
89	Y	33.2	Very low	33	Very low	235 Å²	235	156.8 Å²	156.8	92%	0.922	80%	0.796	S	S	*	*			trans	-155.2	158.9	130.4	-111.3	-72.8	0	0	0	110.1
90	T	33.6	Very low	32.6	Very low	112 Å²	112	155 Å²	155	69%	0.687	79%	0.786	S	S	*	*			trans	-127.2	146.5	-148.8	55.3	0	0	0	0	116.9
91	N	29.2	Very low	32.5	Very low	148 Å²	148	153.7 Å²	153.7	79%	0.791	79%	0.79	S	S	*	*			trans	25.1	128.4	145.8	-77.1	-24.9	0	0	0	120.4
92	M	30.8	Very low	32.1	Very low	189 Å²	189	153.5 Å²	153.5	93%	0.931	79%	0.786	S	S	*	*				-138	149.4	121.3	-99.4	-167.3	-70.7	0	0	110.3
93	K	27.6	Very low	32	Very low	191 Å²	191	153.6 Å²	153.6	83%	0.83	79%	0.79	S	S	*	*			trans	-149.6	130.8	-176.8	-170.7	-174.1	-175.5	-171	0	108.4
94	T	32.4	Very low	31.9	Very low	137 Å²	137	152.3 Å²	152.3	84%	0.84	79%	0.791	S	S	*	*			trans	-143.3	160.3	177.5	-25.3	0	0	0	0	109.3
95	E	28.5	Very low	31.6	Very low	169 Å²	169	151 Å²	151	79%	0.79	79%	0.792	S	S	*	*			trans	-115.7	-178.3	-158.4	-59.4	171.7	116	0	0	112.8
96	E	31.4	Very low	31.5	Very low	186 Å²	186	152 Å²	152	87%	0.869	79%	0.791	S	S	*	*			trans	72.1	145.2	164.5	-62.2	-174.9	166.8	0	0	117.6
97	S	30.4	Very low	31.2	Very low	100 Å²	100	146.9 Å²	146.9	70%	0.699	78%	0.783	S	S	*	*			cis	-158.4	158.4	-6.8	42.4	0	0	0	0	113.2
98	Y	28.2	Very low	30.8	Very low	204 Å²	204	149.5 Å²	149.5	80%	0.8	78%	0.783	S	S	*	*			trans	16.8	128.2	155.3	-73.9	-90.4	0	0	0	121.8
99	H	36.2	Very low	30.5	Very low	185 Å²	185	150.2 Å²	150.2	86%	0.856	79%	0.786	S	S	*	*				-159.3	144	96.3	-114	-76.1	0	0	0	113.8
100	D	28.2	Very low	30.2	Very low	126 Å²	126	147.3 Å²	147.3	67%	0.674	78%	0.781	S	S	*	*			trans	-125.6	154.1	176.9	171.5	34.2	0	0	0	109.4
101	S	31.6	Very low	29.8	Very low	116 Å²	116	149 Å²	149	81%	0.811	79%	0.786	S	S	*	*			trans	-170	130.9	163.4	-82.9	0	0	0	0	113.8
102	T	27.2	Very low	29.8	Very low	126 Å²	126	147.3 Å²	147.3	77%	0.773	78%	0.776	S	S	*	*			trans	-96.6	175.9	-169.6	-35.9	0	0	0	0	114.1
103	C	31.3	Very low	29.6	Very low	117 Å²	117	146.5 Å²	146.5	79%	0.791	77%	0.77	S	S	*	*			trans	-57.1	172.7	173.6	-43.6	0	0	0	0	115.1
104	P	34.4	Very low	29.6	Very low	132 Å²	132	144.3 Å²	144.3	86%	0.857	77%	0.768	S	S	*	*			trans	-134.8	159.2	132.5	38.5	-28.8	0	0	0	115
105	S	31.2	Very low	29.5	Very low	104 Å²	104	144.3 Å²	144.3	73%	0.727	76%	0.761	S	S	*	*			trans	-112.2	139.9	172.9	57.2	0	0	0	0	111.1
106	H	34	Very low	29.4	Very low	189 Å²	189	143.9 Å²	143.9	88%	0.875	76%	0.763	S	S	*	*			trans	175	156.7	163.9	-97.6	-76.1	0	0	0	107.3
107	S	27.3	Very low	29.2	Very low	76 Å²	76	143.5 Å²	143.5	53%	0.531	76%	0.759	S	S	.	*			cis	-177.9	145.7	-26	44.5	0	0	0	0	109.2
108	E	26.9	Very low	29	Very low	165 Å²	165	144.5 Å²	144.5	77%	0.771	76%	0.756	S	S	*	*			trans	63.5	165.4	159.4	-69.1	174.4	119.6	0	0	116.1
109	Q	26.9	Very low	29	Very low	147 Å²	147	142 Å²	142	69%	0.687	75%	0.752	S	S	*	*			cis	-140.7	135.8	-16.8	-104.6	142.1	24.7	0	0	104.7
110	E	26.8	Very low	28.5	Very low	175 Å²	175	141.3 Å²	141.3	82%	0.818	75%	0.749	S	S	*	*				47.3	96.1	93.1	-166.1	172.9	-121.3	0	0	115.4
111	L	26.2	Very low	28.7	Very low	148 Å²	148	139.2 Å²	139.2	78%	0.775	76%	0.757	S	S	*	*			trans	-169.5	141.1	131.4	-128.6	73	0	0	0	112.9
112	D	28.3	Very low	28.6	Very low	111 Å²	111	142 Å²	142	59%	0.594	75%	0.754	S	S	*	*			trans	34.2	128.1	146.1	-66	-27.2	0	0	0	121.7
113	Q	27.3	Very low	28.6	Very low	172 Å²	172	142.7 Å²	142.7	80%	0.804	75%	0.753	S	S	*	*				53.1	122.2	76.1	-60.7	-180	90	0	0	111.5
114	D	26.8	Very low	28.5	Very low	146 Å²	146	146.5 Å²	146.5	78%	0.781	76%	0.759	S	S	*	*				-169.4	-178	80.2	-154.8	-10	0	0	0	112.9
115	I	29.4	Very low	28	Very low	137 Å²	137	147.1 Å²	147.1	70%	0.703	75%	0.754	S	S	*	*			trans	72.6	85.3	158	-60.8	161	0	0	0	116.6
116	L	27	Very low	27.9	Very low	159 Å²	159	150.1 Å²	150.1	83%	0.832	76%	0.761	S	S	*	*			trans	-50.6	133	134.3	-73.3	155.4	0	0	0	110.8
117	K	26.6	Very low	27.4	Very low	179 Å²	179	146.6 Å²	146.6	78%	0.778	76%	0.755	S	S	*	*			trans	167.7	141.4	131.9	-92.5	151.9	-167.3	166.8	0	114.5
118	N	27.1	Very low	27.3	Very low	121 Å²	121	152.1 Å²	152.1	65%	0.647	77%	0.772	S	S	*	*			trans	66.3	153.3	142.7	-63.1	27	0	0	0	118.9
119	E	28.2	Very low	27.3	Very low	151 Å²	151	153 Å²	153	71%	0.706	78%	0.776	S	S	*	*			cis	-157.6	153.5	-16.4	-115.9	166.6	149.5	0	0	112.4
120	H	26.5	Very low	27.2	Very low	171 Å²	171	152.5 Å²	152.5	79%	0.792	78%	0.778	S	S	*	*			trans	5.7	120.1	152.8	-66.7	86.2	0	0	0	120.6
121	G	31.6	Very low	27.1	Very low	81 Å²	81	153 Å²	153	84%	0.835	78%	0.783	S	S	*	*			trans	-139.3	43.3	177.4	0	0	0	0	0	116
122	K	29.5	Very low	27.1	Very low	175 Å²	175	154.1 Å²	154.1	76%	0.761	78%	0.784	S	S	*	*			trans	8	121.8	162.8	-67	174.3	-179.6	174.8	0	120.4
123	N	26.5	Very low	26.9	Very low	140 Å²	140	154.5 Å²	154.5	75%	0.749	79%	0.794	S	S	*	*				44.2	127.7	118.7	-56.7	10.2	0	0	0	120.9
124	E	29.1	Very low	26.7	Very low	198 Å²	198	154 Å²	154	93%	0.925	80%	0.796	S	S	*	*				-143.9	152.7	118.2	-145.3	160.5	-147.2	0	0	110.6
125	L	24.8	Very low	26.6	Very low	144 Å²	144	152.2 Å²	152.2	75%	0.754	79%	0.787	S	S	*	*			trans	-103	145.6	-174.2	-75	73.1	0	0	0	110.8
126	I	28.8	Very low	26.5	Very low	168 Å²	168	152.4 Å²	152.4	86%	0.862	79%	0.787	S	S	*	*			trans	-127.7	135.4	156.4	-60.5	-177.8	0	0	0	107.5
127	P	24.1	Very low	26.4	Very low	115 Å²	115	151.6 Å²	151.6	75%	0.747	78%	0.779	S	S	*	*			trans	-88.3	162.3	-159.3	-8.3	28.2	0	0	0	114.7
128	E	25.8	Very low	26.4	Very low	192 Å²	192	150.7 Å²	150.7	90%	0.897	78%	0.783	S	S	*	*			trans	-60.8	130.6	167	-59.4	171.6	121.9	0	0	111.3
129	Q	25.9	Very low	26.5	Very low	183 Å²	183	149.6 Å²	149.6	86%	0.855	78%	0.78	S	S	*	*			trans	-140.3	103.5	160.5	-73.8	-161.4	-17.4	0	0	111.4
130	N	24.4	Very low	26.5	Very low	136 Å²	136	150.9 Å²	150.9	73%	0.727	79%	0.786	S	S	*	*			trans	39.5	91.5	146.3	-57	8.9	0	0	0	118.5
131	M	26	Very low	26.6	Very low	186 Å²	186	150.4 Å²	150.4	92%	0.916	79%	0.79	S	S	*	*			trans	-113.5	97	135.6	-82.2	-82.5	-79.5	0	0	106.4	C133	M131-C133 PolarHBondContact O-N 2.83Å
132	E	24.8	Very low	26.5	Very low	172 Å²	172	154.5 Å²	154.5	80%	0.804	79%	0.787	S	S	*	*			trans	-66.3	124.7	-174.1	-69.5	179.3	119.8	0	0	111.2	L134	E132-L134 PolarHBondContact O-N 3.04Å
133	C	23.9	Very low	26.7	Very low	118 Å²	118	155.2 Å²	155.2	80%	0.797	79%	0.793	S	S	*	*			trans	-60.5	125	163.6	-60.6	0	0	0	0	108.7	M131 N135	M131-C133 PolarHBondContact O-N 2.83Å; C133-N135 PolarHBondContact O-N 3.07Å
134	L	24.4	Very low	27.1	Very low	162 Å²	162	156.6 Å²	156.6	85%	0.848	79%	0.793	S	S	*	*			trans	-72.6	65	166.3	-84.3	170.7	0	0	0	110.5	E132 I136	E132-L134 PolarHBondContact O-N 3.04Å; L134-I136 VanDerWaalsContact C-N 3.29Å; L134-I136 PolarHBondContact O-N 2.86Å
135	N	25.2	Very low	27.6	Very low	109 Å²	109	152.4 Å²	152.4	58%	0.583	78%	0.776	S	S	*	*			trans	-73.3	84.1	168.6	-178.6	25.4	0	0	0	108.4	C133 Q137	C133-N135 PolarHBondContact O-N 3.07Å; N135-Q137 PolarHBondContact O-N 2.92Å; N135-Q137 WeakPolarHBondContact OD1-CG 3.05Å
136	I	26.9	Very low	28.6	Very low	140 Å²	140	148.1 Å²	148.1	72%	0.718	76%	0.758	S	S	*	*			trans	-75.5	72	179.4	-51.7	-179	0	0	0	109.6	L134	L134-I136 VanDerWaalsContact C-N 3.29Å; L134-I136 PolarHBondContact O-N 2.86Å
137	Q	25.2	Very low	29.6	Very low	143 Å²	143	145.4 Å²	145.4	67%	0.668	74%	0.74	S	S	*	*			trans	-110.9	133.1	162.7	-67.8	-177.3	3	0	0	108	N135	N135-Q137 PolarHBondContact O-N 2.92Å; N135-Q137 WeakPolarHBondContact OD1-CG 3.05Å
138	N	26	Very low	31.5	Very low	159 Å²	159	145 Å²	145	85%	0.85	73%	0.732	S	S	*	*			trans	67	76	-177.2	-53.8	-28	0	0	0	116.9
139	V	29.3	Very low	33.3	Very low	98 Å²	98	140.2 Å²	140.2	59%	0.594	71%	0.709	S	S	*	*			trans	-133.4	79.8	147.5	-169.7	0	0	0	0	110.3	Q142	V139-Q142 HydrophobicContact CG1-CB 3.87Å; V139-Q142 HydrophobicContact CG1-CG 3.94Å
140	E	27.6	Very low	34.7	Very low	178 Å²	178	135.4 Å²	135.4	83%	0.832	69%	0.689	S	S	*	*			trans	-74.1	142	156.2	-65.2	-177.3	137.3	0	0	108.8
141	N	28.1	Very low	36.4	Very low	161 Å²	161	132.2 Å²	132.2	86%	0.861	67%	0.668	S	S	*	*	S	Bend	trans	65.4	47.3	169.8	-55.6	-50.3	0	0	0	118.7
142	Q	30.2	Very low	38.3	Very low	168 Å²	168	128.6 Å²	128.6	79%	0.785	65%	0.649	S	S	*	*			trans	-128.1	151.9	158	-64.8	-165.2	5.3	0	0	112.6	V139	V139-Q142 HydrophobicContact CG1-CB 3.87Å; V139-Q142 HydrophobicContact CG1-CG 3.94Å
143	Q	34.3	Very low	40.2	Very low	190 Å²	190	123.7 Å²	123.7	89%	0.888	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-69.9	131.7	-175.2	-69.2	178.1	-74.7	0	0	111.6	L145	Q143-L145 PolarHBondContact O-N 3.16Å
144	K	35.1	Very low	41.9	Very low	169 Å²	169	120.4 Å²	120.4	74%	0.735	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-58.2	122.4	168.6	-85.2	-164.7	168.8	-164.4	0	110.1
145	L	39.2	Very low	43.8	Very low	110 Å²	110	117.1 Å²	117.1	58%	0.576	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-67.6	144.3	169.8	-67.9	169.6	0	0	0	110.4	Q143 Q149 I150	Q143-L145 PolarHBondContact O-N 3.16Å; L145-Q149 HydrophobicContact CB-CB 4.33Å; L145-Q149 HydrophobicContact CD2-CB 4.13Å; L145-I150 HydrophobicContact CB-CG1 4.16Å
146	S	46.3	Very low	46	Very low	54 Å²	54	119.6 Å²	119.6	38%	0.378	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-76.8	157.2	172.4	66.1	0	0	0	0	111.7	N148 Q149 I150	S146-N148 PolarHBondContact O-N 3.49Å; S146-N148 VanDerWaalsContact O-N 3.13Å; S146-Q149 PolarHBondContact O-N 2.75Å; S146-Q149 PolarHBondContact OG-OE1 3.22Å; S146-I150 PolarHBondContact O-N 3Å
147	F	49.7	Very low	47.7	Very low	110 Å²	110	118.9 Å²	118.9	48%	0.482	58%	0.58	S	S	.	*	H	α-helix	trans	-49.2	-38.9	174.3	176.5	-98.8	0	0	0	113	Q149 I150 K151 Y171	F147-Q149 PolarHBondContact O-N 2.75Å; F147-I150 PolarHBondContact O-N 2.76Å; F147-K151 WeakPolarHBondContact O-CB 3.25Å; F147-K151 PolarHBondContact O-N 3.25Å; F147-Y171 HydrophobicContact CE1-CE2 4.33Å; F147-Y171 HydrophobicContact CE2-CD2 4.4Å; F147-Y171 HydrophobicContact CE2-CE2 4.46Å; F147-Y171 AromaticContact CZ-CD2 3.97Å; F147-Y171 HydrophobicContact CZ-CD2 3.97Å; F147-Y171 AromaticContact CZ-CE2 3.84Å; F147-Y171 HydrophobicContact CZ-CE2 3.84Å; F147-Y171 HydrophobicContact CZ-CG 4.49Å
148	N	62.7	Low	49.1	Very low	106 Å²	106	118.5 Å²	118.5	57%	0.567	58%	0.583	S	S	*	*	H	α-helix	trans	-66.1	-36.9	178.2	-66.9	-16.5	0	0	0	112.7	S146 K151 E152	S146-N148 PolarHBondContact O-N 3.49Å; S146-N148 VanDerWaalsContact O-N 3.13Å; N148-K151 PolarHBondContact O-N 2.83Å; N148-E152 WeakPolarHBondContact O-CG 3.11Å; N148-E152 PolarHBondContact O-N 2.9Å
149	Q	63.2	Low	50.1	Low	93 Å²	93	113.9 Å²	113.9	44%	0.435	56%	0.56	S	S	.	*	H	α-helix	trans	-72.8	-37.6	177.2	-68.5	162.1	-67.2	0	0	111.6	L145 S146 F147 K151 E152 D153	L145-Q149 HydrophobicContact CB-CB 4.33Å; L145-Q149 HydrophobicContact CD2-CB 4.13Å; S146-Q149 PolarHBondContact O-N 2.75Å; S146-Q149 PolarHBondContact OG-OE1 3.22Å; F147-Q149 PolarHBondContact O-N 2.75Å; Q149-K151 VanDerWaalsContact C-N 3.33Å; Q149-E152 PolarHBondContact O-N 3.12Å; Q149-D153 WeakPolarHBondContact O-CB 3.37Å; Q149-D153 PolarHBondContact O-N 3.32Å
150	I	56.1	Low	51.2	Low	82 Å²	82	110.4 Å²	110.4	42%	0.421	54%	0.538	S	S	.	.	H	α-helix	trans	-62.9	-42.5	172.5	-62.6	168.5	0	0	0	109.9	L145 S146 F147 D153 L154	L145-I150 HydrophobicContact CB-CG1 4.16Å; S146-I150 PolarHBondContact O-N 3Å; F147-I150 PolarHBondContact O-N 2.76Å; I150-D153 PolarHBondContact O-N 3.09Å; I150-L154 HydrophobicContact CG2-CD1 3.95Å; I150-L154 WeakPolarHBondContact O-CB 3.41Å; I150-L154 WeakPolarHBondContact O-CG 3.14Å; I150-L154 PolarHBondContact O-N 2.92Å
151	K	60.4	Low	52.3	Low	69 Å²	69	104.1 Å²	104.1	30%	0.3	52%	0.521	S	S	.	.	H	α-helix	trans	-60.7	-51.7	174.3	-170.5	-167.2	176.9	-105.3	0	111.9	F147 N148 Q149 D153 L154 E155 L163	F147-K151 WeakPolarHBondContact O-CB 3.25Å; F147-K151 PolarHBondContact O-N 3.25Å; N148-K151 PolarHBondContact O-N 2.83Å; Q149-K151 VanDerWaalsContact C-N 3.33Å; K151-D153 VanDerWaalsContact C-N 3.26Å; K151-D153 PolarHBondContact O-N 3.18Å; K151-L154 PolarHBondContact O-N 3.01Å; K151-E155 WeakPolarHBondContact CE-OE1 3.44Å; K151-E155 HydrophobicContact CG-CG 4.38Å; K151-E155 IonicContact NZ-OE1 2.71Å; K151-E155 PolarHBondContact NZ-OE1 3.34Å; K151-E155 IonicContact NZ-OE2 2.93Å; K151-E155 PolarHBondContact NZ-OE2 3.02Å; K151-E155 WeakPolarHBondContact O-CB 3.16Å; K151-E155 WeakPolarHBondContact O-CG 3.46Å; K151-E155 PolarHBondContact O-N 2.87Å; K151-L163 HydrophobicContact CD-CD1 4.47Å; K151-L163 HydrophobicContact CG-CD1 4Å
152	E	66.5	Low	53.3	Low	110 Å²	110	98.7 Å²	98.7	51%	0.514	50%	0.495	S	S	.	.	H	α-helix	trans	-60.2	-34.6	179.2	-79.4	-175.1	-172.8	0	0	113	N148 Q149 K156	N148-E152 WeakPolarHBondContact O-CG 3.11Å; N148-E152 PolarHBondContact O-N 2.9Å; Q149-E152 PolarHBondContact O-N 3.12Å; E152-K156 VanDerWaalsContact O-CB 3.3Å; E152-K156 WeakPolarHBondContact O-CB 3.35Å; E152-K156 VanDerWaalsContact O-CG 3.25Å; E152-K156 WeakPolarHBondContact O-CG 3.46Å; E152-K156 PolarHBondContact O-N 3.16Å
153	D	64.6	Low	54.4	Low	69 Å²	69	93.1 Å²	93.1	37%	0.369	47%	0.471	S	S	.	.	H	α-helix	trans	-72.3	-43.3	177	-175.4	56.4	0	0	0	112	Q149 I150 K151 K156 K157	Q149-D153 WeakPolarHBondContact O-CB 3.37Å; Q149-D153 PolarHBondContact O-N 3.32Å; I150-D153 PolarHBondContact O-N 3.09Å; K151-D153 VanDerWaalsContact C-N 3.26Å; K151-D153 PolarHBondContact O-N 3.18Å; D153-K156 PolarHBondContact O-N 3.25Å; D153-K157 VanDerWaalsContact CG-NZ 3.3Å; D153-K157 WeakPolarHBondContact O-CB 3.44Å; D153-K157 VanDerWaalsContact O-CG 3.25Å; D153-K157 WeakPolarHBondContact O-CG 3.33Å; D153-K157 PolarHBondContact O-N 2.95Å; D153-K157 WeakPolarHBondContact OD1-CE 3.42Å; D153-K157 IonicContact OD1-NZ 2.66Å; D153-K157 PolarHBondContact OD1-NZ 2.86Å; D153-K157 WeakPolarHBondContact OD2-CE 3.41Å; D153-K157 IonicContact OD2-NZ 2.98Å; D153-K157 PolarHBondContact OD2-NZ 2.83Å
154	L	58.5	Low	55.1	Low	49 Å²	49	89.2 Å²	89.2	26%	0.257	45%	0.453	S	S	.	.	H	α-helix	trans	-66.7	-36.5	174.7	-70.3	171.4	0	0	0	112.7	I150 K151 K157 N158 V159 I160	I150-L154 HydrophobicContact CG2-CD1 3.95Å; I150-L154 WeakPolarHBondContact O-CB 3.41Å; I150-L154 WeakPolarHBondContact O-CG 3.14Å; I150-L154 PolarHBondContact O-N 2.92Å; K151-L154 PolarHBondContact O-N 3.01Å; L154-K157 PolarHBondContact O-N 2.77Å; L154-N158 PolarHBondContact O-N 3.29Å; L154-V159 HydrophobicContact CD2-CB 4.28Å; L154-V159 HydrophobicContact CD2-CG1 4.49Å; L154-V159 HydrophobicContact CD2-CG2 4.49Å; L154-V159 PolarHBondContact O-N 2.75Å; L154-I160 HydrophobicContact CB-CD1 3.6Å; L154-I160 HydrophobicContact CB-CG1 3.95Å
155	E	64.8	Low	55.6	Low	93 Å²	93	85.9 Å²	85.9	44%	0.435	45%	0.448	S	S	.	.	H	α-helix	trans	-67.1	-42.8	172.4	-73.7	-178.7	147	0	0	111.1	K151 K157 N158 I160	K151-E155 WeakPolarHBondContact CE-OE1 3.44Å; K151-E155 HydrophobicContact CG-CG 4.38Å; K151-E155 IonicContact NZ-OE1 2.71Å; K151-E155 PolarHBondContact NZ-OE1 3.34Å; K151-E155 IonicContact NZ-OE2 2.93Å; K151-E155 PolarHBondContact NZ-OE2 3.02Å; K151-E155 WeakPolarHBondContact O-CB 3.16Å; K151-E155 WeakPolarHBondContact O-CG 3.46Å; K151-E155 PolarHBondContact O-N 2.87Å; E155-K157 VanDerWaalsContact C-N 3.29Å; E155-K157 PolarHBondContact O-N 2.66Å; E155-N158 PolarHBondContact O-N 2.74Å; E155-I160 HydrophobicContact CG-CD1 3.76Å; E155-I160 HydrophobicContact CG-CG1 4.5Å
156	K	70.7	Confident	55.9	Low	160 Å²	160	85.6 Å²	85.6	70%	0.696	45%	0.447	S	S	*	.	H	α-helix	trans	-62.9	-31.5	173.6	-83.7	169.7	-179.8	157.2	0	113.8	E152 D153	E152-K156 VanDerWaalsContact O-CB 3.3Å; E152-K156 WeakPolarHBondContact O-CB 3.35Å; E152-K156 VanDerWaalsContact O-CG 3.25Å; E152-K156 WeakPolarHBondContact O-CG 3.46Å; E152-K156 PolarHBondContact O-N 3.16Å; D153-K156 PolarHBondContact O-N 3.25Å
157	K	63.6	Low	55.4	Low	126 Å²	126	91.3 Å²	91.3	55%	0.548	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	2.4	-177.8	-72	169.3	175.8	170.5	0	114	D153 L154 E155 V159	D153-K157 VanDerWaalsContact CG-NZ 3.3Å; D153-K157 WeakPolarHBondContact O-CB 3.44Å; D153-K157 VanDerWaalsContact O-CG 3.25Å; D153-K157 WeakPolarHBondContact O-CG 3.33Å; D153-K157 PolarHBondContact O-N 2.95Å; D153-K157 WeakPolarHBondContact OD1-CE 3.42Å; D153-K157 IonicContact OD1-NZ 2.66Å; D153-K157 PolarHBondContact OD1-NZ 2.86Å; D153-K157 WeakPolarHBondContact OD2-CE 3.41Å; D153-K157 IonicContact OD2-NZ 2.98Å; D153-K157 PolarHBondContact OD2-NZ 2.83Å; L154-K157 PolarHBondContact O-N 2.77Å; E155-K157 VanDerWaalsContact C-N 3.29Å; E155-K157 PolarHBondContact O-N 2.66Å; K157-V159 HydrophobicContact CB-CG2 3.65Å; K157-V159 PolarHBondContact O-N 3.25Å
158	N	54.5	Low	54.6	Low	135 Å²	135	92 Å²	92	72%	0.722	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	30.1	-177.2	-82	-20.3	0	0	0	114.3	L154 E155	L154-N158 PolarHBondContact O-N 3.29Å; E155-N158 PolarHBondContact O-N 2.74Å
159	V	47.7	Very low	53.7	Low	62 Å²	62	94 Å²	94	38%	0.376	48%	0.481	S	S	.	.			trans	-86.3	-16.9	-175.8	-171.1	0	0	0	0	112.5	L154 K157	L154-V159 HydrophobicContact CD2-CB 4.28Å; L154-V159 HydrophobicContact CD2-CG1 4.49Å; L154-V159 HydrophobicContact CD2-CG2 4.49Å; L154-V159 PolarHBondContact O-N 2.75Å; K157-V159 HydrophobicContact CB-CG2 3.65Å; K157-V159 PolarHBondContact O-N 3.25Å
160	I	50.5	Low	52.4	Low	25 Å²	25	93.6 Å²	93.6	13%	0.128	48%	0.48	C	S	.	.			trans	-121.1	122.5	-172.9	17.4	175.3	0	0	0	112	L154 E155 L163 M173	L154-I160 HydrophobicContact CB-CD1 3.6Å; L154-I160 HydrophobicContact CB-CG1 3.95Å; E155-I160 HydrophobicContact CG-CD1 3.76Å; E155-I160 HydrophobicContact CG-CG1 4.5Å; I160-L163 HydrophobicContact CD1-CD1 3.77Å; I160-L163 HydrophobicContact CD1-CG 4.44Å; I160-M173 HydrophobicContact CG2-CG 3.29Å; I160-M173 HydrophobicContact CG2-SD 3.84Å
161	G	51.1	Low	51.8	Low	46 Å²	46	95.4 Å²	95.4	47%	0.474	48%	0.482	S	S	.	.	S	Bend	trans	-79.3	-30.6	172.3	0	0	0	0	0	113.3	H174	G161-H174 PolarHBondContact N-O 3.04Å
162	S	50.6	Low	51.2	Low	46 Å²	46	94.7 Å²	94.7	32%	0.322	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.8	159.4	163.1	58.6	0	0	0	0	112.6	H174	S162-H174 PolarHBondContact O-N 2.93Å; S162-H174 PolarHBondContact OG-CD2 2.77Å; S162-H174 VanDerWaalsContact OG-CD2 3.3Å
163	L	52	Low	50	Low	52 Å²	52	92.9 Å²	92.9	27%	0.272	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	120.3	167.8	-87.3	160.4	0	0	0	108.6	K151 I160 I172 M173	K151-L163 HydrophobicContact CD-CD1 4.47Å; K151-L163 HydrophobicContact CG-CD1 4Å; I160-L163 HydrophobicContact CD1-CD1 3.77Å; I160-L163 HydrophobicContact CD1-CG 4.44Å; L163-I172 WeakPolarHBondContact CA-O 3.23Å; L163-M173 HydrophobicContact CD2-CB 4.27Å; L163-M173 HydrophobicContact CD2-CG 4.16Å
164	Q	49.8	Very low	49.3	Very low	108 Å²	108	93 Å²	93	51%	0.505	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	132.3	177.5	-69.4	-162.8	-2.7	0	0	111.8	Y171 I172	Q164-Y171 CarbonylContact O-C 3.56Å; Q164-Y171 VanDerWaalsContact O-CA 3.32Å; Q164-Y171 WeakPolarHBondContact O-CA 3.17Å; Q164-I172 PolarHBondContact N-O 3.14Å; Q164-I172 PolarHBondContact O-N 2.81Å
165	P	44.3	Very low	48.7	Very low	99 Å²	99	98.1 Å²	98.1	64%	0.643	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	126.4	174.6	30.3	-32.8	0	0	0	111.2	Y171	P165-Y171 HydrophobicContact CB-CD1 4.09Å; P165-Y171 HydrophobicContact CB-CE1 4Å
166	L	45.3	Very low	47.6	Very low	104 Å²	104	99.4 Å²	99.4	55%	0.545	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-42.8	173.4	-109	169.1	0	0	0	111.6	Q170 I172	L166-Q170 HydrophobicContact CB-CB 3.85Å; L166-Q170 PolarHBondContact N-O 2.89Å; L166-I172 HydrophobicContact CD1-CD1 3.85Å; L166-I172 HydrophobicContact CD1-CG1 3.5Å; L166-I172 HydrophobicContact CD2-CD1 4.42Å; L166-I172 HydrophobicContact CG-CD1 3.81Å; L166-I172 HydrophobicContact CG-CG1 3.75Å
167	R	36	Very low	45.9	Very low	173 Å²	173	96.8 Å²	96.8	65%	0.653	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-156.3	171.9	-177.6	-58.2	-170.2	-163	-164.2	2.7	107.8	E169 Q170	R167-E169 PolarHBondContact O-N 3.36Å; R167-Q170 HydrophobicContact CB-CB 4.15Å; R167-Q170 HydrophobicContact CB-CG 4.33Å; R167-Q170 PolarHBondContact N-O 2.82Å; R167-Q170 PolarHBondContact O-N 3.07Å; R167-Q170 VanDerWaalsContact O-N 3.14Å
168	P	34.6	Very low	44.5	Very low	124 Å²	124	94 Å²	94	81%	0.805	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.9	131.7	156.8	-25.6	35.8	0	0	0	109.9	Q170	P168-Q170 VanDerWaalsContact C-N 3.25Å; P168-Q170 PolarHBondContact O-N 2.84Å
169	E	42.5	Very low	43.4	Very low	148 Å²	148	96.1 Å²	96.1	69%	0.692	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	17	-179.8	-53.8	-179.9	-168.2	0	0	116.1	R167	R167-E169 PolarHBondContact O-N 3.36Å
170	Q	36.6	Very low	42.6	Very low	86 Å²	86	100 Å²	100	40%	0.402	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	130.9	172.8	-62.5	-169.6	-37.8	0	0	112.3	L166 R167 P168	L166-Q170 HydrophobicContact CB-CB 3.85Å; L166-Q170 PolarHBondContact N-O 2.89Å; R167-Q170 HydrophobicContact CB-CB 4.15Å; R167-Q170 HydrophobicContact CB-CG 4.33Å; R167-Q170 PolarHBondContact N-O 2.82Å; R167-Q170 PolarHBondContact O-N 3.07Å; R167-Q170 VanDerWaalsContact O-N 3.14Å; P168-Q170 VanDerWaalsContact C-N 3.25Å; P168-Q170 PolarHBondContact O-N 2.84Å
171	Y	43.6	Very low	41.6	Very low	120 Å²	120	108.7 Å²	108.7	47%	0.471	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.7	140.1	-179.4	-59.4	-85.4	0	0	0	111.5	F147 Q164 P165	F147-Y171 HydrophobicContact CE1-CE2 4.33Å; F147-Y171 HydrophobicContact CE2-CD2 4.4Å; F147-Y171 HydrophobicContact CE2-CE2 4.46Å; F147-Y171 AromaticContact CZ-CD2 3.97Å; F147-Y171 HydrophobicContact CZ-CD2 3.97Å; F147-Y171 AromaticContact CZ-CE2 3.84Å; F147-Y171 HydrophobicContact CZ-CE2 3.84Å; F147-Y171 HydrophobicContact CZ-CG 4.49Å; Q164-Y171 CarbonylContact O-C 3.56Å; Q164-Y171 VanDerWaalsContact O-CA 3.32Å; Q164-Y171 WeakPolarHBondContact O-CA 3.17Å; P165-Y171 HydrophobicContact CB-CD1 4.09Å; P165-Y171 HydrophobicContact CB-CE1 4Å
172	I	47.6	Very low	40.8	Very low	53 Å²	53	111.8 Å²	111.8	27%	0.272	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.5	135.4	166.6	-57.3	176	0	0	0	108.2	L163 Q164 L166	L163-I172 WeakPolarHBondContact CA-O 3.23Å; Q164-I172 PolarHBondContact N-O 3.14Å; Q164-I172 PolarHBondContact O-N 2.81Å; L166-I172 HydrophobicContact CD1-CD1 3.85Å; L166-I172 HydrophobicContact CD1-CG1 3.5Å; L166-I172 HydrophobicContact CD2-CD1 4.42Å; L166-I172 HydrophobicContact CG-CD1 3.81Å; L166-I172 HydrophobicContact CG-CG1 3.75Å
173	M	41.9	Very low	39.9	Very low	73 Å²	73	118.1 Å²	118.1	36%	0.36	61%	0.607	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.8	123.6	174.6	-160.1	-173.6	-50.3	0	0	109.3	I160 L163 L188	I160-M173 HydrophobicContact CG2-CG 3.29Å; I160-M173 HydrophobicContact CG2-SD 3.84Å; L163-M173 HydrophobicContact CD2-CB 4.27Å; L163-M173 HydrophobicContact CD2-CG 4.16Å; M173-L188 HydrophobicContact CE-CD1 4.04Å
174	H	49.9	Very low	39.1	Very low	72 Å²	72	123.2 Å²	123.2	33%	0.333	63%	0.629	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.4	113.9	177.2	-71.3	-77.8	0	0	0	111	G161 S162	G161-H174 PolarHBondContact N-O 3.04Å; S162-H174 PolarHBondContact O-N 2.93Å; S162-H174 PolarHBondContact OG-CD2 2.77Å; S162-H174 VanDerWaalsContact OG-CD2 3.3Å
175	H	46.2	Very low	38.4	Very low	155 Å²	155	123.3 Å²	123.3	72%	0.718	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-70.6	146.1	171.4	-168.2	-83.1	0	0	0	111.3
176	Q	40.2	Very low	38.3	Very low	120 Å²	120	122.6 Å²	122.6	56%	0.561	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-84	126	-179.3	-158.8	161.9	-9.1	0	0	110.4
177	A	35.5	Very low	38.2	Very low	105 Å²	105	120.8 Å²	120.8	87%	0.868	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-75.3	132.6	-167.3	0	0	0	0	0	113.2
178	G	33.3	Very low	38.3	Very low	69 Å²	69	116.3 Å²	116.3	71%	0.711	60%	0.603	S	S	*	*	S	Bend	trans	-145.7	-47.5	-179.5	0	0	0	0	0	115.5
179	L	32.9	Very low	39	Very low	178 Å²	178	112.3 Å²	112.3	93%	0.932	57%	0.574	S	S	*	*	S	Bend	trans	-140	-10.1	-173.9	-91.8	105.6	0	0	0	117.4
180	I	29.5	Very low	38.8	Very low	143 Å²	143	109.4 Å²	109.4	73%	0.733	57%	0.569	S	S	*	*			trans	-118.5	133.8	-168	-56.7	178.3	0	0	0	111.5	Q182	I180-Q182 HydrophobicContact CG2-CB 4.39Å; I180-Q182 PolarHBondContact O-N 3.09Å
181	K	29.4	Very low	38.9	Very low	208 Å²	208	113 Å²	113	90%	0.904	59%	0.586	S	S	*	*			trans	-92	58.2	175.9	-77.2	-172.2	174.6	179.8	0	112.4
182	Q	34.6	Very low	39.4	Very low	112 Å²	112	110.4 Å²	110.4	52%	0.523	58%	0.582	S	S	.	*			trans	-151	146.3	169.8	-104.5	133.5	-18.8	0	0	110.4	I180	I180-Q182 HydrophobicContact CG2-CB 4.39Å; I180-Q182 PolarHBondContact O-N 3.09Å
183	Q	32.9	Very low	39.1	Very low	179 Å²	179	110.3 Å²	110.3	84%	0.836	59%	0.594	S	S	*	*			trans	-105.5	105.8	166.5	-78.8	-175.7	-41.6	0	0	107.7
184	E	34.4	Very low	39.5	Very low	158 Å²	158	111.1 Å²	111.1	74%	0.738	60%	0.6	S	S	*	*			trans	-89.9	132.8	175.9	-64	178.8	146.2	0	0	110
185	M	36.3	Very low	39.6	Very low	110 Å²	110	110.9 Å²	110.9	54%	0.542	60%	0.603	S	S	.	*			trans	-102.2	103.7	170.5	-75.6	-163.5	-58.1	0	0	110	Y200	M185-Y200 HydrophobicContact CE-CD1 4.44Å; M185-Y200 HydrophobicContact CE-CD2 4.08Å; M185-Y200 HydrophobicContact CE-CG 3.95Å
186	L	40.4	Very low	39.8	Very low	85 Å²	85	108.3 Å²	108.3	45%	0.445	59%	0.594	S	S	.	*			trans	-83.5	118.2	169.1	-77.6	161.1	0	0	0	110.3	V195	L186-V195 HydrophobicContact CD2-CG1 3.97Å; L186-V195 HydrophobicContact CD2-CG2 4.01Å
187	V	44.1	Very low	40	Very low	65 Å²	65	105.1 Å²	105.1	39%	0.394	59%	0.585	S	S	.	*			trans	-97.4	119.7	170.8	-173.9	0	0	0	0	108.1	L196	V187-L196 HydrophobicContact CB-CB 4.42Å; V187-L196 HydrophobicContact CG1-CB 4.1Å; V187-L196 HydrophobicContact CG1-CD1 4.27Å; V187-L196 PolarHBondContact O-N 3.02Å
188	L	38.7	Very low	40	Very low	80 Å²	80	106.3 Å²	106.3	42%	0.419	58%	0.577	S	S	.	*	B	Isolated β-bridge	trans	-109.8	146.8	-174.7	-60.9	177.8	0	0	0	112.6	M173 P190 D194 V195	M173-L188 HydrophobicContact CE-CD1 4.04Å; L188-P190 WeakPolarHBondContact O-CD 3.19Å; L188-D194 CarbonylContact C-O 3.57Å; L188-D194 WeakPolarHBondContact CA-O 3.26Å; L188-V195 HydrophobicContact CD2-CG2 3.92Å
189	N	48	Very low	40	Very low	39 Å²	39	111.2 Å²	111.2	21%	0.209	58%	0.581	C	S	.	*			trans	-77.8	116.7	173.8	-176.6	-25.5	0	0	0	110.2	Q191 T192 G193 D194 L196	N189-Q191 PolarHBondContact O-N 2.85Å; N189-Q191 VanDerWaalsContact O-N 3.12Å; N189-Q191 PolarHBondContact OD1-N 2.95Å; N189-T192 VanDerWaalsContact CB-OG1 3.27Å; N189-T192 WeakPolarHBondContact CB-OG1 3.39Å; N189-T192 PolarHBondContact ND2-OG1 2.87Å; N189-T192 PolarHBondContact O-N 2.98Å; N189-G193 PolarHBondContact O-N 2.82Å; N189-D194 HydrophobicContact CB-CB 4.18Å; N189-D194 WeakPolarHBondContact CB-O 3.4Å; N189-D194 PolarHBondContact N-O 2.83Å; N189-L196 HydrophobicContact CB-CD1 4.19Å; N189-L196 HydrophobicContact CB-CD2 3.85Å; N189-L196 HydrophobicContact CB-CG 3.88Å
190	P	38.1	Very low	39.9	Very low	88 Å²	88	111.6 Å²	111.6	57%	0.571	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-10.3	-173.7	28.1	-35.3	0	0	0	114.7	L188	L188-P190 WeakPolarHBondContact O-CD 3.19Å
191	Q	40.2	Very low	39.9	Very low	162 Å²	162	108.8 Å²	108.8	76%	0.757	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	-20.7	-179.6	-60.4	-171.7	7.9	0	0	114.2	N189	N189-Q191 PolarHBondContact O-N 2.85Å; N189-Q191 VanDerWaalsContact O-N 3.12Å; N189-Q191 PolarHBondContact OD1-N 2.95Å
192	T	52.9	Low	39.7	Very low	65 Å²	65	104.1 Å²	104.1	40%	0.399	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-123	-30.7	-174.5	56.5	0	0	0	0	113.7	N189 D194	N189-T192 VanDerWaalsContact CB-OG1 3.27Å; N189-T192 WeakPolarHBondContact CB-OG1 3.39Å; N189-T192 PolarHBondContact ND2-OG1 2.87Å; N189-T192 PolarHBondContact O-N 2.98Å; T192-D194 WeakPolarHBondContact CB-OD2 3.45Å; T192-D194 PolarHBondContact OG1-N 2.89Å; T192-D194 PolarHBondContact OG1-OD2 3.01Å
193	G	42.3	Very low	39.4	Very low	51 Å²	51	106 Å²	106	53%	0.526	57%	0.567	S	S	.	*			trans	91.2	-4.1	-169.2	0	0	0	0	0	114.2	N189	N189-G193 PolarHBondContact O-N 2.82Å
194	D	49.9	Very low	39.2	Very low	90 Å²	90	106.1 Å²	106.1	48%	0.481	57%	0.567	S	S	.	*			trans	-63.5	147.8	-178.6	-47.5	-37.6	0	0	0	111.8	L188 N189 T192 L196	L188-D194 CarbonylContact C-O 3.57Å; L188-D194 WeakPolarHBondContact CA-O 3.26Å; N189-D194 HydrophobicContact CB-CB 4.18Å; N189-D194 WeakPolarHBondContact CB-O 3.4Å; N189-D194 PolarHBondContact N-O 2.83Å; T192-D194 WeakPolarHBondContact CB-OD2 3.45Å; T192-D194 PolarHBondContact OG1-N 2.89Å; T192-D194 PolarHBondContact OG1-OD2 3.01Å; D194-L196 PolarHBondContact O-N 3.06Å
195	V	50.8	Low	38.8	Very low	66 Å²	66	106.6 Å²	106.6	40%	0.4	57%	0.569	S	S	.	*	B	Isolated β-bridge	trans	-74.1	125.2	168.9	-175.6	0	0	0	0	109.2	L186 L188 D198	L186-V195 HydrophobicContact CD2-CG1 3.97Å; L186-V195 HydrophobicContact CD2-CG2 4.01Å; L188-V195 HydrophobicContact CD2-CG2 3.92Å; V195-D198 WeakPolarHBondContact CG1-OD1 3.29Å
196	L	52.2	Low	38.4	Very low	102 Å²	102	106.5 Å²	106.5	53%	0.534	58%	0.575	S	S	.	*	S	Bend	trans	-86.4	-19.9	-177.3	-72.4	176.9	0	0	0	113.7	V187 N189 D194	V187-L196 HydrophobicContact CB-CB 4.42Å; V187-L196 HydrophobicContact CG1-CB 4.1Å; V187-L196 HydrophobicContact CG1-CD1 4.27Å; V187-L196 PolarHBondContact O-N 3.02Å; N189-L196 HydrophobicContact CB-CD1 4.19Å; N189-L196 HydrophobicContact CB-CD2 3.85Å; N189-L196 HydrophobicContact CB-CG 3.88Å; D194-L196 PolarHBondContact O-N 3.06Å
197	S	42.8	Very low	37.8	Very low	52 Å²	52	109.9 Å²	109.9	36%	0.364	59%	0.594	S	S	.	*			trans	-169.7	119.2	172.6	58.3	0	0	0	0	113.5	Q199	S197-Q199 VanDerWaalsContact C-N 3.31Å; S197-Q199 PolarHBondContact O-N 2.83Å
198	D	35.5	Very low	36.9	Very low	131 Å²	131	111.3 Å²	111.3	70%	0.701	60%	0.603	S	S	*	*			trans	-90.7	51.4	167.1	-70	-44.9	0	0	0	111.9	V195	V195-D198 WeakPolarHBondContact CG1-OD1 3.29Å
199	Q	34	Very low	36.3	Very low	171 Å²	171	114.6 Å²	114.6	80%	0.799	62%	0.619	S	S	*	*			trans	-136.1	62.3	-178.8	-70.7	-160.9	-6.6	0	0	114	S197	S197-Q199 VanDerWaalsContact C-N 3.31Å; S197-Q199 PolarHBondContact O-N 2.83Å
200	Y	30.8	Very low	35.3	Very low	186 Å²	186	117.8 Å²	117.8	73%	0.729	64%	0.64	S	S	*	*			trans	-138.8	59.7	155.5	-90.1	-76.1	0	0	0	110.9	M185	M185-Y200 HydrophobicContact CE-CD1 4.44Å; M185-Y200 HydrophobicContact CE-CD2 4.08Å; M185-Y200 HydrophobicContact CE-CG 3.95Å
201	S	28.9	Very low	34.8	Very low	84 Å²	84	117.3 Å²	117.3	59%	0.587	64%	0.636	S	S	*	*			trans	-112	132.3	167.1	-173.8	0	0	0	0	110.1	H203	S201-H203 VanDerWaalsContact C-N 3.32Å; S201-H203 PolarHBondContact O-N 2.92Å
202	S	27.1	Very low	34.2	Very low	110 Å²	110	112.6 Å²	112.6	77%	0.769	63%	0.631	S	S	*	*			trans	-84.2	69.6	-174.6	62	0	0	0	0	112.4
203	H	27.9	Very low	33	Very low	153 Å²	153	113.1 Å²	113.1	71%	0.708	65%	0.648	S	S	*	*			trans	-131.1	112.1	161.1	-92.8	-77.5	0	0	0	109.6	S201 Q205	S201-H203 VanDerWaalsContact C-N 3.32Å; S201-H203 PolarHBondContact O-N 2.92Å; H203-Q205 PolarHBondContact O-N 3.18Å
204	H	29	Very low	32.3	Very low	180 Å²	180	116.7 Å²	116.7	83%	0.833	66%	0.661	S	S	*	*			trans	-71.4	82.1	161.5	-96.3	-105.8	0	0	0	108.5
205	Q	24.7	Very low	31.4	Very low	168 Å²	168	121.4 Å²	121.4	79%	0.785	68%	0.679	S	S	*	*			trans	-95.2	90.4	161.9	-166.6	166	22.9	0	0	107.4	H203 N207	H203-Q205 PolarHBondContact O-N 3.18Å; Q205-N207 PolarHBondContact O-N 3.05Å
206	T	28.9	Very low	30.3	Very low	108 Å²	108	125.8 Å²	125.8	66%	0.663	70%	0.695	S	S	*	*			trans	-61.2	120.6	175.7	-40.2	0	0	0	0	108.5	T208	T206-T208 PolarHBondContact O-N 2.91Å
207	N	26.4	Very low	29.2	Very low	157 Å²	157	131.2 Å²	131.2	84%	0.84	72%	0.715	S	S	*	*			trans	-73.2	70.8	169.2	-86.8	-6.6	0	0	0	110	Q205	Q205-N207 PolarHBondContact O-N 3.05Å
208	T	27	Very low	28.4	Very low	95 Å²	95	132 Å²	132	58%	0.583	73%	0.725	S	S	*	*			trans	-55.2	132.8	150	-54.5	0	0	0	0	107.4	T206 T210	T206-T208 PolarHBondContact O-N 2.91Å; T208-T210 WeakPolarHBondContact CG2-OG1 3.24Å; T208-T210 PolarHBondContact O-N 2.81Å
209	I	25.5	Very low	28	Very low	149 Å²	149	136.8 Å²	136.8	76%	0.764	73%	0.733	S	S	*	*			trans	-74.5	80.5	165.3	-60.4	178.5	0	0	0	106.4	T211	I209-T211 VanDerWaalsContact C-N 3.31Å; I209-T211 PolarHBondContact O-N 2.88Å
210	T	26.9	Very low	27.7	Very low	106 Å²	106	134.2 Å²	134.2	65%	0.65	72%	0.724	S	S	*	*			trans	-79.3	84.5	175.9	-54.9	0	0	0	0	108	T208 G212	T208-T210 WeakPolarHBondContact CG2-OG1 3.24Å; T208-T210 PolarHBondContact O-N 2.81Å; T210-G212 PolarHBondContact O-N 2.78Å
211	T	27.8	Very low	27.7	Very low	78 Å²	78	133.7 Å²	133.7	48%	0.479	73%	0.732	S	S	.	*			trans	-54.1	109.2	164.7	40.8	0	0	0	0	108.8	I209 G213 M796	I209-T211 VanDerWaalsContact C-N 3.31Å; I209-T211 PolarHBondContact O-N 2.88Å; T211-G213 PolarHBondContact O-N 2.78Å; T211-M796 HydrophobicContact CG2-CE 3.91Å; T211-M796 HydrophobicContact CG2-CG 4.25Å
212	G	26.9	Very low	27.7	Very low	63 Å²	63	134.5 Å²	134.5	65%	0.649	73%	0.734	S	S	*	*			trans	-66	129.6	-166.7	0	0	0	0	0	113.6	T210	T210-G212 PolarHBondContact O-N 2.78Å
213	G	27.7	Very low	27.9	Very low	75 Å²	75	134 Å²	134	77%	0.773	73%	0.731	S	S	*	*			trans	-148.8	48.8	-178.3	0	0	0	0	0	112.7	T211 H215	T211-G213 PolarHBondContact O-N 2.78Å; G213-H215 PolarHBondContact O-N 2.94Å
214	T	29	Very low	28.1	Very low	127 Å²	127	132.3 Å²	132.3	78%	0.779	73%	0.731	S	S	*	*			trans	-63.4	125	178.8	9.1	0	0	0	0	112.2
215	H	29.4	Very low	28.3	Very low	188 Å²	188	130.8 Å²	130.8	87%	0.87	73%	0.729	S	S	*	*			trans	-158.6	149.6	131.6	-110.9	-77.6	0	0	0	111.6	G213	G213-H215 PolarHBondContact O-N 2.94Å
216	H	28.4	Very low	28.7	Very low	159 Å²	159	127.7 Å²	127.7	74%	0.736	73%	0.726	S	S	*	*			trans	-84.5	148.5	-175.2	-72.6	-96.8	0	0	0	113.5
217	F	28.1	Very low	28.6	Very low	215 Å²	215	129 Å²	129	94%	0.943	73%	0.734	S	S	*	*				-132.2	155.6	129.8	-116.3	-88.4	0	0	0	109.9
218	A	28	Very low	28.9	Very low	70 Å²	70	127.8 Å²	127.8	58%	0.579	73%	0.732	S	S	*	*			trans	-154.5	161.7	-167.5	0	0	0	0	0	113.3
219	R	26.8	Very low	29.1	Very low	231 Å²	231	128.9 Å²	128.9	87%	0.872	74%	0.738	S	S	*	*			trans	70.5	153.2	172	-65.7	-173.6	175.3	130.9	-0.3	114.6
220	N	26.7	Very low	29.6	Very low	116 Å²	116	127.2 Å²	127.2	62%	0.62	74%	0.737	S	S	*	*			cis	-157	138.5	1.1	-123.3	9.7	0	0	0	109.7
221	I	31	Very low	29.8	Very low	175 Å²	175	127.5 Å²	127.5	90%	0.897	74%	0.743	S	S	*	*			trans	-138.2	142.5	141.3	-62.5	-172.2	0	0	0	107
222	T	29.2	Very low	30	Very low	102 Å²	102	127.9 Å²	127.9	63%	0.626	76%	0.763	S	S	*	*			trans	-129	170.1	-169.4	-50.1	0	0	0	0	110.1
223	S	31.7	Very low	30.2	Very low	100 Å²	100	128.8 Å²	128.8	70%	0.699	77%	0.772	S	S	*	*			trans	89.8	145.6	155.2	88.9	0	0	0	0	116.6
224	T	30.6	Very low	30.4	Very low	117 Å²	117	133.2 Å²	133.2	72%	0.718	78%	0.778	S	S	*	*			cis	-162.3	170	-14.6	8.8	0	0	0	0	110.6
225	N	34.7	Very low	30.7	Very low	147 Å²	147	133.9 Å²	133.9	79%	0.786	78%	0.782	S	S	*	*			trans	104	143.7	161.8	-59.3	-26.6	0	0	0	116.6
226	S	31.9	Very low	30.8	Very low	103 Å²	103	130.5 Å²	130.5	72%	0.72	78%	0.779	S	S	*	*			cis	-163	142.7	-29.4	47.4	0	0	0	0	108.4
227	V	27.1	Very low	31.1	Very low	136 Å²	136	126.1 Å²	126.1	82%	0.824	78%	0.777	S	S	*	*			trans	-127	130	177.7	177.9	0	0	0	0	109.6	V229	V227-V229 HydrophobicContact CG1-CG2 4.34Å
228	V	33.4	Very low	31.8	Very low	132 Å²	132	121.8 Å²	121.8	80%	0.8	77%	0.77	S	S	*	*			trans	-105.1	138.8	176.2	178.9	0	0	0	0	109.3
229	V	30.8	Very low	32.6	Very low	118 Å²	118	123.9 Å²	123.9	72%	0.715	78%	0.778	S	S	*	*			trans	-133.2	137.4	177.5	-178.4	0	0	0	0	108.6	V227	V227-V229 HydrophobicContact CG1-CG2 4.34Å
230	P	35.6	Very low	33	Very low	113 Å²	113	119.9 Å²	119.9	73%	0.734	78%	0.779	S	S	*	*			trans	-140.4	116.6	132.9	30.4	-13.4	0	0	0	114.5
231	S	31.2	Very low	33.5	Very low	112 Å²	112	117.8 Å²	117.8	78%	0.783	79%	0.785	S	S	*	*				48.9	101.8	123.9	-50.9	0	0	0	0	122.1
232	G	30.9	Very low	33.6	Very low	87 Å²	87	115.5 Å²	115.5	90%	0.897	79%	0.785	S	S	*	*				96.4	133.3	117	0	0	0	0	0	120.3
233	G	32.7	Very low	33.7	Very low	82 Å²	82	114.1 Å²	114.1	85%	0.845	79%	0.791	S	S	*	*			trans	152.1	85.1	164.6	0	0	0	0	0	116.3
234	N	30.8	Very low	33.7	Very low	167 Å²	167	115.8 Å²	115.8	89%	0.893	80%	0.797	S	S	*	*			trans	-91	135.7	169.3	-79.1	-19.1	0	0	0	111.6
235	V	35.3	Very low	33.7	Very low	142 Å²	142	117.1 Å²	117.1	86%	0.861	80%	0.804	S	S	*	*			trans	-149.5	151.9	145.7	179.5	0	0	0	0	109.9
236	S	32.8	Very low	33.5	Very low	117 Å²	117	115 Å²	115	82%	0.818	81%	0.807	S	S	*	*			trans	-66.8	171.3	175.6	48.7	0	0	0	0	114.8
237	G	33.9	Very low	33.4	Very low	66 Å²	66	113.7 Å²	113.7	68%	0.68	81%	0.81	S	S	*	*			cis	-176.3	-170.2	6.7	0	0	0	0	0	114
238	P	42	Very low	33.5	Very low	125 Å²	125	116.3 Å²	116.3	81%	0.812	81%	0.813	S	S	*	*			trans	-108.6	-162.9	-168	46.1	-38.8	0	0	0	112.4
239	P	44.4	Very low	33.5	Very low	114 Å²	114	119 Å²	119	74%	0.74	82%	0.818	S	S	*	*			cis	-137.8	-152.9	-2.4	40	-17.7	0	0	0	115.1
240	V	37	Very low	33.5	Very low	146 Å²	146	123.3 Å²	123.3	89%	0.885	83%	0.826	S	S	*	*			trans	107.4	128.2	159	-174.2	0	0	0	0	117.1
241	G	35.5	Very low	33.2	Very low	73 Å²	73	121.9 Å²	121.9	75%	0.753	83%	0.832	S	S	*	*			trans	148.6	64.6	165.5	0	0	0	0	0	118.8
242	S	33.2	Very low	33.2	Very low	127 Å²	127	120.9 Å²	120.9	89%	0.888	83%	0.825	S	S	*	*			trans	-38.8	144.6	173.8	52.2	0	0	0	0	119.1
243	G	32.2	Very low	33.4	Very low	73 Å²	73	122.2 Å²	122.2	75%	0.753	82%	0.816	S	S	*	*			trans	178.8	42.6	171.6	0	0	0	0	0	123.6
244	T	31.3	Very low	33.2	Very low	135 Å²	135	125.6 Å²	125.6	83%	0.828	81%	0.813	S	S	*	*			trans	51.9	106.2	146.2	-48.3	0	0	0	0	122.6
245	V	30.6	Very low	33.4	Very low	144 Å²	144	125.6 Å²	125.6	87%	0.873	80%	0.802	S	S	*	*			trans	61.2	106.3	141.8	-174.6	0	0	0	0	121.3
246	A	31.8	Very low	33.2	Very low	103 Å²	103	124.5 Å²	124.5	85%	0.851	80%	0.798	S	S	*	*			trans	-160.4	153.8	131.1	0	0	0	0	0	109.3
247	G	29.1	Very low	33	Very low	76 Å²	76	128.7 Å²	128.7	78%	0.784	80%	0.801	S	S	*	*			trans	-100	141.3	-170.6	0	0	0	0	0	115.6
248	Q	29.6	Very low	33.1	Very low	190 Å²	190	132.4 Å²	132.4	89%	0.888	81%	0.811	S	S	*	*			trans	-149.4	121.7	166.9	-78.8	-168.8	-15.7	0	0	112.3
249	Q	33.1	Very low	32.6	Very low	190 Å²	190	129.8 Å²	129.8	89%	0.888	81%	0.806	S	S	*	*			trans	-145	113.6	146.2	-69.9	-165.1	-4.3	0	0	105.9
250	K	31	Very low	32	Very low	207 Å²	207	133.5 Å²	133.5	90%	0.9	81%	0.814	S	S	*	*				84.4	92.9	68.4	-88.6	-161.3	169.3	-171.2	0	113.7
251	G	29.3	Very low	31.8	Very low	83 Å²	83	134 Å²	134	86%	0.856	81%	0.812	S	S	*	*			trans	-150.9	107.2	152.5	0	0	0	0	0	106.6
252	S	31.1	Very low	32	Very low	92 Å²	92	136.4 Å²	136.4	64%	0.643	81%	0.814	S	S	*	*			trans	-134.5	111.4	-171.1	59.6	0	0	0	0	111.5	I254	S252-I254 PolarHBondContact O-N 3.4Å
253	T	34	Very low	32	Very low	115 Å²	115	138.2 Å²	138.2	71%	0.706	81%	0.812	S	S	*	*			trans	-63.2	127.9	158.1	-52	0	0	0	0	108	Y255	T253-Y255 HydrophobicContact CG2-CD2 4.24Å; T253-Y255 HydrophobicContact CG2-CE2 3.63Å
254	I	29.2	Very low	32.3	Very low	152 Å²	152	142.7 Å²	142.7	78%	0.779	82%	0.819	S	S	*	*			trans	-95.7	105	-175.2	-59.1	177	0	0	0	109	S252	S252-I254 PolarHBondContact O-N 3.4Å
255	Y	34.6	Very low	32.3	Very low	168 Å²	168	140 Å²	140	66%	0.659	82%	0.817	S	S	*	*			trans	-96.1	142.3	161.5	-65.9	-78.6	0	0	0	109.8	T253 K257	T253-Y255 HydrophobicContact CG2-CD2 4.24Å; T253-Y255 HydrophobicContact CG2-CE2 3.63Å; Y255-K257 PolarHBondContact O-N 2.75Å
256	P	31.9	Very low	32.5	Very low	119 Å²	119	136.9 Å²	136.9	77%	0.773	82%	0.815	S	S	*	*			trans	-72	127.5	-175.2	28.6	-34.1	0	0	0	111.5	T258	P256-T258 PolarHBondContact O-N 2.73Å
257	K	28.9	Very low	32.6	Very low	205 Å²	205	137.9 Å²	137.9	89%	0.891	81%	0.811	S	S	*	*			trans	-77.9	110.3	168.8	-70.8	-169.4	174.4	-168.8	0	110.1	Y255	Y255-K257 PolarHBondContact O-N 2.75Å
258	T	35.9	Very low	32.9	Very low	144 Å²	144	142 Å²	142	88%	0.883	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-64.7	140	160.2	32.6	0	0	0	0	110	P256	P256-T258 PolarHBondContact O-N 2.73Å
259	G	32	Very low	33.2	Very low	69 Å²	69	136.5 Å²	136.5	71%	0.711	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-84.5	157.5	-166.5	0	0	0	0	0	114.7
260	Q	31.4	Very low	33.4	Very low	193 Å²	193	131.2 Å²	131.2	90%	0.902	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-74.8	131.6	169	-69.3	144.6	-57.5	0	0	110.4	P262	Q260-P262 WeakPolarHBondContact O-CD 3.4Å
261	N	33.2	Very low	33.6	Very low	156 Å²	156	128.5 Å²	128.5	83%	0.834	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-76.5	124.9	169	-74.7	-34.8	0	0	0	110.4
262	P	38.9	Very low	34	Very low	124 Å²	124	128 Å²	128	81%	0.805	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-77	152.6	163.6	-9.4	27.7	0	0	0	110.9	Q260	Q260-P262 WeakPolarHBondContact O-CD 3.4Å
263	I	32.1	Very low	34.5	Very low	164 Å²	164	127.8 Å²	127.8	84%	0.841	80%	0.804	S	S	*	*			trans	-104.7	117.2	174	-60	169.4	0	0	0	108.6
264	D	38.4	Very low	34.6	Very low	168 Å²	168	130 Å²	130	90%	0.898	81%	0.812	S	S	*	*			trans	-175.8	153.4	156.8	-94.3	-32.9	0	0	0	107.6
265	G	32.3	Very low	35.1	Very low	77 Å²	77	129 Å²	129	79%	0.794	82%	0.818	S	S	*	*			cis	145.2	60.7	2.2	0	0	0	0	0	112.6
266	G	34.7	Very low	35.4	Very low	80 Å²	80	127 Å²	127	83%	0.825	83%	0.829	S	S	*	*			trans	-165.1	121.7	-175.1	0	0	0	0	0	116.6
267	T	34.4	Very low	35.8	Very low	124 Å²	124	125.1 Å²	125.1	76%	0.761	83%	0.831	S	S	*	*			trans	-82.6	148.9	-175.1	45.6	0	0	0	0	115.5
268	N	35.9	Very low	36.3	Very low	162 Å²	162	121.3 Å²	121.3	87%	0.866	83%	0.83	S	S	*	*				152.9	152.5	119.6	-79.8	-56	0	0	0	113.1
269	G	34.9	Very low	36.6	Very low	75 Å²	75	119.2 Å²	119.2	77%	0.773	83%	0.827	S	S	*	*			trans	179.1	-63.1	173.1	0	0	0	0	0	119.9
270	G	36.6	Very low	36.8	Very low	79 Å²	79	119.6 Å²	119.6	81%	0.814	83%	0.832	S	S	*	*			trans	73.1	-177.4	-175.3	0	0	0	0	0	115.3
271	V	36.8	Very low	37	Very low	149 Å²	149	114.6 Å²	114.6	90%	0.903	83%	0.832	S	S	*	*			cis	-149.4	137.3	-5	175.6	0	0	0	0	110.7
272	G	37.7	Very low	37.1	Very low	72 Å²	72	110.8 Å²	110.8	74%	0.742	83%	0.829	S	S	*	*			trans	95.3	156	149.7	0	0	0	0	0	118.6
273	A	40.1	Very low	37	Very low	88 Å²	88	110.9 Å²	110.9	73%	0.727	83%	0.83	S	S	*	*			cis	-161	147.2	-14.3	0	0	0	0	0	113.1
274	N	37.2	Very low	37.2	Very low	161 Å²	161	109 Å²	109	86%	0.861	83%	0.832	S	S	*	*			trans	50.4	115.9	151.3	-57.8	-12.3	0	0	0	121.7
275	S	40.1	Very low	37	Very low	131 Å²	131	111.6 Å²	111.6	92%	0.916	84%	0.835	S	S	*	*				-161.3	163.9	103.6	45.5	0	0	0	0	110.6
276	S	40.5	Very low	37	Very low	128 Å²	128	113.7 Å²	113.7	90%	0.895	84%	0.837	S	S	*	*			trans	-134	150	-162.5	52.8	0	0	0	0	114.2
277	G	40.3	Very low	36.9	Very low	78 Å²	78	113.5 Å²	113.5	80%	0.804	84%	0.835	S	S	*	*			trans	-158.8	113.3	177.7	0	0	0	0	0	113
278	S	39.9	Very low	36.7	Very low	125 Å²	125	113.6 Å²	113.6	87%	0.874	84%	0.836	S	S	*	*			trans	-44.4	168.3	176.7	-67.3	0	0	0	0	117.9
279	A	40.9	Very low	36.8	Very low	100 Å²	100	113.7 Å²	113.7	83%	0.826	84%	0.836	S	S	*	*			cis	177	162.5	-24.5	0	0	0	0	0	108.2
280	G	36.9	Very low	36.6	Very low	78 Å²	78	117 Å²	117	80%	0.804	84%	0.841	S	S	*	*			trans	121.8	71.4	150.8	0	0	0	0	0	120.1
281	G	35.1	Very low	36.4	Very low	88 Å²	88	116.9 Å²	116.9	91%	0.907	84%	0.839	S	S	*	*				73.3	140.7	124.3	0	0	0	0	0	122.3
282	G	36.5	Very low	36.1	Very low	75 Å²	75	113.2 Å²	113.2	77%	0.773	83%	0.831	S	S	*	*			trans	120.9	87.6	156.4	0	0	0	0	0	116.3
283	P	35.3	Very low	36	Very low	126 Å²	126	113.2 Å²	113.2	82%	0.818	83%	0.831	S	S	*	*			trans	-85	139.3	174.9	33.6	-32.8	0	0	0	112.3
284	S	36.1	Very low	36.5	Very low	126 Å²	126	115.9 Å²	115.9	88%	0.881	83%	0.832	S	S	*	*			trans	-153.1	142.4	163.2	-82.9	0	0	0	0	111.2
285	K	34.3	Very low	37.2	Very low	221 Å²	221	115.5 Å²	115.5	96%	0.961	83%	0.83	S	S	*	*			trans	-86.3	125.6	-177	-62.5	176.8	-180	179.4	0	110.2
286	S	33.8	Very low	38.7	Very low	122 Å²	122	116.5 Å²	116.5	85%	0.853	81%	0.814	S	S	*	*			trans	-144.7	148.5	159.1	-165.5	0	0	0	0	108.5
287	G	31.3	Very low	40.8	Very low	75 Å²	75	112.2 Å²	112.2	77%	0.773	78%	0.784	S	S	*	*			trans	-91	150.6	-169.2	0	0	0	0	0	114.1
288	T	31.8	Very low	43.2	Very low	127 Å²	127	114.6 Å²	114.6	78%	0.779	77%	0.769	S	S	*	*			trans	-137.8	118.2	-179.4	-55.4	0	0	0	0	111.3
289	L	36.8	Very low	45.8	Very low	164 Å²	164	110.6 Å²	110.6	86%	0.859	74%	0.737	S	S	*	*			trans	44.4	125.7	162.5	-80	76	0	0	0	121	G291	L289-G291 PolarHBondContact O-N 2.77Å
290	V	30.8	Very low	48.4	Very low	145 Å²	145	108.9 Å²	108.9	88%	0.879	72%	0.716	S	S	*	*			trans	-72.6	113.4	155.7	174.2	0	0	0	0	109
291	G	32.5	Very low	51.2	Low	76 Å²	76	108.2 Å²	108.2	78%	0.784	69%	0.689	S	S	*	*			trans	-89.2	94.3	167.7	0	0	0	0	0	110.6	L289 G293	L289-G291 PolarHBondContact O-N 2.77Å; G291-G293 PolarHBondContact O-N 2.91Å
292	G	29.8	Very low	54	Low	72 Å²	72	106 Å²	106	74%	0.742	66%	0.656	S	S	*	*			trans	-75.7	81.2	-179.2	0	0	0	0	0	113	L294	G292-L294 PolarHBondContact O-N 3.27Å
293	G	35.9	Very low	56.7	Low	72 Å²	72	102.4 Å²	102.4	74%	0.742	62%	0.62	S	S	*	*			trans	-68.1	113.1	166.2	0	0	0	0	0	110.4	G291 D295	G291-G293 PolarHBondContact O-N 2.91Å; G293-D295 PolarHBondContact O-N 3.15Å
294	L	50.2	Low	59.4	Low	143 Å²	143	100 Å²	100	75%	0.749	60%	0.596	S	S	*	*			trans	-66.5	115.4	166.4	-80.4	159.8	0	0	0	108.3	G292 R296	G292-L294 PolarHBondContact O-N 3.27Å; L294-R296 PolarHBondContact O-N 3.04Å; L294-R296 VanDerWaalsContact O-N 3.13Å
295	D	53.4	Low	62	Low	153 Å²	153	101.3 Å²	101.3	82%	0.818	59%	0.589	S	S	*	*			trans	-68.9	106.8	178.7	-165.5	9.5	0	0	0	109.4	G293	G293-D295 PolarHBondContact O-N 3.15Å
296	R	70.5	Confident	64.8	Low	152 Å²	152	91.3 Å²	91.3	57%	0.574	55%	0.546	S	S	*	.			trans	-89.2	114.2	-177.1	-66.1	-177.3	-177.3	-173.3	-0.6	108.9	L294 R298	L294-R296 PolarHBondContact O-N 3.04Å; L294-R296 VanDerWaalsContact O-N 3.13Å; R296-R298 PolarHBondContact O-N 3.49Å
297	S	83.9	Confident	67.6	Low	39 Å²	39	90.2 Å²	90.2	27%	0.273	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	130.7	170.2	62.7	0	0	0	0	109.6	I333 T334 E335	S297-I333 PolarHBondContact N-O 2.95Å; S297-T334 CarbonylContact O-C 3.55Å; S297-T334 VanDerWaalsContact O-CA 3.23Å; S297-T334 WeakPolarHBondContact O-CA 3.29Å; S297-T334 WeakPolarHBondContact O-CG2 3.29Å; S297-T334 PolarHBondContact OG-OG1 2.92Å; S297-E335 PolarHBondContact O-N 2.97Å
298	R	91.8	Very high	70.6	Confident	127 Å²	127	87.2 Å²	87.2	48%	0.479	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	127.6	176.5	-171.6	176.9	176.4	-127.4	-14.3	109.8	R296 V300 E335 V337 E339	R296-R298 PolarHBondContact O-N 3.49Å; R298-V300 HydrophobicContact CG-CG2 4.12Å; R298-E335 CarbonylContact C-O 3.57Å; R298-E335 WeakPolarHBondContact CA-O 3.41Å; R298-E335 VanDerWaalsContact CD-OE2 3.31Å; R298-E335 WeakPolarHBondContact CD-OE2 3.46Å; R298-E335 HydrophobicContact CG-CB 4.36Å; R298-E335 IonicContact NE-OE2 3.6Å; R298-V337 HydrophobicContact CG-CG2 4.3Å; R298-E339 IonicContact CZ-OE1 3.46Å; R298-E339 IonicContact NH2-OE1 2.67Å; R298-E339 PolarHBondContact NH2-OE1 3.31Å
299	Q	93.8	Very high	73.4	Confident	42 Å²	42	82.5 Å²	82.5	20%	0.196	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	123.1	173.5	-60	-171.5	21.7	0	0	108.1	Y301 R327 T334 E335 V336 V337	Q299-Y301 HydrophobicContact CB-CE2 4.01Å; Q299-Y301 PolarHBondContact OE1-OH 2.91Å; Q299-R327 PolarHBondContact NE2-O 3.2Å; Q299-T334 HydrophobicContact CB-CG2 4.47Å; Q299-T334 HydrophobicContact CG-CG2 3.84Å; Q299-E335 PolarHBondContact N-O 2.82Å; Q299-V336 CarbonylContact O-C 3.58Å; Q299-V336 WeakPolarHBondContact O-CA 3.38Å; Q299-V337 PolarHBondContact O-N 2.84Å
300	V	95.2	Very high	76.2	Confident	63 Å²	63	79.3 Å²	79.3	38%	0.382	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	135.6	-176.3	-177.4	0	0	0	0	109.8	R298 V337 E339	R298-V300 HydrophobicContact CG-CG2 4.12Å; V300-V337 CarbonylContact C-O 3.57Å; V300-V337 WeakPolarHBondContact CA-O 3.42Å; V300-E339 HydrophobicContact CG1-CG 3.94Å; V300-E339 WeakPolarHBondContact CG1-OE1 3.44Å; V300-E339 WeakPolarHBondContact CG1-OE2 3.32Å
301	Y	96.2	Very high	79.3	Confident	64 Å²	64	72.4 Å²	72.4	25%	0.251	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	137.8	-180	-64.2	-69.8	0	0	0	111.5	Q299 M303 I324 P326 V336 V337 F338 E339	Q299-Y301 HydrophobicContact CB-CE2 4.01Å; Q299-Y301 PolarHBondContact OE1-OH 2.91Å; Y301-M303 PolarHBondContact O-N 3Å; Y301-I324 HydrophobicContact CD1-CD1 3.61Å; Y301-I324 HydrophobicContact CD2-CD1 3.35Å; Y301-I324 HydrophobicContact CE1-CD1 3.79Å; Y301-I324 HydrophobicContact CE2-CD1 3.53Å; Y301-I324 HydrophobicContact CG-CD1 3.37Å; Y301-P326 HydrophobicContact CE2-CB 4.32Å; Y301-V336 HydrophobicContact CD2-CG1 3.84Å; Y301-V336 HydrophobicContact CE2-CG1 3.92Å; Y301-V337 PolarHBondContact N-O 2.84Å; Y301-F338 HydrophobicContact CD2-CE1 4.46Å; Y301-F338 CarbonylContact O-C 3.59Å; Y301-F338 VanDerWaalsContact O-CA 3.29Å; Y301-F338 WeakPolarHBondContact O-CA 3.4Å; Y301-E339 PolarHBondContact O-N 2.88Å
302	N	93.3	Very high	82.3	Confident	41 Å²	41	69.2 Å²	69.2	22%	0.219	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	121.3	166.3	178.9	-4.3	0	0	0	108.8	F304 E305 C306	N302-F304 VanDerWaalsContact C-N 3.25Å; N302-F304 PolarHBondContact O-N 2.71Å; N302-F304 PolarHBondContact OD1-N 2.88Å; N302-E305 HydrophobicContact CB-CB 4.16Å; N302-E305 HydrophobicContact CB-CG 4.03Å; N302-E305 WeakPolarHBondContact CB-OE1 3.37Å; N302-E305 PolarHBondContact ND2-OE1 2.79Å; N302-E305 PolarHBondContact O-N 2.86Å; N302-C306 PolarHBondContact O-N 3.08Å; N302-C306 PolarHBondContact O-SG 2.93Å
303	M	94.6	Very high	85.5	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-59.4	-38.4	-179.6	-174.7	61.9	84.2	0	0	111.3	Y301 E305 C306 R322 F338 E339 L341 L551 V567 Y569	Y301-M303 PolarHBondContact O-N 3Å; M303-E305 VanDerWaalsContact C-N 3.27Å; M303-E305 PolarHBondContact O-N 2.99Å; M303-C306 WeakPolarHBondContact O-CB 3.18Å; M303-C306 PolarHBondContact O-N 2.93Å; M303-C306 VanDerWaalsContact O-N 3.08Å; M303-R322 VanDerWaalsContact O-CD 3.24Å; M303-R322 WeakPolarHBondContact O-CD 3.31Å; M303-R322 VanDerWaalsContact O-CZ 3.3Å; M303-R322 PolarHBondContact O-NE 3.23Å; M303-R322 PolarHBondContact O-NH1 3.34Å; M303-R322 VanDerWaalsContact O-NH1 3.09Å; M303-R322 HydrophobicContact SD-CB 4.46Å; M303-F338 HydrophobicContact CB-CB 4.5Å; M303-F338 HydrophobicContact CE-CB 3.57Å; M303-F338 HydrophobicContact CE-CD1 3.86Å; M303-F338 HydrophobicContact CE-CD2 4.32Å; M303-F338 HydrophobicContact CE-CG 3.65Å; M303-F338 HydrophobicContact SD-CD1 4.09Å; M303-F338 HydrophobicContact SD-CG 4.47Å; M303-E339 PolarHBondContact N-O 2.93Å; M303-L341 HydrophobicContact CB-CG 4.38Å; M303-L341 HydrophobicContact CE-CD2 3.86Å; M303-L341 HydrophobicContact CE-CG 4.07Å; M303-L341 HydrophobicContact CG-CG 4.36Å; M303-L551 HydrophobicContact CE-CD2 4.17Å; M303-V567 HydrophobicContact CE-CG1 3.99Å; M303-Y569 HydrophobicContact CG-CE1 4.42Å; M303-Y569 HydrophobicContact SD-CE1 4.21Å
