A0A3Q0KNB7_SCHMA Loading...

C2H2-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KNB7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,444 aa.

						>A0A3Q0KNB7_SCHMA|A0A3Q0KNB7
MKALAQHAISLHDIDKSNVFFKCGHCDRSMNSPTELKSHLRKYSLVLFHCCFPNCRVKSKSVEIIKKHALKFHGTNSPLVTTTYSFMCSWPSSVRPIRIQAHAPDISKLSRRVPSAFFCAHCSFGTSHLENFAQHLAMCRAISSHLLITSLSVTCVLHRCSECGWMTNVRNMLTEHLHDIHPLLSEEDGVITEDFTVPISDESITENYNFISKNMETLRNSPLQQLPNFFSSGNSTLLHNNDGTTLHNDLPLLCSTASNLSAEVTKHLSSIHAPSSIDSCEADEVGDNEEHIGVEGDNDELKKPGTDMNLNNRPVTSNLPPDIVDSKQESVTETAAEEYVQLYFNEQAFVTAYMKNEKFNPNNDTTSDELNGVLEKLRRFASYRVPILGRANQRRVAGCPECLKPFNHGFTDLKKHLLVTHLGVRRDISRFTIDFTHSGRSHHSTLPSQTNNSLIYPDNSPQSKHSFGIRNGRLSGKAFRRKPFPIAPLPSPLCKRPTPGKYEDSRKSPTEPLATVSSDGLPTLVTSGSSYSGGAPVHRVIPGTGVSDHYEDMRSLEEVSAQAPIGRGGIVPLDEMGNPIVAAVVAAGQPQTSTYSGGTEIFLPKVGRQRVQLAYSFPVFNRLLEAYQVPMPERIQLVNRMNHYARMHVIMDVLVPGGAQKRFSCPTCMYTSVHSLADIRKHIMGSHCGISTKRFRLCLRASRHDTTTYRLHSDDRMIRFVEDHRRRQIQLTDARSNIKVTSNDSDAEETKEDSNETYSQIMNDENNQFPNDFTKSQVSFNDQEELETQTIETDLYDDSHQEGVHGADEESDNRFLTANVNLNSEDYFVTPTKTHDNSTVVASDTPNTYSDENAKQNEEIHRRIELPFSDNVLRVLLEREGMFDQYDDLVVKMQVYSKHHLTVVSRGNRIYSYICICGRRFAVVRDEVESDIRPASLADCRRHILGVHARIPQELLTLCCQASRISKESGYKLYADTSLLALAEQHKFRSTRIQSYSRKSEGGISPIKRPLEPIIPNDIEGISELSVPTSSVNSVNQRSNTSYSSMGFNHSAPSQVALHHSSSYSSNHPLTPMLRAPTVKYELSEPDESPPLEYNKPNGKTSSNMNSTKSPEPNPYSFEERHNGLDLEAPRRILTPEESVTWSQKLGLPASWALERIVRLLYSPAVFDHQVRSVLPDGDSFISSLHERMKVYARHSVYITRMRETPNLTQRIYVCCACLTTSHHGFGDVRKHILGVHAHVPERFKSAAMCSSRLNRDDYFLYTDSQLLMLANSPGRNANISALGAASSKTQSHLNHNSAPHKHRQNDSDNSSPQNTPNRKRRFSGTESDSIDLGIKTESSSQLVPDEILHTAHLNGHSAFPPDISTKPYEEHDEHRPPIILTIPRPKAFHPSDQPDDLPVRLSSINSAKPIDEYINSDNAYSSSGSRSRRSMILKSKRPCPTST
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.3	Very low	62.3	Low	139 Å²	139	94.9 Å²	94.9	69%	0.685	51%	0.514	S	S	*	.				0	-72.9	0	-74.8	-153.6	-76.4	0	0	113.2	A3 L4 A5 F21 L36	M1-A3 PolarHBondContact O-N 2.68Å; M1-L4 WeakPolarHBondContact O-CA 3.41Å; M1-L4 PolarHBondContact O-N 2.85Å; M1-A5 PolarHBondContact O-N 2.76Å; M1-A5 VanDerWaalsContact O-N 3.09Å; M1-F21 HydrophobicContact SD-CD1 4.49Å; M1-L36 HydrophobicContact CE-CD2 3.8Å; M1-L36 HydrophobicContact CE-CG 4.38Å; M1-L36 HydrophobicContact SD-CD2 3.74Å
2	K	56.5	Low	62.4	Low	166 Å²	166	97.5 Å²	97.5	72%	0.722	52%	0.52	S	S	*	.	H	α-helix	trans	-43	-55.6	-176.4	-83.9	-166.5	173.3	-171.6	0	114.1	L4 A5 Q6	K2-L4 VanDerWaalsContact C-N 3.26Å; K2-L4 PolarHBondContact O-N 3.21Å; K2-A5 PolarHBondContact O-N 3.14Å; K2-Q6 WeakPolarHBondContact O-CG 3.4Å; K2-Q6 PolarHBondContact O-N 2.94Å; K2-Q6 PolarHBondContact O-OE1 2.9Å
3	A	64.7	Low	62.1	Low	76 Å²	76	102.5 Å²	102.5	63%	0.628	55%	0.547	S	S	*	.	H	α-helix	trans	-58.1	-30.9	178.7	0	0	0	0	0	114.9	M1 H7	M1-A3 PolarHBondContact O-N 2.68Å; A3-H7 VanDerWaalsContact O-CB 3.3Å; A3-H7 WeakPolarHBondContact O-CB 3.42Å; A3-H7 PolarHBondContact O-N 3.39Å
4	L	56.6	Low	62	Low	131 Å²	131	100 Å²	100	69%	0.686	53%	0.532	S	S	*	.	H	α-helix	trans	-81.4	-34.5	-179.2	-158.3	153.6	0	0	0	111.4	M1 K2 H7 A8	M1-L4 WeakPolarHBondContact O-CA 3.41Å; M1-L4 PolarHBondContact O-N 2.85Å; K2-L4 VanDerWaalsContact C-N 3.26Å; K2-L4 PolarHBondContact O-N 3.21Å; L4-H7 PolarHBondContact O-N 3.25Å; L4-A8 PolarHBondContact O-N 2.56Å
5	A	61.8	Low	62.3	Low	18 Å²	18	100.1 Å²	100.1	15%	0.149	53%	0.533	C	S	.	.	H	α-helix	trans	-66.7	-41	168	0	0	0	0	0	111.4	M1 K2 A8 I9 V19 F21	M1-A5 PolarHBondContact O-N 2.76Å; M1-A5 VanDerWaalsContact O-N 3.09Å; K2-A5 PolarHBondContact O-N 3.14Å; A5-A8 PolarHBondContact O-N 3.48Å; A5-I9 WeakPolarHBondContact O-CD1 3.28Å; A5-I9 VanDerWaalsContact O-CG1 3.3Å; A5-I9 WeakPolarHBondContact O-CG1 3.35Å; A5-I9 PolarHBondContact O-N 2.79Å; A5-V19 HydrophobicContact CB-CG1 4.39Å; A5-F21 HydrophobicContact CB-CE1 4.31Å; A5-F21 HydrophobicContact CB-CZ 4.18Å
6	Q	64.2	Low	62.3	Low	124 Å²	124	103.8 Å²	103.8	58%	0.579	54%	0.543	S	S	*	.	H	α-helix	trans	-61.3	-44.7	173.6	-70.9	170.4	-82.7	0	0	111.6	K2 A8 I9 S10	K2-Q6 WeakPolarHBondContact O-CG 3.4Å; K2-Q6 PolarHBondContact O-N 2.94Å; K2-Q6 PolarHBondContact O-OE1 2.9Å; Q6-A8 PolarHBondContact O-N 2.96Å; Q6-I9 PolarHBondContact O-N 3.01Å; Q6-S10 WeakPolarHBondContact O-CB 3.27Å; Q6-S10 PolarHBondContact O-N 3.08Å; Q6-S10 PolarHBondContact O-OG 2.85Å; Q6-S10 VanDerWaalsContact O-OG 3.11Å
7	H	68.5	Low	62.3	Low	105 Å²	105	102.8 Å²	102.8	49%	0.486	55%	0.547	S	S	.	.	H	α-helix	trans	-58.1	-43.1	173.9	177.4	-66.8	0	0	0	112.7	A3 L4 S10 L11	A3-H7 VanDerWaalsContact O-CB 3.3Å; A3-H7 WeakPolarHBondContact O-CB 3.42Å; A3-H7 PolarHBondContact O-N 3.39Å; L4-H7 PolarHBondContact O-N 3.25Å; H7-S10 WeakPolarHBondContact CA-OG 3.37Å; H7-S10 PolarHBondContact O-N 3.18Å; H7-S10 PolarHBondContact O-OG 2.97Å; H7-S10 VanDerWaalsContact O-OG 3.13Å; H7-L11 VanDerWaalsContact CE1-CD1 3.41Å; H7-L11 WeakPolarHBondContact CE1-CD1 3.32Å; H7-L11 WeakPolarHBondContact NE2-CD1 3.22Å; H7-L11 WeakPolarHBondContact O-CB 3.34Å; H7-L11 PolarHBondContact O-N 3.44Å
8	A	59.9	Low	62.4	Low	26 Å²	26	102.9 Å²	102.9	22%	0.215	55%	0.547	C	S	.	.	H	α-helix	trans	-63.6	-44.7	177.9	0	0	0	0	0	112	L4 A5 Q6 S10 H12	L4-A8 PolarHBondContact O-N 2.56Å; A5-A8 PolarHBondContact O-N 3.48Å; Q6-A8 PolarHBondContact O-N 2.96Å; A8-S10 VanDerWaalsContact C-N 3.35Å; A8-S10 PolarHBondContact O-N 3.39Å; A8-H12 PolarHBondContact O-N 3.44Å
9	I	65.9	Low	62.6	Low	59 Å²	59	99.3 Å²	99.3	30%	0.303	53%	0.53	S	S	.	.	H	α-helix	trans	-63.8	-39	176.3	-65	162.3	0	0	0	110.9	A5 Q6 K16 V19	A5-I9 WeakPolarHBondContact O-CD1 3.28Å; A5-I9 VanDerWaalsContact O-CG1 3.3Å; A5-I9 WeakPolarHBondContact O-CG1 3.35Å; A5-I9 PolarHBondContact O-N 2.79Å; Q6-I9 PolarHBondContact O-N 3.01Å; I9-K16 HydrophobicContact CD1-CG 4.39Å; I9-K16 HydrophobicContact CG2-CG 4.48Å; I9-V19 HydrophobicContact CD1-CG2 4.4Å; I9-V19 HydrophobicContact CG1-CG2 3.94Å
10	S	69	Low	63	Low	88 Å²	88	101.3 Å²	101.3	62%	0.615	53%	0.534	S	S	*	.	H	α-helix	trans	-81.3	-15.4	-174	63.5	0	0	0	0	116	Q6 H7 A8	Q6-S10 WeakPolarHBondContact O-CB 3.27Å; Q6-S10 PolarHBondContact O-N 3.08Å; Q6-S10 PolarHBondContact O-OG 2.85Å; Q6-S10 VanDerWaalsContact O-OG 3.11Å; H7-S10 WeakPolarHBondContact CA-OG 3.37Å; H7-S10 PolarHBondContact O-N 3.18Å; H7-S10 PolarHBondContact O-OG 2.97Å; H7-S10 VanDerWaalsContact O-OG 3.13Å; A8-S10 VanDerWaalsContact C-N 3.35Å; A8-S10 PolarHBondContact O-N 3.39Å
11	L	68.6	Low	63.5	Low	112 Å²	112	98 Å²	98	59%	0.586	52%	0.515	S	S	*	.	H	α-helix	trans	-121	-10.2	-171.2	-80.9	162.8	0	0	0	115.5	H7	H7-L11 VanDerWaalsContact CE1-CD1 3.41Å; H7-L11 WeakPolarHBondContact CE1-CD1 3.32Å; H7-L11 WeakPolarHBondContact NE2-CD1 3.22Å; H7-L11 WeakPolarHBondContact O-CB 3.34Å; H7-L11 PolarHBondContact O-N 3.44Å
12	H	64.2	Low	64.9	Low	126 Å²	126	96.4 Å²	96.4	58%	0.583	50%	0.504	S	S	*	.	S	Bend	trans	-124.1	5.2	-177.1	-64.2	-67.2	0	0	0	114	A8 I14	A8-H12 PolarHBondContact O-N 3.44Å; H12-I14 HydrophobicContact CB-CD1 3.55Å; H12-I14 HydrophobicContact CB-CG1 3.63Å; H12-I14 PolarHBondContact O-N 3.41Å; H12-I14 VanDerWaalsContact O-N 3.14Å
13	D	58.1	Low	65.9	Low	163 Å²	163	88.6 Å²	88.6	87%	0.872	47%	0.471	S	S	*	.			trans	50.8	33.4	-175.3	-143.5	13.9	0	0	0	113.1	D15	D13-D15 PolarHBondContact O-N 3.44Å
14	I	60.7	Low	66.4	Low	67 Å²	67	88.4 Å²	88.4	34%	0.344	48%	0.476	S	S	.	.			trans	-80	114.5	-178.7	-65.8	171	0	0	0	108.3	H12 N18 V19	H12-I14 HydrophobicContact CB-CD1 3.55Å; H12-I14 HydrophobicContact CB-CG1 3.63Å; H12-I14 PolarHBondContact O-N 3.41Å; H12-I14 VanDerWaalsContact O-N 3.14Å; I14-N18 HydrophobicContact CG2-CB 3.78Å; I14-V19 HydrophobicContact CG2-CG2 4.02Å
15	D	67.3	Low	67.1	Low	102 Å²	102	86.9 Å²	86.9	55%	0.545	47%	0.465	S	S	.	.			trans	-52.9	140.1	173.5	-176.8	24.2	0	0	0	111.2	D13 S17 N18	D13-D15 PolarHBondContact O-N 3.44Å; D15-S17 PolarHBondContact O-N 3.44Å; D15-S17 VanDerWaalsContact O-N 3.08Å; D15-S17 PolarHBondContact OD2-OG 3.35Å; D15-N18 WeakPolarHBondContact O-CB 3.44Å; D15-N18 PolarHBondContact O-N 2.98Å
16	K	61.8	Low	67.8	Low	158 Å²	158	87.8 Å²	87.8	69%	0.687	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-61.4	-25.8	-169.8	-68.3	171.9	-176.3	162.6	0	112.7	I9 N18 V19	I9-K16 HydrophobicContact CD1-CG 4.39Å; I9-K16 HydrophobicContact CG2-CG 4.48Å; K16-N18 PolarHBondContact O-N 3.36Å; K16-V19 PolarHBondContact O-N 2.83Å
17	S	62.6	Low	68.4	Low	87 Å²	87	86.4 Å²	86.4	61%	0.608	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-55.6	-32.5	171.3	56.8	0	0	0	0	113.7	D15	D15-S17 PolarHBondContact O-N 3.44Å; D15-S17 VanDerWaalsContact O-N 3.08Å; D15-S17 PolarHBondContact OD2-OG 3.35Å
18	N	63.4	Low	68.7	Low	105 Å²	105	89 Å²	89	56%	0.561	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-90.2	2.3	-172.4	-66.6	-52.9	0	0	0	114.2	I14 D15 K16 F20	I14-N18 HydrophobicContact CG2-CB 3.78Å; D15-N18 WeakPolarHBondContact O-CB 3.44Å; D15-N18 PolarHBondContact O-N 2.98Å; K16-N18 PolarHBondContact O-N 3.36Å; N18-F20 WeakPolarHBondContact O-CD1 3.36Å
19	V	65.8	Low	69.5	Low	35 Å²	35	91.3 Å²	91.3	21%	0.212	49%	0.486	C	S	.	.			trans	-100.1	92.7	-176.1	-175.3	0	0	0	0	111.4	A5 I9 I14 K16	A5-V19 HydrophobicContact CB-CG1 4.39Å; I9-V19 HydrophobicContact CD1-CG2 4.4Å; I9-V19 HydrophobicContact CG1-CG2 3.94Å; I14-V19 HydrophobicContact CG2-CG2 4.02Å; K16-V19 PolarHBondContact O-N 2.83Å
20	F	70.2	Confident	70.2	Confident	138 Å²	138	89 Å²	89	61%	0.605	48%	0.475	S	S	*	.			trans	-100.4	147.6	179.6	55.1	-90.2	0	0	0	113.8	N18	N18-F20 WeakPolarHBondContact O-CD1 3.36Å
21	F	74.7	Confident	70.5	Confident	33 Å²	33	91.3 Å²	91.3	15%	0.145	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	96.9	-179.2	-63.9	-84.6	0	0	0	111.1	M1 A5 M30 P33 L36	M1-F21 HydrophobicContact SD-CD1 4.49Å; A5-F21 HydrophobicContact CB-CE1 4.31Å; A5-F21 HydrophobicContact CB-CZ 4.18Å; F21-M30 WeakPolarHBondContact CB-O 3.44Å; F21-M30 PolarHBondContact N-O 3.32Å; F21-M30 PolarHBondContact O-N 3.39Å; F21-P33 HydrophobicContact CD1-CG 4.32Å; F21-P33 HydrophobicContact CD2-CG 4.41Å; F21-P33 HydrophobicContact CE1-CG 3.83Å; F21-P33 HydrophobicContact CE2-CG 3.93Å; F21-P33 HydrophobicContact CZ-CG 3.62Å; F21-L36 HydrophobicContact CB-CB 4.4Å; F21-L36 HydrophobicContact CB-CD2 4.07Å
22	K	77.5	Confident	70.9	Confident	106 Å²	106	87.1 Å²	87.1	46%	0.461	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	132.6	178.5	-151.4	-173	-168.9	-155.4	0	111.9	G24 D27	K22-G24 PolarHBondContact O-N 3.48Å; K22-D27 WeakPolarHBondContact CE-O 3.43Å; K22-D27 WeakPolarHBondContact CE-OD1 3.42Å; K22-D27 WeakPolarHBondContact CE-OD2 3.32Å; K22-D27 WeakPolarHBondContact CG-O 3.32Å; K22-D27 IonicContact NZ-OD1 2.88Å; K22-D27 PolarHBondContact NZ-OD1 3.27Å; K22-D27 IonicContact NZ-OD2 3.25Å; K22-D27 PolarHBondContact NZ-OD2 3.25Å
23	C	78.4	Confident	71.5	Confident	2 Å²	2	83.3 Å²	83.3	1%	0.014	45%	0.446	C	S	.	.			trans	-78.3	107.2	170.8	-178.4	0	0	0	0	110.7	H25 C26 D27 R28 M30 L36 H39	C23-H25 PolarHBondContact O-N 3.18Å; C23-C26 PolarHBondContact O-N 3.1Å; C23-D27 VanDerWaalsContact O-CA 3.29Å; C23-D27 WeakPolarHBondContact O-CA 3.32Å; C23-D27 PolarHBondContact O-N 2.96Å; C23-R28 PolarHBondContact N-O 3.08Å; C23-M30 HydrophobicContact CB-CE 3.77Å; C23-L36 HydrophobicContact CB-CD1 3.89Å; C23-H39 PolarHBondContact SG-NE2 3.08Å; C23-H39 VanDerWaalsContact SG-NE2 3.45Å