304	F	90.9	Very high	88.3	Confident	75 Å²	75	63.3 Å²	63.3	33%	0.329	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-65.2	-30	-178.7	-58.3	-23	0	0	0	112.9	N302 R322 H340 E605	N302-F304 VanDerWaalsContact C-N 3.25Å; N302-F304 PolarHBondContact O-N 2.71Å; N302-F304 PolarHBondContact OD1-N 2.88Å; F304-R322 PolarHBondContact O-NH1 2.95Å; F304-H340 WeakPolarHBondContact CD1-O 3.34Å; F304-H340 HydrophobicContact CD2-CB 4.26Å; F304-H340 WeakPolarHBondContact CE1-O 3.43Å; F304-H340 HydrophobicContact CE2-CB 4.1Å; F304-H340 HydrophobicContact CZ-CB 4.43Å; F304-H340 VanDerWaalsContact CZ-O 3.25Å; F304-H340 WeakPolarHBondContact CZ-O 3.49Å; F304-E605 HydrophobicContact CD1-CB 3.72Å; F304-E605 HydrophobicContact CD1-CG 4.48Å; F304-E605 VanDerWaalsContact CD1-OE2 3.29Å; F304-E605 WeakPolarHBondContact CD1-OE2 3.29Å; F304-E605 HydrophobicContact CE1-CB 3.46Å; F304-E605 VanDerWaalsContact CE1-CB 3.46Å; F304-E605 HydrophobicContact CE1-CG 4.14Å; F304-E605 HydrophobicContact CG-CB 4.39Å; F304-E605 HydrophobicContact CZ-CB 3.89Å
305	E	91.2	Very high	90.2	Very high	155 Å²	155	59.7 Å²	59.7	72%	0.724	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-78.6	-16.6	175.5	-69.5	170.3	-138.5	0	0	113.5	N302 M303 Q307	N302-E305 HydrophobicContact CB-CB 4.16Å; N302-E305 HydrophobicContact CB-CG 4.03Å; N302-E305 WeakPolarHBondContact CB-OE1 3.37Å; N302-E305 PolarHBondContact ND2-OE1 2.79Å; N302-E305 PolarHBondContact O-N 2.86Å; M303-E305 VanDerWaalsContact C-N 3.27Å; M303-E305 PolarHBondContact O-N 2.99Å; E305-Q307 PolarHBondContact O-N 2.68Å
306	C	93	Very high	91.9	Very high	10 Å²	10	55.2 Å²	55.2	7%	0.068	26%	0.261	C	S	.	.	S	Bend	trans	-75.1	117.5	-178.9	-65	0	0	0	0	111	N302 M303 M308 R322	N302-C306 PolarHBondContact O-N 3.08Å; N302-C306 PolarHBondContact O-SG 2.93Å; M303-C306 WeakPolarHBondContact O-CB 3.18Å; M303-C306 PolarHBondContact O-N 2.93Å; M303-C306 VanDerWaalsContact O-N 3.08Å; C306-M308 PolarHBondContact O-N 2.92Å; C306-R322 HydrophobicContact CB-CB 4.25Å; C306-R322 WeakPolarHBondContact O-CD 3.4Å; C306-R322 WeakPolarHBondContact O-CG 3.08Å; C306-R322 PolarHBondContact O-NH1 2.82Å
307	Q	92.6	Very high	92.9	Very high	100 Å²	100	50.3 Å²	50.3	47%	0.467	24%	0.242	S	C	.	.			trans	-47.4	114	-170.5	179.6	178.5	50.3	0	0	113.8	E305 S309 R322 R323	E305-Q307 PolarHBondContact O-N 2.68Å; Q307-S309 PolarHBondContact O-N 2.86Å; Q307-R322 CarbonylContact O-C 3.59Å; Q307-R322 WeakPolarHBondContact O-CA 3.25Å; Q307-R323 PolarHBondContact O-N 3Å
308	M	93.8	Very high	93.5	Very high	11 Å²	11	48.5 Å²	48.5	5%	0.054	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	118.7	166.8	177.7	150.8	52.2	0	0	109.6	C306 L311 I320 R322 W607	C306-M308 PolarHBondContact O-N 2.92Å; M308-L311 HydrophobicContact SD-CB 3.91Å; M308-L311 HydrophobicContact SD-CD1 4.13Å; M308-L311 HydrophobicContact SD-CG 4.43Å; M308-I320 HydrophobicContact SD-CG1 4.2Å; M308-I320 HydrophobicContact SD-CG2 3.87Å; M308-R322 HydrophobicContact CB-CG 4.37Å; M308-W607 HydrophobicContact CE-CB 3.7Å; M308-W607 HydrophobicContact CE-CG 4.04Å
309	S	92.3	Very high	93.7	Very high	29 Å²	29	45.4 Å²	45.4	20%	0.203	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	-30.3	-172.8	70.9	0	0	0	0	112.6	Q307 C321	Q307-S309 PolarHBondContact O-N 2.86Å; S309-C321 PolarHBondContact N-O 3.2Å; S309-C321 PolarHBondContact OG-O 3.33Å
310	Q	93.6	Very high	93.8	Very high	96 Å²	96	43.4 Å²	43.4	45%	0.449	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	140	172.8	-179.6	177.4	-4.2	0	0	109.2	T312 C321	Q310-T312 PolarHBondContact NE2-OG1 3.44Å; Q310-C321 HydrophobicContact CB-CB 4.32Å; Q310-C321 PolarHBondContact N-O 2.95Å; Q310-C321 PolarHBondContact O-N 3.17Å
311	L	96.4	Very high	93.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	127.1	169.8	175.8	64.6	0	0	0	108.5	M308 V313 A318 I320 W607 T609 Y611 M612 T613	M308-L311 HydrophobicContact SD-CB 3.91Å; M308-L311 HydrophobicContact SD-CD1 4.13Å; M308-L311 HydrophobicContact SD-CG 4.43Å; L311-V313 HydrophobicContact CD1-CG2 4.24Å; L311-V313 HydrophobicContact CD2-CG2 4.08Å; L311-V313 HydrophobicContact CG-CG2 3.92Å; L311-A318 HydrophobicContact CD1-CB 4.05Å; L311-I320 HydrophobicContact CD1-CG1 3.79Å; L311-W607 HydrophobicContact CD1-CD2 4.3Å; L311-W607 HydrophobicContact CD1-CE3 4.22Å; L311-W607 HydrophobicContact CD1-CH2 4.35Å; L311-W607 HydrophobicContact CD1-CZ2 4.46Å; L311-W607 HydrophobicContact CD1-CZ3 4.25Å; L311-W607 HydrophobicContact CD2-CD2 4.05Å; L311-W607 HydrophobicContact CD2-CE3 3.55Å; L311-W607 HydrophobicContact CD2-CZ3 4.03Å; L311-T609 HydrophobicContact CB-CG2 4.06Å; L311-T609 HydrophobicContact CD2-CG2 3.95Å; L311-Y611 PolarHBondContact N-O 2.82Å; L311-Y611 VanDerWaalsContact N-O 3.12Å; L311-M612 HydrophobicContact CD2-CE 3.92Å; L311-M612 HydrophobicContact CD2-CG 4.17Å; L311-M612 HydrophobicContact CG-CG 4.48Å; L311-M612 WeakPolarHBondContact O-CA 3.49Å; L311-T613 PolarHBondContact O-N 2.91Å
312	T	96.1	Very high	93.8	Very high	9 Å²	9	38.9 Å²	38.9	6%	0.055	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	109.6	172	-56.8	0	0	0	0	109.5	Q310 F314 A318 L319 T613	Q310-T312 PolarHBondContact NE2-OG1 3.44Å; T312-F314 HydrophobicContact CG2-CE1 4.08Å; T312-F314 HydrophobicContact CG2-CE2 4.12Å; T312-F314 HydrophobicContact CG2-CZ 3.75Å; T312-A318 CarbonylContact O-C 3.58Å; T312-A318 VanDerWaalsContact O-CA 3.27Å; T312-A318 WeakPolarHBondContact O-CA 3.49Å; T312-L319 PolarHBondContact N-O 2.77Å; T312-L319 PolarHBondContact O-N 3.04Å; T312-T613 CarbonylContact C-O 3.58Å; T312-T613 VanDerWaalsContact CA-O 3.3Å; T312-T613 WeakPolarHBondContact CA-O 3.21Å; T312-T613 HydrophobicContact CG2-CG2 4.43Å
313	V	96.5	Very high	93.9	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	126.1	-179.5	-166.4	0	0	0	0	109.1	L311 A318 W576 V599 W607 M612 T613 L614 S615	L311-V313 HydrophobicContact CD1-CG2 4.24Å; L311-V313 HydrophobicContact CD2-CG2 4.08Å; L311-V313 HydrophobicContact CG-CG2 3.92Å; V313-A318 HydrophobicContact CG1-CB 4.44Å; V313-A318 HydrophobicContact CG2-CB 4.31Å; V313-W576 HydrophobicContact CG1-CB 4.27Å; V313-W576 VanDerWaalsContact O-CD1 3.24Å; V313-W576 PolarHBondContact O-NE1 2.86Å; V313-V599 HydrophobicContact CG1-CG1 4.42Å; V313-V599 HydrophobicContact CG2-CG1 4.45Å; V313-W607 HydrophobicContact CG2-CH2 4.35Å; V313-W607 HydrophobicContact CG2-CZ3 3.86Å; V313-M612 HydrophobicContact CG2-CE 3.62Å; V313-T613 PolarHBondContact N-O 3.36Å; V313-L614 HydrophobicContact CB-CD2 4.02Å; V313-L614 HydrophobicContact CG2-CD2 4.34Å; V313-L614 CarbonylContact O-C 3.49Å; V313-L614 WeakPolarHBondContact O-CA 3.23Å; V313-S615 PolarHBondContact O-N 3.36Å
314	F	94.1	Very high	93.9	Very high	20 Å²	20	41.7 Å²	41.7	9%	0.088	20%	0.2	C	C	.	.			trans	-98.4	-177.1	173.8	-54.6	-85.5	0	0	0	110	T312 D316 R317 L319 G575 W576 S615 A617 P619	T312-F314 HydrophobicContact CG2-CE1 4.08Å; T312-F314 HydrophobicContact CG2-CE2 4.12Å; T312-F314 HydrophobicContact CG2-CZ 3.75Å; F314-D316 PolarHBondContact O-N 2.75Å; F314-R317 WeakPolarHBondContact CA-O 3.17Å; F314-R317 HydrophobicContact CB-CG 4.08Å; F314-R317 WeakPolarHBondContact CB-O 3.07Å; F314-R317 HydrophobicContact CD2-CG 3.72Å; F314-R317 HydrophobicContact CG-CG 4.23Å; F314-R317 PolarHBondContact N-O 2.85Å; F314-L319 HydrophobicContact CE2-CB 3.82Å; F314-L319 HydrophobicContact CZ-CB 4.43Å; F314-G575 VanDerWaalsContact O-CA 3.27Å; F314-G575 WeakPolarHBondContact O-CA 3.31Å; F314-W576 PolarHBondContact O-N 3.24Å; F314-S615 WeakPolarHBondContact CA-O 3.27Å; F314-A617 HydrophobicContact CD1-CB 3.88Å; F314-A617 HydrophobicContact CE1-CB 3.85Å; F314-P619 HydrophobicContact CD1-CG 4.39Å; F314-P619 HydrophobicContact CE1-CG 4.29Å; F314-P619 HydrophobicContact CZ-CG 4.47Å
315	L	91.5	Very high	94.1	Very high	68 Å²	68	44.7 Å²	44.7	36%	0.356	21%	0.209	S	C	.	.	S	Bend	trans	-68.1	-21	-179.3	-58.8	177.3	0	0	0	113.3	W576	L315-W576 HydrophobicContact CD2-CZ2 4.31Å; L315-W576 WeakPolarHBondContact CD2-O 3.25Å
316	D	88.2	Confident	94.3	Very high	58 Å²	58	37.3 Å²	37.3	31%	0.31	18%	0.175	S	C	.	.	S	Bend	trans	-135.4	-7.8	-168.6	67.1	-24.8	0	0	0	115.6	F314 C574	F314-D316 PolarHBondContact O-N 2.75Å; D316-C574 CarbonylContact C-O 3.58Å; D316-C574 VanDerWaalsContact O-O 3.13Å
317	R	92.9	Very high	94.3	Very high	50 Å²	50	45 Å²	45	19%	0.189	20%	0.202	C	C	.	.			trans	-160.6	175.4	-174.1	71.8	-166.8	73.2	-148.3	-2.1	111	F314 V570 V571 C574	F314-R317 WeakPolarHBondContact CA-O 3.17Å; F314-R317 HydrophobicContact CB-CG 4.08Å; F314-R317 WeakPolarHBondContact CB-O 3.07Å; F314-R317 HydrophobicContact CD2-CG 3.72Å; F314-R317 HydrophobicContact CG-CG 4.23Å; F314-R317 PolarHBondContact N-O 2.85Å; R317-V570 HydrophobicContact CB-CG1 4.08Å; R317-V570 HydrophobicContact CG-CG1 4.08Å; R317-V571 CarbonylContact C-O 3.57Å; R317-V571 WeakPolarHBondContact CA-O 3.26Å; R317-V571 WeakPolarHBondContact CB-O 3.34Å; R317-C574 VanDerWaalsContact C-SG 3.54Å; R317-C574 PolarHBondContact N-O 2.74Å
318	A	95.7	Very high	94.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	144.7	168.2	0	0	0	0	0	112.2	L311 T312 V313 V570 V571 C574 W607	L311-A318 HydrophobicContact CD1-CB 4.05Å; T312-A318 CarbonylContact O-C 3.58Å; T312-A318 VanDerWaalsContact O-CA 3.27Å; T312-A318 WeakPolarHBondContact O-CA 3.49Å; V313-A318 HydrophobicContact CG1-CB 4.44Å; V313-A318 HydrophobicContact CG2-CB 4.31Å; A318-V570 CarbonylContact O-C 3.59Å; A318-V570 VanDerWaalsContact O-CA 3.27Å; A318-V570 WeakPolarHBondContact O-CA 3.48Å; A318-V571 HydrophobicContact CB-CG2 4.01Å; A318-V571 PolarHBondContact N-O 2.76Å; A318-V571 PolarHBondContact O-N 3.16Å; A318-C574 PolarHBondContact N-SG 3.27Å; A318-C574 VanDerWaalsContact N-SG 3.37Å; A318-W607 HydrophobicContact CB-CH2 3.64Å; A318-W607 HydrophobicContact CB-CZ2 3.99Å
319	L	95.6	Very high	94	Very high	63 Å²	63	43.7 Å²	43.7	33%	0.33	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	119	166.2	172.8	66.5	0	0	0	108.7	T312 F314 V570	T312-L319 PolarHBondContact N-O 2.77Å; T312-L319 PolarHBondContact O-N 3.04Å; F314-L319 HydrophobicContact CE2-CB 3.82Å; F314-L319 HydrophobicContact CZ-CB 4.43Å; L319-V570 HydrophobicContact CD1-CG2 4.13Å
320	I	96.3	Very high	93.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	138.9	175.6	-67.5	173.6	0	0	0	108.4	M308 L311 R322 S568 Y569 V571 E605	M308-I320 HydrophobicContact SD-CG1 4.2Å; M308-I320 HydrophobicContact SD-CG2 3.87Å; L311-I320 HydrophobicContact CD1-CG1 3.79Å; I320-R322 HydrophobicContact CG2-CG 3.91Å; I320-S568 CarbonylContact O-C 3.6Å; I320-S568 WeakPolarHBondContact O-CA 3.3Å; I320-Y569 HydrophobicContact CB-CD2 4.36Å; I320-Y569 HydrophobicContact CB-CE1 4.32Å; I320-Y569 HydrophobicContact CB-CE2 3.98Å; I320-Y569 HydrophobicContact CD1-CE2 3.89Å; I320-Y569 HydrophobicContact CG1-CE2 4.46Å; I320-Y569 HydrophobicContact CG2-CE1 3.86Å; I320-Y569 HydrophobicContact CG2-CE2 4.17Å; I320-Y569 PolarHBondContact N-O 2.87Å; I320-Y569 PolarHBondContact O-N 3.17Å; I320-V571 HydrophobicContact CD1-CG1 4.13Å; I320-V571 HydrophobicContact CD1-CG2 3.66Å; I320-V571 HydrophobicContact CG1-CG2 4.25Å; I320-E605 WeakPolarHBondContact CD1-OE1 3.17Å
321	C	96	Very high	92.7	Very high	20 Å²	20	44.3 Å²	44.3	14%	0.135	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	106.9	168.8	-177.2	0	0	0	0	110.1	S309 Q310 V567	S309-C321 PolarHBondContact N-O 3.2Å; S309-C321 PolarHBondContact OG-O 3.33Å; Q310-C321 HydrophobicContact CB-CB 4.32Å; Q310-C321 PolarHBondContact N-O 2.95Å; Q310-C321 PolarHBondContact O-N 3.17Å; C321-V567 WeakPolarHBondContact CA-O 3.34Å
322	R	96	Very high	92	Very high	11 Å²	11	47.5 Å²	47.5	4%	0.042	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	139.9	176.4	-70.6	178.5	176.2	-91.4	7	110.1	M303 F304 C306 Q307 M308 I320 L566 V567 Y569 E605	M303-R322 VanDerWaalsContact O-CD 3.24Å; M303-R322 WeakPolarHBondContact O-CD 3.31Å; M303-R322 VanDerWaalsContact O-CZ 3.3Å; M303-R322 PolarHBondContact O-NE 3.23Å; M303-R322 PolarHBondContact O-NH1 3.34Å; M303-R322 VanDerWaalsContact O-NH1 3.09Å; M303-R322 HydrophobicContact SD-CB 4.46Å; F304-R322 PolarHBondContact O-NH1 2.95Å; C306-R322 HydrophobicContact CB-CB 4.25Å; C306-R322 WeakPolarHBondContact O-CD 3.4Å; C306-R322 WeakPolarHBondContact O-CG 3.08Å; C306-R322 PolarHBondContact O-NH1 2.82Å; Q307-R322 CarbonylContact O-C 3.59Å; Q307-R322 WeakPolarHBondContact O-CA 3.25Å; M308-R322 HydrophobicContact CB-CG 4.37Å; I320-R322 HydrophobicContact CG2-CG 3.91Å; R322-L566 WeakPolarHBondContact O-CA 3.41Å; R322-V567 PolarHBondContact N-O 2.95Å; R322-V567 PolarHBondContact O-N 3.28Å; R322-Y569 PolarHBondContact NE-OH 2.56Å; R322-Y569 VanDerWaalsContact NE-OH 3.09Å; R322-E605 IonicContact CZ-OE2 3.34Å; R322-E605 IonicContact NE-OE2 3.35Å; R322-E605 IonicContact NH2-OE2 3.11Å; R322-E605 PolarHBondContact NH2-OE2 3.37Å
323	R	94.5	Very high	91.8	Very high	80 Å²	80	49.2 Å²	49.2	30%	0.302	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	134.1	179.6	175.5	176.3	61.8	-166.4	-5.4	110.4	Q307 E564 L566	Q307-R323 PolarHBondContact O-N 3Å; R323-E564 WeakPolarHBondContact CD-OE1 3.24Å; R323-E564 HydrophobicContact CG-CG 4.25Å; R323-L566 HydrophobicContact CB-CD2 3.67Å; R323-L566 HydrophobicContact CG-CD2 3.74Å
324	I	95.1	Very high	91.6	Very high	20 Å²	20	49.2 Å²	49.2	10%	0.103	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	158.2	175	-167.6	173.7	0	0	0	110.6	Y301 F338 M565	Y301-I324 HydrophobicContact CD1-CD1 3.61Å; Y301-I324 HydrophobicContact CD2-CD1 3.35Å; Y301-I324 HydrophobicContact CE1-CD1 3.79Å; Y301-I324 HydrophobicContact CE2-CD1 3.53Å; Y301-I324 HydrophobicContact CG-CD1 3.37Å; I324-F338 HydrophobicContact CD1-CE1 3.9Å; I324-F338 HydrophobicContact CD1-CZ 4.49Å; I324-F338 HydrophobicContact CG2-CE1 4.09Å; I324-F338 HydrophobicContact CG2-CZ 4.01Å; I324-M565 HydrophobicContact CG2-CB 3.85Å; I324-M565 HydrophobicContact CG2-CG 4.19Å; I324-M565 HydrophobicContact CG2-SD 4.14Å; I324-M565 PolarHBondContact N-O 2.72Å; I324-M565 PolarHBondContact O-N 3.41Å; I324-M565 VanDerWaalsContact O-O 3.14Å
325	R	95.6	Very high	91.6	Very high	138 Å²	138	50.7 Å²	50.7	52%	0.521	25%	0.248	S	C	.	.			trans	-130.1	68.1	177.2	-68.4	-177.2	176.8	174.6	-2.9	111.1	V563 E564	R325-V563 WeakPolarHBondContact CA-O 3.45Å; R325-E564 HydrophobicContact CG-CB 4.43Å; R325-E564 IonicContact CZ-OE1 3.77Å; R325-E564 VanDerWaalsContact CZ-OE1 3.28Å; R325-E564 IonicContact NE-OE1 3.44Å; R325-E564 PolarHBondContact NE-OE1 2.97Å; R325-E564 IonicContact NH2-OE1 3.84Å; R325-E564 PolarHBondContact NH2-OE1 3.07Å
326	P	93.6	Very high	91.8	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.231	C	C	.	.			trans	-56.1	154	174.3	26.6	-36.9	0	0	0	110.9	Y301 F328 Q562 V563	Y301-P326 HydrophobicContact CE2-CB 4.32Å; P326-F328 HydrophobicContact CB-CE1 4.23Å; P326-F328 HydrophobicContact CB-CE2 4.01Å; P326-F328 HydrophobicContact CB-CZ 3.74Å; P326-F328 HydrophobicContact CG-CE2 3.63Å; P326-F328 HydrophobicContact CG-CZ 3.57Å; P326-Q562 WeakPolarHBondContact O-CA 3.47Å; P326-V563 WeakPolarHBondContact CD-O 3.32Å; P326-V563 PolarHBondContact O-N 3.06Å; P326-V563 VanDerWaalsContact O-N 3.11Å
327	R	93.7	Very high	92.2	Very high	171 Å²	171	44.9 Å²	44.9	65%	0.645	22%	0.218	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-114.2	122.9	175.9	-173.9	-178.3	178.6	178.3	-0.2	108.9	Q299 G561 Q562	Q299-R327 PolarHBondContact NE2-O 3.2Å; R327-G561 CarbonylContact C-O 3.58Å; R327-G561 WeakPolarHBondContact CA-O 3.49Å; R327-Q562 HydrophobicContact CB-CG 4.06Å; R327-Q562 HydrophobicContact CG-CG 4.28Å
328	F	92	Very high	92.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	158	-177.1	-59.2	-68.6	0	0	0	112	P326 T334 V336 I354 V555 P557 T560 G561 V563	P326-F328 HydrophobicContact CB-CE1 4.23Å; P326-F328 HydrophobicContact CB-CE2 4.01Å; P326-F328 HydrophobicContact CB-CZ 3.74Å; P326-F328 HydrophobicContact CG-CE2 3.63Å; P326-F328 HydrophobicContact CG-CZ 3.57Å; F328-T334 HydrophobicContact CD1-CG2 3.81Å; F328-T334 HydrophobicContact CE1-CG2 3.63Å; F328-V336 HydrophobicContact CE1-CG2 3.73Å; F328-V336 HydrophobicContact CZ-CG2 3.88Å; F328-I354 HydrophobicContact CE2-CD1 4.49Å; F328-V555 HydrophobicContact CE1-CB 4.17Å; F328-V555 HydrophobicContact CE1-CG1 4.15Å; F328-V555 HydrophobicContact CE2-CG1 4.06Å; F328-V555 HydrophobicContact CZ-CB 4.08Å; F328-V555 HydrophobicContact CZ-CG1 3.79Å; F328-V555 HydrophobicContact CZ-CG2 4.13Å; F328-P557 HydrophobicContact CB-CB 3.47Å; F328-P557 VanDerWaalsContact CB-CB 3.47Å; F328-P557 HydrophobicContact CB-CG 3.52Å; F328-P557 HydrophobicContact CD1-CG 3.93Å; F328-P557 HydrophobicContact CD2-CB 4.47Å; F328-P557 HydrophobicContact CG-CB 3.99Å; F328-P557 HydrophobicContact CG-CG 3.77Å; F328-T560 CarbonylContact O-C 3.57Å; F328-T560 WeakPolarHBondContact O-CA 3.38Å; F328-G561 PolarHBondContact N-O 3.24Å; F328-G561 PolarHBondContact O-N 2.99Å; F328-G561 VanDerWaalsContact O-N 3.07Å; F328-V563 HydrophobicContact CD2-CB 4.06Å; F328-V563 HydrophobicContact CD2-CG2 3.84Å; F328-V563 HydrophobicContact CE2-CB 3.96Å; F328-V563 HydrophobicContact CE2-CG2 4.23Å
329	N	88.8	Confident	92.3	Very high	85 Å²	85	45.2 Å²	45.2	46%	0.455	22%	0.221	S	C	.	.			trans	-96.4	144.5	161.8	-63.7	-22.9	0	0	0	108.7	D332 P557	N329-D332 HydrophobicContact CB-CB 4.3Å; N329-D332 WeakPolarHBondContact CB-OD2 3.27Å; N329-D332 PolarHBondContact ND2-OD2 2.68Å; N329-P557 WeakPolarHBondContact O-CB 3.37Å; N329-P557 WeakPolarHBondContact O-CG 3.38Å
330	A	82.7	Confident	91.9	Very high	31 Å²	31	47.7 Å²	47.7	26%	0.256	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	140.4	172.3	0	0	0	0	0	111.5	D332 T560	A330-D332 VanDerWaalsContact C-N 3.25Å; A330-D332 PolarHBondContact O-N 2.77Å; A330-T560 PolarHBondContact N-OG1 3.17Å
331	S	74.9	Confident	91.8	Very high	106 Å²	106	48 Å²	48	74%	0.741	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.4	-20	178.3	-19.8	0	0	0	0	116.8	I333 P557	S331-I333 PolarHBondContact O-N 3.32Å; S331-P557 PolarHBondContact N-O 2.92Å
332	D	81.9	Confident	91.5	Very high	67 Å²	67	47 Å²	47	36%	0.358	23%	0.226	S	C	.	.			trans	-79.6	108.6	177.4	-63.6	-21.4	0	0	0	109.4	N329 A330 T334 P557	N329-D332 HydrophobicContact CB-CB 4.3Å; N329-D332 WeakPolarHBondContact CB-OD2 3.27Å; N329-D332 PolarHBondContact ND2-OD2 2.68Å; A330-D332 VanDerWaalsContact C-N 3.25Å; A330-D332 PolarHBondContact O-N 2.77Å; D332-T334 PolarHBondContact O-N 2.92Å; D332-T334 VanDerWaalsContact O-N 3.13Å; D332-T334 PolarHBondContact O-OG1 2.75Å; D332-P557 WeakPolarHBondContact O-CD 3.3Å; D332-P557 WeakPolarHBondContact O-CG 3.25Å
333	I	91.3	Very high	91.1	Very high	45 Å²	45	47.7 Å²	47.7	23%	0.231	23%	0.232	C	C	.	.			trans	-62.1	119.5	171.6	-62.9	177.2	0	0	0	108.1	S297 S331 L361 L554	S297-I333 PolarHBondContact N-O 2.95Å; S331-I333 PolarHBondContact O-N 3.32Å; I333-L361 HydrophobicContact CD1-CD1 4.18Å; I333-L361 HydrophobicContact CG2-CD1 4.15Å; I333-L554 HydrophobicContact CG2-CD1 3.63Å; I333-L554 HydrophobicContact CG2-CD2 4.33Å; I333-L554 HydrophobicContact CG2-CG 3.85Å
334	T	93.2	Very high	90.9	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	127.7	-173.8	-60.9	0	0	0	0	110.6	S297 Q299 F328 D332 V336 V555	S297-T334 CarbonylContact O-C 3.55Å; S297-T334 VanDerWaalsContact O-CA 3.23Å; S297-T334 WeakPolarHBondContact O-CA 3.29Å; S297-T334 WeakPolarHBondContact O-CG2 3.29Å; S297-T334 PolarHBondContact OG-OG1 2.92Å; Q299-T334 HydrophobicContact CB-CG2 4.47Å; Q299-T334 HydrophobicContact CG-CG2 3.84Å; F328-T334 HydrophobicContact CD1-CG2 3.81Å; F328-T334 HydrophobicContact CE1-CG2 3.63Å; D332-T334 PolarHBondContact O-N 2.92Å; D332-T334 VanDerWaalsContact O-N 3.13Å; D332-T334 PolarHBondContact O-OG1 2.75Å; T334-V336 HydrophobicContact CG2-CG2 4.16Å; T334-V555 PolarHBondContact N-O 3.49Å; T334-V555 PolarHBondContact O-N 3.37Å
335	E	94.7	Very high	90.7	Very high	52 Å²	52	44.1 Å²	44.1	24%	0.243	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	118.2	166.9	-168.9	-173.1	-146.4	0	0	109.4	S297 R298 Q299 V337 S552 L554	S297-E335 PolarHBondContact O-N 2.97Å; R298-E335 CarbonylContact C-O 3.57Å; R298-E335 WeakPolarHBondContact CA-O 3.41Å; R298-E335 VanDerWaalsContact CD-OE2 3.31Å; R298-E335 WeakPolarHBondContact CD-OE2 3.46Å; R298-E335 HydrophobicContact CG-CB 4.36Å; R298-E335 IonicContact NE-OE2 3.6Å; Q299-E335 PolarHBondContact N-O 2.82Å; E335-V337 HydrophobicContact CG-CG2 3.71Å; E335-S552 VanDerWaalsContact CD-OG 3.29Å; E335-S552 WeakPolarHBondContact CG-OG 3.48Å; E335-S552 PolarHBondContact OE1-OG 2.75Å; E335-L554 HydrophobicContact CB-CD1 4.31Å
336	V	95.6	Very high	90.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	106	173.1	-177.5	0	0	0	0	108.2	Q299 Y301 F328 T334 F338 V553 V555 M565	Q299-V336 CarbonylContact O-C 3.58Å; Q299-V336 WeakPolarHBondContact O-CA 3.38Å; Y301-V336 HydrophobicContact CD2-CG1 3.84Å; Y301-V336 HydrophobicContact CE2-CG1 3.92Å; F328-V336 HydrophobicContact CE1-CG2 3.73Å; F328-V336 HydrophobicContact CZ-CG2 3.88Å; T334-V336 HydrophobicContact CG2-CG2 4.16Å; V336-F338 HydrophobicContact CG1-CE2 3.78Å; V336-F338 HydrophobicContact CG1-CZ 3.83Å; V336-V553 HydrophobicContact CB-CB 4.4Å; V336-V553 PolarHBondContact N-O 2.93Å; V336-V553 PolarHBondContact O-N 3.34Å; V336-V555 HydrophobicContact CG2-CG2 4.19Å; V336-M565 HydrophobicContact CG2-CE 4.5Å
337	V	96	Very high	90.2	Very high	3 Å²	3	45.5 Å²	45.5	2%	0.018	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	127.8	179	-173	0	0	0	0	110.5	R298 Q299 V300 Y301 E335 E339 E550 L551	R298-V337 HydrophobicContact CG-CG2 4.3Å; Q299-V337 PolarHBondContact O-N 2.84Å; V300-V337 CarbonylContact C-O 3.57Å; V300-V337 WeakPolarHBondContact CA-O 3.42Å; Y301-V337 PolarHBondContact N-O 2.84Å; E335-V337 HydrophobicContact CG-CG2 3.71Å; V337-E339 HydrophobicContact CG1-CG 4.16Å; V337-E550 HydrophobicContact CG1-CB 4.46Å; V337-L551 CarbonylContact C-O 3.47Å; V337-L551 WeakPolarHBondContact CA-O 3.37Å
338	F	96.5	Very high	89.9	Confident	1 Å²	1	42.4 Å²	42.4	0%	0.004	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	124.6	167.7	-55.4	-92.6	0	0	0	109.3	Y301 M303 I324 V336 L341 E550 L551 V553 M565 V567	Y301-F338 HydrophobicContact CD2-CE1 4.46Å; Y301-F338 CarbonylContact O-C 3.59Å; Y301-F338 VanDerWaalsContact O-CA 3.29Å; Y301-F338 WeakPolarHBondContact O-CA 3.4Å; M303-F338 HydrophobicContact CB-CB 4.5Å; M303-F338 HydrophobicContact CE-CB 3.57Å; M303-F338 HydrophobicContact CE-CD1 3.86Å; M303-F338 HydrophobicContact CE-CD2 4.32Å; M303-F338 HydrophobicContact CE-CG 3.65Å; M303-F338 HydrophobicContact SD-CD1 4.09Å; M303-F338 HydrophobicContact SD-CG 4.47Å; I324-F338 HydrophobicContact CD1-CE1 3.9Å; I324-F338 HydrophobicContact CD1-CZ 4.49Å; I324-F338 HydrophobicContact CG2-CE1 4.09Å; I324-F338 HydrophobicContact CG2-CZ 4.01Å; V336-F338 HydrophobicContact CG1-CE2 3.78Å; V336-F338 HydrophobicContact CG1-CZ 3.83Å; F338-L341 HydrophobicContact CB-CD1 4.45Å; F338-L341 VanDerWaalsContact O-CD1 3.31Å; F338-L341 WeakPolarHBondContact O-CD1 3.39Å; F338-E550 WeakPolarHBondContact O-CA 3.39Å; F338-L551 HydrophobicContact CB-CB 4.32Å; F338-L551 HydrophobicContact CD2-CB 4.47Å; F338-L551 HydrophobicContact CD2-CD2 4.13Å; F338-L551 HydrophobicContact CD2-CG 4.26Å; F338-L551 PolarHBondContact N-O 3.23Å; F338-L551 PolarHBondContact O-N 2.78Å; F338-V553 HydrophobicContact CE2-CG2 4.09Å; F338-M565 HydrophobicContact CE2-SD 4.15Å; F338-M565 HydrophobicContact CZ-SD 3.84Å; F338-V567 HydrophobicContact CE1-CG2 4.4Å; F338-V567 HydrophobicContact CE2-CG2 3.98Å; F338-V567 HydrophobicContact CZ-CG2 3.81Å
339	E	93.3	Very high	89.9	Confident	56 Å²	56	43.3 Å²	43.3	26%	0.262	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	159.7	176.2	-65.1	174.9	-176.8	0	0	109	R298 V300 Y301 M303 V337 E550	R298-E339 IonicContact CZ-OE1 3.46Å; R298-E339 IonicContact NH2-OE1 2.67Å; R298-E339 PolarHBondContact NH2-OE1 3.31Å; V300-E339 HydrophobicContact CG1-CG 3.94Å; V300-E339 WeakPolarHBondContact CG1-OE1 3.44Å; V300-E339 WeakPolarHBondContact CG1-OE2 3.32Å; Y301-E339 PolarHBondContact O-N 2.88Å; M303-E339 PolarHBondContact N-O 2.93Å; V337-E339 HydrophobicContact CG1-CG 4.16Å; E339-E550 HydrophobicContact CG-CG 4.43Å
340	H	89	Confident	90.1	Very high	116 Å²	116	40 Å²	40	54%	0.537	22%	0.216	S	C	.	.			trans	59	56.2	-176.2	-48.2	-66.6	0	0	0	114.3	F304	F304-H340 WeakPolarHBondContact CD1-O 3.34Å; F304-H340 HydrophobicContact CD2-CB 4.26Å; F304-H340 WeakPolarHBondContact CE1-O 3.43Å; F304-H340 HydrophobicContact CE2-CB 4.1Å; F304-H340 HydrophobicContact CZ-CB 4.43Å; F304-H340 VanDerWaalsContact CZ-O 3.25Å; F304-H340 WeakPolarHBondContact CZ-O 3.49Å
341	L	92.6	Very high	90.7	Very high	6 Å²	6	45.6 Å²	45.6	3%	0.031	23%	0.231	C	C	.	.			trans	-75.2	149.6	167	-66.5	92.9	0	0	0	111.1	M303 F338 I345 R549 L551	M303-L341 HydrophobicContact CB-CG 4.38Å; M303-L341 HydrophobicContact CE-CD2 3.86Å; M303-L341 HydrophobicContact CE-CG 4.07Å; M303-L341 HydrophobicContact CG-CG 4.36Å; F338-L341 HydrophobicContact CB-CD1 4.45Å; F338-L341 VanDerWaalsContact O-CD1 3.31Å; F338-L341 WeakPolarHBondContact O-CD1 3.39Å; L341-I345 HydrophobicContact CB-CD1 4.32Å; L341-I345 HydrophobicContact CD2-CD1 3.62Å; L341-R549 HydrophobicContact CB-CB 4.09Å; L341-R549 WeakPolarHBondContact CD1-O 3.14Å; L341-L551 HydrophobicContact CD1-CB 3.95Å; L341-L551 HydrophobicContact CD2-CB 3.87Å; L341-L551 HydrophobicContact CD2-CD2 4.33Å
342	S	91.1	Very high	91.7	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.203	C	C	.	.			trans	-50.3	135.5	178.9	164.3	0	0	0	0	112.4	A344 I345 T603 E605	S342-A344 PolarHBondContact O-N 2.82Å; S342-A344 PolarHBondContact OG-N 2.83Å; S342-I345 WeakPolarHBondContact O-CB 3.43Å; S342-I345 WeakPolarHBondContact O-CG2 3.35Å; S342-I345 PolarHBondContact O-N 2.9Å; S342-T603 PolarHBondContact OG-O 2.8Å; S342-E605 WeakPolarHBondContact CB-OE1 3.44Å
343	P	87.7	Confident	92.4	Very high	25 Å²	25	43.4 Å²	43.4	16%	0.162	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-19.2	172.7	24.4	-34.8	0	0	0	114.1	D544 R549 T603	P343-D544 HydrophobicContact CB-CB 4.21Å; P343-R549 VanDerWaalsContact CA-CZ 3.49Å; P343-T603 VanDerWaalsContact CD-O 3.3Å; P343-T603 WeakPolarHBondContact CD-O 3.29Å
344	A	89.6	Confident	92.4	Very high	6 Å²	6	43.1 Å²	43.1	5%	0.05	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	8.3	178.7	0	0	0	0	0	113.9	S342 V571 N572 R573 T603	S342-A344 PolarHBondContact O-N 2.82Å; S342-A344 PolarHBondContact OG-N 2.83Å; A344-V571 HydrophobicContact CB-CB 4.35Å; A344-V571 WeakPolarHBondContact O-CA 3.37Å; A344-N572 PolarHBondContact O-N 3.12Å; A344-R573 HydrophobicContact CB-CB 4.09Å; A344-R573 HydrophobicContact CB-CG 4.23Å; A344-T603 HydrophobicContact CB-CG2 4.38Å
345	I	91.6	Very high	92.4	Very high	19 Å²	19	49.6 Å²	49.6	10%	0.097	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	133.3	-174.8	-166	168.4	0	0	0	113.6	L341 S342 K347 I350 F365 Y569	L341-I345 HydrophobicContact CB-CD1 4.32Å; L341-I345 HydrophobicContact CD2-CD1 3.62Å; S342-I345 WeakPolarHBondContact O-CB 3.43Å; S342-I345 WeakPolarHBondContact O-CG2 3.35Å; S342-I345 PolarHBondContact O-N 2.9Å; I345-K347 PolarHBondContact O-N 3.14Å; I345-I350 HydrophobicContact CD1-CD1 3.96Å; I345-I350 HydrophobicContact CD1-CG1 4.1Å; I345-F365 HydrophobicContact CG2-CE2 4.22Å; I345-F365 HydrophobicContact CG2-CZ 4.32Å; I345-Y569 HydrophobicContact CD1-CD1 4.49Å; I345-Y569 HydrophobicContact CD1-CD2 3.64Å; I345-Y569 HydrophobicContact CD1-CE2 4.29Å; I345-Y569 HydrophobicContact CD1-CG 3.76Å; I345-Y569 HydrophobicContact CG1-CD2 3.8Å; I345-Y569 HydrophobicContact CG1-CG 4.23Å
346	D	89.8	Confident	92	Very high	47 Å²	47	49.4 Å²	49.4	25%	0.251	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	108.3	163.6	172.3	-6.4	0	0	0	108.9	D348 S349 V570	D346-D348 VanDerWaalsContact C-N 3.27Å; D346-D348 PolarHBondContact O-N 3.02Å; D346-D348 PolarHBondContact OD1-N 3.03Å; D346-S349 WeakPolarHBondContact O-CB 3.34Å; D346-S349 PolarHBondContact O-N 2.89Å; D346-S349 PolarHBondContact O-OG 3.25Å; D346-S349 PolarHBondContact OD1-N 2.96Å; D346-S349 VanDerWaalsContact OD1-N 3.16Å; D346-V570 HydrophobicContact CB-CB 4.21Å; D346-V570 HydrophobicContact CB-CG1 4.45Å; D346-V570 PolarHBondContact N-O 3.38Å
347	K	88.2	Confident	91.7	Very high	120 Å²	120	50.5 Å²	50.5	52%	0.522	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	-36.1	-179.6	75.2	-170.5	-178.5	-175	0	112.9	I345 S349 I350 F365	I345-K347 PolarHBondContact O-N 3.14Å; K347-S349 VanDerWaalsContact C-N 3.27Å; K347-S349 PolarHBondContact O-N 3.22Å; K347-I350 WeakPolarHBondContact O-CG1 3.28Å; K347-I350 PolarHBondContact O-N 3.26Å; K347-F365 HydrophobicContact CB-CD1 3.9Å; K347-F365 HydrophobicContact CB-CE1 3.97Å; K347-F365 HydrophobicContact CB-CG 4.34Å; K347-F365 HydrophobicContact CB-CZ 4.47Å
348	D	88.2	Confident	91.5	Very high	106 Å²	106	50.6 Å²	50.6	57%	0.567	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	-9.6	-172.2	-62.8	-55.4	0	0	0	111.3	D346 R351	D346-D348 VanDerWaalsContact C-N 3.27Å; D346-D348 PolarHBondContact O-N 3.02Å; D346-D348 PolarHBondContact OD1-N 3.03Å; D348-R351 VanDerWaalsContact O-CZ 3.27Å; D348-R351 PolarHBondContact O-NH1 3.4Å; D348-R351 PolarHBondContact O-NH2 3.33Å
349	S	91.7	Very high	91.3	Very high	18 Å²	18	53 Å²	53	13%	0.126	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	-16.1	169.6	79.3	0	0	0	0	115	D346 K347 R351 V570	D346-S349 WeakPolarHBondContact O-CB 3.34Å; D346-S349 PolarHBondContact O-N 2.89Å; D346-S349 PolarHBondContact O-OG 3.25Å; D346-S349 PolarHBondContact OD1-N 2.96Å; D346-S349 VanDerWaalsContact OD1-N 3.16Å; K347-S349 VanDerWaalsContact C-N 3.27Å; K347-S349 PolarHBondContact O-N 3.22Å; S349-R351 PolarHBondContact O-N 3.44Å; S349-V570 PolarHBondContact OG-N 3.41Å
350	I	93.1	Very high	91.3	Very high	17 Å²	17	52.7 Å²	52.7	9%	0.087	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	123.8	-170.4	-62	172.6	0	0	0	111.1	I345 K347 F365 L551	I345-I350 HydrophobicContact CD1-CD1 3.96Å; I345-I350 HydrophobicContact CD1-CG1 4.1Å; K347-I350 WeakPolarHBondContact O-CG1 3.28Å; K347-I350 PolarHBondContact O-N 3.26Å; I350-F365 HydrophobicContact CD1-CB 4.26Å; I350-F365 HydrophobicContact CD1-CD2 3.74Å; I350-F365 HydrophobicContact CD1-CE2 4.42Å; I350-F365 HydrophobicContact CD1-CG 4.21Å; I350-L551 HydrophobicContact CD1-CD1 4.47Å; I350-L551 HydrophobicContact CG2-CD1 4.03Å; I350-L551 HydrophobicContact CG2-CD2 3.97Å
351	R	94.8	Very high	91.6	Very high	148 Å²	148	51.2 Å²	51.2	56%	0.558	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.3	143.3	172.8	-52.4	-65.8	173	-95	-5.6	110	D348 S349 S568	D348-R351 VanDerWaalsContact O-CZ 3.27Å; D348-R351 PolarHBondContact O-NH1 3.4Å; D348-R351 PolarHBondContact O-NH2 3.33Å; S349-R351 PolarHBondContact O-N 3.44Å; R351-S568 PolarHBondContact N-O 3.37Å; R351-S568 PolarHBondContact O-N 3.1Å; R351-S568 PolarHBondContact O-OG 3.4Å
352	V	96	Very high	91.6	Very high	25 Å²	25	54.6 Å²	54.6	15%	0.152	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	123	179	-173.3	0	0	0	0	109.6	I360 V363 V553 M565 L566 V567	V352-I360 HydrophobicContact CB-CD1 4.12Å; V352-I360 HydrophobicContact CG1-CD1 3.8Å; V352-V363 HydrophobicContact CB-CG2 4.38Å; V352-V363 HydrophobicContact CG2-CG1 3.94Å; V352-V363 HydrophobicContact CG2-CG2 4.22Å; V352-V553 HydrophobicContact CG1-CG1 4.3Å; V352-V553 HydrophobicContact CG1-CG2 4.44Å; V352-V553 HydrophobicContact CG2-CG2 4.07Å; V352-M565 HydrophobicContact CG1-CG 3.82Å; V352-M565 HydrophobicContact CG1-SD 4.07Å; V352-L566 CarbonylContact C-O 3.6Å; V352-L566 WeakPolarHBondContact CA-O 3.39Å; V352-V567 HydrophobicContact CG1-CG2 4.37Å; V352-V567 HydrophobicContact CG2-CG1 4.44Å; V352-V567 HydrophobicContact CG2-CG2 4.37Å
353	E	95.6	Very high	91.7	Very high	102 Å²	102	57.4 Å²	57.4	48%	0.477	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	147	166.7	-67.5	-169.8	-171.4	0	0	110.5	R355 M565 L566	E353-R355 IonicContact OE2-CZ 2.75Å; E353-R355 IonicContact OE2-NE 2.68Å; E353-R355 PolarHBondContact OE2-NE 2.66Å; E353-R355 VanDerWaalsContact OE2-NE 3.11Å; E353-R355 IonicContact OE2-NH2 3.24Å; E353-R355 PolarHBondContact OE2-NH2 2.84Å; E353-M565 WeakPolarHBondContact O-CA 3.44Å; E353-M565 WeakPolarHBondContact O-CG 3.02Å; E353-L566 HydrophobicContact CB-CB 4.26Å; E353-L566 PolarHBondContact N-O 2.93Å; E353-L566 PolarHBondContact O-N 2.99Å
354	I	93.2	Very high	91.9	Very high	38 Å²	38	58.6 Å²	58.6	20%	0.195	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	136.5	171	-160.3	163.5	0	0	0	110.9	F328 A358 I360 V555 V563 M565	F328-I354 HydrophobicContact CE2-CD1 4.49Å; I354-A358 HydrophobicContact CD1-CB 3.71Å; I354-A358 HydrophobicContact CG1-CB 4.38Å; I354-I360 HydrophobicContact CB-CD1 4.04Å; I354-I360 HydrophobicContact CB-CG1 4.14Å; I354-I360 HydrophobicContact CD1-CG1 4.48Å; I354-I360 HydrophobicContact CG2-CD1 3.97Å; I354-I360 HydrophobicContact CG2-CG1 3.85Å; I354-V555 HydrophobicContact CD1-CG1 3.77Å; I354-V555 HydrophobicContact CD1-CG2 4.31Å; I354-V563 HydrophobicContact CD1-CG1 3.85Å; I354-V563 HydrophobicContact CG1-CG1 3.37Å; I354-M565 HydrophobicContact CD1-CE 4.05Å
355	R	91.8	Very high	92.1	Very high	136 Å²	136	61.3 Å²	61.3	51%	0.513	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	94.8	-174	-63.7	-177.6	-177.4	-173.2	0.6	110.5	E353 E564	E353-R355 IonicContact OE2-CZ 2.75Å; E353-R355 IonicContact OE2-NE 2.68Å; E353-R355 PolarHBondContact OE2-NE 2.66Å; E353-R355 VanDerWaalsContact OE2-NE 3.11Å; E353-R355 IonicContact OE2-NH2 3.24Å; E353-R355 PolarHBondContact OE2-NH2 2.84Å; R355-E564 HydrophobicContact CB-CB 4.31Å; R355-E564 PolarHBondContact N-O 3.26Å; R355-E564 PolarHBondContact O-N 3.05Å
356	G	87.2	Confident	91.9	Very high	48 Å²	48	62.3 Å²	62.3	50%	0.495	33%	0.327	S	S	.	.	S	Bend	trans	160.6	-166.9	178.3	0	0	0	0	0	111.3	A358	G356-A358 PolarHBondContact O-N 3.32Å
357	A	89	Confident	91.7	Very high	23 Å²	23	62.4 Å²	62.4	19%	0.19	33%	0.334	C	S	.	.	S	Bend	trans	-79.6	64.9	176.3	0	0	0	0	0	111.6	R558 E559	A357-R558 HydrophobicContact CB-CB 4.29Å; A357-R558 WeakPolarHBondContact O-CA 3.38Å; A357-R558 WeakPolarHBondContact O-CB 3.11Å; A357-R558 PolarHBondContact O-N 2.88Å; A357-E559 HydrophobicContact CB-CB 3.78Å; A357-E559 VanDerWaalsContact CB-CD 3.44Å; A357-E559 HydrophobicContact CB-CG 3.6Å; A357-E559 PolarHBondContact O-N 3.02Å
358	A	90.8	Very high	91.4	Very high	5 Å²	5	61.5 Å²	61.5	4%	0.041	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	170.3	176.4	0	0	0	0	0	111	I354 G356 V555 E556 R558 V563	I354-A358 HydrophobicContact CD1-CB 3.71Å; I354-A358 HydrophobicContact CG1-CB 4.38Å; G356-A358 PolarHBondContact O-N 3.32Å; A358-V555 HydrophobicContact CB-CG1 3.91Å; A358-E556 CarbonylContact C-O 3.5Å; A358-E556 VanDerWaalsContact CA-O 3.24Å; A358-E556 WeakPolarHBondContact CA-O 3.49Å; A358-R558 PolarHBondContact O-NH2 2.91Å; A358-V563 HydrophobicContact CB-CG1 4.3Å; A358-V563 HydrophobicContact CB-CG2 4.36Å
359	T	92.9	Very high	90.7	Very high	51 Å²	51	59 Å²	59	31%	0.313	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	138.3	178.4	-44.5	0	0	0	0	108.4	V555 E556	T359-V555 CarbonylContact O-C 3.6Å; T359-V555 WeakPolarHBondContact O-CA 3.36Å; T359-E556 PolarHBondContact N-O 3.39Å; T359-E556 PolarHBondContact O-N 3.07Å
360	I	94.4	Very high	89.8	Confident	50 Å²	50	64.1 Å²	64.1	26%	0.256	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	128.9	168.3	-62.2	165	0	0	0	107.5	V352 I354 V363 V553	V352-I360 HydrophobicContact CB-CD1 4.12Å; V352-I360 HydrophobicContact CG1-CD1 3.8Å; I354-I360 HydrophobicContact CB-CD1 4.04Å; I354-I360 HydrophobicContact CB-CG1 4.14Å; I354-I360 HydrophobicContact CD1-CG1 4.48Å; I354-I360 HydrophobicContact CG2-CD1 3.97Å; I354-I360 HydrophobicContact CG2-CG1 3.85Å; I360-V363 HydrophobicContact CG2-CG2 3.64Å; I360-V553 HydrophobicContact CG1-CG1 4.34Å; I360-V553 HydrophobicContact CG2-CG1 4.1Å
361	L	93.5	Very high	88.5	Confident	85 Å²	85	64.7 Å²	64.7	45%	0.445	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-37.9	177.7	-60.3	-176.9	0	0	0	112.3	I333 L554 E556	I333-L361 HydrophobicContact CD1-CD1 4.18Å; I333-L361 HydrophobicContact CG2-CD1 4.15Å; L361-L554 HydrophobicContact CB-CB 4.24Å; L361-L554 HydrophobicContact CB-CD2 4.07Å; L361-L554 HydrophobicContact CB-CG 4.21Å; L361-L554 HydrophobicContact CD1-CD2 4.14Å; L361-L554 HydrophobicContact CD1-CG 4.28Å; L361-L554 PolarHBondContact N-O 3.02Å; L361-E556 HydrophobicContact CD1-CB 4.09Å; L361-E556 HydrophobicContact CD2-CB 4.16Å; L361-E556 HydrophobicContact CG-CB 4.1Å
362	D	93.4	Very high	87.3	Confident	78 Å²	78	61.7 Å²	61.7	42%	0.417	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	154.8	-180	-177.9	40.3	0	0	0	111	S364 V553 L554	D362-S364 PolarHBondContact OD2-OG 2.98Å; D362-V553 WeakPolarHBondContact O-CA 3.39Å; D362-L554 HydrophobicContact CB-CB 3.95Å; D362-L554 PolarHBondContact O-N 2.81Å
363	V	93.6	Very high	86	Confident	59 Å²	59	64.4 Å²	64.4	36%	0.358	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	105.4	171.5	-178.1	0	0	0	0	108	V352 I360 L551 S552 V553	V352-V363 HydrophobicContact CB-CG2 4.38Å; V352-V363 HydrophobicContact CG2-CG1 3.94Å; V352-V363 HydrophobicContact CG2-CG2 4.22Å; I360-V363 HydrophobicContact CG2-CG2 3.64Å; V363-L551 HydrophobicContact CG1-CD1 3.78Å; V363-S552 WeakPolarHBondContact CA-O 3.32Å; V363-V553 HydrophobicContact CG1-CG2 4.43Å; V363-V553 HydrophobicContact CG2-CG1 4.35Å
364	S	92.4	Very high	84.7	Confident	49 Å²	49	64.8 Å²	64.8	34%	0.343	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	130.3	-176.1	38.2	0	0	0	0	111.9	D362 S552	D362-S364 PolarHBondContact OD2-OG 2.98Å; S364-S552 PolarHBondContact N-O 2.65Å; S364-S552 PolarHBondContact O-N 2.73Å
365	F	92	Very high	83.8	Confident	63 Å²	63	69.4 Å²	69.4	28%	0.276	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	137.9	173.8	172.9	-92.3	0	0	0	109.5	I345 K347 I350 A367 R549 E550	I345-F365 HydrophobicContact CG2-CE2 4.22Å; I345-F365 HydrophobicContact CG2-CZ 4.32Å; K347-F365 HydrophobicContact CB-CD1 3.9Å; K347-F365 HydrophobicContact CB-CE1 3.97Å; K347-F365 HydrophobicContact CB-CG 4.34Å; K347-F365 HydrophobicContact CB-CZ 4.47Å; I350-F365 HydrophobicContact CD1-CB 4.26Å; I350-F365 HydrophobicContact CD1-CD2 3.74Å; I350-F365 HydrophobicContact CD1-CE2 4.42Å; I350-F365 HydrophobicContact CD1-CG 4.21Å; F365-A367 HydrophobicContact CE1-CB 4.17Å; F365-A367 HydrophobicContact CZ-CB 4.42Å; F365-R549 HydrophobicContact CE2-CB 4.09Å; F365-R549 HydrophobicContact CE2-CG 4.37Å; F365-R549 HydrophobicContact CZ-CB 4.17Å; F365-R549 HydrophobicContact CZ-CG 3.97Å; F365-E550 WeakPolarHBondContact CA-O 3.14Å
366	S	88.5	Confident	83.3	Confident	40 Å²	40	66.6 Å²	66.6	28%	0.28	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	145.8	170.8	80.2	0	0	0	0	111.7	K368 R549 E550	S366-K368 WeakPolarHBondContact OG-CE 3.45Å; S366-R549 WeakPolarHBondContact O-CA 3.38Å; S366-E550 PolarHBondContact N-O 2.86Å; S366-E550 PolarHBondContact O-N 3.38Å
367	A	85.3	Confident	82.9	Confident	50 Å²	50	66.9 Å²	66.9	41%	0.413	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	131.8	169.7	0	0	0	0	0	108.1	F365 A548 R549	F365-A367 HydrophobicContact CE1-CB 4.17Å; F365-A367 HydrophobicContact CZ-CB 4.42Å; A367-A548 CarbonylContact C-O 3.54Å; A367-A548 WeakPolarHBondContact CA-O 3.32Å; A367-R549 HydrophobicContact CB-CG 4.22Å
368	K	81.7	Confident	82.5	Confident	101 Å²	101	67.2 Å²	67.2	44%	0.439	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	129.1	-176.4	-57.7	165.9	-162.7	159.9	0	108.5	S366 A548 E550	S366-K368 WeakPolarHBondContact OG-CE 3.45Å; K368-A548 PolarHBondContact N-O 3.38Å; K368-A548 PolarHBondContact O-N 3.34Å; K368-E550 IonicContact NZ-OE1 2.65Å; K368-E550 PolarHBondContact NZ-OE1 3.1Å; K368-E550 IonicContact NZ-OE2 2.78Å; K368-E550 PolarHBondContact NZ-OE2 2.82Å
369	S	74.3	Confident	82.2	Confident	54 Å²	54	72.4 Å²	72.4	38%	0.378	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	136.3	172.6	-172.6	0	0	0	0	110.8	S371	S369-S371 PolarHBondContact OG-N 3.35Å; S369-S371 PolarHBondContact OG-O 2.83Å
370	L	71.8	Confident	81.9	Confident	125 Å²	125	72.4 Å²	72.4	65%	0.654	42%	0.415	S	S	*	.	S	Bend	trans	-85.8	-12.4	174	-67.3	171.8	0	0	0	112.9	H546 A548	L370-H546 VanDerWaalsContact CB-O 3.31Å; L370-H546 WeakPolarHBondContact CB-O 3.43Å; L370-H546 WeakPolarHBondContact CG-O 3.46Å; L370-H546 PolarHBondContact N-O 3.42Å; L370-A548 HydrophobicContact CD1-CB 4.29Å; L370-A548 HydrophobicContact CD2-CB 3.93Å; L370-A548 HydrophobicContact CG-CB 4.04Å
371	S	67.3	Low	81.6	Confident	28 Å²	28	70.9 Å²	70.9	20%	0.196	41%	0.408	C	S	.	.	S	Bend	trans	-136.2	150.7	175.3	63.5	0	0	0	0	113.1	S369 E373 H546	S369-S371 PolarHBondContact OG-N 3.35Å; S369-S371 PolarHBondContact OG-O 2.83Å; S371-E373 VanDerWaalsContact CB-OE2 3.26Å; S371-E373 WeakPolarHBondContact CB-OE2 3.19Å; S371-E373 PolarHBondContact O-N 3Å; S371-E373 VanDerWaalsContact O-N 3.12Å; S371-E373 PolarHBondContact OG-OE2 2.87Å; S371-H546 PolarHBondContact OG-ND1 3.31Å
372	G	68.2	Low	81.3	Confident	85 Å²	85	70.8 Å²	70.8	88%	0.876	41%	0.408	S	S	*	.	S	Bend	trans	-80.4	30.6	174.7	0	0	0	0	0	113.6
373	E	68	Low	81.2	Confident	83 Å²	83	72.4 Å²	72.4	39%	0.388	41%	0.413	S	S	.	.			trans	-101.1	7.3	-174.3	-63.3	167	145.5	0	0	112.1	S371 D375 T376 W377	S371-E373 VanDerWaalsContact CB-OE2 3.26Å; S371-E373 WeakPolarHBondContact CB-OE2 3.19Å; S371-E373 PolarHBondContact O-N 3Å; S371-E373 VanDerWaalsContact O-N 3.12Å; S371-E373 PolarHBondContact OG-OE2 2.87Å; E373-D375 PolarHBondContact O-N 2.92Å; E373-T376 PolarHBondContact O-N 2.87Å; E373-T376 PolarHBondContact O-OG1 3.24Å; E373-W377 PolarHBondContact O-N 3.13Å
374	E	69.5	Low	81.2	Confident	110 Å²	110	70.8 Å²	70.8	51%	0.514	40%	0.402	S	S	.	.	H	α-helix	trans	-56.2	-38.3	-175.2	-169.9	168.7	-174.6	0	0	112.6	S378	E374-S378 WeakPolarHBondContact O-CB 3.34Å; E374-S378 PolarHBondContact O-N 2.96Å; E374-S378 PolarHBondContact O-OG 2.8Å
375	D	73.8	Confident	81	Confident	135 Å²	135	71.4 Å²	71.4	72%	0.722	40%	0.401	S	S	*	.	H	α-helix	trans	-64	-39	174	-70.3	-35.8	0	0	0	112.8	E373 Q379	E373-D375 PolarHBondContact O-N 2.92Å; D375-Q379 WeakPolarHBondContact O-CB 3.45Å; D375-Q379 PolarHBondContact O-N 2.99Å
376	T	81	Confident	81.2	Confident	76 Å²	76	71.6 Å²	71.6	47%	0.466	41%	0.407	S	S	.	.	H	α-helix	trans	-76.3	-41	-176.1	66.2	0	0	0	0	111.2	E373 S378 Q379 C380	E373-T376 PolarHBondContact O-N 2.87Å; E373-T376 PolarHBondContact O-OG1 3.24Å; T376-S378 VanDerWaalsContact C-N 3.34Å; T376-Q379 PolarHBondContact O-N 2.78Å; T376-C380 PolarHBondContact O-N 3.36Å; T376-C380 PolarHBondContact O-SG 2.92Å; T376-C380 VanDerWaalsContact O-SG 3.33Å
377	W	79.1	Confident	81.4	Confident	55 Å²	55	73 Å²	73	21%	0.208	41%	0.409	C	S	.	.	H	α-helix	trans	-61.1	-44.6	170.8	-62	122	0	0	0	111.2	E373 Q379 C380 V381 I539 K542	E373-W377 PolarHBondContact O-N 3.13Å; W377-Q379 VanDerWaalsContact C-N 3.34Å; W377-Q379 PolarHBondContact O-N 2.76Å; W377-C380 PolarHBondContact O-N 2.8Å; W377-V381 WeakPolarHBondContact O-CG2 3.28Å; W377-V381 PolarHBondContact O-N 2.97Å; W377-I539 HydrophobicContact CB-CG2 4.44Å; W377-I539 HydrophobicContact CD2-CG2 4.42Å; W377-I539 HydrophobicContact CE3-CG2 3.65Å; W377-I539 HydrophobicContact CZ3-CG1 4.45Å; W377-I539 HydrophobicContact CZ3-CG2 4.34Å; W377-K542 HydrophobicContact CH2-CD 4.07Å; W377-K542 HydrophobicContact CZ3-CD 4.33Å
378	S	80.3	Confident	81.7	Confident	29 Å²	29	71.1 Å²	71.1	20%	0.203	39%	0.393	C	S	.	.	H	α-helix	trans	-61.6	-39.4	176.3	-61.3	0	0	0	0	112.5	E374 T376 N382	E374-S378 WeakPolarHBondContact O-CB 3.34Å; E374-S378 PolarHBondContact O-N 2.96Å; E374-S378 PolarHBondContact O-OG 2.8Å; T376-S378 VanDerWaalsContact C-N 3.34Å; S378-N382 WeakPolarHBondContact O-CB 3.48Å; S378-N382 PolarHBondContact O-N 3.44Å; S378-N382 VanDerWaalsContact O-N 3.13Å; S378-N382 PolarHBondContact O-ND2 2.65Å
379	Q	85.5	Confident	82.3	Confident	115 Å²	115	72 Å²	72	54%	0.537	39%	0.393	S	S	.	.	H	α-helix	trans	-64.4	-50.6	174.4	-178.1	176.3	-16	0	0	111.3	D375 T376 W377 V381 N382 E383	D375-Q379 WeakPolarHBondContact O-CB 3.45Å; D375-Q379 PolarHBondContact O-N 2.99Å; T376-Q379 PolarHBondContact O-N 2.78Å; W377-Q379 VanDerWaalsContact C-N 3.34Å; W377-Q379 PolarHBondContact O-N 2.76Å; Q379-V381 PolarHBondContact O-N 2.9Å; Q379-N382 PolarHBondContact O-N 2.94Å; Q379-N382 VanDerWaalsContact O-N 3.12Å; Q379-E383 HydrophobicContact CG-CG 4.47Å; Q379-E383 WeakPolarHBondContact CG-OE1 3.26Å; Q379-E383 PolarHBondContact NE2-OE1 2.87Å; Q379-E383 PolarHBondContact O-N 3.4Å
380	C	87.1	Confident	83.3	Confident	51 Å²	51	75.3 Å²	75.3	35%	0.345	40%	0.402	S	S	.	.	H	α-helix	trans	-59.3	-42.7	-179.5	-68.8	0	0	0	0	112.7	T376 W377 E383 L384 I539	T376-C380 PolarHBondContact O-N 3.36Å; T376-C380 PolarHBondContact O-SG 2.92Å; T376-C380 VanDerWaalsContact O-SG 3.33Å; W377-C380 PolarHBondContact O-N 2.8Å; C380-E383 PolarHBondContact O-N 3.32Å; C380-L384 WeakPolarHBondContact O-CG 3.19Å; C380-L384 PolarHBondContact O-N 2.68Å; C380-I539 HydrophobicContact CB-CD1 4.08Å
381	V	86.4	Confident	84.3	Confident	17 Å²	17	70.2 Å²	70.2	10%	0.103	38%	0.377	C	S	.	.	H	α-helix	trans	-62.5	-42.9	175.1	172.1	0	0	0	0	111	W377 Q379 E383 L384 L385 V536 I539	W377-V381 WeakPolarHBondContact O-CG2 3.28Å; W377-V381 PolarHBondContact O-N 2.97Å; Q379-V381 PolarHBondContact O-N 2.9Å; V381-E383 PolarHBondContact O-N 3.21Å; V381-L384 PolarHBondContact O-N 3.1Å; V381-L385 HydrophobicContact CG1-CD1 3.72Å; V381-L385 HydrophobicContact CG1-CG 4.19Å; V381-L385 WeakPolarHBondContact O-CB 3.27Å; V381-L385 WeakPolarHBondContact O-CG 3.33Å; V381-L385 PolarHBondContact O-N 2.85Å; V381-V536 HydrophobicContact CG1-CG1 4.41Å; V381-I539 HydrophobicContact CG2-CB 4.21Å; V381-I539 HydrophobicContact CG2-CG2 3.55Å
382	N	88.2	Confident	85.6	Confident	83 Å²	83	73.8 Å²	73.8	44%	0.444	39%	0.386	S	S	.	.	H	α-helix	trans	-63	-40.5	177.4	-86.1	-73	0	0	0	112.8	S378 Q379 L385 V386	S378-N382 WeakPolarHBondContact O-CB 3.48Å; S378-N382 PolarHBondContact O-N 3.44Å; S378-N382 VanDerWaalsContact O-N 3.13Å; S378-N382 PolarHBondContact O-ND2 2.65Å; Q379-N382 PolarHBondContact O-N 2.94Å; Q379-N382 VanDerWaalsContact O-N 3.12Å; N382-L385 PolarHBondContact O-N 3.49Å; N382-V386 WeakPolarHBondContact O-CG2 3.34Å; N382-V386 PolarHBondContact O-N 2.8Å
383	E	92	Very high	86.9	Confident	112 Å²	112	77.8 Å²	77.8	52%	0.523	38%	0.375	S	S	.	.	H	α-helix	trans	-64.7	-47	177	-72.2	177.4	-168.3	0	0	111.7	Q379 C380 V381 L385 V386 E387	Q379-E383 HydrophobicContact CG-CG 4.47Å; Q379-E383 WeakPolarHBondContact CG-OE1 3.26Å; Q379-E383 PolarHBondContact NE2-OE1 2.87Å; Q379-E383 PolarHBondContact O-N 3.4Å; C380-E383 PolarHBondContact O-N 3.32Å; V381-E383 PolarHBondContact O-N 3.21Å; E383-L385 PolarHBondContact O-N 2.74Å; E383-V386 WeakPolarHBondContact O-CA 3.33Å; E383-V386 WeakPolarHBondContact O-CB 3.45Å; E383-V386 PolarHBondContact O-N 2.76Å; E383-E387 PolarHBondContact O-N 3.15Å
384	L	92.3	Very high	88.2	Confident	25 Å²	25	79.9 Å²	79.9	13%	0.131	38%	0.379	C	S	.	.	H	α-helix	trans	-63.1	-38.8	175.3	-66.9	170.1	0	0	0	112.4	C380 V381 V386 E387 L388 L532 E535 V536 I539	C380-L384 WeakPolarHBondContact O-CG 3.19Å; C380-L384 PolarHBondContact O-N 2.68Å; V381-L384 PolarHBondContact O-N 3.1Å; L384-V386 VanDerWaalsContact C-N 3.27Å; L384-V386 PolarHBondContact O-N 3.04Å; L384-E387 PolarHBondContact O-N 3.35Å; L384-L388 VanDerWaalsContact O-CB 3.3Å; L384-L388 WeakPolarHBondContact O-CB 3.25Å; L384-L388 PolarHBondContact O-N 3.25Å; L384-L532 HydrophobicContact CB-CD2 4.44Å; L384-L532 HydrophobicContact CD2-CD2 3.62Å; L384-E535 HydrophobicContact CD1-CB 3.88Å; L384-E535 HydrophobicContact CD2-CB 4.17Å; L384-E535 WeakPolarHBondContact CD2-OE2 3.43Å; L384-V536 HydrophobicContact CB-CG2 3.57Å; L384-V536 HydrophobicContact CD1-CG2 4.06Å; L384-V536 HydrophobicContact CG-CG2 4.47Å; L384-I539 HydrophobicContact CD1-CD1 3.63Å
385	L	89.6	Confident	89.3	Confident	62 Å²	62	75.2 Å²	75.2	33%	0.325	36%	0.36	S	S	.	.	H	α-helix	trans	-69.1	-22.2	174.1	-71.5	176	0	0	0	112.8	V381 N382 E383 L388 R389 V536	V381-L385 HydrophobicContact CG1-CD1 3.72Å; V381-L385 HydrophobicContact CG1-CG 4.19Å; V381-L385 WeakPolarHBondContact O-CB 3.27Å; V381-L385 WeakPolarHBondContact O-CG 3.33Å; V381-L385 PolarHBondContact O-N 2.85Å; N382-L385 PolarHBondContact O-N 3.49Å; E383-L385 PolarHBondContact O-N 2.74Å; L385-L388 HydrophobicContact CD2-CD2 4.18Å; L385-R389 WeakPolarHBondContact O-CG 3.4Å; L385-R389 PolarHBondContact O-N 3.48Å; L385-R389 PolarHBondContact O-NE 3.49Å; L385-V536 HydrophobicContact CD2-CG2 4.32Å; L385-V536 HydrophobicContact CG-CG2 4.47Å
386	V	94.2	Very high	90.2	Very high	67 Å²	67	73.3 Å²	73.3	41%	0.406	35%	0.349	S	S	.	.	H	α-helix	trans	-72.9	-47.7	167	168	0	0	0	0	110.5	N382 E383 L384 L388 R389 Q390	N382-V386 WeakPolarHBondContact O-CG2 3.34Å; N382-V386 PolarHBondContact O-N 2.8Å; E383-V386 WeakPolarHBondContact O-CA 3.33Å; E383-V386 WeakPolarHBondContact O-CB 3.45Å; E383-V386 PolarHBondContact O-N 2.76Å; L384-V386 VanDerWaalsContact C-N 3.27Å; L384-V386 PolarHBondContact O-N 3.04Å; V386-L388 PolarHBondContact O-N 3.42Å; V386-R389 VanDerWaalsContact CG2-NH2 3.32Å; V386-R389 PolarHBondContact O-N 2.85Å; V386-Q390 WeakPolarHBondContact O-CG 3.3Å; V386-Q390 PolarHBondContact O-N 3.29Å
387	E	94.1	Very high	90.9	Very high	69 Å²	69	75.1 Å²	75.1	32%	0.322	36%	0.356	S	S	.	.	H	α-helix	trans	-61.2	-45.4	178.3	-157.9	-167.9	146.4	0	0	111.3	E383 L384 R389 Q390 C391 R528 L532	E383-E387 PolarHBondContact O-N 3.15Å; L384-E387 PolarHBondContact O-N 3.35Å; E387-R389 VanDerWaalsContact C-N 3.27Å; E387-R389 PolarHBondContact O-N 3.14Å; E387-Q390 CarbonylContact O-C 3.57Å; E387-Q390 WeakPolarHBondContact O-CA 3.47Å; E387-Q390 WeakPolarHBondContact O-CB 3.37Å; E387-Q390 PolarHBondContact O-N 2.9Å; E387-C391 PolarHBondContact O-N 3.22Å; E387-R528 IonicContact OE1-CZ 2.73Å; E387-R528 IonicContact OE1-NE 3.81Å; E387-R528 PolarHBondContact OE1-NE 3.4Å; E387-R528 IonicContact OE1-NH2 3.95Å; E387-R528 PolarHBondContact OE1-NH2 3.12Å; E387-R528 IonicContact OE2-CZ 3.59Å; E387-R528 IonicContact OE2-NE 3.99Å; E387-R528 IonicContact OE2-NH2 3.17Å; E387-R528 PolarHBondContact OE2-NH2 2.97Å; E387-L532 HydrophobicContact CB-CD1 3.97Å; E387-L532 HydrophobicContact CB-CD2 3.98Å; E387-L532 HydrophobicContact CG-CD1 3.86Å; E387-L532 HydrophobicContact CG-CD2 4.3Å
388	L	91.9	Very high	91.7	Very high	12 Å²	12	72.8 Å²	72.8	6%	0.063	35%	0.348	C	S	.	.	H	α-helix	trans	-57.6	-38.9	178.9	-179.8	60.8	0	0	0	112.3	L384 L385 V386 Q390 R392 I529 L532 E533	L384-L388 VanDerWaalsContact O-CB 3.3Å; L384-L388 WeakPolarHBondContact O-CB 3.25Å; L384-L388 PolarHBondContact O-N 3.25Å; L385-L388 HydrophobicContact CD2-CD2 4.18Å; V386-L388 PolarHBondContact O-N 3.42Å; L388-Q390 VanDerWaalsContact C-N 3.35Å; L388-R392 HydrophobicContact CD1-CG 4.4Å; L388-R392 WeakPolarHBondContact O-CB 3.43Å; L388-R392 VanDerWaalsContact O-CG 3.32Å; L388-R392 WeakPolarHBondContact O-CG 3.44Å; L388-R392 PolarHBondContact O-N 2.91Å; L388-I529 HydrophobicContact CD1-CB 4.35Å; L388-I529 HydrophobicContact CD1-CG1 4.41Å; L388-I529 HydrophobicContact CD1-CG2 3.88Å; L388-L532 HydrophobicContact CB-CB 4.41Å; L388-L532 HydrophobicContact CB-CD1 4.32Å; L388-L532 HydrophobicContact CD1-CB 4.15Å; L388-E533 HydrophobicContact CD1-CG 3.79Å; L388-E533 HydrophobicContact CD2-CG 3.87Å
389	R	93	Very high	92.3	Very high	120 Å²	120	73.9 Å²	73.9	45%	0.453	35%	0.353	S	S	.	.	H	α-helix	trans	-69.2	-30.3	174.2	-77.9	178.8	-71.1	176.8	-4.3	112.7	L385 V386 E387 R393	L385-R389 WeakPolarHBondContact O-CG 3.4Å; L385-R389 PolarHBondContact O-N 3.48Å; L385-R389 PolarHBondContact O-NE 3.49Å; V386-R389 VanDerWaalsContact CG2-NH2 3.32Å; V386-R389 PolarHBondContact O-N 2.85Å; E387-R389 VanDerWaalsContact C-N 3.27Å; E387-R389 PolarHBondContact O-N 3.14Å; R389-R393 WeakPolarHBondContact O-CD 3.45Å; R389-R393 VanDerWaalsContact O-CG 3.25Å; R389-R393 WeakPolarHBondContact O-CG 3.39Å; R389-R393 PolarHBondContact O-N 3.49Å
390	Q	95.1	Very high	92.6	Very high	122 Å²	122	73 Å²	73	57%	0.57	35%	0.352	S	S	*	.	H	α-helix	trans	-73.8	-45.4	173.8	-64.7	-180	37.3	0	0	111.3	V386 E387 L388 R393 R394	V386-Q390 WeakPolarHBondContact O-CG 3.3Å; V386-Q390 PolarHBondContact O-N 3.29Å; E387-Q390 CarbonylContact O-C 3.57Å; E387-Q390 WeakPolarHBondContact O-CA 3.47Å; E387-Q390 WeakPolarHBondContact O-CB 3.37Å; E387-Q390 PolarHBondContact O-N 2.9Å; L388-Q390 VanDerWaalsContact C-N 3.35Å; Q390-R393 PolarHBondContact O-N 3.27Å; Q390-R394 PolarHBondContact O-N 2.8Å
391	C	94.5	Very high	92.9	Very high	18 Å²	18	74.6 Å²	74.6	12%	0.122	35%	0.351	C	S	.	.	H	α-helix	trans	-61.8	-46.1	177.5	-65.2	0	0	0	0	112.1	E387 R393 R394 A395 V525 I529 L532	E387-C391 PolarHBondContact O-N 3.22Å; C391-R393 PolarHBondContact O-N 2.83Å; C391-R394 WeakPolarHBondContact O-CB 3.39Å; C391-R394 PolarHBondContact O-N 3.37Å; C391-A395 PolarHBondContact O-N 2.64Å; C391-V525 HydrophobicContact CB-CG1 4.29Å; C391-V525 WeakPolarHBondContact O-CG1 3.25Å; C391-I529 HydrophobicContact CB-CD1 4.37Å; C391-I529 HydrophobicContact CB-CG1 3.66Å; C391-L532 HydrophobicContact CB-CD1 4.36Å
392	R	94.6	Very high	93.2	Very high	104 Å²	104	74.8 Å²	74.8	39%	0.392	35%	0.351	S	S	.	.	H	α-helix	trans	-56.9	-48.5	174.9	-73.7	175.5	177.1	-174.3	0.7	111.8	L388 R394 A395 D396 I529 E533	L388-R392 HydrophobicContact CD1-CG 4.4Å; L388-R392 WeakPolarHBondContact O-CB 3.43Å; L388-R392 VanDerWaalsContact O-CG 3.32Å; L388-R392 WeakPolarHBondContact O-CG 3.44Å; L388-R392 PolarHBondContact O-N 2.91Å; R392-R394 VanDerWaalsContact C-N 3.27Å; R392-R394 PolarHBondContact O-N 3.29Å; R392-A395 WeakPolarHBondContact O-CB 3.39Å; R392-A395 PolarHBondContact O-N 2.89Å; R392-A395 VanDerWaalsContact O-N 3.11Å; R392-D396 PolarHBondContact O-N 2.85Å; R392-I529 HydrophobicContact CG-CD1 3.91Å; R392-I529 HydrophobicContact CG-CG1 4.19Å; R392-E533 IonicContact CZ-OE1 2.64Å; R392-E533 IonicContact NE-OE1 3.97Å; R392-E533 IonicContact NH2-OE1 2.75Å; R392-E533 PolarHBondContact NH2-OE1 2.94Å
393	R	94.7	Very high	93.2	Very high	169 Å²	169	74 Å²	74	64%	0.638	35%	0.346	S	S	*	.	H	α-helix	trans	-59	-33.5	173.8	-74.4	172.5	177.5	177.8	-0.2	113.3	R389 Q390 C391 N397	R389-R393 WeakPolarHBondContact O-CD 3.45Å; R389-R393 VanDerWaalsContact O-CG 3.25Å; R389-R393 WeakPolarHBondContact O-CG 3.39Å; R389-R393 PolarHBondContact O-N 3.49Å; Q390-R393 PolarHBondContact O-N 3.27Å; C391-R393 PolarHBondContact O-N 2.83Å; R393-N397 PolarHBondContact O-N 2.91Å; R393-N397 PolarHBondContact O-ND2 3.37Å
394	R	95.4	Very high	93.1	Very high	127 Å²	127	76.1 Å²	76.1	48%	0.479	35%	0.349	S	S	.	.	H	α-helix	trans	-69.7	-43.7	175.2	-172.2	174.4	175.8	-171	-0.9	110.8	Q390 C391 R392 D396 N397 L398 E521 V525	Q390-R394 PolarHBondContact O-N 2.8Å; C391-R394 WeakPolarHBondContact O-CB 3.39Å; C391-R394 PolarHBondContact O-N 3.37Å; R392-R394 VanDerWaalsContact C-N 3.27Å; R392-R394 PolarHBondContact O-N 3.29Å; R394-D396 PolarHBondContact O-N 2.86Å; R394-N397 PolarHBondContact O-N 2.9Å; R394-L398 HydrophobicContact CG-CD1 4.05Å; R394-L398 VanDerWaalsContact O-CG 3.3Å; R394-L398 WeakPolarHBondContact O-CG 3.37Å; R394-L398 PolarHBondContact O-N 3.28Å; R394-E521 IonicContact CZ-OE1 3.8Å; R394-E521 VanDerWaalsContact CZ-OE1 3.26Å; R394-E521 IonicContact NE-OE1 3.67Å; R394-E521 PolarHBondContact NE-OE1 2.8Å; R394-E521 IonicContact NH2-OE1 3.75Å; R394-E521 PolarHBondContact NH2-OE1 2.82Å; R394-V525 HydrophobicContact CB-CG1 4.21Å; R394-V525 HydrophobicContact CB-CG2 4.49Å; R394-V525 HydrophobicContact CG-CG2 3.98Å
395	A	93.3	Very high	93	Very high	12 Å²	12	75.3 Å²	75.3	10%	0.099	35%	0.345	C	S	.	.	H	α-helix	trans	-58	-45.4	174.2	0	0	0	0	0	111.9	C391 R392 N397 L398 V399 L522 V525 I529	C391-A395 PolarHBondContact O-N 2.64Å; R392-A395 WeakPolarHBondContact O-CB 3.39Å; R392-A395 PolarHBondContact O-N 2.89Å; R392-A395 VanDerWaalsContact O-N 3.11Å; A395-N397 VanDerWaalsContact C-N 3.32Å; A395-N397 PolarHBondContact O-N 3.1Å; A395-L398 PolarHBondContact O-N 2.85Å; A395-L398 VanDerWaalsContact O-N 3.12Å; A395-V399 WeakPolarHBondContact O-CG2 3.34Å; A395-V399 PolarHBondContact O-N 2.93Å; A395-L522 HydrophobicContact CB-CD1 3.78Å; A395-V525 HydrophobicContact CB-CG1 3.96Å; A395-I529 HydrophobicContact CB-CD1 4.13Å
396	D	92.3	Very high	93	Very high	94 Å²	94	76.7 Å²	76.7	50%	0.503	35%	0.35	S	S	.	.	H	α-helix	trans	-57	-44.3	176.2	-62.3	-39	0	0	0	112	R392 R394 L398 N400	R392-D396 PolarHBondContact O-N 2.85Å; R394-D396 PolarHBondContact O-N 2.86Å; D396-L398 VanDerWaalsContact C-N 3.34Å; D396-L398 PolarHBondContact O-N 2.84Å; D396-N400 WeakPolarHBondContact O-CB 3.4Å; D396-N400 PolarHBondContact O-N 3.28Å; D396-N400 PolarHBondContact O-ND2 3.39Å
397	N	94.8	Very high	92.7	Very high	115 Å²	115	80 Å²	80	62%	0.615	36%	0.359	S	S	*	.	H	α-helix	trans	-66.2	-34.7	177.9	-79.3	-64.2	0	0	0	112.6	R393 R394 A395 N400 R401	R393-N397 PolarHBondContact O-N 2.91Å; R393-N397 PolarHBondContact O-ND2 3.37Å; R394-N397 PolarHBondContact O-N 2.9Å; A395-N397 VanDerWaalsContact C-N 3.32Å; A395-N397 PolarHBondContact O-N 3.1Å; N397-N400 PolarHBondContact O-N 3.17Å; N397-R401 PolarHBondContact O-N 3.07Å
398	L	95.3	Very high	92.5	Very high	6 Å²	6	80.8 Å²	80.8	3%	0.031	36%	0.363	C	S	.	.	H	α-helix	trans	-73.9	-42.2	178.6	-66.7	168.9	0	0	0	112.1	R394 A395 D396 N400 R401 I402 T518 E521 L522 V525	R394-L398 HydrophobicContact CG-CD1 4.05Å; R394-L398 VanDerWaalsContact O-CG 3.3Å; R394-L398 WeakPolarHBondContact O-CG 3.37Å; R394-L398 PolarHBondContact O-N 3.28Å; A395-L398 PolarHBondContact O-N 2.85Å; A395-L398 VanDerWaalsContact O-N 3.12Å; D396-L398 VanDerWaalsContact C-N 3.34Å; D396-L398 PolarHBondContact O-N 2.84Å; L398-N400 VanDerWaalsContact C-N 3.27Å; L398-N400 PolarHBondContact O-N 2.69Å; L398-R401 VanDerWaalsContact CD2-NH1 3.33Å; L398-R401 WeakPolarHBondContact O-CA 3.41Å; L398-R401 WeakPolarHBondContact O-CB 3.28Å; L398-R401 PolarHBondContact O-N 3.25Å; L398-I402 WeakPolarHBondContact O-CG1 3.38Å; L398-I402 PolarHBondContact O-N 2.9Å; L398-T518 HydrophobicContact CB-CG2 4.21Å; L398-T518 HydrophobicContact CD2-CG2 3.96Å; L398-E521 HydrophobicContact CD1-CB 4.01Å; L398-E521 HydrophobicContact CD1-CG 3.73Å; L398-E521 HydrophobicContact CD2-CB 4.23Å; L398-E521 HydrophobicContact CD2-CG 4.1Å; L398-E521 VanDerWaalsContact CD2-OE2 3.22Å; L398-E521 WeakPolarHBondContact CD2-OE2 2.97Å; L398-L522 HydrophobicContact CB-CB 4.27Å; L398-L522 HydrophobicContact CB-CD1 4.27Å; L398-L522 HydrophobicContact CD1-CB 4.44Å; L398-V525 HydrophobicContact CD1-CG2 4.16Å
399	V	93.2	Very high	92.4	Very high	51 Å²	51	83 Å²	83	31%	0.309	37%	0.37	S	S	.	.	H	α-helix	trans	-57.8	-42.2	170.5	172.1	0	0	0	0	110.7	A395 R401 I402 I403 L522	A395-V399 WeakPolarHBondContact O-CG2 3.34Å; A395-V399 PolarHBondContact O-N 2.93Å; V399-R401 VanDerWaalsContact C-N 3.26Å; V399-R401 PolarHBondContact O-N 3.32Å; V399-I402 PolarHBondContact O-N 3.06Å; V399-I403 HydrophobicContact CG1-CD1 3.69Å; V399-I403 HydrophobicContact CG1-CG1 4.46Å; V399-I403 WeakPolarHBondContact O-CB 3.37Å; V399-I403 VanDerWaalsContact O-CG1 3.3Å; V399-I403 WeakPolarHBondContact O-CG1 3.26Å; V399-I403 PolarHBondContact O-N 3.26Å; V399-L522 HydrophobicContact CG2-CD1 4Å; V399-L522 HydrophobicContact CG2-CD2 3.71Å
400	N	91.9	Very high	91.8	Very high	96 Å²	96	80.5 Å²	80.5	51%	0.513	37%	0.37	S	S	.	.	H	α-helix	trans	-69.9	-16.2	173.9	-79.7	-78.4	0	0	0	114.4	D396 N397 L398 R404	D396-N400 WeakPolarHBondContact O-CB 3.4Å; D396-N400 PolarHBondContact O-N 3.28Å; D396-N400 PolarHBondContact O-ND2 3.39Å; N397-N400 PolarHBondContact O-N 3.17Å; L398-N400 VanDerWaalsContact C-N 3.27Å; L398-N400 PolarHBondContact O-N 2.69Å; N400-R404 PolarHBondContact O-NH1 3.11Å
401	R	93.9	Very high	91.3	Very high	86 Å²	86	79.7 Å²	79.7	33%	0.325	37%	0.373	S	S	.	.	H	α-helix	trans	-81	-48.1	171	-174.4	169.5	106.8	-154.1	2.1	110.1	N397 L398 V399 R404 T405 T518 E521	N397-R401 PolarHBondContact O-N 3.07Å; L398-R401 VanDerWaalsContact CD2-NH1 3.33Å; L398-R401 WeakPolarHBondContact O-CA 3.41Å; L398-R401 WeakPolarHBondContact O-CB 3.28Å; L398-R401 PolarHBondContact O-N 3.25Å; V399-R401 VanDerWaalsContact C-N 3.26Å; V399-R401 PolarHBondContact O-N 3.32Å; R401-R404 PolarHBondContact O-N 3.21Å; R401-R404 VanDerWaalsContact O-N 3.16Å; R401-T405 PolarHBondContact O-N 3.21Å; R401-T405 PolarHBondContact O-OG1 3.09Å; R401-T518 HydrophobicContact CB-CG2 3.87Å; R401-T518 HydrophobicContact CG-CG2 3.93Å; R401-T518 VanDerWaalsContact CZ-OG1 3.23Å; R401-T518 VanDerWaalsContact NE-CG2 3.34Å; R401-T518 PolarHBondContact NE-OG1 3.01Å; R401-T518 VanDerWaalsContact NH2-CA 3.29Å; R401-T518 PolarHBondContact NH2-OG1 2.83Å; R401-E521 IonicContact CZ-OE2 3.14Å; R401-E521 IonicContact NH1-OE2 2.82Å; R401-E521 PolarHBondContact NH1-OE2 3.37Å; R401-E521 IonicContact NH2-OE2 2.82Å; R401-E521 PolarHBondContact NH2-OE2 2.95Å
402	I	92.1	Very high	90.9	Very high	21 Å²	21	80.3 Å²	80.3	11%	0.108	38%	0.375	C	S	.	.	H	α-helix	trans	-53	-57.7	173.6	-64.6	172.8	0	0	0	110.5	L398 V399 R404 T405 E406 L515 T518 L522	L398-I402 WeakPolarHBondContact O-CG1 3.38Å; L398-I402 PolarHBondContact O-N 2.9Å; V399-I402 PolarHBondContact O-N 3.06Å; I402-R404 PolarHBondContact O-N 2.8Å; I402-T405 PolarHBondContact O-N 3.06Å; I402-E406 HydrophobicContact CG2-CG 4Å; I402-E406 VanDerWaalsContact CG2-OE1 3.28Å; I402-E406 WeakPolarHBondContact CG2-OE1 3.49Å; I402-E406 WeakPolarHBondContact O-CG 3.42Å; I402-E406 PolarHBondContact O-N 3.43Å; I402-L515 HydrophobicContact CG2-CD2 4.11Å; I402-T518 HydrophobicContact CD1-CG2 4.16Å; I402-T518 HydrophobicContact CG1-CG2 3.49Å; I402-T518 VanDerWaalsContact CG1-CG2 3.49Å; I402-L522 HydrophobicContact CD1-CD2 3.77Å
403	I	88.7	Confident	90.2	Very high	66 Å²	66	78.5 Å²	78.5	34%	0.338	37%	0.372	S	S	.	.	H	α-helix	trans	-58.4	-23.9	-178.6	-67.2	168.7	0	0	0	113.2	V399 E406 K407	V399-I403 HydrophobicContact CG1-CD1 3.69Å; V399-I403 HydrophobicContact CG1-CG1 4.46Å; V399-I403 WeakPolarHBondContact O-CB 3.37Å; V399-I403 VanDerWaalsContact O-CG1 3.3Å; V399-I403 WeakPolarHBondContact O-CG1 3.26Å; V399-I403 PolarHBondContact O-N 3.26Å; I403-E406 WeakPolarHBondContact CA-OE2 3.29Å; I403-K407 VanDerWaalsContact O-CD 3.25Å; I403-K407 WeakPolarHBondContact O-CD 3.33Å; I403-K407 WeakPolarHBondContact O-CG 3.44Å
404	R	90.5	Very high	89.5	Confident	156 Å²	156	74.7 Å²	74.7	59%	0.589	37%	0.367	S	S	*	.	H	α-helix	trans	-79.8	-49	173.1	-179.4	-177.7	-77.2	98.4	-6.5	110.8	N400 R401 I402 K407 Q408	N400-R404 PolarHBondContact O-NH1 3.11Å; R401-R404 PolarHBondContact O-N 3.21Å; R401-R404 VanDerWaalsContact O-N 3.16Å; I402-R404 PolarHBondContact O-N 2.8Å; R404-K407 PolarHBondContact O-N 3.46Å; R404-Q408 WeakPolarHBondContact O-CG 3.45Å; R404-Q408 PolarHBondContact O-N 3.19Å
405	T	90.2	Very high	88.8	Confident	9 Å²	9	73.4 Å²	73.4	6%	0.055	37%	0.365	C	S	.	.	H	α-helix	trans	-64.9	-41.9	-178.4	-53	0	0	0	0	112	R401 I402 K407 Q408 R409 F511 V514 L515	R401-T405 PolarHBondContact O-N 3.21Å; R401-T405 PolarHBondContact O-OG1 3.09Å; I402-T405 PolarHBondContact O-N 3.06Å; T405-K407 VanDerWaalsContact C-N 3.26Å; T405-K407 PolarHBondContact O-N 3.07Å; T405-Q408 PolarHBondContact O-N 2.96Å; T405-R409 PolarHBondContact O-N 3.43Å; T405-F511 HydrophobicContact CG2-CB 4.07Å; T405-F511 HydrophobicContact CG2-CD1 3.77Å; T405-F511 HydrophobicContact CG2-CG 4.21Å; T405-V514 HydrophobicContact CG2-CB 4.3Å; T405-V514 HydrophobicContact CG2-CG1 3.98Å; T405-L515 HydrophobicContact CG2-CD1 4.38Å; T405-L515 HydrophobicContact CG2-CD2 3.96Å; T405-L515 HydrophobicContact CG2-CG 3.75Å
406	E	90.3	Very high	88	Confident	91 Å²	91	73.8 Å²	73.8	43%	0.425	37%	0.368	S	S	.	.	H	α-helix	trans	-53.8	-42.6	173.6	-70.5	171.1	156.8	0	0	112.1	I402 I403 R409 C410 L515	I402-E406 HydrophobicContact CG2-CG 4Å; I402-E406 VanDerWaalsContact CG2-OE1 3.28Å; I402-E406 WeakPolarHBondContact CG2-OE1 3.49Å; I402-E406 WeakPolarHBondContact O-CG 3.42Å; I402-E406 PolarHBondContact O-N 3.43Å; I403-E406 WeakPolarHBondContact CA-OE2 3.29Å; E406-R409 WeakPolarHBondContact O-CB 3.33Å; E406-R409 PolarHBondContact O-N 3.43Å; E406-C410 VanDerWaalsContact O-CB 3.31Å; E406-C410 WeakPolarHBondContact O-CB 3.27Å; E406-C410 PolarHBondContact O-N 2.82Å; E406-L515 HydrophobicContact CG-CD2 3.79Å
407	K	87.4	Confident	87.1	Confident	135 Å²	135	73.7 Å²	73.7	59%	0.587	37%	0.368	S	S	*	.	H	α-helix	trans	-70.2	-32	178.6	-71.2	172.5	-172.9	166.9	0	112.5	I403 R404 T405 V411	I403-K407 VanDerWaalsContact O-CD 3.25Å; I403-K407 WeakPolarHBondContact O-CD 3.33Å; I403-K407 WeakPolarHBondContact O-CG 3.44Å; R404-K407 PolarHBondContact O-N 3.46Å; T405-K407 VanDerWaalsContact C-N 3.26Å; T405-K407 PolarHBondContact O-N 3.07Å; K407-V411 WeakPolarHBondContact O-CB 3.32Å; K407-V411 VanDerWaalsContact O-CG2 3.25Å; K407-V411 WeakPolarHBondContact O-CG2 3.35Å; K407-V411 PolarHBondContact O-N 2.86Å
408	Q	89.9	Confident	86.1	Confident	87 Å²	87	69.9 Å²	69.9	41%	0.407	35%	0.35	S	S	.	.	H	α-helix	trans	-70.9	-40.6	173.8	-65.6	179.6	-109.9	0	0	111.3	R404 T405 L412 F511	R404-Q408 WeakPolarHBondContact O-CG 3.45Å; R404-Q408 PolarHBondContact O-N 3.19Å; T405-Q408 PolarHBondContact O-N 2.96Å; Q408-L412 PolarHBondContact O-N 3Å; Q408-L412 VanDerWaalsContact O-N 3.13Å; Q408-F511 HydrophobicContact CB-CE1 3.88Å; Q408-F511 HydrophobicContact CB-CE2 3.87Å; Q408-F511 HydrophobicContact CB-CZ 3.54Å; Q408-F511 HydrophobicContact CG-CZ 4.48Å
409	R	88.5	Confident	84.9	Confident	58 Å²	58	71.1 Å²	71.1	22%	0.219	36%	0.357	C	S	.	.	H	α-helix	trans	-59.8	-53.4	172.6	-170.7	-143	-172.2	84	22.9	111.9	T405 E406 V411 L412 E413 F511 D512	T405-R409 PolarHBondContact O-N 3.43Å; E406-R409 WeakPolarHBondContact O-CB 3.33Å; E406-R409 PolarHBondContact O-N 3.43Å; R409-V411 VanDerWaalsContact C-N 3.29Å; R409-V411 PolarHBondContact O-N 2.85Å; R409-L412 WeakPolarHBondContact O-CA 3.45Å; R409-L412 WeakPolarHBondContact O-CB 3.18Å; R409-L412 PolarHBondContact O-N 2.85Å; R409-E413 WeakPolarHBondContact CD-OE1 3.35Å; R409-E413 HydrophobicContact CG-CG 4.47Å; R409-E413 IonicContact CZ-OE1 3.26Å; R409-E413 IonicContact NE-OE1 2.7Å; R409-E413 PolarHBondContact NE-OE1 3.05Å; R409-E413 IonicContact NE-OE2 3.48Å; R409-E413 IonicContact NH2-OE1 2.64Å; R409-E413 WeakPolarHBondContact O-CG 3.21Å; R409-E413 PolarHBondContact O-N 2.97Å; R409-F511 HydrophobicContact CB-CB 4.35Å; R409-F511 HydrophobicContact CB-CD2 4.31Å; R409-D512 IonicContact CZ-OD1 3.63Å; R409-D512 IonicContact CZ-OD2 3.49Å; R409-D512 IonicContact NH1-OD1 2.77Å; R409-D512 PolarHBondContact NH1-OD1 2.84Å; R409-D512 IonicContact NH1-OD2 2.68Å; R409-D512 PolarHBondContact NH1-OD2 2.92Å; R409-D512 IonicContact NH2-OD1 3.23Å; R409-D512 PolarHBondContact NH2-OD1 3.06Å; R409-D512 IonicContact NH2-OD2 3.78Å; R409-D512 PolarHBondContact NH2-OD2 2.86Å
410	C	81.8	Confident	83.6	Confident	67 Å²	67	71.5 Å²	71.5	45%	0.453	36%	0.362	S	S	.	.	H	α-helix	trans	-58.8	-37.6	-179.8	176.2	0	0	0	0	112.7	E406 T414	E406-C410 VanDerWaalsContact O-CB 3.31Å; E406-C410 WeakPolarHBondContact O-CB 3.27Å; E406-C410 PolarHBondContact O-N 2.82Å; C410-T414 VanDerWaalsContact O-CB 3.3Å; C410-T414 WeakPolarHBondContact O-CB 3.43Å; C410-T414 PolarHBondContact O-N 2.87Å; C410-T414 PolarHBondContact O-OG1 3.05Å
411	V	84.4	Confident	82	Confident	105 Å²	105	73.6 Å²	73.6	64%	0.636	36%	0.362	S	S	*	.	H	α-helix	trans	-66.5	-37.9	173.5	167	0	0	0	0	112	K407 R409 F415	K407-V411 WeakPolarHBondContact O-CB 3.32Å; K407-V411 VanDerWaalsContact O-CG2 3.25Å; K407-V411 WeakPolarHBondContact O-CG2 3.35Å; K407-V411 PolarHBondContact O-N 2.86Å; R409-V411 VanDerWaalsContact C-N 3.29Å; R409-V411 PolarHBondContact O-N 2.85Å; V411-F415 WeakPolarHBondContact O-CB 3.27Å; V411-F415 PolarHBondContact O-N 2.56Å; V411-F415 VanDerWaalsContact O-N 3.1Å
412	L	84.9	Confident	80.2	Confident	31 Å²	31	74.8 Å²	74.8	16%	0.162	37%	0.367	C	S	.	.	H	α-helix	trans	-67.6	-45.6	176.9	-174.1	63.4	0	0	0	111.4	Q408 R409 F415 A416 Y504 E507 A508 F511	Q408-L412 PolarHBondContact O-N 3Å; Q408-L412 VanDerWaalsContact O-N 3.13Å; R409-L412 WeakPolarHBondContact O-CA 3.45Å; R409-L412 WeakPolarHBondContact O-CB 3.18Å; R409-L412 PolarHBondContact O-N 2.85Å; L412-F415 PolarHBondContact O-N 3.12Å; L412-A416 PolarHBondContact O-N 3.41Å; L412-A416 VanDerWaalsContact O-N 3.09Å; L412-Y504 HydrophobicContact CD1-CD2 3.76Å; L412-Y504 HydrophobicContact CD1-CE2 4.3Å; L412-Y504 HydrophobicContact CD2-CD2 4.26Å; L412-Y504 HydrophobicContact CD2-CE2 4.39Å; L412-Y504 HydrophobicContact CG-CD2 3.65Å; L412-Y504 HydrophobicContact CG-CE2 3.72Å; L412-E507 HydrophobicContact CD2-CB 4.04Å; L412-E507 HydrophobicContact CD2-CG 4.26Å; L412-A508 HydrophobicContact CD2-CB 4.07Å; L412-F511 HydrophobicContact CD2-CD2 4.08Å; L412-F511 HydrophobicContact CD2-CE2 4.04Å
413	E	80.6	Confident	78.2	Confident	67 Å²	67	79 Å²	79	31%	0.313	39%	0.386	S	S	.	.	H	α-helix	trans	-60.4	-49.4	175	-69.7	166.8	151.7	0	0	111.4	R409 F415 A416 D417	R409-E413 WeakPolarHBondContact CD-OE1 3.35Å; R409-E413 HydrophobicContact CG-CG 4.47Å; R409-E413 IonicContact CZ-OE1 3.26Å; R409-E413 IonicContact NE-OE1 2.7Å; R409-E413 PolarHBondContact NE-OE1 3.05Å; R409-E413 IonicContact NE-OE2 3.48Å; R409-E413 IonicContact NH2-OE1 2.64Å; R409-E413 WeakPolarHBondContact O-CG 3.21Å; R409-E413 PolarHBondContact O-N 2.97Å; E413-F415 PolarHBondContact O-N 3.3Å; E413-A416 PolarHBondContact O-N 2.73Å; E413-D417 PolarHBondContact O-N 3.23Å
414	T	80.8	Confident	76.1	Confident	89 Å²	89	80.9 Å²	80.9	55%	0.546	40%	0.397	S	S	.	.	H	α-helix	trans	-56.8	-35.4	175.9	-57	0	0	0	0	111.9	C410 S418	C410-T414 VanDerWaalsContact O-CB 3.3Å; C410-T414 WeakPolarHBondContact O-CB 3.43Å; C410-T414 PolarHBondContact O-N 2.87Å; C410-T414 PolarHBondContact O-OG1 3.05Å; T414-S418 WeakPolarHBondContact O-CB 3.3Å; T414-S418 PolarHBondContact O-N 3.41Å; T414-S418 VanDerWaalsContact O-N 3.07Å
415	F	79.7	Confident	74	Confident	100 Å²	100	79.7 Å²	79.7	44%	0.439	40%	0.398	S	S	.	.	H	α-helix	trans	-71.7	-37.9	177.3	-173	-95.8	0	0	0	112.4	V411 L412 E413 S418 L419 F500	V411-F415 WeakPolarHBondContact O-CB 3.27Å; V411-F415 PolarHBondContact O-N 2.56Å; V411-F415 VanDerWaalsContact O-N 3.1Å; L412-F415 PolarHBondContact O-N 3.12Å; E413-F415 PolarHBondContact O-N 3.3Å; F415-S418 WeakPolarHBondContact O-CB 3.44Å; F415-S418 PolarHBondContact O-N 3.34Å; F415-S418 PolarHBondContact O-OG 3.09Å; F415-L419 HydrophobicContact CD1-CD1 3.93Å; F415-L419 HydrophobicContact CE1-CD1 3.58Å; F415-L419 HydrophobicContact CE1-CG 4.36Å; F415-L419 HydrophobicContact CZ-CD1 4.37Å; F415-L419 PolarHBondContact O-N 2.92Å; F415-F500 AromaticContact CD1-CE2 3.81Å; F415-F500 HydrophobicContact CD1-CE2 3.81Å; F415-F500 AromaticContact CD1-CZ 3.57Å; F415-F500 HydrophobicContact CD1-CZ 3.57Å; F415-F500 HydrophobicContact CE1-CD2 4.26Å; F415-F500 HydrophobicContact CE1-CE1 4.43Å; F415-F500 AromaticContact CE1-CE2 3.51Å; F415-F500 HydrophobicContact CE1-CE2 3.51Å; F415-F500 AromaticContact CE1-CZ 3.62Å; F415-F500 HydrophobicContact CE1-CZ 3.62Å
416	A	76.5	Confident	71.9	Confident	20 Å²	20	84.8 Å²	84.8	17%	0.165	42%	0.423	C	S	.	.	H	α-helix	trans	-67.2	-41.9	174.4	0	0	0	0	0	112.5	L412 E413 S418 L419 S420 Y504	L412-A416 PolarHBondContact O-N 3.41Å; L412-A416 VanDerWaalsContact O-N 3.09Å; E413-A416 PolarHBondContact O-N 2.73Å; A416-S418 PolarHBondContact O-N 2.97Å; A416-L419 WeakPolarHBondContact O-CA 3.47Å; A416-L419 WeakPolarHBondContact O-CB 3.49Å; A416-L419 PolarHBondContact O-N 2.99Å; A416-S420 PolarHBondContact O-N 2.95Å; A416-Y504 HydrophobicContact CB-CD2 3.88Å; A416-Y504 HydrophobicContact CB-CE2 3.39Å
417	D	74.7	Confident	69.6	Low	92 Å²	92	87.1 Å²	87.1	49%	0.492	44%	0.438	S	S	.	.	H	α-helix	trans	-60.3	-33.2	170.8	-85.7	-9	0	0	0	112.1	E413 L419 S420 R421	E413-D417 PolarHBondContact O-N 3.23Å; D417-L419 PolarHBondContact O-N 3.19Å; D417-S420 PolarHBondContact O-OG 2.97Å; D417-R421 VanDerWaalsContact O-CG 3.3Å; D417-R421 WeakPolarHBondContact O-CG 3.39Å; D417-R421 PolarHBondContact O-N 3.22Å
418	S	73	Confident	67.4	Low	34 Å²	34	87.8 Å²	87.8	24%	0.238	45%	0.448	C	S	.	.	H	α-helix	trans	-68.6	-21	173.7	93.3	0	0	0	0	113.4	T414 F415 A416 R422	T414-S418 WeakPolarHBondContact O-CB 3.3Å; T414-S418 PolarHBondContact O-N 3.41Å; T414-S418 VanDerWaalsContact O-N 3.07Å; F415-S418 WeakPolarHBondContact O-CB 3.44Å; F415-S418 PolarHBondContact O-N 3.34Å; F415-S418 PolarHBondContact O-OG 3.09Å; A416-S418 PolarHBondContact O-N 2.97Å; S418-R422 WeakPolarHBondContact O-CG 3.13Å; S418-R422 PolarHBondContact O-NE 3.05Å; S418-R422 VanDerWaalsContact O-NE 3.17Å; S418-R422 PolarHBondContact O-NH1 3.09Å; S418-R422 PolarHBondContact O-NH2 3.2Å; S418-R422 PolarHBondContact OG-NH2 3.23Å
419	L	69.6	Low	64.7	Low	33 Å²	33	86.8 Å²	86.8	17%	0.173	46%	0.461	C	S	.	.	H	α-helix	trans	-89	-47.2	178.2	-79.3	162.7	0	0	0	111.6	F415 A416 D417 R421 R422 F500	F415-L419 HydrophobicContact CD1-CD1 3.93Å; F415-L419 HydrophobicContact CE1-CD1 3.58Å; F415-L419 HydrophobicContact CE1-CG 4.36Å; F415-L419 HydrophobicContact CZ-CD1 4.37Å; F415-L419 PolarHBondContact O-N 2.92Å; A416-L419 WeakPolarHBondContact O-CA 3.47Å; A416-L419 WeakPolarHBondContact O-CB 3.49Å; A416-L419 PolarHBondContact O-N 2.99Å; D417-L419 PolarHBondContact O-N 3.19Å; L419-R421 VanDerWaalsContact C-N 3.34Å; L419-R421 PolarHBondContact O-N 2.7Å; L419-R422 VanDerWaalsContact CD2-NH1 3.31Å; L419-R422 WeakPolarHBondContact O-CB 3.48Å; L419-R422 PolarHBondContact O-N 2.93Å; L419-F500 HydrophobicContact CD1-CD1 3.62Å; L419-F500 HydrophobicContact CD1-CE1 3.24Å; L419-F500 HydrophobicContact CD1-CE2 4.44Å; L419-F500 HydrophobicContact CD1-CG 4.38Å; L419-F500 HydrophobicContact CD1-CZ 3.72Å
420	S	67.1	Low	61.9	Low	59 Å²	59	87.7 Å²	87.7	41%	0.413	49%	0.488	S	S	.	.	H	α-helix	trans	-58.2	-44.6	179.5	58.7	0	0	0	0	112	A416 D417 R422 E423	A416-S420 PolarHBondContact O-N 2.95Å; D417-S420 PolarHBondContact O-OG 2.97Å; S420-R422 PolarHBondContact O-N 2.95Å; S420-R422 VanDerWaalsContact O-N 3.15Å; S420-E423 PolarHBondContact O-N 3.1Å; S420-E423 VanDerWaalsContact O-N 3.12Å
421	R	58.2	Low	59.4	Low	139 Å²	139	89.5 Å²	89.5	53%	0.525	50%	0.501	S	S	.	.	H	α-helix	trans	-57.7	-28.2	175.9	-68.5	-179.9	-170.4	-148.6	5.1	113.6	D417 L419 E425 D1142	D417-R421 VanDerWaalsContact O-CG 3.3Å; D417-R421 WeakPolarHBondContact O-CG 3.39Å; D417-R421 PolarHBondContact O-N 3.22Å; L419-R421 VanDerWaalsContact C-N 3.34Å; L419-R421 PolarHBondContact O-N 2.7Å; R421-E425 PolarHBondContact O-N 2.85Å; R421-D1142 IonicContact CZ-OD2 2.68Å; R421-D1142 VanDerWaalsContact CZ-OD2 3.26Å; R421-D1142 IonicContact NH1-OD2 3.04Å; R421-D1142 PolarHBondContact NH1-OD2 3.46Å; R421-D1142 IonicContact NH2-OD2 3.28Å; R421-D1142 PolarHBondContact NH2-OD2 3.43Å
422	R	55.3	Low	56.9	Low	112 Å²	112	92 Å²	92	42%	0.423	51%	0.505	S	S	.	.	H	α-helix	trans	-78.1	-26.2	178.8	-66.4	-179.6	-155.9	114.5	16.2	113.5	S418 L419 S420 I426	S418-R422 WeakPolarHBondContact O-CG 3.13Å; S418-R422 PolarHBondContact O-NE 3.05Å; S418-R422 VanDerWaalsContact O-NE 3.17Å; S418-R422 PolarHBondContact O-NH1 3.09Å; S418-R422 PolarHBondContact O-NH2 3.2Å; S418-R422 PolarHBondContact OG-NH2 3.23Å; L419-R422 VanDerWaalsContact CD2-NH1 3.31Å; L419-R422 WeakPolarHBondContact O-CB 3.48Å; L419-R422 PolarHBondContact O-N 2.93Å; S420-R422 PolarHBondContact O-N 2.95Å; S420-R422 VanDerWaalsContact O-N 3.15Å; R422-I426 WeakPolarHBondContact O-CD1 3.36Å; R422-I426 VanDerWaalsContact O-CG1 3.27Å; R422-I426 WeakPolarHBondContact O-CG1 3.44Å; R422-I426 PolarHBondContact O-N 2.99Å
423	E	49.2	Very low	54.4	Low	110 Å²	110	100.6 Å²	100.6	51%	0.514	54%	0.537	S	S	.	.	H	α-helix	trans	-71.9	-37.6	176	-64.9	-162.6	128.5	0	0	111.1	S420 I426 L427	S420-E423 PolarHBondContact O-N 3.1Å; S420-E423 VanDerWaalsContact O-N 3.12Å; E423-I426 PolarHBondContact O-N 3.02Å; E423-L427 WeakPolarHBondContact O-CG 3.44Å; E423-L427 PolarHBondContact O-N 2.82Å
424	D	45	Very low	52.1	Low	105 Å²	105	101.4 Å²	101.4	56%	0.561	56%	0.564	S	S	*	*	H	α-helix	trans	-62.7	-41.7	172.8	-86.3	-30.1	0	0	0	112.4	I426 L427 L428	D424-I426 VanDerWaalsContact C-N 3.33Å; D424-I426 PolarHBondContact O-N 3.29Å; D424-L427 PolarHBondContact O-N 2.86Å; D424-L428 WeakPolarHBondContact O-CB 3.42Å; D424-L428 PolarHBondContact O-N 3.06Å; D424-L428 VanDerWaalsContact O-N 3.1Å
425	E	46.8	Very low	49.8	Very low	130 Å²	130	105.5 Å²	105.5	61%	0.607	58%	0.576	S	S	*	*	H	α-helix	trans	-58.8	-43.3	173	-76.8	-165.2	109	0	0	112.2	R421 L427 L428 G429	R421-E425 PolarHBondContact O-N 2.85Å; E425-L427 VanDerWaalsContact C-N 3.35Å; E425-L428 PolarHBondContact O-N 2.93Å; E425-G429 PolarHBondContact O-N 2.97Å
426	I	46.3	Very low	47.6	Very low	116 Å²	116	107 Å²	107	60%	0.595	59%	0.594	S	S	*	*	H	α-helix	trans	-67.4	-36.2	-179.5	-69.4	167	0	0	0	111.2	R422 E423 D424	R422-I426 WeakPolarHBondContact O-CD1 3.36Å; R422-I426 VanDerWaalsContact O-CG1 3.27Å; R422-I426 WeakPolarHBondContact O-CG1 3.44Å; R422-I426 PolarHBondContact O-N 2.99Å; E423-I426 PolarHBondContact O-N 3.02Å; D424-I426 VanDerWaalsContact C-N 3.33Å; D424-I426 PolarHBondContact O-N 3.29Å
427	L	42.7	Very low	45.3	Very low	141 Å²	141	112.2 Å²	112.2	74%	0.738	62%	0.624	S	S	*	*	H	α-helix	trans	-76.4	-20	178.6	-74.8	166.8	0	0	0	113.9	E423 D424 E425	E423-L427 WeakPolarHBondContact O-CG 3.44Å; E423-L427 PolarHBondContact O-N 2.82Å; D424-L427 PolarHBondContact O-N 2.86Å; E425-L427 VanDerWaalsContact C-N 3.35Å
428	L	39.8	Very low	43.2	Very low	149 Å²	149	116 Å²	116	78%	0.78	64%	0.643	S	S	*	*	H	α-helix	trans	-107.7	-15	-177	-71.1	166.1	0	0	0	115	D424 E425	D424-L428 WeakPolarHBondContact O-CB 3.42Å; D424-L428 PolarHBondContact O-N 3.06Å; D424-L428 VanDerWaalsContact O-N 3.1Å; E425-L428 PolarHBondContact O-N 2.93Å
429	G	34	Very low	41.2	Very low	66 Å²	66	120.9 Å²	120.9	68%	0.68	67%	0.667	S	S	*	*	S	Bend	trans	-85.5	-9.8	-175.4	0	0	0	0	0	117.6	E425 S431	E425-G429 PolarHBondContact O-N 2.97Å; G429-S431 PolarHBondContact O-N 2.83Å
430	G	30.3	Very low	39.3	Very low	77 Å²	77	126.5 Å²	126.5	79%	0.794	70%	0.697	S	S	*	*			trans	-89.3	59.3	-158.4	0	0	0	0	0	118.9
431	S	28.5	Very low	37.5	Very low	105 Å²	105	131.1 Å²	131.1	73%	0.734	72%	0.715	S	S	*	*			trans	-158.3	88.8	170.8	-168.4	0	0	0	0	117.2	G429	G429-S431 PolarHBondContact O-N 2.83Å
432	H	33	Very low	36.1	Very low	156 Å²	156	129.4 Å²	129.4	72%	0.722	72%	0.722	S	S	*	*	S	Bend	trans	-160.5	134.9	149	-111.8	30.5	0	0	0	114.1
433	Y	31.7	Very low	34.8	Very low	213 Å²	213	131 Å²	131	84%	0.835	74%	0.739	S	S	*	*			trans	56.2	103.1	168.8	-55.1	-66	0	0	0	120.1
434	G	32.2	Very low	34	Very low	84 Å²	84	133.4 Å²	133.4	87%	0.866	75%	0.75	S	S	*	*			trans	-175.8	122.2	162.2	0	0	0	0	0	111.4
435	H	31.6	Very low	33.3	Very low	175 Å²	175	134.5 Å²	134.5	81%	0.81	76%	0.761	S	S	*	*			trans	-124.4	110.8	-166.6	172.2	-72.2	0	0	0	112.9
436	T	33.5	Very low	32.5	Very low	132 Å²	132	130 Å²	130	81%	0.81	75%	0.749	S	S	*	*			trans	-174.5	163.2	138.9	17	0	0	0	0	112.2
437	T	29.4	Very low	31.9	Very low	128 Å²	128	129.4 Å²	129.4	79%	0.785	75%	0.751	S	S	*	*			trans	-93.7	141.5	-172.5	51	0	0	0	0	114.3
438	L	31.2	Very low	31.5	Very low	173 Å²	173	128.5 Å²	128.5	91%	0.906	75%	0.751	S	S	*	*			trans	-155.6	156.1	139.5	-111.9	164.7	0	0	0	110.6
439	N	29.2	Very low	31.2	Very low	136 Å²	136	127.5 Å²	127.5	73%	0.727	75%	0.746	S	S	*	*			trans	-102.5	159.8	-162.9	-66.8	-37.2	0	0	0	113.9
440	N	29.7	Very low	31.1	Very low	150 Å²	150	130.9 Å²	130.9	80%	0.802	74%	0.744	S	S	*	*			trans	65.3	94.9	158.7	-60.3	-10.6	0	0	0	118.6
441	I	30	Very low	31.4	Very low	156 Å²	156	132.4 Å²	132.4	80%	0.8	74%	0.738	S	S	*	*			trans	-144.9	140.9	131.6	-87.2	121.2	0	0	0	107.6
442	P	29.4	Very low	31.7	Very low	104 Å²	104	134.7 Å²	134.7	68%	0.675	74%	0.742	S	S	*	*			trans	-76.9	161.6	178.8	-14.3	30.9	0	0	0	114	H444	P442-H444 PolarHBondContact O-N 2.97Å
443	N	26.9	Very low	31.6	Very low	146 Å²	146	133.3 Å²	133.3	78%	0.781	74%	0.74	S	S	*	*			trans	-54	120.6	177.3	-60.1	-2.6	0	0	0	112.6
444	H	32.8	Very low	31.7	Very low	160 Å²	160	129.7 Å²	129.7	74%	0.741	73%	0.734	S	S	*	*			trans	-100.1	41	167.6	-92	-89.3	0	0	0	112.6	P442 G446	P442-H444 PolarHBondContact O-N 2.97Å; H444-G446 VanDerWaalsContact C-N 3.28Å; H444-G446 PolarHBondContact O-N 2.81Å
445	T	31	Very low	31.7	Very low	128 Å²	128	131.9 Å²	131.9	79%	0.785	74%	0.735	S	S	*	*			trans	-72.2	82.2	165.4	50.9	0	0	0	0	109.3
446	G	30.3	Very low	31.7	Very low	36 Å²	36	126.9 Å²	126.9	37%	0.371	72%	0.721	S	S	.	*			trans	-177.1	20.9	-176.7	0	0	0	0	0	116.9	H444	H444-G446 VanDerWaalsContact C-N 3.28Å; H444-G446 PolarHBondContact O-N 2.81Å
447	V	32	Very low	31.6	Very low	102 Å²	102	129.8 Å²	129.8	62%	0.618	73%	0.725	S	S	*	*	S	Bend	trans	-101	-31.3	-179.3	-175.9	0	0	0	0	112.4
448	V	34.1	Very low	31.7	Very low	123 Å²	123	127.3 Å²	127.3	75%	0.745	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-72.5	-36.5	-177.6	-174.2	0	0	0	0	111.9	Q450	V448-Q450 PolarHBondContact O-N 3.04Å
449	D	34.7	Very low	31.6	Very low	128 Å²	128	120.8 Å²	120.8	68%	0.684	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-73.4	-5.5	-179.5	-59.7	-58	0	0	0	114.9
450	Q	32.2	Very low	31.6	Very low	137 Å²	137	118.7 Å²	118.7	64%	0.64	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-102	-11.6	-176.8	-67.8	-164.5	-6.2	0	0	114.7	V448	V448-Q450 PolarHBondContact O-N 3.04Å
451	V	35.5	Very low	31.8	Very low	109 Å²	109	118.8 Å²	118.8	66%	0.661	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-76.5	-39.8	177.9	-177.1	0	0	0	0	111.2	N453	V451-N453 PolarHBondContact O-N 3.26Å
452	N	34.3	Very low	31.7	Very low	152 Å²	152	115.1 Å²	115.1	81%	0.813	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-76.7	14.4	-176.8	-67.9	-14.1	0	0	0	114.9
453	N	32.8	Very low	31.7	Very low	128 Å²	128	114 Å²	114	68%	0.684	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-128	9.4	-174.6	-116.9	-49.3	0	0	0	114.6	V451	V451-N453 PolarHBondContact O-N 3.26Å
454	I	33.5	Very low	31.7	Very low	137 Å²	137	110.4 Å²	110.4	70%	0.703	68%	0.681	S	S	*	*			trans	-123.2	61.6	-175.9	-45.9	-179	0	0	0	111
455	S	31.1	Very low	31.6	Very low	129 Å²	129	109 Å²	109	90%	0.902	68%	0.683	S	S	*	*	S	Bend	trans	-156.6	46.5	172.3	-82.1	0	0	0	0	113.6
456	S	32.5	Very low	31.6	Very low	71 Å²	71	108.9 Å²	108.9	50%	0.497	68%	0.683	S	S	.	*	S	Bend	trans	-139.5	6.5	-179.8	63.2	0	0	0	0	116.4
457	Q	30.9	Very low	32	Very low	192 Å²	192	113.1 Å²	113.1	90%	0.897	70%	0.704	S	S	*	*			trans	-139.6	121.7	175.6	-61.8	-170.2	15.6	0	0	112.3
458	G	31.3	Very low	31.9	Very low	77 Å²	77	113 Å²	113	79%	0.794	71%	0.714	S	S	*	*			trans	140.1	73.9	168	0	0	0	0	0	116.1
459	A	28.6	Very low	31.7	Very low	36 Å²	36	114.9 Å²	114.9	30%	0.298	72%	0.72	S	S	.	*			trans	-128.9	92.8	179.3	0	0	0	0	0	113.7	N701 T703	A459-N701 HydrophobicContact CB-CB 4.09Å; A459-T703 HydrophobicContact CB-CG2 4.43Å
460	T	29.5	Very low	31.5	Very low	92 Å²	92	113.2 Å²	113.2	56%	0.564	72%	0.724	S	S	*	*			trans	-168.3	151.9	158.7	14.6	0	0	0	0	112.2
461	L	33.6	Very low	31.4	Very low	152 Å²	152	115.6 Å²	115.6	80%	0.796	74%	0.735	S	S	*	*			trans	71.5	114.3	176.9	-50.9	169.5	0	0	0	114.4
462	S	29.6	Very low	31	Very low	79 Å²	79	119 Å²	119	55%	0.552	75%	0.746	S	S	*	*				58.6	114.9	62.1	73.9	0	0	0	0	114.3
463	G	27.7	Very low	30.7	Very low	81 Å²	81	116.1 Å²	116.1	84%	0.835	74%	0.743	S	S	*	*			cis	142.9	142.9	-5.9	0	0	0	0	0	112.4
464	G	28.3	Very low	30.6	Very low	70 Å²	70	114.3 Å²	114.3	72%	0.722	75%	0.746	S	S	*	*			trans	155.6	124.9	173	0	0	0	0	0	116.2
465	T	29.6	Very low	30.5	Very low	129 Å²	129	114 Å²	114	79%	0.791	75%	0.751	S	S	*	*			trans	42.2	111.1	144.7	47.6	0	0	0	0	122.3
466	T	31.6	Very low	30.6	Very low	127 Å²	127	114 Å²	114	78%	0.779	75%	0.745	S	S	*	*				78.6	133.3	120.2	-48.1	0	0	0	0	119.1
467	P	38.6	Very low	30.5	Very low	124 Å²	124	114.1 Å²	114.1	81%	0.805	75%	0.751	S	S	*	*			trans	-92.1	161.2	-170	37.4	-37.6	0	0	0	115
468	A	30.5	Very low	30.5	Very low	100 Å²	100	112.7 Å²	112.7	83%	0.826	74%	0.744	S	S	*	*			trans	-149.2	153.9	169.8	0	0	0	0	0	112.8
469	N	29.2	Very low	30.8	Very low	162 Å²	162	116.6 Å²	116.6	87%	0.866	74%	0.741	S	S	*	*			trans	-79.9	151.2	-170.2	-62.6	-37.1	0	0	0	115.4
470	A	30.2	Very low	31	Very low	94 Å²	94	123.5 Å²	123.5	78%	0.777	77%	0.765	S	S	*	*			trans	30.1	116	137.1	0	0	0	0	0	121.4
471	Q	30.5	Very low	30.9	Very low	187 Å²	187	124.4 Å²	124.4	87%	0.874	77%	0.774	S	S	*	*			trans	-155.4	131.6	149.6	-103.5	151	33	0	0	106.2
472	M	27.9	Very low	30.6	Very low	179 Å²	179	124.1 Å²	124.1	88%	0.882	77%	0.771	S	S	*	*			cis	58.4	123.9	48.5	-69.9	-126.7	-66.1	0	0	113.3
473	A	28.2	Very low	30.7	Very low	93 Å²	93	127 Å²	127	77%	0.769	78%	0.78	S	S	*	*			cis	-158.7	-172.1	-2.1	0	0	0	0	0	111.5
474	A	29.5	Very low	31.1	Very low	90 Å²	90	129.8 Å²	129.8	74%	0.744	78%	0.777	S	S	*	*			trans	-25.8	149.7	173.3	0	0	0	0	0	117.2
475	T	31.4	Very low	31.7	Very low	130 Å²	130	133.8 Å²	133.8	80%	0.798	79%	0.786	S	S	*	*				-157.8	171.2	56.5	50.6	0	0	0	0	110.1
476	T	32.8	Very low	32.6	Very low	128 Å²	128	132.9 Å²	132.9	79%	0.785	78%	0.781	S	S	*	*			cis	-155.7	175.2	36.2	-54.6	0	0	0	0	110.6
477	A	31.4	Very low	33.3	Very low	75 Å²	75	130.7 Å²	130.7	62%	0.62	76%	0.764	S	S	*	*			trans	-51.2	169.6	172.5	0	0	0	0	0	114.7
478	E	31.5	Very low	33.8	Very low	162 Å²	162	128.9 Å²	128.9	76%	0.757	75%	0.753	S	S	*	*			cis	-164.6	167.9	32.5	-154.2	149.3	-120.3	0	0	114.8
479	H	37	Very low	34.6	Very low	158 Å²	158	133.4 Å²	133.4	73%	0.731	75%	0.75	S	S	*	*			trans	79.5	119.6	164.2	-68.5	-55.6	0	0	0	123.3
480	K	33.4	Very low	36.1	Very low	181 Å²	181	128.2 Å²	128.2	79%	0.787	72%	0.722	S	S	*	*			trans	81	85.4	137.6	-73.8	-174.5	172.9	-179	0	122
481	C	26.6	Very low	37.3	Very low	111 Å²	111	127.7 Å²	127.7	75%	0.75	71%	0.711	S	S	*	*				61.3	123.7	107.3	-62.5	0	0	0	0	122.4
482	I	27.7	Very low	38.6	Very low	146 Å²	146	126.4 Å²	126.4	75%	0.749	70%	0.702	S	S	*	*			trans	77.7	87.7	142.2	-56.8	159.5	0	0	0	116.8
483	N	30.8	Very low	40.7	Very low	139 Å²	139	119.6 Å²	119.6	74%	0.743	67%	0.67	S	S	*	*				-177.8	166.7	113.6	-93.1	-16.2	0	0	0	111.9
484	D	37.1	Very low	42.9	Very low	141 Å²	141	120.7 Å²	120.7	75%	0.754	67%	0.666	S	S	*	*			trans	47.3	104.8	167.1	-57.7	-28.6	0	0	0	119.8	T486	D484-T486 PolarHBondContact O-N 2.85Å
485	V	40.6	Very low	44.9	Very low	153 Å²	153	123.5 Å²	123.5	93%	0.927	66%	0.664	S	S	*	*			trans	-83.8	92.2	158.2	179.8	0	0	0	0	107.8
486	T	47.7	Very low	46.8	Very low	110 Å²	110	119.2 Å²	119.2	68%	0.675	64%	0.638	S	S	*	*			trans	-66.5	130.6	174.2	39	0	0	0	0	110.8	D484	D484-T486 PolarHBondContact O-N 2.85Å
487	N	46.8	Very low	48.7	Very low	81 Å²	81	115 Å²	115	43%	0.433	61%	0.611	S	S	.	*			trans	-74.7	121.9	174.8	167.8	23.6	0	0	0	109.1	Y489 D490	N487-Y489 PolarHBondContact O-N 2.85Å; N487-Y489 VanDerWaalsContact O-N 3.09Å; N487-Y489 PolarHBondContact OD1-N 2.86Å; N487-D490 HydrophobicContact CB-CB 4.14Å; N487-D490 PolarHBondContact ND2-N 2.81Å; N487-D490 WeakPolarHBondContact O-CB 3.44Å; N487-D490 PolarHBondContact O-N 2.82Å
488	P	49.2	Very low	50.8	Low	87 Å²	87	117.2 Å²	117.2	57%	0.565	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-12.4	179.4	27.3	-35.1	0	0	0	113.6	T496	P488-T496 WeakPolarHBondContact O-CG2 3.47Å; P488-T496 PolarHBondContact O-OG1 3.45Å
489	Y	47.5	Very low	53	Low	195 Å²	195	116 Å²	116	77%	0.765	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	12.9	173.5	-53.6	-79.3	0	0	0	113.4	N487 P491	N487-Y489 PolarHBondContact O-N 2.85Å; N487-Y489 VanDerWaalsContact O-N 3.09Å; N487-Y489 PolarHBondContact OD1-N 2.86Å; Y489-P491 WeakPolarHBondContact O-CD 3.49Å
490	D	59.4	Low	55	Low	52 Å²	52	110.8 Å²	110.8	28%	0.278	58%	0.575	S	S	.	*			trans	-74.4	119.8	172.5	-165.7	-21.1	0	0	0	109.5	N487 K492 N493	N487-D490 HydrophobicContact CB-CB 4.14Å; N487-D490 PolarHBondContact ND2-N 2.81Å; N487-D490 WeakPolarHBondContact O-CB 3.44Å; N487-D490 PolarHBondContact O-N 2.82Å; D490-K492 PolarHBondContact O-N 3.24Å; D490-K492 VanDerWaalsContact O-N 3.11Å; D490-K492 VanDerWaalsContact OD1-CB 3.26Å; D490-K492 WeakPolarHBondContact OD1-CB 3.31Å; D490-K492 VanDerWaalsContact OD1-CG 3.31Å; D490-K492 WeakPolarHBondContact OD1-CG 3.26Å; D490-K492 PolarHBondContact OD1-N 3.35Å; D490-N493 WeakPolarHBondContact O-CB 3.48Å; D490-N493 PolarHBondContact O-N 3.48Å
491	P	56.1	Low	57.2	Low	84 Å²	84	106.7 Å²	106.7	55%	0.545	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63	-13.2	174.2	27.3	-35.7	0	0	0	113.2	Y489 N493	Y489-P491 WeakPolarHBondContact O-CD 3.49Å; P491-N493 VanDerWaalsContact C-N 3.32Å
492	K	59.1	Low	59.8	Low	159 Å²	159	106.3 Å²	106.3	69%	0.691	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-11.9	171.6	-57.9	168.9	-175.9	173.5	0	113.3	D490 V494	D490-K492 PolarHBondContact O-N 3.24Å; D490-K492 VanDerWaalsContact O-N 3.11Å; D490-K492 VanDerWaalsContact OD1-CB 3.26Å; D490-K492 WeakPolarHBondContact OD1-CB 3.31Å; D490-K492 VanDerWaalsContact OD1-CG 3.31Å; D490-K492 WeakPolarHBondContact OD1-CG 3.26Å; D490-K492 PolarHBondContact OD1-N 3.35Å; K492-V494 PolarHBondContact O-N 3.14Å
493	N	71.8	Confident	62.5	Low	37 Å²	37	104 Å²	104	20%	0.198	54%	0.536	C	S	.	.	S	Bend	trans	-75.7	117.3	170.5	-178.8	17	0	0	0	109.2	D490 P491 E495 T496 L497	D490-N493 WeakPolarHBondContact O-CB 3.48Å; D490-N493 PolarHBondContact O-N 3.48Å; P491-N493 VanDerWaalsContact C-N 3.32Å; N493-E495 PolarHBondContact ND2-OE2 2.81Å; N493-E495 PolarHBondContact O-N 2.8Å; N493-E495 PolarHBondContact OD1-N 3.28Å; N493-T496 PolarHBondContact ND2-OG1 3.4Å; N493-T496 VanDerWaalsContact ND2-OG1 3.11Å; N493-T496 WeakPolarHBondContact O-CB 3.39Å; N493-T496 PolarHBondContact O-N 2.77Å; N493-L497 PolarHBondContact O-N 3.07Å
494	V	72.6	Confident	65	Low	115 Å²	115	100.2 Å²	100.2	70%	0.697	51%	0.512	S	S	*	.	H	α-helix	trans	-56.3	-33.9	179	-178.3	0	0	0	0	111.7	K492 H498	K492-V494 PolarHBondContact O-N 3.14Å; V494-H498 VanDerWaalsContact O-CB 3.26Å; V494-H498 WeakPolarHBondContact O-CB 3.42Å; V494-H498 PolarHBondContact O-N 2.93Å
495	E	72.9	Confident	67.4	Low	149 Å²	149	99 Å²	99	70%	0.696	50%	0.5	S	S	*	.	H	α-helix	trans	-68.2	-40.3	176.2	-54.2	176.6	146.5	0	0	112	N493 K499	N493-E495 PolarHBondContact ND2-OE2 2.81Å; N493-E495 PolarHBondContact O-N 2.8Å; N493-E495 PolarHBondContact OD1-N 3.28Å; E495-K499 VanDerWaalsContact O-CB 3.27Å; E495-K499 WeakPolarHBondContact O-CB 3.49Å; E495-K499 PolarHBondContact O-N 2.94Å
496	T	71.1	Confident	69.7	Low	40 Å²	40	96.3 Å²	96.3	25%	0.245	48%	0.481	C	S	.	.	H	α-helix	trans	-69.8	-39.5	178.3	-55.7	0	0	0	0	110.8	P488 N493 F500	P488-T496 WeakPolarHBondContact O-CG2 3.47Å; P488-T496 PolarHBondContact O-OG1 3.45Å; N493-T496 PolarHBondContact ND2-OG1 3.4Å; N493-T496 VanDerWaalsContact ND2-OG1 3.11Å; N493-T496 WeakPolarHBondContact O-CB 3.39Å; N493-T496 PolarHBondContact O-N 2.77Å; T496-F500 PolarHBondContact O-N 2.99Å
497	L	72.3	Confident	71.7	Confident	41 Å²	41	93.7 Å²	93.7	22%	0.215	46%	0.461	C	S	.	.	H	α-helix	trans	-66.9	-46.7	173.9	-178.9	61.2	0	0	0	112	N493 K499 F500 L501	N493-L497 PolarHBondContact O-N 3.07Å; L497-K499 VanDerWaalsContact C-N 3.33Å; L497-K499 PolarHBondContact O-N 2.91Å; L497-F500 PolarHBondContact O-N 3.45Å; L497-F500 VanDerWaalsContact O-N 3.13Å; L497-L501 HydrophobicContact CD1-CD1 4.29Å; L497-L501 HydrophobicContact CD1-CG 4.3Å; L497-L501 HydrophobicContact CG-CD1 4.11Å; L497-L501 WeakPolarHBondContact O-CG 3.42Å; L497-L501 PolarHBondContact O-N 2.99Å
498	H	75.4	Confident	73.6	Confident	121 Å²	121	90.6 Å²	90.6	56%	0.56	45%	0.447	S	S	*	.	H	α-helix	trans	-56.6	-48.4	175.8	-176	-65.8	0	0	0	111	V494 F500 L501 E502	V494-H498 VanDerWaalsContact O-CB 3.26Å; V494-H498 WeakPolarHBondContact O-CB 3.42Å; V494-H498 PolarHBondContact O-N 2.93Å; H498-F500 VanDerWaalsContact C-N 3.29Å; H498-F500 PolarHBondContact O-N 3.13Å; H498-L501 PolarHBondContact O-N 3.5Å; H498-E502 IonicContact CE1-OE2 3.18Å; H498-E502 IonicContact ND1-OE2 2.71Å; H498-E502 WeakPolarHBondContact O-CB 3.3Å; H498-E502 PolarHBondContact O-N 3.49Å
499	K	78.1	Confident	75.6	Confident	135 Å²	135	91.5 Å²	91.5	59%	0.587	44%	0.443	S	S	*	.	H	α-helix	trans	-63.8	-32.9	177.9	-173.5	172.1	-176.6	174.9	0	112.8	E495 L497 I503	E495-K499 VanDerWaalsContact O-CB 3.27Å; E495-K499 WeakPolarHBondContact O-CB 3.49Å; E495-K499 PolarHBondContact O-N 2.94Å; L497-K499 VanDerWaalsContact C-N 3.33Å; L497-K499 PolarHBondContact O-N 2.91Å; K499-I503 HydrophobicContact CG-CD1 4.21Å; K499-I503 WeakPolarHBondContact O-CD1 3.18Å; K499-I503 VanDerWaalsContact O-CG1 3.24Å; K499-I503 WeakPolarHBondContact O-CG1 3.24Å; K499-I503 PolarHBondContact O-N 3.27Å
500	F	78.3	Confident	77.8	Confident	49 Å²	49	88.9 Å²	88.9	22%	0.215	43%	0.432	C	S	.	.	H	α-helix	trans	-67.8	-46.5	171.7	172.4	-95.1	0	0	0	111.8	F415 L419 T496 L497 H498 E502 I503 Y504	F415-F500 AromaticContact CD1-CE2 3.81Å; F415-F500 HydrophobicContact CD1-CE2 3.81Å; F415-F500 AromaticContact CD1-CZ 3.57Å; F415-F500 HydrophobicContact CD1-CZ 3.57Å; F415-F500 HydrophobicContact CE1-CD2 4.26Å; F415-F500 HydrophobicContact CE1-CE1 4.43Å; F415-F500 AromaticContact CE1-CE2 3.51Å; F415-F500 HydrophobicContact CE1-CE2 3.51Å; F415-F500 AromaticContact CE1-CZ 3.62Å; F415-F500 HydrophobicContact CE1-CZ 3.62Å; L419-F500 HydrophobicContact CD1-CD1 3.62Å; L419-F500 HydrophobicContact CD1-CE1 3.24Å; L419-F500 HydrophobicContact CD1-CE2 4.44Å; L419-F500 HydrophobicContact CD1-CG 4.38Å; L419-F500 HydrophobicContact CD1-CZ 3.72Å; T496-F500 PolarHBondContact O-N 2.99Å; L497-F500 PolarHBondContact O-N 3.45Å; L497-F500 VanDerWaalsContact O-N 3.13Å; H498-F500 VanDerWaalsContact C-N 3.29Å; H498-F500 PolarHBondContact O-N 3.13Å; F500-E502 VanDerWaalsContact C-N 3.29Å; F500-E502 PolarHBondContact O-N 2.88Å; F500-I503 PolarHBondContact O-N 2.77Å; F500-Y504 HydrophobicContact CZ-CD2 4.27Å; F500-Y504 HydrophobicContact CZ-CG 4.46Å; F500-Y504 WeakPolarHBondContact O-CB 3.48Å; F500-Y504 PolarHBondContact O-N 3.11Å
501	L	79.7	Confident	79.3	Confident	95 Å²	95	87.2 Å²	87.2	50%	0.497	42%	0.422	S	S	.	.	H	α-helix	trans	-64.1	-35.2	-179.7	-69	171	0	0	0	112.4	L497 H498 Y504 K505	L497-L501 HydrophobicContact CD1-CD1 4.29Å; L497-L501 HydrophobicContact CD1-CG 4.3Å; L497-L501 HydrophobicContact CG-CD1 4.11Å; L497-L501 WeakPolarHBondContact O-CG 3.42Å; L497-L501 PolarHBondContact O-N 2.99Å; H498-L501 PolarHBondContact O-N 3.5Å; L501-Y504 PolarHBondContact O-N 2.89Å; L501-K505 WeakPolarHBondContact O-CB 3.38Å; L501-K505 PolarHBondContact O-N 3.19Å
502	E	81.1	Confident	80.9	Confident	103 Å²	103	86.6 Å²	86.6	48%	0.481	42%	0.415	S	S	.	.	H	α-helix	trans	-60.8	-51.7	171.1	-169.5	170.7	-162	0	0	110.9	H498 F500 Y504 K505 D506	H498-E502 IonicContact CE1-OE2 3.18Å; H498-E502 IonicContact ND1-OE2 2.71Å; H498-E502 WeakPolarHBondContact O-CB 3.3Å; H498-E502 PolarHBondContact O-N 3.49Å; F500-E502 VanDerWaalsContact C-N 3.29Å; F500-E502 PolarHBondContact O-N 2.88Å; E502-Y504 PolarHBondContact O-N 2.96Å; E502-K505 PolarHBondContact O-N 3.19Å; E502-D506 PolarHBondContact O-N 3.22Å
503	I	83.8	Confident	82.6	Confident	97 Å²	97	82.1 Å²	82.1	50%	0.497	40%	0.401	S	S	.	.	H	α-helix	trans	-62.8	-39.4	175.9	-68.4	166	0	0	0	112.3	K499 F500 E507	K499-I503 HydrophobicContact CG-CD1 4.21Å; K499-I503 WeakPolarHBondContact O-CD1 3.18Å; K499-I503 VanDerWaalsContact O-CG1 3.24Å; K499-I503 WeakPolarHBondContact O-CG1 3.24Å; K499-I503 PolarHBondContact O-N 3.27Å; F500-I503 PolarHBondContact O-N 2.77Å; I503-E507 WeakPolarHBondContact O-CB 3.46Å; I503-E507 PolarHBondContact O-N 3.13Å
504	Y	85.1	Confident	83.6	Confident	61 Å²	61	82.7 Å²	82.7	24%	0.239	41%	0.405	C	S	.	.	H	α-helix	trans	-61	-48.4	176.6	171.1	-91.4	0	0	0	111	L412 A416 F500 L501 E502 A508	L412-Y504 HydrophobicContact CD1-CD2 3.76Å; L412-Y504 HydrophobicContact CD1-CE2 4.3Å; L412-Y504 HydrophobicContact CD2-CD2 4.26Å; L412-Y504 HydrophobicContact CD2-CE2 4.39Å; L412-Y504 HydrophobicContact CG-CD2 3.65Å; L412-Y504 HydrophobicContact CG-CE2 3.72Å; A416-Y504 HydrophobicContact CB-CD2 3.88Å; A416-Y504 HydrophobicContact CB-CE2 3.39Å; F500-Y504 HydrophobicContact CZ-CD2 4.27Å; F500-Y504 HydrophobicContact CZ-CG 4.46Å; F500-Y504 WeakPolarHBondContact O-CB 3.48Å; F500-Y504 PolarHBondContact O-N 3.11Å; L501-Y504 PolarHBondContact O-N 2.89Å; E502-Y504 PolarHBondContact O-N 2.96Å; Y504-A508 WeakPolarHBondContact O-CB 3.5Å; Y504-A508 PolarHBondContact O-N 3.38Å
505	K	86	Confident	84.6	Confident	115 Å²	115	78.3 Å²	78.3	50%	0.5	38%	0.378	S	S	.	.	H	α-helix	trans	-60.9	-50.1	178.2	179.5	-175.2	172.6	-68.7	0	110.9	L501 E502 E507 A508 E509	L501-K505 WeakPolarHBondContact O-CB 3.38Å; L501-K505 PolarHBondContact O-N 3.19Å; E502-K505 PolarHBondContact O-N 3.19Å; K505-E507 PolarHBondContact O-N 3.41Å; K505-A508 PolarHBondContact O-N 3.13Å; K505-E509 IonicContact NZ-OE2 2.72Å; K505-E509 PolarHBondContact NZ-OE2 3.41Å; K505-E509 VanDerWaalsContact O-CB 3.27Å; K505-E509 WeakPolarHBondContact O-CB 3.34Å; K505-E509 PolarHBondContact O-N 2.9Å
506	D	89.2	Confident	85.5	Confident	97 Å²	97	77 Å²	77	52%	0.519	37%	0.373	S	S	.	.	H	α-helix	trans	-62.1	-42.8	-176.7	-74	1.8	0	0	0	112.2	E502 R510	E502-D506 PolarHBondContact O-N 3.22Å; D506-R510 WeakPolarHBondContact O-CB 3.12Å; D506-R510 PolarHBondContact O-N 3Å
507	E	90	Very high	86.7	Confident	55 Å²	55	78.9 Å²	78.9	26%	0.257	38%	0.382	S	S	.	.	H	α-helix	trans	-76.3	-30.1	179.3	-164.9	71	177	0	0	112.3	L412 I503 K505 R510 F511	L412-E507 HydrophobicContact CD2-CB 4.04Å; L412-E507 HydrophobicContact CD2-CG 4.26Å; I503-E507 WeakPolarHBondContact O-CB 3.46Å; I503-E507 PolarHBondContact O-N 3.13Å; K505-E507 PolarHBondContact O-N 3.41Å; E507-R510 IonicContact OE1-CZ 3.81Å; E507-R510 IonicContact OE1-NH1 2.68Å; E507-R510 PolarHBondContact OE1-NH1 2.82Å; E507-R510 WeakPolarHBondContact OE2-CD 3.17Å; E507-R510 IonicContact OE2-CZ 3.62Å; E507-R510 IonicContact OE2-NE 2.89Å; E507-R510 IonicContact OE2-NH1 2.8Å; E507-R510 PolarHBondContact OE2-NH1 2.87Å; E507-F511 HydrophobicContact CG-CD2 4.26Å; E507-F511 HydrophobicContact CG-CE1 4.49Å; E507-F511 HydrophobicContact CG-CE2 3.65Å; E507-F511 HydrophobicContact CG-CZ 3.76Å; E507-F511 VanDerWaalsContact O-CD2 3.26Å; E507-F511 WeakPolarHBondContact O-CD2 3.14Å; E507-F511 WeakPolarHBondContact O-CG 3.49Å; E507-F511 PolarHBondContact O-N 2.8Å; E507-F511 WeakPolarHBondContact OE1-CZ 3.39Å
508	A	87.7	Confident	87.7	Confident	16 Å²	16	76.9 Å²	76.9	13%	0.132	37%	0.371	C	S	.	.	H	α-helix	trans	-67.4	-51.1	171.9	0	0	0	0	0	111.7	L412 Y504 K505 R510 F511 D512	L412-A508 HydrophobicContact CD2-CB 4.07Å; Y504-A508 WeakPolarHBondContact O-CB 3.5Å; Y504-A508 PolarHBondContact O-N 3.38Å; K505-A508 PolarHBondContact O-N 3.13Å; A508-R510 PolarHBondContact O-N 2.92Å; A508-F511 PolarHBondContact O-N 2.73Å; A508-D512 PolarHBondContact O-N 2.97Å
509	E	90.6	Very high	88.6	Confident	105 Å²	105	74.1 Å²	74.1	49%	0.491	36%	0.363	S	S	.	.	H	α-helix	trans	-57.3	-36.1	176.1	-171	173.7	149.2	0	0	111.2	K505 T513	K505-E509 IonicContact NZ-OE2 2.72Å; K505-E509 PolarHBondContact NZ-OE2 3.41Å; K505-E509 VanDerWaalsContact O-CB 3.27Å; K505-E509 WeakPolarHBondContact O-CB 3.34Å; K505-E509 PolarHBondContact O-N 2.9Å; E509-T513 WeakPolarHBondContact O-CB 3.38Å; E509-T513 PolarHBondContact O-N 2.79Å; E509-T513 PolarHBondContact O-OG1 3.17Å