24	G	75.6	Confident	72.7	Confident	72 Å²	72	80.4 Å²	80.4	74%	0.742	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	15.1	179.7	0	0	0	0	0	117.1	K22	K22-G24 PolarHBondContact O-N 3.48Å
25	H	71.7	Confident	73.7	Confident	99 Å²	99	80.8 Å²	80.8	46%	0.458	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.9	-44.4	170.5	-70.2	-63.7	0	0	0	112.1	C23 F86 C88 S89	C23-H25 PolarHBondContact O-N 3.18Å; H25-F86 AromaticContact CD2-CD2 3.82Å; H25-F86 AromaticContact CD2-CG 3.82Å; H25-F86 AromaticContact NE2-CD2 3.27Å; H25-F86 VanDerWaalsContact NE2-CD2 3.27Å; H25-F86 WeakPolarHBondContact NE2-CD2 3.45Å; H25-F86 AromaticContact NE2-CG 3.78Å; H25-C88 WeakPolarHBondContact CB-SG 3.34Å; H25-S89 WeakPolarHBondContact O-CB 3.46Å
26	C	75.5	Confident	74.4	Confident	36 Å²	36	76.4 Å²	76.4	24%	0.243	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115	6.5	-176.8	73	0	0	0	0	114.1	C23 R28 H39 C88	C23-C26 PolarHBondContact O-N 3.1Å; C26-R28 PolarHBondContact O-N 3.32Å; C26-R28 VanDerWaalsContact SG-CB 3.59Å; C26-H39 PolarHBondContact SG-CE1 3.14Å; C26-H39 PolarHBondContact SG-NE2 3.32Å; C26-C88 VanDerWaalsContact CB-C 3.49Å; C26-C88 HydrophobicContact CB-CB 3.9Å; C26-C88 VanDerWaalsContact CB-O 3.24Å; C26-C88 WeakPolarHBondContact CB-O 3.39Å
27	D	76.2	Confident	75.3	Confident	96 Å²	96	74.9 Å²	74.9	51%	0.513	41%	0.405	S	S	.	.			trans	57.9	-0.6	-179.3	-102.1	5.1	0	0	0	117.3	K22 C23 S29	K22-D27 WeakPolarHBondContact CE-O 3.43Å; K22-D27 WeakPolarHBondContact CE-OD1 3.42Å; K22-D27 WeakPolarHBondContact CE-OD2 3.32Å; K22-D27 WeakPolarHBondContact CG-O 3.32Å; K22-D27 IonicContact NZ-OD1 2.88Å; K22-D27 PolarHBondContact NZ-OD1 3.27Å; K22-D27 IonicContact NZ-OD2 3.25Å; K22-D27 PolarHBondContact NZ-OD2 3.25Å; C23-D27 VanDerWaalsContact O-CA 3.29Å; C23-D27 WeakPolarHBondContact O-CA 3.32Å; C23-D27 PolarHBondContact O-N 2.96Å; D27-S29 PolarHBondContact O-N 3.46Å
28	R	75.9	Confident	76.3	Confident	160 Å²	160	74.4 Å²	74.4	60%	0.604	40%	0.402	S	S	*	.			trans	-58.8	121.4	175.2	-174.8	169.5	-178.3	156.2	2.7	111.4	C23 C26	C23-R28 PolarHBondContact N-O 3.08Å; C26-R28 PolarHBondContact O-N 3.32Å; C26-R28 VanDerWaalsContact SG-CB 3.59Å
29	S	76.7	Confident	77.2	Confident	73 Å²	73	70.3 Å²	70.3	51%	0.51	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	145	165.1	44.2	0	0	0	0	111.1	D27	D27-S29 PolarHBondContact O-N 3.46Å
30	M	80.8	Confident	77.8	Confident	11 Å²	11	70.8 Å²	70.8	5%	0.054	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	150.3	176.3	-79.2	165	-73.9	0	0	109	F21 C23 E35 L36 H39	F21-M30 WeakPolarHBondContact CB-O 3.44Å; F21-M30 PolarHBondContact N-O 3.32Å; F21-M30 PolarHBondContact O-N 3.39Å; C23-M30 HydrophobicContact CB-CE 3.77Å; M30-E35 HydrophobicContact CB-CB 3.78Å; M30-E35 WeakPolarHBondContact CB-OE2 3.47Å; M30-E35 HydrophobicContact CG-CB 3.88Å; M30-E35 VanDerWaalsContact SD-C 3.58Å; M30-E35 HydrophobicContact SD-CB 3.93Å; M30-L36 HydrophobicContact CE-CB 4.06Å; M30-L36 HydrophobicContact CE-CD1 3.58Å; M30-L36 HydrophobicContact CE-CG 4.4Å; M30-L36 HydrophobicContact SD-CB 4.4Å; M30-H39 HydrophobicContact CE-CB 4.01Å; M30-H39 HydrophobicContact SD-CB 3.55Å; M30-H39 VanDerWaalsContact SD-CB 3.55Å
31	N	75.4	Confident	78.3	Confident	136 Å²	136	72.9 Å²	72.9	73%	0.727	38%	0.384	S	S	*	.	S	Bend	trans	-86.9	-18.3	-169.3	-63.7	-6.8	0	0	0	112	E35	N31-E35 PolarHBondContact N-OE2 2.61Å
32	S	76.3	Confident	78.5	Confident	24 Å²	24	79 Å²	79	17%	0.168	41%	0.411	C	S	.	.	S	Bend	trans	-134.1	154.3	179.2	72.7	0	0	0	0	114.5	T34 E35 L36	S32-T34 VanDerWaalsContact CB-OG1 3.25Å; S32-T34 WeakPolarHBondContact CB-OG1 3.46Å; S32-T34 PolarHBondContact O-N 2.74Å; S32-T34 PolarHBondContact OG-OG1 2.79Å; S32-E35 WeakPolarHBondContact CB-OE1 3.46Å; S32-E35 PolarHBondContact N-OE1 3.13Å; S32-E35 PolarHBondContact O-N 3.1Å; S32-E35 VanDerWaalsContact OG-CD 3.3Å; S32-E35 WeakPolarHBondContact OG-CG 3.35Å; S32-E35 PolarHBondContact OG-N 2.88Å; S32-E35 VanDerWaalsContact OG-N 3.07Å; S32-E35 PolarHBondContact OG-OE1 3.27Å; S32-L36 PolarHBondContact O-N 2.95Å
33	P	76	Confident	78.4	Confident	46 Å²	46	76.2 Å²	76.2	30%	0.299	40%	0.398	S	S	.	.	H	α-helix	trans	-61.5	-24.1	170	-18.4	30.1	0	0	0	112.8	F21 K37	F21-P33 HydrophobicContact CD1-CG 4.32Å; F21-P33 HydrophobicContact CD2-CG 4.41Å; F21-P33 HydrophobicContact CE1-CG 3.83Å; F21-P33 HydrophobicContact CE2-CG 3.93Å; F21-P33 HydrophobicContact CZ-CG 3.62Å; P33-K37 WeakPolarHBondContact O-CB 3.37Å; P33-K37 PolarHBondContact O-N 3.18Å
34	T	83.9	Confident	78.2	Confident	102 Å²	102	78 Å²	78	63%	0.626	41%	0.41	S	S	*	.	H	α-helix	trans	-70.2	-43.8	177.1	19.2	0	0	0	0	112	S32 K37 S38	S32-T34 VanDerWaalsContact CB-OG1 3.25Å; S32-T34 WeakPolarHBondContact CB-OG1 3.46Å; S32-T34 PolarHBondContact O-N 2.74Å; S32-T34 PolarHBondContact OG-OG1 2.79Å; T34-K37 PolarHBondContact O-N 2.94Å; T34-S38 WeakPolarHBondContact O-CB 3.38Å; T34-S38 PolarHBondContact O-N 3.46Å
35	E	82.1	Confident	78.2	Confident	76 Å²	76	76.8 Å²	76.8	36%	0.355	39%	0.387	S	S	.	.	H	α-helix	trans	-60.4	-48.9	169.6	-74.5	149.2	-109.2	0	0	111	M30 N31 S32 K37 S38 H39	M30-E35 HydrophobicContact CB-CB 3.78Å; M30-E35 WeakPolarHBondContact CB-OE2 3.47Å; M30-E35 HydrophobicContact CG-CB 3.88Å; M30-E35 VanDerWaalsContact SD-C 3.58Å; M30-E35 HydrophobicContact SD-CB 3.93Å; N31-E35 PolarHBondContact N-OE2 2.61Å; S32-E35 WeakPolarHBondContact CB-OE1 3.46Å; S32-E35 PolarHBondContact N-OE1 3.13Å; S32-E35 PolarHBondContact O-N 3.1Å; S32-E35 VanDerWaalsContact OG-CD 3.3Å; S32-E35 WeakPolarHBondContact OG-CG 3.35Å; S32-E35 PolarHBondContact OG-N 2.88Å; S32-E35 VanDerWaalsContact OG-N 3.07Å; S32-E35 PolarHBondContact OG-OE1 3.27Å; E35-K37 VanDerWaalsContact C-N 3.3Å; E35-K37 PolarHBondContact O-N 3.5Å; E35-S38 CarbonylContact O-C 3.56Å; E35-S38 WeakPolarHBondContact O-CB 3.25Å; E35-S38 PolarHBondContact O-N 3.21Å; E35-H39 VanDerWaalsContact O-CB 3.29Å; E35-H39 WeakPolarHBondContact O-CB 3.34Å; E35-H39 PolarHBondContact O-N 2.94Å
36	L	81.1	Confident	78.5	Confident	10 Å²	10	74.4 Å²	74.4	5%	0.052	38%	0.379	C	S	.	.	H	α-helix	trans	-60.2	-38.2	178.7	176.9	57.2	0	0	0	112.1	M1 F21 C23 M30 S32 L40	M1-L36 HydrophobicContact CE-CD2 3.8Å; M1-L36 HydrophobicContact CE-CG 4.38Å; M1-L36 HydrophobicContact SD-CD2 3.74Å; F21-L36 HydrophobicContact CB-CB 4.4Å; F21-L36 HydrophobicContact CB-CD2 4.07Å; C23-L36 HydrophobicContact CB-CD1 3.89Å; M30-L36 HydrophobicContact CE-CB 4.06Å; M30-L36 HydrophobicContact CE-CD1 3.58Å; M30-L36 HydrophobicContact CE-CG 4.4Å; M30-L36 HydrophobicContact SD-CB 4.4Å; S32-L36 PolarHBondContact O-N 2.95Å; L36-L40 HydrophobicContact CD1-CD1 3.93Å; L36-L40 HydrophobicContact CD1-CG 4.06Å; L36-L40 HydrophobicContact CG-CD1 4.17Å; L36-L40 WeakPolarHBondContact O-CB 3.36Å; L36-L40 VanDerWaalsContact O-CG 3.29Å; L36-L40 WeakPolarHBondContact O-CG 3.37Å; L36-L40 PolarHBondContact O-N 3.32Å
37	K	81.2	Confident	78.6	Confident	125 Å²	125	72.8 Å²	72.8	54%	0.543	37%	0.368	S	S	.	.	H	α-helix	trans	-67	-40	173.1	-174.1	179.3	180	-177.7	0	112.4	P33 T34 E35 R41	P33-K37 WeakPolarHBondContact O-CB 3.37Å; P33-K37 PolarHBondContact O-N 3.18Å; T34-K37 PolarHBondContact O-N 2.94Å; E35-K37 VanDerWaalsContact C-N 3.3Å; E35-K37 PolarHBondContact O-N 3.5Å; K37-R41 WeakPolarHBondContact O-CB 3.21Å; K37-R41 WeakPolarHBondContact O-CG 3.44Å; K37-R41 PolarHBondContact O-N 3.43Å; K37-R41 VanDerWaalsContact O-N 3.14Å
38	S	84.6	Confident	78.9	Confident	78 Å²	78	70.1 Å²	70.1	55%	0.545	35%	0.352	S	S	.	.	H	α-helix	trans	-65.3	-46	176.5	-173.1	0	0	0	0	111.3	T34 E35 R41 K42	T34-S38 WeakPolarHBondContact O-CB 3.38Å; T34-S38 PolarHBondContact O-N 3.46Å; E35-S38 CarbonylContact O-C 3.56Å; E35-S38 WeakPolarHBondContact O-CB 3.25Å; E35-S38 PolarHBondContact O-N 3.21Å; S38-R41 PolarHBondContact O-N 2.89Å; S38-K42 WeakPolarHBondContact O-CB 3.4Å; S38-K42 PolarHBondContact O-N 3.15Å
39	H	81.8	Confident	79.2	Confident	18 Å²	18	63.6 Å²	63.6	8%	0.083	33%	0.328	C	S	.	.	H	α-helix	trans	-57	-53.5	175	177.5	100.7	0	0	0	112	C23 C26 M30 E35 R41 K42 Y43 C88	C23-H39 PolarHBondContact SG-NE2 3.08Å; C23-H39 VanDerWaalsContact SG-NE2 3.45Å; C26-H39 PolarHBondContact SG-CE1 3.14Å; C26-H39 PolarHBondContact SG-NE2 3.32Å; M30-H39 HydrophobicContact CE-CB 4.01Å; M30-H39 HydrophobicContact SD-CB 3.55Å; M30-H39 VanDerWaalsContact SD-CB 3.55Å; E35-H39 VanDerWaalsContact O-CB 3.29Å; E35-H39 WeakPolarHBondContact O-CB 3.34Å; E35-H39 PolarHBondContact O-N 2.94Å; H39-R41 VanDerWaalsContact C-N 3.28Å; H39-R41 PolarHBondContact O-N 2.89Å; H39-K42 PolarHBondContact O-N 3.37Å; H39-K42 VanDerWaalsContact O-N 3.17Å; H39-Y43 AromaticContact CE1-CD2 3.87Å; H39-Y43 AromaticContact CE1-CE2 3.81Å; H39-Y43 AromaticContact ND1-CE2 3.87Å; H39-Y43 AromaticContact NE2-CD2 3.93Å; H39-Y43 VanDerWaalsContact O-CD2 3.25Å; H39-Y43 WeakPolarHBondContact O-CD2 3.48Å; H39-Y43 PolarHBondContact O-N 2.94Å; H39-C88 WeakPolarHBondContact NE2-CB 3.46Å; H39-C88 PolarHBondContact NE2-SG 2.67Å; H39-C88 VanDerWaalsContact NE2-SG 3.43Å
40	L	79.3	Confident	79.5	Confident	45 Å²	45	60.6 Å²	60.6	24%	0.236	31%	0.307	C	S	.	.	H	α-helix	trans	-61.6	-36.3	-179.9	-71.8	170.1	0	0	0	112.1	L36 S44 F86	L36-L40 HydrophobicContact CD1-CD1 3.93Å; L36-L40 HydrophobicContact CD1-CG 4.06Å; L36-L40 HydrophobicContact CG-CD1 4.17Å; L36-L40 WeakPolarHBondContact O-CB 3.36Å; L36-L40 VanDerWaalsContact O-CG 3.29Å; L36-L40 WeakPolarHBondContact O-CG 3.37Å; L36-L40 PolarHBondContact O-N 3.32Å; L40-S44 WeakPolarHBondContact O-CB 3.42Å; L40-S44 PolarHBondContact O-N 3.07Å; L40-F86 HydrophobicContact CB-CD1 4.36Å; L40-F86 HydrophobicContact CB-CE1 4Å; L40-F86 HydrophobicContact CD2-CD1 3.79Å; L40-F86 HydrophobicContact CD2-CE1 3.98Å; L40-F86 HydrophobicContact CD2-CG 4.23Å; L40-F86 WeakPolarHBondContact O-CE1 3.3Å
41	R	80.4	Confident	79.4	Confident	182 Å²	182	62.2 Å²	62.2	69%	0.687	32%	0.319	S	S	*	.	H	α-helix	trans	-68.2	-41.7	172.6	-80.9	-178.8	162.4	-166.1	-8	113.3	K37 S38 H39 Y43 S44	K37-R41 WeakPolarHBondContact O-CB 3.21Å; K37-R41 WeakPolarHBondContact O-CG 3.44Å; K37-R41 PolarHBondContact O-N 3.43Å; K37-R41 VanDerWaalsContact O-N 3.14Å; S38-R41 PolarHBondContact O-N 2.89Å; H39-R41 VanDerWaalsContact C-N 3.28Å; H39-R41 PolarHBondContact O-N 2.89Å; R41-Y43 PolarHBondContact O-N 3.42Å; R41-S44 PolarHBondContact O-N 2.85Å; R41-S44 PolarHBondContact O-OG 3.48Å
42	K	78.1	Confident	79.4	Confident	161 Å²	161	59.3 Å²	59.3	70%	0.7	30%	0.3	S	S	*	.	H	α-helix	trans	-63.4	-25	-179.8	-176.4	167.1	-179.2	171.7	0	112.4	S38 H39	S38-K42 WeakPolarHBondContact O-CB 3.4Å; S38-K42 PolarHBondContact O-N 3.15Å; H39-K42 PolarHBondContact O-N 3.37Å; H39-K42 VanDerWaalsContact O-N 3.17Å
43	Y	75.4	Confident	79.1	Confident	48 Å²	48	62.7 Å²	62.7	19%	0.188	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.3	24.1	-177.6	-58.1	-67.2	0	0	0	113.9	H39 R41 F86 M87 C88	H39-Y43 AromaticContact CE1-CD2 3.87Å; H39-Y43 AromaticContact CE1-CE2 3.81Å; H39-Y43 AromaticContact ND1-CE2 3.87Å; H39-Y43 AromaticContact NE2-CD2 3.93Å; H39-Y43 VanDerWaalsContact O-CD2 3.25Å; H39-Y43 WeakPolarHBondContact O-CD2 3.48Å; H39-Y43 PolarHBondContact O-N 2.94Å; R41-Y43 PolarHBondContact O-N 3.42Å; Y43-F86 CarbonylContact O-C 3.43Å; Y43-F86 WeakPolarHBondContact O-CA 3.43Å; Y43-M87 WeakPolarHBondContact O-CG 3.29Å; Y43-M87 PolarHBondContact O-N 3.05Å; Y43-C88 HydrophobicContact CD2-CB 3.54Å; Y43-C88 HydrophobicContact CE2-CB 4.27Å; Y43-C88 HydrophobicContact CG-CB 3.69Å
44	S	74.8	Confident	78.7	Confident	40 Å²	40	68.4 Å²	68.4	28%	0.28	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	114.1	176.1	60.2	0	0	0	0	112.6	L40 R41	L40-S44 WeakPolarHBondContact O-CB 3.42Å; L40-S44 PolarHBondContact O-N 3.07Å; R41-S44 PolarHBondContact O-N 2.85Å; R41-S44 PolarHBondContact O-OG 3.48Å
45	L	75.9	Confident	78.3	Confident	47 Å²	47	64.9 Å²	64.9	25%	0.246	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	133	164.2	-179.9	66.9	0	0	0	109.7	L47 Y84 S85 M87	L45-L47 HydrophobicContact CD2-CD1 4.38Å; L45-L47 HydrophobicContact CD2-CD2 4.38Å; L45-L47 HydrophobicContact CD2-CG 4.35Å; L45-L47 HydrophobicContact CG-CG 4.37Å; L45-Y84 CarbonylContact O-C 3.54Å; L45-Y84 WeakPolarHBondContact O-CA 3.48Å; L45-S85 PolarHBondContact N-O 3.39Å; L45-S85 PolarHBondContact O-N 2.87Å; L45-M87 HydrophobicContact CB-CE 4.36Å; L45-M87 HydrophobicContact CB-CG 4.15Å; L45-M87 HydrophobicContact CB-SD 3.82Å; L45-M87 HydrophobicContact CD2-CE 4.22Å
46	V	76.4	Confident	77.9	Confident	49 Å²	49	69.7 Å²	69.7	30%	0.297	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	135	175.8	-172.8	0	0	0	0	109.5	F48 T82 Y84	V46-F48 HydrophobicContact CG1-CE1 4.21Å; V46-F48 HydrophobicContact CG1-CE2 4.06Å; V46-F48 HydrophobicContact CG1-CZ 3.75Å; V46-T82 HydrophobicContact CG1-CG2 3.43Å; V46-T82 VanDerWaalsContact CG1-CG2 3.43Å; V46-Y84 HydrophobicContact CG2-CD1 4.01Å; V46-Y84 HydrophobicContact CG2-CE1 3.81Å
47	L	79.2	Confident	77.8	Confident	2 Å²	2	70.2 Å²	70.2	1%	0.01	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	137.6	177.5	-68.9	167.2	0	0	0	110.6	L45 H49 K60 T82 T83 F118	L45-L47 HydrophobicContact CD2-CD1 4.38Å; L45-L47 HydrophobicContact CD2-CD2 4.38Å; L45-L47 HydrophobicContact CD2-CG 4.35Å; L45-L47 HydrophobicContact CG-CG 4.37Å; L47-H49 PolarHBondContact O-CD2 2.96Å; L47-K60 HydrophobicContact CD2-CG 3.98Å; L47-T82 WeakPolarHBondContact O-CA 3.45Å; L47-T83 PolarHBondContact N-O 3.45Å; L47-T83 PolarHBondContact O-N 3.31Å; L47-F118 HydrophobicContact CD1-CD1 3.86Å; L47-F118 HydrophobicContact CD1-CE1 3.22Å; L47-F118 HydrophobicContact CD1-CZ 3.71Å
48	F	82.3	Confident	77.7	Confident	39 Å²	39	65.1 Å²	65.1	17%	0.171	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	137.9	-179.1	-57.8	-80.2	0	0	0	110.1	V46 K58 S59 K60 V62 I65 V80 T81 T82	V46-F48 HydrophobicContact CG1-CE1 4.21Å; V46-F48 HydrophobicContact CG1-CE2 4.06Å; V46-F48 HydrophobicContact CG1-CZ 3.75Å; F48-K58 VanDerWaalsContact O-CA 3.31Å; F48-K58 WeakPolarHBondContact O-CA 3.33Å; F48-S59 PolarHBondContact N-O 2.95Å; F48-S59 PolarHBondContact O-N 3.21Å; F48-K60 WeakPolarHBondContact CD2-O 3.44Å; F48-K60 WeakPolarHBondContact CE2-O 3.48Å; F48-V62 HydrophobicContact CD1-CB 3.92Å; F48-V62 HydrophobicContact CD1-CG2 3.8Å; F48-V62 HydrophobicContact CD2-CB 3.87Å; F48-V62 HydrophobicContact CE1-CB 3.93Å; F48-V62 HydrophobicContact CE1-CG2 3.96Å; F48-V62 HydrophobicContact CE2-CB 3.88Å; F48-V62 HydrophobicContact CG-CB 3.88Å; F48-V62 HydrophobicContact CG-CG2 4.14Å; F48-V62 HydrophobicContact CZ-CB 3.91Å; F48-V62 HydrophobicContact CZ-CG2 4.43Å; F48-I65 HydrophobicContact CB-CB 4.28Å; F48-I65 HydrophobicContact CB-CG1 3.89Å; F48-I65 WeakPolarHBondContact O-CD1 3.21Å; F48-V80 HydrophobicContact CB-CG1 4.02Å; F48-V80 HydrophobicContact CD1-CG1 4.18Å; F48-T81 WeakPolarHBondContact CA-O 3.09Å; F48-T82 HydrophobicContact CD1-CG2 4.28Å; F48-T82 HydrophobicContact CE1-CG2 3.98Å
49	H	81.9	Confident	77.4	Confident	24 Å²	24	61.5 Å²	61.5	11%	0.111	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	138.3	-174.9	-53.4	-120.9	0	0	0	108.7	L47 K58 V80 T81 T83	L47-H49 PolarHBondContact O-CD2 2.96Å; H49-K58 WeakPolarHBondContact ND1-CD 3.27Å; H49-K58 WeakPolarHBondContact ND1-CE 3.45Å; H49-K58 WeakPolarHBondContact ND1-CG 3.44Å; H49-V80 CarbonylContact O-C 3.45Å; H49-V80 WeakPolarHBondContact O-CA 3.28Å; H49-T81 PolarHBondContact CD2-O 3.42Å; H49-T81 PolarHBondContact N-O 3.04Å; H49-T81 PolarHBondContact O-N 3.39Å; H49-T83 VanDerWaalsContact NE2-CG2 3.26Å; H49-T83 WeakPolarHBondContact NE2-CG2 3.35Å; H49-T83 PolarHBondContact NE2-OG1 3.13Å
50	C	83.3	Confident	77.2	Confident	9 Å²	9	65.9 Å²	65.9	6%	0.061	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	128.7	168.4	-172.5	0	0	0	0	109.9	F52 C55 V57 I65 H73	C50-F52 VanDerWaalsContact C-N 3.33Å; C50-C55 HydrophobicContact CB-CB 4.33Å; C50-V57 PolarHBondContact N-O 3.26Å; C50-I65 HydrophobicContact CB-CG2 4.42Å; C50-H73 PolarHBondContact SG-CD2 3.21Å
51	C	77.5	Confident	77.1	Confident	46 Å²	46	65.6 Å²	65.6	31%	0.311	32%	0.32	S	S	.	.			trans	-86.6	1.3	-179.3	-61.4	0	0	0	0	114.3	L79 T81	C51-L79 HydrophobicContact CB-CB 3.72Å; C51-L79 VanDerWaalsContact CB-O 3.28Å; C51-L79 WeakPolarHBondContact CB-O 3.22Å; C51-L79 PolarHBondContact N-O 3.02Å; C51-L79 VanDerWaalsContact SG-CB 3.56Å; C51-L79 PolarHBondContact SG-O 3.26Å; C51-L79 VanDerWaalsContact SG-O 3.39Å; C51-T81 VanDerWaalsContact SG-CB 3.58Å; C51-T81 PolarHBondContact SG-N 3.36Å; C51-T81 PolarHBondContact SG-OG1 3.06Å
52	F	76.3	Confident	77.2	Confident	74 Å²	74	58.7 Å²	58.7	33%	0.325	30%	0.298	S	S	.	.	S	Bend	trans	-63.4	137.7	-177.1	-165.1	-97	0	0	0	110.5	C50 N54 C55 H73	C50-F52 VanDerWaalsContact C-N 3.33Å; F52-N54 PolarHBondContact O-N 2.95Å; F52-C55 HydrophobicContact CB-CB 4.1Å; F52-C55 WeakPolarHBondContact O-CB 3.33Å; F52-C55 PolarHBondContact O-N 3.37Å; F52-H73 HydrophobicContact CB-CB 4.22Å; F52-H73 VanDerWaalsContact CB-CD2 3.46Å; F52-H73 WeakPolarHBondContact CB-CD2 3.31Å; F52-H73 HydrophobicContact CD1-CB 4.16Å; F52-H73 AromaticContact CD1-CE1 3.76Å; F52-H73 AromaticContact CD1-CG 3.62Å; F52-H73 AromaticContact CD1-ND1 3.28Å; F52-H73 VanDerWaalsContact CD1-ND1 3.28Å; F52-H73 WeakPolarHBondContact CD1-ND1 3.29Å; F52-H73 HydrophobicContact CD2-CB 3.6Å; F52-H73 AromaticContact CD2-CG 3.85Å; F52-H73 HydrophobicContact CE1-CB 4.44Å; F52-H73 AromaticContact CE1-ND1 3.75Å; F52-H73 HydrophobicContact CE2-CB 3.91Å; F52-H73 HydrophobicContact CG-CB 3.72Å; F52-H73 AromaticContact CG-CD2 3.82Å; F52-H73 AromaticContact CG-CG 3.4Å; F52-H73 AromaticContact CG-ND1 3.62Å; F52-H73 HydrophobicContact CZ-CB 4.31Å
53	P	69.2	Low	77.4	Confident	95 Å²	95	56.7 Å²	56.7	62%	0.617	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	134.4	-178.5	-29.5	36.4	0	0	0	112.8	C55	P53-C55 PolarHBondContact O-N 3.17Å; P53-C55 VanDerWaalsContact O-N 3.08Å
54	N	67.4	Low	77.7	Confident	166 Å²	166	58.1 Å²	58.1	89%	0.888	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	-0.9	-174.9	-54.6	-34.3	0	0	0	116.5	F52	F52-N54 PolarHBondContact O-N 2.95Å
55	C	76.5	Confident	78.1	Confident	28 Å²	28	56.2 Å²	56.2	19%	0.189	29%	0.288	C	S	.	.			trans	-71.7	133.9	170.6	-172.5	0	0	0	0	111	C50 F52 P53 V57 H68	C50-C55 HydrophobicContact CB-CB 4.33Å; F52-C55 HydrophobicContact CB-CB 4.1Å; F52-C55 WeakPolarHBondContact O-CB 3.33Å; F52-C55 PolarHBondContact O-N 3.37Å; P53-C55 PolarHBondContact O-N 3.17Å; P53-C55 VanDerWaalsContact O-N 3.08Å; C55-V57 PolarHBondContact SG-N 2.88Å; C55-H68 PolarHBondContact SG-NE2 3.43Å
56	R	73.4	Confident	78.4	Confident	177 Å²	177	58.3 Å²	58.3	67%	0.668	30%	0.295	S	S	*	.			trans	-117.1	10.3	177	-66.2	-176.3	172.4	-170.8	-3	113.6
57	V	79.3	Confident	78.7	Confident	22 Å²	22	62.5 Å²	62.5	13%	0.133	31%	0.309	C	S	.	.			trans	-75.1	128.4	-175.4	-177.3	0	0	0	0	110.9	C50 C55 I65	C50-V57 PolarHBondContact N-O 3.26Å; C55-V57 PolarHBondContact SG-N 2.88Å; V57-I65 HydrophobicContact CB-CD1 4.45Å; V57-I65 HydrophobicContact CG1-CD1 3.88Å; V57-I65 VanDerWaalsContact O-CD1 3.31Å; V57-I65 WeakPolarHBondContact O-CD1 3.49Å
58	K	79	Confident	78.9	Confident	17 Å²	17	63.7 Å²	63.7	7%	0.074	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	143.3	179.6	-55.7	-179.9	-178.3	-177	0	108.6	F48 H49 F118 C119 V169	F48-K58 VanDerWaalsContact O-CA 3.31Å; F48-K58 WeakPolarHBondContact O-CA 3.33Å; H49-K58 WeakPolarHBondContact ND1-CD 3.27Å; H49-K58 WeakPolarHBondContact ND1-CE 3.45Å; H49-K58 WeakPolarHBondContact ND1-CG 3.44Å; K58-F118 HydrophobicContact CD-CB 4.39Å; K58-C119 PolarHBondContact NZ-O 3.48Å; K58-V169 HydrophobicContact CD-CG2 4.45Å
59	S	78.8	Confident	79	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.014	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	160.7	172.6	179.3	0	0	0	0	110.6	F48 S61 E175	F48-S59 PolarHBondContact N-O 2.95Å; F48-S59 PolarHBondContact O-N 3.21Å; S59-S61 PolarHBondContact OG-N 3.48Å; S59-S61 VanDerWaalsContact OG-N 3.08Å; S59-E175 WeakPolarHBondContact CB-OE1 3.12Å; S59-E175 PolarHBondContact OG-OE1 3.07Å
60	K	77.8	Confident	79	Confident	111 Å²	111	66.6 Å²	66.6	48%	0.483	33%	0.334	S	S	.	.	S	Bend	trans	-69.4	-24.1	166.8	-59	166.6	-167.3	151.5	0	111.4	L47 F48	L47-K60 HydrophobicContact CD2-CG 3.98Å; F48-K60 WeakPolarHBondContact CD2-O 3.44Å; F48-K60 WeakPolarHBondContact CE2-O 3.48Å
61	S	77.3	Confident	79	Confident	39 Å²	39	74.2 Å²	74.2	27%	0.273	37%	0.366	S	S	.	.			trans	-95.7	122.5	179.4	178.8	0	0	0	0	112.3	S59 E63 I64 I65	S59-S61 PolarHBondContact OG-N 3.48Å; S59-S61 VanDerWaalsContact OG-N 3.08Å; S61-E63 PolarHBondContact O-N 2.92Å; S61-E63 PolarHBondContact OG-N 3.17Å; S61-I64 PolarHBondContact O-N 3.2Å; S61-I64 PolarHBondContact OG-N 2.85Å; S61-I65 PolarHBondContact O-N 3.03Å
62	V	81.2	Confident	79.2	Confident	37 Å²	37	78.4 Å²	78.4	22%	0.224	38%	0.379	C	S	.	.	H	α-helix	trans	-63.3	-26.3	170.5	72.3	0	0	0	0	111.8	F48 K66	F48-V62 HydrophobicContact CD1-CB 3.92Å; F48-V62 HydrophobicContact CD1-CG2 3.8Å; F48-V62 HydrophobicContact CD2-CB 3.87Å; F48-V62 HydrophobicContact CE1-CB 3.93Å; F48-V62 HydrophobicContact CE1-CG2 3.96Å; F48-V62 HydrophobicContact CE2-CB 3.88Å; F48-V62 HydrophobicContact CG-CB 3.88Å; F48-V62 HydrophobicContact CG-CG2 4.14Å; F48-V62 HydrophobicContact CZ-CB 3.91Å; F48-V62 HydrophobicContact CZ-CG2 4.43Å; V62-K66 HydrophobicContact CG2-CD 4.38Å; V62-K66 WeakPolarHBondContact O-CB 3.31Å; V62-K66 VanDerWaalsContact O-CG 3.25Å; V62-K66 WeakPolarHBondContact O-CG 3.48Å; V62-K66 PolarHBondContact O-N 3.46Å
63	E	81.8	Confident	79.4	Confident	119 Å²	119	76.8 Å²	76.8	56%	0.556	37%	0.373	S	S	*	.	H	α-helix	trans	-74.6	-39.3	-180	-58.7	-177.1	-176.4	0	0	112.2	S61 I65 K66 K67	S61-E63 PolarHBondContact O-N 2.92Å; S61-E63 PolarHBondContact OG-N 3.17Å; E63-I65 VanDerWaalsContact C-N 3.31Å; E63-K66 PolarHBondContact O-N 3.24Å; E63-K67 WeakPolarHBondContact O-CB 3.42Å; E63-K67 VanDerWaalsContact O-CG 3.28Å; E63-K67 WeakPolarHBondContact O-CG 3.35Å; E63-K67 PolarHBondContact O-N 3.47Å