510	R	93	Very high	89.4	Confident	141 Å²	141	73.2 Å²	73.2	53%	0.532	36%	0.361	S	S	.	.	H	α-helix	trans	-69.2	-39.9	172.5	179.6	177.3	167.9	-130.3	-13.5	113.5	D506 E507 A508 V514	D506-R510 WeakPolarHBondContact O-CB 3.12Å; D506-R510 PolarHBondContact O-N 3Å; E507-R510 IonicContact OE1-CZ 3.81Å; E507-R510 IonicContact OE1-NH1 2.68Å; E507-R510 PolarHBondContact OE1-NH1 2.82Å; E507-R510 WeakPolarHBondContact OE2-CD 3.17Å; E507-R510 IonicContact OE2-CZ 3.62Å; E507-R510 IonicContact OE2-NE 2.89Å; E507-R510 IonicContact OE2-NH1 2.8Å; E507-R510 PolarHBondContact OE2-NH1 2.87Å; A508-R510 PolarHBondContact O-N 2.92Å; R510-V514 WeakPolarHBondContact O-CB 3.4Å; R510-V514 VanDerWaalsContact O-CG2 3.29Å; R510-V514 WeakPolarHBondContact O-CG2 3.3Å; R510-V514 PolarHBondContact O-N 3.19Å
511	F	91.6	Very high	90.2	Very high	16 Å²	16	72.8 Å²	72.8	7%	0.07	36%	0.359	C	S	.	.	H	α-helix	trans	-69.4	-38.9	174	-70.3	-36.8	0	0	0	112.2	T405 Q408 R409 L412 E507 A508 V514 L515	T405-F511 HydrophobicContact CG2-CB 4.07Å; T405-F511 HydrophobicContact CG2-CD1 3.77Å; T405-F511 HydrophobicContact CG2-CG 4.21Å; Q408-F511 HydrophobicContact CB-CE1 3.88Å; Q408-F511 HydrophobicContact CB-CE2 3.87Å; Q408-F511 HydrophobicContact CB-CZ 3.54Å; Q408-F511 HydrophobicContact CG-CZ 4.48Å; R409-F511 HydrophobicContact CB-CB 4.35Å; R409-F511 HydrophobicContact CB-CD2 4.31Å; L412-F511 HydrophobicContact CD2-CD2 4.08Å; L412-F511 HydrophobicContact CD2-CE2 4.04Å; E507-F511 HydrophobicContact CG-CD2 4.26Å; E507-F511 HydrophobicContact CG-CE1 4.49Å; E507-F511 HydrophobicContact CG-CE2 3.65Å; E507-F511 HydrophobicContact CG-CZ 3.76Å; E507-F511 VanDerWaalsContact O-CD2 3.26Å; E507-F511 WeakPolarHBondContact O-CD2 3.14Å; E507-F511 WeakPolarHBondContact O-CG 3.49Å; E507-F511 PolarHBondContact O-N 2.8Å; E507-F511 WeakPolarHBondContact OE1-CZ 3.39Å; A508-F511 PolarHBondContact O-N 2.73Å; F511-V514 PolarHBondContact O-N 3.2Å; F511-L515 WeakPolarHBondContact O-CB 3.46Å; F511-L515 VanDerWaalsContact O-CG 3.25Å; F511-L515 WeakPolarHBondContact O-CG 3.24Å; F511-L515 PolarHBondContact O-N 2.86Å
512	D	89.8	Confident	91	Very high	72 Å²	72	68.6 Å²	68.6	39%	0.385	34%	0.337	S	S	.	.	H	α-helix	trans	-56	-52.4	170.6	-89.9	-58	0	0	0	111.3	R409 A508 V514 L515 M516	R409-D512 IonicContact CZ-OD1 3.63Å; R409-D512 IonicContact CZ-OD2 3.49Å; R409-D512 IonicContact NH1-OD1 2.77Å; R409-D512 PolarHBondContact NH1-OD1 2.84Å; R409-D512 IonicContact NH1-OD2 2.68Å; R409-D512 PolarHBondContact NH1-OD2 2.92Å; R409-D512 IonicContact NH2-OD1 3.23Å; R409-D512 PolarHBondContact NH2-OD1 3.06Å; R409-D512 IonicContact NH2-OD2 3.78Å; R409-D512 PolarHBondContact NH2-OD2 2.86Å; A508-D512 PolarHBondContact O-N 2.97Å; D512-V514 PolarHBondContact O-N 2.87Å; D512-L515 PolarHBondContact O-N 2.85Å; D512-M516 PolarHBondContact O-N 2.9Å
513	T	93.6	Very high	91.7	Very high	65 Å²	65	67.7 Å²	67.7	40%	0.399	33%	0.333	S	S	.	.	H	α-helix	trans	-57	-48.2	177.1	-54.5	0	0	0	0	111.5	E509 L515 M516 D517	E509-T513 WeakPolarHBondContact O-CB 3.38Å; E509-T513 PolarHBondContact O-N 2.79Å; E509-T513 PolarHBondContact O-OG1 3.17Å; T513-L515 VanDerWaalsContact C-N 3.33Å; T513-L515 PolarHBondContact O-N 2.95Å; T513-M516 PolarHBondContact O-N 2.9Å; T513-D517 WeakPolarHBondContact O-CB 3.49Å; T513-D517 VanDerWaalsContact O-CG 3.28Å; T513-D517 PolarHBondContact O-N 3.39Å
514	V	93.6	Very high	92.3	Very high	48 Å²	48	68.4 Å²	68.4	29%	0.291	33%	0.334	S	S	.	.	H	α-helix	trans	-64.6	-35.7	179	170	0	0	0	0	112	T405 R510 F511 D512 T518	T405-V514 HydrophobicContact CG2-CB 4.3Å; T405-V514 HydrophobicContact CG2-CG1 3.98Å; R510-V514 WeakPolarHBondContact O-CB 3.4Å; R510-V514 VanDerWaalsContact O-CG2 3.29Å; R510-V514 WeakPolarHBondContact O-CG2 3.3Å; R510-V514 PolarHBondContact O-N 3.19Å; F511-V514 PolarHBondContact O-N 3.2Å; D512-V514 PolarHBondContact O-N 2.87Å; V514-T518 VanDerWaalsContact O-CB 3.29Å; V514-T518 WeakPolarHBondContact O-CB 3.41Å; V514-T518 PolarHBondContact O-N 3.3Å; V514-T518 PolarHBondContact O-OG1 2.85Å
515	L	93	Very high	92.8	Very high	23 Å²	23	65.8 Å²	65.8	12%	0.12	33%	0.325	C	S	.	.	H	α-helix	trans	-66.2	-44.9	175.5	-74.8	167.1	0	0	0	111.1	I402 T405 E406 F511 D512 T513 T518 T519	I402-L515 HydrophobicContact CG2-CD2 4.11Å; T405-L515 HydrophobicContact CG2-CD1 4.38Å; T405-L515 HydrophobicContact CG2-CD2 3.96Å; T405-L515 HydrophobicContact CG2-CG 3.75Å; E406-L515 HydrophobicContact CG-CD2 3.79Å; F511-L515 WeakPolarHBondContact O-CB 3.46Å; F511-L515 VanDerWaalsContact O-CG 3.25Å; F511-L515 WeakPolarHBondContact O-CG 3.24Å; F511-L515 PolarHBondContact O-N 2.86Å; D512-L515 PolarHBondContact O-N 2.85Å; T513-L515 VanDerWaalsContact C-N 3.33Å; T513-L515 PolarHBondContact O-N 2.95Å; L515-T518 PolarHBondContact O-N 2.81Å; L515-T519 WeakPolarHBondContact O-CB 3.26Å; L515-T519 PolarHBondContact O-N 2.81Å; L515-T519 PolarHBondContact O-OG1 2.93Å
516	M	93	Very high	93.2	Very high	122 Å²	122	64.9 Å²	64.9	60%	0.601	32%	0.318	S	S	*	.	H	α-helix	trans	-58.7	-55.9	175.6	-170.8	-178.1	73.2	0	0	111.2	D512 T513 T518 T519 E520	D512-M516 PolarHBondContact O-N 2.9Å; T513-M516 PolarHBondContact O-N 2.9Å; M516-T518 VanDerWaalsContact C-N 3.27Å; M516-T518 PolarHBondContact O-N 3.33Å; M516-T519 PolarHBondContact O-N 2.77Å; M516-T519 VanDerWaalsContact O-N 3.07Å; M516-E520 PolarHBondContact O-N 2.84Å
517	D	95	Very high	93.5	Very high	79 Å²	79	64 Å²	64	42%	0.422	32%	0.317	S	S	.	.	H	α-helix	trans	-56.2	-39.7	179.3	-69.9	-5.7	0	0	0	112.3	T513 E521	T513-D517 WeakPolarHBondContact O-CB 3.49Å; T513-D517 VanDerWaalsContact O-CG 3.28Å; T513-D517 PolarHBondContact O-N 3.39Å; D517-E521 WeakPolarHBondContact O-CB 3.46Å; D517-E521 PolarHBondContact O-N 3.09Å; D517-E521 VanDerWaalsContact O-N 3.08Å
518	T	93.9	Very high	93.8	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-72.7	-34.1	179.7	-48.5	0	0	0	0	112.4	L398 R401 I402 V514 L515 M516 L522	L398-T518 HydrophobicContact CB-CG2 4.21Å; L398-T518 HydrophobicContact CD2-CG2 3.96Å; R401-T518 HydrophobicContact CB-CG2 3.87Å; R401-T518 HydrophobicContact CG-CG2 3.93Å; R401-T518 VanDerWaalsContact CZ-OG1 3.23Å; R401-T518 VanDerWaalsContact NE-CG2 3.34Å; R401-T518 PolarHBondContact NE-OG1 3.01Å; R401-T518 VanDerWaalsContact NH2-CA 3.29Å; R401-T518 PolarHBondContact NH2-OG1 2.83Å; I402-T518 HydrophobicContact CD1-CG2 4.16Å; I402-T518 HydrophobicContact CG1-CG2 3.49Å; I402-T518 VanDerWaalsContact CG1-CG2 3.49Å; V514-T518 VanDerWaalsContact O-CB 3.29Å; V514-T518 WeakPolarHBondContact O-CB 3.41Å; V514-T518 PolarHBondContact O-N 3.3Å; V514-T518 PolarHBondContact O-OG1 2.85Å; L515-T518 PolarHBondContact O-N 2.81Å; M516-T518 VanDerWaalsContact C-N 3.27Å; M516-T518 PolarHBondContact O-N 3.33Å; T518-L522 WeakPolarHBondContact O-CB 3.49Å; T518-L522 PolarHBondContact O-N 3.5Å
519	T	94.2	Very high	94	Very high	62 Å²	62	65 Å²	65	38%	0.38	32%	0.316	S	S	.	.	H	α-helix	trans	-74.1	-39.9	179.6	-54.3	0	0	0	0	110.4	L515 M516 L522 E523	L515-T519 WeakPolarHBondContact O-CB 3.26Å; L515-T519 PolarHBondContact O-N 2.81Å; L515-T519 PolarHBondContact O-OG1 2.93Å; M516-T519 PolarHBondContact O-N 2.77Å; M516-T519 VanDerWaalsContact O-N 3.07Å; T519-L522 WeakPolarHBondContact O-CB 3.35Å; T519-L522 PolarHBondContact O-N 2.78Å; T519-E523 PolarHBondContact O-N 2.65Å
520	E	95.4	Very high	94	Very high	116 Å²	116	65 Å²	65	54%	0.542	32%	0.316	S	S	.	.	H	α-helix	trans	-62.7	-46.1	171.7	-158.5	-160.4	143	0	0	111.4	M516 L522 E523 Q524	M516-E520 PolarHBondContact O-N 2.84Å; E520-L522 PolarHBondContact O-N 2.86Å; E520-E523 PolarHBondContact O-N 3.28Å; E520-Q524 WeakPolarHBondContact O-CG 3.19Å; E520-Q524 PolarHBondContact O-N 3.43Å; E520-Q524 PolarHBondContact OE1-NE2 2.67Å
521	E	95.9	Very high	94.1	Very high	41 Å²	41	60.9 Å²	60.9	19%	0.192	31%	0.307	C	S	.	.	H	α-helix	trans	-58.9	-35.5	176	-160.5	-168.4	157.5	0	0	111.7	R394 L398 R401 D517 V525	R394-E521 IonicContact CZ-OE1 3.8Å; R394-E521 VanDerWaalsContact CZ-OE1 3.26Å; R394-E521 IonicContact NE-OE1 3.67Å; R394-E521 PolarHBondContact NE-OE1 2.8Å; R394-E521 IonicContact NH2-OE1 3.75Å; R394-E521 PolarHBondContact NH2-OE1 2.82Å; L398-E521 HydrophobicContact CD1-CB 4.01Å; L398-E521 HydrophobicContact CD1-CG 3.73Å; L398-E521 HydrophobicContact CD2-CB 4.23Å; L398-E521 HydrophobicContact CD2-CG 4.1Å; L398-E521 VanDerWaalsContact CD2-OE2 3.22Å; L398-E521 WeakPolarHBondContact CD2-OE2 2.97Å; R401-E521 IonicContact CZ-OE2 3.14Å; R401-E521 IonicContact NH1-OE2 2.82Å; R401-E521 PolarHBondContact NH1-OE2 3.37Å; R401-E521 IonicContact NH2-OE2 2.82Å; R401-E521 PolarHBondContact NH2-OE2 2.95Å; D517-E521 WeakPolarHBondContact O-CB 3.46Å; D517-E521 PolarHBondContact O-N 3.09Å; D517-E521 VanDerWaalsContact O-N 3.08Å; E521-V525 WeakPolarHBondContact O-CB 3.27Å; E521-V525 WeakPolarHBondContact O-CG2 3.32Å; E521-V525 PolarHBondContact O-N 3.45Å; E521-V525 VanDerWaalsContact O-N 3.15Å
522	L	95.9	Very high	94.1	Very high	6 Å²	6	60.1 Å²	60.1	3%	0.031	30%	0.303	C	S	.	.	H	α-helix	trans	-69.2	-43.5	176.8	178.1	59.7	0	0	0	112.1	A395 L398 V399 I402 T518 T519 E520 V525 R526	A395-L522 HydrophobicContact CB-CD1 3.78Å; L398-L522 HydrophobicContact CB-CB 4.27Å; L398-L522 HydrophobicContact CB-CD1 4.27Å; L398-L522 HydrophobicContact CD1-CB 4.44Å; V399-L522 HydrophobicContact CG2-CD1 4Å; V399-L522 HydrophobicContact CG2-CD2 3.71Å; I402-L522 HydrophobicContact CD1-CD2 3.77Å; T518-L522 WeakPolarHBondContact O-CB 3.49Å; T518-L522 PolarHBondContact O-N 3.5Å; T519-L522 WeakPolarHBondContact O-CB 3.35Å; T519-L522 PolarHBondContact O-N 2.78Å; E520-L522 PolarHBondContact O-N 2.86Å; L522-V525 PolarHBondContact O-N 3.32Å; L522-R526 HydrophobicContact CD1-CG 4.39Å; L522-R526 WeakPolarHBondContact O-CB 3.45Å; L522-R526 WeakPolarHBondContact O-CG 3.19Å; L522-R526 PolarHBondContact O-N 3.21Å
523	E	94.7	Very high	94	Very high	85 Å²	85	58.9 Å²	58.9	40%	0.397	30%	0.295	S	S	.	.	H	α-helix	trans	-69	-37.2	177.4	-69.5	-48.2	130.4	0	0	112.9	T519 E520 V525 R526 T527	T519-E523 PolarHBondContact O-N 2.65Å; E520-E523 PolarHBondContact O-N 3.28Å; E523-V525 VanDerWaalsContact C-N 3.3Å; E523-V525 PolarHBondContact O-N 2.95Å; E523-R526 PolarHBondContact O-N 3.27Å; E523-R526 VanDerWaalsContact OE1-CD 3.23Å; E523-R526 WeakPolarHBondContact OE1-CD 3.49Å; E523-R526 IonicContact OE1-CZ 3.26Å; E523-R526 IonicContact OE1-NE 3.31Å; E523-R526 IonicContact OE1-NH1 2.76Å; E523-R526 PolarHBondContact OE1-NH1 3.16Å; E523-T527 WeakPolarHBondContact O-CB 3.48Å; E523-T527 PolarHBondContact O-N 3.01Å; E523-T527 PolarHBondContact O-OG1 2.89Å
524	Q	96.6	Very high	93.7	Very high	111 Å²	111	61.2 Å²	61.2	52%	0.519	30%	0.3	S	S	.	.	H	α-helix	trans	-58.7	-43	170.5	-69.5	177.8	17.5	0	0	111.1	E520 T527 R528	E520-Q524 WeakPolarHBondContact O-CG 3.19Å; E520-Q524 PolarHBondContact O-N 3.43Å; E520-Q524 PolarHBondContact OE1-NE2 2.67Å; Q524-T527 PolarHBondContact O-N 3.01Å; Q524-R528 PolarHBondContact O-N 3.02Å; Q524-R528 VanDerWaalsContact O-N 3.09Å
525	V	95.3	Very high	93.5	Very high	7 Å²	7	62.1 Å²	62.1	4%	0.042	30%	0.301	C	S	.	.	H	α-helix	trans	-71.7	-37.8	178.2	173.2	0	0	0	0	112.2	C391 R394 A395 L398 E521 L522 E523 R528 I529	C391-V525 HydrophobicContact CB-CG1 4.29Å; C391-V525 WeakPolarHBondContact O-CG1 3.25Å; R394-V525 HydrophobicContact CB-CG1 4.21Å; R394-V525 HydrophobicContact CB-CG2 4.49Å; R394-V525 HydrophobicContact CG-CG2 3.98Å; A395-V525 HydrophobicContact CB-CG1 3.96Å; L398-V525 HydrophobicContact CD1-CG2 4.16Å; E521-V525 WeakPolarHBondContact O-CB 3.27Å; E521-V525 WeakPolarHBondContact O-CG2 3.32Å; E521-V525 PolarHBondContact O-N 3.45Å; E521-V525 VanDerWaalsContact O-N 3.15Å; L522-V525 PolarHBondContact O-N 3.32Å; E523-V525 VanDerWaalsContact C-N 3.3Å; E523-V525 PolarHBondContact O-N 2.95Å; V525-R528 PolarHBondContact O-N 3.36Å; V525-I529 HydrophobicContact CG1-CD1 4.21Å; V525-I529 WeakPolarHBondContact O-CG1 3.36Å; V525-I529 PolarHBondContact O-N 3.04Å
526	R	95.1	Very high	93	Very high	95 Å²	95	61.5 Å²	61.5	36%	0.358	30%	0.298	S	S	.	.	H	α-helix	trans	-58.9	-45.9	171.7	-76.8	168.6	170.8	-178.5	-1.3	111.1	L522 E523 R528 I529 E530	L522-R526 HydrophobicContact CD1-CG 4.39Å; L522-R526 WeakPolarHBondContact O-CB 3.45Å; L522-R526 WeakPolarHBondContact O-CG 3.19Å; L522-R526 PolarHBondContact O-N 3.21Å; E523-R526 PolarHBondContact O-N 3.27Å; E523-R526 VanDerWaalsContact OE1-CD 3.23Å; E523-R526 WeakPolarHBondContact OE1-CD 3.49Å; E523-R526 IonicContact OE1-CZ 3.26Å; E523-R526 IonicContact OE1-NE 3.31Å; E523-R526 IonicContact OE1-NH1 2.76Å; E523-R526 PolarHBondContact OE1-NH1 3.16Å; R526-R528 VanDerWaalsContact C-N 3.31Å; R526-R528 PolarHBondContact O-N 3.29Å; R526-I529 WeakPolarHBondContact O-CA 3.42Å; R526-I529 WeakPolarHBondContact O-CB 3.45Å; R526-I529 PolarHBondContact O-N 3.43Å; R526-E530 PolarHBondContact O-N 3.18Å
527	T	95.7	Very high	92.3	Very high	80 Å²	80	60.8 Å²	60.8	49%	0.491	29%	0.289	S	S	.	.	H	α-helix	trans	-60.1	-38.1	175.2	-54.4	0	0	0	0	112	E523 Q524 T531	E523-T527 WeakPolarHBondContact O-CB 3.48Å; E523-T527 PolarHBondContact O-N 3.01Å; E523-T527 PolarHBondContact O-OG1 2.89Å; Q524-T527 PolarHBondContact O-N 3.01Å; T527-T531 PolarHBondContact O-N 3.49Å; T527-T531 VanDerWaalsContact O-N 3.1Å; T527-T531 PolarHBondContact O-OG1 3.12Å
528	R	96.3	Very high	91.8	Very high	70 Å²	70	59.8 Å²	59.8	26%	0.264	28%	0.283	S	S	.	.	H	α-helix	trans	-69.6	-35.3	173.7	-171.7	56.3	-174.7	147.1	1.3	112.7	E387 Q524 V525 R526 T531 L532 E535	E387-R528 IonicContact OE1-CZ 2.73Å; E387-R528 IonicContact OE1-NE 3.81Å; E387-R528 PolarHBondContact OE1-NE 3.4Å; E387-R528 IonicContact OE1-NH2 3.95Å; E387-R528 PolarHBondContact OE1-NH2 3.12Å; E387-R528 IonicContact OE2-CZ 3.59Å; E387-R528 IonicContact OE2-NE 3.99Å; E387-R528 IonicContact OE2-NH2 3.17Å; E387-R528 PolarHBondContact OE2-NH2 2.97Å; Q524-R528 PolarHBondContact O-N 3.02Å; Q524-R528 VanDerWaalsContact O-N 3.09Å; V525-R528 PolarHBondContact O-N 3.36Å; R526-R528 VanDerWaalsContact C-N 3.31Å; R526-R528 PolarHBondContact O-N 3.29Å; R528-T531 WeakPolarHBondContact CA-OG1 3.45Å; R528-T531 PolarHBondContact NH1-OG1 3.01Å; R528-T531 PolarHBondContact O-OG1 3.37Å; R528-T531 VanDerWaalsContact O-OG1 3.08Å; R528-L532 HydrophobicContact CG-CD1 3.91Å; R528-L532 HydrophobicContact CG-CG 4.3Å; R528-L532 VanDerWaalsContact O-CB 3.29Å; R528-L532 WeakPolarHBondContact O-CB 3.46Å; R528-L532 WeakPolarHBondContact O-CD1 3.35Å; R528-L532 VanDerWaalsContact O-CG 3.28Å; R528-L532 WeakPolarHBondContact O-CG 3.37Å; R528-L532 PolarHBondContact O-N 2.88Å; R528-E535 IonicContact CZ-OE1 2.86Å; R528-E535 IonicContact CZ-OE2 2.64Å; R528-E535 VanDerWaalsContact NH1-CD 3.31Å; R528-E535 IonicContact NH1-OE1 3.55Å; R528-E535 PolarHBondContact NH1-OE1 3.09Å; R528-E535 IonicContact NH1-OE2 3.44Å; R528-E535 PolarHBondContact NH1-OE2 3.12Å; R528-E535 IonicContact NH2-OE1 2.8Å; R528-E535 IonicContact NH2-OE2 2.7Å; R528-E535 PolarHBondContact NH2-OE2 3.39Å; R528-E535 VanDerWaalsContact NH2-OE2 3.11Å
529	I	92.9	Very high	91.2	Very high	22 Å²	22	60.8 Å²	60.8	11%	0.113	29%	0.289	C	S	.	.	H	α-helix	trans	-60.8	-49	172.9	-70.2	165.1	0	0	0	110.4	L388 C391 R392 A395 V525 R526 T531 L532 E533	L388-I529 HydrophobicContact CD1-CB 4.35Å; L388-I529 HydrophobicContact CD1-CG1 4.41Å; L388-I529 HydrophobicContact CD1-CG2 3.88Å; C391-I529 HydrophobicContact CB-CD1 4.37Å; C391-I529 HydrophobicContact CB-CG1 3.66Å; R392-I529 HydrophobicContact CG-CD1 3.91Å; R392-I529 HydrophobicContact CG-CG1 4.19Å; A395-I529 HydrophobicContact CB-CD1 4.13Å; V525-I529 HydrophobicContact CG1-CD1 4.21Å; V525-I529 WeakPolarHBondContact O-CG1 3.36Å; V525-I529 PolarHBondContact O-N 3.04Å; R526-I529 WeakPolarHBondContact O-CA 3.42Å; R526-I529 WeakPolarHBondContact O-CB 3.45Å; R526-I529 PolarHBondContact O-N 3.43Å; I529-T531 PolarHBondContact O-N 3.02Å; I529-L532 PolarHBondContact O-N 2.96Å; I529-E533 WeakPolarHBondContact O-CG 3.25Å; I529-E533 PolarHBondContact O-N 3.01Å
530	E	89.9	Confident	90.3	Very high	103 Å²	103	61.6 Å²	61.6	48%	0.481	29%	0.288	S	S	.	.	H	α-helix	trans	-63.8	-39.9	-179	-69.1	-174.1	172	0	0	113	R526 K534	R526-E530 PolarHBondContact O-N 3.18Å; E530-K534 WeakPolarHBondContact O-CB 3.45Å; E530-K534 PolarHBondContact O-N 3.33Å
531	T	94.1	Very high	89.2	Confident	56 Å²	56	58.8 Å²	58.8	34%	0.344	28%	0.276	S	S	.	.	H	α-helix	trans	-69.2	-42.1	175.7	47.2	0	0	0	0	112.3	T527 R528 I529 K534 E535	T527-T531 PolarHBondContact O-N 3.49Å; T527-T531 VanDerWaalsContact O-N 3.1Å; T527-T531 PolarHBondContact O-OG1 3.12Å; R528-T531 WeakPolarHBondContact CA-OG1 3.45Å; R528-T531 PolarHBondContact NH1-OG1 3.01Å; R528-T531 PolarHBondContact O-OG1 3.37Å; R528-T531 VanDerWaalsContact O-OG1 3.08Å; I529-T531 PolarHBondContact O-N 3.02Å; T531-K534 CarbonylContact O-C 3.56Å; T531-K534 WeakPolarHBondContact O-CA 3.32Å; T531-K534 WeakPolarHBondContact O-CB 3.4Å; T531-K534 PolarHBondContact O-N 2.95Å; T531-K534 VanDerWaalsContact O-N 3.11Å; T531-E535 WeakPolarHBondContact O-CG 3.27Å; T531-E535 PolarHBondContact O-N 3.18Å
532	L	92.3	Very high	88.3	Confident	0 Å²	0	61 Å²	61	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-60.6	-45.5	173.5	-81.8	168.4	0	0	0	112.8	L384 E387 L388 C391 R528 I529 K534 E535 V536	L384-L532 HydrophobicContact CB-CD2 4.44Å; L384-L532 HydrophobicContact CD2-CD2 3.62Å; E387-L532 HydrophobicContact CB-CD1 3.97Å; E387-L532 HydrophobicContact CB-CD2 3.98Å; E387-L532 HydrophobicContact CG-CD1 3.86Å; E387-L532 HydrophobicContact CG-CD2 4.3Å; L388-L532 HydrophobicContact CB-CB 4.41Å; L388-L532 HydrophobicContact CB-CD1 4.32Å; L388-L532 HydrophobicContact CD1-CB 4.15Å; C391-L532 HydrophobicContact CB-CD1 4.36Å; R528-L532 HydrophobicContact CG-CD1 3.91Å; R528-L532 HydrophobicContact CG-CG 4.3Å; R528-L532 VanDerWaalsContact O-CB 3.29Å; R528-L532 WeakPolarHBondContact O-CB 3.46Å; R528-L532 WeakPolarHBondContact O-CD1 3.35Å; R528-L532 VanDerWaalsContact O-CG 3.28Å; R528-L532 WeakPolarHBondContact O-CG 3.37Å; R528-L532 PolarHBondContact O-N 2.88Å; I529-L532 PolarHBondContact O-N 2.96Å; L532-K534 PolarHBondContact O-N 3.46Å; L532-E535 PolarHBondContact O-N 2.88Å; L532-V536 WeakPolarHBondContact O-CG2 3.42Å; L532-V536 PolarHBondContact O-N 2.69Å
533	E	86.9	Confident	87.2	Confident	45 Å²	45	63.3 Å²	63.3	21%	0.21	30%	0.296	C	S	.	.	H	α-helix	trans	-63.7	-30	175.6	-71.4	-178.2	-168.6	0	0	111.8	L388 R392 I529 R537	L388-E533 HydrophobicContact CD1-CG 3.79Å; L388-E533 HydrophobicContact CD2-CG 3.87Å; R392-E533 IonicContact CZ-OE1 2.64Å; R392-E533 IonicContact NE-OE1 3.97Å; R392-E533 IonicContact NH2-OE1 2.75Å; R392-E533 PolarHBondContact NH2-OE1 2.94Å; I529-E533 WeakPolarHBondContact O-CG 3.25Å; I529-E533 PolarHBondContact O-N 3.01Å; E533-R537 VanDerWaalsContact C-CZ 3.45Å; E533-R537 VanDerWaalsContact C-NH2 3.27Å; E533-R537 WeakPolarHBondContact O-CB 3.35Å; E533-R537 VanDerWaalsContact O-CG 3.25Å; E533-R537 WeakPolarHBondContact O-CG 3.4Å; E533-R537 PolarHBondContact O-N 3.14Å; E533-R537 PolarHBondContact O-NE 2.78Å; E533-R537 VanDerWaalsContact O-NE 3.08Å; E533-R537 PolarHBondContact O-NH2 3.24Å; E533-R537 IonicContact OE2-NH1 3.82Å
534	K	87	Confident	86	Confident	115 Å²	115	61 Å²	61	50%	0.5	29%	0.286	S	S	.	.	H	α-helix	trans	-71.2	-46.4	171.4	-164.1	-161.4	173.4	-151.3	0	111.4	E530 T531 L532 V536 R537 D538	E530-K534 WeakPolarHBondContact O-CB 3.45Å; E530-K534 PolarHBondContact O-N 3.33Å; T531-K534 CarbonylContact O-C 3.56Å; T531-K534 WeakPolarHBondContact O-CA 3.32Å; T531-K534 WeakPolarHBondContact O-CB 3.4Å; T531-K534 PolarHBondContact O-N 2.95Å; T531-K534 VanDerWaalsContact O-N 3.11Å; L532-K534 PolarHBondContact O-N 3.46Å; K534-V536 VanDerWaalsContact C-N 3.3Å; K534-V536 PolarHBondContact O-N 2.84Å; K534-R537 VanDerWaalsContact N-NH2 3.16Å; K534-R537 PolarHBondContact O-N 3.1Å; K534-D538 WeakPolarHBondContact CE-OD2 3.49Å; K534-D538 IonicContact NZ-OD2 3.92Å; K534-D538 PolarHBondContact NZ-OD2 2.71Å; K534-D538 VanDerWaalsContact O-CB 3.29Å; K534-D538 WeakPolarHBondContact O-CB 3.25Å; K534-D538 VanDerWaalsContact O-CG 3.25Å; K534-D538 PolarHBondContact O-N 3Å
535	E	89.6	Confident	84.7	Confident	67 Å²	67	61.6 Å²	61.6	31%	0.313	29%	0.289	S	S	.	.	H	α-helix	trans	-57.3	-41.7	177.9	-74.5	159.2	-149.9	0	0	111.8	L384 R528 T531 L532 I539	L384-E535 HydrophobicContact CD1-CB 3.88Å; L384-E535 HydrophobicContact CD2-CB 4.17Å; L384-E535 WeakPolarHBondContact CD2-OE2 3.43Å; R528-E535 IonicContact CZ-OE1 2.86Å; R528-E535 IonicContact CZ-OE2 2.64Å; R528-E535 VanDerWaalsContact NH1-CD 3.31Å; R528-E535 IonicContact NH1-OE1 3.55Å; R528-E535 PolarHBondContact NH1-OE1 3.09Å; R528-E535 IonicContact NH1-OE2 3.44Å; R528-E535 PolarHBondContact NH1-OE2 3.12Å; R528-E535 IonicContact NH2-OE1 2.8Å; R528-E535 IonicContact NH2-OE2 2.7Å; R528-E535 PolarHBondContact NH2-OE2 3.39Å; R528-E535 VanDerWaalsContact NH2-OE2 3.11Å; T531-E535 WeakPolarHBondContact O-CG 3.27Å; T531-E535 PolarHBondContact O-N 3.18Å; L532-E535 PolarHBondContact O-N 2.88Å; E535-I539 WeakPolarHBondContact O-CG1 3.33Å; E535-I539 PolarHBondContact O-N 3.32Å
536	V	84	Confident	83.7	Confident	9 Å²	9	64.6 Å²	64.6	6%	0.055	30%	0.302	C	S	.	.	H	α-helix	trans	-62.1	-54	172.7	172.6	0	0	0	0	111.1	V381 L384 L385 L532 K534 D538 I539 E540	V381-V536 HydrophobicContact CG1-CG1 4.41Å; L384-V536 HydrophobicContact CB-CG2 3.57Å; L384-V536 HydrophobicContact CD1-CG2 4.06Å; L384-V536 HydrophobicContact CG-CG2 4.47Å; L385-V536 HydrophobicContact CD2-CG2 4.32Å; L385-V536 HydrophobicContact CG-CG2 4.47Å; L532-V536 WeakPolarHBondContact O-CG2 3.42Å; L532-V536 PolarHBondContact O-N 2.69Å; K534-V536 VanDerWaalsContact C-N 3.3Å; K534-V536 PolarHBondContact O-N 2.84Å; V536-D538 VanDerWaalsContact C-N 3.3Å; V536-D538 PolarHBondContact O-N 2.69Å; V536-I539 PolarHBondContact O-N 3.05Å; V536-E540 HydrophobicContact CG1-CG 4.19Å; V536-E540 WeakPolarHBondContact CG1-OE1 3.44Å; V536-E540 WeakPolarHBondContact O-CG 3.48Å; V536-E540 PolarHBondContact O-N 2.88Å
537	R	78.4	Confident	82.9	Confident	107 Å²	107	62.5 Å²	62.5	40%	0.404	30%	0.298	S	S	.	.	H	α-helix	trans	-57.9	-41.6	178.9	-73.6	178.7	-63.4	-113.1	-1.8	112.3	E533 K534 I539 E540 L541	E533-R537 VanDerWaalsContact C-CZ 3.45Å; E533-R537 VanDerWaalsContact C-NH2 3.27Å; E533-R537 WeakPolarHBondContact O-CB 3.35Å; E533-R537 VanDerWaalsContact O-CG 3.25Å; E533-R537 WeakPolarHBondContact O-CG 3.4Å; E533-R537 PolarHBondContact O-N 3.14Å; E533-R537 PolarHBondContact O-NE 2.78Å; E533-R537 VanDerWaalsContact O-NE 3.08Å; E533-R537 PolarHBondContact O-NH2 3.24Å; E533-R537 IonicContact OE2-NH1 3.82Å; K534-R537 VanDerWaalsContact N-NH2 3.16Å; K534-R537 PolarHBondContact O-N 3.1Å; R537-I539 PolarHBondContact O-N 3.11Å; R537-E540 PolarHBondContact O-N 2.96Å; R537-L541 VanDerWaalsContact O-CB 3.28Å; R537-L541 WeakPolarHBondContact O-CB 3.23Å; R537-L541 WeakPolarHBondContact O-CD1 3.33Å; R537-L541 WeakPolarHBondContact O-CG 3.3Å; R537-L541 PolarHBondContact O-N 3.12Å
538	D	83.3	Confident	82.2	Confident	58 Å²	58	60 Å²	60	31%	0.31	29%	0.286	S	S	.	.	H	α-helix	trans	-69.6	-15.5	179.4	-71.9	-0.1	0	0	0	112.2	K534 V536 K542	K534-D538 WeakPolarHBondContact CE-OD2 3.49Å; K534-D538 IonicContact NZ-OD2 3.92Å; K534-D538 PolarHBondContact NZ-OD2 2.71Å; K534-D538 VanDerWaalsContact O-CB 3.29Å; K534-D538 WeakPolarHBondContact O-CB 3.25Å; K534-D538 VanDerWaalsContact O-CG 3.25Å; K534-D538 PolarHBondContact O-N 3Å; V536-D538 VanDerWaalsContact C-N 3.3Å; V536-D538 PolarHBondContact O-N 2.69Å; D538-K542 WeakPolarHBondContact O-CD 3.31Å; D538-K542 WeakPolarHBondContact O-CE 3.4Å; D538-K542 WeakPolarHBondContact O-CG 3.27Å; D538-K542 PolarHBondContact O-NZ 3.3Å
539	I	82.6	Confident	81.9	Confident	22 Å²	22	57.8 Å²	57.8	11%	0.113	28%	0.277	C	S	.	.	H	α-helix	trans	-94.2	-45.5	171.2	-70.6	168.4	0	0	0	111	W377 C380 V381 L384 E535 V536 R537 L541 K542 Q543	W377-I539 HydrophobicContact CB-CG2 4.44Å; W377-I539 HydrophobicContact CD2-CG2 4.42Å; W377-I539 HydrophobicContact CE3-CG2 3.65Å; W377-I539 HydrophobicContact CZ3-CG1 4.45Å; W377-I539 HydrophobicContact CZ3-CG2 4.34Å; C380-I539 HydrophobicContact CB-CD1 4.08Å; V381-I539 HydrophobicContact CG2-CB 4.21Å; V381-I539 HydrophobicContact CG2-CG2 3.55Å; L384-I539 HydrophobicContact CD1-CD1 3.63Å; E535-I539 WeakPolarHBondContact O-CG1 3.33Å; E535-I539 PolarHBondContact O-N 3.32Å; V536-I539 PolarHBondContact O-N 3.05Å; R537-I539 PolarHBondContact O-N 3.11Å; I539-L541 PolarHBondContact O-N 2.79Å; I539-K542 WeakPolarHBondContact O-CB 3.48Å; I539-K542 PolarHBondContact O-N 2.89Å; I539-Q543 PolarHBondContact O-N 3.46Å
540	E	74.6	Confident	81.9	Confident	79 Å²	79	59 Å²	59	37%	0.369	28%	0.283	S	S	.	.	H	α-helix	trans	-54.8	-40.9	173.9	-70.5	175.3	163.6	0	0	111.2	V536 R537 Q543 D544	V536-E540 HydrophobicContact CG1-CG 4.19Å; V536-E540 WeakPolarHBondContact CG1-OE1 3.44Å; V536-E540 WeakPolarHBondContact O-CG 3.48Å; V536-E540 PolarHBondContact O-N 2.88Å; R537-E540 PolarHBondContact O-N 2.96Å; E540-Q543 PolarHBondContact O-N 3.34Å; E540-D544 WeakPolarHBondContact O-CB 3.45Å; E540-D544 PolarHBondContact O-N 2.97Å
541	L	72.2	Confident	82.1	Confident	57 Å²	57	54.1 Å²	54.1	30%	0.298	26%	0.26	S	S	.	.	H	α-helix	trans	-61.1	-42.5	173.5	-78.1	166.1	0	0	0	112.7	R537 I539 D544 E545	R537-L541 VanDerWaalsContact O-CB 3.28Å; R537-L541 WeakPolarHBondContact O-CB 3.23Å; R537-L541 WeakPolarHBondContact O-CD1 3.33Å; R537-L541 WeakPolarHBondContact O-CG 3.3Å; R537-L541 PolarHBondContact O-N 3.12Å; I539-L541 PolarHBondContact O-N 2.79Å; L541-D544 PolarHBondContact O-N 3.44Å; L541-E545 WeakPolarHBondContact O-CB 3.44Å; L541-E545 VanDerWaalsContact O-CG 3.31Å; L541-E545 WeakPolarHBondContact O-CG 3.47Å; L541-E545 PolarHBondContact O-N 3.23Å
542	K	76.2	Confident	82.2	Confident	88 Å²	88	52.2 Å²	52.2	38%	0.383	25%	0.249	S	C	.	.	H	α-helix	trans	-66.5	-43.6	177.1	-69.1	175.6	-169.9	105.1	0	111.5	W377 D538 I539 D544 E545 H546	W377-K542 HydrophobicContact CH2-CD 4.07Å; W377-K542 HydrophobicContact CZ3-CD 4.33Å; D538-K542 WeakPolarHBondContact O-CD 3.31Å; D538-K542 WeakPolarHBondContact O-CE 3.4Å; D538-K542 WeakPolarHBondContact O-CG 3.27Å; D538-K542 PolarHBondContact O-NZ 3.3Å; I539-K542 WeakPolarHBondContact O-CB 3.48Å; I539-K542 PolarHBondContact O-N 2.89Å; K542-D544 VanDerWaalsContact C-N 3.3Å; K542-D544 PolarHBondContact O-N 3.07Å; K542-E545 PolarHBondContact O-N 3.01Å; K542-H546 PolarHBondContact O-CD2 2.77Å; K542-H546 VanDerWaalsContact O-CD2 3.24Å; K542-H546 PolarHBondContact O-N 3.3Å
543	Q	72.6	Confident	82.4	Confident	53 Å²	53	52.2 Å²	52.2	25%	0.248	25%	0.249	C	C	.	.	H	α-helix	trans	-61	-42.3	175.9	-170.1	173.6	4.9	0	0	110.5	I539 E540 H546 L547	I539-Q543 PolarHBondContact O-N 3.46Å; E540-Q543 PolarHBondContact O-N 3.34Å; Q543-H546 PolarHBondContact O-N 3.35Å; Q543-L547 PolarHBondContact O-N 3.29Å
544	D	69.7	Low	82.8	Confident	37 Å²	37	51.3 Å²	51.3	20%	0.198	25%	0.245	C	C	.	.	H	α-helix	trans	-62.8	-40.9	172.3	-96.3	-36	0	0	0	113.1	P343 E540 L541 K542 H546 L547 R549 R573	P343-D544 HydrophobicContact CB-CB 4.21Å; E540-D544 WeakPolarHBondContact O-CB 3.45Å; E540-D544 PolarHBondContact O-N 2.97Å; L541-D544 PolarHBondContact O-N 3.44Å; K542-D544 VanDerWaalsContact C-N 3.3Å; K542-D544 PolarHBondContact O-N 3.07Å; D544-H546 VanDerWaalsContact C-N 3.31Å; D544-H546 PolarHBondContact O-N 3.07Å; D544-L547 PolarHBondContact O-N 3.33Å; D544-R549 VanDerWaalsContact O-CZ 3.27Å; D544-R549 PolarHBondContact O-NH1 2.96Å; D544-R549 PolarHBondContact O-NH2 3.17Å; D544-R549 IonicContact OD1-CZ 2.79Å; D544-R549 IonicContact OD1-NH2 3.17Å; D544-R549 PolarHBondContact OD1-NH2 3.31Å; D544-R573 IonicContact OD2-CZ 2.73Å; D544-R573 IonicContact OD2-NH1 3.38Å; D544-R573 PolarHBondContact OD2-NH1 2.99Å; D544-R573 IonicContact OD2-NH2 3.48Å; D544-R573 PolarHBondContact OD2-NH2 3.24Å
545	E	70.5	Confident	83.1	Confident	123 Å²	123	45.8 Å²	45.8	58%	0.575	22%	0.221	S	C	*	.	H	α-helix	trans	-67.6	-30.6	177.6	-77.4	175.2	-178	0	0	112.4	L541 K542 L547	L541-E545 WeakPolarHBondContact O-CB 3.44Å; L541-E545 VanDerWaalsContact O-CG 3.31Å; L541-E545 WeakPolarHBondContact O-CG 3.47Å; L541-E545 PolarHBondContact O-N 3.23Å; K542-E545 PolarHBondContact O-N 3.01Å; E545-L547 VanDerWaalsContact C-N 3.27Å; E545-L547 PolarHBondContact O-N 3.44Å
546	H	74	Confident	83.3	Confident	70 Å²	70	46.6 Å²	46.6	32%	0.324	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-3.5	173.9	-84	-110.5	0	0	0	114.2	L370 S371 K542 Q543 D544	L370-H546 VanDerWaalsContact CB-O 3.31Å; L370-H546 WeakPolarHBondContact CB-O 3.43Å; L370-H546 WeakPolarHBondContact CG-O 3.46Å; L370-H546 PolarHBondContact N-O 3.42Å; S371-H546 PolarHBondContact OG-ND1 3.31Å; K542-H546 PolarHBondContact O-CD2 2.77Å; K542-H546 VanDerWaalsContact O-CD2 3.24Å; K542-H546 PolarHBondContact O-N 3.3Å; Q543-H546 PolarHBondContact O-N 3.35Å; D544-H546 VanDerWaalsContact C-N 3.31Å; D544-H546 PolarHBondContact O-N 3.07Å
547	L	77.6	Confident	83.7	Confident	51 Å²	51	46.2 Å²	46.2	27%	0.267	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	110.4	172.2	-69.2	175.4	0	0	0	111.8	Q543 D544 E545 R549	Q543-L547 PolarHBondContact O-N 3.29Å; D544-L547 PolarHBondContact O-N 3.33Å; E545-L547 VanDerWaalsContact C-N 3.27Å; E545-L547 PolarHBondContact O-N 3.44Å; L547-R549 PolarHBondContact O-N 3.19Å; L547-R549 PolarHBondContact O-NH1 2.95Å
548	A	82.3	Confident	84.3	Confident	29 Å²	29	48.5 Å²	48.5	24%	0.24	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	112.3	166.5	0	0	0	0	0	109.9	A367 K368 L370	A367-A548 CarbonylContact C-O 3.54Å; A367-A548 WeakPolarHBondContact CA-O 3.32Å; K368-A548 PolarHBondContact N-O 3.38Å; K368-A548 PolarHBondContact O-N 3.34Å; L370-A548 HydrophobicContact CD1-CB 4.29Å; L370-A548 HydrophobicContact CD2-CB 3.93Å; L370-A548 HydrophobicContact CG-CB 4.04Å
549	R	88.3	Confident	84.7	Confident	22 Å²	22	52 Å²	52	8%	0.083	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	128.9	179.1	-65.4	172.8	-168.4	73.8	-4.5	110.6	L341 P343 F365 S366 A367 D544 L547	L341-R549 HydrophobicContact CB-CB 4.09Å; L341-R549 WeakPolarHBondContact CD1-O 3.14Å; P343-R549 VanDerWaalsContact CA-CZ 3.49Å; F365-R549 HydrophobicContact CE2-CB 4.09Å; F365-R549 HydrophobicContact CE2-CG 4.37Å; F365-R549 HydrophobicContact CZ-CB 4.17Å; F365-R549 HydrophobicContact CZ-CG 3.97Å; S366-R549 WeakPolarHBondContact O-CA 3.38Å; A367-R549 HydrophobicContact CB-CG 4.22Å; D544-R549 VanDerWaalsContact O-CZ 3.27Å; D544-R549 PolarHBondContact O-NH1 2.96Å; D544-R549 PolarHBondContact O-NH2 3.17Å; D544-R549 IonicContact OD1-CZ 2.79Å; D544-R549 IonicContact OD1-NH2 3.17Å; D544-R549 PolarHBondContact OD1-NH2 3.31Å; L547-R549 PolarHBondContact O-N 3.19Å; L547-R549 PolarHBondContact O-NH1 2.95Å
550	E	92.9	Very high	85.2	Confident	48 Å²	48	55.1 Å²	55.1	22%	0.224	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	144.4	-179	-64.7	170.6	-164.2	0	0	110.5	V337 F338 E339 F365 S366 K368	V337-E550 HydrophobicContact CG1-CB 4.46Å; F338-E550 WeakPolarHBondContact O-CA 3.39Å; E339-E550 HydrophobicContact CG-CG 4.43Å; F365-E550 WeakPolarHBondContact CA-O 3.14Å; S366-E550 PolarHBondContact N-O 2.86Å; S366-E550 PolarHBondContact O-N 3.38Å; K368-E550 IonicContact NZ-OE1 2.65Å; K368-E550 PolarHBondContact NZ-OE1 3.1Å; K368-E550 IonicContact NZ-OE2 2.78Å; K368-E550 PolarHBondContact NZ-OE2 2.82Å
551	L	95.7	Very high	86	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	113.5	171.8	171.9	66.6	0	0	0	108.9	M303 V337 F338 L341 I350 V363 V553 V567	M303-L551 HydrophobicContact CE-CD2 4.17Å; V337-L551 CarbonylContact C-O 3.47Å; V337-L551 WeakPolarHBondContact CA-O 3.37Å; F338-L551 HydrophobicContact CB-CB 4.32Å; F338-L551 HydrophobicContact CD2-CB 4.47Å; F338-L551 HydrophobicContact CD2-CD2 4.13Å; F338-L551 HydrophobicContact CD2-CG 4.26Å; F338-L551 PolarHBondContact N-O 3.23Å; F338-L551 PolarHBondContact O-N 2.78Å; L341-L551 HydrophobicContact CD1-CB 3.95Å; L341-L551 HydrophobicContact CD2-CB 3.87Å; L341-L551 HydrophobicContact CD2-CD2 4.33Å; I350-L551 HydrophobicContact CD1-CD1 4.47Å; I350-L551 HydrophobicContact CG2-CD1 4.03Å; I350-L551 HydrophobicContact CG2-CD2 3.97Å; V363-L551 HydrophobicContact CG1-CD1 3.78Å; L551-V553 HydrophobicContact CG-CG2 4.34Å; L551-V567 HydrophobicContact CD2-CG1 3.76Å
552	S	95.6	Very high	87	Confident	16 Å²	16	56.5 Å²	56.5	11%	0.112	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	133.3	173.7	-171	0	0	0	0	110.7	E335 V363 S364	E335-S552 VanDerWaalsContact CD-OG 3.29Å; E335-S552 WeakPolarHBondContact CG-OG 3.48Å; E335-S552 PolarHBondContact OE1-OG 2.75Å; V363-S552 WeakPolarHBondContact CA-O 3.32Å; S364-S552 PolarHBondContact N-O 2.65Å; S364-S552 PolarHBondContact O-N 2.73Å
553	V	95.9	Very high	87.8	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	111.7	175.2	-177.9	0	0	0	0	107.9	V336 F338 V352 I360 D362 V363 L551 V555 M565	V336-V553 HydrophobicContact CB-CB 4.4Å; V336-V553 PolarHBondContact N-O 2.93Å; V336-V553 PolarHBondContact O-N 3.34Å; F338-V553 HydrophobicContact CE2-CG2 4.09Å; V352-V553 HydrophobicContact CG1-CG1 4.3Å; V352-V553 HydrophobicContact CG1-CG2 4.44Å; V352-V553 HydrophobicContact CG2-CG2 4.07Å; I360-V553 HydrophobicContact CG1-CG1 4.34Å; I360-V553 HydrophobicContact CG2-CG1 4.1Å; D362-V553 WeakPolarHBondContact O-CA 3.39Å; V363-V553 HydrophobicContact CG1-CG2 4.43Å; V363-V553 HydrophobicContact CG2-CG1 4.35Å; L551-V553 HydrophobicContact CG-CG2 4.34Å; V553-V555 HydrophobicContact CG1-CG2 3.91Å; V553-M565 HydrophobicContact CG1-CE 3.97Å
554	L	95.4	Very high	88.8	Confident	25 Å²	25	52.2 Å²	52.2	13%	0.131	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	122.1	178.4	-165.8	68.2	0	0	0	109.3	I333 E335 L361 D362	I333-L554 HydrophobicContact CG2-CD1 3.63Å; I333-L554 HydrophobicContact CG2-CD2 4.33Å; I333-L554 HydrophobicContact CG2-CG 3.85Å; E335-L554 HydrophobicContact CB-CD1 4.31Å; L361-L554 HydrophobicContact CB-CB 4.24Å; L361-L554 HydrophobicContact CB-CD2 4.07Å; L361-L554 HydrophobicContact CB-CG 4.21Å; L361-L554 HydrophobicContact CD1-CD2 4.14Å; L361-L554 HydrophobicContact CD1-CG 4.28Å; L361-L554 PolarHBondContact N-O 3.02Å; D362-L554 HydrophobicContact CB-CB 3.95Å; D362-L554 PolarHBondContact O-N 2.81Å
555	V	94.8	Very high	90.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	133.5	-173	-176.8	0	0	0	0	110.9	F328 T334 V336 I354 A358 T359 V553 P557 M565	F328-V555 HydrophobicContact CE1-CB 4.17Å; F328-V555 HydrophobicContact CE1-CG1 4.15Å; F328-V555 HydrophobicContact CE2-CG1 4.06Å; F328-V555 HydrophobicContact CZ-CB 4.08Å; F328-V555 HydrophobicContact CZ-CG1 3.79Å; F328-V555 HydrophobicContact CZ-CG2 4.13Å; T334-V555 PolarHBondContact N-O 3.49Å; T334-V555 PolarHBondContact O-N 3.37Å; V336-V555 HydrophobicContact CG2-CG2 4.19Å; I354-V555 HydrophobicContact CD1-CG1 3.77Å; I354-V555 HydrophobicContact CD1-CG2 4.31Å; A358-V555 HydrophobicContact CB-CG1 3.91Å; T359-V555 CarbonylContact O-C 3.6Å; T359-V555 WeakPolarHBondContact O-CA 3.36Å; V553-V555 HydrophobicContact CG1-CG2 3.91Å; V555-P557 WeakPolarHBondContact O-CD 3.32Å; V555-M565 HydrophobicContact CG2-CE 3.85Å
556	E	93.5	Very high	91.3	Very high	83 Å²	83	45.8 Å²	45.8	39%	0.388	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	110.7	168.1	-174.8	-172.6	-140.6	0	0	109.8	A358 T359 L361	A358-E556 CarbonylContact C-O 3.5Å; A358-E556 VanDerWaalsContact CA-O 3.24Å; A358-E556 WeakPolarHBondContact CA-O 3.49Å; T359-E556 PolarHBondContact N-O 3.39Å; T359-E556 PolarHBondContact O-N 3.07Å; L361-E556 HydrophobicContact CD1-CB 4.09Å; L361-E556 HydrophobicContact CD2-CB 4.16Å; L361-E556 HydrophobicContact CG-CB 4.1Å
557	P	91.8	Very high	92.4	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.013	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	124.6	179.5	-3.5	24	0	0	0	111.4	F328 N329 S331 D332 V555	F328-P557 HydrophobicContact CB-CB 3.47Å; F328-P557 VanDerWaalsContact CB-CB 3.47Å; F328-P557 HydrophobicContact CB-CG 3.52Å; F328-P557 HydrophobicContact CD1-CG 3.93Å; F328-P557 HydrophobicContact CD2-CB 4.47Å; F328-P557 HydrophobicContact CG-CB 3.99Å; F328-P557 HydrophobicContact CG-CG 3.77Å; N329-P557 WeakPolarHBondContact O-CB 3.37Å; N329-P557 WeakPolarHBondContact O-CG 3.38Å; S331-P557 PolarHBondContact N-O 2.92Å; D332-P557 WeakPolarHBondContact O-CD 3.3Å; D332-P557 WeakPolarHBondContact O-CG 3.25Å; V555-P557 WeakPolarHBondContact O-CD 3.32Å
558	R	90.4	Very high	93.3	Very high	154 Å²	154	41.6 Å²	41.6	58%	0.581	21%	0.212	S	C	*	.	S	Bend	trans	-86.6	-22.2	178.4	-66.8	176.8	-86.2	155.2	-4	112.8	A357 A358	A357-R558 HydrophobicContact CB-CB 4.29Å; A357-R558 WeakPolarHBondContact O-CA 3.38Å; A357-R558 WeakPolarHBondContact O-CB 3.11Å; A357-R558 PolarHBondContact O-N 2.88Å; A358-R558 PolarHBondContact O-NH2 2.91Å
559	E	92.2	Very high	93.9	Very high	132 Å²	132	40.2 Å²	40.2	62%	0.617	20%	0.2	S	C	*	.	S	Bend	trans	-138.2	149.2	176.4	-63	172.5	-162.1	0	0	111.2	A357 G561	A357-E559 HydrophobicContact CB-CB 3.78Å; A357-E559 VanDerWaalsContact CB-CD 3.44Å; A357-E559 HydrophobicContact CB-CG 3.6Å; A357-E559 PolarHBondContact O-N 3.02Å; E559-G561 PolarHBondContact O-N 3Å
560	T	92.3	Very high	94.2	Very high	87 Å²	87	40.3 Å²	40.3	53%	0.534	20%	0.203	S	C	.	.	S	Bend	trans	-76.4	110.6	174.4	-61.1	0	0	0	0	109.9	F328 A330	F328-T560 CarbonylContact O-C 3.57Å; F328-T560 WeakPolarHBondContact O-CA 3.38Å; A330-T560 PolarHBondContact N-OG1 3.17Å
561	G	92	Very high	94.3	Very high	24 Å²	24	38 Å²	38	25%	0.247	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.1	-179.6	-174.5	0	0	0	0	0	114.4	R327 F328 E559	R327-G561 CarbonylContact C-O 3.58Å; R327-G561 WeakPolarHBondContact CA-O 3.49Å; F328-G561 PolarHBondContact N-O 3.24Å; F328-G561 PolarHBondContact O-N 2.99Å; F328-G561 VanDerWaalsContact O-N 3.07Å; E559-G561 PolarHBondContact O-N 3Å
562	Q	92.8	Very high	94	Very high	141 Å²	141	40.6 Å²	40.6	66%	0.659	21%	0.206	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	137.9	164.6	-80.9	-177.3	-21.1	0	0	109.7	P326 R327	P326-Q562 WeakPolarHBondContact O-CA 3.47Å; R327-Q562 HydrophobicContact CB-CG 4.06Å; R327-Q562 HydrophobicContact CG-CG 4.28Å
563	V	92.5	Very high	93.7	Very high	8 Å²	8	42.8 Å²	42.8	5%	0.048	21%	0.212	C	C	.	.			trans	-125.2	136.4	-180	176.9	0	0	0	0	108	R325 P326 F328 I354 A358	R325-V563 WeakPolarHBondContact CA-O 3.45Å; P326-V563 WeakPolarHBondContact CD-O 3.32Å; P326-V563 PolarHBondContact O-N 3.06Å; P326-V563 VanDerWaalsContact O-N 3.11Å; F328-V563 HydrophobicContact CD2-CB 4.06Å; F328-V563 HydrophobicContact CD2-CG2 3.84Å; F328-V563 HydrophobicContact CE2-CB 3.96Å; F328-V563 HydrophobicContact CE2-CG2 4.23Å; I354-V563 HydrophobicContact CD1-CG1 3.85Å; I354-V563 HydrophobicContact CG1-CG1 3.37Å; A358-V563 HydrophobicContact CB-CG1 4.3Å; A358-V563 HydrophobicContact CB-CG2 4.36Å
564	E	95	Very high	93.6	Very high	43 Å²	43	43.3 Å²	43.3	20%	0.201	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	121.4	178.2	-179	165.2	-90.2	0	0	109.8	R323 R325 R355	R323-E564 WeakPolarHBondContact CD-OE1 3.24Å; R323-E564 HydrophobicContact CG-CG 4.25Å; R325-E564 HydrophobicContact CG-CB 4.43Å; R325-E564 IonicContact CZ-OE1 3.77Å; R325-E564 VanDerWaalsContact CZ-OE1 3.28Å; R325-E564 IonicContact NE-OE1 3.44Å; R325-E564 PolarHBondContact NE-OE1 2.97Å; R325-E564 IonicContact NH2-OE1 3.84Å; R325-E564 PolarHBondContact NH2-OE1 3.07Å; R355-E564 HydrophobicContact CB-CB 4.31Å; R355-E564 PolarHBondContact N-O 3.26Å; R355-E564 PolarHBondContact O-N 3.05Å
565	M	95.9	Very high	93.5	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	137.7	176.9	178	-171.1	-75.8	0	0	109.1	I324 V336 F338 V352 E353 I354 V553 V555 V567	I324-M565 HydrophobicContact CG2-CB 3.85Å; I324-M565 HydrophobicContact CG2-CG 4.19Å; I324-M565 HydrophobicContact CG2-SD 4.14Å; I324-M565 PolarHBondContact N-O 2.72Å; I324-M565 PolarHBondContact O-N 3.41Å; I324-M565 VanDerWaalsContact O-O 3.14Å; V336-M565 HydrophobicContact CG2-CE 4.5Å; F338-M565 HydrophobicContact CE2-SD 4.15Å; F338-M565 HydrophobicContact CZ-SD 3.84Å; V352-M565 HydrophobicContact CG1-CG 3.82Å; V352-M565 HydrophobicContact CG1-SD 4.07Å; E353-M565 WeakPolarHBondContact O-CA 3.44Å; E353-M565 WeakPolarHBondContact O-CG 3.02Å; I354-M565 HydrophobicContact CD1-CE 4.05Å; V553-M565 HydrophobicContact CG1-CE 3.97Å; V555-M565 HydrophobicContact CG2-CE 3.85Å; M565-V567 HydrophobicContact CG-CG2 4.45Å; M565-V567 HydrophobicContact SD-CG2 4.4Å
566	L	96.3	Very high	93.5	Very high	26 Å²	26	42.7 Å²	42.7	14%	0.136	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	129	174.8	-55.2	175.4	0	0	0	108	R322 R323 V352 E353	R322-L566 WeakPolarHBondContact O-CA 3.41Å; R323-L566 HydrophobicContact CB-CD2 3.67Å; R323-L566 HydrophobicContact CG-CD2 3.74Å; V352-L566 CarbonylContact C-O 3.6Å; V352-L566 WeakPolarHBondContact CA-O 3.39Å; E353-L566 HydrophobicContact CB-CB 4.26Å; E353-L566 PolarHBondContact N-O 2.93Å; E353-L566 PolarHBondContact O-N 2.99Å
567	V	96.8	Very high	93.6	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	119.3	172.4	-175.9	0	0	0	0	107.1	M303 C321 R322 F338 V352 L551 M565 Y569	M303-V567 HydrophobicContact CE-CG1 3.99Å; C321-V567 WeakPolarHBondContact CA-O 3.34Å; R322-V567 PolarHBondContact N-O 2.95Å; R322-V567 PolarHBondContact O-N 3.28Å; F338-V567 HydrophobicContact CE1-CG2 4.4Å; F338-V567 HydrophobicContact CE2-CG2 3.98Å; F338-V567 HydrophobicContact CZ-CG2 3.81Å; V352-V567 HydrophobicContact CG1-CG2 4.37Å; V352-V567 HydrophobicContact CG2-CG1 4.44Å; V352-V567 HydrophobicContact CG2-CG2 4.37Å; L551-V567 HydrophobicContact CD2-CG1 3.76Å; M565-V567 HydrophobicContact CG-CG2 4.45Å; M565-V567 HydrophobicContact SD-CG2 4.4Å; V567-Y569 HydrophobicContact CG1-CD1 4.37Å
568	S	96.2	Very high	93.7	Very high	31 Å²	31	44.5 Å²	44.5	22%	0.217	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	135.2	178.5	61.3	0	0	0	0	111.4	I320 R351	I320-S568 CarbonylContact O-C 3.6Å; I320-S568 WeakPolarHBondContact O-CA 3.3Å; R351-S568 PolarHBondContact N-O 3.37Å; R351-S568 PolarHBondContact O-N 3.1Å; R351-S568 PolarHBondContact O-OG 3.4Å
569	Y	95.4	Very high	93.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	154.3	-176.4	58.7	-89.9	0	0	0	110.6	M303 I320 R322 I345 V567 V571 E605	M303-Y569 HydrophobicContact CG-CE1 4.42Å; M303-Y569 HydrophobicContact SD-CE1 4.21Å; I320-Y569 HydrophobicContact CB-CD2 4.36Å; I320-Y569 HydrophobicContact CB-CE1 4.32Å; I320-Y569 HydrophobicContact CB-CE2 3.98Å; I320-Y569 HydrophobicContact CD1-CE2 3.89Å; I320-Y569 HydrophobicContact CG1-CE2 4.46Å; I320-Y569 HydrophobicContact CG2-CE1 3.86Å; I320-Y569 HydrophobicContact CG2-CE2 4.17Å; I320-Y569 PolarHBondContact N-O 2.87Å; I320-Y569 PolarHBondContact O-N 3.17Å; R322-Y569 PolarHBondContact NE-OH 2.56Å; R322-Y569 VanDerWaalsContact NE-OH 3.09Å; I345-Y569 HydrophobicContact CD1-CD1 4.49Å; I345-Y569 HydrophobicContact CD1-CD2 3.64Å; I345-Y569 HydrophobicContact CD1-CE2 4.29Å; I345-Y569 HydrophobicContact CD1-CG 3.76Å; I345-Y569 HydrophobicContact CG1-CD2 3.8Å; I345-Y569 HydrophobicContact CG1-CG 4.23Å; V567-Y569 HydrophobicContact CG1-CD1 4.37Å; Y569-V571 HydrophobicContact CD2-CG1 3.76Å; Y569-V571 HydrophobicContact CE2-CG1 3.59Å; Y569-E605 PolarHBondContact OH-OE1 2.85Å; Y569-E605 PolarHBondContact OH-OE2 3.03Å
570	V	95.2	Very high	94.1	Very high	23 Å²	23	31.5 Å²	31.5	14%	0.139	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	139.9	173.1	173.4	0	0	0	0	109.3	R317 A318 L319 D346 S349	R317-V570 HydrophobicContact CB-CG1 4.08Å; R317-V570 HydrophobicContact CG-CG1 4.08Å; A318-V570 CarbonylContact O-C 3.59Å; A318-V570 VanDerWaalsContact O-CA 3.27Å; A318-V570 WeakPolarHBondContact O-CA 3.48Å; L319-V570 HydrophobicContact CD1-CG2 4.13Å; D346-V570 HydrophobicContact CB-CB 4.21Å; D346-V570 HydrophobicContact CB-CG1 4.45Å; D346-V570 PolarHBondContact N-O 3.38Å; S349-V570 PolarHBondContact OG-N 3.41Å
571	V	94	Very high	94.2	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	137.6	168.9	-68.6	0	0	0	0	110.1	R317 A318 I320 A344 Y569 C574 T603 W607	R317-V571 CarbonylContact C-O 3.57Å; R317-V571 WeakPolarHBondContact CA-O 3.26Å; R317-V571 WeakPolarHBondContact CB-O 3.34Å; A318-V571 HydrophobicContact CB-CG2 4.01Å; A318-V571 PolarHBondContact N-O 2.76Å; A318-V571 PolarHBondContact O-N 3.16Å; I320-V571 HydrophobicContact CD1-CG1 4.13Å; I320-V571 HydrophobicContact CD1-CG2 3.66Å; I320-V571 HydrophobicContact CG1-CG2 4.25Å; A344-V571 HydrophobicContact CB-CB 4.35Å; A344-V571 WeakPolarHBondContact O-CA 3.37Å; Y569-V571 HydrophobicContact CD2-CG1 3.76Å; Y569-V571 HydrophobicContact CE2-CG1 3.59Å; V571-C574 PolarHBondContact O-SG 2.97Å; V571-T603 HydrophobicContact CB-CG2 4.16Å; V571-T603 HydrophobicContact CG2-CG2 3.92Å; V571-W607 HydrophobicContact CG2-CZ2 4.01Å
572	N	89.2	Confident	94.2	Very high	56 Å²	56	26.4 Å²	26.4	30%	0.299	13%	0.134	S	C	.	.			trans	-87.4	-160.3	172.3	-60.1	-49.9	0	0	0	109.7	A344 C574 T603	A344-N572 PolarHBondContact O-N 3.12Å; N572-C574 PolarHBondContact O-N 2.94Å; N572-C574 VanDerWaalsContact O-N 3.11Å; N572-C574 PolarHBondContact O-SG 2.63Å; N572-T603 VanDerWaalsContact O-CG2 3.31Å; N572-T603 WeakPolarHBondContact O-CG2 3.17Å
573	R	89.6	Confident	94.2	Very high	62 Å²	62	22.4 Å²	22.4	23%	0.234	11%	0.113	C	C	.	.	S	Bend	trans	54.1	31.8	177.5	-61.5	-173.3	174.7	128.7	2.4	113.9	A344 D544 A602 Y729	A344-R573 HydrophobicContact CB-CB 4.09Å; A344-R573 HydrophobicContact CB-CG 4.23Å; D544-R573 IonicContact OD2-CZ 2.73Å; D544-R573 IonicContact OD2-NH1 3.38Å; D544-R573 PolarHBondContact OD2-NH1 2.99Å; D544-R573 IonicContact OD2-NH2 3.48Å; D544-R573 PolarHBondContact OD2-NH2 3.24Å; R573-A602 HydrophobicContact CB-CB 4.46Å; R573-A602 PolarHBondContact O-N 2.96Å; R573-Y729 WeakPolarHBondContact CA-OH 3.24Å; R573-Y729 PolarHBondContact N-OH 3.25Å
574	C	93.7	Very high	94	Very high	10 Å²	10	22 Å²	22	7%	0.068	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	168.4	178.3	59.6	0	0	0	0	111.5	D316 R317 A318 V571 N572 Q600 Q601 T603 W607	D316-C574 CarbonylContact C-O 3.58Å; D316-C574 VanDerWaalsContact O-O 3.13Å; R317-C574 VanDerWaalsContact C-SG 3.54Å; R317-C574 PolarHBondContact N-O 2.74Å; A318-C574 PolarHBondContact N-SG 3.27Å; A318-C574 VanDerWaalsContact N-SG 3.37Å; V571-C574 PolarHBondContact O-SG 2.97Å; N572-C574 PolarHBondContact O-N 2.94Å; N572-C574 VanDerWaalsContact O-N 3.11Å; N572-C574 PolarHBondContact O-SG 2.63Å; C574-Q600 CarbonylContact C-O 3.56Å; C574-Q600 VanDerWaalsContact CA-O 3.24Å; C574-Q600 WeakPolarHBondContact CA-O 3.27Å; C574-Q600 WeakPolarHBondContact CB-O 3.28Å; C574-Q601 HydrophobicContact CB-CB 3.54Å; C574-T603 HydrophobicContact CB-CG2 3.77Å; C574-W607 HydrophobicContact CB-CH2 3.64Å; C574-W607 HydrophobicContact CB-CZ2 4.07Å
575	G	94	Very high	93.6	Very high	9 Å²	9	22.3 Å²	22.3	9%	0.093	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.9	-171.3	174	0	0	0	0	0	112.8	F314 Q600	F314-G575 VanDerWaalsContact O-CA 3.27Å; F314-G575 WeakPolarHBondContact O-CA 3.31Å; G575-Q600 PolarHBondContact N-O 3.47Å; G575-Q600 PolarHBondContact O-N 2.86Å
576	W	95.1	Very high	92.6	Very high	4 Å²	4	26.5 Å²	26.5	2%	0.015	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	156.4	171.7	77	-79.9	0	0	0	112.8	V313 F314 L315 P578 M598 V599 L614 S615 T616 L936 L992	V313-W576 HydrophobicContact CG1-CB 4.27Å; V313-W576 VanDerWaalsContact O-CD1 3.24Å; V313-W576 PolarHBondContact O-NE1 2.86Å; F314-W576 PolarHBondContact O-N 3.24Å; L315-W576 HydrophobicContact CD2-CZ2 4.31Å; L315-W576 WeakPolarHBondContact CD2-O 3.25Å; W576-P578 HydrophobicContact CZ3-CB 4.16Å; W576-M598 CarbonylContact C-O 3.52Å; W576-M598 WeakPolarHBondContact CA-O 3.46Å; W576-V599 HydrophobicContact CB-CG2 3.98Å; W576-L614 HydrophobicContact CB-CD2 4.25Å; W576-L614 HydrophobicContact CD2-CB 3.84Å; W576-L614 HydrophobicContact CD2-CD1 3.97Å; W576-L614 HydrophobicContact CD2-CD2 4.44Å; W576-L614 HydrophobicContact CD2-CG 4.3Å; W576-L614 HydrophobicContact CE3-CB 4.28Å; W576-L614 HydrophobicContact CE3-CD1 3.76Å; W576-L614 HydrophobicContact CG-CB 4.2Å; W576-L614 HydrophobicContact CG-CD1 4.35Å; W576-L614 HydrophobicContact CG-CD2 4.06Å; W576-L614 HydrophobicContact CG-CG 4.44Å; W576-L614 HydrophobicContact CH2-CB 4.32Å; W576-L614 HydrophobicContact CZ2-CB 3.92Å; W576-L614 HydrophobicContact CZ3-CB 4.5Å; W576-L614 HydrophobicContact CZ3-CD1 4.17Å; W576-S615 PolarHBondContact NE1-O 3.21Å; W576-T616 HydrophobicContact CH2-CG2 4.39Å; W576-T616 HydrophobicContact CZ2-CG2 3.92Å; W576-L936 HydrophobicContact CH2-CD1 3.67Å; W576-L936 HydrophobicContact CZ2-CD1 4.31Å; W576-L936 HydrophobicContact CZ3-CD1 4.37Å; W576-L992 HydrophobicContact CH2-CD1 3.54Å; W576-L992 HydrophobicContact CZ2-CD1 4.24Å; W576-L992 HydrophobicContact CZ3-CD1 4.31Å
577	K	94.6	Very high	91.6	Very high	104 Å²	104	33 Å²	33	45%	0.452	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	143.5	174.6	-65.5	173	-177.5	169.8	0	110.4	M598	K577-M598 PolarHBondContact N-O 3.48Å; K577-M598 PolarHBondContact O-N 2.86Å
578	P	94.5	Very high	90.5	Very high	19 Å²	19	38 Å²	38	12%	0.123	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	144.1	174.4	30.4	-36.1	0	0	0	111.5	W576 Y580 Y595 L992 A993	W576-P578 HydrophobicContact CZ3-CB 4.16Å; P578-Y580 HydrophobicContact CB-CE2 4.16Å; P578-Y595 HydrophobicContact CB-CE2 3.79Å; P578-L992 HydrophobicContact CB-CB 3.97Å; P578-L992 HydrophobicContact CB-CD1 4.31Å; P578-L992 HydrophobicContact CG-CB 3.9Å; P578-L992 HydrophobicContact CG-CD1 4.3Å; P578-A993 WeakPolarHBondContact CG-O 3.48Å
579	A	95.3	Very high	89.6	Confident	11 Å²	11	37.9 Å²	37.9	9%	0.091	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	155.6	170.3	0	0	0	0	0	110.9	Y596 M598	A579-Y596 PolarHBondContact N-O 2.81Å; A579-Y596 PolarHBondContact O-N 2.89Å; A579-M598 HydrophobicContact CB-CG 3.7Å; A579-M598 HydrophobicContact CB-SD 4.32Å