64	I	82.5	Confident	79.6	Confident	77 Å²	77	74 Å²	74	40%	0.395	36%	0.361	S	S	.	.	H	α-helix	trans	-62.7	-43.3	174.3	-65.5	177.9	0	0	0	109.3	S61 K67 H68	S61-I64 PolarHBondContact O-N 3.2Å; S61-I64 PolarHBondContact OG-N 2.85Å; I64-K67 PolarHBondContact O-N 3.34Å; I64-H68 VanDerWaalsContact O-CB 3.3Å; I64-H68 WeakPolarHBondContact O-CB 3.31Å; I64-H68 PolarHBondContact O-N 2.84Å
65	I	83.4	Confident	79.5	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-66.3	-40.5	175.9	-68.4	-73.3	0	0	0	112.4	F48 C50 V57 S61 E63 H68 A69 V80	F48-I65 HydrophobicContact CB-CB 4.28Å; F48-I65 HydrophobicContact CB-CG1 3.89Å; F48-I65 WeakPolarHBondContact O-CD1 3.21Å; C50-I65 HydrophobicContact CB-CG2 4.42Å; V57-I65 HydrophobicContact CB-CD1 4.45Å; V57-I65 HydrophobicContact CG1-CD1 3.88Å; V57-I65 VanDerWaalsContact O-CD1 3.31Å; V57-I65 WeakPolarHBondContact O-CD1 3.49Å; S61-I65 PolarHBondContact O-N 3.03Å; E63-I65 VanDerWaalsContact C-N 3.31Å; I65-H68 PolarHBondContact O-N 2.93Å; I65-A69 WeakPolarHBondContact O-CB 3.48Å; I65-A69 PolarHBondContact O-N 2.89Å; I65-V80 HydrophobicContact CG2-CB 4.33Å; I65-V80 HydrophobicContact CG2-CG1 3.71Å; I65-V80 HydrophobicContact CG2-CG2 3.7Å
66	K	82.3	Confident	78.6	Confident	91 Å²	91	77.6 Å²	77.6	40%	0.396	38%	0.383	S	S	.	.	H	α-helix	trans	-62.8	-47	173.6	-78.8	171.9	175.7	179.9	0	111.9	V62 E63 H68 A69 L70	V62-K66 HydrophobicContact CG2-CD 4.38Å; V62-K66 WeakPolarHBondContact O-CB 3.31Å; V62-K66 VanDerWaalsContact O-CG 3.25Å; V62-K66 WeakPolarHBondContact O-CG 3.48Å; V62-K66 PolarHBondContact O-N 3.46Å; E63-K66 PolarHBondContact O-N 3.24Å; K66-H68 VanDerWaalsContact C-N 3.34Å; K66-H68 PolarHBondContact O-N 2.96Å; K66-A69 PolarHBondContact O-N 3.18Å; K66-L70 WeakPolarHBondContact O-CB 3.24Å; K66-L70 PolarHBondContact O-N 3.09Å
67	K	83.1	Confident	77.6	Confident	137 Å²	137	70.2 Å²	70.2	60%	0.596	36%	0.358	S	S	*	.	H	α-helix	trans	-60.6	-41.8	175.8	-75.5	169.3	178.3	168.4	0	111.3	E63 I64 K71	E63-K67 WeakPolarHBondContact O-CB 3.42Å; E63-K67 VanDerWaalsContact O-CG 3.28Å; E63-K67 WeakPolarHBondContact O-CG 3.35Å; E63-K67 PolarHBondContact O-N 3.47Å; I64-K67 PolarHBondContact O-N 3.34Å; K67-K71 WeakPolarHBondContact O-CB 3.34Å; K67-K71 PolarHBondContact O-N 3.25Å
68	H	83.5	Confident	76.2	Confident	27 Å²	27	73.1 Å²	73.1	13%	0.125	38%	0.377	C	S	.	.	H	α-helix	trans	-61.4	-51.1	173.7	171.3	71.3	0	0	0	111.8	C55 I64 I65 K66 L70 K71 F72 H73	C55-H68 PolarHBondContact SG-NE2 3.43Å; I64-H68 VanDerWaalsContact O-CB 3.3Å; I64-H68 WeakPolarHBondContact O-CB 3.31Å; I64-H68 PolarHBondContact O-N 2.84Å; I65-H68 PolarHBondContact O-N 2.93Å; K66-H68 VanDerWaalsContact C-N 3.34Å; K66-H68 PolarHBondContact O-N 2.96Å; H68-L70 PolarHBondContact O-N 2.87Å; H68-K71 PolarHBondContact O-N 2.96Å; H68-F72 AromaticContact CE1-CD2 3.56Å; H68-F72 AromaticContact CE1-CG 3.84Å; H68-F72 AromaticContact ND1-CD2 3.21Å; H68-F72 WeakPolarHBondContact ND1-CD2 3.28Å; H68-F72 AromaticContact ND1-CE2 3.71Å; H68-F72 AromaticContact ND1-CG 3.97Å; H68-F72 WeakPolarHBondContact O-CD2 3.25Å; H68-F72 PolarHBondContact O-N 2.9Å; H68-H73 AromaticContact CD2-NE2 3.73Å; H68-H73 AromaticContact CE1-NE2 3.8Å; H68-H73 AromaticContact NE2-CD2 3.86Å; H68-H73 AromaticContact NE2-CE1 3.77Å; H68-H73 AromaticContact NE2-NE2 2.96Å; H68-H73 PolarHBondContact NE2-NE2 2.95Å
69	A	82.8	Confident	75.3	Confident	12 Å²	12	78.2 Å²	78.2	10%	0.099	41%	0.405	C	S	.	.	H	α-helix	trans	-60.1	-45.3	-179.3	0	0	0	0	0	112.2	I65 K66 K71 H73 G74	I65-A69 WeakPolarHBondContact O-CB 3.48Å; I65-A69 PolarHBondContact O-N 2.89Å; K66-A69 PolarHBondContact O-N 3.18Å; A69-K71 PolarHBondContact O-N 3.22Å; A69-H73 CarbonylContact O-C 2.9Å; A69-H73 WeakPolarHBondContact O-CA 3.28Å; A69-H73 WeakPolarHBondContact O-CB 3.46Å; A69-H73 PolarHBondContact O-N 3.13Å; A69-G74 PolarHBondContact O-N 3.07Å
70	L	83.3	Confident	74.9	Confident	112 Å²	112	80.4 Å²	80.4	59%	0.586	42%	0.418	S	S	*	.	H	α-helix	trans	-59.3	-44	173.7	-86.3	157.1	0	0	0	112.9	K66 H68 T75	K66-L70 WeakPolarHBondContact O-CB 3.24Å; K66-L70 PolarHBondContact O-N 3.09Å; H68-L70 PolarHBondContact O-N 2.87Å; L70-T75 HydrophobicContact CD2-CG2 4.16Å
71	K	82.9	Confident	74.7	Confident	169 Å²	169	78.1 Å²	78.1	74%	0.735	41%	0.413	S	S	*	.	H	α-helix	trans	-76.1	-32.7	-174.3	-174.9	173.1	179.6	-179.9	0	113.9	K67 H68 A69	K67-K71 WeakPolarHBondContact O-CB 3.34Å; K67-K71 PolarHBondContact O-N 3.25Å; H68-K71 PolarHBondContact O-N 2.96Å; A69-K71 PolarHBondContact O-N 3.22Å
72	F	81.1	Confident	74.6	Confident	135 Å²	135	78.4 Å²	78.4	59%	0.592	41%	0.414	S	S	*	.	H	α-helix	trans	-111.3	-27.7	-171.7	-69.4	-84.5	0	0	0	114.5	H68	H68-F72 AromaticContact CE1-CD2 3.56Å; H68-F72 AromaticContact CE1-CG 3.84Å; H68-F72 AromaticContact ND1-CD2 3.21Å; H68-F72 WeakPolarHBondContact ND1-CD2 3.28Å; H68-F72 AromaticContact ND1-CE2 3.71Å; H68-F72 AromaticContact ND1-CG 3.97Å; H68-F72 WeakPolarHBondContact O-CD2 3.25Å; H68-F72 PolarHBondContact O-N 2.9Å
73	H	81.7	Confident	74.2	Confident	40 Å²	40	77.1 Å²	77.1	19%	0.185	41%	0.406	C	S	.	.	H	α-helix	trans	-118.9	-1.6	-173.7	-47.6	-43.7	0	0	0	113.4	C50 F52 H68 A69	C50-H73 PolarHBondContact SG-CD2 3.21Å; F52-H73 HydrophobicContact CB-CB 4.22Å; F52-H73 VanDerWaalsContact CB-CD2 3.46Å; F52-H73 WeakPolarHBondContact CB-CD2 3.31Å; F52-H73 HydrophobicContact CD1-CB 4.16Å; F52-H73 AromaticContact CD1-CE1 3.76Å; F52-H73 AromaticContact CD1-CG 3.62Å; F52-H73 AromaticContact CD1-ND1 3.28Å; F52-H73 VanDerWaalsContact CD1-ND1 3.28Å; F52-H73 WeakPolarHBondContact CD1-ND1 3.29Å; F52-H73 HydrophobicContact CD2-CB 3.6Å; F52-H73 AromaticContact CD2-CG 3.85Å; F52-H73 HydrophobicContact CE1-CB 4.44Å; F52-H73 AromaticContact CE1-ND1 3.75Å; F52-H73 HydrophobicContact CE2-CB 3.91Å; F52-H73 HydrophobicContact CG-CB 3.72Å; F52-H73 AromaticContact CG-CD2 3.82Å; F52-H73 AromaticContact CG-CG 3.4Å; F52-H73 AromaticContact CG-ND1 3.62Å; F52-H73 HydrophobicContact CZ-CB 4.31Å; H68-H73 AromaticContact CD2-NE2 3.73Å; H68-H73 AromaticContact CE1-NE2 3.8Å; H68-H73 AromaticContact NE2-CD2 3.86Å; H68-H73 AromaticContact NE2-CE1 3.77Å; H68-H73 AromaticContact NE2-NE2 2.96Å; H68-H73 PolarHBondContact NE2-NE2 2.95Å; A69-H73 CarbonylContact O-C 2.9Å; A69-H73 WeakPolarHBondContact O-CA 3.28Å; A69-H73 WeakPolarHBondContact O-CB 3.46Å; A69-H73 PolarHBondContact O-N 3.13Å
74	G	72.6	Confident	73.7	Confident	35 Å²	35	77.8 Å²	77.8	36%	0.361	40%	0.404	S	S	.	.			trans	73.6	177.8	177.9	0	0	0	0	0	114.6	A69 N76 S77	A69-G74 PolarHBondContact O-N 3.07Å; G74-N76 PolarHBondContact O-N 2.96Å; G74-S77 PolarHBondContact O-N 3.48Å
75	T	64.6	Low	73	Confident	122 Å²	122	74.5 Å²	74.5	75%	0.748	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-18.5	-174.8	51	0	0	0	0	114.5	L70	L70-T75 HydrophobicContact CD2-CG2 4.16Å
76	N	57.9	Low	72.4	Confident	148 Å²	148	77.2 Å²	77.2	79%	0.791	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	5.4	-174.6	-62.3	-3.2	0	0	0	113	G74 P78	G74-N76 PolarHBondContact O-N 2.96Å; N76-P78 VanDerWaalsContact O-CD 3.24Å; N76-P78 WeakPolarHBondContact O-CD 3.22Å
77	S	52	Low	71.9	Confident	23 Å²	23	73.8 Å²	73.8	16%	0.161	39%	0.386	C	S	.	.			trans	-67.1	111.7	177.9	174	0	0	0	0	111.6	G74	G74-S77 PolarHBondContact O-N 3.48Å
78	P	51.5	Low	71.5	Confident	82 Å²	82	67.3 Å²	67.3	53%	0.532	36%	0.358	S	S	.	.			trans	-77	141.1	-179.2	32.5	-33.8	0	0	0	111.6	N76	N76-P78 VanDerWaalsContact O-CD 3.24Å; N76-P78 WeakPolarHBondContact O-CD 3.22Å
79	L	59.8	Low	70.7	Confident	124 Å²	124	68.3 Å²	68.3	65%	0.649	37%	0.368	S	S	*	.			trans	72.3	133.3	162.3	-54.3	158.2	0	0	0	117.1	C51	C51-L79 HydrophobicContact CB-CB 3.72Å; C51-L79 VanDerWaalsContact CB-O 3.28Å; C51-L79 WeakPolarHBondContact CB-O 3.22Å; C51-L79 PolarHBondContact N-O 3.02Å; C51-L79 VanDerWaalsContact SG-CB 3.56Å; C51-L79 PolarHBondContact SG-O 3.26Å; C51-L79 VanDerWaalsContact SG-O 3.39Å
80	V	70.2	Confident	69.9	Low	49 Å²	49	68.8 Å²	68.8	30%	0.297	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	116.2	157.8	171.1	0	0	0	0	106.4	F48 H49 I65	F48-V80 HydrophobicContact CB-CG1 4.02Å; F48-V80 HydrophobicContact CD1-CG1 4.18Å; H49-V80 CarbonylContact O-C 3.45Å; H49-V80 WeakPolarHBondContact O-CA 3.28Å; I65-V80 HydrophobicContact CG2-CB 4.33Å; I65-V80 HydrophobicContact CG2-CG1 3.71Å; I65-V80 HydrophobicContact CG2-CG2 3.7Å
81	T	73.8	Confident	68.9	Low	62 Å²	62	65.8 Å²	65.8	38%	0.38	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	140.4	175.5	-77.5	0	0	0	0	109.3	F48 H49 C51 T83	F48-T81 WeakPolarHBondContact CA-O 3.09Å; H49-T81 PolarHBondContact CD2-O 3.42Å; H49-T81 PolarHBondContact N-O 3.04Å; H49-T81 PolarHBondContact O-N 3.39Å; C51-T81 VanDerWaalsContact SG-CB 3.58Å; C51-T81 PolarHBondContact SG-N 3.36Å; C51-T81 PolarHBondContact SG-OG1 3.06Å; T81-T83 HydrophobicContact CG2-CG2 4.04Å
82	T	75.4	Confident	67.9	Low	45 Å²	45	62.5 Å²	62.5	28%	0.276	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	129.1	173.2	-54.9	0	0	0	0	109	V46 L47 F48	V46-T82 HydrophobicContact CG1-CG2 3.43Å; V46-T82 VanDerWaalsContact CG1-CG2 3.43Å; L47-T82 WeakPolarHBondContact O-CA 3.45Å; F48-T82 HydrophobicContact CD1-CG2 4.28Å; F48-T82 HydrophobicContact CE1-CG2 3.98Å
83	T	71.3	Confident	66.4	Low	10 Å²	10	60.7 Å²	60.7	6%	0.061	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	151.3	175	67.2	0	0	0	0	111	L47 H49 T81	L47-T83 PolarHBondContact N-O 3.45Å; L47-T83 PolarHBondContact O-N 3.31Å; H49-T83 VanDerWaalsContact NE2-CG2 3.26Å; H49-T83 WeakPolarHBondContact NE2-CG2 3.35Å; H49-T83 PolarHBondContact NE2-OG1 3.13Å; T81-T83 HydrophobicContact CG2-CG2 4.04Å
84	Y	71.9	Confident	65.1	Low	134 Å²	134	59.7 Å²	59.7	53%	0.525	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	130.9	176.3	-59.5	-92.1	0	0	0	110.2	L45 V46	L45-Y84 CarbonylContact O-C 3.54Å; L45-Y84 WeakPolarHBondContact O-CA 3.48Å; V46-Y84 HydrophobicContact CG2-CD1 4.01Å; V46-Y84 HydrophobicContact CG2-CE1 3.81Å
85	S	67.2	Low	64.1	Low	8 Å²	8	61.6 Å²	61.6	6%	0.056	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	131.8	169.6	-179.1	0	0	0	0	109.4	L45 G125	L45-S85 PolarHBondContact N-O 3.39Å; L45-S85 PolarHBondContact O-N 2.87Å; S85-G125 PolarHBondContact OG-O 2.82Å
86	F	71.9	Confident	63.2	Low	56 Å²	56	59.8 Å²	59.8	25%	0.246	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	108.5	-172.9	-65.8	-75.7	0	0	0	111.7	H25 L40 Y43 C88	H25-F86 AromaticContact CD2-CD2 3.82Å; H25-F86 AromaticContact CD2-CG 3.82Å; H25-F86 AromaticContact NE2-CD2 3.27Å; H25-F86 VanDerWaalsContact NE2-CD2 3.27Å; H25-F86 WeakPolarHBondContact NE2-CD2 3.45Å; H25-F86 AromaticContact NE2-CG 3.78Å; L40-F86 HydrophobicContact CB-CD1 4.36Å; L40-F86 HydrophobicContact CB-CE1 4Å; L40-F86 HydrophobicContact CD2-CD1 3.79Å; L40-F86 HydrophobicContact CD2-CE1 3.98Å; L40-F86 HydrophobicContact CD2-CG 4.23Å; L40-F86 WeakPolarHBondContact O-CE1 3.3Å; Y43-F86 CarbonylContact O-C 3.43Å; Y43-F86 WeakPolarHBondContact O-CA 3.43Å; F86-C88 VanDerWaalsContact C-N 3.28Å; F86-C88 PolarHBondContact O-N 2.75Å
87	M	71.5	Confident	62.4	Low	19 Å²	19	59.4 Å²	59.4	9%	0.094	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-83	3	-171.5	-41.5	-171.9	91.6	0	0	113.8	Y43 L45 S89 W90 P96	Y43-M87 WeakPolarHBondContact O-CG 3.29Å; Y43-M87 PolarHBondContact O-N 3.05Å; L45-M87 HydrophobicContact CB-CE 4.36Å; L45-M87 HydrophobicContact CB-CG 4.15Å; L45-M87 HydrophobicContact CB-SD 3.82Å; L45-M87 HydrophobicContact CD2-CE 4.22Å; M87-S89 VanDerWaalsContact C-N 3.29Å; M87-S89 PolarHBondContact O-N 2.87Å; M87-W90 HydrophobicContact CB-CD2 4.17Å; M87-W90 HydrophobicContact CB-CG 4.27Å; M87-W90 HydrophobicContact CE-CD2 4.2Å; M87-W90 HydrophobicContact CE-CE3 3.81Å; M87-W90 HydrophobicContact CE-CH2 3.26Å; M87-W90 HydrophobicContact CE-CZ2 3.64Å; M87-W90 HydrophobicContact CE-CZ3 3.35Å; M87-W90 VanDerWaalsContact O-CB 3.31Å; M87-W90 WeakPolarHBondContact O-CB 3.39Å; M87-W90 PolarHBondContact O-N 3.43Å; M87-W90 VanDerWaalsContact O-N 3.16Å; M87-P96 VanDerWaalsContact CE-CD 3.45Å; M87-P96 HydrophobicContact CE-CG 3.45Å; M87-P96 VanDerWaalsContact CE-CG 3.45Å; M87-P96 HydrophobicContact SD-CG 3.87Å
88	C	75.2	Confident	61.7	Low	1 Å²	1	69.1 Å²	69.1	1%	0.007	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-70.7	-25.8	-175.3	51.8	0	0	0	0	113.1	H25 C26 H39 Y43 F86 W90 R95	H25-C88 WeakPolarHBondContact CB-SG 3.34Å; C26-C88 VanDerWaalsContact CB-C 3.49Å; C26-C88 HydrophobicContact CB-CB 3.9Å; C26-C88 VanDerWaalsContact CB-O 3.24Å; C26-C88 WeakPolarHBondContact CB-O 3.39Å; H39-C88 WeakPolarHBondContact NE2-CB 3.46Å; H39-C88 PolarHBondContact NE2-SG 2.67Å; H39-C88 VanDerWaalsContact NE2-SG 3.43Å; Y43-C88 HydrophobicContact CD2-CB 3.54Å; Y43-C88 HydrophobicContact CE2-CB 4.27Å; Y43-C88 HydrophobicContact CG-CB 3.69Å; F86-C88 VanDerWaalsContact C-N 3.28Å; F86-C88 PolarHBondContact O-N 2.75Å; C88-W90 VanDerWaalsContact C-N 3.26Å; C88-R95 PolarHBondContact O-NH2 3.32Å
89	S	67	Low	60.7	Low	49 Å²	49	73.1 Å²	73.1	34%	0.343	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-71.4	-21.3	172.8	57.3	0	0	0	0	113.1	H25 M87	H25-S89 WeakPolarHBondContact O-CB 3.46Å; M87-S89 VanDerWaalsContact C-N 3.29Å; M87-S89 PolarHBondContact O-N 2.87Å
90	W	64.8	Low	59.3	Low	22 Å²	22	74.9 Å²	74.9	8%	0.083	39%	0.39	C	S	.	.	S	Bend	trans	-67.2	142	-174	-61.2	19.8	0	0	0	109.3	M87 C88 V94 R95 S127	M87-W90 HydrophobicContact CB-CD2 4.17Å; M87-W90 HydrophobicContact CB-CG 4.27Å; M87-W90 HydrophobicContact CE-CD2 4.2Å; M87-W90 HydrophobicContact CE-CE3 3.81Å; M87-W90 HydrophobicContact CE-CH2 3.26Å; M87-W90 HydrophobicContact CE-CZ2 3.64Å; M87-W90 HydrophobicContact CE-CZ3 3.35Å; M87-W90 VanDerWaalsContact O-CB 3.31Å; M87-W90 WeakPolarHBondContact O-CB 3.39Å; M87-W90 PolarHBondContact O-N 3.43Å; M87-W90 VanDerWaalsContact O-N 3.16Å; C88-W90 VanDerWaalsContact C-N 3.26Å; W90-V94 HydrophobicContact CE3-CG1 3.89Å; W90-V94 HydrophobicContact CZ3-CG1 4.35Å; W90-R95 HydrophobicContact CB-CG 3.81Å; W90-R95 PolarHBondContact O-NE 2.87Å; W90-R95 PolarHBondContact O-NH2 2.77Å; W90-R95 VanDerWaalsContact O-NH2 3.13Å; W90-S127 PolarHBondContact NE1-OG 3.35Å
91	P	61.9	Low	57.5	Low	49 Å²	49	76.8 Å²	76.8	32%	0.318	41%	0.41	S	S	.	.			trans	-55.1	150.9	172.8	-24.2	32.7	0	0	0	111.7	S93 V94 R95	P91-S93 PolarHBondContact O-N 3.23Å; P91-V94 HydrophobicContact CB-CG2 4.1Å; P91-V94 HydrophobicContact CG-CG2 4.14Å; P91-V94 PolarHBondContact O-N 3.16Å; P91-R95 PolarHBondContact O-N 3.41Å
92	S	62.3	Low	55.5	Low	99 Å²	99	81.9 Å²	81.9	69%	0.692	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-25.3	-179.1	-56.1	0	0	0	0	113.7
93	S	50.4	Low	53.5	Low	98 Å²	98	84.2 Å²	84.2	69%	0.685	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-10.6	174.8	60	0	0	0	0	115.1	P91	P91-S93 PolarHBondContact O-N 3.23Å
94	V	53.5	Low	52	Low	19 Å²	19	89.6 Å²	89.6	12%	0.115	49%	0.488	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	-25.1	-174.7	-172.4	0	0	0	0	111.6	W90 P91 P114	W90-V94 HydrophobicContact CE3-CG1 3.89Å; W90-V94 HydrophobicContact CZ3-CG1 4.35Å; P91-V94 HydrophobicContact CB-CG2 4.1Å; P91-V94 HydrophobicContact CG-CG2 4.14Å; P91-V94 PolarHBondContact O-N 3.16Å; V94-P114 HydrophobicContact CG1-CB 3.98Å; V94-P114 HydrophobicContact CG1-CG 4.16Å
95	R	51.6	Low	50.2	Low	75 Å²	75	88.3 Å²	88.3	28%	0.283	49%	0.491	S	S	.	.	S	Bend	trans	-54.2	136.6	170.1	-70.9	177.8	-166.6	162.2	10.6	109.4	C88 W90 P91 I97	C88-R95 PolarHBondContact O-NH2 3.32Å; W90-R95 HydrophobicContact CB-CG 3.81Å; W90-R95 PolarHBondContact O-NE 2.87Å; W90-R95 PolarHBondContact O-NH2 2.77Å; W90-R95 VanDerWaalsContact O-NH2 3.13Å; P91-R95 PolarHBondContact O-N 3.41Å; R95-I97 PolarHBondContact O-N 3.06Å
96	P	46.2	Very low	48.9	Very low	84 Å²	84	95.4 Å²	95.4	55%	0.545	53%	0.526	S	S	.	.			trans	-58.1	113.5	169.1	-20.6	31.3	0	0	0	109	M87 R98	M87-P96 VanDerWaalsContact CE-CD 3.45Å; M87-P96 HydrophobicContact CE-CG 3.45Å; M87-P96 VanDerWaalsContact CE-CG 3.45Å; M87-P96 HydrophobicContact SD-CG 3.87Å; P96-R98 PolarHBondContact O-N 3.4Å; P96-R98 VanDerWaalsContact O-N 3.08Å
97	I	40.2	Very low	47.6	Very low	139 Å²	139	96.9 Å²	96.9	71%	0.713	54%	0.544	S	S	*	.			trans	-57.5	115.7	157.8	-62.4	173.2	0	0	0	104.6	R95 I99	R95-I97 PolarHBondContact O-N 3.06Å; I97-I99 PolarHBondContact O-N 2.91Å
98	R	37.5	Very low	46	Very low	227 Å²	227	104.3 Å²	104.3	86%	0.857	58%	0.575	S	S	*	*			trans	-58.4	109.1	176.2	-174.2	-171.5	-160.6	-167.5	5	106	P96 Q100	P96-R98 PolarHBondContact O-N 3.4Å; P96-R98 VanDerWaalsContact O-N 3.08Å; R98-Q100 PolarHBondContact O-N 3.32Å
99	I	31.2	Very low	44.1	Very low	166 Å²	166	112 Å²	112	85%	0.851	62%	0.616	S	S	*	*			trans	-57.2	96.7	-158.1	-57	174.4	0	0	0	110.9	I97 A101	I97-I99 PolarHBondContact O-N 2.91Å; I99-A101 PolarHBondContact O-N 3.14Å
100	Q	31.4	Very low	42.5	Very low	161 Å²	161	115.3 Å²	115.3	75%	0.752	64%	0.639	S	S	*	*			trans	-94.9	77.5	173.2	-78.3	-175.7	-72.2	0	0	108.1	R98 H102	R98-Q100 PolarHBondContact O-N 3.32Å; Q100-H102 PolarHBondContact O-CD2 2.99Å; Q100-H102 PolarHBondContact O-N 3.34Å
101	A	30.6	Very low	41.4	Very low	89 Å²	89	124.9 Å²	124.9	74%	0.736	68%	0.675	S	S	*	*	S	Bend	trans	47.9	-1.2	150.8	0	0	0	0	0	121.7	I99	I99-A101 PolarHBondContact O-N 3.14Å
102	H	33	Very low	40.7	Very low	170 Å²	170	133 Å²	133	79%	0.787	70%	0.699	S	S	*	*			trans	-126.4	112.8	-169.4	-58.7	-69.7	0	0	0	111.7	Q100	Q100-H102 PolarHBondContact O-CD2 2.99Å; Q100-H102 PolarHBondContact O-N 3.34Å
103	A	32.8	Very low	40.2	Very low	93 Å²	93	131.4 Å²	131.4	77%	0.769	69%	0.685	S	S	*	*			trans	-82.7	171	153.6	0	0	0	0	0	109.3
104	P	39.2	Very low	40.7	Very low	123 Å²	123	129 Å²	129	80%	0.799	67%	0.668	S	S	*	*			cis	-107.8	-158	-2.9	44.7	-32.5	0	0	0	109.5
105	D	34.9	Very low	41.7	Very low	107 Å²	107	128.7 Å²	128.7	57%	0.572	67%	0.666	S	S	*	*			cis	-149.2	130.3	44.9	178.4	-6.3	0	0	0	109.5	S107	D105-S107 VanDerWaalsContact C-N 3.33Å; D105-S107 VanDerWaalsContact CG-OG 3.26Å; D105-S107 PolarHBondContact O-N 3.21Å; D105-S107 WeakPolarHBondContact OD1-CB 3.34Å; D105-S107 PolarHBondContact OD1-N 3.21Å; D105-S107 VanDerWaalsContact OD1-N 3.14Å; D105-S107 PolarHBondContact OD1-OG 2.75Å; D105-S107 PolarHBondContact OD2-OG 3.38Å
106	I	40.7	Very low	43	Very low	157 Å²	157	125.6 Å²	125.6	81%	0.805	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-80.8	-16.6	-167.7	-64	172.5	0	0	0	111.9	K108	I106-K108 VanDerWaalsContact C-N 3.3Å; I106-K108 PolarHBondContact O-N 2.87Å; I106-K108 VanDerWaalsContact O-N 3.1Å
107	S	42.9	Very low	44.8	Very low	87 Å²	87	121.7 Å²	121.7	61%	0.608	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-72.1	-2.5	-164.8	60.3	0	0	0	0	117.4	D105	D105-S107 VanDerWaalsContact C-N 3.33Å; D105-S107 VanDerWaalsContact CG-OG 3.26Å; D105-S107 PolarHBondContact O-N 3.21Å; D105-S107 WeakPolarHBondContact OD1-CB 3.34Å; D105-S107 PolarHBondContact OD1-N 3.21Å; D105-S107 VanDerWaalsContact OD1-N 3.14Å; D105-S107 PolarHBondContact OD1-OG 2.75Å; D105-S107 PolarHBondContact OD2-OG 3.38Å
108	K	38.8	Very low	46.8	Very low	175 Å²	175	115.7 Å²	115.7	76%	0.761	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-128.3	14.3	-168.9	-72.8	175.2	-177.8	162.9	0	116.4	I106 S110	I106-K108 VanDerWaalsContact C-N 3.3Å; I106-K108 PolarHBondContact O-N 2.87Å; I106-K108 VanDerWaalsContact O-N 3.1Å; K108-S110 PolarHBondContact O-N 2.84Å
109	L	34.9	Very low	48.9	Very low	163 Å²	163	104.9 Å²	104.9	85%	0.853	56%	0.559	S	S	*	*			trans	-76	32.9	-173.4	-123.3	77.2	0	0	0	116.5	R111	L109-R111 VanDerWaalsContact C-N 3.32Å; L109-R111 PolarHBondContact O-N 2.69Å
110	S	33.6	Very low	51	Low	118 Å²	118	99.4 Å²	99.4	83%	0.825	54%	0.539	S	S	*	.			trans	-88.2	27	-176.3	-160.7	0	0	0	0	114.5	K108	K108-S110 PolarHBondContact O-N 2.84Å
111	R	42.6	Very low	53	Low	223 Å²	223	94.8 Å²	94.8	84%	0.842	52%	0.517	S	S	*	.	S	Bend	trans	-139.8	96.5	-176.3	-72.8	-170.4	174.6	-174.6	-1.2	114	L109	L109-R111 VanDerWaalsContact C-N 3.32Å; L109-R111 PolarHBondContact O-N 2.69Å
112	R	46.3	Very low	55.1	Low	219 Å²	219	92.8 Å²	92.8	83%	0.826	50%	0.497	S	S	*	.			trans	53.5	88.7	168.2	-64.3	-174.9	-179.2	-178.6	-0.8	114.4
113	V	52.7	Low	57.1	Low	66 Å²	66	88.6 Å²	88.6	40%	0.4	49%	0.487	S	S	.	.			trans	-52.4	136.5	173	-159.9	0	0	0	0	110.9	C163 W165	V113-C163 WeakPolarHBondContact CG1-O 3.21Å; V113-C163 WeakPolarHBondContact CG2-O 3.17Å; V113-W165 HydrophobicContact CG1-CB 4.01Å
114	P	60	Low	59	Low	49 Å²	49	87.6 Å²	87.6	32%	0.318	47%	0.465	S	S	.	.			trans	-56.8	145.8	170.8	-22.5	32.6	0	0	0	111.3	V94 W165	V94-P114 HydrophobicContact CG1-CB 3.98Å; V94-P114 HydrophobicContact CG1-CG 4.16Å; P114-W165 PolarHBondContact O-NE1 3.31Å
115	S	74.6	Confident	60.7	Low	12 Å²	12	82.6 Å²	82.6	8%	0.084	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	159.4	169.9	-59.3	0	0	0	0	109.5	F117 S127 M166	S115-F117 VanDerWaalsContact CB-CE2 3.41Å; S115-F117 VanDerWaalsContact CB-CZ 3.46Å; S115-S127 VanDerWaalsContact O-CA 3.22Å; S115-S127 WeakPolarHBondContact O-CA 3.34Å; S115-S127 VanDerWaalsContact O-CB 3.29Å; S115-S127 WeakPolarHBondContact O-CB 3.34Å; S115-M166 CarbonylContact C-O 3.54Å; S115-M166 VanDerWaalsContact CA-O 3.22Å; S115-M166 WeakPolarHBondContact CA-O 3.27Å; S115-M166 WeakPolarHBondContact CB-O 3.32Å
116	A	78.8	Confident	62.7	Low	10 Å²	10	78 Å²	78	8%	0.083	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	95.4	-175.6	0	0	0	0	0	111.2	F118 W165 M166 T167	A116-F118 HydrophobicContact CB-CE2 3.79Å; A116-F118 HydrophobicContact CB-CZ 3.87Å; A116-F118 WeakPolarHBondContact O-CE2 3.41Å; A116-W165 HydrophobicContact CB-CH2 4.26Å; A116-W165 HydrophobicContact CB-CZ2 3.78Å; A116-M166 PolarHBondContact N-O 3.33Å; A116-T167 WeakPolarHBondContact O-CA 3.36Å; A116-T167 VanDerWaalsContact O-CB 3.27Å; A116-T167 WeakPolarHBondContact O-CB 3.19Å; A116-T167 PolarHBondContact O-OG1 3.35Å