580	Y	94.8	Very high	89.2	Confident	1 Å²	1	39.8 Å²	39.8	0%	0.004	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	144.7	-171.9	-57.2	-86.6	0	0	0	113.2	P578 I593 V594 Y595 I991 L992 P995 T996 N997 I1010	P578-Y580 HydrophobicContact CB-CE2 4.16Å; Y580-I593 HydrophobicContact CD1-CG2 3.77Å; Y580-I593 HydrophobicContact CG-CG2 4.42Å; Y580-V594 WeakPolarHBondContact CA-O 3.39Å; Y580-Y595 AromaticContact CD1-CD2 3.77Å; Y580-Y595 HydrophobicContact CD1-CD2 3.77Å; Y580-Y595 HydrophobicContact CD1-CG 4.18Å; Y580-Y595 HydrophobicContact CE1-CD1 4.35Å; Y580-Y595 AromaticContact CE1-CD2 3.1Å; Y580-Y595 HydrophobicContact CE1-CD2 3.1Å; Y580-Y595 AromaticContact CE1-CE2 3.69Å; Y580-Y595 HydrophobicContact CE1-CE2 3.69Å; Y580-Y595 AromaticContact CE1-CG 3.52Å; Y580-Y595 HydrophobicContact CE1-CG 3.52Å; Y580-Y595 HydrophobicContact CE2-CD2 4.44Å; Y580-Y595 HydrophobicContact CE2-CE2 4.44Å; Y580-Y595 AromaticContact CZ-CD2 3.5Å; Y580-Y595 VanDerWaalsContact CZ-CD2 3.5Å; Y580-Y595 AromaticContact CZ-CE2 3.55Å; Y580-Y595 WeakPolarHBondContact OH-CE2 3.42Å; Y580-I991 HydrophobicContact CE1-CG2 3.96Å; Y580-I991 HydrophobicContact CE2-CG2 4.45Å; Y580-L992 WeakPolarHBondContact CE2-O 3.33Å; Y580-L992 PolarHBondContact OH-N 3.19Å; Y580-L992 VanDerWaalsContact OH-N 3.09Å; Y580-L992 PolarHBondContact OH-O 3.08Å; Y580-L992 VanDerWaalsContact OH-O 3.07Å; Y580-P995 PolarHBondContact N-O 3.11Å; Y580-T996 CarbonylContact O-C 3.57Å; Y580-T996 WeakPolarHBondContact O-CA 3.45Å; Y580-N997 PolarHBondContact O-N 3.36Å; Y580-I1010 HydrophobicContact CD2-CG2 3.37Å; Y580-I1010 HydrophobicContact CE2-CG2 3.36Å; Y580-I1010 HydrophobicContact CG-CG2 4.11Å
581	D	94.8	Very high	89	Confident	4 Å²	4	38.7 Å²	38.7	2%	0.021	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	114.2	160.5	-68.5	-5.9	0	0	0	108.2	V594 Y596 R953 N997 Y999	D581-V594 HydrophobicContact CB-CB 4.4Å; D581-V594 PolarHBondContact N-O 3.1Å; D581-V594 PolarHBondContact O-N 3.19Å; D581-Y596 HydrophobicContact CB-CE2 3.95Å; D581-Y596 PolarHBondContact OD2-OH 3.08Å; D581-R953 IonicContact OD1-NH1 3.57Å; D581-R953 PolarHBondContact OD1-NH1 2.84Å; D581-R953 IonicContact OD1-NH2 3.53Å; D581-R953 IonicContact OD2-CZ 3.22Å; D581-R953 IonicContact OD2-NH1 2.67Å; D581-R953 PolarHBondContact OD2-NH1 2.86Å; D581-N997 CarbonylContact C-O 3.57Å; D581-N997 WeakPolarHBondContact CA-O 3.44Å; D581-N997 WeakPolarHBondContact OD1-CB 3.24Å; D581-N997 PolarHBondContact OD1-ND2 2.81Å; D581-Y999 HydrophobicContact CB-CD2 4.4Å; D581-Y999 HydrophobicContact CB-CE2 3.94Å
582	I	92.8	Very high	88.9	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	125.7	172.6	-66.7	-177.1	0	0	0	109	I584 M591 I593 T996 N997 Y999 C1021	I582-I584 HydrophobicContact CG2-CG1 4.48Å; I582-M591 HydrophobicContact CG2-CG 3.67Å; I582-M591 HydrophobicContact CG2-SD 3.71Å; I582-I593 HydrophobicContact CD1-CD1 4.28Å; I582-I593 HydrophobicContact CG1-CB 4.49Å; I582-I593 HydrophobicContact CG1-CD1 4.32Å; I582-I593 HydrophobicContact CG1-CG1 4.07Å; I582-I593 HydrophobicContact CG1-CG2 4.08Å; I582-T996 HydrophobicContact CB-CG2 4.26Å; I582-T996 HydrophobicContact CD1-CG2 3.61Å; I582-T996 HydrophobicContact CG1-CG2 3.59Å; I582-N997 PolarHBondContact N-O 2.94Å; I582-Y999 PolarHBondContact O-N 3.44Å; I582-C1021 HydrophobicContact CD1-CB 4.18Å; I582-C1021 VanDerWaalsContact CD1-SG 3.58Å
583	R	92.1	Very high	89	Confident	57 Å²	57	38.8 Å²	38.8	22%	0.215	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	116	175.6	-61.3	-174.2	177.1	-90.5	-17.8	110.3	F585 M591 K592 Y999 N1002	R583-F585 HydrophobicContact CB-CE2 3.92Å; R583-F585 HydrophobicContact CB-CZ 3.94Å; R583-M591 CarbonylContact O-C 3.51Å; R583-M591 WeakPolarHBondContact O-CA 3.27Å; R583-K592 PolarHBondContact N-O 2.77Å; R583-K592 PolarHBondContact O-N 2.76Å; R583-Y999 WeakPolarHBondContact CA-O 3.42Å; R583-Y999 HydrophobicContact CG-CD2 4.31Å; R583-N1002 PolarHBondContact NH1-OD1 3.22Å
584	I	88.7	Confident	89.2	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	136.7	173.1	-62.4	140.9	0	0	0	108.3	I582 Y965 I998 Y999 A1000 D1001 L1023	I582-I584 HydrophobicContact CG2-CG1 4.48Å; I584-Y965 HydrophobicContact CG1-CE1 4.48Å; I584-Y965 HydrophobicContact CG2-CE1 4.22Å; I584-I998 HydrophobicContact CD1-CG2 3.95Å; I584-Y999 PolarHBondContact N-O 3.37Å; I584-A1000 HydrophobicContact CB-CB 3.99Å; I584-A1000 HydrophobicContact CD1-CB 4.27Å; I584-A1000 HydrophobicContact CG2-CB 4.21Å; I584-A1000 WeakPolarHBondContact O-CA 3.39Å; I584-D1001 PolarHBondContact O-N 3.18Å; I584-L1023 HydrophobicContact CD1-CB 4.1Å; I584-L1023 HydrophobicContact CD1-CD1 3.48Å; I584-L1023 VanDerWaalsContact CD1-CD1 3.48Å; I584-L1023 HydrophobicContact CD1-CD2 4.02Å; I584-L1023 HydrophobicContact CD1-CG 4.05Å; I584-L1023 HydrophobicContact CG1-CD1 4Å
585	F	85.4	Confident	89.2	Confident	48 Å²	48	36.2 Å²	36.2	21%	0.211	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	106.1	172.3	-60.6	-76.7	0	0	0	108.6	R583 N587 D588 G589 T590 K592	R583-F585 HydrophobicContact CB-CE2 3.92Å; R583-F585 HydrophobicContact CB-CZ 3.94Å; F585-N587 VanDerWaalsContact C-N 3.26Å; F585-N587 PolarHBondContact O-N 3.3Å; F585-D588 WeakPolarHBondContact CB-OD1 3.44Å; F585-G589 WeakPolarHBondContact O-CA 3.27Å; F585-G589 PolarHBondContact O-N 3.11Å; F585-T590 PolarHBondContact N-O 2.8Å; F585-T590 VanDerWaalsContact N-O 3.1Å; F585-K592 HydrophobicContact CE2-CB 4.16Å
586	N	76	Confident	89.2	Confident	88 Å²	88	37.1 Å²	37.1	47%	0.471	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-24.4	-171.2	-73	-50.4	0	0	0	112.8	D1001	N586-D1001 WeakPolarHBondContact CB-OD2 3.29Å; N586-D1001 PolarHBondContact N-OD1 3.44Å; N586-D1001 PolarHBondContact ND2-OD2 2.8Å
587	N	74.4	Confident	89.2	Confident	163 Å²	163	37 Å²	37	87%	0.872	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-28.7	-177	-68.6	-30.5	0	0	0	114.1	F585	F585-N587 VanDerWaalsContact C-N 3.26Å; F585-N587 PolarHBondContact O-N 3.3Å
588	D	75.3	Confident	89.3	Confident	107 Å²	107	34.1 Å²	34.1	57%	0.572	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117.9	-8.3	179	62.1	25.9	0	0	0	113.5	F585 T590	F585-D588 WeakPolarHBondContact CB-OD1 3.44Å; D588-T590 VanDerWaalsContact C-N 3.26Å; D588-T590 HydrophobicContact CB-CG2 4.36Å; D588-T590 PolarHBondContact O-N 2.97Å; D588-T590 VanDerWaalsContact OD1-CB 3.27Å; D588-T590 WeakPolarHBondContact OD1-CB 3.2Å; D588-T590 VanDerWaalsContact OD1-CG2 3.32Å; D588-T590 WeakPolarHBondContact OD1-CG2 3.37Å; D588-T590 PolarHBondContact OD1-N 2.9Å; D588-T590 PolarHBondContact OD1-OG1 3.47Å; D588-T590 PolarHBondContact OD2-OG1 3.19Å
589	G	77.3	Confident	89.4	Confident	28 Å²	28	33.2 Å²	33.2	29%	0.289	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.4	9.6	-179.8	0	0	0	0	0	114.1	F585 Y965	F585-G589 WeakPolarHBondContact O-CA 3.27Å; F585-G589 PolarHBondContact O-N 3.11Å; G589-Y965 WeakPolarHBondContact O-CE2 3.37Å
590	T	86.2	Confident	89.4	Confident	41 Å²	41	35.7 Å²	35.7	25%	0.252	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	159.5	-179.6	66.3	0	0	0	0	112.4	F585 D588 Y965	F585-T590 PolarHBondContact N-O 2.8Å; F585-T590 VanDerWaalsContact N-O 3.1Å; D588-T590 VanDerWaalsContact C-N 3.26Å; D588-T590 HydrophobicContact CB-CG2 4.36Å; D588-T590 PolarHBondContact O-N 2.97Å; D588-T590 VanDerWaalsContact OD1-CB 3.27Å; D588-T590 WeakPolarHBondContact OD1-CB 3.2Å; D588-T590 VanDerWaalsContact OD1-CG2 3.32Å; D588-T590 WeakPolarHBondContact OD1-CG2 3.37Å; D588-T590 PolarHBondContact OD1-N 2.9Å; D588-T590 PolarHBondContact OD1-OG1 3.47Å; D588-T590 PolarHBondContact OD2-OG1 3.19Å; T590-Y965 PolarHBondContact O-OH 2.86Å
591	M	90	Very high	89.4	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	120	170.5	-178.6	-177.5	69.3	0	0	109.5	I582 R583 I593 L961 P963 A981 A983	I582-M591 HydrophobicContact CG2-CG 3.67Å; I582-M591 HydrophobicContact CG2-SD 3.71Å; R583-M591 CarbonylContact O-C 3.51Å; R583-M591 WeakPolarHBondContact O-CA 3.27Å; M591-I593 HydrophobicContact CE-CD1 4.07Å; M591-I593 HydrophobicContact CE-CG1 4.22Å; M591-L961 HydrophobicContact CE-CB 4.13Å; M591-L961 HydrophobicContact CE-CD1 4.02Å; M591-L961 PolarHBondContact N-O 2.64Å; M591-L961 PolarHBondContact O-N 3.39Å; M591-P963 HydrophobicContact CB-CG 3.7Å; M591-P963 HydrophobicContact CE-CB 4.32Å; M591-P963 HydrophobicContact CE-CG 4.44Å; M591-P963 HydrophobicContact SD-CG 4.38Å; M591-A981 HydrophobicContact SD-CB 4.22Å; M591-A983 HydrophobicContact CE-CB 3.79Å
592	K	92	Very high	89.2	Confident	57 Å²	57	37 Å²	37	25%	0.248	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	116.2	175.3	-176.7	-178.4	-60.1	-66.2	0	108.8	R583 F585 L958 D960	R583-K592 PolarHBondContact N-O 2.77Å; R583-K592 PolarHBondContact O-N 2.76Å; F585-K592 HydrophobicContact CE2-CB 4.16Å; K592-L958 HydrophobicContact CD-CD2 4.36Å; K592-D960 WeakPolarHBondContact CB-OD1 3.48Å; K592-D960 WeakPolarHBondContact CE-OD1 3.22Å; K592-D960 WeakPolarHBondContact CG-OD1 3.35Å; K592-D960 IonicContact NZ-OD1 3.74Å; K592-D960 PolarHBondContact NZ-OD1 2.72Å; K592-D960 IonicContact NZ-OD2 3.61Å; K592-D960 PolarHBondContact NZ-OD2 2.83Å
593	I	92.6	Very high	89.1	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	119.1	169.9	-46.3	-169.8	0	0	0	108	Y580 I582 M591 L959 L961 I1010 F1019	Y580-I593 HydrophobicContact CD1-CG2 3.77Å; Y580-I593 HydrophobicContact CG-CG2 4.42Å; I582-I593 HydrophobicContact CD1-CD1 4.28Å; I582-I593 HydrophobicContact CG1-CB 4.49Å; I582-I593 HydrophobicContact CG1-CD1 4.32Å; I582-I593 HydrophobicContact CG1-CG1 4.07Å; I582-I593 HydrophobicContact CG1-CG2 4.08Å; M591-I593 HydrophobicContact CE-CD1 4.07Å; M591-I593 HydrophobicContact CE-CG1 4.22Å; I593-L959 HydrophobicContact CB-CB 4.25Å; I593-L959 PolarHBondContact N-O 3.09Å; I593-L959 PolarHBondContact O-N 2.8Å; I593-L961 HydrophobicContact CD1-CD1 3.89Å; I593-L961 HydrophobicContact CG1-CD1 4.29Å; I593-I1010 HydrophobicContact CD1-CD1 4.28Å; I593-F1019 HydrophobicContact CD1-CE2 4.05Å; I593-F1019 HydrophobicContact CD1-CZ 3.85Å
594	V	93.6	Very high	88.9	Confident	11 Å²	11	35.6 Å²	35.6	7%	0.067	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	121.6	168.4	-166.9	0	0	0	0	108.2	Y580 D581 Y596 T955 L958	Y580-V594 WeakPolarHBondContact CA-O 3.39Å; D581-V594 HydrophobicContact CB-CB 4.4Å; D581-V594 PolarHBondContact N-O 3.1Å; D581-V594 PolarHBondContact O-N 3.19Å; V594-Y596 HydrophobicContact CB-CE2 3.87Å; V594-Y596 HydrophobicContact CG1-CD1 4.31Å; V594-Y596 HydrophobicContact CG1-CD2 4.41Å; V594-Y596 HydrophobicContact CG1-CE1 3.59Å; V594-Y596 HydrophobicContact CG1-CE2 3.7Å; V594-Y596 WeakPolarHBondContact CG1-OH 3.39Å; V594-T955 HydrophobicContact CG1-CG2 4.16Å; V594-L958 HydrophobicContact CB-CD2 4.09Å; V594-L958 HydrophobicContact CG1-CD2 3.72Å; V594-L958 HydrophobicContact CG2-CD2 3.73Å
595	Y	93.3	Very high	89	Confident	8 Å²	8	35.8 Å²	35.8	3%	0.031	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	123.8	178.7	-179.7	-158.8	0	0	0	110.3	P578 Y580 L936 V956 G957 L992	P578-Y595 HydrophobicContact CB-CE2 3.79Å; Y580-Y595 AromaticContact CD1-CD2 3.77Å; Y580-Y595 HydrophobicContact CD1-CD2 3.77Å; Y580-Y595 HydrophobicContact CD1-CG 4.18Å; Y580-Y595 HydrophobicContact CE1-CD1 4.35Å; Y580-Y595 AromaticContact CE1-CD2 3.1Å; Y580-Y595 HydrophobicContact CE1-CD2 3.1Å; Y580-Y595 AromaticContact CE1-CE2 3.69Å; Y580-Y595 HydrophobicContact CE1-CE2 3.69Å; Y580-Y595 AromaticContact CE1-CG 3.52Å; Y580-Y595 HydrophobicContact CE1-CG 3.52Å; Y580-Y595 HydrophobicContact CE2-CD2 4.44Å; Y580-Y595 HydrophobicContact CE2-CE2 4.44Å; Y580-Y595 AromaticContact CZ-CD2 3.5Å; Y580-Y595 VanDerWaalsContact CZ-CD2 3.5Å; Y580-Y595 AromaticContact CZ-CE2 3.55Å; Y580-Y595 WeakPolarHBondContact OH-CE2 3.42Å; Y595-L936 HydrophobicContact CE1-CD1 3.73Å; Y595-L936 HydrophobicContact CE1-CD2 4.28Å; Y595-L936 VanDerWaalsContact OH-CD1 3.27Å; Y595-L936 WeakPolarHBondContact OH-CD1 3.24Å; Y595-V956 HydrophobicContact CD1-CB 3.87Å; Y595-V956 HydrophobicContact CD1-CG1 3.68Å; Y595-V956 HydrophobicContact CE1-CB 4.25Å; Y595-V956 HydrophobicContact CE1-CG1 3.84Å; Y595-V956 HydrophobicContact CG-CB 4.13Å; Y595-V956 HydrophobicContact CG-CG1 4.43Å; Y595-V956 PolarHBondContact O-N 2.94Å; Y595-G957 PolarHBondContact N-O 2.88Å; Y595-G957 PolarHBondContact O-N 2.82Å; Y595-L992 WeakPolarHBondContact OH-CD1 3.4Å
596	Y	94.2	Very high	89.4	Confident	28 Å²	28	36.6 Å²	36.6	11%	0.11	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	150.1	177	-53.7	-76.5	0	0	0	112.3	A579 D581 V594 R953 V954 T955	A579-Y596 PolarHBondContact N-O 2.81Å; A579-Y596 PolarHBondContact O-N 2.89Å; D581-Y596 HydrophobicContact CB-CE2 3.95Å; D581-Y596 PolarHBondContact OD2-OH 3.08Å; V594-Y596 HydrophobicContact CB-CE2 3.87Å; V594-Y596 HydrophobicContact CG1-CD1 4.31Å; V594-Y596 HydrophobicContact CG1-CD2 4.41Å; V594-Y596 HydrophobicContact CG1-CE1 3.59Å; V594-Y596 HydrophobicContact CG1-CE2 3.7Å; V594-Y596 WeakPolarHBondContact CG1-OH 3.39Å; Y596-R953 HydrophobicContact CD1-CG 3.47Å; Y596-R953 VanDerWaalsContact CD1-CG 3.47Å; Y596-R953 HydrophobicContact CD2-CG 4.39Å; Y596-R953 HydrophobicContact CE1-CG 4.03Å; Y596-R953 HydrophobicContact CG-CG 3.66Å; Y596-V954 CarbonylContact C-O 3.59Å; Y596-V954 WeakPolarHBondContact CA-O 3.35Å; Y596-V954 WeakPolarHBondContact CB-O 3.25Å; Y596-T955 HydrophobicContact CE1-CG2 4.42Å; Y596-T955 WeakPolarHBondContact CE1-OG1 3.42Å
597	G	94.8	Very high	90.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	128.6	152.8	0	0	0	0	0	109.3	V954	G597-V954 PolarHBondContact N-O 2.94Å; G597-V954 PolarHBondContact O-N 3.39Å
598	M	96	Very high	91.2	Very high	45 Å²	45	31.1 Å²	31.1	22%	0.222	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	102.3	164.9	-60.6	-55.4	-55.4	0	0	107.1	W576 K577 A579 P951 R953	W576-M598 CarbonylContact C-O 3.52Å; W576-M598 WeakPolarHBondContact CA-O 3.46Å; K577-M598 PolarHBondContact N-O 3.48Å; K577-M598 PolarHBondContact O-N 2.86Å; A579-M598 HydrophobicContact CB-CG 3.7Å; A579-M598 HydrophobicContact CB-SD 4.32Å; M598-P951 HydrophobicContact CE-CB 3.59Å; M598-P951 VanDerWaalsContact CE-O 3.27Å; M598-P951 WeakPolarHBondContact CE-O 3.3Å; M598-R953 HydrophobicContact CE-CB 3.96Å; M598-R953 HydrophobicContact SD-CB 3.7Å; M598-R953 HydrophobicContact SD-CG 3.76Å
599	V	96.7	Very high	91.8	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	132.5	-177.6	-179.7	0	0	0	0	109	V313 W576 W607 M612 L614 I945 P951 N952 V954	V313-V599 HydrophobicContact CG1-CG1 4.42Å; V313-V599 HydrophobicContact CG2-CG1 4.45Å; W576-V599 HydrophobicContact CB-CG2 3.98Å; V599-W607 HydrophobicContact CG1-CZ3 4.2Å; V599-M612 HydrophobicContact CB-CE 4.3Å; V599-M612 HydrophobicContact CG1-CE 3.85Å; V599-M612 HydrophobicContact CG2-CE 3.74Å; V599-L614 HydrophobicContact CG2-CD2 3.79Å; V599-I945 HydrophobicContact CG1-CD1 4.38Å; V599-P951 CarbonylContact O-C 3.58Å; V599-N952 PolarHBondContact N-O 2.83Å; V599-N952 PolarHBondContact O-N 3.26Å; V599-V954 HydrophobicContact CG2-CG1 4.13Å; V599-V954 HydrophobicContact CG2-CG2 3.94Å
600	Q	95.6	Very high	92.3	Very high	63 Å²	63	35 Å²	35	29%	0.294	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	133.6	-175.7	-167.7	178.6	11.2	0	0	108.8	C574 G575 N949	C574-Q600 CarbonylContact C-O 3.56Å; C574-Q600 VanDerWaalsContact CA-O 3.24Å; C574-Q600 WeakPolarHBondContact CA-O 3.27Å; C574-Q600 WeakPolarHBondContact CB-O 3.28Å; G575-Q600 PolarHBondContact N-O 3.47Å; G575-Q600 PolarHBondContact O-N 2.86Å; Q600-N949 VanDerWaalsContact CG-O 3.24Å; Q600-N949 WeakPolarHBondContact CG-O 3.43Å; Q600-N949 WeakPolarHBondContact CG-OD1 3.43Å; Q600-N949 PolarHBondContact NE2-O 3.34Å; Q600-N949 PolarHBondContact NE2-OD1 2.68Å
601	Q	94.6	Very high	92.6	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	138.4	-175.7	77.6	95.9	-16	0	0	113.3	C574 T603 E605 W607 I945 R946 C947 N949	C574-Q601 HydrophobicContact CB-CB 3.54Å; Q601-T603 HydrophobicContact CB-CG2 4.32Å; Q601-T603 PolarHBondContact OE1-OG1 2.91Å; Q601-E605 PolarHBondContact NE2-O 2.97Å; Q601-W607 HydrophobicContact CB-CE3 4.33Å; Q601-W607 HydrophobicContact CB-CH2 3.76Å; Q601-W607 HydrophobicContact CB-CZ2 4.02Å; Q601-W607 HydrophobicContact CB-CZ3 3.91Å; Q601-W607 HydrophobicContact CG-CD2 4.08Å; Q601-W607 HydrophobicContact CG-CE3 3.98Å; Q601-W607 HydrophobicContact CG-CH2 4.27Å; Q601-W607 HydrophobicContact CG-CZ2 4.33Å; Q601-W607 HydrophobicContact CG-CZ3 4.07Å; Q601-I945 HydrophobicContact CG-CG2 4.11Å; Q601-I945 PolarHBondContact NE2-O 2.93Å; Q601-I945 VanDerWaalsContact NE2-O 3.1Å; Q601-R946 WeakPolarHBondContact CG-O 3.4Å; Q601-R946 VanDerWaalsContact NE2-C 3.26Å; Q601-R946 PolarHBondContact NE2-O 3.07Å; Q601-C947 CarbonylContact O-C 3.57Å; Q601-C947 WeakPolarHBondContact O-CA 3.34Å; Q601-N949 WeakPolarHBondContact O-CA 3.48Å; Q601-N949 PolarHBondContact O-N 3.04Å; Q601-N949 VanDerWaalsContact O-N 3.08Å
602	A	91.6	Very high	92.9	Very high	31 Å²	31	40.3 Å²	40.3	26%	0.256	19%	0.189	S	C	.	.			trans	-133.2	47.7	176.5	0	0	0	0	0	109.3	R573 G604 N949	R573-A602 HydrophobicContact CB-CB 4.46Å; R573-A602 PolarHBondContact O-N 2.96Å; A602-G604 VanDerWaalsContact C-N 3.33Å; A602-N949 HydrophobicContact CB-CB 4.06Å
603	T	91	Very high	93	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.186	C	C	.	.	S	Bend	trans	-87.1	1.2	-171.6	65.9	0	0	0	0	114.3	S342 P343 A344 V571 N572 C574 Q601 E605 W607	S342-T603 PolarHBondContact OG-O 2.8Å; P343-T603 VanDerWaalsContact CD-O 3.3Å; P343-T603 WeakPolarHBondContact CD-O 3.29Å; A344-T603 HydrophobicContact CB-CG2 4.38Å; V571-T603 HydrophobicContact CB-CG2 4.16Å; V571-T603 HydrophobicContact CG2-CG2 3.92Å; N572-T603 VanDerWaalsContact O-CG2 3.31Å; N572-T603 WeakPolarHBondContact O-CG2 3.17Å; C574-T603 HydrophobicContact CB-CG2 3.77Å; Q601-T603 HydrophobicContact CB-CG2 4.32Å; Q601-T603 PolarHBondContact OE1-OG1 2.91Å; T603-E605 PolarHBondContact O-N 3Å; T603-E605 WeakPolarHBondContact OG1-CG 3.48Å; T603-E605 PolarHBondContact OG1-O 3.02Å; T603-W607 HydrophobicContact CG2-CZ2 3.69Å; T603-W607 PolarHBondContact OG1-NE1 3.3Å
604	G	87.4	Confident	93.1	Very high	29 Å²	29	39 Å²	39	30%	0.299	19%	0.186	S	C	.	.	S	Bend	trans	71.4	4.3	-173.8	0	0	0	0	0	114.7	A602	A602-G604 VanDerWaalsContact C-N 3.33Å
605	E	90.7	Very high	93.1	Very high	4 Å²	4	38.4 Å²	38.4	2%	0.019	18%	0.183	C	C	.	.	S	Bend	trans	-130.9	133.4	172.7	59	176.7	152.8	0	0	111.6	F304 I320 R322 S342 Y569 Q601 T603	F304-E605 HydrophobicContact CD1-CB 3.72Å; F304-E605 HydrophobicContact CD1-CG 4.48Å; F304-E605 VanDerWaalsContact CD1-OE2 3.29Å; F304-E605 WeakPolarHBondContact CD1-OE2 3.29Å; F304-E605 HydrophobicContact CE1-CB 3.46Å; F304-E605 VanDerWaalsContact CE1-CB 3.46Å; F304-E605 HydrophobicContact CE1-CG 4.14Å; F304-E605 HydrophobicContact CG-CB 4.39Å; F304-E605 HydrophobicContact CZ-CB 3.89Å; I320-E605 WeakPolarHBondContact CD1-OE1 3.17Å; R322-E605 IonicContact CZ-OE2 3.34Å; R322-E605 IonicContact NE-OE2 3.35Å; R322-E605 IonicContact NH2-OE2 3.11Å; R322-E605 PolarHBondContact NH2-OE2 3.37Å; S342-E605 WeakPolarHBondContact CB-OE1 3.44Å; Y569-E605 PolarHBondContact OH-OE1 2.85Å; Y569-E605 PolarHBondContact OH-OE2 3.03Å; Q601-E605 PolarHBondContact NE2-O 2.97Å; T603-E605 PolarHBondContact O-N 3Å; T603-E605 WeakPolarHBondContact OG1-CG 3.48Å; T603-E605 PolarHBondContact OG1-O 3.02Å
606	D	93.7	Very high	92.8	Very high	65 Å²	65	39 Å²	39	35%	0.348	19%	0.187	S	C	.	.			trans	-72.3	135.6	170.8	-85.9	4.8	0	0	0	110	I944 R946 C947	D606-I944 HydrophobicContact CB-CD1 3.96Å; D606-I944 HydrophobicContact CB-CG1 4.08Å; D606-I944 WeakPolarHBondContact OD2-CD1 3.36Å; D606-R946 WeakPolarHBondContact OD1-CA 3.48Å; D606-C947 PolarHBondContact OD1-N 2.89Å
607	W	94.9	Very high	92.2	Very high	1 Å²	1	38.4 Å²	38.4	0%	0.004	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-99.5	101.1	-172.9	-69.4	-5.2	0	0	0	112.4	M308 L311 V313 A318 V571 C574 V599 Q601 T603 I944 I945	M308-W607 HydrophobicContact CE-CB 3.7Å; M308-W607 HydrophobicContact CE-CG 4.04Å; L311-W607 HydrophobicContact CD1-CD2 4.3Å; L311-W607 HydrophobicContact CD1-CE3 4.22Å; L311-W607 HydrophobicContact CD1-CH2 4.35Å; L311-W607 HydrophobicContact CD1-CZ2 4.46Å; L311-W607 HydrophobicContact CD1-CZ3 4.25Å; L311-W607 HydrophobicContact CD2-CD2 4.05Å; L311-W607 HydrophobicContact CD2-CE3 3.55Å; L311-W607 HydrophobicContact CD2-CZ3 4.03Å; V313-W607 HydrophobicContact CG2-CH2 4.35Å; V313-W607 HydrophobicContact CG2-CZ3 3.86Å; A318-W607 HydrophobicContact CB-CH2 3.64Å; A318-W607 HydrophobicContact CB-CZ2 3.99Å; V571-W607 HydrophobicContact CG2-CZ2 4.01Å; C574-W607 HydrophobicContact CB-CH2 3.64Å; C574-W607 HydrophobicContact CB-CZ2 4.07Å; V599-W607 HydrophobicContact CG1-CZ3 4.2Å; Q601-W607 HydrophobicContact CB-CE3 4.33Å; Q601-W607 HydrophobicContact CB-CH2 3.76Å; Q601-W607 HydrophobicContact CB-CZ2 4.02Å; Q601-W607 HydrophobicContact CB-CZ3 3.91Å; Q601-W607 HydrophobicContact CG-CD2 4.08Å; Q601-W607 HydrophobicContact CG-CE3 3.98Å; Q601-W607 HydrophobicContact CG-CH2 4.27Å; Q601-W607 HydrophobicContact CG-CZ2 4.33Å; Q601-W607 HydrophobicContact CG-CZ3 4.07Å; T603-W607 HydrophobicContact CG2-CZ2 3.69Å; T603-W607 PolarHBondContact OG1-NE1 3.3Å; W607-I944 CarbonylContact O-C 3.58Å; W607-I944 WeakPolarHBondContact O-CA 3.49Å; W607-I945 HydrophobicContact CB-CB 4.22Å; W607-I945 HydrophobicContact CE3-CG2 4.47Å; W607-I945 PolarHBondContact N-O 2.86Å; W607-I945 PolarHBondContact O-N 2.88Å
608	E	93.1	Very high	91	Very high	134 Å²	134	43.6 Å²	43.6	63%	0.626	21%	0.212	S	C	*	.			trans	-97.2	106.3	168	-63.8	-169.6	-169.3	0	0	110.9	I944	E608-I944 HydrophobicContact CG-CB 4.31Å; E608-I944 HydrophobicContact CG-CD1 4.38Å; E608-I944 HydrophobicContact CG-CG1 4.09Å
609	T	88.7	Confident	89.4	Confident	12 Å²	12	45.3 Å²	45.3	7%	0.074	23%	0.227	C	C	.	.			trans	-132.7	152.9	176.4	-173.9	0	0	0	0	113.2	L311 Y611 M612 P941	L311-T609 HydrophobicContact CB-CG2 4.06Å; L311-T609 HydrophobicContact CD2-CG2 3.95Å; T609-Y611 PolarHBondContact OG1-N 3.26Å; T609-Y611 PolarHBondContact OG1-O 3.1Å; T609-M612 HydrophobicContact CG2-CB 4.08Å; T609-P941 HydrophobicContact CG2-CB 4.36Å
610	R	88.3	Confident	87.5	Confident	206 Å²	206	47.4 Å²	47.4	78%	0.777	25%	0.248	S	C	*	.	S	Bend	trans	-100.4	-13.3	169.4	-61.7	-175	-177.1	-129.6	-2	113.5
611	Y	92.4	Very high	85.8	Confident	151 Å²	151	50.1 Å²	50.1	59%	0.592	26%	0.264	S	S	*	.			trans	-135.2	118.4	-179.4	-63.3	-74.3	0	0	0	109.4	L311 T609	L311-Y611 PolarHBondContact N-O 2.82Å; L311-Y611 VanDerWaalsContact N-O 3.12Å; T609-Y611 PolarHBondContact OG1-N 3.26Å; T609-Y611 PolarHBondContact OG1-O 3.1Å
612	M	95.4	Very high	84	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	131.2	-176.5	-174.1	-176.8	-160.8	0	0	109.6	L311 V313 V599 T609 L614 V938 P941 I945 V954	L311-M612 HydrophobicContact CD2-CE 3.92Å; L311-M612 HydrophobicContact CD2-CG 4.17Å; L311-M612 HydrophobicContact CG-CG 4.48Å; L311-M612 WeakPolarHBondContact O-CA 3.49Å; V313-M612 HydrophobicContact CG2-CE 3.62Å; V599-M612 HydrophobicContact CB-CE 4.3Å; V599-M612 HydrophobicContact CG1-CE 3.85Å; V599-M612 HydrophobicContact CG2-CE 3.74Å; T609-M612 HydrophobicContact CG2-CB 4.08Å; M612-L614 HydrophobicContact CE-CD2 4.01Å; M612-V938 HydrophobicContact CB-CB 4.16Å; M612-V938 HydrophobicContact CB-CG2 4.27Å; M612-V938 HydrophobicContact CG-CB 4.48Å; M612-V938 HydrophobicContact CG-CG2 4.09Å; M612-V938 PolarHBondContact O-N 2.88Å; M612-V938 HydrophobicContact SD-CG2 4.16Å; M612-P941 HydrophobicContact CB-CB 4.04Å; M612-P941 HydrophobicContact CB-CG 3.75Å; M612-P941 HydrophobicContact SD-CB 4.4Å; M612-I945 HydrophobicContact CE-CD1 3.55Å; M612-I945 HydrophobicContact SD-CD1 3.96Å; M612-V954 HydrophobicContact SD-CG1 4.36Å
613	T	95.2	Very high	82.7	Confident	28 Å²	28	55.4 Å²	55.4	17%	0.172	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	134.6	174.5	-52.5	0	0	0	0	108.7	L311 T312 V313 Q935 L936	L311-T613 PolarHBondContact O-N 2.91Å; T312-T613 CarbonylContact C-O 3.58Å; T312-T613 VanDerWaalsContact CA-O 3.3Å; T312-T613 WeakPolarHBondContact CA-O 3.21Å; T312-T613 HydrophobicContact CG2-CG2 4.43Å; V313-T613 PolarHBondContact N-O 3.36Å; T613-Q935 HydrophobicContact CG2-CB 4.14Å; T613-L936 CarbonylContact C-O 3.46Å; T613-L936 WeakPolarHBondContact CA-O 3.45Å
614	L	94.8	Very high	81.4	Confident	0 Å²	0	61 Å²	61	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	138.5	167.4	-52.3	-177.4	0	0	0	108.6	V313 W576 V599 M612 Q935 L936 V938 V954 V956	V313-L614 HydrophobicContact CB-CD2 4.02Å; V313-L614 HydrophobicContact CG2-CD2 4.34Å; V313-L614 CarbonylContact O-C 3.49Å; V313-L614 WeakPolarHBondContact O-CA 3.23Å; W576-L614 HydrophobicContact CB-CD2 4.25Å; W576-L614 HydrophobicContact CD2-CB 3.84Å; W576-L614 HydrophobicContact CD2-CD1 3.97Å; W576-L614 HydrophobicContact CD2-CD2 4.44Å; W576-L614 HydrophobicContact CD2-CG 4.3Å; W576-L614 HydrophobicContact CE3-CB 4.28Å; W576-L614 HydrophobicContact CE3-CD1 3.76Å; W576-L614 HydrophobicContact CG-CB 4.2Å; W576-L614 HydrophobicContact CG-CD1 4.35Å; W576-L614 HydrophobicContact CG-CD2 4.06Å; W576-L614 HydrophobicContact CG-CG 4.44Å; W576-L614 HydrophobicContact CH2-CB 4.32Å; W576-L614 HydrophobicContact CZ2-CB 3.92Å; W576-L614 HydrophobicContact CZ3-CB 4.5Å; W576-L614 HydrophobicContact CZ3-CD1 4.17Å; V599-L614 HydrophobicContact CG2-CD2 3.79Å; M612-L614 HydrophobicContact CE-CD2 4.01Å; L614-Q935 CarbonylContact O-C 3.51Å; L614-Q935 WeakPolarHBondContact O-CA 3.49Å; L614-L936 HydrophobicContact CB-CB 4.3Å; L614-L936 PolarHBondContact N-O 3.22Å; L614-L936 PolarHBondContact O-N 3.29Å; L614-V938 HydrophobicContact CD1-CG2 4.19Å; L614-V938 HydrophobicContact CD2-CG2 4.35Å; L614-V938 HydrophobicContact CG-CG2 3.82Å; L614-V954 HydrophobicContact CD1-CG2 3.87Å; L614-V956 HydrophobicContact CD1-CG2 3.79Å
615	S	91.9	Very high	80.7	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	146.3	179.3	-168.8	0	0	0	0	113.7	V313 F314 W576 A617 I934	V313-S615 PolarHBondContact O-N 3.36Å; F314-S615 WeakPolarHBondContact CA-O 3.27Å; W576-S615 PolarHBondContact NE1-O 3.21Å; S615-A617 VanDerWaalsContact C-N 3.35Å; S615-A617 PolarHBondContact OG-N 3.49Å; S615-I934 VanDerWaalsContact CA-O 3.24Å; S615-I934 WeakPolarHBondContact CA-O 3.49Å; S615-I934 PolarHBondContact OG-O 2.97Å
616	T	87.9	Confident	79.6	Confident	21 Å²	21	70.5 Å²	70.5	13%	0.129	41%	0.41	C	S	.	.			trans	-91.9	7.1	170.2	61.3	0	0	0	0	113.3	W576 I934 L992	W576-T616 HydrophobicContact CH2-CG2 4.39Å; W576-T616 HydrophobicContact CZ2-CG2 3.92Å; T616-I934 HydrophobicContact CG2-CB 4.41Å; T616-I934 PolarHBondContact N-O 2.9Å; T616-I934 PolarHBondContact OG1-N 2.82Å; T616-L992 HydrophobicContact CG2-CD1 3.46Å; T616-L992 VanDerWaalsContact CG2-CD1 3.46Å; T616-L992 HydrophobicContact CG2-CD2 4.1Å; T616-L992 HydrophobicContact CG2-CG 4.44Å
617	A	81.1	Confident	78.4	Confident	15 Å²	15	76.1 Å²	76.1	12%	0.124	43%	0.433	C	S	.	.			trans	-59.7	142.3	174.4	0	0	0	0	0	110.6	F314 S615 P619 T933	F314-A617 HydrophobicContact CD1-CB 3.88Å; F314-A617 HydrophobicContact CE1-CB 3.85Å; S615-A617 VanDerWaalsContact C-N 3.35Å; S615-A617 PolarHBondContact OG-N 3.49Å; A617-P619 VanDerWaalsContact O-CD 3.23Å; A617-P619 WeakPolarHBondContact O-CD 3.27Å; A617-T933 HydrophobicContact CB-CG2 3.55Å
618	Q	71	Confident	77.3	Confident	108 Å²	108	84.3 Å²	84.3	51%	0.505	48%	0.477	S	S	.	.			trans	-115.7	67.8	172.4	-66.5	179.6	-50.7	0	0	109.6	G620 I621	Q618-G620 PolarHBondContact O-N 2.98Å; Q618-G620 VanDerWaalsContact O-N 3.14Å; Q618-I621 HydrophobicContact CB-CD1 3.8Å; Q618-I621 HydrophobicContact CB-CG1 4.03Å; Q618-I621 HydrophobicContact CG-CD1 4.46Å; Q618-I621 PolarHBondContact O-N 3.44Å
619	P	61.4	Low	76.1	Confident	82 Å²	82	81.2 Å²	81.2	53%	0.532	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-16.5	-175.4	29.6	-36.8	0	0	0	113.4	F314 A617 I621	F314-P619 HydrophobicContact CD1-CG 4.39Å; F314-P619 HydrophobicContact CE1-CG 4.29Å; F314-P619 HydrophobicContact CZ-CG 4.47Å; A617-P619 VanDerWaalsContact O-CD 3.23Å; A617-P619 WeakPolarHBondContact O-CD 3.27Å; P619-I621 VanDerWaalsContact C-N 3.33Å
620	G	57.4	Low	75.3	Confident	44 Å²	44	87.7 Å²	87.7	45%	0.454	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-9.3	173.3	0	0	0	0	0	115	Q618 G622	Q618-G620 PolarHBondContact O-N 2.98Å; Q618-G620 VanDerWaalsContact O-N 3.14Å; G620-G622 PolarHBondContact O-N 2.76Å; G620-G622 VanDerWaalsContact O-N 3.12Å
621	I	59.8	Low	74.2	Confident	120 Å²	120	86.6 Å²	86.6	62%	0.615	52%	0.517	S	S	*	.	S	Bend	trans	-75.9	100.9	167	-62.8	177.9	0	0	0	106.8	Q618 P619	Q618-I621 HydrophobicContact CB-CD1 3.8Å; Q618-I621 HydrophobicContact CB-CG1 4.03Å; Q618-I621 HydrophobicContact CG-CD1 4.46Å; Q618-I621 PolarHBondContact O-N 3.44Å; P619-I621 VanDerWaalsContact C-N 3.33Å
622	G	57.1	Low	72.6	Confident	54 Å²	54	88.8 Å²	88.8	56%	0.557	52%	0.524	S	S	*	.			trans	-57	142.4	-177.9	0	0	0	0	0	112.5	G620 T624	G620-G622 PolarHBondContact O-N 2.76Å; G620-G622 VanDerWaalsContact O-N 3.12Å; G622-T624 PolarHBondContact O-N 3.02Å; G622-T624 VanDerWaalsContact O-N 3.09Å
623	G	64.1	Low	70.9	Confident	88 Å²	88	95.3 Å²	95.3	91%	0.907	56%	0.563	S	S	*	*	S	Bend	trans	-68.6	-2.2	177.9	0	0	0	0	0	114.9
624	T	63	Low	69.2	Low	118 Å²	118	101 Å²	101	72%	0.724	59%	0.588	S	S	*	*	S	Bend	trans	-80.9	125.8	176.4	-47.9	0	0	0	0	109.9	G622	G622-T624 PolarHBondContact O-N 3.02Å; G622-T624 VanDerWaalsContact O-N 3.09Å
625	V	73.8	Confident	67.2	Low	117 Å²	117	110.7 Å²	110.7	71%	0.709	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-64	126.4	174.2	-178.7	0	0	0	0	109.2
626	P	67.2	Low	65	Low	115 Å²	115	121.4 Å²	121.4	75%	0.747	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-65.3	136.2	177.9	26.6	-34.2	0	0	0	110.8
627	H	68.3	Low	63	Low	183 Å²	183	130.4 Å²	130.4	85%	0.847	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-78.8	139	177	-65.9	-61.7	0	0	0	111.2
628	L	70.9	Confident	61.2	Low	174 Å²	174	135.8 Å²	135.8	91%	0.911	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-80.7	126.1	174.1	-68.8	172.2	0	0	0	110.6
629	G	68.7	Low	59.7	Low	68 Å²	68	138.9 Å²	138.9	70%	0.701	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-69.2	158.5	168.6	0	0	0	0	0	112.7	Q631	G629-Q631 PolarHBondContact O-N 2.76Å
630	I	70.9	Confident	58.9	Low	148 Å²	148	139.5 Å²	139.5	76%	0.759	75%	0.749	S	S	*	*			trans	-77.2	104.9	177	-58.6	175.2	0	0	0	109.3	R632	I630-R632 HydrophobicContact CG2-CG 4.48Å; I630-R632 PolarHBondContact O-N 3.12Å
631	Q	66	Low	58.3	Low	184 Å²	184	142.8 Å²	142.8	86%	0.86	76%	0.763	S	S	*	*			trans	-61.4	125.1	167.7	-72.5	-171.7	-8.1	0	0	110.4	G629	G629-Q631 PolarHBondContact O-N 2.76Å
632	R	59.8	Low	57.6	Low	197 Å²	197	141.8 Å²	141.8	74%	0.743	77%	0.772	S	S	*	*			trans	-107.2	114.4	175	-66.1	-173.8	178.3	-147.4	-0.3	109.9	I630	I630-R632 HydrophobicContact CG2-CG 4.48Å; I630-R632 PolarHBondContact O-N 3.12Å
633	V	57.8	Low	57.2	Low	137 Å²	137	146 Å²	146	83%	0.83	78%	0.78	S	S	*	*			trans	-85.1	130.8	172.1	-177.3	0	0	0	0	109
634	H	61.2	Low	56.1	Low	148 Å²	148	147.5 Å²	147.5	69%	0.685	77%	0.774	S	S	*	*			trans	-122.8	149.2	171	-64.5	-60	0	0	0	109.1	R636	H634-R636 PolarHBondContact O-N 2.8Å
635	F	51.9	Low	54.9	Low	203 Å²	203	149 Å²	149	89%	0.89	78%	0.776	S	S	*	*			trans	-56.2	135.1	167.2	-70.2	-72.3	0	0	0	109.2	R637	F635-R637 PolarHBondContact O-N 3.11Å
636	R	46.1	Very low	53.6	Low	225 Å²	225	148.8 Å²	148.8	85%	0.849	78%	0.78	S	S	*	*			trans	-56.2	110.1	171.6	-166.4	-173.2	-147.5	175.5	7.2	107	H634 D638	H634-R636 PolarHBondContact O-N 2.8Å; R636-D638 PolarHBondContact O-N 3Å; R636-D638 VanDerWaalsContact O-N 3.17Å
637	R	45.3	Very low	52.1	Low	210 Å²	210	153.9 Å²	153.9	79%	0.792	78%	0.784	S	S	*	*			trans	-67.4	115.4	168.1	-69.4	-178.1	-176.6	160.6	1.5	105.6	F635 H639	F635-R637 PolarHBondContact O-N 3.11Å; R637-H639 VanDerWaalsContact C-N 3.29Å; R637-H639 PolarHBondContact O-CD2 2.93Å; R637-H639 PolarHBondContact O-N 2.95Å
638	D	43	Very low	50.7	Low	129 Å²	129	152.5 Å²	152.5	69%	0.69	78%	0.783	S	S	*	*			trans	-66	98.8	170.7	-74	-41.5	0	0	0	107.8	R636 S640	R636-D638 PolarHBondContact O-N 3Å; R636-D638 VanDerWaalsContact O-N 3.17Å; D638-S640 PolarHBondContact O-N 3.24Å
639	H	41.1	Very low	49.3	Very low	172 Å²	172	148.1 Å²	148.1	80%	0.796	77%	0.772	S	S	*	*			trans	-68.8	69.1	161.5	-58.9	-70.5	0	0	0	107.4	R637 P641	R637-H639 VanDerWaalsContact C-N 3.29Å; R637-H639 PolarHBondContact O-CD2 2.93Å; R637-H639 PolarHBondContact O-N 2.95Å; H639-P641 WeakPolarHBondContact O-CD 3.36Å
640	S	44.3	Very low	47.8	Very low	95 Å²	95	152.3 Å²	152.3	66%	0.664	78%	0.777	S	S	*	*			trans	-51.4	116.8	173.9	-58.2	0	0	0	0	107.3	D638 A642	D638-S640 PolarHBondContact O-N 3.24Å; S640-A642 PolarHBondContact O-N 3.08Å; S640-A642 VanDerWaalsContact O-N 3.1Å
641	P	44.7	Very low	46.1	Very low	114 Å²	114	150.3 Å²	150.3	74%	0.74	78%	0.776	S	S	*	*			trans	-60.2	123.2	-179.4	24.3	-32.6	0	0	0	107.3	H639 I643	H639-P641 WeakPolarHBondContact O-CD 3.36Å; P641-I643 PolarHBondContact O-N 3.22Å
642	A	44.1	Very low	44.8	Very low	98 Å²	98	147 Å²	147	81%	0.81	77%	0.773	S	S	*	*			trans	-58.7	108.2	-174.6	0	0	0	0	0	109.2	S640 P644	S640-A642 PolarHBondContact O-N 3.08Å; S640-A642 VanDerWaalsContact O-N 3.1Å; A642-P644 VanDerWaalsContact O-CD 3.3Å; A642-P644 WeakPolarHBondContact O-CD 3.35Å; A642-P644 VanDerWaalsContact O-N 3.16Å
643	I	49.4	Very low	43.7	Very low	143 Å²	143	143.9 Å²	143.9	73%	0.733	78%	0.776	S	S	*	*			trans	-62.1	119	-175.3	-60.2	175.5	0	0	0	107.7	P641 I645	P641-I643 PolarHBondContact O-N 3.22Å; I643-I645 PolarHBondContact O-N 3.31Å
644	P	40.4	Very low	42.8	Very low	120 Å²	120	142.4 Å²	142.4	78%	0.779	77%	0.772	S	S	*	*			trans	-72.1	97.4	178.1	28.7	-32.7	0	0	0	108.8	A642 S646	A642-P644 VanDerWaalsContact O-CD 3.3Å; A642-P644 WeakPolarHBondContact O-CD 3.35Å; A642-P644 VanDerWaalsContact O-N 3.16Å; P644-S646 PolarHBondContact O-N 3.35Å
645	I	38.5	Very low	41.5	Very low	149 Å²	149	141.7 Å²	141.7	76%	0.764	78%	0.778	S	S	*	*			trans	-67	96.1	178.7	-59	178.1	0	0	0	109.1	I643 R647	I643-I645 PolarHBondContact O-N 3.31Å; I645-R647 PolarHBondContact O-N 2.67Å
646	S	45.8	Very low	40.8	Very low	112 Å²	112	138.5 Å²	138.5	78%	0.783	78%	0.775	S	S	*	*			trans	-60.3	124.7	170.5	-176.6	0	0	0	0	109.9	P644	P644-S646 PolarHBondContact O-N 3.35Å
647	R	35.2	Very low	40.4	Very low	223 Å²	223	134 Å²	134	84%	0.842	77%	0.773	S	S	*	*			trans	-118.2	81.8	-173.1	-166.9	-169.8	-67.9	167.7	-1.8	111.5	I645	I645-R647 PolarHBondContact O-N 2.67Å
648	N	40.1	Very low	39.9	Very low	153 Å²	153	127.2 Å²	127.2	82%	0.818	77%	0.768	S	S	*	*			trans	-164.1	143.2	166.8	-90.2	-37	0	0	0	108.4
649	A	41.5	Very low	39.7	Very low	82 Å²	82	131.1 Å²	131.1	68%	0.678	77%	0.774	S	S	*	*			cis	-152.3	141.8	-1.8	0	0	0	0	0	113.6
650	I	36.4	Very low	39.6	Very low	156 Å²	156	128.1 Å²	128.1	80%	0.8	77%	0.773	S	S	*	*			trans	18.9	119.9	144	-33.9	174.7	0	0	0	119.8
651	S	36.1	Very low	39.3	Very low	106 Å²	106	129 Å²	129	74%	0.741	78%	0.779	S	S	*	*				158.4	120.9	118.5	-72	0	0	0	0	115.8
652	S	37.8	Very low	39	Very low	114 Å²	114	127.5 Å²	127.5	80%	0.797	78%	0.784	S	S	*	*				149.3	119.1	124.1	61	0	0	0	0	117.3
653	T	36	Very low	38.6	Very low	132 Å²	132	126.4 Å²	126.4	81%	0.81	78%	0.782	S	S	*	*			trans	60.8	127.3	146.5	33.4	0	0	0	0	126.2
654	S	39.4	Very low	38.2	Very low	106 Å²	106	127.4 Å²	127.4	74%	0.741	79%	0.786	S	S	*	*			trans	76	84.7	138	55.2	0	0	0	0	124.2
655	V	35	Very low	38.1	Very low	134 Å²	134	127.2 Å²	127.2	81%	0.812	78%	0.782	S	S	*	*				36.6	124	113.4	-175	0	0	0	0	120.5
656	T	37.1	Very low	38.1	Very low	135 Å²	135	124.8 Å²	124.8	83%	0.828	78%	0.779	S	S	*	*				-172.2	155.1	116.3	-71.5	0	0	0	0	111.8
657	T	36.4	Very low	37.5	Very low	131 Å²	131	125.5 Å²	125.5	80%	0.804	78%	0.779	S	S	*	*			trans	-98.1	154.3	-163.1	8.4	0	0	0	0	117.4
658	G	36	Very low	37.4	Very low	67 Å²	67	120.9 Å²	120.9	69%	0.691	78%	0.776	S	S	*	*			trans	126.1	147.9	144.2	0	0	0	0	0	116.1
659	Y	38.8	Very low	37.1	Very low	212 Å²	212	119.1 Å²	119.1	83%	0.831	77%	0.77	S	S	*	*			cis	177.8	151.5	-16.9	-124.4	-69.4	0	0	0	105.8
660	S	37.6	Very low	37	Very low	108 Å²	108	122.1 Å²	122.1	76%	0.755	77%	0.773	S	S	*	*			trans	73.1	153.6	166.8	-47.2	0	0	0	0	118.4
661	S	38.6	Very low	37.1	Very low	114 Å²	114	120.4 Å²	120.4	80%	0.797	77%	0.773	S	S	*	*			cis	158.3	133.6	-45.3	55.9	0	0	0	0	110.1
662	G	37.9	Very low	36.9	Very low	82 Å²	82	119.1 Å²	119.1	85%	0.845	77%	0.768	S	S	*	*			trans	162.5	85.1	163.9	0	0	0	0	0	121.1
663	G	36	Very low	36.8	Very low	75 Å²	75	119 Å²	119	77%	0.773	77%	0.768	S	S	*	*			trans	75.6	168.9	148.5	0	0	0	0	0	119.9
664	M	42.3	Very low	36.7	Very low	164 Å²	164	119.4 Å²	119.4	81%	0.808	77%	0.77	S	S	*	*			cis	-165	144.2	-11.1	-120.7	176.3	83.6	0	0	112.9
665	T	37.8	Very low	36.4	Very low	116 Å²	116	117 Å²	117	71%	0.712	76%	0.761	S	S	*	*			trans	63.9	152.7	156.6	54.6	0	0	0	0	118.6
666	S	37.8	Very low	36.3	Very low	98 Å²	98	119.2 Å²	119.2	69%	0.685	76%	0.762	S	S	*	*			cis	-153.6	138.1	9.5	-9.5	0	0	0	0	110.1
667	T	33.7	Very low	36.1	Very low	128 Å²	128	121.6 Å²	121.6	79%	0.785	76%	0.764	S	S	*	*				69.7	121.1	88.2	-52.6	0	0	0	0	111.8
668	T	33.5	Very low	35.8	Very low	126 Å²	126	122.3 Å²	122.3	77%	0.773	76%	0.762	S	S	*	*			cis	-169.3	173.5	14.7	-128.2	0	0	0	0	109.1
669	T	33.6	Very low	35.5	Very low	115 Å²	115	124.5 Å²	124.5	71%	0.706	77%	0.767	S	S	*	*			cis	-165.8	164.2	-1.4	-102.9	0	0	0	0	109.4
670	I	39	Very low	35.1	Very low	145 Å²	145	117.8 Å²	117.8	74%	0.744	76%	0.762	S	S	*	*			trans	-113.2	157.4	171.2	-22.2	173.6	0	0	0	110
671	P	38.2	Very low	34.7	Very low	121 Å²	121	117.3 Å²	117.3	79%	0.786	76%	0.764	S	S	*	*				-148	155.8	98.3	34.5	-16.5	0	0	0	114.7
672	A	33.6	Very low	34.2	Very low	78 Å²	78	117 Å²	117	65%	0.645	76%	0.762	S	S	*	*			cis	103	161.3	18.5	0	0	0	0	0	116.1
673	S	34	Very low	33.8	Very low	113 Å²	113	119.1 Å²	119.1	79%	0.79	76%	0.764	S	S	*	*			trans	77	144.4	-179.6	83.3	0	0	0	0	116.1
674	T	34.8	Very low	33.4	Very low	140 Å²	140	122.5 Å²	122.5	86%	0.859	77%	0.77	S	S	*	*			cis	-162.8	169.4	-12.8	9.5	0	0	0	0	107.8
675	G	32.2	Very low	32.7	Very low	54 Å²	54	118.1 Å²	118.1	56%	0.557	77%	0.766	S	S	*	*			cis	162.2	173.9	1.6	0	0	0	0	0	111.5
676	H	34.1	Very low	32.3	Very low	181 Å²	181	122 Å²	122	84%	0.838	77%	0.773	S	S	*	*			trans	78.2	122.4	-173.9	-52.9	84	0	0	0	115.1
677	Q	31.5	Very low	31.9	Very low	186 Å²	186	124.1 Å²	124.1	87%	0.869	78%	0.777	S	S	*	*			cis	87.9	158.5	17.6	-62.2	-155.1	3.7	0	0	118.8
678	I	31.6	Very low	31.6	Very low	146 Å²	146	123.9 Å²	123.9	75%	0.749	78%	0.775	S	S	*	*			trans	94.8	95.3	-177.5	-57.5	166.1	0	0	0	111.2
679	S	29.6	Very low	31.5	Very low	113 Å²	113	129.1 Å²	129.1	79%	0.79	78%	0.781	S	S	*	*				72.4	135	60	81.9	0	0	0	0	114.2
680	G	29.2	Very low	31.4	Very low	71 Å²	71	128.7 Å²	128.7	73%	0.732	78%	0.783	S	S	*	*			cis	175	-157.1	4.2	0	0	0	0	0	111.4
681	A	30.3	Very low	30.9	Very low	98 Å²	98	127.7 Å²	127.7	81%	0.81	79%	0.787	S	S	*	*			trans	64.9	128.2	179.7	0	0	0	0	0	115.9
682	S	26.8	Very low	30.6	Very low	108 Å²	108	126.8 Å²	126.8	76%	0.755	78%	0.78	S	S	*	*			cis	91.7	109.3	30.2	80.5	0	0	0	0	115.7
683	S	29.7	Very low	30.3	Very low	125 Å²	125	132.5 Å²	132.5	87%	0.874	79%	0.79	S	S	*	*				177.4	161.8	128.3	48	0	0	0	0	114.5
684	T	27.6	Very low	29.9	Very low	147 Å²	147	134.5 Å²	134.5	90%	0.902	79%	0.791	S	S	*	*			trans	-76.7	147.4	-170.2	49.3	0	0	0	0	117.6
685	G	29.3	Very low	29.6	Very low	71 Å²	71	131 Å²	131	73%	0.732	78%	0.783	S	S	*	*			trans	159.7	109.9	155.7	0	0	0	0	0	111.7
686	K	28.7	Very low	29.3	Very low	197 Å²	197	132.8 Å²	132.8	86%	0.857	79%	0.793	S	S	*	*				73.6	134.5	69	-79.5	-167.8	174.6	-179.5	0	115.6
687	N	28.8	Very low	28.9	Very low	143 Å²	143	133 Å²	133	77%	0.765	79%	0.791	S	S	*	*			trans	80.3	128.4	174.8	-53.3	-23.5	0	0	0	115
688	T	28	Very low	28.7	Very low	123 Å²	123	132.9 Å²	132.9	76%	0.755	79%	0.788	S	S	*	*			cis	111.8	154.9	16.3	62.9	0	0	0	0	114.1
689	R	30.5	Very low	28.4	Very low	237 Å²	237	134.7 Å²	134.7	89%	0.894	79%	0.785	S	S	*	*			trans	87	127.4	-170.1	-56.2	174.4	-178	-154.8	-1.8	113.4
690	S	31.4	Very low	28.3	Very low	106 Å²	106	135.1 Å²	135.1	74%	0.741	79%	0.788	S	S	*	*			cis	70.1	115.9	2.6	-171.2	0	0	0	0	118.9	T692	S690-T692 PolarHBondContact OG-OG1 2.84Å
691	C	29.4	Very low	28.1	Very low	124 Å²	124	135.4 Å²	135.4	84%	0.838	77%	0.773	S	S	*	*			trans	-172.7	125.2	154.5	-172.5	0	0	0	0	108.2
692	T	30.7	Very low	27.9	Very low	101 Å²	101	140.3 Å²	140.3	62%	0.62	77%	0.77	S	S	*	*			cis	112	84	-2.7	-46.8	0	0	0	0	116	S690	S690-T692 PolarHBondContact OG-OG1 2.84Å
693	K	28.5	Very low	28.1	Very low	198 Å²	198	139.4 Å²	139.4	86%	0.861	76%	0.761	S	S	*	*			trans	-143.2	129.3	158.5	-97	174.7	172.8	177.6	0	109.7
694	L	25.8	Very low	28.6	Very low	155 Å²	155	138.8 Å²	138.8	81%	0.812	75%	0.753	S	S	*	*			cis	74.1	129	45.3	-69.2	152.5	0	0	0	113
695	G	27.6	Very low	28.7	Very low	67 Å²	67	134.7 Å²	134.7	69%	0.691	74%	0.74	S	S	*	*			cis	-159.9	155.8	-0.7	0	0	0	0	0	110.9
696	A	27.2	Very low	28.8	Very low	92 Å²	92	137.7 Å²	137.7	76%	0.76	75%	0.745	S	S	*	*				71.6	113.9	75.7	0	0	0	0	0	115.6
697	F	24.9	Very low	28.8	Very low	185 Å²	185	135 Å²	135	81%	0.811	74%	0.74	S	S	*	*			trans	-169.2	143.2	132.2	-121.2	-135.3	0	0	0	116.9
698	K	27	Very low	28.8	Very low	184 Å²	184	134 Å²	134	80%	0.8	73%	0.733	S	S	*	*			trans	57.1	117.4	154.1	-77.5	178.6	179.9	170.6	0	123.5
699	R	26	Very low	28.8	Very low	184 Å²	184	134 Å²	134	69%	0.694	73%	0.728	S	S	*	*			trans	-54.8	153.7	152.6	-55.1	165.9	167.5	-160.5	-9.8	114.1
700	S	26.2	Very low	28.7	Very low	122 Å²	122	129.6 Å²	129.6	85%	0.853	72%	0.718	S	S	*	*			trans	-152.9	160.2	130.3	71.4	0	0	0	0	110.7
701	N	25.3	Very low	28.5	Very low	76 Å²	76	130.7 Å²	130.7	41%	0.406	72%	0.715	S	S	.	*			trans	-113.2	148.6	-171.9	-10.2	-107.5	0	0	0	111.9	A459	A459-N701 HydrophobicContact CB-CB 4.09Å
702	R	26.3	Very low	28.4	Very low	201 Å²	201	129.9 Å²	129.9	76%	0.758	70%	0.702	S	S	*	*				170.2	114.2	121.7	-92.3	160.5	-176.5	-169.6	0.1	115.4
703	T	30.5	Very low	28.1	Very low	90 Å²	90	134.7 Å²	134.7	55%	0.552	71%	0.709	S	S	*	*				31.2	155.8	117.9	38.2	0	0	0	0	122.6	A459	A459-T703 HydrophobicContact CB-CG2 4.43Å
704	P	40.6	Very low	28	Very low	111 Å²	111	131.8 Å²	131.8	72%	0.721	71%	0.707	S	S	*	*				-133.5	-167.9	-125.9	45.7	-30.3	0	0	0	115.9
705	G	29.4	Very low	27.9	Very low	61 Å²	61	128 Å²	128	63%	0.629	71%	0.706	S	S	*	*			trans	147.4	154.2	164.9	0	0	0	0	0	112.7
706	T	31.4	Very low	27.9	Very low	134 Å²	134	130.2 Å²	130.2	82%	0.822	71%	0.711	S	S	*	*			cis	-170.1	132.6	-3.4	10.2	0	0	0	0	111.2
707	N	30.3	Very low	27.8	Very low	142 Å²	142	134.1 Å²	134.1	76%	0.759	72%	0.715	S	S	*	*				69.8	155.4	129.4	-131.4	12.9	0	0	0	118.4
708	I	28.4	Very low	28	Very low	121 Å²	121	129.5 Å²	129.5	62%	0.621	70%	0.699	S	S	*	*			cis	-153.7	158.1	10.9	-11.4	179.8	0	0	0	110.9
709	N	28.4	Very low	28	Very low	122 Å²	122	127.5 Å²	127.5	65%	0.652	70%	0.697	S	S	*	*			trans	68.1	149.6	147.9	-73.1	13.6	0	0	0	120.8
710	E	28.1	Very low	28	Very low	145 Å²	145	128 Å²	128	68%	0.678	71%	0.708	S	S	*	*			cis	-164.3	152.4	-2.6	-118.5	167.8	140.7	0	0	113.8
711	I	27.1	Very low	28	Very low	130 Å²	130	128.3 Å²	128.3	67%	0.667	70%	0.704	S	S	*	*			trans	78.9	114.3	140.2	-75.8	162.8	0	0	0	122.8
712	D	26.2	Very low	28	Very low	106 Å²	106	131.9 Å²	131.9	57%	0.567	72%	0.715	S	S	*	*			trans	73.7	113.7	134.6	-73.7	9.3	0	0	0	126.4
713	R	25.7	Very low	28	Very low	203 Å²	203	129.2 Å²	129.2	77%	0.766	72%	0.716	S	S	*	*				104.9	118.8	118.8	-75.9	172	-146	-161.4	7.9	122.7
714	V	26.1	Very low	27.7	Very low	136 Å²	136	132 Å²	132	82%	0.824	73%	0.726	S	S	*	*				61.9	95.6	127.3	-173.3	0	0	0	0	118.6
715	G	24.1	Very low	26.9	Very low	77 Å²	77	133.3 Å²	133.3	79%	0.794	72%	0.724	S	S	*	*				72.4	97.7	105.9	0	0	0	0	0	119.7
716	S	26.7	Very low	26.9	Very low	113 Å²	113	136.4 Å²	136.4	79%	0.79	73%	0.726	S	S	*	*			trans	-159.8	109.5	134.8	-157.5	0	0	0	0	109.1
717	M	24.5	Very low	26.6	Very low	173 Å²	173	136 Å²	136	85%	0.852	71%	0.713	S	S	*	*			trans	-79.4	142.6	152.9	-69.8	162	65.7	0	0	107
718	D	28.7	Very low	26.6	Very low	89 Å²	89	133.9 Å²	133.9	48%	0.476	71%	0.707	S	S	.	*			trans	157.2	107.8	164.6	-84.4	-22	0	0	0	108.3
719	N	28.1	Very low	26.6	Very low	142 Å²	142	135.7 Å²	135.7	76%	0.759	71%	0.707	S	S	*	*			trans	167	61.1	159.1	-91.5	-50.4	0	0	0	113.2
720	E	26.4	Very low	26.6	Very low	195 Å²	195	135.9 Å²	135.9	91%	0.911	71%	0.707	S	S	*	*			trans	-141.7	75.2	166.1	-83.9	-141.4	130.9	0	0	113.7
721	V	25	Very low	26.6	Very low	127 Å²	127	134.3 Å²	134.3	77%	0.77	71%	0.712	S	S	*	*			trans	-146.9	142.5	157.3	-146.6	0	0	0	0	111.8
722	K	26.1	Very low	26.7	Very low	151 Å²	151	134 Å²	134	66%	0.657	72%	0.719	S	S	*	*			trans	74.6	99.5	167.1	-51.4	166.5	-173.5	162.8	0	117.2
723	L	26	Very low	27	Very low	145 Å²	145	135.5 Å²	135.5	76%	0.759	73%	0.726	S	S	*	*				-159.9	67.2	107.5	-154	74.9	0	0	0	114.2	M725	L723-M725 HydrophobicContact CD1-CG 4.49Å; L723-M725 HydrophobicContact CG-CG 4.36Å; L723-M725 PolarHBondContact O-N 2.94Å; L723-M725 VanDerWaalsContact O-N 3.1Å
724	L	24.5	Very low	27.1	Very low	149 Å²	149	129.7 Å²	129.7	78%	0.78	72%	0.717	S	S	*	*			trans	-74.2	97.4	165.1	-88.6	168.5	0	0	0	110.3
725	M	24.7	Very low	27.2	Very low	138 Å²	138	129 Å²	129	68%	0.68	72%	0.718	S	S	*	*			trans	-134.2	41.6	174.2	-79.4	-71.6	-74.2	0	0	111.8	L723	L723-M725 HydrophobicContact CD1-CG 4.49Å; L723-M725 HydrophobicContact CG-CG 4.36Å; L723-M725 PolarHBondContact O-N 2.94Å; L723-M725 VanDerWaalsContact O-N 3.1Å
726	L	27.6	Very low	27.5	Very low	127 Å²	127	137.2 Å²	137.2	67%	0.665	73%	0.725	S	S	*	*			trans	-69.6	134.5	161.2	-77.4	166.4	0	0	0	108.8	P728	L726-P728 WeakPolarHBondContact O-CD 3.42Å
727	F	26.9	Very low	27.6	Very low	125 Å²	125	140.2 Å²	140.2	55%	0.548	73%	0.727	S	S	.	*			trans	-86.3	112.7	-174	-78.8	-114.9	0	0	0	111.1	Y729	F727-Y729 PolarHBondContact O-N 3.28Å
728	P	28.4	Very low	27.9	Very low	98 Å²	98	140.6 Å²	140.6	64%	0.636	73%	0.731	S	S	*	*			trans	-78.8	107.4	165.2	32.4	-31.7	0	0	0	109.2	L726 I730	L726-P728 WeakPolarHBondContact O-CD 3.42Å; P728-I730 HydrophobicContact CB-CD1 4.16Å; P728-I730 HydrophobicContact CB-CG1 4.23Å; P728-I730 PolarHBondContact O-N 3.19Å; P728-I730 VanDerWaalsContact O-N 3.12Å
729	Y	30	Very low	27.8	Very low	159 Å²	159	144.7 Å²	144.7	62%	0.624	75%	0.748	S	S	*	*			trans	-67.3	105.7	163.2	-109.7	-99.3	0	0	0	108	R573 F727	R573-Y729 WeakPolarHBondContact CA-OH 3.24Å; R573-Y729 PolarHBondContact N-OH 3.25Å; F727-Y729 PolarHBondContact O-N 3.28Å
730	I	28	Very low	28	Very low	125 Å²	125	143.1 Å²	143.1	64%	0.641	75%	0.748	S	S	*	*			trans	-129.6	118.9	173.5	-62.1	177.2	0	0	0	107.6	P728 P732	P728-I730 HydrophobicContact CB-CD1 4.16Å; P728-I730 HydrophobicContact CB-CG1 4.23Å; P728-I730 PolarHBondContact O-N 3.19Å; P728-I730 VanDerWaalsContact O-N 3.12Å; I730-P732 WeakPolarHBondContact O-CD 3.5Å
731	S	28.4	Very low	28	Very low	112 Å²	112	140 Å²	140	78%	0.783	74%	0.742	S	S	*	*			trans	-81.2	125.3	173.9	-173.5	0	0	0	0	110.4
732	P	29.3	Very low	28.4	Very low	125 Å²	125	139.3 Å²	139.3	81%	0.812	73%	0.734	S	S	*	*			trans	-106.2	88.7	174	35.8	-24.4	0	0	0	110.6	I730	I730-P732 WeakPolarHBondContact O-CD 3.5Å
733	D	31.8	Very low	28.5	Very low	136 Å²	136	139.7 Å²	139.7	73%	0.727	74%	0.736	S	S	*	*			trans	-136.3	108.6	168	-165.6	7	0	0	0	111.9
734	S	27.7	Very low	28.8	Very low	81 Å²	81	137.7 Å²	137.7	57%	0.566	73%	0.733	S	S	*	*			trans	-170.1	106.2	171.8	-83.5	0	0	0	0	109.2	S27	S27-S734 PolarHBondContact OG-OG 3.15Å; S27-S734 VanDerWaalsContact OG-OG 3.07Å
735	S	29.4	Very low	29	Very low	122 Å²	122	137.8 Å²	137.8	85%	0.853	74%	0.735	S	S	*	*			trans	-153.1	103.8	168	-84.6	0	0	0	0	111.3
736	R	28.7	Very low	29.4	Very low	250 Å²	250	139.6 Å²	139.6	94%	0.943	75%	0.746	S	S	*	*			trans	-129.1	131.1	165	-82.3	-168.6	170.1	-159.5	-1.6	110
737	Q	30.2	Very low	29.4	Very low	175 Å²	175	140.6 Å²	140.6	82%	0.818	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-78.5	142.7	176.4	-64.4	176.2	-10.9	0	0	110.8
738	L	30.2	Very low	29.8	Very low	181 Å²	181	141.7 Å²	141.7	95%	0.948	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-99.8	126.2	155.5	-77.9	169.9	0	0	0	108.4
739	Q	27	Very low	29.9	Very low	176 Å²	176	145.1 Å²	145.1	82%	0.822	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-91.8	134.8	178	-67.3	-176.8	-2.1	0	0	111.1
740	S	31.9	Very low	29.8	Very low	109 Å²	109	144.3 Å²	144.3	76%	0.762	78%	0.776	S	S	*	*			trans	-148	118	145.8	54.3	0	0	0	0	111
741	V	27.1	Very low	30	Very low	130 Å²	130	144 Å²	144	79%	0.788	79%	0.785	S	S	*	*				34.7	117.9	124.8	-173.2	0	0	0	0	115.2
742	D	32.2	Very low	29.9	Very low	112 Å²	112	150.4 Å²	150.4	60%	0.599	79%	0.792	S	S	*	*				-161.6	157.2	51.6	-144.9	3.6	0	0	0	118.3
743	K	28.8	Very low	30	Very low	159 Å²	159	152.5 Å²	152.5	69%	0.691	80%	0.795	S	S	*	*			trans	27	115.8	151.9	-76.1	165.6	-157.4	79	0	122.9
744	S	32.2	Very low	30.1	Very low	102 Å²	102	151.9 Å²	151.9	71%	0.713	80%	0.799	S	S	*	*				110.3	127.3	108.7	74.9	0	0	0	0	122.7
745	N	28.7	Very low	30	Very low	151 Å²	151	153.9 Å²	153.9	81%	0.807	81%	0.813	S	S	*	*			trans	53.5	112.9	142.4	-61.6	-22.8	0	0	0	122
746	L	32.6	Very low	30.2	Very low	177 Å²	177	153.2 Å²	153.2	93%	0.927	82%	0.815	S	S	*	*				-165.7	148.4	107.8	-104.8	161	0	0	0	112.6
747	N	28.7	Very low	30.2	Very low	147 Å²	147	144.9 Å²	144.9	79%	0.786	81%	0.807	S	S	*	*			trans	-90.8	152.1	176.3	-71.6	-44.8	0	0	0	111
748	E	33.5	Very low	30.3	Very low	148 Å²	148	143.1 Å²	143.1	69%	0.692	81%	0.808	S	S	*	*				174.3	141.5	98	-91.6	-149.5	132.3	0	0	116.6
749	K	30.9	Very low	30.3	Very low	171 Å²	171	140.7 Å²	140.7	74%	0.743	80%	0.801	S	S	*	*			trans	73.8	149.4	145.1	-73.8	167	-178.7	144.3	0	121
750	T	27.9	Very low	30.6	Very low	141 Å²	141	138 Å²	138	87%	0.865	80%	0.798	S	S	*	*			trans	-134	158.6	-170.2	51.5	0	0	0	0	110.7
751	S	31.9	Very low	30.5	Very low	120 Å²	120	138.9 Å²	138.9	84%	0.839	80%	0.799	S	S	*	*			trans	-146.4	126.3	165.6	59	0	0	0	0	110.8
752	R	27.8	Very low	30.6	Very low	245 Å²	245	141.9 Å²	141.9	93%	0.925	80%	0.798	S	S	*	*			trans	-85.6	150.2	-178.3	-62.9	176.7	175.2	-179.5	-3.2	112.2
753	L	31.7	Very low	30.3	Very low	169 Å²	169	141.6 Å²	141.6	89%	0.885	81%	0.805	S	S	*	*			trans	-131.3	147.3	150.3	-82	172.8	0	0	0	109.8
754	P	32.8	Very low	30.3	Very low	124 Å²	124	141.6 Å²	141.6	81%	0.805	81%	0.805	S	S	*	*			trans	-94.5	167.9	-170.8	37.8	-36.6	0	0	0	114.1
755	S	26.6	Very low	30	Very low	122 Å²	122	148.4 Å²	148.4	85%	0.853	82%	0.815	S	S	*	*			trans	-98.8	136.1	-179.8	48.8	0	0	0	0	114
756	A	32	Very low	30	Very low	109 Å²	109	148.6 Å²	148.6	90%	0.901	81%	0.814	S	S	*	*			trans	-169.1	133.4	156.7	0	0	0	0	0	108.8
757	G	30.2	Very low	29.7	Very low	75 Å²	75	144.8 Å²	144.8	77%	0.773	80%	0.802	S	S	*	*			trans	160.3	50.1	179.6	0	0	0	0	0	118.7
758	T	31	Very low	29.6	Very low	137 Å²	137	141.9 Å²	141.9	84%	0.84	80%	0.799	S	S	*	*			trans	11.9	109.8	155.3	-46	0	0	0	0	119.3
759	T	31.6	Very low	29.3	Very low	131 Å²	131	142.7 Å²	142.7	80%	0.804	81%	0.808	S	S	*	*			trans	-81.1	133.7	159.1	38.2	0	0	0	0	111.3
760	P	32.8	Very low	29.1	Very low	118 Å²	118	139 Å²	139	77%	0.766	81%	0.809	S	S	*	*			trans	-86.1	113.6	176	31.9	-31.9	0	0	0	111.8	Y762	P760-Y762 PolarHBondContact O-N 2.75Å
761	T	28.5	Very low	28.9	Very low	128 Å²	128	137.2 Å²	137.2	79%	0.785	81%	0.809	S	S	*	*			trans	-70.6	125.8	168.8	-23.5	0	0	0	0	110.1
762	Y	30.2	Very low	28.7	Very low	193 Å²	193	136.7 Å²	136.7	76%	0.757	80%	0.801	S	S	*	*			trans	-117.8	69	174.2	-141.7	-99.6	0	0	0	112.5	P760 K764	P760-Y762 PolarHBondContact O-N 2.75Å; Y762-K764 HydrophobicContact CE1-CD 4.27Å; Y762-K764 PolarHBondContact OH-NZ 3.39Å
763	S	26.3	Very low	28.6	Very low	106 Å²	106	133.4 Å²	133.4	74%	0.741	79%	0.794	S	S	*	*			trans	-96	117.4	166.7	52.2	0	0	0	0	110.3
764	K	29.2	Very low	28.5	Very low	159 Å²	159	135.4 Å²	135.4	69%	0.691	79%	0.791	S	S	*	*			trans	-129.6	111.6	171.5	-100.1	-178.8	175.3	170.2	0	111	Y762	Y762-K764 HydrophobicContact CE1-CD 4.27Å; Y762-K764 PolarHBondContact OH-NZ 3.39Å
765	R	25	Very low	28.1	Very low	246 Å²	246	137.8 Å²	137.8	93%	0.928	79%	0.791	S	S	*	*			trans	-69.6	123.8	164	-69.7	174.2	168.9	-177.6	-4.1	109.7
766	I	29.5	Very low	28.3	Very low	154 Å²	154	138 Å²	138	79%	0.79	79%	0.788	S	S	*	*			trans	-145.5	106.6	145.5	-53.4	-178.5	0	0	0	104.2
767	S	26.5	Very low	28.2	Very low	97 Å²	97	138.3 Å²	138.3	68%	0.678	78%	0.78	S	S	*	*			cis	77.9	79.6	44.8	87.6	0	0	0	0	115.2
768	A	26	Very low	28	Very low	87 Å²	87	140.6 Å²	140.6	72%	0.719	78%	0.781	S	S	*	*			trans	67.1	155	150.1	0	0	0	0	0	120.5
769	N	26.1	Very low	28	Very low	164 Å²	164	141.7 Å²	141.7	88%	0.877	78%	0.781	S	S	*	*			trans	63.9	97.8	159.4	-58.7	-12.1	0	0	0	119.2
770	A	26.7	Very low	27.8	Very low	93 Å²	93	144 Å²	144	77%	0.769	78%	0.783	S	S	*	*				-156	107.1	124.7	0	0	0	0	0	110.3
771	A	24.5	Very low	27.6	Very low	105 Å²	105	148.1 Å²	148.1	87%	0.868	78%	0.783	S	S	*	*			trans	-87.5	121.4	161	0	0	0	0	0	107.7
772	V	28.7	Very low	27.9	Very low	109 Å²	109	148.1 Å²	148.1	66%	0.661	79%	0.785	S	S	*	*			trans	-126.3	113.9	175	-179.9	0	0	0	0	108.2	Y774	V772-Y774 HydrophobicContact CG1-CD2 4.4Å; V772-Y774 HydrophobicContact CG1-CE2 4.11Å
773	F	24.1	Very low	27.7	Very low	176 Å²	176	143.5 Å²	143.5	77%	0.772	77%	0.774	S	S	*	*			trans	-68.8	139.6	169.5	-84.6	-107.8	0	0	0	110	Q775	F773-Q775 HydrophobicContact CD1-CG 4.4Å
774	Y	30.7	Very low	27.9	Very low	210 Å²	210	148.7 Å²	148.7	82%	0.824	78%	0.783	S	S	*	*			trans	-118.4	107.4	147.9	-86.5	-82.2	0	0	0	108.4	V772	V772-Y774 HydrophobicContact CG1-CD2 4.4Å; V772-Y774 HydrophobicContact CG1-CE2 4.11Å
775	Q	24.1	Very low	27.7	Very low	175 Å²	175	146.6 Å²	146.6	82%	0.818	78%	0.784	S	S	*	*			trans	-84.9	129.8	163.3	-72.3	179	-49	0	0	108.4	F773	F773-Q775 HydrophobicContact CD1-CG 4.4Å
776	T	31.4	Very low	27.7	Very low	127 Å²	127	146.7 Å²	146.7	78%	0.779	79%	0.785	S	S	*	*			trans	-125	142.3	163.9	35.1	0	0	0	0	109.3
777	P	29	Very low	27.6	Very low	114 Å²	114	142.8 Å²	142.8	74%	0.74	78%	0.782	S	S	*	*			trans	-86.3	157.1	-159.7	34	-37.4	0	0	0	114
778	P	25.6	Very low	27.7	Very low	123 Å²	123	145.9 Å²	145.9	80%	0.799	79%	0.79	S	S	*	*			trans	-82	131.5	173.3	32.9	-32.7	0	0	0	111.5
779	L	31.4	Very low	27.7	Very low	160 Å²	160	148.2 Å²	148.2	84%	0.838	79%	0.79	S	S	*	*			trans	-133.8	133.4	165	-78.8	178.1	0	0	0	112.2
780	Q	28.1	Very low	27.8	Very low	181 Å²	181	147 Å²	147	85%	0.846	78%	0.784	S	S	*	*			trans	-55.2	150.9	-168.1	-66	147.3	-52.2	0	0	116.5
781	R	28.7	Very low	27.8	Very low	203 Å²	203	149 Å²	149	77%	0.766	78%	0.782	S	S	*	*			trans	-67.6	173.2	154.7	-64.4	-170.3	-179.1	179.7	1.3	110.7	D783	R781-D783 WeakPolarHBondContact CD-OD1 3.2Å; R781-D783 IonicContact CZ-OD1 2.63Å; R781-D783 IonicContact NE-OD1 3.5Å; R781-D783 IonicContact NH1-OD1 3.72Å; R781-D783 PolarHBondContact NH1-OD1 3.29Å
782	P	34	Very low	27.9	Very low	128 Å²	128	150.4 Å²	150.4	83%	0.831	77%	0.773	S	S	*	*				-127.9	152.8	102.1	37	-32.9	0	0	0	113.8
783	D	26	Very low	27.6	Very low	97 Å²	97	150.7 Å²	150.7	52%	0.519	78%	0.78	S	S	.	*			trans	-84.7	161.4	-179.2	-55.6	-84.3	0	0	0	113	R781	R781-D783 WeakPolarHBondContact CD-OD1 3.2Å; R781-D783 IonicContact CZ-OD1 2.63Å; R781-D783 IonicContact NE-OD1 3.5Å; R781-D783 IonicContact NH1-OD1 3.72Å; R781-D783 PolarHBondContact NH1-OD1 3.29Å
784	F	29.8	Very low	27.7	Very low	214 Å²	214	152.7 Å²	152.7	94%	0.939	78%	0.784	S	S	*	*			trans	-135.6	123.2	155.9	-117.7	-85.1	0	0	0	109.4
785	T	25.1	Very low	27.3	Very low	116 Å²	116	149 Å²	149	71%	0.712	77%	0.774	S	S	*	*			trans	-122.9	139.4	177	56.6	0	0	0	0	110
786	R	25.8	Very low	27.3	Very low	248 Å²	248	145.7 Å²	145.7	94%	0.936	76%	0.76	S	S	*	*				166.6	138.9	128.3	-96.2	178.9	170.4	-168.3	-2.5	113.3
787	G	27.6	Very low	27	Very low	71 Å²	71	144.4 Å²	144.4	73%	0.732	75%	0.752	S	S	*	*			trans	91.7	146.2	152.9	0	0	0	0	0	115.4
788	L	28.3	Very low	26.9	Very low	163 Å²	163	147.5 Å²	147.5	85%	0.853	76%	0.763	S	S	*	*			cis	-154	168.9	-10.7	-121.2	167.8	0	0	0	108.3
789	N	25.6	Very low	27	Very low	135 Å²	135	150.8 Å²	150.8	72%	0.722	76%	0.759	S	S	*	*			trans	-56.7	141.6	-176.6	-51.7	-10.4	0	0	0	111.9
790	D	28.4	Very low	26.7	Very low	140 Å²	140	152.2 Å²	152.2	75%	0.749	77%	0.767	S	S	*	*				-168.9	143.1	106.6	-96.4	-20.9	0	0	0	114.2
791	N	26.4	Very low	26.7	Very low	133 Å²	133	147.2 Å²	147.2	71%	0.711	75%	0.751	S	S	*	*			trans	3.5	121.7	156.8	-44.2	-61.8	0	0	0	119.7
792	I	26	Very low	26.5	Very low	136 Å²	136	144.8 Å²	144.8	70%	0.697	75%	0.749	S	S	*	*				168.5	128	110.6	-84.6	157.7	0	0	0	109.4	Y794	I792-Y794 HydrophobicContact CG2-CD2 3.5Å; I792-Y794 HydrophobicContact CG2-CE2 3.66Å; I792-Y794 HydrophobicContact CG2-CG 4.35Å
793	S	22.7	Very low	26.3	Very low	114 Å²	114	149 Å²	149	80%	0.797	75%	0.75	S	S	*	*			trans	-83.5	119	162.2	49.5	0	0	0	0	109.7
794	Y	26.6	Very low	26.6	Very low	218 Å²	218	152 Å²	152	86%	0.855	76%	0.755	S	S	*	*			trans	-95.6	104.1	165.6	-100	-75.3	0	0	0	110.3	I792	I792-Y794 HydrophobicContact CG2-CD2 3.5Å; I792-Y794 HydrophobicContact CG2-CE2 3.66Å; I792-Y794 HydrophobicContact CG2-CG 4.35Å
795	E	23.4	Very low	26.5	Very low	133 Å²	133	147.9 Å²	147.9	62%	0.621	74%	0.743	S	S	*	*			trans	-99.4	168	164.4	-155.7	177.5	-170.4	0	0	108.7
796	M	23.3	Very low	26.7	Very low	105 Å²	105	149.7 Å²	149.7	52%	0.517	75%	0.748	S	S	.	*	S	Bend	trans	68.2	124.2	166	-66.3	-174	169.2	0	0	120.6	T211	T211-M796 HydrophobicContact CG2-CE 3.91Å; T211-M796 HydrophobicContact CG2-CG 4.25Å
797	T	26	Very low	26.8	Very low	101 Å²	101	143 Å²	143	62%	0.62	74%	0.739	S	S	*	*			trans	49	109.7	138.3	65.1	0	0	0	0	120.2
798	D	26	Very low	27	Very low	179 Å²	179	146 Å²	146	96%	0.957	74%	0.744	S	S	*	*			trans	-71	128.1	137	-95.6	-42.8	0	0	0	108.5
799	R	26.8	Very low	27	Very low	192 Å²	192	146 Å²	146	73%	0.725	74%	0.739	S	S	*	*			trans	-107.2	139.1	178.6	-76.7	177.8	163	-167.9	-6.1	110.3
800	L	27	Very low	27.1	Very low	190 Å²	190	149.7 Å²	149.7	100%	0.995	75%	0.745	S	S	*	*			trans	-84.5	99.1	139.9	-77.7	173.1	0	0	0	108
801	S	26.7	Very low	27.2	Very low	75 Å²	75	148 Å²	148	52%	0.524	74%	0.743	S	S	.	*			trans	-111.8	152.4	156.3	51.2	0	0	0	0	106.9
802	E	26	Very low	27.4	Very low	152 Å²	152	146.3 Å²	146.3	71%	0.71	74%	0.741	S	S	*	*			cis	-140.7	154.6	26.1	-57.1	164.1	124.9	0	0	111.1
803	Y	28	Very low	27.5	Very low	217 Å²	217	145.3 Å²	145.3	85%	0.851	74%	0.742	S	S	*	*				-160.1	97.5	129	-126.2	-90.4	0	0	0	113
804	Y	32.5	Very low	27.9	Very low	159 Å²	159	148.2 Å²	148.2	62%	0.624	75%	0.747	S	S	*	*			trans	41.7	113.5	150.9	-71.7	-78.1	0	0	0	124.6
805	D	28.9	Very low	28.1	Very low	129 Å²	129	141.1 Å²	141.1	69%	0.69	74%	0.74	S	S	*	*				39.7	130.9	123.9	-67.3	-21.6	0	0	0	122.1
806	N	27.7	Very low	28.5	Very low	153 Å²	153	146.7 Å²	146.7	82%	0.818	76%	0.755	S	S	*	*				-168.2	157.9	101.9	-107.6	-74.5	0	0	0	117.1
807	S	29.7	Very low	28.9	Very low	108 Å²	108	146 Å²	146	76%	0.755	76%	0.76	S	S	*	*			trans	66.5	80.3	156.4	50.8	0	0	0	0	121.5
808	T	31	Very low	29.3	Very low	134 Å²	134	147.4 Å²	147.4	82%	0.822	76%	0.764	S	S	*	*			trans	-38.6	148.1	142.8	-28.3	0	0	0	0	116.4
809	E	28.7	Very low	29.6	Very low	163 Å²	163	143.4 Å²	143.4	76%	0.762	75%	0.751	S	S	*	*				155.9	122.8	119.1	-84.5	-161.9	155.8	0	0	114.3
810	Y	27.6	Very low	29.9	Very low	213 Å²	213	142.5 Å²	142.5	84%	0.835	76%	0.757	S	S	*	*				-168.8	149.8	105.6	-124.7	-100.1	0	0	0	115.2
811	C	30.7	Very low	30.2	Very low	105 Å²	105	137.6 Å²	137.6	71%	0.709	74%	0.743	S	S	*	*			trans	-54.3	165.7	176.8	-70.6	0	0	0	0	116.8
812	S	30.3	Very low	30.5	Very low	97 Å²	97	139.4 Å²	139.4	68%	0.678	76%	0.756	S	S	*	*			cis	-165.2	-151	-13	48.1	0	0	0	0	108.3
813	T	28.5	Very low	30.8	Very low	115 Å²	115	138.9 Å²	138.9	71%	0.706	76%	0.763	S	S	*	*			cis	-169.9	166.4	19.5	-22.2	0	0	0	0	111.4
814	L	30.9	Very low	31	Very low	175 Å²	175	134.3 Å²	134.3	92%	0.916	76%	0.758	S	S	*	*			trans	68.6	127.8	163.6	-60.1	165.4	0	0	0	118.2
815	G	30.6	Very low	31	Very low	68 Å²	68	134.8 Å²	134.8	70%	0.701	77%	0.77	S	S	*	*			cis	157.5	139.2	-17	0	0	0	0	0	116.1
816	R	30.6	Very low	31.2	Very low	251 Å²	251	136.3 Å²	136.3	95%	0.947	77%	0.773	S	S	*	*			trans	68.4	160.7	168.2	-66.6	177.6	171.2	139.5	-2.1	118.1
817	S	32.3	Very low	31.4	Very low	89 Å²	89	134.2 Å²	134.2	62%	0.622	77%	0.771	S	S	*	*			cis	-175.3	-172.8	-48	59.4	0	0	0	0	107.8
818	D	34.6	Very low	31.5	Very low	132 Å²	132	133.7 Å²	133.7	71%	0.706	77%	0.767	S	S	*	*			cis	-163.4	144.3	11.2	-134.4	-50.2	0	0	0	113.3
819	S	32.9	Very low	31.5	Very low	95 Å²	95	135.7 Å²	135.7	66%	0.664	77%	0.772	S	S	*	*			trans	65.7	165	152.5	86.9	0	0	0	0	119.7
820	M	32.9	Very low	31.6	Very low	173 Å²	173	131.5 Å²	131.5	85%	0.852	77%	0.772	S	S	*	*			cis	-162	154.6	0.4	-144.5	178.5	-127	0	0	112.7
821	A	33.9	Very low	31.9	Very low	87 Å²	87	132.3 Å²	132.3	72%	0.719	77%	0.774	S	S	*	*			trans	61.6	164.1	149.1	0	0	0	0	0	120.9
822	S	31.2	Very low	31.9	Very low	112 Å²	112	137.7 Å²	137.7	78%	0.783	78%	0.779	S	S	*	*			cis	173.2	145.9	-40.8	-92.2	0	0	0	0	109
823	T	33.7	Very low	32.1	Very low	141 Å²	141	140.8 Å²	140.8	87%	0.865	79%	0.788	S	S	*	*			trans	160	141.5	135.5	-68.8	0	0	0	0	112.8
824	T	31.8	Very low	32.1	Very low	121 Å²	121	144.4 Å²	144.4	74%	0.742	79%	0.794	S	S	*	*			trans	-110.3	164.8	-173.5	-40	0	0	0	0	111.9
825	L	32.3	Very low	32.1	Very low	169 Å²	169	144.4 Å²	144.4	89%	0.885	79%	0.794	S	S	*	*			trans	-163.8	152.7	141.6	-108.2	169.8	0	0	0	116.3
826	H	33.9	Very low	32	Very low	162 Å²	162	149.6 Å²	149.6	75%	0.75	80%	0.8	S	S	*	*			trans	-87.3	161.6	-157.8	-78.1	144.8	0	0	0	120.9
827	S	30.9	Very low	32.3	Very low	109 Å²	109	142.3 Å²	142.3	76%	0.762	79%	0.785	S	S	*	*			trans	69.5	159.9	131.8	67.7	0	0	0	0	122.1
828	S	32.1	Very low	32	Very low	97 Å²	97	149.4 Å²	149.4	68%	0.678	80%	0.798	S	S	*	*			cis	-171.2	160.5	-22.9	56.6	0	0	0	0	113.4
829	L	30.9	Very low	31.8	Very low	176 Å²	176	149.1 Å²	149.1	92%	0.921	81%	0.806	S	S	*	*			trans	49.6	134.8	146.9	-70.6	163.7	0	0	0	123.3
830	G	31.9	Very low	31.6	Very low	75 Å²	75	154.5 Å²	154.5	77%	0.773	82%	0.818	S	S	*	*			trans	-174.5	26.3	174.3	0	0	0	0	0	127.3
831	R	32.9	Very low	31.6	Very low	229 Å²	229	152.2 Å²	152.2	86%	0.864	82%	0.819	S	S	*	*			trans	49.7	122.9	158.7	-68.8	-176.6	172.9	-171.9	-0.2	124
832	R	30.2	Very low	31.3	Very low	218 Å²	218	159.4 Å²	159.4	82%	0.823	83%	0.827	S	S	*	*			trans	46	127.6	131.6	-64.8	-178.1	175.6	172.3	-1.3	122.6
833	N	34.4	Very low	31.4	Very low	162 Å²	162	163 Å²	163	87%	0.866	83%	0.832	S	S	*	*				-166.6	171.5	102.7	-108	-25.1	0	0	0	115
834	K	29	Very low	31	Very low	192 Å²	192	161.8 Å²	161.8	84%	0.835	82%	0.824	S	S	*	*			trans	-95.2	154.8	-173.5	-55.9	173.7	177.6	179.4	0	113.3
835	L	30.7	Very low	31.2	Very low	174 Å²	174	163.8 Å²	163.8	91%	0.911	83%	0.829	S	S	*	*				177.6	167.4	120.2	-95.1	158.9	0	0	0	114.2
836	H	29.6	Very low	31	Very low	178 Å²	178	166.1 Å²	166.1	82%	0.824	83%	0.826	S	S	*	*			trans	-144.1	177	-173.7	-123.1	9.9	0	0	0	107
837	P	35.4	Very low	30.9	Very low	98 Å²	98	164 Å²	164	64%	0.636	83%	0.825	S	S	*	*			cis	-138.3	-170.2	-14.4	41.2	-22.2	0	0	0	114.5
838	R	26.2	Very low	31	Very low	238 Å²	238	166.7 Å²	166.7	90%	0.898	83%	0.828	S	S	*	*			trans	48.8	128.2	151.1	-77.5	179.8	169.7	-180	-2.1	121.7
839	S	31.4	Very low	31	Very low	125 Å²	125	167.4 Å²	167.4	87%	0.874	83%	0.829	S	S	*	*				-179.7	-168.5	105.4	58.3	0	0	0	0	112.3
840	K	28.7	Very low	31.2	Very low	208 Å²	208	166.1 Å²	166.1	90%	0.904	82%	0.818	S	S	*	*			trans	-120.6	149.4	-169	-56.4	174.3	-179.7	177.4	0	112.2
841	S	31.7	Very low	31.3	Very low	126 Å²	126	171.7 Å²	171.7	88%	0.881	82%	0.816	S	S	*	*			trans	-151.1	148.8	150.3	48.6	0	0	0	0	111.8
842	R	28.6	Very low	31.5	Very low	237 Å²	237	166.7 Å²	166.7	89%	0.894	81%	0.806	S	S	*	*			trans	-93.6	156	161.9	-82.4	172.9	159.3	170.2	-8	107.5
843	E	32.7	Very low	31.6	Very low	188 Å²	188	159.7 Å²	159.7	88%	0.879	80%	0.802	S	S	*	*			trans	-145.1	170.8	142.2	-151	121.6	-121	0	0	110.4
844	T	26.7	Very low	31.7	Very low	115 Å²	115	160 Å²	160	71%	0.706	80%	0.802	S	S	*	*			trans	-150.1	129.4	-171.3	-64.7	0	0	0	0	110.2
845	I	34.6	Very low	31.9	Very low	163 Å²	163	156.4 Å²	156.4	84%	0.836	80%	0.796	S	S	*	*			trans	-128.7	126.5	175.8	-62.6	-177.9	0	0	0	109.8
846	R	27.6	Very low	32.3	Very low	219 Å²	219	154.1 Å²	154.1	83%	0.826	79%	0.792	S	S	*	*			trans	-101.3	169	161.8	-56.2	171.2	171.2	163.7	-4.8	106.7
847	T	32.1	Very low	32.4	Very low	118 Å²	118	150.8 Å²	150.8	72%	0.724	79%	0.789	S	S	*	*			cis	-165	168.4	19.4	-28	0	0	0	0	107.7
848	I	33.6	Very low	32.6	Very low	164 Å²	164	150 Å²	150	84%	0.841	80%	0.798	S	S	*	*				-175.6	167.9	123.7	-96.1	165.9	0	0	0	109.4
849	T	32.4	Very low	33	Very low	112 Å²	112	144.6 Å²	144.6	69%	0.687	79%	0.791	S	S	*	*			trans	-100	148.5	-176.8	45.9	0	0	0	0	113.6
850	Q	35.2	Very low	33.2	Very low	150 Å²	150	146.3 Å²	146.3	70%	0.701	79%	0.79	S	S	*	*				159.8	163.6	115	-83	-173.6	105.4	0	0	108.5
851	R	34.2	Very low	33.5	Very low	191 Å²	191	142.7 Å²	142.7	72%	0.721	78%	0.776	S	S	*	*			cis	-170.3	171.1	-5.9	-114.5	-168.6	140.1	102.9	10.4	107.8
852	D	35.6	Very low	33.6	Very low	125 Å²	125	147.6 Å²	147.6	67%	0.668	78%	0.776	S	S	*	*			cis	-162.1	143.1	-25.5	-130.6	5	0	0	0	107.8
853	G	33.8	Very low	33.9	Very low	71 Å²	71	140.1 Å²	140.1	73%	0.732	77%	0.772	S	S	*	*			trans	81.9	157.6	169.3	0	0	0	0	0	117.8
854	I	35.5	Very low	34	Very low	169 Å²	169	135 Å²	135	87%	0.867	77%	0.77	S	S	*	*			cis	-141.2	154.1	-5.8	-64.9	-177.3	0	0	0	109
855	T	33.4	Very low	34.2	Very low	116 Å²	116	135 Å²	135	71%	0.712	78%	0.775	S	S	*	*			trans	-138.1	165.2	172.1	-28.4	0	0	0	0	109.7
856	P	38.7	Very low	34.3	Very low	125 Å²	125	134.5 Å²	134.5	81%	0.812	77%	0.772	S	S	*	*				-148.3	165.3	106.4	38.7	-23.3	0	0	0	115.8
857	S	32.6	Very low	34.5	Very low	109 Å²	109	132 Å²	132	76%	0.762	77%	0.77	S	S	*	*			trans	-108.4	162.6	173.6	-53.5	0	0	0	0	112.2
858	G	38.9	Very low	34.5	Very low	80 Å²	80	132.2 Å²	132.2	83%	0.825	78%	0.776	S	S	*	*			trans	-119.6	149.3	166.7	0	0	0	0	0	111.7
859	T	34.4	Very low	34.3	Very low	125 Å²	125	129.4 Å²	129.4	77%	0.767	77%	0.767	S	S	*	*			trans	-141	158.2	-163.9	-39.2	0	0	0	0	111.5
860	L	35.7	Very low	34.3	Very low	161 Å²	161	134.6 Å²	134.6	84%	0.843	78%	0.775	S	S	*	*			trans	138.2	165.6	152.1	-74.9	163.1	0	0	0	112.4
861	Q	36	Very low	34.3	Very low	132 Å²	132	132.1 Å²	132.1	62%	0.617	78%	0.78	S	S	*	*				-160.1	143.1	-71.2	-138.8	-169	53.4	0	0	111.2
862	R	34.3	Very low	34.2	Very low	230 Å²	230	130.1 Å²	130.1	87%	0.868	79%	0.79	S	S	*	*			trans	66.4	154.8	166.3	-51.3	176	-173.1	-127.5	-1.4	116.8
863	G	33.2	Very low	34.1	Very low	79 Å²	79	127.6 Å²	127.6	81%	0.814	79%	0.793	S	S	*	*			cis	162.8	154.1	-11.5	0	0	0	0	0	113.7
864	G	34.7	Very low	34.2	Very low	82 Å²	82	131.5 Å²	131.5	85%	0.845	80%	0.797	S	S	*	*			trans	94.8	145.3	174.5	0	0	0	0	0	115.4
865	S	31.9	Very low	34.1	Very low	115 Å²	115	134.3 Å²	134.3	80%	0.804	80%	0.796	S	S	*	*			cis	157.3	165.4	-41.8	-172.2	0	0	0	0	109.7
866	I	36.3	Very low	34.1	Very low	152 Å²	152	133.1 Å²	133.1	78%	0.779	79%	0.793	S	S	*	*			trans	91.6	140.6	170.2	-54.9	176.9	0	0	0	116.5
867	E	31.7	Very low	33.8	Very low	165 Å²	165	132 Å²	132	77%	0.771	79%	0.788	S	S	*	*			trans	-103.6	175.3	-165.6	-41.7	113.9	118.8	0	0	114.5
868	S	32.8	Very low	33.9	Very low	123 Å²	123	131.9 Å²	131.9	86%	0.86	79%	0.787	S	S	*	*				-176	169.8	124.4	35.9	0	0	0	0	112.4
869	T	29.1	Very low	33.8	Very low	105 Å²	105	134.5 Å²	134.5	64%	0.644	79%	0.787	S	S	*	*			trans	-135	177.1	-159.4	-52.6	0	0	0	0	111.4
870	Y	33	Very low	33.6	Very low	221 Å²	221	139.6 Å²	139.6	87%	0.867	79%	0.793	S	S	*	*			trans	80.6	150.6	171.1	-43.5	-75.1	0	0	0	115.1
871	A	35.3	Very low	33.7	Very low	98 Å²	98	137 Å²	137	81%	0.81	79%	0.786	S	S	*	*			cis	-142.6	-179	7.3	0	0	0	0	0	113.5
872	T	30.8	Very low	33.8	Very low	150 Å²	150	137.7 Å²	137.7	92%	0.92	79%	0.792	S	S	*	*			trans	-87.4	160.1	-176.8	45.6	0	0	0	0	114.4
873	G	34.7	Very low	33.8	Very low	72 Å²	72	131.2 Å²	131.2	74%	0.742	78%	0.781	S	S	*	*			trans	-174.7	70.2	178.6	0	0	0	0	0	119.8
874	L	35.2	Very low	33.9	Very low	153 Å²	153	138 Å²	138	80%	0.801	78%	0.782	S	S	*	*			trans	42.1	126.4	142.4	-64.1	166.2	0	0	0	123.3
875	R	32.9	Very low	34.1	Very low	227 Å²	227	144.9 Å²	144.9	86%	0.857	78%	0.783	S	S	*	*			trans	65.7	157.6	136.7	-68.3	-177	179.4	-141.8	0.8	119.4
876	S	34.2	Very low	34.3	Very low	91 Å²	91	144.9 Å²	144.9	64%	0.636	78%	0.778	S	S	*	*			cis	-169.2	142.5	-24	51.4	0	0	0	0	112.2
877	S	33.4	Very low	34.3	Very low	103 Å²	103	146.2 Å²	146.2	72%	0.72	79%	0.786	S	S	*	*			trans	58.2	141.7	143.6	65.7	0	0	0	0	123.9
878	S	32.9	Very low	34.3	Very low	106 Å²	106	141.3 Å²	141.3	74%	0.741	78%	0.78	S	S	*	*			trans	96.3	109.7	137.1	-70.8	0	0	0	0	123.2
879	T	37.6	Very low	34.4	Very low	135 Å²	135	141.7 Å²	141.7	83%	0.828	78%	0.783	S	S	*	*				90.2	143.4	126.2	-49.8	0	0	0	0	120.4
880	R	29.5	Very low	34.5	Very low	232 Å²	232	140.8 Å²	140.8	88%	0.875	78%	0.78	S	S	*	*			trans	-99.8	-153.1	178.2	-44.9	170.9	169.1	-177.6	-4.7	109.6
881	P	39.4	Very low	34.6	Very low	107 Å²	107	138 Å²	138	70%	0.695	78%	0.777	S	S	*	*			cis	-128.7	-152.8	-34	22.9	3.2	0	0	0	111.5
882	I	37.2	Very low	34.5	Very low	146 Å²	146	138.9 Å²	138.9	75%	0.749	77%	0.768	S	S	*	*			trans	104.2	105.5	146.2	-65.9	167	0	0	0	121.1
883	S	33.4	Very low	34.6	Very low	93 Å²	93	139.3 Å²	139.3	65%	0.65	76%	0.757	S	S	*	*			trans	71.1	135	132.5	-80	0	0	0	0	127.2
884	R	36.9	Very low	34.5	Very low	221 Å²	221	142.6 Å²	142.6	83%	0.834	76%	0.758	S	S	*	*			trans	66.4	125	135.4	-64.5	172.3	-164.3	-155.4	6.1	121.2
885	R	37.7	Very low	34.3	Very low	228 Å²	228	140 Å²	140	86%	0.86	75%	0.752	S	S	*	*				170	108.6	106.1	-91	-173.3	-170.2	-156.3	1.7	109.8
886	T	37	Very low	34.4	Very low	114 Å²	114	135.1 Å²	135.1	70%	0.699	75%	0.748	S	S	*	*				86.1	126.7	76.1	51.2	0	0	0	0	116.2
887	L	36.2	Very low	34.1	Very low	181 Å²	181	137 Å²	137	95%	0.948	76%	0.755	S	S	*	*			trans	70.9	149.4	164.1	-55.5	164.3	0	0	0	116.6
888	G	31.2	Very low	34.2	Very low	62 Å²	62	137.7 Å²	137.7	64%	0.639	76%	0.76	S	S	*	*			cis	158.1	150.7	-9.4	0	0	0	0	0	113.2
889	S	34.6	Very low	34.1	Very low	131 Å²	131	141.2 Å²	141.2	92%	0.916	77%	0.765	S	S	*	*			trans	65.7	164.1	174.1	-68.3	0	0	0	0	117.8
890	S	32.2	Very low	34	Very low	86 Å²	86	140.4 Å²	140.4	60%	0.601	77%	0.765	S	S	*	*			cis	-177.3	137.2	-33	-174.7	0	0	0	0	109.6
891	M	33.7	Very low	34.8	Very low	161 Å²	161	134.9 Å²	134.9	79%	0.793	76%	0.759	S	S	*	*			trans	63.3	161.8	163.1	-71.6	-169.6	-62.9	0	0	116.7
892	L	34.2	Very low	34.6	Very low	117 Å²	117	137.3 Å²	137.3	61%	0.613	77%	0.765	S	S	*	*			cis	-160.5	171.7	-7.9	-120	168.7	0	0	0	110.2
893	F	33.6	Very low	34.4	Very low	159 Å²	159	137 Å²	137	70%	0.697	77%	0.765	S	S	*	*			trans	68.5	132.5	157.1	-68.6	-57.3	0	0	0	122.6
894	N	30.8	Very low	34.5	Very low	141 Å²	141	137.8 Å²	137.8	75%	0.754	77%	0.766	S	S	*	*			trans	54.2	142.8	130	-64.5	2.6	0	0	0	121.4
895	S	32.3	Very low	34.5	Very low	99 Å²	99	134 Å²	134	69%	0.692	76%	0.762	S	S	*	*			cis	-177.7	-174.1	0.4	46.8	0	0	0	0	112.2
896	V	33.4	Very low	34.3	Very low	125 Å²	125	133.2 Å²	133.2	76%	0.758	76%	0.759	S	S	*	*			trans	74.8	86.8	158.9	-173.7	0	0	0	0	118.8
897	T	29.4	Very low	34.1	Very low	130 Å²	130	133.7 Å²	133.7	80%	0.798	76%	0.762	S	S	*	*				5.8	124.5	119.5	-43.1	0	0	0	0	119.9
898	S	35.4	Very low	34.1	Very low	118 Å²	118	129.5 Å²	129.5	83%	0.825	75%	0.748	S	S	*	*				-160.5	150.5	126.5	73.9	0	0	0	0	112.3
899	Q	31.3	Very low	34.3	Very low	179 Å²	179	133.1 Å²	133.1	84%	0.836	75%	0.752	S	S	*	*			trans	-90.8	154.8	176.5	-57.2	165.4	1.6	0	0	111.1
900	S	35	Very low	34.3	Very low	118 Å²	118	133.9 Å²	133.9	83%	0.825	75%	0.746	S	S	*	*			trans	-175	142	134.4	-84.9	0	0	0	0	112.3
901	P	46	Very low	34.4	Very low	117 Å²	117	138.2 Å²	138.2	76%	0.76	76%	0.758	S	S	*	*			trans	-93.1	161	168	37.5	-33.5	0	0	0	111.9
902	L	34	Very low	34.5	Very low	157 Å²	157	138.8 Å²	138.8	82%	0.822	76%	0.764	S	S	*	*			trans	175.1	157.7	141	-100.6	164.7	0	0	0	113.3
903	L	34.8	Very low	34.8	Very low	141 Å²	141	138.5 Å²	138.5	74%	0.738	77%	0.773	S	S	*	*			trans	56.8	107.3	160.8	-59.2	161.9	0	0	0	117.4
904	T	34.4	Very low	34.9	Very low	109 Å²	109	139.7 Å²	139.7	67%	0.669	78%	0.78	S	S	*	*				81.7	123.2	51.6	71.4	0	0	0	0	117.6
905	N	36.8	Very low	35.5	Very low	140 Å²	140	139 Å²	139	75%	0.749	78%	0.783	S	S	*	*			trans	88.1	132.1	139.7	-79.4	-30	0	0	0	123.5
906	R	33.6	Very low	35.9	Very low	212 Å²	212	138.9 Å²	138.9	80%	0.8	79%	0.789	S	S	*	*			trans	77.6	108.2	140.5	-77.5	-177	175.4	-176.7	-2.9	118.4
907	T	33.2	Very low	36	Very low	124 Å²	124	141.3 Å²	141.3	76%	0.761	80%	0.796	S	S	*	*				69.1	135.2	83.7	61.7	0	0	0	0	113.7
908	S	35.6	Very low	36.5	Very low	94 Å²	94	142.6 Å²	142.6	66%	0.657	80%	0.798	S	S	*	*			cis	-162.5	176	14.9	45	0	0	0	0	113.8
909	N	36.9	Very low	36.9	Very low	138 Å²	138	142.9 Å²	142.9	74%	0.738	80%	0.796	S	S	*	*			trans	87.7	116.1	145.4	-73.3	-4.8	0	0	0	122.5
910	L	32.7	Very low	37.2	Very low	147 Å²	147	140.3 Å²	140.3	77%	0.77	79%	0.793	S	S	*	*			trans	86.4	146.5	136.6	-94.4	80.1	0	0	0	122.3
911	M	35.6	Very low	37.5	Very low	177 Å²	177	140.2 Å²	140.2	87%	0.872	79%	0.79	S	S	*	*			trans	83.6	133.9	166.9	-64.6	-167.7	171.3	0	0	120.2
912	N	35.3	Very low	37	Very low	172 Å²	172	143.9 Å²	143.9	92%	0.92	80%	0.797	S	S	*	*			trans	-54.9	135.1	-170.4	-64.7	-18	0	0	0	116.1
913	S	39.7	Very low	37	Very low	112 Å²	112	144.8 Å²	144.8	78%	0.783	80%	0.797	S	S	*	*			trans	-154	146.3	149.7	58.5	0	0	0	0	110.5
914	Q	37.6	Very low	37.1	Very low	184 Å²	184	143.9 Å²	143.9	86%	0.86	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-64.2	141.7	177.5	-66.4	162.8	-85.2	0	0	111.6	A916	Q914-A916 PolarHBondContact O-N 3.45Å
915	P	42	Very low	37.1	Very low	126 Å²	126	144.6 Å²	144.6	82%	0.818	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-68.4	118.5	161.5	-12.7	28.4	0	0	0	109.2
916	A	40.3	Very low	37	Very low	97 Å²	97	144.1 Å²	144.1	80%	0.802	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-70.1	135.6	168.9	0	0	0	0	0	109.7	Q914 L918	Q914-A916 PolarHBondContact O-N 3.45Å; A916-L918 PolarHBondContact O-N 3.16Å
917	L	37.1	Very low	37	Very low	176 Å²	176	138.6 Å²	138.6	92%	0.921	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-67.8	124.4	175.5	-74.7	163.6	0	0	0	110
918	L	39.1	Very low	37.1	Very low	157 Å²	157	140.1 Å²	140.1	82%	0.822	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-64.3	138.5	163.1	-77	161.2	0	0	0	108.8	A916 T920	A916-L918 PolarHBondContact O-N 3.16Å; L918-T920 PolarHBondContact O-N 3.33Å; L918-T920 VanDerWaalsContact O-N 3.09Å
919	P	43.9	Very low	37	Very low	123 Å²	123	139 Å²	139	80%	0.799	81%	0.813	S	S	*	*			trans	-68.7	110.2	176.6	27.9	-33	0	0	0	109.7
920	T	37.7	Very low	37	Very low	125 Å²	125	138.3 Å²	138.3	77%	0.767	82%	0.815	S	S	*	*			trans	-56.8	137.4	164.3	3.3	0	0	0	0	108.8	L918 Q922	L918-T920 PolarHBondContact O-N 3.33Å; L918-T920 VanDerWaalsContact O-N 3.09Å; T920-Q922 PolarHBondContact O-N 2.61Å
921	P	40.8	Very low	37.6	Very low	116 Å²	116	136.9 Å²	136.9	75%	0.753	81%	0.812	S	S	*	*			trans	-59.3	124.9	172.9	25.3	-33.4	0	0	0	108.8	Q923	P921-Q923 PolarHBondContact O-N 2.92Å
922	Q	35.3	Very low	38.7	Very low	194 Å²	194	131.9 Å²	131.9	91%	0.907	80%	0.798	S	S	*	*			trans	-61.8	113.1	174.7	-71.7	-179.1	-41	0	0	108.4	T920	T920-Q922 PolarHBondContact O-N 2.61Å
923	Q	34.2	Very low	40.5	Very low	177 Å²	177	127.4 Å²	127.4	83%	0.827	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-57.8	137.2	162.5	-71	177.5	-78.6	0	0	107.6	P921 T925	P921-Q923 PolarHBondContact O-N 2.92Å; Q923-T925 PolarHBondContact O-N 3.44Å
924	P	37.6	Very low	42.5	Very low	121 Å²	121	123.5 Å²	123.5	79%	0.786	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-58.7	126.7	173.5	25.5	-33.1	0	0	0	108.3
925	T	34.6	Very low	44.9	Very low	125 Å²	125	121 Å²	121	77%	0.767	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-54.1	130.1	172.8	47.1	0	0	0	0	108.8	Q923 S927	Q923-T925 PolarHBondContact O-N 3.44Å; T925-S927 PolarHBondContact O-N 2.82Å
926	P	34.2	Very low	47.2	Very low	129 Å²	129	115.2 Å²	115.2	84%	0.838	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-58.7	118.3	180	23.9	-33	0	0	0	109.3	V928	P926-V928 PolarHBondContact O-N 2.9Å
927	S	34.1	Very low	49.6	Very low	96 Å²	96	117 Å²	117	67%	0.671	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-63.5	130	175.8	49.2	0	0	0	0	109.6	T925 G929	T925-S927 PolarHBondContact O-N 2.82Å; S927-G929 PolarHBondContact O-N 3.35Å
928	V	35.9	Very low	52.3	Low	157 Å²	157	108.8 Å²	108.8	95%	0.952	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.1	123.7	177.5	-178.7	0	0	0	0	110	P926	P926-V928 PolarHBondContact O-N 2.9Å
929	G	32.1	Very low	54.8	Low	69 Å²	69	105.7 Å²	105.7	71%	0.711	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	141.4	-26.7	170.1	0	0	0	0	0	116.5	S927 V931	S927-G929 PolarHBondContact O-N 3.35Å; G929-V931 PolarHBondContact O-N 2.96Å
930	T	36.3	Very low	57	Low	125 Å²	125	110.4 Å²	110.4	77%	0.767	64%	0.638	S	S	*	*			trans	-80.2	104.6	-179.2	-49.2	0	0	0	0	111.2	A932	T930-A932 PolarHBondContact O-N 2.9Å
931	V	46.3	Very low	59.6	Low	117 Å²	117	105.9 Å²	105.9	71%	0.709	61%	0.611	S	S	*	*			trans	-65.3	106.4	168.1	-179.5	0	0	0	0	108.5	G929 T933	G929-V931 PolarHBondContact O-N 2.96Å; V931-T933 PolarHBondContact O-N 2.87Å
932	A	58.6	Low	62	Low	71 Å²	71	102.1 Å²	102.1	59%	0.587	59%	0.587	S	S	*	*			trans	-65.4	104.4	176.6	0	0	0	0	0	109.5	T930 I934	T930-A932 PolarHBondContact O-N 2.9Å; A932-I934 PolarHBondContact O-N 3.31Å
933	T	73.5	Confident	64.6	Low	79 Å²	79	97.1 Å²	97.1	49%	0.485	58%	0.578	S	S	.	*			trans	-62.6	122.4	171.9	-75	0	0	0	0	109.1	A617 V931	A617-T933 HydrophobicContact CB-CG2 3.55Å; V931-T933 PolarHBondContact O-N 2.87Å
934	I	82.4	Confident	67.4	Low	30 Å²	30	91.4 Å²	91.4	15%	0.154	55%	0.553	C	S	.	*			trans	-99.9	140.9	178.4	-66.8	151.4	0	0	0	108	S615 T616 A932 L936 L992	S615-I934 VanDerWaalsContact CA-O 3.24Å; S615-I934 WeakPolarHBondContact CA-O 3.49Å; S615-I934 PolarHBondContact OG-O 2.97Å; T616-I934 HydrophobicContact CG2-CB 4.41Å; T616-I934 PolarHBondContact N-O 2.9Å; T616-I934 PolarHBondContact OG1-N 2.82Å; A932-I934 PolarHBondContact O-N 3.31Å; I934-L936 HydrophobicContact CG2-CD1 4.23Å; I934-L936 HydrophobicContact CG2-CD2 3.77Å; I934-L936 HydrophobicContact CG2-CG 3.81Å; I934-L992 HydrophobicContact CD1-CD2 3.63Å
935	Q	87.7	Confident	70.1	Confident	132 Å²	132	85.7 Å²	85.7	62%	0.617	52%	0.516	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.2	133.2	172.4	-72.5	-176.6	-15	0	0	108.4	T613 L614	T613-Q935 HydrophobicContact CG2-CB 4.14Å; L614-Q935 CarbonylContact O-C 3.51Å; L614-Q935 WeakPolarHBondContact O-CA 3.49Å
936	L	89.4	Confident	72.9	Confident	3 Å²	3	86.2 Å²	86.2	2%	0.016	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	109.8	-170.9	-59.5	166.6	0	0	0	108.2	W576 Y595 T613 L614 I934 V956 F989	W576-L936 HydrophobicContact CH2-CD1 3.67Å; W576-L936 HydrophobicContact CZ2-CD1 4.31Å; W576-L936 HydrophobicContact CZ3-CD1 4.37Å; Y595-L936 HydrophobicContact CE1-CD1 3.73Å; Y595-L936 HydrophobicContact CE1-CD2 4.28Å; Y595-L936 VanDerWaalsContact OH-CD1 3.27Å; Y595-L936 WeakPolarHBondContact OH-CD1 3.24Å; T613-L936 CarbonylContact C-O 3.46Å; T613-L936 WeakPolarHBondContact CA-O 3.45Å; L614-L936 HydrophobicContact CB-CB 4.3Å; L614-L936 PolarHBondContact N-O 3.22Å; L614-L936 PolarHBondContact O-N 3.29Å; I934-L936 HydrophobicContact CG2-CD1 4.23Å; I934-L936 HydrophobicContact CG2-CD2 3.77Å; I934-L936 HydrophobicContact CG2-CG 3.81Å; L936-V956 HydrophobicContact CB-CG1 3.88Å; L936-V956 HydrophobicContact CD1-CG1 4.19Å; L936-V956 HydrophobicContact CD2-CG1 4.06Å; L936-V956 HydrophobicContact CG-CG1 4.24Å; L936-F989 HydrophobicContact CD2-CD1 4.23Å
937	E	91.8	Very high	75.6	Confident	134 Å²	134	82.4 Å²	82.4	63%	0.626	48%	0.479	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.3	128.6	172	-173.7	173.6	-171.5	0	0	109.5	P939	E937-P939 VanDerWaalsContact O-CD 3.25Å; E937-P939 WeakPolarHBondContact O-CD 3.44Å
938	V	93	Very high	78.2	Confident	4 Å²	4	81.4 Å²	81.4	2%	0.024	47%	0.466	C	S	.	.			trans	-85.6	108.1	176.4	-179.8	0	0	0	0	107.8	M612 L614 R940 P941 V954	M612-V938 HydrophobicContact CB-CB 4.16Å; M612-V938 HydrophobicContact CB-CG2 4.27Å; M612-V938 HydrophobicContact CG-CB 4.48Å; M612-V938 HydrophobicContact CG-CG2 4.09Å; M612-V938 PolarHBondContact O-N 2.88Å; M612-V938 HydrophobicContact SD-CG2 4.16Å; L614-V938 HydrophobicContact CD1-CG2 4.19Å; L614-V938 HydrophobicContact CD2-CG2 4.35Å; L614-V938 HydrophobicContact CG-CG2 3.82Å; V938-R940 PolarHBondContact O-N 2.82Å; V938-R940 VanDerWaalsContact O-N 3.09Å; V938-P941 HydrophobicContact CB-CG 4.49Å; V938-P941 HydrophobicContact CG1-CG 4.39Å; V938-P941 WeakPolarHBondContact O-CD 3.34Å; V938-V954 HydrophobicContact CG1-CB 3.94Å; V938-V954 HydrophobicContact CG1-CG2 4.06Å; V938-V954 HydrophobicContact CG2-CG2 3.92Å
939	P	91	Very high	80.8	Confident	93 Å²	93	77.7 Å²	77.7	60%	0.604	44%	0.441	S	S	*	.	S	Bend	trans	-70	-15.8	-166.9	-21.4	35.2	0	0	0	114.4	E937 T955 V956	E937-P939 VanDerWaalsContact O-CD 3.25Å; E937-P939 WeakPolarHBondContact O-CD 3.44Å; P939-T955 WeakPolarHBondContact CD-O 3.32Å; P939-V956 WeakPolarHBondContact CD-O 3.43Å
940	R	90.3	Very high	83.7	Confident	222 Å²	222	79.6 Å²	79.6	84%	0.838	43%	0.432	S	S	*	.	S	Bend	trans	-147.2	88.7	173.3	-58.1	-178.2	-155.6	146.7	9.6	108.8	V938	V938-R940 PolarHBondContact O-N 2.82Å; V938-R940 VanDerWaalsContact O-N 3.09Å
941	P	91.8	Very high	86.4	Confident	30 Å²	30	76.6 Å²	76.6	20%	0.195	41%	0.414	C	S	.	.			trans	-61.3	152.2	172.5	-20	33.6	0	0	0	110.6	T609 M612 V938	T609-P941 HydrophobicContact CG2-CB 4.36Å; M612-P941 HydrophobicContact CB-CB 4.04Å; M612-P941 HydrophobicContact CB-CG 3.75Å; M612-P941 HydrophobicContact SD-CB 4.4Å; V938-P941 HydrophobicContact CB-CG 4.49Å; V938-P941 HydrophobicContact CG1-CG 4.39Å; V938-P941 WeakPolarHBondContact O-CD 3.34Å
942	P	91.5	Very high	88.7	Confident	37 Å²	37	73 Å²	73	24%	0.24	39%	0.391	C	S	.	.			trans	-55.4	150.4	164.8	-22.6	34.2	0	0	0	110.9	I944 I945 V954	P942-I944 PolarHBondContact O-N 2.95Å; P942-I945 HydrophobicContact CB-CG1 3.99Å; P942-I945 HydrophobicContact CG-CD1 4.18Å; P942-I945 HydrophobicContact CG-CG1 3.93Å; P942-V954 HydrophobicContact CG-CG1 3.7Å
943	A	90.5	Very high	90.4	Very high	89 Å²	89	74.9 Å²	74.9	74%	0.736	38%	0.383	S	S	*	.	S	Bend	trans	-63.4	-31.1	177.2	0	0	0	0	0	112.5
944	I	92.7	Very high	91.4	Very high	56 Å²	56	71.2 Å²	71.2	29%	0.287	36%	0.361	S	S	.	.			trans	-146.7	140.6	176.3	-167	168.7	0	0	0	108.5	D606 W607 E608 P942	D606-I944 HydrophobicContact CB-CD1 3.96Å; D606-I944 HydrophobicContact CB-CG1 4.08Å; D606-I944 WeakPolarHBondContact OD2-CD1 3.36Å; W607-I944 CarbonylContact O-C 3.58Å; W607-I944 WeakPolarHBondContact O-CA 3.49Å; E608-I944 HydrophobicContact CG-CB 4.31Å; E608-I944 HydrophobicContact CG-CD1 4.38Å; E608-I944 HydrophobicContact CG-CG1 4.09Å; P942-I944 PolarHBondContact O-N 2.95Å
945	I	94.5	Very high	92	Very high	2 Å²	2	72.9 Å²	72.9	1%	0.01	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-120.1	112.6	167.4	-59.7	174.5	0	0	0	106.7	V599 Q601 W607 M612 P942 N952 V954	V599-I945 HydrophobicContact CG1-CD1 4.38Å; Q601-I945 HydrophobicContact CG-CG2 4.11Å; Q601-I945 PolarHBondContact NE2-O 2.93Å; Q601-I945 VanDerWaalsContact NE2-O 3.1Å; W607-I945 HydrophobicContact CB-CB 4.22Å; W607-I945 HydrophobicContact CE3-CG2 4.47Å; W607-I945 PolarHBondContact N-O 2.86Å; W607-I945 PolarHBondContact O-N 2.88Å; M612-I945 HydrophobicContact CE-CD1 3.55Å; M612-I945 HydrophobicContact SD-CD1 3.96Å; P942-I945 HydrophobicContact CB-CG1 3.99Å; P942-I945 HydrophobicContact CG-CD1 4.18Å; P942-I945 HydrophobicContact CG-CG1 3.93Å; I945-N952 HydrophobicContact CG2-CB 4.04Å; I945-V954 HydrophobicContact CD1-CG1 4.42Å
946	R	93.4	Very high	92.1	Very high	136 Å²	136	67.3 Å²	67.3	51%	0.513	35%	0.347	S	S	.	.			trans	-73	156.5	-171.1	-69.6	-167.8	-172.1	92	7	113.3	Q601 D606 D948	Q601-R946 WeakPolarHBondContact CG-O 3.4Å; Q601-R946 VanDerWaalsContact NE2-C 3.26Å; Q601-R946 PolarHBondContact NE2-O 3.07Å; D606-R946 WeakPolarHBondContact OD1-CA 3.48Å; R946-D948 HydrophobicContact CB-CB 4.22Å; R946-D948 VanDerWaalsContact CB-CG 3.49Å; R946-D948 VanDerWaalsContact CB-OD2 3.27Å; R946-D948 WeakPolarHBondContact CB-OD2 3.37Å; R946-D948 PolarHBondContact O-N 2.9Å
947	C	90.9	Very high	92.1	Very high	48 Å²	48	68.2 Å²	68.2	32%	0.324	36%	0.358	S	S	.	.	S	Bend	trans	-84.4	30.5	170.1	71.4	0	0	0	0	113.3	Q601 D606 N949	Q601-C947 CarbonylContact O-C 3.57Å; Q601-C947 WeakPolarHBondContact O-CA 3.34Å; D606-C947 PolarHBondContact OD1-N 2.89Å; C947-N949 VanDerWaalsContact C-N 3.28Å
948	D	89.4	Confident	92.1	Very high	75 Å²	75	67 Å²	67	40%	0.401	36%	0.355	S	S	.	.	S	Bend	trans	-84	0.6	179.8	54.6	16.2	0	0	0	113.5	R946 E950	R946-D948 HydrophobicContact CB-CB 4.22Å; R946-D948 VanDerWaalsContact CB-CG 3.49Å; R946-D948 VanDerWaalsContact CB-OD2 3.27Å; R946-D948 WeakPolarHBondContact CB-OD2 3.37Å; R946-D948 PolarHBondContact O-N 2.9Å; D948-E950 PolarHBondContact O-N 3.09Å; D948-E950 WeakPolarHBondContact OD1-CB 3.3Å; D948-E950 PolarHBondContact OD1-N 3.18Å; D948-E950 VanDerWaalsContact OD1-N 3.08Å
949	N	90.2	Very high	92	Very high	79 Å²	79	67.3 Å²	67.3	42%	0.422	36%	0.356	S	S	.	.			trans	60.3	17.1	-173.7	-158.7	39.8	0	0	0	114.5	Q600 Q601 A602 C947	Q600-N949 VanDerWaalsContact CG-O 3.24Å; Q600-N949 WeakPolarHBondContact CG-O 3.43Å; Q600-N949 WeakPolarHBondContact CG-OD1 3.43Å; Q600-N949 PolarHBondContact NE2-O 3.34Å; Q600-N949 PolarHBondContact NE2-OD1 2.68Å; Q601-N949 WeakPolarHBondContact O-CA 3.48Å; Q601-N949 PolarHBondContact O-N 3.04Å; Q601-N949 VanDerWaalsContact O-N 3.08Å; A602-N949 HydrophobicContact CB-CB 4.06Å; C947-N949 VanDerWaalsContact C-N 3.28Å
950	E	92.6	Very high	91.9	Very high	110 Å²	110	67.7 Å²	67.7	51%	0.514	35%	0.353	S	S	.	.			trans	-86.8	140.3	177.6	-77	-64.8	152	0	0	112.4	D948 N952	D948-E950 PolarHBondContact O-N 3.09Å; D948-E950 WeakPolarHBondContact OD1-CB 3.3Å; D948-E950 PolarHBondContact OD1-N 3.18Å; D948-E950 VanDerWaalsContact OD1-N 3.08Å; E950-N952 PolarHBondContact O-N 2.73Å; E950-N952 PolarHBondContact O-ND2 3.08Å
951	P	93	Very high	91.9	Very high	61 Å²	61	57.3 Å²	57.3	40%	0.396	31%	0.314	S	S	.	.			trans	-67.1	97.5	179.9	-23.8	36.1	0	0	0	114.2	M598 V599 R953	M598-P951 HydrophobicContact CE-CB 3.59Å; M598-P951 VanDerWaalsContact CE-O 3.27Å; M598-P951 WeakPolarHBondContact CE-O 3.3Å; V599-P951 CarbonylContact O-C 3.58Å; P951-R953 PolarHBondContact O-N 3.39Å
952	N	94.6	Very high	91.7	Very high	41 Å²	41	64.1 Å²	64.1	22%	0.219	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	114.1	176.6	-80.3	-103.3	0	0	0	111	V599 I945 E950 V954	V599-N952 PolarHBondContact N-O 2.83Å; V599-N952 PolarHBondContact O-N 3.26Å; I945-N952 HydrophobicContact CG2-CB 4.04Å; E950-N952 PolarHBondContact O-N 2.73Å; E950-N952 PolarHBondContact O-ND2 3.08Å; N952-V954 PolarHBondContact O-N 2.81Å
953	R	94.6	Very high	91.7	Very high	111 Å²	111	63.1 Å²	63.1	42%	0.419	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	109.2	-179.3	-174.9	-170.9	-78.8	-146.2	2.9	111.4	D581 Y596 M598 P951	D581-R953 IonicContact OD1-NH1 3.57Å; D581-R953 PolarHBondContact OD1-NH1 2.84Å; D581-R953 IonicContact OD1-NH2 3.53Å; D581-R953 IonicContact OD2-CZ 3.22Å; D581-R953 IonicContact OD2-NH1 2.67Å; D581-R953 PolarHBondContact OD2-NH1 2.86Å; Y596-R953 HydrophobicContact CD1-CG 3.47Å; Y596-R953 VanDerWaalsContact CD1-CG 3.47Å; Y596-R953 HydrophobicContact CD2-CG 4.39Å; Y596-R953 HydrophobicContact CE1-CG 4.03Å; Y596-R953 HydrophobicContact CG-CG 3.66Å; M598-R953 HydrophobicContact CE-CB 3.96Å; M598-R953 HydrophobicContact SD-CB 3.7Å; M598-R953 HydrophobicContact SD-CG 3.76Å; P951-R953 PolarHBondContact O-N 3.39Å
954	V	94.7	Very high	91.6	Very high	3 Å²	3	64.7 Å²	64.7	2%	0.018	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	137.3	172.7	-48.3	0	0	0	0	110.9	Y596 G597 V599 M612 L614 V938 P942 I945 N952	Y596-V954 CarbonylContact C-O 3.59Å; Y596-V954 WeakPolarHBondContact CA-O 3.35Å; Y596-V954 WeakPolarHBondContact CB-O 3.25Å; G597-V954 PolarHBondContact N-O 2.94Å; G597-V954 PolarHBondContact O-N 3.39Å; V599-V954 HydrophobicContact CG2-CG1 4.13Å; V599-V954 HydrophobicContact CG2-CG2 3.94Å; M612-V954 HydrophobicContact SD-CG1 4.36Å; L614-V954 HydrophobicContact CD1-CG2 3.87Å; V938-V954 HydrophobicContact CG1-CB 3.94Å; V938-V954 HydrophobicContact CG1-CG2 4.06Å; V938-V954 HydrophobicContact CG2-CG2 3.92Å; P942-V954 HydrophobicContact CG-CG1 3.7Å; I945-V954 HydrophobicContact CD1-CG1 4.42Å; N952-V954 PolarHBondContact O-N 2.81Å
955	T	93.9	Very high	91.4	Very high	64 Å²	64	65.1 Å²	65.1	39%	0.393	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	120.3	178.5	-54	0	0	0	0	110	V594 Y596 P939	V594-T955 HydrophobicContact CG1-CG2 4.16Å; Y596-T955 HydrophobicContact CE1-CG2 4.42Å; Y596-T955 WeakPolarHBondContact CE1-OG1 3.42Å; P939-T955 WeakPolarHBondContact CD-O 3.32Å
956	V	91.1	Very high	91.1	Very high	15 Å²	15	66.3 Å²	66.3	9%	0.091	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-49.9	174.6	174.6	0	0	0	0	110.2	Y595 L614 L936 P939	Y595-V956 HydrophobicContact CD1-CB 3.87Å; Y595-V956 HydrophobicContact CD1-CG1 3.68Å; Y595-V956 HydrophobicContact CE1-CB 4.25Å; Y595-V956 HydrophobicContact CE1-CG1 3.84Å; Y595-V956 HydrophobicContact CG-CB 4.13Å; Y595-V956 HydrophobicContact CG-CG1 4.43Å; Y595-V956 PolarHBondContact O-N 2.94Å; L614-V956 HydrophobicContact CD1-CG2 3.79Å; L936-V956 HydrophobicContact CB-CG1 3.88Å; L936-V956 HydrophobicContact CD1-CG1 4.19Å; L936-V956 HydrophobicContact CD2-CG1 4.06Å; L936-V956 HydrophobicContact CG-CG1 4.24Å; P939-V956 WeakPolarHBondContact CD-O 3.43Å
957	G	89.2	Confident	91.1	Very high	23 Å²	23	60.8 Å²	60.8	24%	0.237	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.9	171.6	-172.5	0	0	0	0	0	115.1	Y595	Y595-G957 PolarHBondContact N-O 2.88Å; Y595-G957 PolarHBondContact O-N 2.82Å
958	L	91.3	Very high	91.3	Very high	109 Å²	109	59.7 Å²	59.7	57%	0.571	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126	117.9	175.5	-64.5	170.5	0	0	0	107.4	K592 V594	K592-L958 HydrophobicContact CD-CD2 4.36Å; V594-L958 HydrophobicContact CB-CD2 4.09Å; V594-L958 HydrophobicContact CG1-CD2 3.72Å; V594-L958 HydrophobicContact CG2-CD2 3.73Å
959	L	90.1	Very high	91.7	Very high	9 Å²	9	56.1 Å²	56.1	5%	0.047	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	106.3	179.8	-57.5	78.8	0	0	0	107.8	I593 T987 I991	I593-L959 HydrophobicContact CB-CB 4.25Å; I593-L959 PolarHBondContact N-O 3.09Å; I593-L959 PolarHBondContact O-N 2.8Å; L959-T987 HydrophobicContact CB-CG2 4.15Å; L959-T987 HydrophobicContact CD2-CG2 3.86Å; L959-T987 HydrophobicContact CG-CG2 3.97Å; L959-I991 HydrophobicContact CD2-CD1 3.97Å; L959-I991 HydrophobicContact CD2-CG1 3.96Å
960	D	90.3	Very high	92	Very high	101 Å²	101	55.3 Å²	55.3	54%	0.54	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	114.1	176.6	-80.2	-45.9	0	0	0	110.4	K592	K592-D960 WeakPolarHBondContact CB-OD1 3.48Å; K592-D960 WeakPolarHBondContact CE-OD1 3.22Å; K592-D960 WeakPolarHBondContact CG-OD1 3.35Å; K592-D960 IonicContact NZ-OD1 3.74Å; K592-D960 PolarHBondContact NZ-OD1 2.72Å; K592-D960 IonicContact NZ-OD2 3.61Å; K592-D960 PolarHBondContact NZ-OD2 2.83Å
961	L	89.6	Confident	92.1	Very high	5 Å²	5	50.3 Å²	50.3	3%	0.026	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	151.9	-172	-59.7	178.4	0	0	0	111	M591 I593 P963 A983 N986 F1019	M591-L961 HydrophobicContact CE-CB 4.13Å; M591-L961 HydrophobicContact CE-CD1 4.02Å; M591-L961 PolarHBondContact N-O 2.64Å; M591-L961 PolarHBondContact O-N 3.39Å; I593-L961 HydrophobicContact CD1-CD1 3.89Å; I593-L961 HydrophobicContact CG1-CD1 4.29Å; L961-P963 WeakPolarHBondContact O-CD 3.46Å; L961-A983 HydrophobicContact CD1-CB 4.29Å; L961-N986 HydrophobicContact CD2-CB 4.43Å; L961-F1019 HydrophobicContact CD1-CE1 4.08Å; L961-F1019 HydrophobicContact CD1-CZ 3.72Å
962	Q	88.4	Confident	92.1	Very high	173 Å²	173	52.3 Å²	52.3	81%	0.808	26%	0.257	S	S	*	.			trans	-111.7	89.4	174.1	-66.8	179.5	7.1	0	0	108.4
963	P	90.9	Very high	91.9	Very high	15 Å²	15	59.3 Å²	59.3	10%	0.097	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-75.8	154.5	179.4	33	-37.1	0	0	0	111.6	M591 L961 Y965 A981 T982 A983	M591-P963 HydrophobicContact CB-CG 3.7Å; M591-P963 HydrophobicContact CE-CB 4.32Å; M591-P963 HydrophobicContact CE-CG 4.44Å; M591-P963 HydrophobicContact SD-CG 4.38Å; L961-P963 WeakPolarHBondContact O-CD 3.46Å; P963-Y965 HydrophobicContact CG-CD2 4.48Å; P963-Y965 HydrophobicContact CG-CE1 3.93Å; P963-Y965 HydrophobicContact CG-CE2 3.75Å; P963-Y965 VanDerWaalsContact CG-CZ 3.42Å; P963-Y965 WeakPolarHBondContact CG-OH 3.38Å; P963-A981 HydrophobicContact CB-CB 3.91Å; P963-A981 HydrophobicContact CG-CB 4.43Å; P963-T982 CarbonylContact C-O 3.56Å; P963-T982 VanDerWaalsContact CA-O 3.25Å; P963-T982 WeakPolarHBondContact CA-O 3.24Å; P963-A983 HydrophobicContact CB-CB 4.21Å
964	R	88.9	Confident	91.8	Very high	122 Å²	122	55.3 Å²	55.3	46%	0.46	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	119.8	156.6	169	177.6	152.9	152.2	-3.6	108.6	E966 T982	R964-E966 IonicContact CZ-OE2 3.82Å; R964-E966 VanDerWaalsContact CZ-OE2 3.23Å; R964-E966 IonicContact NE-OE2 2.74Å; R964-E966 PolarHBondContact NE-OE2 3.21Å; R964-E966 IonicContact NH2-OE2 3.97Å; R964-E966 PolarHBondContact NH2-OE2 3.27Å; R964-T982 PolarHBondContact N-O 2.7Å; R964-T982 PolarHBondContact O-N 2.79Å
965	Y	87.4	Confident	91.8	Very high	65 Å²	65	59.7 Å²	59.7	26%	0.255	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	139.7	168.3	-60	-75	0	0	0	111.3	I584 G589 T590 P963 L979 K980 A981 L1023	I584-Y965 HydrophobicContact CG1-CE1 4.48Å; I584-Y965 HydrophobicContact CG2-CE1 4.22Å; G589-Y965 WeakPolarHBondContact O-CE2 3.37Å; T590-Y965 PolarHBondContact O-OH 2.86Å; P963-Y965 HydrophobicContact CG-CD2 4.48Å; P963-Y965 HydrophobicContact CG-CE1 3.93Å; P963-Y965 HydrophobicContact CG-CE2 3.75Å; P963-Y965 VanDerWaalsContact CG-CZ 3.42Å; P963-Y965 WeakPolarHBondContact CG-OH 3.38Å; Y965-L979 HydrophobicContact CD1-CD1 4.17Å; Y965-K980 WeakPolarHBondContact CA-O 3.31Å; Y965-A981 HydrophobicContact CD1-CB 4.07Å; Y965-A981 HydrophobicContact CE1-CB 3.93Å; Y965-L1023 HydrophobicContact CD1-CD1 4.05Å; Y965-L1023 HydrophobicContact CE1-CD1 3.77Å
966	E	89.1	Confident	91.8	Very high	27 Å²	27	62.5 Å²	62.5	13%	0.126	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	149.4	169.4	58.7	-164.8	-164.1	0	0	109.2	R964 K980	R964-E966 IonicContact CZ-OE2 3.82Å; R964-E966 VanDerWaalsContact CZ-OE2 3.23Å; R964-E966 IonicContact NE-OE2 2.74Å; R964-E966 PolarHBondContact NE-OE2 3.21Å; R964-E966 IonicContact NH2-OE2 3.97Å; R964-E966 PolarHBondContact NH2-OE2 3.27Å; E966-K980 HydrophobicContact CG-CB 4.3Å; E966-K980 HydrophobicContact CG-CD 4.29Å; E966-K980 HydrophobicContact CG-CG 4.46Å; E966-K980 PolarHBondContact N-O 3.26Å; E966-K980 WeakPolarHBondContact O-CA 3.33Å; E966-K980 WeakPolarHBondContact O-CB 3.5Å; E966-K980 PolarHBondContact O-N 3.4Å; E966-K980 VanDerWaalsContact O-O 3.14Å; E966-K980 IonicContact OE1-NZ 2.75Å; E966-K980 PolarHBondContact OE1-NZ 3Å
967	Y	93.6	Very high	91.9	Very high	21 Å²	21	61.8 Å²	61.8	8%	0.082	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	144.8	172.8	-66.5	-87.7	0	0	0	109.9	Y978 L979 E1026 I1029 R1066 V1068 R1069 L1070 M1071	Y967-Y978 CarbonylContact C-O 3.55Å; Y967-Y978 WeakPolarHBondContact CA-O 3.22Å; Y967-L979 HydrophobicContact CD1-CB 4.08Å; Y967-L979 HydrophobicContact CD1-CD1 4.09Å; Y967-L979 HydrophobicContact CE1-CB 3.89Å; Y967-L979 HydrophobicContact CE1-CD1 3.78Å; Y967-L979 HydrophobicContact CE1-CG 4.35Å; Y967-L979 HydrophobicContact CE2-CD1 4.34Å; Y967-E1026 HydrophobicContact CD1-CB 3.95Å; Y967-E1026 HydrophobicContact CD1-CG 4.09Å; Y967-E1026 HydrophobicContact CE1-CB 3.6Å; Y967-E1026 HydrophobicContact CE1-CG 3.42Å; Y967-E1026 VanDerWaalsContact CE1-CG 3.42Å; Y967-E1026 PolarHBondContact OH-OE2 3.11Å; Y967-I1029 HydrophobicContact CD1-CD1 3.77Å; Y967-I1029 HydrophobicContact CD2-CD1 3.87Å; Y967-I1029 HydrophobicContact CE1-CD1 4.31Å; Y967-I1029 HydrophobicContact CE2-CD1 4.37Å; Y967-I1029 HydrophobicContact CG-CD1 3.49Å; Y967-I1029 VanDerWaalsContact CG-CD1 3.49Å; Y967-R1066 PolarHBondContact OH-NH2 3.19Å; Y967-R1066 VanDerWaalsContact OH-NH2 3.14Å; Y967-V1068 HydrophobicContact CD2-CG1 3.57Å; Y967-V1068 HydrophobicContact CE2-CG1 3.89Å; Y967-V1068 HydrophobicContact CG-CG1 4.44Å; Y967-R1069 PolarHBondContact N-O 3.2Å; Y967-R1069 VanDerWaalsContact N-O 3.08Å; Y967-L1070 CarbonylContact O-C 3.53Å; Y967-L1070 WeakPolarHBondContact O-CA 3.35Å; Y967-M1071 PolarHBondContact O-N 3.11Å
968	V	95.3	Very high	92	Very high	24 Å²	24	65 Å²	65	15%	0.145	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	139.7	178.7	-172	0	0	0	0	109.6	A977 Y978 K980 M1071 V1073	V968-A977 CarbonylContact O-C 3.53Å; V968-Y978 PolarHBondContact N-O 3.37Å; V968-Y978 PolarHBondContact O-N 3.35Å; V968-K980 HydrophobicContact CG2-CB 4.08Å; V968-K980 HydrophobicContact CG2-CD 3.79Å; V968-M1071 CarbonylContact C-O 3.6Å; V968-M1071 WeakPolarHBondContact CA-O 3.46Å; V968-M1071 HydrophobicContact CG1-CE 3.7Å; V968-M1071 HydrophobicContact CG2-CB 4.42Å; V968-M1071 HydrophobicContact CG2-CE 3.99Å; V968-V1073 HydrophobicContact CG1-CG2 4.37Å
969	T	96.4	Very high	91.8	Very high	1 Å²	1	60.9 Å²	60.9	1%	0.006	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	146.8	172.1	-175.5	0	0	0	0	111.1	P971 Y976 I1031 L1070 M1071 V1072 V1073	T969-P971 HydrophobicContact CG2-CG 4Å; T969-Y976 WeakPolarHBondContact CB-O 3.5Å; T969-Y976 PolarHBondContact OG1-O 3.37Å; T969-I1031 HydrophobicContact CG2-CD1 4.13Å; T969-I1031 HydrophobicContact CG2-CG1 4.25Å; T969-I1031 WeakPolarHBondContact OG1-CD1 3.33Å; T969-L1070 HydrophobicContact CG2-CD1 3.98Å; T969-L1070 HydrophobicContact CG2-CD2 4.46Å; T969-L1070 HydrophobicContact CG2-CG 4.4Å; T969-M1071 PolarHBondContact N-O 3.17Å; T969-V1072 HydrophobicContact CG2-CB 4.2Å; T969-V1072 HydrophobicContact CG2-CG1 4.15Å; T969-V1072 HydrophobicContact CG2-CG2 3.84Å; T969-V1073 PolarHBondContact O-N 2.73Å
970	V	96.7	Very high	91.8	Very high	62 Å²	62	61.7 Å²	61.7	38%	0.376	28%	0.279	S	S	.	.			trans	-124.7	77.7	175.3	-172.2	0	0	0	0	107	K972 R973 S974 V1073	V970-K972 PolarHBondContact O-N 3.37Å; V970-R973 HydrophobicContact CG1-CB 4.4Å; V970-R973 HydrophobicContact CG1-CG 4.4Å; V970-R973 PolarHBondContact O-N 2.88Å; V970-S974 PolarHBondContact O-N 2.93Å; V970-V1073 HydrophobicContact CG2-CB 4.4Å
971	P	94.8	Very high	91.8	Very high	4 Å²	4	57 Å²	57	3%	0.026	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-26.6	-162.4	-30.6	40.4	0	0	0	115.1	T969 R973 S974 I1031 Y1033 I1058 V1072 V1073	T969-P971 HydrophobicContact CG2-CG 4Å; P971-R973 VanDerWaalsContact C-N 3.35Å; P971-S974 WeakPolarHBondContact CA-O 3.46Å; P971-I1031 HydrophobicContact CB-CG2 3.85Å; P971-I1031 HydrophobicContact CG-CG2 3.91Å; P971-Y1033 HydrophobicContact CB-CD2 3.49Å; P971-Y1033 VanDerWaalsContact CB-CD2 3.49Å; P971-Y1033 HydrophobicContact CB-CE2 4.18Å; P971-Y1033 HydrophobicContact CB-CG 4.08Å; P971-I1058 HydrophobicContact CB-CG2 4.14Å; P971-I1058 HydrophobicContact CG-CD1 4.4Å; P971-I1058 HydrophobicContact CG-CG2 3.87Å; P971-V1072 HydrophobicContact CG-CG1 3.91Å; P971-V1073 WeakPolarHBondContact CD-O 3.47Å
972	K	92.5	Very high	91.8	Very high	103 Å²	103	57.4 Å²	57.4	45%	0.448	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-25.2	175.5	-168.5	-176.6	170.6	-165.7	0	113.8	V970 Y1033 Q1075	V970-K972 PolarHBondContact O-N 3.37Å; K972-Y1033 HydrophobicContact CB-CE1 4.32Å; K972-Y1033 HydrophobicContact CB-CE2 4.3Å; K972-Y1033 HydrophobicContact CG-CE1 4.33Å; K972-Q1075 HydrophobicContact CD-CG 4.19Å
973	R	92.4	Very high	92	Very high	189 Å²	189	49.4 Å²	49.4	71%	0.713	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.6	-26.3	175.2	-64.6	-164.4	82.7	168.3	10	113.7	V970 P971	V970-R973 HydrophobicContact CG1-CB 4.4Å; V970-R973 HydrophobicContact CG1-CG 4.4Å; V970-R973 PolarHBondContact O-N 2.88Å; P971-R973 VanDerWaalsContact C-N 3.35Å
974	S	92.2	Very high	92.1	Very high	26 Å²	26	51.1 Å²	51.1	18%	0.182	23%	0.23	C	C	.	.			trans	-158.3	132.8	179.9	175.2	0	0	0	0	111.5	V970 P971 Y976 Y978	V970-S974 PolarHBondContact O-N 2.93Å; P971-S974 WeakPolarHBondContact CA-O 3.46Å; S974-Y976 PolarHBondContact O-N 3.07Å; S974-Y976 PolarHBondContact OG-N 3.18Å; S974-Y978 PolarHBondContact OG-OH 3.34Å
975	L	94.4	Very high	92.3	Very high	96 Å²	96	45.3 Å²	45.3	50%	0.503	21%	0.208	S	C	.	.	S	Bend	trans	-79	5.6	175.9	-61.9	179.8	0	0	0	113.7	I1031	L975-I1031 HydrophobicContact CD2-CG2 4.37Å; L975-I1031 VanDerWaalsContact O-CD1 3.3Å; L975-I1031 WeakPolarHBondContact O-CD1 3.37Å