117	F	84.5	Confident	64.2	Low	1 Å²	1	71.1 Å²	71.1	0%	0.004	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	137.9	-177.8	-46.8	-73.6	0	0	0	111.4	S115 G125 T126 L129 F132 L157 M166 N168	S115-F117 VanDerWaalsContact CB-CE2 3.41Å; S115-F117 VanDerWaalsContact CB-CZ 3.46Å; F117-G125 CarbonylContact O-C 3.6Å; F117-G125 WeakPolarHBondContact O-CA 3.34Å; F117-T126 HydrophobicContact CB-CG2 4.37Å; F117-T126 PolarHBondContact N-O 2.91Å; F117-T126 PolarHBondContact O-N 2.81Å; F117-L129 HydrophobicContact CD1-CD1 4.32Å; F117-L129 HydrophobicContact CD2-CB 4.49Å; F117-L129 HydrophobicContact CD2-CD1 4.47Å; F117-L129 HydrophobicContact CE1-CD1 3.96Å; F117-L129 HydrophobicContact CE2-CB 3.76Å; F117-L129 HydrophobicContact CE2-CD1 4.12Å; F117-L129 HydrophobicContact CZ-CB 4Å; F117-L129 HydrophobicContact CZ-CD1 3.84Å; F117-L129 HydrophobicContact CZ-CG 4.39Å; F117-F132 HydrophobicContact CB-CB 3.84Å; F117-F132 HydrophobicContact CB-CD1 3.6Å; F117-F132 HydrophobicContact CB-CD2 3.64Å; F117-F132 HydrophobicContact CB-CE1 4Å; F117-F132 HydrophobicContact CB-CE2 4.06Å; F117-F132 HydrophobicContact CB-CG 3.4Å; F117-F132 HydrophobicContact CB-CZ 4.22Å; F117-F132 HydrophobicContact CD1-CD1 4.21Å; F117-F132 HydrophobicContact CD2-CB 4.26Å; F117-F132 HydrophobicContact CG-CB 4.2Å; F117-F132 AromaticContact CG-CD1 3.95Å; F117-F132 HydrophobicContact CG-CD1 3.95Å; F117-F132 HydrophobicContact CG-CG 4.05Å; F117-L157 HydrophobicContact CD1-CD2 3.86Å; F117-L157 HydrophobicContact CE1-CD1 4.27Å; F117-L157 HydrophobicContact CE1-CD2 3.83Å; F117-M166 HydrophobicContact CE1-CB 4.16Å; F117-M166 HydrophobicContact CZ-CB 4.17Å; F117-M166 HydrophobicContact CZ-CE 4.42Å; F117-N168 WeakPolarHBondContact CA-OD1 3.44Å
118	F	81.9	Confident	65.7	Low	13 Å²	13	69.8 Å²	69.8	6%	0.057	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	130	-173.4	-54.7	-74.7	0	0	0	111.5	L47 K58 A116 A120 N168 V169 M172	L47-F118 HydrophobicContact CD1-CD1 3.86Å; L47-F118 HydrophobicContact CD1-CE1 3.22Å; L47-F118 HydrophobicContact CD1-CZ 3.71Å; K58-F118 HydrophobicContact CD-CB 4.39Å; A116-F118 HydrophobicContact CB-CE2 3.79Å; A116-F118 HydrophobicContact CB-CZ 3.87Å; A116-F118 WeakPolarHBondContact O-CE2 3.41Å; F118-A120 PolarHBondContact O-N 2.76Å; F118-N168 PolarHBondContact N-OD1 2.63Å; F118-N168 PolarHBondContact O-ND2 2.95Å; F118-N168 PolarHBondContact O-OD1 3.08Å; F118-V169 HydrophobicContact CD2-CG2 4.11Å; F118-M172 HydrophobicContact CD2-SD 4.14Å; F118-M172 HydrophobicContact CE2-CE 3.71Å; F118-M172 HydrophobicContact CE2-SD 3.51Å; F118-M172 VanDerWaalsContact CE2-SD 3.51Å; F118-M172 HydrophobicContact CZ-CE 4.01Å; F118-M172 HydrophobicContact CZ-SD 4.22Å
119	C	81.4	Confident	67.8	Low	0 Å²	0	64 Å²	64	0%	0	34%	0.338	C	S	.	.			trans	-63.5	134.8	175.3	-172.5	0	0	0	0	110.4	K58 H121 F124 H135 C139	K58-C119 PolarHBondContact NZ-O 3.48Å; C119-H121 VanDerWaalsContact C-N 3.26Å; C119-H121 PolarHBondContact SG-N 2.92Å; C119-H121 VanDerWaalsContact SG-N 3.42Å; C119-F124 HydrophobicContact CB-CB 4.26Å; C119-F124 PolarHBondContact N-O 3.41Å; C119-H135 WeakPolarHBondContact CB-NE2 3.5Å; C119-H135 PolarHBondContact SG-NE2 3.21Å; C119-H135 VanDerWaalsContact SG-NE2 3.36Å; C119-C139 PolarHBondContact SG-SG 2.84Å
120	A	74.5	Confident	70	Confident	52 Å²	52	63.4 Å²	63.4	43%	0.43	33%	0.332	S	S	.	.	S	Bend	trans	-75.6	-17.6	175.9	0	0	0	0	0	112.5	F118	F118-A120 PolarHBondContact O-N 2.76Å
121	H	73.9	Confident	72.2	Confident	64 Å²	64	60.9 Å²	60.9	30%	0.296	31%	0.309	S	S	.	.	S	Bend	trans	-110.3	-15.1	-172.2	-66.1	-115.4	0	0	0	114.1	C119 A141 I142	C119-H121 VanDerWaalsContact C-N 3.26Å; C119-H121 PolarHBondContact SG-N 2.92Å; C119-H121 VanDerWaalsContact SG-N 3.42Å; H121-A141 HydrophobicContact CB-CB 3.74Å; H121-A141 WeakPolarHBondContact CB-O 3.29Å; H121-A141 PolarHBondContact ND1-O 2.86Å; H121-A141 WeakPolarHBondContact O-CB 3.25Å; H121-I142 HydrophobicContact CB-CG1 3.83Å
122	C	75.7	Confident	74.3	Confident	47 Å²	47	50.3 Å²	50.3	32%	0.318	27%	0.269	S	S	.	.	S	Bend	trans	-149.2	172.4	174.9	84.1	0	0	0	0	112.5	F124 H135 C139 A141	C122-F124 PolarHBondContact O-N 2.9Å; C122-H135 PolarHBondContact SG-CE1 3.27Å; C122-H135 PolarHBondContact SG-NE2 2.94Å; C122-C139 VanDerWaalsContact SG-SG 3.67Å; C122-A141 HydrophobicContact CB-CB 4.15Å
123	S	73.8	Confident	76.1	Confident	81 Å²	81	40.9 Å²	40.9	57%	0.566	24%	0.238	S	C	*	.	S	Bend	trans	-69.1	10.2	-174.8	-46	0	0	0	0	116.4
124	F	72.7	Confident	77.5	Confident	72 Å²	72	43.5 Å²	43.5	32%	0.316	25%	0.246	S	C	.	.			trans	-78.1	137.7	-178.7	-176.4	-94.1	0	0	0	112.1	C119 C122 T126 H135	C119-F124 HydrophobicContact CB-CB 4.26Å; C119-F124 PolarHBondContact N-O 3.41Å; C122-F124 PolarHBondContact O-N 2.9Å; F124-T126 HydrophobicContact CD1-CG2 4.44Å; F124-T126 HydrophobicContact CE1-CG2 3.55Å; F124-T126 HydrophobicContact CZ-CG2 4.14Å; F124-H135 VanDerWaalsContact CB-CE1 3.43Å; F124-H135 WeakPolarHBondContact CB-CE1 3.34Å; F124-H135 HydrophobicContact CD1-CB 3.62Å; F124-H135 AromaticContact CD1-CD2 3.5Å; F124-H135 AromaticContact CD1-CG 3.22Å; F124-H135 AromaticContact CD1-ND1 3.64Å; F124-H135 AromaticContact CD2-ND1 3.74Å; F124-H135 HydrophobicContact CE1-CB 3.35Å; F124-H135 AromaticContact CE1-CG 3.55Å; F124-H135 HydrophobicContact CE2-CB 4.48Å; F124-H135 HydrophobicContact CG-CB 4.28Å; F124-H135 AromaticContact CG-CD2 3.88Å; F124-H135 AromaticContact CG-CE1 3.69Å; F124-H135 AromaticContact CG-CG 3.55Å; F124-H135 AromaticContact CG-ND1 3.43Å; F124-H135 WeakPolarHBondContact CG-ND1 3.48Å; F124-H135 AromaticContact CG-NE2 3.96Å; F124-H135 HydrophobicContact CZ-CB 3.84Å
125	G	75.3	Confident	78.5	Confident	18 Å²	18	42.7 Å²	42.7	19%	0.186	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	143.5	171.6	0	0	0	0	0	112.2	S85 F117	S85-G125 PolarHBondContact OG-O 2.82Å; F117-G125 CarbonylContact O-C 3.6Å; F117-G125 WeakPolarHBondContact O-CA 3.34Å
126	T	76.7	Confident	78.9	Confident	12 Å²	12	42.6 Å²	42.6	7%	0.074	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	153.4	-171.2	175.8	0	0	0	0	110.8	F117 F124 H128 N131 F132	F117-T126 HydrophobicContact CB-CG2 4.37Å; F117-T126 PolarHBondContact N-O 2.91Å; F117-T126 PolarHBondContact O-N 2.81Å; F124-T126 HydrophobicContact CD1-CG2 4.44Å; F124-T126 HydrophobicContact CE1-CG2 3.55Å; F124-T126 HydrophobicContact CZ-CG2 4.14Å; T126-H128 WeakPolarHBondContact CG2-O 3.43Å; T126-H128 PolarHBondContact OG1-N 2.78Å; T126-H128 PolarHBondContact OG1-O 3.49Å; T126-N131 HydrophobicContact CG2-CB 4.26Å; T126-F132 HydrophobicContact CG2-CB 3.62Å; T126-F132 HydrophobicContact CG2-CD2 4.32Å; T126-F132 HydrophobicContact CG2-CG 4.39Å
127	S	72.2	Confident	79	Confident	12 Å²	12	43 Å²	43	8%	0.084	24%	0.24	C	C	.	.	S	Bend	trans	-89.4	-16	169.8	49.1	0	0	0	0	113.7	W90 S115	W90-S127 PolarHBondContact NE1-OG 3.35Å; S115-S127 VanDerWaalsContact O-CA 3.22Å; S115-S127 WeakPolarHBondContact O-CA 3.34Å; S115-S127 VanDerWaalsContact O-CB 3.29Å; S115-S127 WeakPolarHBondContact O-CB 3.34Å
128	H	75.9	Confident	78.6	Confident	58 Å²	58	49 Å²	49	27%	0.269	27%	0.269	S	S	.	.			trans	-95.6	123.8	-179.2	-63.9	-102.1	0	0	0	110.3	T126 E130 N131 F132	T126-H128 WeakPolarHBondContact CG2-O 3.43Å; T126-H128 PolarHBondContact OG1-N 2.78Å; T126-H128 PolarHBondContact OG1-O 3.49Å; H128-E130 VanDerWaalsContact C-N 3.34Å; H128-E130 PolarHBondContact O-N 2.93Å; H128-N131 HydrophobicContact CB-CB 4.08Å; H128-N131 PolarHBondContact O-N 3.03Å; H128-F132 PolarHBondContact O-N 2.74Å
129	L	81.6	Confident	78.3	Confident	53 Å²	53	48.6 Å²	48.6	28%	0.277	27%	0.268	S	S	.	.	H	α-helix	trans	-65.2	-35.9	-179.7	-176	58.7	0	0	0	112.1	F117 F132 A133 L157 F195	F117-L129 HydrophobicContact CD1-CD1 4.32Å; F117-L129 HydrophobicContact CD2-CB 4.49Å; F117-L129 HydrophobicContact CD2-CD1 4.47Å; F117-L129 HydrophobicContact CE1-CD1 3.96Å; F117-L129 HydrophobicContact CE2-CB 3.76Å; F117-L129 HydrophobicContact CE2-CD1 4.12Å; F117-L129 HydrophobicContact CZ-CB 4Å; F117-L129 HydrophobicContact CZ-CD1 3.84Å; F117-L129 HydrophobicContact CZ-CG 4.39Å; L129-F132 HydrophobicContact CD1-CD1 4.2Å; L129-F132 CarbonylContact O-C 3.57Å; L129-F132 WeakPolarHBondContact O-CA 3.26Å; L129-F132 WeakPolarHBondContact O-CB 3.23Å; L129-F132 PolarHBondContact O-N 3Å; L129-F132 VanDerWaalsContact O-N 3.11Å; L129-A133 PolarHBondContact O-N 3.08Å; L129-L157 HydrophobicContact CD1-CD1 3.99Å; L129-L157 HydrophobicContact CD2-CD1 4.37Å; L129-F195 HydrophobicContact CD1-CD1 4.11Å; L129-F195 HydrophobicContact CD1-CD2 4.31Å; L129-F195 HydrophobicContact CD1-CE1 3.7Å; L129-F195 HydrophobicContact CD1-CE2 3.94Å; L129-F195 HydrophobicContact CD1-CG 4.4Å; L129-F195 HydrophobicContact CD1-CZ 3.61Å; L129-F195 HydrophobicContact CD2-CD2 4.29Å; L129-F195 HydrophobicContact CD2-CE2 3.76Å; L129-F195 HydrophobicContact CD2-CZ 4.13Å; L129-F195 HydrophobicContact CG-CE1 4.3Å; L129-F195 HydrophobicContact CG-CE2 3.89Å; L129-F195 HydrophobicContact CG-CZ 3.71Å
130	E	81.7	Confident	77.7	Confident	152 Å²	152	56.5 Å²	56.5	71%	0.71	30%	0.298	S	S	*	.	H	α-helix	trans	-57.1	-52.3	172.8	-66.4	157.1	-168.6	0	0	111.6	H128 F132 A133 Q134	H128-E130 VanDerWaalsContact C-N 3.34Å; H128-E130 PolarHBondContact O-N 2.93Å; E130-F132 PolarHBondContact O-N 3.43Å; E130-A133 PolarHBondContact O-N 3.36Å; E130-Q134 WeakPolarHBondContact O-CB 3.4Å; E130-Q134 PolarHBondContact O-N 2.56Å
131	N	80.4	Confident	77.3	Confident	65 Å²	65	55.3 Å²	55.3	35%	0.348	29%	0.288	S	S	.	.	H	α-helix	trans	-63.3	-28	175.8	-66.1	-9.8	0	0	0	112	T126 H128 H135	T126-N131 HydrophobicContact CG2-CB 4.26Å; H128-N131 HydrophobicContact CB-CB 4.08Å; H128-N131 PolarHBondContact O-N 3.03Å; N131-H135 WeakPolarHBondContact O-CB 3.48Å; N131-H135 PolarHBondContact O-N 2.8Å
132	F	84.9	Confident	77	Confident	1 Å²	1	52.5 Å²	52.5	0%	0.004	28%	0.275	C	S	.	.	H	α-helix	trans	-73	-44	174.9	-174.3	-126.1	0	0	0	111.2	F117 T126 H128 L129 E130 H135 L136 N168	F117-F132 HydrophobicContact CB-CB 3.84Å; F117-F132 HydrophobicContact CB-CD1 3.6Å; F117-F132 HydrophobicContact CB-CD2 3.64Å; F117-F132 HydrophobicContact CB-CE1 4Å; F117-F132 HydrophobicContact CB-CE2 4.06Å; F117-F132 HydrophobicContact CB-CG 3.4Å; F117-F132 HydrophobicContact CB-CZ 4.22Å; F117-F132 HydrophobicContact CD1-CD1 4.21Å; F117-F132 HydrophobicContact CD2-CB 4.26Å; F117-F132 HydrophobicContact CG-CB 4.2Å; F117-F132 AromaticContact CG-CD1 3.95Å; F117-F132 HydrophobicContact CG-CD1 3.95Å; F117-F132 HydrophobicContact CG-CG 4.05Å; T126-F132 HydrophobicContact CG2-CB 3.62Å; T126-F132 HydrophobicContact CG2-CD2 4.32Å; T126-F132 HydrophobicContact CG2-CG 4.39Å; H128-F132 PolarHBondContact O-N 2.74Å; L129-F132 HydrophobicContact CD1-CD1 4.2Å; L129-F132 CarbonylContact O-C 3.57Å; L129-F132 WeakPolarHBondContact O-CA 3.26Å; L129-F132 WeakPolarHBondContact O-CB 3.23Å; L129-F132 PolarHBondContact O-N 3Å; L129-F132 VanDerWaalsContact O-N 3.11Å; E130-F132 PolarHBondContact O-N 3.43Å; F132-H135 PolarHBondContact O-N 3.24Å; F132-L136 HydrophobicContact CD1-CD1 4.01Å; F132-L136 HydrophobicContact CD2-CG 4.37Å; F132-L136 HydrophobicContact CE1-CD1 3.6Å; F132-L136 HydrophobicContact CE1-CG 4.23Å; F132-L136 HydrophobicContact CE2-CD1 4.32Å; F132-L136 HydrophobicContact CE2-CD2 4.03Å; F132-L136 HydrophobicContact CE2-CG 4.05Å; F132-L136 HydrophobicContact CZ-CD1 3.77Å; F132-L136 HydrophobicContact CZ-CD2 3.95Å; F132-L136 HydrophobicContact CZ-CG 3.98Å; F132-L136 WeakPolarHBondContact O-CG 3.18Å; F132-L136 PolarHBondContact O-N 3.45Å; F132-N168 HydrophobicContact CE1-CB 4.33Å; F132-N168 HydrophobicContact CZ-CB 4.41Å; F132-N168 WeakPolarHBondContact CZ-ND2 3.43Å