976	Y	93	Very high	92.3	Very high	122 Å²	122	48.2 Å²	48.2	48%	0.478	23%	0.228	S	C	.	.	S	Bend	trans	-90.8	150.7	173.3	-65.8	-79.8	0	0	0	111.7	T969 S974 A1025 I1031	T969-Y976 WeakPolarHBondContact CB-O 3.5Å; T969-Y976 PolarHBondContact OG1-O 3.37Å; S974-Y976 PolarHBondContact O-N 3.07Å; S974-Y976 PolarHBondContact OG-N 3.18Å; Y976-A1025 HydrophobicContact CD1-CB 4.23Å; Y976-A1025 HydrophobicContact CG-CB 4.18Å; Y976-I1031 VanDerWaalsContact C-CD1 3.49Å
977	A	93.6	Very high	92.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	145.7	157.1	0	0	0	0	0	108.7	V968 A1025 E1026 I1029 I1031 L1070	V968-A977 CarbonylContact O-C 3.53Å; A977-A1025 CarbonylContact O-C 3.52Å; A977-A1025 WeakPolarHBondContact O-CA 3.42Å; A977-E1026 PolarHBondContact O-N 3.44Å; A977-I1029 HydrophobicContact CB-CB 3.81Å; A977-I1029 HydrophobicContact CB-CD1 3.83Å; A977-I1029 HydrophobicContact CB-CG1 4.34Å; A977-I1029 HydrophobicContact CB-CG2 3.96Å; A977-I1031 HydrophobicContact CB-CD1 4.05Å; A977-L1070 HydrophobicContact CB-CD1 4.05Å
978	Y	91	Very high	91.5	Very high	91 Å²	91	56.2 Å²	56.2	36%	0.357	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	135.3	178.2	-63.5	-96.9	0	0	0	109	Y967 V968 S974 G1024 A1025	Y967-Y978 CarbonylContact C-O 3.55Å; Y967-Y978 WeakPolarHBondContact CA-O 3.22Å; V968-Y978 PolarHBondContact N-O 3.37Å; V968-Y978 PolarHBondContact O-N 3.35Å; S974-Y978 PolarHBondContact OG-OH 3.34Å; Y978-G1024 VanDerWaalsContact CA-O 3.29Å; Y978-G1024 WeakPolarHBondContact CA-O 3.33Å; Y978-A1025 HydrophobicContact CD1-CB 4.12Å; Y978-A1025 HydrophobicContact CE1-CB 3.93Å
979	L	88.2	Confident	90.7	Very high	22 Å²	22	60.6 Å²	60.6	12%	0.115	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	129.6	174.1	178.5	62.1	0	0	0	109.1	Y965 Y967 L1023 G1024	Y965-L979 HydrophobicContact CD1-CD1 4.17Å; Y967-L979 HydrophobicContact CD1-CB 4.08Å; Y967-L979 HydrophobicContact CD1-CD1 4.09Å; Y967-L979 HydrophobicContact CE1-CB 3.89Å; Y967-L979 HydrophobicContact CE1-CD1 3.78Å; Y967-L979 HydrophobicContact CE1-CG 4.35Å; Y967-L979 HydrophobicContact CE2-CD1 4.34Å; L979-L1023 HydrophobicContact CB-CB 4.15Å; L979-L1023 HydrophobicContact CD2-CB 4.13Å; L979-L1023 HydrophobicContact CD2-CD1 3.95Å; L979-L1023 HydrophobicContact CG-CB 4.07Å; L979-L1023 HydrophobicContact CG-CD1 3.93Å; L979-L1023 HydrophobicContact CG-CG 4.42Å; L979-L1023 WeakPolarHBondContact O-CB 3.37Å; L979-L1023 PolarHBondContact O-N 2.96Å; L979-G1024 PolarHBondContact N-O 3.05Å
980	K	89.7	Confident	90.3	Very high	26 Å²	26	62.3 Å²	62.3	11%	0.113	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	123.1	178.7	176.3	-178.2	173.4	-102.8	0	109.6	Y965 E966 V968 T982 N1020	Y965-K980 WeakPolarHBondContact CA-O 3.31Å; E966-K980 HydrophobicContact CG-CB 4.3Å; E966-K980 HydrophobicContact CG-CD 4.29Å; E966-K980 HydrophobicContact CG-CG 4.46Å; E966-K980 PolarHBondContact N-O 3.26Å; E966-K980 WeakPolarHBondContact O-CA 3.33Å; E966-K980 WeakPolarHBondContact O-CB 3.5Å; E966-K980 PolarHBondContact O-N 3.4Å; E966-K980 VanDerWaalsContact O-O 3.14Å; E966-K980 IonicContact OE1-NZ 2.75Å; E966-K980 PolarHBondContact OE1-NZ 3Å; V968-K980 HydrophobicContact CG2-CB 4.08Å; V968-K980 HydrophobicContact CG2-CD 3.79Å; K980-T982 PolarHBondContact NZ-OG1 3.24Å; K980-N1020 WeakPolarHBondContact CE-OD1 3.5Å; K980-N1020 PolarHBondContact NZ-OD1 3.31Å
981	A	89.1	Confident	89.9	Confident	2 Å²	2	59.5 Å²	59.5	2%	0.017	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	134.4	164.4	0	0	0	0	0	109.6	M591 P963 Y965 N1020 C1021 L1023	M591-A981 HydrophobicContact SD-CB 4.22Å; P963-A981 HydrophobicContact CB-CB 3.91Å; P963-A981 HydrophobicContact CG-CB 4.43Å; Y965-A981 HydrophobicContact CD1-CB 4.07Å; Y965-A981 HydrophobicContact CE1-CB 3.93Å; A981-N1020 CarbonylContact O-C 3.59Å; A981-N1020 WeakPolarHBondContact O-CA 3.36Å; A981-C1021 HydrophobicContact CB-CB 4.45Å; A981-C1021 PolarHBondContact N-O 3.47Å; A981-C1021 PolarHBondContact O-N 2.87Å; A981-L1023 HydrophobicContact CB-CD1 3.56Å; A981-L1023 HydrophobicContact CB-CD2 4.35Å; A981-L1023 HydrophobicContact CB-CG 4.19Å
982	T	91.6	Very high	89.8	Confident	15 Å²	15	60.6 Å²	60.6	9%	0.092	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	118.9	170.7	-49.9	0	0	0	0	107.9	P963 R964 K980 E1018 F1019 N1020	P963-T982 CarbonylContact C-O 3.56Å; P963-T982 VanDerWaalsContact CA-O 3.25Å; P963-T982 WeakPolarHBondContact CA-O 3.24Å; R964-T982 PolarHBondContact N-O 2.7Å; R964-T982 PolarHBondContact O-N 2.79Å; K980-T982 PolarHBondContact NZ-OG1 3.24Å; T982-E1018 HydrophobicContact CG2-CG 3.71Å; T982-F1019 WeakPolarHBondContact CA-O 3.3Å; T982-N1020 PolarHBondContact OG1-OD1 3.34Å
983	A	91.8	Very high	89.8	Confident	4 Å²	4	58.6 Å²	58.6	3%	0.033	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	159	-176.2	0	0	0	0	0	111	M591 L961 P963 E1018 F1019	M591-A983 HydrophobicContact CE-CB 3.79Å; L961-A983 HydrophobicContact CD1-CB 4.29Å; P963-A983 HydrophobicContact CB-CB 4.21Å; A983-E1018 CarbonylContact O-C 3.6Å; A983-E1018 WeakPolarHBondContact O-CA 3.35Å; A983-F1019 HydrophobicContact CB-CD1 4.31Å; A983-F1019 HydrophobicContact CB-CE1 3.74Å; A983-F1019 HydrophobicContact CB-CE2 4.39Å; A983-F1019 HydrophobicContact CB-CZ 3.8Å; A983-F1019 PolarHBondContact N-O 2.98Å; A983-F1019 VanDerWaalsContact O-CD1 3.26Å; A983-F1019 WeakPolarHBondContact O-CD1 3.29Å; A983-F1019 PolarHBondContact O-N 2.9Å
984	V	92.9	Very high	89.8	Confident	51 Å²	51	50 Å²	50	31%	0.309	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	136.4	168.7	-178	0	0	0	0	107.9	N986 E1017 E1018	V984-N986 VanDerWaalsContact C-N 3.27Å; V984-N986 WeakPolarHBondContact CG1-OD1 3.5Å; V984-N986 PolarHBondContact O-N 2.94Å; V984-E1017 WeakPolarHBondContact CA-O 3.17Å; V984-E1018 HydrophobicContact CG2-CB 4.37Å
985	N	92.2	Very high	89.9	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.275	C	S	.	.			trans	-71.8	84.1	173	179.6	11.7	0	0	0	110.2	T987 F989 I991 V1013 A1014 G1016 E1017 F1019	N985-T987 PolarHBondContact O-N 3.07Å; N985-T987 VanDerWaalsContact O-N 3.13Å; N985-T987 PolarHBondContact OD1-N 3.21Å; N985-T987 PolarHBondContact OD1-OG1 3.42Å; N985-F989 PolarHBondContact ND2-O 2.76Å; N985-I991 HydrophobicContact CB-CD1 4.3Å; N985-V1013 HydrophobicContact CB-CG1 3.82Å; N985-V1013 PolarHBondContact ND2-O 2.99Å; N985-A1014 WeakPolarHBondContact CB-O 3.44Å; N985-A1014 PolarHBondContact ND2-O 3.32Å; N985-G1016 PolarHBondContact O-N 3.04Å; N985-E1017 PolarHBondContact N-O 2.88Å; N985-F1019 HydrophobicContact CB-CE1 4.29Å
986	N	88.9	Confident	89.9	Confident	126 Å²	126	48.1 Å²	48.1	67%	0.674	25%	0.252	S	S	*	.			trans	-78.5	18.3	179.7	-65.7	-25.6	0	0	0	113.4	L961 V984	L961-N986 HydrophobicContact CD2-CB 4.43Å; V984-N986 VanDerWaalsContact C-N 3.27Å; V984-N986 WeakPolarHBondContact CG1-OD1 3.5Å; V984-N986 PolarHBondContact O-N 2.94Å
987	T	84.3	Confident	89.9	Confident	31 Å²	31	44 Å²	44	19%	0.19	24%	0.238	C	C	.	.	S	Bend	trans	-108.1	160	-180	80.3	0	0	0	0	111.3	L959 N985 F989 P1015	L959-T987 HydrophobicContact CB-CG2 4.15Å; L959-T987 HydrophobicContact CD2-CG2 3.86Å; L959-T987 HydrophobicContact CG-CG2 3.97Å; N985-T987 PolarHBondContact O-N 3.07Å; N985-T987 VanDerWaalsContact O-N 3.13Å; N985-T987 PolarHBondContact OD1-N 3.21Å; N985-T987 PolarHBondContact OD1-OG1 3.42Å; T987-F989 PolarHBondContact O-N 3.09Å; T987-F989 PolarHBondContact OG1-N 3.48Å; T987-F989 PolarHBondContact OG1-O 3.49Å; T987-P1015 WeakPolarHBondContact O-CB 3.25Å
988	E	81.1	Confident	89.8	Confident	186 Å²	186	44.1 Å²	44.1	87%	0.869	24%	0.239	S	C	*	.	S	Bend	trans	-73.6	-6.1	176.5	-58.7	-174.9	151.2	0	0	112.9
989	F	78.7	Confident	89.8	Confident	116 Å²	116	41.9 Å²	41.9	51%	0.509	23%	0.23	S	C	.	.	S	Bend	trans	-97.5	134.2	-176.8	-51.9	-76.6	0	0	0	111.6	L936 N985 T987 I991	L936-F989 HydrophobicContact CD2-CD1 4.23Å; N985-F989 PolarHBondContact ND2-O 2.76Å; T987-F989 PolarHBondContact O-N 3.09Å; T987-F989 PolarHBondContact OG1-N 3.48Å; T987-F989 PolarHBondContact OG1-O 3.49Å; F989-I991 PolarHBondContact O-N 3.19Å
990	S	86.6	Confident	89.6	Confident	36 Å²	36	41.6 Å²	41.6	25%	0.252	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-68.5	125.5	162.4	-58.8	0	0	0	0	109.8
991	I	89.8	Confident	89.3	Confident	4 Å²	4	43.7 Å²	43.7	2%	0.021	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-74.2	131.2	168.1	-58.6	172.4	0	0	0	106.9	Y580 L959 N985 F989 I1010 A1012 V1013 F1019	Y580-I991 HydrophobicContact CE1-CG2 3.96Å; Y580-I991 HydrophobicContact CE2-CG2 4.45Å; L959-I991 HydrophobicContact CD2-CD1 3.97Å; L959-I991 HydrophobicContact CD2-CG1 3.96Å; N985-I991 HydrophobicContact CB-CD1 4.3Å; F989-I991 PolarHBondContact O-N 3.19Å; I991-I1010 HydrophobicContact CD1-CD1 4.41Å; I991-I1010 HydrophobicContact CG2-CD1 3.87Å; I991-I1010 HydrophobicContact CG2-CG1 4.17Å; I991-I1010 HydrophobicContact CG2-CG2 4.1Å; I991-A1012 CarbonylContact O-C 3.57Å; I991-A1012 VanDerWaalsContact O-CA 3.3Å; I991-A1012 WeakPolarHBondContact O-CA 3.32Å; I991-V1013 HydrophobicContact CB-CB 4.1Å; I991-V1013 HydrophobicContact CD1-CB 4.38Å; I991-V1013 PolarHBondContact N-O 3.22Å; I991-V1013 PolarHBondContact O-N 2.63Å; I991-F1019 HydrophobicContact CD1-CE1 4.27Å; I991-F1019 HydrophobicContact CD1-CZ 4.12Å
992	L	91.4	Very high	89.1	Confident	27 Å²	27	48.2 Å²	48.2	14%	0.141	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-87.5	153.1	175.8	-63.9	-177.9	0	0	0	110.5	W576 P578 Y580 Y595 T616 I934 G994	W576-L992 HydrophobicContact CH2-CD1 3.54Å; W576-L992 HydrophobicContact CZ2-CD1 4.24Å; W576-L992 HydrophobicContact CZ3-CD1 4.31Å; P578-L992 HydrophobicContact CB-CB 3.97Å; P578-L992 HydrophobicContact CB-CD1 4.31Å; P578-L992 HydrophobicContact CG-CB 3.9Å; P578-L992 HydrophobicContact CG-CD1 4.3Å; Y580-L992 WeakPolarHBondContact CE2-O 3.33Å; Y580-L992 PolarHBondContact OH-N 3.19Å; Y580-L992 VanDerWaalsContact OH-N 3.09Å; Y580-L992 PolarHBondContact OH-O 3.08Å; Y580-L992 VanDerWaalsContact OH-O 3.07Å; Y595-L992 WeakPolarHBondContact OH-CD1 3.4Å; T616-L992 HydrophobicContact CG2-CD1 3.46Å; T616-L992 VanDerWaalsContact CG2-CD1 3.46Å; T616-L992 HydrophobicContact CG2-CD2 4.1Å; T616-L992 HydrophobicContact CG2-CG 4.44Å; I934-L992 HydrophobicContact CD1-CD2 3.63Å; L992-G994 PolarHBondContact O-N 3.33Å
993	A	93.4	Very high	88.8	Confident	60 Å²	60	52.2 Å²	52.2	50%	0.496	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-62.9	135	171.3	0	0	0	0	0	110.5	P578 I1010 A1012	P578-A993 WeakPolarHBondContact CG-O 3.48Å; A993-I1010 CarbonylContact C-O 3.6Å; A993-I1010 VanDerWaalsContact CA-O 3.24Å; A993-I1010 WeakPolarHBondContact CA-O 3.42Å; A993-A1012 HydrophobicContact CB-CB 4.42Å
994	G	92.6	Very high	88.7	Confident	10 Å²	10	56.9 Å²	56.9	10%	0.103	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.5	167	178.7	0	0	0	0	0	116.2	L992 T996 I1010	L992-G994 PolarHBondContact O-N 3.33Å; G994-T996 PolarHBondContact O-OG1 2.92Å; G994-I1010 PolarHBondContact N-O 2.78Å; G994-I1010 PolarHBondContact O-N 2.71Å
995	P	94.4	Very high	88.2	Confident	78 Å²	78	58.2 Å²	58.2	51%	0.506	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	143.4	179.5	28.5	-36.2	0	0	0	111.8	Y580	Y580-P995 PolarHBondContact N-O 3.11Å
996	T	93	Very high	88	Confident	3 Å²	3	59.2 Å²	59.2	2%	0.018	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	126.2	-171.6	-61.1	0	0	0	0	111.2	Y580 I582 G994 I998 K1007 S1008 I1010	Y580-T996 CarbonylContact O-C 3.57Å; Y580-T996 WeakPolarHBondContact O-CA 3.45Å; I582-T996 HydrophobicContact CB-CG2 4.26Å; I582-T996 HydrophobicContact CD1-CG2 3.61Å; I582-T996 HydrophobicContact CG1-CG2 3.59Å; G994-T996 PolarHBondContact O-OG1 2.92Å; T996-I998 HydrophobicContact CG2-CG1 4.21Å; T996-K1007 CarbonylContact O-C 2.98Å; T996-K1007 WeakPolarHBondContact O-CA 3.18Å; T996-S1008 WeakPolarHBondContact CA-O 3.33Å; T996-S1008 WeakPolarHBondContact CB-O 3.48Å; T996-S1008 PolarHBondContact N-O 3.05Å; T996-S1008 PolarHBondContact O-N 3.06Å; T996-I1010 PolarHBondContact OG1-N 2.72Å
997	N	93.8	Very high	88	Confident	35 Å²	35	61.5 Å²	61.5	19%	0.187	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	141.2	166.2	-55.1	-61.5	0	0	0	109.5	Y580 D581 I582 Y999 F1004	Y580-N997 PolarHBondContact O-N 3.36Å; D581-N997 CarbonylContact C-O 3.57Å; D581-N997 WeakPolarHBondContact CA-O 3.44Å; D581-N997 WeakPolarHBondContact OD1-CB 3.24Å; D581-N997 PolarHBondContact OD1-ND2 2.81Å; I582-N997 PolarHBondContact N-O 2.94Å; N997-Y999 HydrophobicContact CB-CE2 3.75Å; N997-F1004 HydrophobicContact CB-CD2 4.49Å; N997-F1004 HydrophobicContact CB-CE2 4.07Å
998	I	91.3	Very high	88.3	Confident	4 Å²	4	61.8 Å²	61.8	2%	0.021	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	130	-177.9	-60.2	179.2	0	0	0	109.9	I584 T996 I1005 G1006 H1022 L1023	I584-I998 HydrophobicContact CD1-CG2 3.95Å; T996-I998 HydrophobicContact CG2-CG1 4.21Å; I998-I1005 HydrophobicContact CG2-CD1 4.3Å; I998-I1005 PolarHBondContact O-N 3.45Å; I998-G1006 PolarHBondContact N-O 3.2Å; I998-H1022 WeakPolarHBondContact CD1-O 3.35Å; I998-L1023 HydrophobicContact CD1-CD2 4.06Å; I998-L1023 HydrophobicContact CG2-CB 4.44Å; I998-L1023 HydrophobicContact CG2-CD2 4.17Å
999	Y	90.7	Very high	88.7	Confident	44 Å²	44	60.1 Å²	60.1	17%	0.173	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	139.8	176.4	-55.3	-101	0	0	0	110.3	D581 I582 R583 I584 N997 T1003 F1004	D581-Y999 HydrophobicContact CB-CD2 4.4Å; D581-Y999 HydrophobicContact CB-CE2 3.94Å; I582-Y999 PolarHBondContact O-N 3.44Å; R583-Y999 WeakPolarHBondContact CA-O 3.42Å; R583-Y999 HydrophobicContact CG-CD2 4.31Å; I584-Y999 PolarHBondContact N-O 3.37Å; N997-Y999 HydrophobicContact CB-CE2 3.75Å; Y999-T1003 CarbonylContact C-O 3.54Å; Y999-T1003 WeakPolarHBondContact CA-O 3.34Å; Y999-F1004 HydrophobicContact CD1-CB 3.85Å; Y999-F1004 HydrophobicContact CD1-CD2 4.44Å; Y999-F1004 HydrophobicContact CE1-CB 3.76Å; Y999-F1004 HydrophobicContact CE1-CD2 4.02Å; Y999-F1004 HydrophobicContact CE1-CG 4.37Å; Y999-F1004 HydrophobicContact CE2-CD2 4.5Å
1000	A	84.8	Confident	89.2	Confident	16 Å²	16	54.9 Å²	54.9	13%	0.132	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	134.1	163.2	0	0	0	0	0	110.5	I584 N1002 T1003 I1005	I584-A1000 HydrophobicContact CB-CB 3.99Å; I584-A1000 HydrophobicContact CD1-CB 4.27Å; I584-A1000 HydrophobicContact CG2-CB 4.21Å; I584-A1000 WeakPolarHBondContact O-CA 3.39Å; A1000-N1002 PolarHBondContact O-N 2.95Å; A1000-N1002 VanDerWaalsContact O-N 3.1Å; A1000-T1003 PolarHBondContact N-O 3.1Å; A1000-T1003 WeakPolarHBondContact O-CB 3.4Å; A1000-T1003 PolarHBondContact O-N 3.08Å; A1000-I1005 HydrophobicContact CB-CD1 3.47Å; A1000-I1005 VanDerWaalsContact CB-CD1 3.47Å; A1000-I1005 HydrophobicContact CB-CG1 4.41Å
1001	D	83	Confident	89.5	Confident	70 Å²	70	59.1 Å²	59.1	37%	0.374	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	39.5	-175.2	-54.4	-39.6	0	0	0	112.1	I584 N586 T1003	I584-D1001 PolarHBondContact O-N 3.18Å; N586-D1001 WeakPolarHBondContact CB-OD2 3.29Å; N586-D1001 PolarHBondContact N-OD1 3.44Å; N586-D1001 PolarHBondContact ND2-OD2 2.8Å; D1001-T1003 VanDerWaalsContact C-N 3.26Å; D1001-T1003 PolarHBondContact O-N 2.91Å
1002	N	84.2	Confident	89.6	Confident	97 Å²	97	61.8 Å²	61.8	52%	0.519	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	-2.9	-172.5	-62.3	-53.1	0	0	0	118	R583 A1000	R583-N1002 PolarHBondContact NH1-OD1 3.22Å; A1000-N1002 PolarHBondContact O-N 2.95Å; A1000-N1002 VanDerWaalsContact O-N 3.1Å
1003	T	86.5	Confident	89.7	Confident	99 Å²	99	60.6 Å²	60.6	61%	0.607	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	130.7	171.2	-57.5	0	0	0	0	110.3	Y999 A1000 D1001	Y999-T1003 CarbonylContact C-O 3.54Å; Y999-T1003 WeakPolarHBondContact CA-O 3.34Å; A1000-T1003 PolarHBondContact N-O 3.1Å; A1000-T1003 WeakPolarHBondContact O-CB 3.4Å; A1000-T1003 PolarHBondContact O-N 3.08Å; D1001-T1003 VanDerWaalsContact C-N 3.26Å; D1001-T1003 PolarHBondContact O-N 2.91Å
1004	F	88.9	Confident	89.6	Confident	102 Å²	102	59.8 Å²	59.8	45%	0.447	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	127.9	174.6	174.8	-100.8	0	0	0	110.6	N997 Y999 G1006 K1007	N997-F1004 HydrophobicContact CB-CD2 4.49Å; N997-F1004 HydrophobicContact CB-CE2 4.07Å; Y999-F1004 HydrophobicContact CD1-CB 3.85Å; Y999-F1004 HydrophobicContact CD1-CD2 4.44Å; Y999-F1004 HydrophobicContact CE1-CB 3.76Å; Y999-F1004 HydrophobicContact CE1-CD2 4.02Å; Y999-F1004 HydrophobicContact CE1-CG 4.37Å; Y999-F1004 HydrophobicContact CE2-CD2 4.5Å; F1004-G1006 WeakPolarHBondContact CE2-O 3.39Å; F1004-G1006 VanDerWaalsContact CZ-C 3.46Å; F1004-G1006 VanDerWaalsContact CZ-CA 3.5Å; F1004-G1006 WeakPolarHBondContact CZ-O 3.27Å; F1004-K1007 HydrophobicContact CZ-CG 4.1Å
1005	I	83.8	Confident	89.5	Confident	78 Å²	78	62.4 Å²	62.4	40%	0.4	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	-37.2	178.5	-58.4	164.1	0	0	0	111.3	I998 A1000 L1023	I998-I1005 HydrophobicContact CG2-CD1 4.3Å; I998-I1005 PolarHBondContact O-N 3.45Å; A1000-I1005 HydrophobicContact CB-CD1 3.47Å; A1000-I1005 VanDerWaalsContact CB-CD1 3.47Å; A1000-I1005 HydrophobicContact CB-CG1 4.41Å; I1005-L1023 WeakPolarHBondContact CG2-O 3.25Å
1006	G	86.5	Confident	89.4	Confident	21 Å²	21	61.4 Å²	61.4	22%	0.216	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.5	-169.4	-176.2	0	0	0	0	0	114.4	I998 F1004	I998-G1006 PolarHBondContact N-O 3.2Å; F1004-G1006 WeakPolarHBondContact CE2-O 3.39Å; F1004-G1006 VanDerWaalsContact CZ-C 3.46Å; F1004-G1006 VanDerWaalsContact CZ-CA 3.5Å; F1004-G1006 WeakPolarHBondContact CZ-O 3.27Å
1007	K	90.2	Very high	89.4	Confident	174 Å²	174	64.2 Å²	64.2	76%	0.757	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.8	153.1	176.4	-61.2	-179	-178.2	174.1	0	110.6	T996 F1004	T996-K1007 CarbonylContact O-C 2.98Å; T996-K1007 WeakPolarHBondContact O-CA 3.18Å; F1004-K1007 HydrophobicContact CZ-CG 4.1Å
1008	S	88.8	Confident	89.4	Confident	37 Å²	37	67.2 Å²	67.2	26%	0.259	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	-175.5	172.4	-158.3	0	0	0	0	109.2	T996	T996-S1008 WeakPolarHBondContact CA-O 3.33Å; T996-S1008 WeakPolarHBondContact CB-O 3.48Å; T996-S1008 PolarHBondContact N-O 3.05Å; T996-S1008 PolarHBondContact O-N 3.06Å
1009	E	90.3	Very high	89.4	Confident	151 Å²	151	67.1 Å²	67.1	71%	0.706	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.8	141.1	170.3	-62.5	-167.8	153.1	0	0	109.7
1010	I	90.3	Very high	89.3	Confident	7 Å²	7	68 Å²	68	4%	0.036	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	136.6	165.2	-162.5	159.4	0	0	0	107.8	Y580 I593 I991 A993 G994 T996 F1019	Y580-I1010 HydrophobicContact CD2-CG2 3.37Å; Y580-I1010 HydrophobicContact CE2-CG2 3.36Å; Y580-I1010 HydrophobicContact CG-CG2 4.11Å; I593-I1010 HydrophobicContact CD1-CD1 4.28Å; I991-I1010 HydrophobicContact CD1-CD1 4.41Å; I991-I1010 HydrophobicContact CG2-CD1 3.87Å; I991-I1010 HydrophobicContact CG2-CG1 4.17Å; I991-I1010 HydrophobicContact CG2-CG2 4.1Å; A993-I1010 CarbonylContact C-O 3.6Å; A993-I1010 VanDerWaalsContact CA-O 3.24Å; A993-I1010 WeakPolarHBondContact CA-O 3.42Å; G994-I1010 PolarHBondContact N-O 2.78Å; G994-I1010 PolarHBondContact O-N 2.71Å; T996-I1010 PolarHBondContact OG1-N 2.72Å; I1010-F1019 HydrophobicContact CD1-CD2 3.99Å; I1010-F1019 HydrophobicContact CD1-CE2 3.62Å; I1010-F1019 HydrophobicContact CD1-CZ 4.44Å; I1010-F1019 HydrophobicContact CG1-CD2 4.36Å; I1010-F1019 HydrophobicContact CG1-CE2 4.47Å
1011	R	92.3	Very high	89.3	Confident	125 Å²	125	67.6 Å²	67.6	47%	0.472	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-74.6	172.4	172.1	68.3	168.1	-163.7	-125.8	-0.6	110.5	V1013 E1017 E1018	R1011-V1013 HydrophobicContact CG-CG2 3.89Å; R1011-V1013 PolarHBondContact O-N 3.3Å; R1011-E1017 IonicContact CZ-OE1 3.43Å; R1011-E1017 VanDerWaalsContact CZ-OE1 3.31Å; R1011-E1017 IonicContact NE-OE1 2.76Å; R1011-E1017 PolarHBondContact NE-OE1 3.44Å; R1011-E1017 VanDerWaalsContact NE-OE1 3.14Å; R1011-E1017 IonicContact NH2-OE1 2.77Å; R1011-E1017 PolarHBondContact NH2-OE1 2.85Å; R1011-E1018 PolarHBondContact NH2-O 2.85Å
1012	A	92.3	Very high	89.3	Confident	59 Å²	59	69.5 Å²	69.5	49%	0.488	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-65.4	133.6	163.6	0	0	0	0	0	109.6	I991 A993	I991-A1012 CarbonylContact O-C 3.57Å; I991-A1012 VanDerWaalsContact O-CA 3.3Å; I991-A1012 WeakPolarHBondContact O-CA 3.32Å; A993-A1012 HydrophobicContact CB-CB 4.42Å
1013	V	92.1	Very high	89.3	Confident	2 Å²	2	65 Å²	65	1%	0.012	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-137.1	116.2	-177.6	-173.6	0	0	0	0	109.5	N985 I991 R1011 E1017 F1019	N985-V1013 HydrophobicContact CB-CG1 3.82Å; N985-V1013 PolarHBondContact ND2-O 2.99Å; I991-V1013 HydrophobicContact CB-CB 4.1Å; I991-V1013 HydrophobicContact CD1-CB 4.38Å; I991-V1013 PolarHBondContact N-O 3.22Å; I991-V1013 PolarHBondContact O-N 2.63Å; R1011-V1013 HydrophobicContact CG-CG2 3.89Å; R1011-V1013 PolarHBondContact O-N 3.3Å; V1013-E1017 WeakPolarHBondContact CA-OE2 3.47Å; V1013-E1017 HydrophobicContact CG1-CB 3.71Å; V1013-E1017 HydrophobicContact CG1-CG 4.09Å; V1013-F1019 HydrophobicContact CB-CB 4.47Å; V1013-F1019 HydrophobicContact CG1-CB 3.96Å; V1013-F1019 HydrophobicContact CG1-CD1 3.7Å; V1013-F1019 HydrophobicContact CG1-CE1 4.47Å; V1013-F1019 HydrophobicContact CG1-CG 4.06Å; V1013-F1019 HydrophobicContact CG2-CB 3.59Å; V1013-F1019 HydrophobicContact CG2-CD1 4.28Å; V1013-F1019 HydrophobicContact CG2-CD2 4.32Å; V1013-F1019 HydrophobicContact CG2-CG 3.84Å
1014	A	91.7	Very high	89	Confident	44 Å²	44	61.6 Å²	61.6	36%	0.364	34%	0.338	S	S	.	.			trans	-70.9	159.1	177.8	0	0	0	0	0	112.3	N985 G1016 E1017	N985-A1014 WeakPolarHBondContact CB-O 3.44Å; N985-A1014 PolarHBondContact ND2-O 3.32Å; A1014-G1016 PolarHBondContact O-N 3.08Å; A1014-E1017 HydrophobicContact CB-CB 4.4Å; A1014-E1017 PolarHBondContact N-OE2 2.92Å; A1014-E1017 VanDerWaalsContact O-CB 3.28Å; A1014-E1017 WeakPolarHBondContact O-CB 3.37Å; A1014-E1017 PolarHBondContact O-N 3.31Å; A1014-E1017 VanDerWaalsContact O-N 3.1Å
1015	P	91	Very high	88.8	Confident	64 Å²	64	59.3 Å²	59.3	42%	0.416	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	128.6	167.1	-30	38.5	0	0	0	111.8	T987	T987-P1015 WeakPolarHBondContact O-CB 3.25Å
1016	G	92.2	Very high	88.8	Confident	58 Å²	58	57.6 Å²	57.6	60%	0.598	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.2	0.8	-177.7	0	0	0	0	0	116.3	N985 A1014	N985-G1016 PolarHBondContact O-N 3.04Å; A1014-G1016 PolarHBondContact O-N 3.08Å
1017	E	93.2	Very high	88.7	Confident	61 Å²	61	61.3 Å²	61.3	29%	0.285	34%	0.344	S	S	.	.			trans	-85	140.4	-179.6	-172.2	-166.1	141.4	0	0	112.7	V984 N985 R1011 V1013 A1014	V984-E1017 WeakPolarHBondContact CA-O 3.17Å; N985-E1017 PolarHBondContact N-O 2.88Å; R1011-E1017 IonicContact CZ-OE1 3.43Å; R1011-E1017 VanDerWaalsContact CZ-OE1 3.31Å; R1011-E1017 IonicContact NE-OE1 2.76Å; R1011-E1017 PolarHBondContact NE-OE1 3.44Å; R1011-E1017 VanDerWaalsContact NE-OE1 3.14Å; R1011-E1017 IonicContact NH2-OE1 2.77Å; R1011-E1017 PolarHBondContact NH2-OE1 2.85Å; V1013-E1017 WeakPolarHBondContact CA-OE2 3.47Å; V1013-E1017 HydrophobicContact CG1-CB 3.71Å; V1013-E1017 HydrophobicContact CG1-CG 4.09Å; A1014-E1017 HydrophobicContact CB-CB 4.4Å; A1014-E1017 PolarHBondContact N-OE2 2.92Å; A1014-E1017 VanDerWaalsContact O-CB 3.28Å; A1014-E1017 WeakPolarHBondContact O-CB 3.37Å; A1014-E1017 PolarHBondContact O-N 3.31Å; A1014-E1017 VanDerWaalsContact O-N 3.1Å
1018	E	93.1	Very high	88.6	Confident	99 Å²	99	53.4 Å²	53.4	46%	0.463	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	124.1	173.1	-176.3	179.2	129.3	0	0	110.8	T982 A983 V984 R1011 K1101	T982-E1018 HydrophobicContact CG2-CG 3.71Å; A983-E1018 CarbonylContact O-C 3.6Å; A983-E1018 WeakPolarHBondContact O-CA 3.35Å; V984-E1018 HydrophobicContact CG2-CB 4.37Å; R1011-E1018 PolarHBondContact NH2-O 2.85Å; E1018-K1101 IonicContact OE1-NZ 3.29Å; E1018-K1101 PolarHBondContact OE1-NZ 2.87Å
1019	F	91.6	Very high	88.9	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.009	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	159.4	-179.8	71.7	-79.3	0	0	0	112.4	I593 L961 T982 A983 N985 I991 I1010 V1013	I593-F1019 HydrophobicContact CD1-CE2 4.05Å; I593-F1019 HydrophobicContact CD1-CZ 3.85Å; L961-F1019 HydrophobicContact CD1-CE1 4.08Å; L961-F1019 HydrophobicContact CD1-CZ 3.72Å; T982-F1019 WeakPolarHBondContact CA-O 3.3Å; A983-F1019 HydrophobicContact CB-CD1 4.31Å; A983-F1019 HydrophobicContact CB-CE1 3.74Å; A983-F1019 HydrophobicContact CB-CE2 4.39Å; A983-F1019 HydrophobicContact CB-CZ 3.8Å; A983-F1019 PolarHBondContact N-O 2.98Å; A983-F1019 VanDerWaalsContact O-CD1 3.26Å; A983-F1019 WeakPolarHBondContact O-CD1 3.29Å; A983-F1019 PolarHBondContact O-N 2.9Å; N985-F1019 HydrophobicContact CB-CE1 4.29Å; I991-F1019 HydrophobicContact CD1-CE1 4.27Å; I991-F1019 HydrophobicContact CD1-CZ 4.12Å; I1010-F1019 HydrophobicContact CD1-CD2 3.99Å; I1010-F1019 HydrophobicContact CD1-CE2 3.62Å; I1010-F1019 HydrophobicContact CD1-CZ 4.44Å; I1010-F1019 HydrophobicContact CG1-CD2 4.36Å; I1010-F1019 HydrophobicContact CG1-CE2 4.47Å; V1013-F1019 HydrophobicContact CB-CB 4.47Å; V1013-F1019 HydrophobicContact CG1-CB 3.96Å; V1013-F1019 HydrophobicContact CG1-CD1 3.7Å; V1013-F1019 HydrophobicContact CG1-CE1 4.47Å; V1013-F1019 HydrophobicContact CG1-CG 4.06Å; V1013-F1019 HydrophobicContact CG2-CB 3.59Å; V1013-F1019 HydrophobicContact CG2-CD1 4.28Å; V1013-F1019 HydrophobicContact CG2-CD2 4.32Å; V1013-F1019 HydrophobicContact CG2-CG 3.84Å
1020	N	89.4	Confident	89.1	Confident	61 Å²	61	49.1 Å²	49.1	33%	0.326	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	139.4	-178.1	-58.7	-57.8	0	0	0	110.1	K980 A981 T982	K980-N1020 WeakPolarHBondContact CE-OD1 3.5Å; K980-N1020 PolarHBondContact NZ-OD1 3.31Å; A981-N1020 CarbonylContact O-C 3.59Å; A981-N1020 WeakPolarHBondContact O-CA 3.36Å; T982-N1020 PolarHBondContact OG1-OD1 3.34Å
1021	C	83.8	Confident	89.4	Confident	9 Å²	9	49.6 Å²	49.6	6%	0.061	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	130.9	168.1	-62.4	0	0	0	0	109.1	I582 A981 L1023	I582-C1021 HydrophobicContact CD1-CB 4.18Å; I582-C1021 VanDerWaalsContact CD1-SG 3.58Å; A981-C1021 HydrophobicContact CB-CB 4.45Å; A981-C1021 PolarHBondContact N-O 3.47Å; A981-C1021 PolarHBondContact O-N 2.87Å; C1021-L1023 HydrophobicContact CB-CD2 3.69Å
1022	H	84.2	Confident	89.6	Confident	109 Å²	109	47.6 Å²	47.6	51%	0.505	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	116.9	178.4	-54.7	107.3	0	0	0	108.5	I998	I998-H1022 WeakPolarHBondContact CD1-O 3.35Å
1023	L	82.3	Confident	89.8	Confident	4 Å²	4	47.7 Å²	47.7	2%	0.021	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	13.9	-159.6	-50.9	-178.2	0	0	0	113.8	I584 Y965 L979 A981 I998 I1005 C1021	I584-L1023 HydrophobicContact CD1-CB 4.1Å; I584-L1023 HydrophobicContact CD1-CD1 3.48Å; I584-L1023 VanDerWaalsContact CD1-CD1 3.48Å; I584-L1023 HydrophobicContact CD1-CD2 4.02Å; I584-L1023 HydrophobicContact CD1-CG 4.05Å; I584-L1023 HydrophobicContact CG1-CD1 4Å; Y965-L1023 HydrophobicContact CD1-CD1 4.05Å; Y965-L1023 HydrophobicContact CE1-CD1 3.77Å; L979-L1023 HydrophobicContact CB-CB 4.15Å; L979-L1023 HydrophobicContact CD2-CB 4.13Å; L979-L1023 HydrophobicContact CD2-CD1 3.95Å; L979-L1023 HydrophobicContact CG-CB 4.07Å; L979-L1023 HydrophobicContact CG-CD1 3.93Å; L979-L1023 HydrophobicContact CG-CG 4.42Å; L979-L1023 WeakPolarHBondContact O-CB 3.37Å; L979-L1023 PolarHBondContact O-N 2.96Å; A981-L1023 HydrophobicContact CB-CD1 3.56Å; A981-L1023 HydrophobicContact CB-CD2 4.35Å; A981-L1023 HydrophobicContact CB-CG 4.19Å; I998-L1023 HydrophobicContact CD1-CD2 4.06Å; I998-L1023 HydrophobicContact CG2-CB 4.44Å; I998-L1023 HydrophobicContact CG2-CD2 4.17Å; I1005-L1023 WeakPolarHBondContact CG2-O 3.25Å; C1021-L1023 HydrophobicContact CB-CD2 3.69Å
1024	G	81	Confident	89.8	Confident	26 Å²	26	51.8 Å²	51.8	27%	0.268	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	104.4	174.3	-177.8	0	0	0	0	0	113.9	Y978 L979	Y978-G1024 VanDerWaalsContact CA-O 3.29Å; Y978-G1024 WeakPolarHBondContact CA-O 3.33Å; L979-G1024 PolarHBondContact N-O 3.05Å
1025	A	85.6	Confident	89.7	Confident	54 Å²	54	54.7 Å²	54.7	45%	0.446	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	146.3	175.8	0	0	0	0	0	111.3	Y976 A977 Y978	Y976-A1025 HydrophobicContact CD1-CB 4.23Å; Y976-A1025 HydrophobicContact CG-CB 4.18Å; A977-A1025 CarbonylContact O-C 3.52Å; A977-A1025 WeakPolarHBondContact O-CA 3.42Å; Y978-A1025 HydrophobicContact CD1-CB 4.12Å; Y978-A1025 HydrophobicContact CE1-CB 3.93Å
1026	E	82.2	Confident	89.6	Confident	42 Å²	42	55.7 Å²	55.7	20%	0.196	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	131.1	-179.5	176.7	60.1	-98.5	0	0	110.7	Y967 A977 G1028 I1029 F1064	Y967-E1026 HydrophobicContact CD1-CB 3.95Å; Y967-E1026 HydrophobicContact CD1-CG 4.09Å; Y967-E1026 HydrophobicContact CE1-CB 3.6Å; Y967-E1026 HydrophobicContact CE1-CG 3.42Å; Y967-E1026 VanDerWaalsContact CE1-CG 3.42Å; Y967-E1026 PolarHBondContact OH-OE2 3.11Å; A977-E1026 PolarHBondContact O-N 3.44Å; E1026-G1028 PolarHBondContact OE1-N 3.07Å; E1026-I1029 HydrophobicContact CG-CG1 4.33Å; E1026-F1064 VanDerWaalsContact CD-CZ 3.4Å; E1026-F1064 HydrophobicContact CG-CE2 4.03Å; E1026-F1064 HydrophobicContact CG-CZ 3.96Å; E1026-F1064 WeakPolarHBondContact OE2-CZ 3.39Å
1027	N	84.8	Confident	89.5	Confident	99 Å²	99	58.5 Å²	58.5	53%	0.529	30%	0.302	S	S	.	.	S	Bend	trans	-89.3	-20.8	178	-88.4	-57.2	0	0	0	113.4	I1029 K1030	N1027-I1029 PolarHBondContact O-N 3.21Å; N1027-K1030 WeakPolarHBondContact O-CE 3.47Å; N1027-K1030 PolarHBondContact O-NZ 2.8Å; N1027-K1030 PolarHBondContact OD1-NZ 3.07Å
1028	G	89.4	Confident	89.4	Confident	8 Å²	8	62.9 Å²	62.9	8%	0.082	32%	0.321	C	S	.	.	S	Bend	trans	-73.6	3.3	178.4	0	0	0	0	0	116.1	E1026 T1063 F1064	E1026-G1028 PolarHBondContact OE1-N 3.07Å; G1028-T1063 VanDerWaalsContact C-OG1 3.29Å; G1028-T1063 WeakPolarHBondContact CA-OG1 3.49Å; G1028-T1063 PolarHBondContact O-N 3.22Å; G1028-T1063 PolarHBondContact O-OG1 3.42Å; G1028-F1064 WeakPolarHBondContact O-CD2 3.02Å
1029	I	93.3	Very high	89.2	Confident	3 Å²	3	62.8 Å²	62.8	2%	0.015	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	124.8	172.4	-55	177.3	0	0	0	107.5	Y967 A977 E1026 N1027 I1031 R1061 F1064 V1068 L1070	Y967-I1029 HydrophobicContact CD1-CD1 3.77Å; Y967-I1029 HydrophobicContact CD2-CD1 3.87Å; Y967-I1029 HydrophobicContact CE1-CD1 4.31Å; Y967-I1029 HydrophobicContact CE2-CD1 4.37Å; Y967-I1029 HydrophobicContact CG-CD1 3.49Å; Y967-I1029 VanDerWaalsContact CG-CD1 3.49Å; A977-I1029 HydrophobicContact CB-CB 3.81Å; A977-I1029 HydrophobicContact CB-CD1 3.83Å; A977-I1029 HydrophobicContact CB-CG1 4.34Å; A977-I1029 HydrophobicContact CB-CG2 3.96Å; E1026-I1029 HydrophobicContact CG-CG1 4.33Å; N1027-I1029 PolarHBondContact O-N 3.21Å; I1029-I1031 HydrophobicContact CG2-CD1 4.36Å; I1029-R1061 WeakPolarHBondContact CA-O 3.38Å; I1029-F1064 HydrophobicContact CG1-CE2 4.22Å; I1029-V1068 HydrophobicContact CD1-CG1 3.76Å; I1029-V1068 HydrophobicContact CG1-CG1 4.45Å; I1029-L1070 HydrophobicContact CD1-CD1 4.17Å; I1029-L1070 HydrophobicContact CG2-CD1 4.49Å; I1029-L1070 HydrophobicContact CG2-CD2 3.89Å
1030	K	96.1	Very high	88.8	Confident	96 Å²	96	69.7 Å²	69.7	42%	0.417	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	135.6	176.2	-58.7	-51.1	-172.7	-161.8	0	110.2	N1027 V1060 R1061 T1063	N1027-K1030 WeakPolarHBondContact O-CE 3.47Å; N1027-K1030 PolarHBondContact O-NZ 2.8Å; N1027-K1030 PolarHBondContact OD1-NZ 3.07Å; K1030-V1060 WeakPolarHBondContact O-CA 3.37Å; K1030-R1061 HydrophobicContact CB-CB 4.46Å; K1030-R1061 PolarHBondContact N-O 3.02Å; K1030-R1061 PolarHBondContact O-N 3.49Å; K1030-T1063 HydrophobicContact CG-CG2 4.03Å
1031	I	96.6	Very high	88	Confident	17 Å²	17	70.4 Å²	70.4	9%	0.087	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	137.5	178.2	-63.6	119.2	0	0	0	108.9	T969 P971 L975 Y976 A977 I1029 I1058 E1059 V1060	T969-I1031 HydrophobicContact CG2-CD1 4.13Å; T969-I1031 HydrophobicContact CG2-CG1 4.25Å; T969-I1031 WeakPolarHBondContact OG1-CD1 3.33Å; P971-I1031 HydrophobicContact CB-CG2 3.85Å; P971-I1031 HydrophobicContact CG-CG2 3.91Å; L975-I1031 HydrophobicContact CD2-CG2 4.37Å; L975-I1031 VanDerWaalsContact O-CD1 3.3Å; L975-I1031 WeakPolarHBondContact O-CD1 3.37Å; Y976-I1031 VanDerWaalsContact C-CD1 3.49Å; A977-I1031 HydrophobicContact CB-CD1 4.05Å; I1029-I1031 HydrophobicContact CG2-CD1 4.36Å; I1031-I1058 HydrophobicContact CG2-CG2 4.22Å; I1031-E1059 CarbonylContact C-O 3.48Å; I1031-E1059 WeakPolarHBondContact CA-O 3.39Å; I1031-V1060 HydrophobicContact CG1-CG1 3.92Å; I1031-V1060 HydrophobicContact CG2-CG1 4.48Å
1032	L	95.8	Very high	86.8	Confident	82 Å²	82	74 Å²	74	43%	0.429	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	105.3	170.5	170.7	64.2	0	0	0	108.4	R1034 E1059	L1032-R1034 HydrophobicContact CD2-CG 4.35Å; L1032-R1034 HydrophobicContact CG-CG 4.09Å; L1032-E1059 HydrophobicContact CB-CB 4.24Å; L1032-E1059 PolarHBondContact N-O 2.89Å; L1032-E1059 PolarHBondContact O-N 2.99Å
1033	Y	95.6	Very high	85.3	Confident	61 Å²	61	71.9 Å²	71.9	24%	0.239	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	109.4	171.9	-167.2	-106.4	0	0	0	108.2	P971 K972 Q1056 I1058	P971-Y1033 HydrophobicContact CB-CD2 3.49Å; P971-Y1033 VanDerWaalsContact CB-CD2 3.49Å; P971-Y1033 HydrophobicContact CB-CE2 4.18Å; P971-Y1033 HydrophobicContact CB-CG 4.08Å; K972-Y1033 HydrophobicContact CB-CE1 4.32Å; K972-Y1033 HydrophobicContact CB-CE2 4.3Å; K972-Y1033 HydrophobicContact CG-CE1 4.33Å; Y1033-Q1056 HydrophobicContact CD2-CG 4.35Å; Y1033-Q1056 VanDerWaalsContact CE2-CD 3.45Å; Y1033-Q1056 HydrophobicContact CE2-CG 3.52Å; Y1033-Q1056 VanDerWaalsContact CE2-NE2 3.35Å; Y1033-I1058 HydrophobicContact CD2-CD1 4.18Å; Y1033-I1058 HydrophobicContact CD2-CG1 3.87Å; Y1033-I1058 HydrophobicContact CD2-CG2 4.48Å; Y1033-I1058 HydrophobicContact CE2-CD1 4.09Å; Y1033-I1058 HydrophobicContact CE2-CG1 4.08Å
1034	R	93.5	Very high	83.8	Confident	89 Å²	89	74.5 Å²	74.5	34%	0.336	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-80.7	159.5	-174.5	-61.6	179.2	176.2	-113.8	1.7	110.6	L1032 Q1056 L1057 E1059	L1032-R1034 HydrophobicContact CD2-CG 4.35Å; L1032-R1034 HydrophobicContact CG-CG 4.09Å; R1034-Q1056 PolarHBondContact O-NE2 2.75Å; R1034-L1057 HydrophobicContact CB-CB 4.09Å; R1034-L1057 HydrophobicContact CG-CB 4.32Å; R1034-L1057 PolarHBondContact N-O 3.34Å; R1034-E1059 IonicContact CZ-OE2 2.66Å; R1034-E1059 IonicContact NE-OE2 2.95Å; R1034-E1059 IonicContact NH2-OE2 3.95Å; R1034-E1059 PolarHBondContact NH2-OE2 3.45Å
1035	P	89.1	Confident	82.4	Confident	104 Å²	104	80 Å²	80	68%	0.675	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-56.6	141.1	175.5	-26.8	35.9	0	0	0	113	F1037	P1035-F1037 WeakPolarHBondContact O-CD2 3.5Å; P1035-F1037 WeakPolarHBondContact O-CE2 3.35Å; P1035-F1037 PolarHBondContact O-N 2.98Å
1036	L	89.6	Confident	81	Confident	85 Å²	85	83 Å²	83	45%	0.445	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-68.2	121.4	-179.8	-177.6	66.6	0	0	0	111	F1054 Q1056	L1036-F1054 HydrophobicContact CD1-CB 4.41Å; L1036-F1054 HydrophobicContact CD2-CD1 4.04Å; L1036-F1054 HydrophobicContact CG-CD1 4.48Å; L1036-Q1056 HydrophobicContact CD1-CB 3.86Å
1037	F	89.6	Confident	80.1	Confident	117 Å²	117	82.9 Å²	82.9	51%	0.513	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	128	172.9	-63.8	-91.6	0	0	0	109.8	P1035 F1054 K1055 L1057	P1035-F1037 WeakPolarHBondContact O-CD2 3.5Å; P1035-F1037 WeakPolarHBondContact O-CE2 3.35Å; P1035-F1037 PolarHBondContact O-N 2.98Å; F1037-F1054 CarbonylContact O-C 3.57Å; F1037-F1054 WeakPolarHBondContact O-CA 3.35Å; F1037-K1055 HydrophobicContact CB-CB 4.37Å; F1037-K1055 PolarHBondContact N-O 2.89Å; F1037-K1055 PolarHBondContact O-N 2.9Å; F1037-L1057 HydrophobicContact CE2-CD1 4.25Å
1038	K	90	Very high	79.7	Confident	154 Å²	154	86.9 Å²	86.9	67%	0.67	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.9	136.8	170.7	65.1	179.9	-179.4	178.2	0	110.5	M1052 T1053 F1054	K1038-M1052 HydrophobicContact CB-SD 4.14Å; K1038-T1053 WeakPolarHBondContact CA-O 3.37Å; K1038-F1054 HydrophobicContact CB-CD1 3.88Å; K1038-F1054 HydrophobicContact CB-CE1 3.98Å; K1038-F1054 HydrophobicContact CD-CE1 4.42Å
1039	Y	88.9	Confident	79.3	Confident	96 Å²	96	89.5 Å²	89.5	38%	0.376	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	140.4	175.6	67.4	-86.8	0	0	0	111.5	E1041 T1053 K1130	Y1039-E1041 HydrophobicContact CD2-CG 3.96Å; Y1039-E1041 HydrophobicContact CE2-CG 3.42Å; Y1039-E1041 VanDerWaalsContact CE2-CG 3.42Å; Y1039-E1041 WeakPolarHBondContact CE2-OE1 3.43Å; Y1039-E1041 PolarHBondContact OH-OE1 2.89Å; Y1039-T1053 HydrophobicContact CE1-CG2 3.73Å; Y1039-T1053 HydrophobicContact CE2-CG2 4.36Å; Y1039-T1053 PolarHBondContact N-O 3.45Å; Y1039-T1053 PolarHBondContact O-N 3.23Å; Y1039-T1053 VanDerWaalsContact OH-CG2 3.26Å; Y1039-T1053 WeakPolarHBondContact OH-CG2 3.3Å; Y1039-K1130 VanDerWaalsContact OH-CE 3.23Å; Y1039-K1130 WeakPolarHBondContact OH-CE 3.36Å; Y1039-K1130 PolarHBondContact OH-NZ 3.33Å
1040	R	83.5	Confident	78.7	Confident	147 Å²	147	89.3 Å²	89.3	56%	0.555	49%	0.491	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	127.1	176	-155.9	-177.5	-148.7	172	9.8	109	A1050 T1051 M1052	R1040-A1050 VanDerWaalsContact NH2-CB 3.34Å; R1040-T1051 WeakPolarHBondContact CA-O 3.19Å; R1040-T1051 WeakPolarHBondContact CG-O 3.29Å; R1040-M1052 HydrophobicContact CB-CE 4.17Å; R1040-M1052 HydrophobicContact CG-CE 4.43Å
1041	E	72	Confident	78.3	Confident	77 Å²	77	86.3 Å²	86.3	36%	0.36	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	135	170.8	-75.2	-176.6	-157.2	0	0	109.6	Y1039 T1043 T1051 T1053	Y1039-E1041 HydrophobicContact CD2-CG 3.96Å; Y1039-E1041 HydrophobicContact CE2-CG 3.42Å; Y1039-E1041 VanDerWaalsContact CE2-CG 3.42Å; Y1039-E1041 WeakPolarHBondContact CE2-OE1 3.43Å; Y1039-E1041 PolarHBondContact OH-OE1 2.89Å; E1041-T1043 PolarHBondContact O-N 3.4Å; E1041-T1051 PolarHBondContact N-O 3.01Å; E1041-T1053 WeakPolarHBondContact OE1-CB 3.43Å; E1041-T1053 PolarHBondContact OE1-OG1 3.47Å
1042	G	59.7	Low	77.9	Confident	83 Å²	83	87.5 Å²	87.5	86%	0.856	49%	0.487	S	S	*	.			trans	-68.3	106.4	-168.6	0	0	0	0	0	112	G1044	G1042-G1044 PolarHBondContact O-N 3.18Å
1043	T	53	Low	77.7	Confident	65 Å²	65	83.6 Å²	83.6	40%	0.399	47%	0.466	S	S	.	.			trans	-57.7	122.9	173.4	51.4	0	0	0	0	110.2	E1041 N1049	E1041-T1043 PolarHBondContact O-N 3.4Å; T1043-N1049 WeakPolarHBondContact CG2-O 3.44Å
1044	G	51.2	Low	77.5	Confident	60 Å²	60	82.2 Å²	82.2	62%	0.619	46%	0.462	S	S	*	.			trans	-53.9	148	165.4	0	0	0	0	0	110.3	G1042 S1046 G1047	G1042-G1044 PolarHBondContact O-N 3.18Å; G1044-S1046 PolarHBondContact O-N 3.49Å; G1044-G1047 PolarHBondContact O-N 2.84Å; G1044-G1047 VanDerWaalsContact O-N 3.12Å
1045	S	51.1	Low	77.6	Confident	140 Å²	140	80.9 Å²	80.9	98%	0.979	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	33	-158.5	-43.8	0	0	0	0	117.4
1046	S	56.4	Low	77.9	Confident	119 Å²	119	76.1 Å²	76.1	83%	0.832	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-147.5	7.6	177.4	-175.6	0	0	0	0	112.9	G1044	G1044-S1046 PolarHBondContact O-N 3.49Å
1047	G	62.1	Low	78.3	Confident	39 Å²	39	73.1 Å²	73.1	40%	0.402	41%	0.411	S	S	.	.			trans	-77.5	130.1	-175.6	0	0	0	0	0	113.9	G1044 I1137	G1044-G1047 PolarHBondContact O-N 2.84Å; G1044-G1047 VanDerWaalsContact O-N 3.12Å; G1047-I1137 WeakPolarHBondContact O-CD1 3.49Å
1048	K	77.5	Confident	78.6	Confident	182 Å²	182	67.6 Å²	67.6	79%	0.791	39%	0.387	S	S	*	.	S	Bend	trans	-83	-16.8	169.9	-64.5	-175.4	177.8	-175.6	0	113.5	I1137	K1048-I1137 PolarHBondContact O-N 3.36Å; K1048-I1137 VanDerWaalsContact O-N 3.09Å
1049	N	79.6	Confident	79	Confident	63 Å²	63	62.5 Å²	62.5	34%	0.337	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	141.1	-174.7	-60.5	27.5	0	0	0	109	T1043 H1135	T1043-N1049 WeakPolarHBondContact CG2-O 3.44Å; N1049-H1135 CarbonylContact C-O 3.59Å; N1049-H1135 WeakPolarHBondContact CA-O 3.13Å; N1049-H1135 WeakPolarHBondContact CB-O 3.35Å
1050	A	82.8	Confident	79.4	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	152.3	166.8	0	0	0	0	0	110.4	R1040 E1134 H1135 I1137	R1040-A1050 VanDerWaalsContact NH2-CB 3.34Å; A1050-E1134 CarbonylContact O-C 3.56Å; A1050-E1134 VanDerWaalsContact O-CA 3.29Å; A1050-E1134 WeakPolarHBondContact O-CA 3.42Å; A1050-H1135 PolarHBondContact N-O 3.29Å; A1050-H1135 PolarHBondContact O-N 3.13Å; A1050-I1137 HydrophobicContact CB-CG1 3.92Å
1051	T	86.5	Confident	80.1	Confident	32 Å²	32	56.7 Å²	56.7	20%	0.196	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	117.6	172.7	-51.2	0	0	0	0	109.1	R1040 E1041 V1133 E1134	R1040-T1051 WeakPolarHBondContact CA-O 3.19Å; R1040-T1051 WeakPolarHBondContact CG-O 3.29Å; E1041-T1051 PolarHBondContact N-O 3.01Å; T1051-V1133 WeakPolarHBondContact CA-O 3.21Å; T1051-E1134 HydrophobicContact CG2-CG 4.25Å
1052	M	88.1	Confident	81.2	Confident	43 Å²	43	53 Å²	53	21%	0.212	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	120.1	173.6	-174.7	62.4	64.3	0	0	109	K1038 R1040 F1054 S1132 V1133	K1038-M1052 HydrophobicContact CB-SD 4.14Å; R1040-M1052 HydrophobicContact CB-CE 4.17Å; R1040-M1052 HydrophobicContact CG-CE 4.43Å; M1052-F1054 HydrophobicContact CB-CE2 3.94Å; M1052-F1054 HydrophobicContact CB-CZ 4.33Å; M1052-F1054 HydrophobicContact CG-CD2 4.21Å; M1052-F1054 HydrophobicContact CG-CE1 4.24Å; M1052-F1054 HydrophobicContact CG-CE2 3.5Å; M1052-F1054 HydrophobicContact CG-CZ 3.53Å; M1052-S1132 CarbonylContact O-C 3.52Å; M1052-S1132 WeakPolarHBondContact O-CA 3.43Å; M1052-V1133 PolarHBondContact N-O 2.71Å; M1052-V1133 PolarHBondContact O-N 3.29Å
1053	T	91.2	Very high	82.9	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	126.5	177.7	-60	0	0	0	0	110.4	K1038 Y1039 E1041 L1089 K1130	K1038-T1053 WeakPolarHBondContact CA-O 3.37Å; Y1039-T1053 HydrophobicContact CE1-CG2 3.73Å; Y1039-T1053 HydrophobicContact CE2-CG2 4.36Å; Y1039-T1053 PolarHBondContact N-O 3.45Å; Y1039-T1053 PolarHBondContact O-N 3.23Å; Y1039-T1053 VanDerWaalsContact OH-CG2 3.26Å; Y1039-T1053 WeakPolarHBondContact OH-CG2 3.3Å; E1041-T1053 WeakPolarHBondContact OE1-CB 3.43Å; E1041-T1053 PolarHBondContact OE1-OG1 3.47Å; T1053-L1089 HydrophobicContact CG2-CD1 3.96Å; T1053-K1130 HydrophobicContact CG2-CD 4.33Å; T1053-K1130 HydrophobicContact CG2-CG 4.01Å
1054	F	92.8	Very high	84.7	Confident	32 Å²	32	50.8 Å²	50.8	14%	0.14	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	137.7	178.2	-61.5	-93.7	0	0	0	109.4	L1036 F1037 K1038 M1052 K1130 Y1131 V1133	L1036-F1054 HydrophobicContact CD1-CB 4.41Å; L1036-F1054 HydrophobicContact CD2-CD1 4.04Å; L1036-F1054 HydrophobicContact CG-CD1 4.48Å; F1037-F1054 CarbonylContact O-C 3.57Å; F1037-F1054 WeakPolarHBondContact O-CA 3.35Å; K1038-F1054 HydrophobicContact CB-CD1 3.88Å; K1038-F1054 HydrophobicContact CB-CE1 3.98Å; K1038-F1054 HydrophobicContact CD-CE1 4.42Å; M1052-F1054 HydrophobicContact CB-CE2 3.94Å; M1052-F1054 HydrophobicContact CB-CZ 4.33Å; M1052-F1054 HydrophobicContact CG-CD2 4.21Å; M1052-F1054 HydrophobicContact CG-CE1 4.24Å; M1052-F1054 HydrophobicContact CG-CE2 3.5Å; M1052-F1054 HydrophobicContact CG-CZ 3.53Å; F1054-K1130 VanDerWaalsContact O-CA 3.24Å; F1054-K1130 WeakPolarHBondContact O-CA 3.32Å; F1054-K1130 VanDerWaalsContact O-CG 3.29Å; F1054-K1130 WeakPolarHBondContact O-CG 3.46Å; F1054-Y1131 HydrophobicContact CB-CD2 4.1Å; F1054-Y1131 HydrophobicContact CB-CE1 4.11Å; F1054-Y1131 HydrophobicContact CB-CE2 3.65Å; F1054-Y1131 AromaticContact CD2-CD2 3.91Å; F1054-Y1131 HydrophobicContact CD2-CD2 3.91Å; F1054-Y1131 AromaticContact CD2-CE2 3.42Å; F1054-Y1131 HydrophobicContact CD2-CE2 3.42Å; F1054-Y1131 VanDerWaalsContact CD2-CE2 3.42Å; F1054-Y1131 HydrophobicContact CE2-CE2 4.19Å; F1054-Y1131 HydrophobicContact CG-CD2 4.33Å; F1054-Y1131 AromaticContact CG-CE2 3.64Å; F1054-Y1131 HydrophobicContact CG-CE2 3.64Å; F1054-Y1131 AromaticContact CG-CZ 3.92Å; F1054-Y1131 PolarHBondContact N-O 2.74Å; F1054-Y1131 PolarHBondContact O-N 3.29Å; F1054-V1133 HydrophobicContact CD2-CG2 4.02Å; F1054-V1133 HydrophobicContact CE2-CB 4.16Å; F1054-V1133 HydrophobicContact CE2-CG2 3.66Å
1055	K	95	Very high	86.6	Confident	60 Å²	60	54.5 Å²	54.5	26%	0.261	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	114.6	174.4	175.7	163.6	175.3	147.5	0	110.5	F1037 T1128 L1129 K1130	F1037-K1055 HydrophobicContact CB-CB 4.37Å; F1037-K1055 PolarHBondContact N-O 2.89Å; F1037-K1055 PolarHBondContact O-N 2.9Å; K1055-T1128 HydrophobicContact CD-CG2 3.94Å; K1055-T1128 VanDerWaalsContact CE-CG2 3.45Å; K1055-T1128 HydrophobicContact CG-CG2 3.98Å; K1055-T1128 PolarHBondContact NZ-OG1 3.43Å; K1055-T1128 VanDerWaalsContact NZ-OG1 3.16Å; K1055-L1129 CarbonylContact C-O 3.58Å; K1055-L1129 WeakPolarHBondContact CA-O 3.19Å; K1055-K1130 HydrophobicContact CB-CG 4.23Å
1056	Q	95.7	Very high	88.6	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.019	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	141.6	171.9	-176.6	53.3	46	0	0	109.7	Y1033 R1034 L1036 I1058 L1129	Y1033-Q1056 HydrophobicContact CD2-CG 4.35Å; Y1033-Q1056 VanDerWaalsContact CE2-CD 3.45Å; Y1033-Q1056 HydrophobicContact CE2-CG 3.52Å; Y1033-Q1056 VanDerWaalsContact CE2-NE2 3.35Å; R1034-Q1056 PolarHBondContact O-NE2 2.75Å; L1036-Q1056 HydrophobicContact CD1-CB 3.86Å; Q1056-I1058 HydrophobicContact CG-CG1 4.31Å; Q1056-L1129 HydrophobicContact CB-CB 4.23Å; Q1056-L1129 PolarHBondContact N-O 2.96Å; Q1056-L1129 PolarHBondContact O-N 2.77Å
1057	L	96.7	Very high	90.3	Very high	23 Å²	23	55 Å²	55	12%	0.12	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	130.7	176.4	-74	174.1	0	0	0	109.9	R1034 F1037 E1126 T1128	R1034-L1057 HydrophobicContact CB-CB 4.09Å; R1034-L1057 HydrophobicContact CG-CB 4.32Å; R1034-L1057 PolarHBondContact N-O 3.34Å; F1037-L1057 HydrophobicContact CE2-CD1 4.25Å; L1057-E1126 HydrophobicContact CD2-CG 4.26Å; L1057-T1128 WeakPolarHBondContact CD2-OG1 3.31Å
1058	I	97.6	Very high	91.8	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	116.9	-178.5	-42	-178.6	0	0	0	107.9	P971 I1031 Y1033 Q1056 V1060 V1072 D1074 E1126 L1127	P971-I1058 HydrophobicContact CB-CG2 4.14Å; P971-I1058 HydrophobicContact CG-CD1 4.4Å; P971-I1058 HydrophobicContact CG-CG2 3.87Å; I1031-I1058 HydrophobicContact CG2-CG2 4.22Å; Y1033-I1058 HydrophobicContact CD2-CD1 4.18Å; Y1033-I1058 HydrophobicContact CD2-CG1 3.87Å; Y1033-I1058 HydrophobicContact CD2-CG2 4.48Å; Y1033-I1058 HydrophobicContact CE2-CD1 4.09Å; Y1033-I1058 HydrophobicContact CE2-CG1 4.08Å; Q1056-I1058 HydrophobicContact CG-CG1 4.31Å; I1058-V1060 HydrophobicContact CG2-CG1 4.29Å; I1058-V1072 HydrophobicContact CD1-CG1 4.15Å; I1058-V1072 HydrophobicContact CG2-CG1 4.46Å; I1058-D1074 HydrophobicContact CD1-CB 4.16Å; I1058-E1126 CarbonylContact O-C 3.6Å; I1058-L1127 HydrophobicContact CB-CB 4.28Å; I1058-L1127 PolarHBondContact N-O 3.32Å; I1058-L1127 PolarHBondContact O-N 2.88Å
1059	E	97.6	Very high	92.5	Very high	47 Å²	47	50.9 Å²	50.9	22%	0.22	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	127.1	174.1	-179.9	-175.9	149.3	0	0	109	I1031 L1032 R1034 I1124	I1031-E1059 CarbonylContact C-O 3.48Å; I1031-E1059 WeakPolarHBondContact CA-O 3.39Å; L1032-E1059 HydrophobicContact CB-CB 4.24Å; L1032-E1059 PolarHBondContact N-O 2.89Å; L1032-E1059 PolarHBondContact O-N 2.99Å; R1034-E1059 IonicContact CZ-OE2 2.66Å; R1034-E1059 IonicContact NE-OE2 2.95Å; R1034-E1059 IonicContact NH2-OE2 3.95Å; R1034-E1059 PolarHBondContact NH2-OE2 3.45Å; E1059-I1124 HydrophobicContact CG-CG2 3.7Å
1060	V	97.5	Very high	93.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	138.4	176.6	-61.7	0	0	0	0	110.6	K1030 I1031 I1058 L1070 V1072 L1117 L1119 I1124 R1125	K1030-V1060 WeakPolarHBondContact O-CA 3.37Å; I1031-V1060 HydrophobicContact CG1-CG1 3.92Å; I1031-V1060 HydrophobicContact CG2-CG1 4.48Å; I1058-V1060 HydrophobicContact CG2-CG1 4.29Å; V1060-L1070 HydrophobicContact CB-CD2 3.95Å; V1060-L1070 HydrophobicContact CG1-CD2 4.04Å; V1060-L1070 HydrophobicContact CG2-CD2 4.16Å; V1060-V1072 HydrophobicContact CG1-CG2 4.02Å; V1060-L1117 HydrophobicContact CG2-CD1 3.69Å; V1060-L1119 HydrophobicContact CG2-CD1 4.16Å; V1060-I1124 CarbonylContact O-C 3.59Å; V1060-I1124 WeakPolarHBondContact O-CA 3.34Å; V1060-R1125 HydrophobicContact CG2-CB 4.24Å; V1060-R1125 PolarHBondContact N-O 2.97Å; V1060-R1125 PolarHBondContact O-N 2.86Å
1061	R	97.3	Very high	93.9	Very high	122 Å²	122	49.5 Å²	49.5	46%	0.46	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	122.5	-178	177	173.8	-177.9	-168.7	-3.5	110.8	I1029 K1030 T1063 E1123 I1124	I1029-R1061 WeakPolarHBondContact CA-O 3.38Å; K1030-R1061 HydrophobicContact CB-CB 4.46Å; K1030-R1061 PolarHBondContact N-O 3.02Å; K1030-R1061 PolarHBondContact O-N 3.49Å; R1061-T1063 HydrophobicContact CG-CG2 3.94Å; R1061-E1123 WeakPolarHBondContact CA-O 3.37Å; R1061-I1124 HydrophobicContact CB-CG1 4.03Å; R1061-I1124 HydrophobicContact CG-CD1 4.47Å; R1061-I1124 HydrophobicContact CG-CG1 3.74Å
1062	N	96.8	Very high	94.5	Very high	0 Å²	0	48 Å²	48	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	124	163.9	-177.8	9.9	0	0	0	108.8	F1064 R1066 L1119 G1120 G1122 E1123	N1062-F1064 WeakPolarHBondContact OD1-CB 3.36Å; N1062-F1064 WeakPolarHBondContact OD1-CD2 3.25Å; N1062-F1064 PolarHBondContact OD1-N 3.33Å; N1062-R1066 PolarHBondContact ND2-O 3.36Å; N1062-L1119 HydrophobicContact CB-CB 4.11Å; N1062-L1119 HydrophobicContact CB-CD1 4.46Å; N1062-G1120 PolarHBondContact ND2-O 3.42Å; N1062-G1122 CarbonylContact O-C 3.55Å; N1062-G1122 WeakPolarHBondContact O-CA 3.38Å; N1062-G1122 PolarHBondContact O-N 3.36Å; N1062-E1123 PolarHBondContact N-O 3.24Å
1063	T	94.6	Very high	94.9	Very high	65 Å²	65	46.6 Å²	46.6	40%	0.399	21%	0.205	S	C	.	.			trans	-108.3	7.2	173.3	67.5	0	0	0	0	113.2	G1028 K1030 R1061	G1028-T1063 VanDerWaalsContact C-OG1 3.29Å; G1028-T1063 WeakPolarHBondContact CA-OG1 3.49Å; G1028-T1063 PolarHBondContact O-N 3.22Å; G1028-T1063 PolarHBondContact O-OG1 3.42Å; K1030-T1063 HydrophobicContact CG-CG2 4.03Å; R1061-T1063 HydrophobicContact CG-CG2 3.94Å
1064	F	90.5	Very high	95.1	Very high	36 Å²	36	46.9 Å²	46.9	16%	0.158	21%	0.206	C	C	.	.	S	Bend	trans	-78.3	160.5	169.5	-65.6	-75.4	0	0	0	112.9	E1026 G1028 I1029 N1062 R1066 V1068 P1121 G1122	E1026-F1064 VanDerWaalsContact CD-CZ 3.4Å; E1026-F1064 HydrophobicContact CG-CE2 4.03Å; E1026-F1064 HydrophobicContact CG-CZ 3.96Å; E1026-F1064 WeakPolarHBondContact OE2-CZ 3.39Å; G1028-F1064 WeakPolarHBondContact O-CD2 3.02Å; I1029-F1064 HydrophobicContact CG1-CE2 4.22Å; N1062-F1064 WeakPolarHBondContact OD1-CB 3.36Å; N1062-F1064 WeakPolarHBondContact OD1-CD2 3.25Å; N1062-F1064 PolarHBondContact OD1-N 3.33Å; F1064-R1066 VanDerWaalsContact C-N 3.31Å; F1064-R1066 HydrophobicContact CB-CG 3.83Å; F1064-R1066 VanDerWaalsContact CE1-NH2 3.32Å; F1064-R1066 HydrophobicContact CG-CG 4.28Å; F1064-R1066 VanDerWaalsContact CZ-NH2 3.27Å; F1064-V1068 HydrophobicContact CD2-CG2 3.75Å; F1064-V1068 HydrophobicContact CE2-CG2 4.36Å; F1064-V1068 HydrophobicContact CG-CG2 4.48Å; F1064-P1121 WeakPolarHBondContact O-CA 3.2Å; F1064-G1122 PolarHBondContact O-N 2.94Å
1065	D	92	Very high	95.1	Very high	138 Å²	138	48.8 Å²	48.8	74%	0.738	22%	0.216	S	C	*	.	S	Bend	trans	-75.3	-15.9	165.3	63.5	-21	0	0	0	113.6	P1121	D1065-P1121 VanDerWaalsContact O-CB 3.31Å; D1065-P1121 WeakPolarHBondContact O-CB 3.34Å; D1065-P1121 WeakPolarHBondContact O-CG 3.42Å
1066	R	91.9	Very high	94.9	Very high	118 Å²	118	46.3 Å²	46.3	45%	0.445	21%	0.206	S	C	.	.	S	Bend	trans	-100.2	158.3	176.4	63.5	173.4	-176.4	-90.5	3.4	113.6	Y967 N1062 F1064 V1068	Y967-R1066 PolarHBondContact OH-NH2 3.19Å; Y967-R1066 VanDerWaalsContact OH-NH2 3.14Å; N1062-R1066 PolarHBondContact ND2-O 3.36Å; F1064-R1066 VanDerWaalsContact C-N 3.31Å; F1064-R1066 HydrophobicContact CB-CG 3.83Å; F1064-R1066 VanDerWaalsContact CE1-NH2 3.32Å; F1064-R1066 HydrophobicContact CG-CG 4.28Å; F1064-R1066 VanDerWaalsContact CZ-NH2 3.27Å; R1066-V1068 HydrophobicContact CG-CG2 4.4Å
1067	R	93.4	Very high	94.6	Very high	152 Å²	152	47.5 Å²	47.5	57%	0.574	21%	0.214	S	C	*	.			trans	-68.8	143.1	167.9	174.1	177.8	-73.9	-97.3	-9	110.1	D1118 L1119	R1067-D1118 WeakPolarHBondContact CD-OD1 3.39Å; R1067-D1118 WeakPolarHBondContact CG-OD1 3.46Å; R1067-D1118 IonicContact CZ-OD1 3.11Å; R1067-D1118 IonicContact CZ-OD2 3.32Å; R1067-D1118 IonicContact NE-OD1 3.64Å; R1067-D1118 IonicContact NH1-OD1 3.19Å; R1067-D1118 PolarHBondContact NH1-OD1 2.8Å; R1067-D1118 IonicContact NH1-OD2 2.71Å; R1067-D1118 PolarHBondContact NH1-OD2 2.92Å; R1067-L1119 CarbonylContact C-O 3.5Å; R1067-L1119 WeakPolarHBondContact CA-O 3.38Å
1068	V	91.9	Very high	94.2	Very high	6 Å²	6	51.7 Å²	51.7	4%	0.036	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	138.1	-172.4	169.3	0	0	0	0	111	Y967 I1029 F1064 R1066 L1119	Y967-V1068 HydrophobicContact CD2-CG1 3.57Å; Y967-V1068 HydrophobicContact CE2-CG1 3.89Å; Y967-V1068 HydrophobicContact CG-CG1 4.44Å; I1029-V1068 HydrophobicContact CD1-CG1 3.76Å; I1029-V1068 HydrophobicContact CG1-CG1 4.45Å; F1064-V1068 HydrophobicContact CD2-CG2 3.75Å; F1064-V1068 HydrophobicContact CE2-CG2 4.36Å; F1064-V1068 HydrophobicContact CG-CG2 4.48Å; R1066-V1068 HydrophobicContact CG-CG2 4.4Å; V1068-L1119 PolarHBondContact N-O 3.22Å; V1068-L1119 PolarHBondContact O-N 2.84Å
1069	R	93.3	Very high	93.7	Very high	127 Å²	127	53.8 Å²	53.8	48%	0.479	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	125.2	166.5	-68.5	-167.6	-177.9	-153.3	3.9	111.2	Y967 L1117 D1118	Y967-R1069 PolarHBondContact N-O 3.2Å; Y967-R1069 VanDerWaalsContact N-O 3.08Å; R1069-L1117 CarbonylContact C-O 3.57Å; R1069-L1117 WeakPolarHBondContact CA-O 3.45Å; R1069-D1118 HydrophobicContact CG-CB 4.43Å
1070	L	95.7	Very high	92.9	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	120	-178.5	176.9	65.9	0	0	0	110	Y967 T969 A977 I1029 V1060 V1072 L1117 L1119	Y967-L1070 CarbonylContact O-C 3.53Å; Y967-L1070 WeakPolarHBondContact O-CA 3.35Å; T969-L1070 HydrophobicContact CG2-CD1 3.98Å; T969-L1070 HydrophobicContact CG2-CD2 4.46Å; T969-L1070 HydrophobicContact CG2-CG 4.4Å; A977-L1070 HydrophobicContact CB-CD1 4.05Å; I1029-L1070 HydrophobicContact CD1-CD1 4.17Å; I1029-L1070 HydrophobicContact CG2-CD1 4.49Å; I1029-L1070 HydrophobicContact CG2-CD2 3.89Å; V1060-L1070 HydrophobicContact CB-CD2 3.95Å; V1060-L1070 HydrophobicContact CG1-CD2 4.04Å; V1060-L1070 HydrophobicContact CG2-CD2 4.16Å; L1070-V1072 HydrophobicContact CD2-CG2 4.03Å; L1070-V1072 HydrophobicContact CG-CG2 4.09Å; L1070-L1117 PolarHBondContact N-O 2.64Å; L1070-L1117 WeakPolarHBondContact O-CB 3.35Å; L1070-L1117 PolarHBondContact O-N 3.38Å; L1070-L1119 HydrophobicContact CB-CD1 4.26Å; L1070-L1119 HydrophobicContact CD2-CD1 4.09Å
1071	M	96.2	Very high	92.2	Very high	34 Å²	34	61 Å²	61	17%	0.167	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	113	166	-172.4	171.7	70.1	0	0	109.7	Y967 V968 T969 V1073 R1106 E1114 W1115	Y967-M1071 PolarHBondContact O-N 3.11Å; V968-M1071 CarbonylContact C-O 3.6Å; V968-M1071 WeakPolarHBondContact CA-O 3.46Å; V968-M1071 HydrophobicContact CG1-CE 3.7Å; V968-M1071 HydrophobicContact CG2-CB 4.42Å; V968-M1071 HydrophobicContact CG2-CE 3.99Å; T969-M1071 PolarHBondContact N-O 3.17Å; M1071-V1073 HydrophobicContact CE-CG2 3.97Å; M1071-V1073 HydrophobicContact CG-CG2 4.04Å; M1071-V1073 HydrophobicContact SD-CG2 4.42Å; M1071-R1106 PolarHBondContact SD-NH2 2.81Å; M1071-E1114 HydrophobicContact SD-CB 4.38Å; M1071-E1114 HydrophobicContact SD-CG 4.35Å; M1071-W1115 CarbonylContact C-O 3.38Å; M1071-W1115 VanDerWaalsContact CA-O 3.28Å; M1071-W1115 WeakPolarHBondContact CA-O 3.29Å
1072	V	97.7	Very high	91.5	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	137	168.8	-174.8	0	0	0	0	108.4	T969 P971 I1058 V1060 L1070 E1114 W1115 L1117 L1127	T969-V1072 HydrophobicContact CG2-CB 4.2Å; T969-V1072 HydrophobicContact CG2-CG1 4.15Å; T969-V1072 HydrophobicContact CG2-CG2 3.84Å; P971-V1072 HydrophobicContact CG-CG1 3.91Å; I1058-V1072 HydrophobicContact CD1-CG1 4.15Å; I1058-V1072 HydrophobicContact CG2-CG1 4.46Å; V1060-V1072 HydrophobicContact CG1-CG2 4.02Å; L1070-V1072 HydrophobicContact CD2-CG2 4.03Å; L1070-V1072 HydrophobicContact CG-CG2 4.09Å; V1072-E1114 WeakPolarHBondContact O-CA 3.42Å; V1072-W1115 HydrophobicContact CB-CB 4.45Å; V1072-W1115 HydrophobicContact CB-CE3 4.16Å; V1072-W1115 HydrophobicContact CG1-CE3 4.17Å; V1072-W1115 HydrophobicContact CG1-CZ3 4.46Å; V1072-W1115 PolarHBondContact N-O 3.04Å; V1072-W1115 PolarHBondContact O-N 2.96Å; V1072-L1117 HydrophobicContact CG2-CD1 3.85Å; V1072-L1127 HydrophobicContact CB-CD1 3.85Å; V1072-L1127 HydrophobicContact CG1-CD1 3.85Å; V1072-L1127 HydrophobicContact CG2-CD1 3.88Å
1073	V	97.1	Very high	91	Very high	14 Å²	14	67 Å²	67	9%	0.085	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	130.8	177.9	-169.6	0	0	0	0	110	V968 T969 V970 P971 M1071 N1112 V1113 E1114	V968-V1073 HydrophobicContact CG1-CG2 4.37Å; T969-V1073 PolarHBondContact O-N 2.73Å; V970-V1073 HydrophobicContact CG2-CB 4.4Å; P971-V1073 WeakPolarHBondContact CD-O 3.47Å; M1071-V1073 HydrophobicContact CE-CG2 3.97Å; M1071-V1073 HydrophobicContact CG-CG2 4.04Å; M1071-V1073 HydrophobicContact SD-CG2 4.42Å; V1073-N1112 HydrophobicContact CG1-CB 3.82Å; V1073-V1113 WeakPolarHBondContact CA-O 3.45Å; V1073-E1114 HydrophobicContact CG1-CG 4.42Å; V1073-E1114 HydrophobicContact CG2-CG 4.28Å
1074	D	95.5	Very high	90.5	Very high	6 Å²	6	65.7 Å²	65.7	3%	0.032	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	157.1	175	-163.8	7.5	0	0	0	110.7	I1058 N1112 V1113 W1115 L1129	I1058-D1074 HydrophobicContact CD1-CB 4.16Å; D1074-N1112 CarbonylContact O-C 3.55Å; D1074-N1112 VanDerWaalsContact O-CA 3.28Å; D1074-N1112 WeakPolarHBondContact O-CA 3.38Å; D1074-V1113 PolarHBondContact N-O 3.12Å; D1074-V1113 VanDerWaalsContact N-O 3.15Å; D1074-V1113 PolarHBondContact O-N 2.99Å; D1074-W1115 HydrophobicContact CB-CH2 4.25Å; D1074-W1115 HydrophobicContact CB-CZ3 3.93Å; D1074-L1129 HydrophobicContact CB-CD2 4.05Å
1075	Q	92.8	Very high	90.5	Very high	73 Å²	73	69 Å²	69	34%	0.341	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	144.8	-168.7	67.2	179	105.2	0	0	113.8	K972 N1112	K972-Q1075 HydrophobicContact CD-CG 4.19Å; Q1075-N1112 VanDerWaalsContact CA-OD1 3.27Å; Q1075-N1112 WeakPolarHBondContact CA-OD1 3.31Å; Q1075-N1112 WeakPolarHBondContact CB-OD1 3.04Å
1076	V	91.5	Very high	90.4	Very high	8 Å²	8	64.3 Å²	64.3	5%	0.048	32%	0.324	C	S	.	.			trans	-111.1	133.4	164.7	177.8	0	0	0	0	107.8	V1086 L1088 M1107 N1111 V1113 L1129 Y1131	V1076-V1086 HydrophobicContact CG1-CG1 3.88Å; V1076-L1088 HydrophobicContact CG2-CD1 4.13Å; V1076-M1107 HydrophobicContact CB-CE 4.13Å; V1076-M1107 HydrophobicContact CG2-CE 3.95Å; V1076-N1111 PolarHBondContact N-O 2.79Å; V1076-N1111 PolarHBondContact O-ND2 3.44Å; V1076-V1113 HydrophobicContact CG2-CG2 3.9Å; V1076-L1129 HydrophobicContact CG2-CD1 3.89Å; V1076-L1129 HydrophobicContact CG2-CD2 4.35Å; V1076-Y1131 HydrophobicContact CG1-CG 4.48Å
1077	P	90.1	Very high	90.4	Very high	29 Å²	29	61.7 Å²	61.7	19%	0.188	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-62.4	144	178.7	22.9	-30.3	0	0	0	111.3	V1086 N1111 Y1131	P1077-V1086 HydrophobicContact CG-CG1 3.98Å; P1077-V1086 HydrophobicContact CG-CG2 4.3Å; P1077-V1086 WeakPolarHBondContact O-CG1 3.5Å; P1077-N1111 PolarHBondContact O-ND2 2.89Å; P1077-Y1131 HydrophobicContact CG-CD2 4.05Å; P1077-Y1131 HydrophobicContact CG-CE2 3.55Å
1078	V	87.8	Confident	90.4	Very high	111 Å²	111	56.8 Å²	56.8	67%	0.673	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-96.3	146	168.1	-177.7	0	0	0	0	107.3	N1111	V1078-N1111 HydrophobicContact CG2-CB 3.57Å
1079	S	85.9	Confident	90.5	Very high	44 Å²	44	59.3 Å²	59.3	31%	0.308	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-78.3	139.2	174.2	-170.4	0	0	0	0	111.6	E1081 I1084	S1079-E1081 PolarHBondContact OG-N 2.81Å; S1079-E1081 PolarHBondContact OG-O 2.9Å; S1079-I1084 VanDerWaalsContact CB-O 3.27Å; S1079-I1084 WeakPolarHBondContact CB-O 3.22Å; S1079-I1084 WeakPolarHBondContact OG-CB 3.49Å; S1079-I1084 PolarHBondContact OG-O 3.24Å
1080	A	80.8	Confident	90.6	Very high	103 Å²	103	56.6 Å²	56.6	85%	0.851	31%	0.309	S	S	*	.	S	Bend	trans	-92.9	-12.8	169.2	0	0	0	0	0	113.4
1081	E	83.2	Confident	90.6	Very high	94 Å²	94	57.4 Å²	57.4	44%	0.439	32%	0.315	S	S	.	.	S	Bend	trans	-136.5	141	-178.7	-74.9	-168.6	-143.3	0	0	112.2	S1079 K1083 I1084	S1079-E1081 PolarHBondContact OG-N 2.81Å; S1079-E1081 PolarHBondContact OG-O 2.9Å; E1081-K1083 PolarHBondContact O-N 2.89Å; E1081-K1083 WeakPolarHBondContact OE2-CE 3.38Å; E1081-K1083 IonicContact OE2-NZ 3.25Å; E1081-K1083 PolarHBondContact OE2-NZ 2.7Å; E1081-I1084 HydrophobicContact CB-CD1 4.44Å; E1081-I1084 PolarHBondContact O-N 2.84Å; E1081-I1084 VanDerWaalsContact O-O 3.1Å
1082	D	83.4	Confident	90.4	Very high	158 Å²	158	61.9 Å²	61.9	85%	0.845	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-23.2	176.2	-75.5	-19.9	0	0	0	114.6	I1084	D1082-I1084 VanDerWaalsContact C-N 3.32Å
1083	K	84.7	Confident	90	Very high	90 Å²	90	63 Å²	63	39%	0.391	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-31	175.8	-54.6	-171.7	-150.1	124.2	0	112.6	E1081 P1136 E1139	E1081-K1083 PolarHBondContact O-N 2.89Å; E1081-K1083 WeakPolarHBondContact OE2-CE 3.38Å; E1081-K1083 IonicContact OE2-NZ 3.25Å; E1081-K1083 PolarHBondContact OE2-NZ 2.7Å; K1083-P1136 HydrophobicContact CB-CG 4.1Å; K1083-P1136 HydrophobicContact CD-CG 3.9Å; K1083-E1139 WeakPolarHBondContact CD-OE2 3.32Å; K1083-E1139 WeakPolarHBondContact CE-OE2 3.4Å; K1083-E1139 VanDerWaalsContact NZ-CD 3.34Å; K1083-E1139 IonicContact NZ-OE1 3.19Å; K1083-E1139 PolarHBondContact NZ-OE1 2.83Å; K1083-E1139 IonicContact NZ-OE2 3.97Å; K1083-E1139 PolarHBondContact NZ-OE2 2.75Å
1084	I	86.1	Confident	89.4	Confident	38 Å²	38	70 Å²	70	20%	0.195	38%	0.379	C	S	.	.			trans	-95.9	127.4	-175	-63.4	167.1	0	0	0	108.3	S1079 E1081 D1082 V1133 E1134 H1135 L1141	S1079-I1084 VanDerWaalsContact CB-O 3.27Å; S1079-I1084 WeakPolarHBondContact CB-O 3.22Å; S1079-I1084 WeakPolarHBondContact OG-CB 3.49Å; S1079-I1084 PolarHBondContact OG-O 3.24Å; E1081-I1084 HydrophobicContact CB-CD1 4.44Å; E1081-I1084 PolarHBondContact O-N 2.84Å; E1081-I1084 VanDerWaalsContact O-O 3.1Å; D1082-I1084 VanDerWaalsContact C-N 3.32Å; I1084-V1133 HydrophobicContact CG2-CG1 3.71Å; I1084-E1134 CarbonylContact C-O 3.55Å; I1084-E1134 VanDerWaalsContact CA-O 3.29Å; I1084-E1134 WeakPolarHBondContact CA-O 3.49Å; I1084-H1135 HydrophobicContact CG1-CB 4.29Å; I1084-L1141 HydrophobicContact CD1-CD2 3.81Å; I1084-L1141 HydrophobicContact CG1-CD2 4.1Å; I1084-L1141 HydrophobicContact CG2-CD2 4.1Å
1085	K	89.9	Confident	88.8	Confident	106 Å²	106	74.7 Å²	74.7	46%	0.461	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	122.8	179.8	-56.4	177.7	-173.4	167.4	0	111	V1133 E1134	K1085-V1133 CarbonylContact O-C 3.6Å; K1085-V1133 WeakPolarHBondContact O-CA 3.43Å; K1085-E1134 HydrophobicContact CB-CB 4.21Å; K1085-E1134 PolarHBondContact N-O 3.5Å; K1085-E1134 PolarHBondContact O-N 2.84Å
1086	V	90.6	Very high	88.4	Confident	39 Å²	39	74.2 Å²	74.2	24%	0.236	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	119.8	175	-171.6	0	0	0	0	109.5	V1076 P1077 Y1131 S1132 V1133	V1076-V1086 HydrophobicContact CG1-CG1 3.88Å; P1077-V1086 HydrophobicContact CG-CG1 3.98Å; P1077-V1086 HydrophobicContact CG-CG2 4.3Å; P1077-V1086 WeakPolarHBondContact O-CG1 3.5Å; V1086-Y1131 HydrophobicContact CG1-CD2 4.16Å; V1086-S1132 WeakPolarHBondContact CA-O 3.26Å; V1086-V1133 HydrophobicContact CG2-CG2 4.32Å
1087	N	91.5	Very high	88	Confident	63 Å²	63	79.5 Å²	79.5	34%	0.337	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	119.5	177.6	-60.9	-60.9	0	0	0	110.1	L1089 Y1131 S1132 E1134	N1087-L1089 PolarHBondContact O-N 2.89Å; N1087-Y1131 CarbonylContact O-C 3.41Å; N1087-Y1131 WeakPolarHBondContact O-CA 3.28Å; N1087-Y1131 WeakPolarHBondContact O-CB 3.43Å; N1087-S1132 PolarHBondContact N-O 3.19Å; N1087-S1132 PolarHBondContact O-N 3.37Å; N1087-E1134 PolarHBondContact ND2-OE1 3.24Å
1088	L	93.7	Very high	87.8	Confident	49 Å²	49	84.2 Å²	84.2	26%	0.257	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	124.8	170.4	-179.6	64.5	0	0	0	110.2	V1076 E1090 I1093 M1107 V1113 L1129	V1076-L1088 HydrophobicContact CG2-CD1 4.13Å; L1088-E1090 WeakPolarHBondContact CD1-O 3.45Å; L1088-I1093 HydrophobicContact CD2-CD1 3.73Å; L1088-I1093 HydrophobicContact CD2-CG1 4.14Å; L1088-M1107 HydrophobicContact CD2-CE 3.95Å; L1088-V1113 HydrophobicContact CD2-CG2 4.26Å; L1088-L1129 HydrophobicContact CD1-CD1 3.73Å
1089	L	93.8	Very high	87.7	Confident	60 Å²	60	84.5 Å²	84.5	31%	0.314	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	-50.8	-178	-55.5	177.9	0	0	0	111.4	T1053 N1087 T1092 K1130	T1053-L1089 HydrophobicContact CG2-CD1 3.96Å; N1087-L1089 PolarHBondContact O-N 2.89Å; L1089-T1092 PolarHBondContact O-OG1 3Å; L1089-K1130 WeakPolarHBondContact CA-O 3.38Å; L1089-K1130 HydrophobicContact CB-CB 4.4Å; L1089-K1130 HydrophobicContact CB-CD 4.13Å; L1089-K1130 HydrophobicContact CB-CG 4.23Å; L1089-K1130 WeakPolarHBondContact CB-O 3.4Å; L1089-K1130 HydrophobicContact CD1-CD 4.11Å; L1089-K1130 HydrophobicContact CD1-CG 4.18Å; L1089-K1130 PolarHBondContact N-O 3.46Å
1090	E	94.4	Very high	87.8	Confident	70 Å²	70	84.6 Å²	84.6	33%	0.327	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	134.5	176.8	-57.8	163.5	-140.3	0	0	108.4	L1088 T1128 L1129 K1130	L1088-E1090 WeakPolarHBondContact CD1-O 3.45Å; E1090-T1128 HydrophobicContact CB-CG2 4.17Å; E1090-T1128 VanDerWaalsContact OE2-CG2 3.25Å; E1090-T1128 WeakPolarHBondContact OE2-CG2 3.31Å; E1090-L1129 CarbonylContact O-C 3.51Å; E1090-L1129 WeakPolarHBondContact O-CA 3.43Å; E1090-K1130 HydrophobicContact CB-CB 3.81Å; E1090-K1130 HydrophobicContact CG-CB 4.2Å; E1090-K1130 HydrophobicContact CG-CD 4.22Å; E1090-K1130 PolarHBondContact N-O 2.92Å; E1090-K1130 PolarHBondContact O-N 3.05Å; E1090-K1130 WeakPolarHBondContact OE1-CD 3.39Å; E1090-K1130 IonicContact OE1-NZ 3.48Å
1091	P	95.3	Very high	88	Confident	17 Å²	17	85.6 Å²	85.6	11%	0.11	42%	0.418	C	S	.	.	S	Bend	cis	-72.9	148.7	-5.3	31.8	-35.7	0	0	0	112.2	I1093 I1105 V1113 W1115	P1091-I1093 HydrophobicContact CG-CD1 4.43Å; P1091-I1093 HydrophobicContact CG-CG1 4.31Å; P1091-I1093 PolarHBondContact O-N 3.29Å; P1091-I1105 HydrophobicContact CB-CD1 4.13Å; P1091-I1105 HydrophobicContact CB-CG2 3.83Å; P1091-I1105 HydrophobicContact CG-CG2 3.5Å; P1091-V1113 HydrophobicContact CG-CG1 3.84Å; P1091-W1115 HydrophobicContact CG-CZ2 4.09Å
1092	T	92.6	Very high	88.2	Confident	127 Å²	127	88.2 Å²	88.2	78%	0.779	43%	0.434	S	S	*	.			trans	-77.1	85.8	-178.6	-45.3	0	0	0	0	111.8	L1089 K1094	L1089-T1092 PolarHBondContact O-OG1 3Å; T1092-K1094 PolarHBondContact O-N 2.9Å
1093	I	90	Very high	88.6	Confident	25 Å²	25	85 Å²	85	13%	0.128	41%	0.41	C	S	.	.			trans	-79.8	116	179.5	-58.6	172.7	0	0	0	110.1	L1088 P1091 H1095 P1096 I1105 M1107 V1113	L1088-I1093 HydrophobicContact CD2-CD1 3.73Å; L1088-I1093 HydrophobicContact CD2-CG1 4.14Å; P1091-I1093 HydrophobicContact CG-CD1 4.43Å; P1091-I1093 HydrophobicContact CG-CG1 4.31Å; P1091-I1093 PolarHBondContact O-N 3.29Å; I1093-H1095 PolarHBondContact O-N 3.42Å; I1093-P1096 HydrophobicContact CG2-CB 4.2Å; I1093-I1105 HydrophobicContact CD1-CG2 4.31Å; I1093-I1105 HydrophobicContact CG1-CG2 4.11Å; I1093-M1107 HydrophobicContact CD1-CB 4.06Å; I1093-V1113 HydrophobicContact CD1-CG1 4.23Å; I1093-V1113 HydrophobicContact CD1-CG2 4.16Å
1094	K	84.6	Confident	89	Confident	161 Å²	161	84.6 Å²	84.6	70%	0.7	42%	0.417	S	S	*	.	S	Bend	trans	-76.9	114.5	171.4	-65.7	-177.7	-178.6	-180	0	110	T1092 R1103	T1092-K1094 PolarHBondContact O-N 2.9Å; K1094-R1103 PolarHBondContact O-NH1 2.81Å
1095	H	83.1	Confident	89.4	Confident	103 Å²	103	85.7 Å²	85.7	48%	0.477	42%	0.423	S	S	.	.			trans	66.1	68.1	-173.2	-60	-74.3	0	0	0	114.1	I1093 E1097 K1098	I1093-H1095 PolarHBondContact O-N 3.42Å; H1095-E1097 WeakPolarHBondContact CA-OE2 3.44Å; H1095-E1097 WeakPolarHBondContact CB-OE1 3.48Å; H1095-E1097 WeakPolarHBondContact CB-OE2 3.28Å; H1095-E1097 IonicContact CE1-OE1 3.39Å; H1095-E1097 IonicContact CG-OE1 2.69Å; H1095-E1097 IonicContact CG-OE2 2.84Å; H1095-E1097 IonicContact ND1-OE1 2.69Å; H1095-E1097 PolarHBondContact ND1-OE1 3.31Å; H1095-E1097 IonicContact ND1-OE2 3.97Å; H1095-E1097 PolarHBondContact O-N 2.92Å; H1095-K1098 HydrophobicContact CB-CB 4.29Å; H1095-K1098 HydrophobicContact CB-CD 4.26Å; H1095-K1098 PolarHBondContact O-N 2.78Å; H1095-K1098 VanDerWaalsContact O-N 3.16Å
1096	P	82.9	Confident	89.6	Confident	63 Å²	63	81.3 Å²	81.3	41%	0.409	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-20.3	174.6	30.4	-35.5	0	0	0	112.4	I1093 K1098 M1107	I1093-P1096 HydrophobicContact CG2-CB 4.2Å; P1096-K1098 PolarHBondContact O-N 3.44Å; P1096-M1107 HydrophobicContact CB-CB 3.98Å; P1096-M1107 HydrophobicContact CB-CG 4.39Å
1097	E	83.2	Confident	89.7	Confident	120 Å²	120	79.9 Å²	79.9	56%	0.561	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-1.9	175.4	83.3	-64.3	166.9	0	0	113.9	H1095	H1095-E1097 WeakPolarHBondContact CA-OE2 3.44Å; H1095-E1097 WeakPolarHBondContact CB-OE1 3.48Å; H1095-E1097 WeakPolarHBondContact CB-OE2 3.28Å; H1095-E1097 IonicContact CE1-OE1 3.39Å; H1095-E1097 IonicContact CG-OE1 2.69Å; H1095-E1097 IonicContact CG-OE2 2.84Å; H1095-E1097 IonicContact ND1-OE1 2.69Å; H1095-E1097 PolarHBondContact ND1-OE1 3.31Å; H1095-E1097 IonicContact ND1-OE2 3.97Å; H1095-E1097 PolarHBondContact O-N 2.92Å
1098	K	86	Confident	89.6	Confident	128 Å²	128	78 Å²	78	56%	0.557	38%	0.384	S	S	*	.	S	Bend	trans	-130.6	103.2	-176.7	-67.6	173	-171.9	150.4	0	111.3	H1095 P1096 D1100	H1095-K1098 HydrophobicContact CB-CB 4.29Å; H1095-K1098 HydrophobicContact CB-CD 4.26Å; H1095-K1098 PolarHBondContact O-N 2.78Å; H1095-K1098 VanDerWaalsContact O-N 3.16Å; P1096-K1098 PolarHBondContact O-N 3.44Å; K1098-D1100 PolarHBondContact O-N 3.33Å
1099	Y	86.9	Confident	89.4	Confident	116 Å²	116	84.3 Å²	84.3	46%	0.455	41%	0.41	S	S	.	.			trans	-65.3	122.6	172	-169.5	-102.9	0	0	0	111.2	K1101 R1106 M1107 N1108 E1114	Y1099-K1101 HydrophobicContact CE1-CB 4.08Å; Y1099-R1106 HydrophobicContact CD2-CG 4.36Å; Y1099-R1106 HydrophobicContact CE2-CG 3.94Å; Y1099-R1106 PolarHBondContact OH-NE 2.82Å; Y1099-M1107 WeakPolarHBondContact CD2-O 3.08Å; Y1099-N1108 HydrophobicContact CD2-CB 3.97Å; Y1099-N1108 HydrophobicContact CE2-CB 3.77Å; Y1099-E1114 WeakPolarHBondContact CE2-OE2 3.37Å; Y1099-E1114 PolarHBondContact OH-OE2 3.13Å
1100	D	87.2	Confident	89.1	Confident	47 Å²	47	87.5 Å²	87.5	25%	0.251	42%	0.421	S	S	.	.			trans	-127.6	99.9	177.6	-179	-2.4	0	0	0	108.4	K1098 N1102 R1103 R1106	K1098-D1100 PolarHBondContact O-N 3.33Å; D1100-N1102 PolarHBondContact O-N 2.83Å; D1100-N1102 WeakPolarHBondContact OD1-CB 3.33Å; D1100-N1102 PolarHBondContact OD1-N 2.84Å; D1100-N1102 PolarHBondContact OD1-ND2 3.13Å; D1100-R1103 HydrophobicContact CB-CG 3.98Å; D1100-R1103 PolarHBondContact O-N 2.85Å; D1100-R1103 WeakPolarHBondContact OD2-CG 3.43Å; D1100-R1103 IonicContact OD2-CZ 3.69Å; D1100-R1103 IonicContact OD2-NE 3.66Å; D1100-R1103 PolarHBondContact OD2-NE 2.86Å; D1100-R1103 IonicContact OD2-NH2 4Å; D1100-R1106 VanDerWaalsContact O-CD 3.32Å; D1100-R1106 WeakPolarHBondContact O-CD 3.48Å
1101	K	84.5	Confident	88.9	Confident	124 Å²	124	86.3 Å²	86.3	54%	0.539	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-16.8	-177.8	-167.8	174.2	-178.8	177.2	0	112.6	E1018 Y1099	E1018-K1101 IonicContact OE1-NZ 3.29Å; E1018-K1101 PolarHBondContact OE1-NZ 2.87Å; Y1099-K1101 HydrophobicContact CE1-CB 4.08Å
1102	N	87.8	Confident	88.8	Confident	148 Å²	148	87.5 Å²	87.5	79%	0.791	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-9	179.6	-48.1	-76.2	0	0	0	113.5	D1100	D1100-N1102 PolarHBondContact O-N 2.83Å; D1100-N1102 WeakPolarHBondContact OD1-CB 3.33Å; D1100-N1102 PolarHBondContact OD1-N 2.84Å; D1100-N1102 PolarHBondContact OD1-ND2 3.13Å
1103	R	91.9	Very high	88.9	Confident	90 Å²	90	81.5 Å²	81.5	34%	0.34	39%	0.385	S	S	.	.	S	Bend	trans	-88.3	138.7	179.3	-67.5	-178.2	-171.5	-162.1	3.8	111.5	K1094 D1100 I1105 R1106	K1094-R1103 PolarHBondContact O-NH1 2.81Å; D1100-R1103 HydrophobicContact CB-CG 3.98Å; D1100-R1103 PolarHBondContact O-N 2.85Å; D1100-R1103 WeakPolarHBondContact OD2-CG 3.43Å; D1100-R1103 IonicContact OD2-CZ 3.69Å; D1100-R1103 IonicContact OD2-NE 3.66Å; D1100-R1103 PolarHBondContact OD2-NE 2.86Å; D1100-R1103 IonicContact OD2-NH2 4Å; R1103-I1105 PolarHBondContact O-N 2.83Å; R1103-R1106 PolarHBondContact O-NH1 2.73Å
1104	P	92.9	Very high	89.3	Confident	82 Å²	82	81 Å²	81	53%	0.532	38%	0.383	S	S	.	.	S	Bend	trans	-72	-15.9	176.4	31.2	-36.2	0	0	0	112.8	W1115 D1116	P1104-W1115 CarbonylContact O-C 3.55Å; P1104-W1115 VanDerWaalsContact O-CA 3.31Å; P1104-W1115 WeakPolarHBondContact O-CA 3.5Å; P1104-D1116 PolarHBondContact O-N 2.95Å
1105	I	94.6	Very high	89.9	Confident	62 Å²	62	73.6 Å²	73.6	32%	0.318	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	127.8	172.3	-48.5	-179.6	0	0	0	108.5	P1091 I1093 R1103 V1113 E1114 W1115	P1091-I1105 HydrophobicContact CB-CD1 4.13Å; P1091-I1105 HydrophobicContact CB-CG2 3.83Å; P1091-I1105 HydrophobicContact CG-CG2 3.5Å; I1093-I1105 HydrophobicContact CD1-CG2 4.31Å; I1093-I1105 HydrophobicContact CG1-CG2 4.11Å; R1103-I1105 PolarHBondContact O-N 2.83Å; I1105-V1113 HydrophobicContact CG2-CG1 4.21Å; I1105-E1114 WeakPolarHBondContact CA-O 3.23Å; I1105-W1115 HydrophobicContact CG1-CG 4.5Å
1106	R	94.6	Very high	90.5	Very high	13 Å²	13	70.5 Å²	70.5	5%	0.049	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	159.1	-173.2	60.5	-163.3	179	-102.6	-10.4	111.2	M1071 Y1099 D1100 R1103 E1114	M1071-R1106 PolarHBondContact SD-NH2 2.81Å; Y1099-R1106 HydrophobicContact CD2-CG 4.36Å; Y1099-R1106 HydrophobicContact CE2-CG 3.94Å; Y1099-R1106 PolarHBondContact OH-NE 2.82Å; D1100-R1106 VanDerWaalsContact O-CD 3.32Å; D1100-R1106 WeakPolarHBondContact O-CD 3.48Å; R1103-R1106 PolarHBondContact O-NH1 2.73Å; R1106-E1114 HydrophobicContact CG-CB 3.95Å; R1106-E1114 IonicContact CZ-OE2 3.63Å; R1106-E1114 PolarHBondContact N-O 3.3Å; R1106-E1114 VanDerWaalsContact N-O 3.12Å; R1106-E1114 IonicContact NE-OE2 2.73Å; R1106-E1114 PolarHBondContact NE-OE2 3.38Å; R1106-E1114 IonicContact NH2-OE2 2.65Å; R1106-E1114 PolarHBondContact NH2-OE2 2.98Å; R1106-E1114 PolarHBondContact O-N 3.24Å
1107	M	92.3	Very high	91.1	Very high	10 Å²	10	68 Å²	68	5%	0.049	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	132.1	173.7	-175.6	66.3	90.4	0	0	108.5	V1076 L1088 I1093 P1096 Y1099 N1112 V1113	V1076-M1107 HydrophobicContact CB-CE 4.13Å; V1076-M1107 HydrophobicContact CG2-CE 3.95Å; L1088-M1107 HydrophobicContact CD2-CE 3.95Å; I1093-M1107 HydrophobicContact CD1-CB 4.06Å; P1096-M1107 HydrophobicContact CB-CB 3.98Å; P1096-M1107 HydrophobicContact CB-CG 4.39Å; Y1099-M1107 WeakPolarHBondContact CD2-O 3.08Å; M1107-N1112 VanDerWaalsContact SD-O 3.36Å; M1107-V1113 HydrophobicContact CE-CG2 3.73Å; M1107-V1113 HydrophobicContact SD-CG2 3.89Å
1108	N	90.4	Very high	91.6	Very high	24 Å²	24	64.8 Å²	64.8	13%	0.128	31%	0.307	C	S	.	.			trans	-97.1	173.7	179.6	83	19.2	0	0	0	113.1	Y1099 F1110 N1111 N1112 E1114	Y1099-N1108 HydrophobicContact CD2-CB 3.97Å; Y1099-N1108 HydrophobicContact CE2-CB 3.77Å; N1108-F1110 PolarHBondContact O-N 2.9Å; N1108-F1110 WeakPolarHBondContact OD1-CB 3.39Å; N1108-F1110 PolarHBondContact OD1-N 2.77Å; N1108-N1111 PolarHBondContact O-N 2.88Å; N1108-N1112 PolarHBondContact N-O 2.68Å; N1108-N1112 PolarHBondContact OD1-N 3.45Å; N1108-E1114 HydrophobicContact CB-CG 4.44Å; N1108-E1114 VanDerWaalsContact CB-OE1 3.26Å; N1108-E1114 WeakPolarHBondContact CB-OE1 3.39Å; N1108-E1114 PolarHBondContact ND2-OE1 2.84Å
1109	K	88.7	Confident	92.1	Very high	181 Å²	181	58.7 Å²	58.7	79%	0.787	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-10.4	-174.8	69.9	165.7	-170.4	165.9	0	115.4
1110	F	86.8	Confident	92.6	Very high	127 Å²	127	53.6 Å²	53.6	56%	0.557	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	13.3	177.4	-57.4	-72.5	0	0	0	112.2	N1108 N1112	N1108-F1110 PolarHBondContact O-N 2.9Å; N1108-F1110 WeakPolarHBondContact OD1-CB 3.39Å; N1108-F1110 PolarHBondContact OD1-N 2.77Å; F1110-N1112 PolarHBondContact O-N 3.49Å
1111	N	90.1	Very high	93	Very high	45 Å²	45	55 Å²	55	24%	0.241	28%	0.275	C	S	.	.	S	Bend	trans	59.7	28.5	-173.6	-151.6	49	0	0	0	114.3	V1076 P1077 V1078 N1108	V1076-N1111 PolarHBondContact N-O 2.79Å; V1076-N1111 PolarHBondContact O-ND2 3.44Å; P1077-N1111 PolarHBondContact O-ND2 2.89Å; V1078-N1111 HydrophobicContact CG2-CB 3.57Å; N1108-N1111 PolarHBondContact O-N 2.88Å
1112	N	93.9	Very high	93.5	Very high	42 Å²	42	51.1 Å²	51.1	23%	0.225	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	136.3	171.5	-61.4	-25.1	0	0	0	110.6	V1073 D1074 Q1075 M1107 N1108 F1110	V1073-N1112 HydrophobicContact CG1-CB 3.82Å; D1074-N1112 CarbonylContact O-C 3.55Å; D1074-N1112 VanDerWaalsContact O-CA 3.28Å; D1074-N1112 WeakPolarHBondContact O-CA 3.38Å; Q1075-N1112 VanDerWaalsContact CA-OD1 3.27Å; Q1075-N1112 WeakPolarHBondContact CA-OD1 3.31Å; Q1075-N1112 WeakPolarHBondContact CB-OD1 3.04Å; M1107-N1112 VanDerWaalsContact SD-O 3.36Å; N1108-N1112 PolarHBondContact N-O 2.68Å; N1108-N1112 PolarHBondContact OD1-N 3.45Å; F1110-N1112 PolarHBondContact O-N 3.49Å
1113	V	95.5	Very high	94	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	128.9	172.9	177.7	0	0	0	0	108.9	V1073 D1074 V1076 L1088 P1091 I1093 I1105 M1107 W1115 L1129	V1073-V1113 WeakPolarHBondContact CA-O 3.45Å; D1074-V1113 PolarHBondContact N-O 3.12Å; D1074-V1113 VanDerWaalsContact N-O 3.15Å; D1074-V1113 PolarHBondContact O-N 2.99Å; V1076-V1113 HydrophobicContact CG2-CG2 3.9Å; L1088-V1113 HydrophobicContact CD2-CG2 4.26Å; P1091-V1113 HydrophobicContact CG-CG1 3.84Å; I1093-V1113 HydrophobicContact CD1-CG1 4.23Å; I1093-V1113 HydrophobicContact CD1-CG2 4.16Å; I1105-V1113 HydrophobicContact CG2-CG1 4.21Å; M1107-V1113 HydrophobicContact CE-CG2 3.73Å; M1107-V1113 HydrophobicContact SD-CG2 3.89Å; V1113-W1115 HydrophobicContact CB-CE3 4.48Å; V1113-W1115 HydrophobicContact CB-CH2 3.88Å; V1113-W1115 HydrophobicContact CB-CZ2 4.37Å; V1113-W1115 HydrophobicContact CB-CZ3 3.94Å; V1113-W1115 HydrophobicContact CG1-CD2 3.9Å; V1113-W1115 HydrophobicContact CG1-CE3 3.89Å; V1113-W1115 HydrophobicContact CG1-CH2 3.6Å; V1113-W1115 HydrophobicContact CG1-CZ2 3.63Å; V1113-W1115 HydrophobicContact CG1-CZ3 3.74Å; V1113-W1115 WeakPolarHBondContact O-CZ3 3.36Å; V1113-L1129 HydrophobicContact CB-CD1 4.42Å; V1113-L1129 HydrophobicContact CG2-CD1 3.92Å
1114	E	96.7	Very high	94.3	Very high	15 Å²	15	46.9 Å²	46.9	7%	0.07	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	124.1	175.3	-62.3	176.5	-174.4	0	0	109.4	M1071 V1072 V1073 Y1099 I1105 R1106 N1108	M1071-E1114 HydrophobicContact SD-CB 4.38Å; M1071-E1114 HydrophobicContact SD-CG 4.35Å; V1072-E1114 WeakPolarHBondContact O-CA 3.42Å; V1073-E1114 HydrophobicContact CG1-CG 4.42Å; V1073-E1114 HydrophobicContact CG2-CG 4.28Å; Y1099-E1114 WeakPolarHBondContact CE2-OE2 3.37Å; Y1099-E1114 PolarHBondContact OH-OE2 3.13Å; I1105-E1114 WeakPolarHBondContact CA-O 3.23Å; R1106-E1114 HydrophobicContact CG-CB 3.95Å; R1106-E1114 IonicContact CZ-OE2 3.63Å; R1106-E1114 PolarHBondContact N-O 3.3Å; R1106-E1114 VanDerWaalsContact N-O 3.12Å; R1106-E1114 IonicContact NE-OE2 2.73Å; R1106-E1114 PolarHBondContact NE-OE2 3.38Å; R1106-E1114 IonicContact NH2-OE2 2.65Å; R1106-E1114 PolarHBondContact NH2-OE2 2.98Å; R1106-E1114 PolarHBondContact O-N 3.24Å; N1108-E1114 HydrophobicContact CB-CG 4.44Å; N1108-E1114 VanDerWaalsContact CB-OE1 3.26Å; N1108-E1114 WeakPolarHBondContact CB-OE1 3.39Å; N1108-E1114 PolarHBondContact ND2-OE1 2.84Å
1115	W	97.2	Very high	94.5	Very high	6 Å²	6	46.6 Å²	46.6	2%	0.023	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	114.4	168.5	-59.1	-105	0	0	0	109.7	M1071 V1072 D1074 P1091 P1104 I1105 V1113 L1117 L1127 L1129	M1071-W1115 CarbonylContact C-O 3.38Å; M1071-W1115 VanDerWaalsContact CA-O 3.28Å; M1071-W1115 WeakPolarHBondContact CA-O 3.29Å; V1072-W1115 HydrophobicContact CB-CB 4.45Å; V1072-W1115 HydrophobicContact CB-CE3 4.16Å; V1072-W1115 HydrophobicContact CG1-CE3 4.17Å; V1072-W1115 HydrophobicContact CG1-CZ3 4.46Å; V1072-W1115 PolarHBondContact N-O 3.04Å; V1072-W1115 PolarHBondContact O-N 2.96Å; D1074-W1115 HydrophobicContact CB-CH2 4.25Å; D1074-W1115 HydrophobicContact CB-CZ3 3.93Å; P1091-W1115 HydrophobicContact CG-CZ2 4.09Å; P1104-W1115 CarbonylContact O-C 3.55Å; P1104-W1115 VanDerWaalsContact O-CA 3.31Å; P1104-W1115 WeakPolarHBondContact O-CA 3.5Å; I1105-W1115 HydrophobicContact CG1-CG 4.5Å; V1113-W1115 HydrophobicContact CB-CE3 4.48Å; V1113-W1115 HydrophobicContact CB-CH2 3.88Å; V1113-W1115 HydrophobicContact CB-CZ2 4.37Å; V1113-W1115 HydrophobicContact CB-CZ3 3.94Å; V1113-W1115 HydrophobicContact CG1-CD2 3.9Å; V1113-W1115 HydrophobicContact CG1-CE3 3.89Å; V1113-W1115 HydrophobicContact CG1-CH2 3.6Å; V1113-W1115 HydrophobicContact CG1-CZ2 3.63Å; V1113-W1115 HydrophobicContact CG1-CZ3 3.74Å; V1113-W1115 WeakPolarHBondContact O-CZ3 3.36Å; W1115-L1117 HydrophobicContact CB-CD2 3.95Å; W1115-L1117 HydrophobicContact CB-CG 4.2Å; W1115-L1127 HydrophobicContact CB-CD1 4.24Å; W1115-L1127 HydrophobicContact CD2-CD1 3.85Å; W1115-L1127 HydrophobicContact CE3-CD1 4.15Å; W1115-L1127 HydrophobicContact CG-CD1 3.93Å; W1115-L1127 HydrophobicContact CG-CD2 4.29Å; W1115-L1129 HydrophobicContact CH2-CB 3.95Å; W1115-L1129 HydrophobicContact CH2-CD1 4.18Å; W1115-L1129 HydrophobicContact CH2-CD2 4.42Å; W1115-L1129 HydrophobicContact CH2-CG 4.42Å; W1115-L1129 HydrophobicContact CZ2-CB 4.19Å; W1115-L1129 HydrophobicContact CZ2-CD1 4.42Å
1116	D	95.4	Very high	94.6	Very high	38 Å²	38	48.9 Å²	48.9	20%	0.203	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	106.2	170.2	-176.7	-7.3	0	0	0	108.9	P1104	P1104-D1116 PolarHBondContact O-N 2.95Å
1117	L	95.9	Very high	94.7	Very high	11 Å²	11	48.8 Å²	48.8	6%	0.058	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	115.6	-173.2	-54	-180	0	0	0	111	V1060 R1069 L1070 V1072 W1115 L1119 L1127	V1060-L1117 HydrophobicContact CG2-CD1 3.69Å; R1069-L1117 CarbonylContact C-O 3.57Å; R1069-L1117 WeakPolarHBondContact CA-O 3.45Å; L1070-L1117 PolarHBondContact N-O 2.64Å; L1070-L1117 WeakPolarHBondContact O-CB 3.35Å; L1070-L1117 PolarHBondContact O-N 3.38Å; V1072-L1117 HydrophobicContact CG2-CD1 3.85Å; W1115-L1117 HydrophobicContact CB-CD2 3.95Å; W1115-L1117 HydrophobicContact CB-CG 4.2Å; L1117-L1119 HydrophobicContact CB-CD2 4.43Å; L1117-L1119 HydrophobicContact CB-CG 4.19Å; L1117-L1127 HydrophobicContact CD1-CD1 4.2Å; L1117-L1127 HydrophobicContact CD1-CD2 4.1Å; L1117-L1127 HydrophobicContact CD2-CD2 4.05Å
1118	D	94.9	Very high	94.9	Very high	52 Å²	52	49.7 Å²	49.7	28%	0.278	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	109.8	164	-170.7	10.4	0	0	0	109.4	R1067 R1069 R1125	R1067-D1118 WeakPolarHBondContact CD-OD1 3.39Å; R1067-D1118 WeakPolarHBondContact CG-OD1 3.46Å; R1067-D1118 IonicContact CZ-OD1 3.11Å; R1067-D1118 IonicContact CZ-OD2 3.32Å; R1067-D1118 IonicContact NE-OD1 3.64Å; R1067-D1118 IonicContact NH1-OD1 3.19Å; R1067-D1118 PolarHBondContact NH1-OD1 2.8Å; R1067-D1118 IonicContact NH1-OD2 2.71Å; R1067-D1118 PolarHBondContact NH1-OD2 2.92Å; R1069-D1118 HydrophobicContact CG-CB 4.43Å; D1118-R1125 PolarHBondContact O-NH1 3.46Å; D1118-R1125 PolarHBondContact O-NH2 3.21Å
1119	L	96.2	Very high	95.2	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	127.6	-173.1	-65.3	171.5	0	0	0	111.1	V1060 N1062 R1067 V1068 L1070 L1117 E1123 R1125	V1060-L1119 HydrophobicContact CG2-CD1 4.16Å; N1062-L1119 HydrophobicContact CB-CB 4.11Å; N1062-L1119 HydrophobicContact CB-CD1 4.46Å; R1067-L1119 CarbonylContact C-O 3.5Å; R1067-L1119 WeakPolarHBondContact CA-O 3.38Å; V1068-L1119 PolarHBondContact N-O 3.22Å; V1068-L1119 PolarHBondContact O-N 2.84Å; L1070-L1119 HydrophobicContact CB-CD1 4.26Å; L1070-L1119 HydrophobicContact CD2-CD1 4.09Å; L1117-L1119 HydrophobicContact CB-CD2 4.43Å; L1117-L1119 HydrophobicContact CB-CG 4.19Å; L1119-E1123 WeakPolarHBondContact CA-OE2 3.31Å; L1119-E1123 HydrophobicContact CD2-CG 4.38Å; L1119-R1125 HydrophobicContact CD2-CB 3.78Å
1120	G	96.6	Very high	95.6	Very high	9 Å²	9	41.6 Å²	41.6	9%	0.093	22%	0.219	C	C	.	.			trans	-68.7	167	172.8	0	0	0	0	0	113.6	N1062 G1122 E1123	N1062-G1120 PolarHBondContact ND2-O 3.42Å; G1120-G1122 PolarHBondContact O-N 3.42Å; G1120-E1123 PolarHBondContact N-OE2 3.41Å; G1120-E1123 VanDerWaalsContact O-CB 3.25Å; G1120-E1123 WeakPolarHBondContact O-CB 3.34Å; G1120-E1123 PolarHBondContact O-N 2.86Å
1121	P	96.4	Very high	95.9	Very high	77 Å²	77	37 Å²	37	50%	0.5	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	129.7	172.8	-24.4	34.5	0	0	0	111.4	F1064 D1065 E1123	F1064-P1121 WeakPolarHBondContact O-CA 3.2Å; D1065-P1121 VanDerWaalsContact O-CB 3.31Å; D1065-P1121 WeakPolarHBondContact O-CB 3.34Å; D1065-P1121 WeakPolarHBondContact O-CG 3.42Å; P1121-E1123 PolarHBondContact O-N 2.93Å; P1121-E1123 VanDerWaalsContact O-N 3.14Å
1122	G	95.4	Very high	96	Very high	42 Å²	42	35.3 Å²	35.3	43%	0.433	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	2.1	-177.3	0	0	0	0	0	116.3	N1062 F1064 G1120	N1062-G1122 CarbonylContact O-C 3.55Å; N1062-G1122 WeakPolarHBondContact O-CA 3.38Å; N1062-G1122 PolarHBondContact O-N 3.36Å; F1064-G1122 PolarHBondContact O-N 2.94Å; G1120-G1122 PolarHBondContact O-N 3.42Å
1123	E	97.7	Very high	95.9	Very high	62 Å²	62	33.7 Å²	33.7	29%	0.29	18%	0.182	S	C	.	.			trans	-67.7	136.7	-174.5	-167.1	-173.3	149.6	0	0	112	R1061 N1062 L1119 G1120 P1121 R1125	R1061-E1123 WeakPolarHBondContact CA-O 3.37Å; N1062-E1123 PolarHBondContact N-O 3.24Å; L1119-E1123 WeakPolarHBondContact CA-OE2 3.31Å; L1119-E1123 HydrophobicContact CD2-CG 4.38Å; G1120-E1123 PolarHBondContact N-OE2 3.41Å; G1120-E1123 VanDerWaalsContact O-CB 3.25Å; G1120-E1123 WeakPolarHBondContact O-CB 3.34Å; G1120-E1123 PolarHBondContact O-N 2.86Å; P1121-E1123 PolarHBondContact O-N 2.93Å; P1121-E1123 VanDerWaalsContact O-N 3.14Å; E1123-R1125 VanDerWaalsContact CD-NH2 3.34Å; E1123-R1125 IonicContact OE1-CZ 3.72Å; E1123-R1125 IonicContact OE1-NE 3.19Å; E1123-R1125 PolarHBondContact OE1-NE 3.41Å; E1123-R1125 IonicContact OE1-NH2 2.83Å; E1123-R1125 PolarHBondContact OE1-NH2 2.98Å; E1123-R1125 IonicContact OE2-NH2 3.81Å; E1123-R1125 PolarHBondContact OE2-NH2 3.31Å
1124	I	97.2	Very high	95.6	Very high	87 Å²	87	36.2 Å²	36.2	45%	0.446	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	133.3	169.5	-54.7	174.6	0	0	0	108.2	E1059 V1060 R1061	E1059-I1124 HydrophobicContact CG-CG2 3.7Å; V1060-I1124 CarbonylContact O-C 3.59Å; V1060-I1124 WeakPolarHBondContact O-CA 3.34Å; R1061-I1124 HydrophobicContact CB-CG1 4.03Å; R1061-I1124 HydrophobicContact CG-CD1 4.47Å; R1061-I1124 HydrophobicContact CG-CG1 3.74Å
1125	R	97.3	Very high	95	Very high	75 Å²	75	36.2 Å²	36.2	28%	0.283	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	127.6	178.1	-164.5	175.3	-68.7	172.6	0.9	110.2	V1060 D1118 L1119 E1123	V1060-R1125 HydrophobicContact CG2-CB 4.24Å; V1060-R1125 PolarHBondContact N-O 2.97Å; V1060-R1125 PolarHBondContact O-N 2.86Å; D1118-R1125 PolarHBondContact O-NH1 3.46Å; D1118-R1125 PolarHBondContact O-NH2 3.21Å; L1119-R1125 HydrophobicContact CD2-CB 3.78Å; E1123-R1125 VanDerWaalsContact CD-NH2 3.34Å; E1123-R1125 IonicContact OE1-CZ 3.72Å; E1123-R1125 IonicContact OE1-NE 3.19Å; E1123-R1125 PolarHBondContact OE1-NE 3.41Å; E1123-R1125 IonicContact OE1-NH2 2.83Å; E1123-R1125 PolarHBondContact OE1-NH2 2.98Å; E1123-R1125 IonicContact OE2-NH2 3.81Å; E1123-R1125 PolarHBondContact OE2-NH2 3.31Å
1126	E	97.3	Very high	94.3	Very high	110 Å²	110	37 Å²	37	51%	0.514	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	136.2	173.5	-171.8	178.9	79.8	0	0	110.1	L1057 I1058	L1057-E1126 HydrophobicContact CD2-CG 4.26Å; I1058-E1126 CarbonylContact O-C 3.6Å
1127	L	97.1	Very high	93.4	Very high	12 Å²	12	38.8 Å²	38.8	6%	0.063	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	142.4	171.7	-49.6	178.2	0	0	0	109.2	I1058 V1072 W1115 L1117	I1058-L1127 HydrophobicContact CB-CB 4.28Å; I1058-L1127 PolarHBondContact N-O 3.32Å; I1058-L1127 PolarHBondContact O-N 2.88Å; V1072-L1127 HydrophobicContact CB-CD1 3.85Å; V1072-L1127 HydrophobicContact CG1-CD1 3.85Å; V1072-L1127 HydrophobicContact CG2-CD1 3.88Å; W1115-L1127 HydrophobicContact CB-CD1 4.24Å; W1115-L1127 HydrophobicContact CD2-CD1 3.85Å; W1115-L1127 HydrophobicContact CE3-CD1 4.15Å; W1115-L1127 HydrophobicContact CG-CD1 3.93Å; W1115-L1127 HydrophobicContact CG-CD2 4.29Å; L1117-L1127 HydrophobicContact CD1-CD1 4.2Å; L1117-L1127 HydrophobicContact CD1-CD2 4.1Å; L1117-L1127 HydrophobicContact CD2-CD2 4.05Å
1128	T	96.8	Very high	92.4	Very high	28 Å²	28	45.6 Å²	45.6	17%	0.172	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	131	165.4	-66.5	0	0	0	0	109.3	K1055 L1057 E1090 K1130	K1055-T1128 HydrophobicContact CD-CG2 3.94Å; K1055-T1128 VanDerWaalsContact CE-CG2 3.45Å; K1055-T1128 HydrophobicContact CG-CG2 3.98Å; K1055-T1128 PolarHBondContact NZ-OG1 3.43Å; K1055-T1128 VanDerWaalsContact NZ-OG1 3.16Å; L1057-T1128 WeakPolarHBondContact CD2-OG1 3.31Å; E1090-T1128 HydrophobicContact CB-CG2 4.17Å; E1090-T1128 VanDerWaalsContact OE2-CG2 3.25Å; E1090-T1128 WeakPolarHBondContact OE2-CG2 3.31Å; T1128-K1130 HydrophobicContact CG2-CB 4.07Å
1129	L	96.8	Very high	91.1	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	126.7	158.9	179.2	64.1	0	0	0	107.8	K1055 Q1056 D1074 V1076 L1088 E1090 V1113 W1115 Y1131	K1055-L1129 CarbonylContact C-O 3.58Å; K1055-L1129 WeakPolarHBondContact CA-O 3.19Å; Q1056-L1129 HydrophobicContact CB-CB 4.23Å; Q1056-L1129 PolarHBondContact N-O 2.96Å; Q1056-L1129 PolarHBondContact O-N 2.77Å; D1074-L1129 HydrophobicContact CB-CD2 4.05Å; V1076-L1129 HydrophobicContact CG2-CD1 3.89Å; V1076-L1129 HydrophobicContact CG2-CD2 4.35Å; L1088-L1129 HydrophobicContact CD1-CD1 3.73Å; E1090-L1129 CarbonylContact O-C 3.51Å; E1090-L1129 WeakPolarHBondContact O-CA 3.43Å; V1113-L1129 HydrophobicContact CB-CD1 4.42Å; V1113-L1129 HydrophobicContact CG2-CD1 3.92Å; W1115-L1129 HydrophobicContact CH2-CB 3.95Å; W1115-L1129 HydrophobicContact CH2-CD1 4.18Å; W1115-L1129 HydrophobicContact CH2-CD2 4.42Å; W1115-L1129 HydrophobicContact CH2-CG 4.42Å; W1115-L1129 HydrophobicContact CZ2-CB 4.19Å; W1115-L1129 HydrophobicContact CZ2-CD1 4.42Å; L1129-Y1131 HydrophobicContact CG-CD1 4.47Å
1130	K	96	Very high	89.7	Confident	35 Å²	35	54 Å²	54	15%	0.152	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	126.5	-177.8	-171.3	-167.9	176.9	-173.2	0	109.8	Y1039 T1053 F1054 K1055 L1089 E1090 T1128	Y1039-K1130 VanDerWaalsContact OH-CE 3.23Å; Y1039-K1130 WeakPolarHBondContact OH-CE 3.36Å; Y1039-K1130 PolarHBondContact OH-NZ 3.33Å; T1053-K1130 HydrophobicContact CG2-CD 4.33Å; T1053-K1130 HydrophobicContact CG2-CG 4.01Å; F1054-K1130 VanDerWaalsContact O-CA 3.24Å; F1054-K1130 WeakPolarHBondContact O-CA 3.32Å; F1054-K1130 VanDerWaalsContact O-CG 3.29Å; F1054-K1130 WeakPolarHBondContact O-CG 3.46Å; K1055-K1130 HydrophobicContact CB-CG 4.23Å; L1089-K1130 WeakPolarHBondContact CA-O 3.38Å; L1089-K1130 HydrophobicContact CB-CB 4.4Å; L1089-K1130 HydrophobicContact CB-CD 4.13Å; L1089-K1130 HydrophobicContact CB-CG 4.23Å; L1089-K1130 WeakPolarHBondContact CB-O 3.4Å; L1089-K1130 HydrophobicContact CD1-CD 4.11Å; L1089-K1130 HydrophobicContact CD1-CG 4.18Å; L1089-K1130 PolarHBondContact N-O 3.46Å; E1090-K1130 HydrophobicContact CB-CB 3.81Å; E1090-K1130 HydrophobicContact CG-CB 4.2Å; E1090-K1130 HydrophobicContact CG-CD 4.22Å; E1090-K1130 PolarHBondContact N-O 2.92Å; E1090-K1130 PolarHBondContact O-N 3.05Å; E1090-K1130 WeakPolarHBondContact OE1-CD 3.39Å; E1090-K1130 IonicContact OE1-NZ 3.48Å; T1128-K1130 HydrophobicContact CG2-CB 4.07Å
1131	Y	94.4	Very high	88.3	Confident	30 Å²	30	56 Å²	56	12%	0.118	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	153.7	175.7	57.4	-93.4	0	0	0	110.1	F1054 V1076 P1077 V1086 N1087 L1129 V1133	F1054-Y1131 HydrophobicContact CB-CD2 4.1Å; F1054-Y1131 HydrophobicContact CB-CE1 4.11Å; F1054-Y1131 HydrophobicContact CB-CE2 3.65Å; F1054-Y1131 AromaticContact CD2-CD2 3.91Å; F1054-Y1131 HydrophobicContact CD2-CD2 3.91Å; F1054-Y1131 AromaticContact CD2-CE2 3.42Å; F1054-Y1131 HydrophobicContact CD2-CE2 3.42Å; F1054-Y1131 VanDerWaalsContact CD2-CE2 3.42Å; F1054-Y1131 HydrophobicContact CE2-CE2 4.19Å; F1054-Y1131 HydrophobicContact CG-CD2 4.33Å; F1054-Y1131 AromaticContact CG-CE2 3.64Å; F1054-Y1131 HydrophobicContact CG-CE2 3.64Å; F1054-Y1131 AromaticContact CG-CZ 3.92Å; F1054-Y1131 PolarHBondContact N-O 2.74Å; F1054-Y1131 PolarHBondContact O-N 3.29Å; V1076-Y1131 HydrophobicContact CG1-CG 4.48Å; P1077-Y1131 HydrophobicContact CG-CD2 4.05Å; P1077-Y1131 HydrophobicContact CG-CE2 3.55Å; V1086-Y1131 HydrophobicContact CG1-CD2 4.16Å; N1087-Y1131 CarbonylContact O-C 3.41Å; N1087-Y1131 WeakPolarHBondContact O-CA 3.28Å; N1087-Y1131 WeakPolarHBondContact O-CB 3.43Å; L1129-Y1131 HydrophobicContact CG-CD1 4.47Å; Y1131-V1133 HydrophobicContact CD2-CG2 4.05Å; Y1131-V1133 HydrophobicContact CE2-CG2 4.1Å
1132	S	92.5	Very high	86.7	Confident	9 Å²	9	57.3 Å²	57.3	6%	0.063	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	146.5	169.5	59.1	0	0	0	0	111.1	M1052 V1086 N1087	M1052-S1132 CarbonylContact O-C 3.52Å; M1052-S1132 WeakPolarHBondContact O-CA 3.43Å; V1086-S1132 WeakPolarHBondContact CA-O 3.26Å; N1087-S1132 PolarHBondContact N-O 3.19Å; N1087-S1132 PolarHBondContact O-N 3.37Å
1133	V	91.1	Very high	85.1	Confident	9 Å²	9	60.4 Å²	60.4	6%	0.055	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	117.1	173.2	-173.7	0	0	0	0	107.8	T1051 M1052 F1054 I1084 K1085 V1086 Y1131 L1141	T1051-V1133 WeakPolarHBondContact CA-O 3.21Å; M1052-V1133 PolarHBondContact N-O 2.71Å; M1052-V1133 PolarHBondContact O-N 3.29Å; F1054-V1133 HydrophobicContact CD2-CG2 4.02Å; F1054-V1133 HydrophobicContact CE2-CB 4.16Å; F1054-V1133 HydrophobicContact CE2-CG2 3.66Å; I1084-V1133 HydrophobicContact CG2-CG1 3.71Å; K1085-V1133 CarbonylContact O-C 3.6Å; K1085-V1133 WeakPolarHBondContact O-CA 3.43Å; V1086-V1133 HydrophobicContact CG2-CG2 4.32Å; Y1131-V1133 HydrophobicContact CD2-CG2 4.05Å; Y1131-V1133 HydrophobicContact CE2-CG2 4.1Å; V1133-L1141 HydrophobicContact CB-CD1 4.24Å; V1133-L1141 HydrophobicContact CG1-CD1 3.73Å; V1133-L1141 HydrophobicContact CG1-CD2 3.96Å
1134	E	89.2	Confident	82.9	Confident	53 Å²	53	62.7 Å²	62.7	25%	0.248	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	132.8	168.7	-61.3	169.9	-149.9	0	0	109.2	A1050 T1051 I1084 K1085 N1087	A1050-E1134 CarbonylContact O-C 3.56Å; A1050-E1134 VanDerWaalsContact O-CA 3.29Å; A1050-E1134 WeakPolarHBondContact O-CA 3.42Å; T1051-E1134 HydrophobicContact CG2-CG 4.25Å; I1084-E1134 CarbonylContact C-O 3.55Å; I1084-E1134 VanDerWaalsContact CA-O 3.29Å; I1084-E1134 WeakPolarHBondContact CA-O 3.49Å; K1085-E1134 HydrophobicContact CB-CB 4.21Å; K1085-E1134 PolarHBondContact N-O 3.5Å; K1085-E1134 PolarHBondContact O-N 2.84Å; N1087-E1134 PolarHBondContact ND2-OE1 3.24Å
1135	H	84.2	Confident	80.6	Confident	14 Å²	14	63.1 Å²	63.1	7%	0.065	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	161.6	177.6	70.1	115.1	0	0	0	110.9	N1049 A1050 I1084 E1139 L1141	N1049-H1135 CarbonylContact C-O 3.59Å; N1049-H1135 WeakPolarHBondContact CA-O 3.13Å; N1049-H1135 WeakPolarHBondContact CB-O 3.35Å; A1050-H1135 PolarHBondContact N-O 3.29Å; A1050-H1135 PolarHBondContact O-N 3.13Å; I1084-H1135 HydrophobicContact CG1-CB 4.29Å; H1135-E1139 PolarHBondContact ND1-O 2.99Å; H1135-L1141 HydrophobicContact CB-CD1 4.21Å; H1135-L1141 HydrophobicContact CB-CD2 3.94Å; H1135-L1141 HydrophobicContact CB-CG 4.03Å
1136	P	83	Confident	78.1	Confident	24 Å²	24	64.3 Å²	64.3	16%	0.156	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	144	174.6	-22.8	36	0	0	0	112.3	K1083 N1138 E1139	K1083-P1136 HydrophobicContact CB-CG 4.1Å; K1083-P1136 HydrophobicContact CD-CG 3.9Å; P1136-N1138 PolarHBondContact O-N 3.37Å; P1136-N1138 VanDerWaalsContact O-N 3.16Å; P1136-E1139 HydrophobicContact CB-CB 4.15Å; P1136-E1139 HydrophobicContact CB-CG 4.1Å; P1136-E1139 HydrophobicContact CG-CB 4.38Å; P1136-E1139 HydrophobicContact CG-CG 4.37Å; P1136-E1139 PolarHBondContact O-N 3.12Å
1137	I	74.8	Confident	75.1	Confident	74 Å²	74	64.5 Å²	64.5	38%	0.379	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-23.4	-178	-79.1	174	0	0	0	113.7	G1047 K1048 A1050	G1047-I1137 WeakPolarHBondContact O-CD1 3.49Å; K1048-I1137 PolarHBondContact O-N 3.36Å; K1048-I1137 VanDerWaalsContact O-N 3.09Å; A1050-I1137 HydrophobicContact CB-CG1 3.92Å
1138	N	74.8	Confident	71.8	Confident	154 Å²	154	73.1 Å²	73.1	82%	0.824	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	9.8	-176	-58.8	11.4	0	0	0	113.3	P1136	P1136-N1138 PolarHBondContact O-N 3.37Å; P1136-N1138 VanDerWaalsContact O-N 3.16Å
1139	E	68.4	Low	70.6	Confident	77 Å²	77	75.4 Å²	75.4	36%	0.36	42%	0.416	S	S	.	.	S	Bend	trans	-128.3	119	-177.9	-64.3	179.1	-169.2	0	0	108.9	K1083 H1135 P1136	K1083-E1139 WeakPolarHBondContact CD-OE2 3.32Å; K1083-E1139 WeakPolarHBondContact CE-OE2 3.4Å; K1083-E1139 VanDerWaalsContact NZ-CD 3.34Å; K1083-E1139 IonicContact NZ-OE1 3.19Å; K1083-E1139 PolarHBondContact NZ-OE1 2.83Å; K1083-E1139 IonicContact NZ-OE2 3.97Å; K1083-E1139 PolarHBondContact NZ-OE2 2.75Å; H1135-E1139 PolarHBondContact ND1-O 2.99Å; P1136-E1139 HydrophobicContact CB-CB 4.15Å; P1136-E1139 HydrophobicContact CB-CG 4.1Å; P1136-E1139 HydrophobicContact CG-CB 4.38Å; P1136-E1139 HydrophobicContact CG-CG 4.37Å; P1136-E1139 PolarHBondContact O-N 3.12Å
1140	D	66.7	Low	69.2	Low	151 Å²	151	79.3 Å²	79.3	81%	0.807	44%	0.438	S	S	*	.			trans	-73.7	148.7	-179.9	-93.4	-26.4	0	0	0	112.6
1141	L	67.1	Low	67.7	Low	53 Å²	53	81.7 Å²	81.7	28%	0.277	45%	0.454	S	S	.	.			trans	-91.8	101.7	177.3	-77.6	170.5	0	0	0	110.7	I1084 V1133 H1135	I1084-L1141 HydrophobicContact CD1-CD2 3.81Å; I1084-L1141 HydrophobicContact CG1-CD2 4.1Å; I1084-L1141 HydrophobicContact CG2-CD2 4.1Å; V1133-L1141 HydrophobicContact CB-CD1 4.24Å; V1133-L1141 HydrophobicContact CG1-CD1 3.73Å; V1133-L1141 HydrophobicContact CG1-CD2 3.96Å; H1135-L1141 HydrophobicContact CB-CD1 4.21Å; H1135-L1141 HydrophobicContact CB-CD2 3.94Å; H1135-L1141 HydrophobicContact CB-CG 4.03Å
1142	D	62.8	Low	66.1	Low	104 Å²	104	84.8 Å²	84.8	56%	0.556	47%	0.473	S	S	*	.			trans	-84.9	150.6	159	-142.5	-46.6	0	0	0	110.6	R421	R421-D1142 IonicContact CZ-OD2 2.68Å; R421-D1142 VanDerWaalsContact CZ-OD2 3.26Å; R421-D1142 IonicContact NH1-OD2 3.04Å; R421-D1142 PolarHBondContact NH1-OD2 3.46Å; R421-D1142 IonicContact NH2-OD2 3.28Å; R421-D1142 PolarHBondContact NH2-OD2 3.43Å
1143	V	61.5	Low	64.5	Low	106 Å²	106	89.5 Å²	89.5	64%	0.642	50%	0.499	S	S	*	.			trans	-139.2	80.2	-174.9	-173.4	0	0	0	0	109.5
1144	S	51.5	Low	62.7	Low	111 Å²	111	94.9 Å²	94.9	78%	0.776	53%	0.529	S	S	*	.			trans	-71.6	153.6	172.1	55.2	0	0	0	0	112
1145	V	49.5	Very low	60.8	Low	96 Å²	96	97.9 Å²	97.9	58%	0.582	55%	0.549	S	S	*	.			trans	-106	121.3	166.1	178.9	0	0	0	0	107.1	E1147	V1145-E1147 PolarHBondContact O-N 2.85Å
1146	S	43.8	Very low	59	Low	99 Å²	99	104.3 Å²	104.3	69%	0.692	59%	0.586	S	S	*	*			trans	-82.1	111.3	169.9	58.5	0	0	0	0	109.7
1147	E	34.6	Very low	57	Low	114 Å²	114	111 Å²	111	53%	0.533	62%	0.622	S	S	.	*			trans	-62.1	155.3	162.4	-66.5	-133.8	110.6	0	0	111	V1145	V1145-E1147 PolarHBondContact O-N 2.85Å
1148	N	28.8	Very low	55.4	Low	193 Å²	193	114.4 Å²	114.4	100%	1.032	64%	0.644	S	S	*	*			trans	-145.2	0	-164.6	-124.7	-26.3	0	0	0	111.3

Retrieved 1,148 of 1,148 residues in 1341.6 ms (Link to these results)

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