133	A	84.4	Confident	76.3	Confident	21 Å²	21	50.9 Å²	50.9	17%	0.174	26%	0.264	C	S	.	.	H	α-helix	trans	-62.4	-50.3	175.4	0	0	0	0	0	111.7	L129 E130 H135 L136 A137 F195 V197	L129-A133 PolarHBondContact O-N 3.08Å; E130-A133 PolarHBondContact O-N 3.36Å; A133-H135 PolarHBondContact O-N 2.78Å; A133-L136 PolarHBondContact O-N 3.28Å; A133-L136 VanDerWaalsContact O-N 3.11Å; A133-A137 PolarHBondContact O-N 3.06Å; A133-F195 HydrophobicContact CB-CE1 3.9Å; A133-F195 HydrophobicContact CB-CZ 3.89Å; A133-V197 HydrophobicContact CB-CG1 4.26Å; A133-V197 HydrophobicContact CB-CG2 3.89Å; A133-V197 WeakPolarHBondContact O-CG1 3.17Å
134	Q	82.1	Confident	75.5	Confident	121 Å²	121	50.8 Å²	50.8	57%	0.565	26%	0.264	S	S	*	.	H	α-helix	trans	-57.2	-40.6	174.9	-170.2	-177.5	38.9	0	0	111.1	E130 M138	E130-Q134 WeakPolarHBondContact O-CB 3.4Å; E130-Q134 PolarHBondContact O-N 2.56Å; Q134-M138 HydrophobicContact CG-SD 3.97Å; Q134-M138 WeakPolarHBondContact O-CB 3.14Å; Q134-M138 VanDerWaalsContact O-CG 3.29Å; Q134-M138 WeakPolarHBondContact O-CG 3.19Å; Q134-M138 PolarHBondContact O-N 3.44Å
135	H	82.2	Confident	74.6	Confident	32 Å²	32	54.6 Å²	54.6	15%	0.148	28%	0.282	C	S	.	.	H	α-helix	trans	-64.8	-47.1	173.7	178.3	75.4	0	0	0	112.9	C119 C122 F124 N131 F132 A133 A137 M138 C139	C119-H135 WeakPolarHBondContact CB-NE2 3.5Å; C119-H135 PolarHBondContact SG-NE2 3.21Å; C119-H135 VanDerWaalsContact SG-NE2 3.36Å; C122-H135 PolarHBondContact SG-CE1 3.27Å; C122-H135 PolarHBondContact SG-NE2 2.94Å; F124-H135 VanDerWaalsContact CB-CE1 3.43Å; F124-H135 WeakPolarHBondContact CB-CE1 3.34Å; F124-H135 HydrophobicContact CD1-CB 3.62Å; F124-H135 AromaticContact CD1-CD2 3.5Å; F124-H135 AromaticContact CD1-CG 3.22Å; F124-H135 AromaticContact CD1-ND1 3.64Å; F124-H135 AromaticContact CD2-ND1 3.74Å; F124-H135 HydrophobicContact CE1-CB 3.35Å; F124-H135 AromaticContact CE1-CG 3.55Å; F124-H135 HydrophobicContact CE2-CB 4.48Å; F124-H135 HydrophobicContact CG-CB 4.28Å; F124-H135 AromaticContact CG-CD2 3.88Å; F124-H135 AromaticContact CG-CE1 3.69Å; F124-H135 AromaticContact CG-CG 3.55Å; F124-H135 AromaticContact CG-ND1 3.43Å; F124-H135 WeakPolarHBondContact CG-ND1 3.48Å; F124-H135 AromaticContact CG-NE2 3.96Å; F124-H135 HydrophobicContact CZ-CB 3.84Å; N131-H135 WeakPolarHBondContact O-CB 3.48Å; N131-H135 PolarHBondContact O-N 2.8Å; F132-H135 PolarHBondContact O-N 3.24Å; A133-H135 PolarHBondContact O-N 2.78Å; H135-A137 VanDerWaalsContact C-N 3.32Å; H135-A137 PolarHBondContact O-N 3.07Å; H135-M138 CarbonylContact O-C 3.55Å; H135-M138 PolarHBondContact O-N 2.93Å; H135-M138 VanDerWaalsContact O-N 3.1Å; H135-C139 PolarHBondContact NE2-SG 2.9Å; H135-C139 WeakPolarHBondContact O-CA 3.47Å; H135-C139 VanDerWaalsContact O-CB 3.23Å; H135-C139 WeakPolarHBondContact O-CB 3.43Å; H135-C139 PolarHBondContact O-N 3.2Å
136	L	83.2	Confident	73.4	Confident	9 Å²	9	57.3 Å²	57.3	5%	0.047	29%	0.292	C	S	.	.	H	α-helix	trans	-58.5	-44	179.4	-74	177.9	0	0	0	111.4	F132 A133 M138 C139 I142 V197	F132-L136 HydrophobicContact CD1-CD1 4.01Å; F132-L136 HydrophobicContact CD2-CG 4.37Å; F132-L136 HydrophobicContact CE1-CD1 3.6Å; F132-L136 HydrophobicContact CE1-CG 4.23Å; F132-L136 HydrophobicContact CE2-CD1 4.32Å; F132-L136 HydrophobicContact CE2-CD2 4.03Å; F132-L136 HydrophobicContact CE2-CG 4.05Å; F132-L136 HydrophobicContact CZ-CD1 3.77Å; F132-L136 HydrophobicContact CZ-CD2 3.95Å; F132-L136 HydrophobicContact CZ-CG 3.98Å; F132-L136 WeakPolarHBondContact O-CG 3.18Å; F132-L136 PolarHBondContact O-N 3.45Å; A133-L136 PolarHBondContact O-N 3.28Å; A133-L136 VanDerWaalsContact O-N 3.11Å; L136-M138 VanDerWaalsContact C-N 3.28Å; L136-M138 PolarHBondContact O-N 2.82Å; L136-C139 PolarHBondContact O-N 2.8Å; L136-I142 HydrophobicContact CB-CD1 4.48Å; L136-I142 HydrophobicContact CD2-CD1 3.59Å; L136-V197 HydrophobicContact CB-CG2 4.32Å; L136-V197 HydrophobicContact CD1-CG2 3.93Å
137	A	79.7	Confident	72.2	Confident	20 Å²	20	64 Å²	64	17%	0.165	33%	0.326	C	S	.	.	H	α-helix	trans	-62.8	-31.4	175.9	0	0	0	0	0	113.3	A133 H135 V197	A133-A137 PolarHBondContact O-N 3.06Å; H135-A137 VanDerWaalsContact C-N 3.32Å; H135-A137 PolarHBondContact O-N 3.07Å; A137-V197 HydrophobicContact CB-CG1 3.99Å
138	M	76.6	Confident	71.2	Confident	125 Å²	125	65.4 Å²	65.4	62%	0.616	33%	0.333	S	S	*	.	H	α-helix	trans	-103.1	2.3	-176.8	-61.7	-179.9	74	0	0	114.2	Q134 H135 L136 R140	Q134-M138 HydrophobicContact CG-SD 3.97Å; Q134-M138 WeakPolarHBondContact O-CB 3.14Å; Q134-M138 VanDerWaalsContact O-CG 3.29Å; Q134-M138 WeakPolarHBondContact O-CG 3.19Å; Q134-M138 PolarHBondContact O-N 3.44Å; H135-M138 CarbonylContact O-C 3.55Å; H135-M138 PolarHBondContact O-N 2.93Å; H135-M138 VanDerWaalsContact O-N 3.1Å; L136-M138 VanDerWaalsContact C-N 3.28Å; L136-M138 PolarHBondContact O-N 2.82Å; M138-R140 PolarHBondContact O-N 2.96Å
139	C	75.9	Confident	70.1	Confident	5 Å²	5	69.2 Å²	69.2	3%	0.034	36%	0.36	C	S	.	.			trans	-77.3	100	-170.3	-169.4	0	0	0	0	111.5	C119 C122 H135 L136 A141 I142 S143	C119-C139 PolarHBondContact SG-SG 2.84Å; C122-C139 VanDerWaalsContact SG-SG 3.67Å; H135-C139 PolarHBondContact NE2-SG 2.9Å; H135-C139 WeakPolarHBondContact O-CA 3.47Å; H135-C139 VanDerWaalsContact O-CB 3.23Å; H135-C139 WeakPolarHBondContact O-CB 3.43Å; H135-C139 PolarHBondContact O-N 3.2Å; L136-C139 PolarHBondContact O-N 2.8Å; C139-A141 PolarHBondContact O-N 3.38Å; C139-I142 HydrophobicContact CB-CB 4.25Å; C139-I142 HydrophobicContact CB-CD1 3.75Å; C139-I142 HydrophobicContact CB-CG1 3.78Å; C139-I142 WeakPolarHBondContact O-CA 3.24Å; C139-I142 WeakPolarHBondContact O-CB 3.21Å; C139-I142 PolarHBondContact O-N 2.96Å; C139-S143 PolarHBondContact O-N 3.42Å; C139-S143 VanDerWaalsContact O-N 3.14Å; C139-S143 PolarHBondContact O-OG 2.86Å
140	R	69.2	Low	69	Low	166 Å²	166	69 Å²	69	63%	0.626	36%	0.363	S	S	*	.	H	α-helix	trans	-49	-31.4	176.4	-65.8	-174.2	174	162.7	-0.2	114.5	M138 S143 S144	M138-R140 PolarHBondContact O-N 2.96Å; R140-S143 CarbonylContact O-C 3.6Å; R140-S143 PolarHBondContact O-N 3.24Å; R140-S144 WeakPolarHBondContact O-CB 3.44Å; R140-S144 PolarHBondContact O-N 2.9Å; R140-S144 PolarHBondContact O-OG 3.24Å
141	A	66.2	Low	68.3	Low	27 Å²	27	66.8 Å²	66.8	22%	0.223	36%	0.355	C	S	.	.	H	α-helix	trans	-79.6	-15.6	179.6	0	0	0	0	0	114.1	H121 C122 C139 H145	H121-A141 HydrophobicContact CB-CB 3.74Å; H121-A141 WeakPolarHBondContact CB-O 3.29Å; H121-A141 PolarHBondContact ND1-O 2.86Å; H121-A141 WeakPolarHBondContact O-CB 3.25Å; C122-A141 HydrophobicContact CB-CB 4.15Å; C139-A141 PolarHBondContact O-N 3.38Å; A141-H145 WeakPolarHBondContact O-CB 3.27Å
142	I	66.6	Low	68	Low	6 Å²	6	65.4 Å²	65.4	3%	0.031	35%	0.351	C	S	.	.	H	α-helix	trans	-77	-51.6	162.3	-60.2	179.6	0	0	0	107.8	H121 L136 C139 S144 H145 L146 V153	H121-I142 HydrophobicContact CB-CG1 3.83Å; L136-I142 HydrophobicContact CB-CD1 4.48Å; L136-I142 HydrophobicContact CD2-CD1 3.59Å; C139-I142 HydrophobicContact CB-CB 4.25Å; C139-I142 HydrophobicContact CB-CD1 3.75Å; C139-I142 HydrophobicContact CB-CG1 3.78Å; C139-I142 WeakPolarHBondContact O-CA 3.24Å; C139-I142 WeakPolarHBondContact O-CB 3.21Å; C139-I142 PolarHBondContact O-N 2.96Å; I142-S144 PolarHBondContact O-N 2.82Å; I142-H145 PolarHBondContact O-N 2.81Å; I142-L146 HydrophobicContact CG2-CD1 3.56Å; I142-L146 PolarHBondContact O-N 3.35Å; I142-V153 HydrophobicContact CD1-CG1 4.28Å; I142-V153 HydrophobicContact CG2-CG2 4.07Å
143	S	61.4	Low	67.6	Low	12 Å²	12	66.5 Å²	66.5	8%	0.084	36%	0.358	C	S	.	.	H	α-helix	trans	-64.5	-19.3	-177.1	-42.3	0	0	0	0	115.3	C139 R140 N207 I211	C139-S143 PolarHBondContact O-N 3.42Å; C139-S143 VanDerWaalsContact O-N 3.14Å; C139-S143 PolarHBondContact O-OG 2.86Å; R140-S143 CarbonylContact O-C 3.6Å; R140-S143 PolarHBondContact O-N 3.24Å; S143-N207 PolarHBondContact OG-ND2 3.47Å; S143-I211 WeakPolarHBondContact O-CD1 3.47Å
144	S	56.4	Low	67.4	Low	80 Å²	80	69.1 Å²	69.1	56%	0.559	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-11.3	174	68.4	0	0	0	0	113.9	R140 I142	R140-S144 WeakPolarHBondContact O-CB 3.44Å; R140-S144 PolarHBondContact O-N 2.9Å; R140-S144 PolarHBondContact O-OG 3.24Å; I142-S144 PolarHBondContact O-N 2.82Å
145	H	53.7	Low	67.4	Low	152 Å²	152	64.4 Å²	64.4	70%	0.704	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.1	-24	-169.4	-133	-52.2	0	0	0	113.7	A141 I142	A141-H145 WeakPolarHBondContact O-CB 3.27Å; I142-H145 PolarHBondContact O-N 2.81Å
146	L	51.4	Low	67.5	Low	74 Å²	74	65.8 Å²	65.8	39%	0.387	36%	0.362	S	S	.	.	S	Bend	trans	-94.3	127.8	158.1	-69.7	106	0	0	0	109.4	I142 I148	I142-L146 HydrophobicContact CG2-CD1 3.56Å; I142-L146 PolarHBondContact O-N 3.35Å; L146-I148 VanDerWaalsContact C-N 3.29Å; L146-I148 HydrophobicContact CB-CG1 4.32Å; L146-I148 WeakPolarHBondContact O-CG1 3.18Å; L146-I148 PolarHBondContact O-N 3.49Å
147	L	49.9	Very low	67.8	Low	152 Å²	152	65.7 Å²	65.7	80%	0.796	36%	0.362	S	S	*	.			trans	-63.4	99.3	147.4	-76.7	159.3	0	0	0	105.6	T149	L147-T149 PolarHBondContact O-N 3.05Å
148	I	52.3	Low	68.2	Low	43 Å²	43	65.8 Å²	65.8	22%	0.221	36%	0.359	C	S	.	.			trans	-69	91.7	-167.7	-51.2	-179.5	0	0	0	110.2	L146 S150 I199 I204	L146-I148 VanDerWaalsContact C-N 3.29Å; L146-I148 HydrophobicContact CB-CG1 4.32Å; L146-I148 WeakPolarHBondContact O-CG1 3.18Å; L146-I148 PolarHBondContact O-N 3.49Å; I148-S150 WeakPolarHBondContact CG2-O 3.44Å; I148-I199 HydrophobicContact CG2-CD1 4.03Å; I148-I204 HydrophobicContact CD1-CG1 4.12Å; I148-I204 HydrophobicContact CD1-CG2 4.42Å; I148-I204 HydrophobicContact CG2-CD1 3.85Å; I148-I204 HydrophobicContact CG2-CG1 4.37Å
149	T	52.2	Low	68.7	Low	138 Å²	138	63.9 Å²	63.9	85%	0.847	35%	0.345	S	S	*	.			trans	-90.7	-17.3	169.4	51.1	0	0	0	0	112.4	L147	L147-T149 PolarHBondContact O-N 3.05Å
150	S	59.4	Low	69.2	Low	47 Å²	47	63.8 Å²	63.8	33%	0.329	34%	0.344	S	S	.	.	S	Bend	trans	-104.1	128.2	176.7	57.7	0	0	0	0	111.6	I148 S152	I148-S150 WeakPolarHBondContact CG2-O 3.44Å; S150-S152 PolarHBondContact O-N 3.31Å; S150-S152 PolarHBondContact OG-O 2.83Å
151	L	66.3	Low	69.9	Low	106 Å²	106	58 Å²	58	56%	0.555	33%	0.329	S	S	*	.	S	Bend	trans	-74	26.6	173.5	-62.4	175.3	0	0	0	112.9	P198 I199 D201 I204	L151-P198 WeakPolarHBondContact O-CA 3.38Å; L151-I199 PolarHBondContact O-N 3.37Å; L151-D201 WeakPolarHBondContact CD2-OD1 3.41Å; L151-I204 HydrophobicContact CD2-CD1 3.76Å
152	S	74.9	Confident	70.6	Confident	37 Å²	37	63.3 Å²	63.3	26%	0.259	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	154.3	-177.1	59.1	0	0	0	0	112.1	S150 V197	S150-S152 PolarHBondContact O-N 3.31Å; S150-S152 PolarHBondContact OG-O 2.83Å; S152-V197 CarbonylContact C-O 3.48Å; S152-V197 WeakPolarHBondContact CA-O 3.36Å; S152-V197 WeakPolarHBondContact CB-O 3.3Å
153	V	76.1	Confident	71.2	Confident	23 Å²	23	65 Å²	65	14%	0.139	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	116.2	165.6	-173.3	0	0	0	0	108.1	I142 V197 I199	I142-V153 HydrophobicContact CD1-CG1 4.28Å; I142-V153 HydrophobicContact CG2-CG2 4.07Å; V153-V197 PolarHBondContact N-O 2.94Å; V153-V197 PolarHBondContact O-N 3.37Å; V153-I199 HydrophobicContact CG2-CD1 3.63Å; V153-I199 HydrophobicContact CG2-CG1 3.88Å
154	T	79.2	Confident	72.1	Confident	76 Å²	76	65.7 Å²	65.7	47%	0.466	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	137	170.4	-54.6	0	0	0	0	110.4	D194 T196	T154-D194 HydrophobicContact CG2-CB 4.24Å; T154-T196 WeakPolarHBondContact CG2-OG1 3.46Å; T154-T196 WeakPolarHBondContact OG1-CG2 3.45Å; T154-T196 PolarHBondContact OG1-OG1 2.97Å
155	C	81.9	Confident	73.3	Confident	23 Å²	23	63.4 Å²	63.4	16%	0.155	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	144.5	170.2	64.5	0	0	0	0	111.3	F195	C155-F195 PolarHBondContact N-O 3.04Å; C155-F195 WeakPolarHBondContact O-CB 3.46Å; C155-F195 PolarHBondContact O-N 3.17Å
156	V	85.7	Confident	74.8	Confident	60 Å²	60	58.7 Å²	58.7	36%	0.364	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	129.6	176.3	-174.1	0	0	0	0	109.5	N168 T192	V156-N168 WeakPolarHBondContact O-CA 3.49Å; V156-N168 WeakPolarHBondContact O-CB 3.33Å; V156-T192 HydrophobicContact CG1-CG2 4.04Å
157	L	88.7	Confident	76.6	Confident	8 Å²	8	55.1 Å²	55.1	4%	0.042	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	147.9	163	-57.7	-175.1	0	0	0	109.4	F117 L129 N168 T192 E193 F195	F117-L157 HydrophobicContact CD1-CD2 3.86Å; F117-L157 HydrophobicContact CE1-CD1 4.27Å; F117-L157 HydrophobicContact CE1-CD2 3.83Å; L129-L157 HydrophobicContact CD1-CD1 3.99Å; L129-L157 HydrophobicContact CD2-CD1 4.37Å; L157-N168 HydrophobicContact CD2-CB 3.76Å; L157-T192 CarbonylContact O-C 3.52Å; L157-T192 WeakPolarHBondContact O-CA 3.33Å; L157-E193 PolarHBondContact N-O 3.11Å; L157-E193 PolarHBondContact O-N 3Å; L157-F195 HydrophobicContact CD1-CB 3.7Å; L157-F195 HydrophobicContact CD1-CD2 4.11Å; L157-F195 HydrophobicContact CD1-CG 3.91Å; L157-F195 HydrophobicContact CD2-CB 4.37Å; L157-F195 HydrophobicContact CG-CB 3.66Å; L157-F195 HydrophobicContact CG-CG 4.31Å
158	H	87.8	Confident	78.3	Confident	21 Å²	21	49.2 Å²	49.2	10%	0.097	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	124.9	174.9	-52.5	-83.6	0	0	0	107.4	M166 T167 R170 L173 V190 I191 T192	H158-M166 CarbonylContact O-C 3.47Å; H158-M166 WeakPolarHBondContact O-CA 3.48Å; H158-T167 HydrophobicContact CB-CG2 4.49Å; H158-T167 PolarHBondContact N-O 3.36Å; H158-T167 PolarHBondContact O-N 3.28Å; H158-R170 PolarHBondContact CD2-N 3.37Å; H158-R170 VanDerWaalsContact CD2-N 3.34Å; H158-R170 PolarHBondContact NE2-N 2.91Å; H158-L173 HydrophobicContact CB-CB 4.28Å; H158-L173 HydrophobicContact CB-CD2 3.58Å; H158-V190 HydrophobicContact CB-CG1 4.36Å; H158-I191 WeakPolarHBondContact CA-O 3.49Å; H158-T192 WeakPolarHBondContact ND1-CG2 3.45Å
159	R	88.2	Confident	79.9	Confident	86 Å²	86	47.8 Å²	47.8	33%	0.325	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	142.2	175.2	69.6	-177.6	-178.4	-152.8	-4.1	111	W165 M166 I191 E193	R159-W165 CarbonylContact C-O 3.57Å; R159-W165 WeakPolarHBondContact CA-O 3.37Å; R159-M166 HydrophobicContact CB-CG 3.77Å; R159-M166 HydrophobicContact CB-SD 4.43Å; R159-I191 HydrophobicContact CG-CB 3.72Å; R159-I191 HydrophobicContact CG-CD1 4.42Å; R159-I191 HydrophobicContact CG-CG2 4.35Å; R159-I191 PolarHBondContact N-O 3.34Å; R159-I191 PolarHBondContact O-N 3.28Å; R159-E193 VanDerWaalsContact CZ-CD 3.45Å; R159-E193 IonicContact CZ-OE1 2.75Å; R159-E193 IonicContact CZ-OE2 3.56Å; R159-E193 IonicContact NE-OE2 2.67Å; R159-E193 IonicContact NH1-OE1 3.68Å; R159-E193 PolarHBondContact NH1-OE1 2.81Å; R159-E193 IonicContact NH1-OE2 3.88Å; R159-E193 PolarHBondContact NH1-OE2 3.27Å; R159-E193 IonicContact NH2-OE1 3.14Å
160	C	86.6	Confident	81.4	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.014	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	135.9	166	-177.4	0	0	0	0	109.5	G164 W165 L173 G189	C160-G164 VanDerWaalsContact O-CA 3.28Å; C160-G164 WeakPolarHBondContact O-CA 3.29Å; C160-G164 PolarHBondContact O-N 2.88Å; C160-W165 HydrophobicContact CB-CB 4.32Å; C160-W165 PolarHBondContact N-O 2.86Å; C160-L173 HydrophobicContact CB-CD1 3.86Å; C160-G189 WeakPolarHBondContact CA-O 3.47Å
161	S	84	Confident	82.6	Confident	46 Å²	46	46.8 Å²	46.8	32%	0.322	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-41.2	175.1	42.7	0	0	0	0	113.3	D188 G189	S161-D188 WeakPolarHBondContact CB-O 3.47Å; S161-D188 PolarHBondContact OG-O 3.03Å; S161-G189 PolarHBondContact N-O 3.36Å; S161-G189 WeakPolarHBondContact OG-CA 3.3Å
162	E	79.3	Confident	83.4	Confident	137 Å²	137	42 Å²	42	64%	0.64	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-64.8	-178.4	-73.9	-66.2	141.2	0	0	113	L184	E162-L184 HydrophobicContact CB-CD1 4.16Å; E162-L184 HydrophobicContact CG-CD1 3.64Å; E162-L184 HydrophobicContact CG-CD2 3.99Å; E162-L184 HydrophobicContact CG-CG 4.21Å
163	C	79.7	Confident	83.9	Confident	42 Å²	42	40.3 Å²	40.3	28%	0.284	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-8.1	-173.7	74.2	0	0	0	0	114.8	V113 W165 H176 H181	V113-C163 WeakPolarHBondContact CG1-O 3.21Å; V113-C163 WeakPolarHBondContact CG2-O 3.17Å; C163-W165 PolarHBondContact O-N 3.04Å; C163-W165 VanDerWaalsContact SG-CB 3.57Å; C163-H176 PolarHBondContact SG-CE1 2.87Å; C163-H176 PolarHBondContact SG-NE2 3.19Å; C163-H181 WeakPolarHBondContact CB-NE2 3.2Å; C163-H181 PolarHBondContact SG-NE2 3.2Å
164	G	80.7	Confident	84.2	Confident	27 Å²	27	40.7 Å²	40.7	28%	0.278	22%	0.216	S	C	.	.			trans	74.6	13.9	-178.6	0	0	0	0	0	116.1	C160 M166	C160-G164 VanDerWaalsContact O-CA 3.28Å; C160-G164 WeakPolarHBondContact O-CA 3.29Å; C160-G164 PolarHBondContact O-N 2.88Å; G164-M166 WeakPolarHBondContact O-CG 3.35Å; G164-M166 PolarHBondContact O-N 2.84Å
165	W	82.3	Confident	84.4	Confident	32 Å²	32	38.7 Å²	38.7	12%	0.121	20%	0.202	C	C	.	.			trans	-67.8	126.5	-178.3	-174.6	88.9	0	0	0	111.5	V113 P114 A116 R159 C160 C163 T167 M172 L173 H176	V113-W165 HydrophobicContact CG1-CB 4.01Å; P114-W165 PolarHBondContact O-NE1 3.31Å; A116-W165 HydrophobicContact CB-CH2 4.26Å; A116-W165 HydrophobicContact CB-CZ2 3.78Å; R159-W165 CarbonylContact C-O 3.57Å; R159-W165 WeakPolarHBondContact CA-O 3.37Å; C160-W165 HydrophobicContact CB-CB 4.32Å; C160-W165 PolarHBondContact N-O 2.86Å; C163-W165 PolarHBondContact O-N 3.04Å; C163-W165 VanDerWaalsContact SG-CB 3.57Å; W165-T167 HydrophobicContact CE3-CG2 4.36Å; W165-T167 HydrophobicContact CH2-CG2 3.87Å; W165-T167 HydrophobicContact CZ3-CG2 3.43Å; W165-T167 VanDerWaalsContact CZ3-CG2 3.43Å; W165-M172 HydrophobicContact CH2-CB 4.04Å; W165-M172 HydrophobicContact CH2-CE 4.46Å; W165-M172 HydrophobicContact CZ3-CB 4.49Å; W165-M172 WeakPolarHBondContact CZ3-O 3.43Å; W165-L173 HydrophobicContact CE3-CD1 3.74Å; W165-L173 HydrophobicContact CZ3-CB 4.26Å; W165-L173 HydrophobicContact CZ3-CD1 4.2Å; W165-H176 HydrophobicContact CD2-CB 4.44Å; W165-H176 HydrophobicContact CE3-CB 3.95Å; W165-H176 AromaticContact CE3-CG 3.84Å; W165-H176 AromaticContact CG-ND1 3.98Å; W165-H176 HydrophobicContact CZ3-CB 4.08Å
166	M	85.1	Confident	84.5	Confident	52 Å²	52	38.4 Å²	38.4	26%	0.256	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	141.2	-171.1	-54.1	-166.3	-79.8	0	0	114.6	S115 A116 F117 H158 R159 G164	S115-M166 CarbonylContact C-O 3.54Å; S115-M166 VanDerWaalsContact CA-O 3.22Å; S115-M166 WeakPolarHBondContact CA-O 3.27Å; S115-M166 WeakPolarHBondContact CB-O 3.32Å; A116-M166 PolarHBondContact N-O 3.33Å; F117-M166 HydrophobicContact CE1-CB 4.16Å; F117-M166 HydrophobicContact CZ-CB 4.17Å; F117-M166 HydrophobicContact CZ-CE 4.42Å; H158-M166 CarbonylContact O-C 3.47Å; H158-M166 WeakPolarHBondContact O-CA 3.48Å; R159-M166 HydrophobicContact CB-CG 3.77Å; R159-M166 HydrophobicContact CB-SD 4.43Å; G164-M166 WeakPolarHBondContact O-CG 3.35Å; G164-M166 PolarHBondContact O-N 2.84Å
167	T	88.1	Confident	84.5	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	158.9	171.4	-174	0	0	0	0	111.7	A116 H158 W165 V169 M172 L173	A116-T167 WeakPolarHBondContact O-CA 3.36Å; A116-T167 VanDerWaalsContact O-CB 3.27Å; A116-T167 WeakPolarHBondContact O-CB 3.19Å; A116-T167 PolarHBondContact O-OG1 3.35Å; H158-T167 HydrophobicContact CB-CG2 4.49Å; H158-T167 PolarHBondContact N-O 3.36Å; H158-T167 PolarHBondContact O-N 3.28Å; W165-T167 HydrophobicContact CE3-CG2 4.36Å; W165-T167 HydrophobicContact CH2-CG2 3.87Å; W165-T167 HydrophobicContact CZ3-CG2 3.43Å; W165-T167 VanDerWaalsContact CZ3-CG2 3.43Å; T167-V169 VanDerWaalsContact C-N 3.34Å; T167-V169 VanDerWaalsContact CG2-O 3.27Å; T167-V169 WeakPolarHBondContact CG2-O 3.47Å; T167-V169 PolarHBondContact OG1-N 3.49Å; T167-M172 HydrophobicContact CG2-CB 4.27Å; T167-L173 HydrophobicContact CG2-CB 3.96Å
168	N	86.6	Confident	84.2	Confident	27 Å²	27	42.4 Å²	42.4	14%	0.144	21%	0.213	C	C	.	.	S	Bend	trans	-95.8	19.4	170.3	77.1	-51.7	0	0	0	113.3	F117 F118 F132 V156 L157	F117-N168 WeakPolarHBondContact CA-OD1 3.44Å; F118-N168 PolarHBondContact N-OD1 2.63Å; F118-N168 PolarHBondContact O-ND2 2.95Å; F118-N168 PolarHBondContact O-OD1 3.08Å; F132-N168 HydrophobicContact CE1-CB 4.33Å; F132-N168 HydrophobicContact CZ-CB 4.41Å; F132-N168 WeakPolarHBondContact CZ-ND2 3.43Å; V156-N168 WeakPolarHBondContact O-CA 3.49Å; V156-N168 WeakPolarHBondContact O-CB 3.33Å; L157-N168 HydrophobicContact CD2-CB 3.76Å
169	V	84.8	Confident	83.8	Confident	14 Å²	14	47 Å²	47	9%	0.085	24%	0.238	C	C	.	.			trans	-132.3	100.2	-179.9	-178.2	0	0	0	0	109.4	K58 F118 T167 N171 M172	K58-V169 HydrophobicContact CD-CG2 4.45Å; F118-V169 HydrophobicContact CD2-CG2 4.11Å; T167-V169 VanDerWaalsContact C-N 3.34Å; T167-V169 VanDerWaalsContact CG2-O 3.27Å; T167-V169 WeakPolarHBondContact CG2-O 3.47Å; T167-V169 PolarHBondContact OG1-N 3.49Å; V169-N171 HydrophobicContact CG1-CB 4.4Å; V169-N171 PolarHBondContact O-N 3.5Å; V169-N171 VanDerWaalsContact O-N 3.09Å; V169-M172 HydrophobicContact CB-CB 4.47Å; V169-M172 HydrophobicContact CB-CG 4.36Å; V169-M172 HydrophobicContact CG1-CG 4.16Å; V169-M172 PolarHBondContact O-N 2.79Å
170	R	84.8	Confident	83.5	Confident	91 Å²	91	48 Å²	48	34%	0.343	25%	0.248	S	C	.	.	H	α-helix	trans	-47.3	-44.3	-176	-168	174.6	170.2	106.9	10	113.2	H158 M172 L173 T174 E186	H158-R170 PolarHBondContact CD2-N 3.37Å; H158-R170 VanDerWaalsContact CD2-N 3.34Å; H158-R170 PolarHBondContact NE2-N 2.91Å; R170-M172 PolarHBondContact O-N 3.3Å; R170-L173 WeakPolarHBondContact O-CA 3.36Å; R170-L173 WeakPolarHBondContact O-CB 3.47Å; R170-L173 PolarHBondContact O-N 2.95Å; R170-T174 HydrophobicContact CG-CG2 4.32Å; R170-T174 PolarHBondContact O-N 3.11Å; R170-E186 IonicContact CZ-OE2 2.69Å; R170-E186 IonicContact NE-OE2 2.9Å; R170-E186 PolarHBondContact NH2-O 3.31Å; R170-E186 VanDerWaalsContact NH2-O 3.13Å; R170-E186 IonicContact NH2-OE2 2.75Å; R170-E186 PolarHBondContact NH2-OE2 3.14Å; R170-E186 VanDerWaalsContact NH2-OE2 3.14Å
171	N	83.2	Confident	83.3	Confident	72 Å²	72	49.7 Å²	49.7	39%	0.385	26%	0.256	S	S	.	.	H	α-helix	trans	-56.9	-31.4	179	-62.4	52.2	0	0	0	114.1	V169 T174 E175	V169-N171 HydrophobicContact CG1-CB 4.4Å; V169-N171 PolarHBondContact O-N 3.5Å; V169-N171 VanDerWaalsContact O-N 3.09Å; N171-T174 WeakPolarHBondContact CA-OG1 3.46Å; N171-T174 PolarHBondContact O-OG1 2.66Å; N171-E175 WeakPolarHBondContact O-CB 3.49Å; N171-E175 WeakPolarHBondContact O-CG 3.47Å; N171-E175 PolarHBondContact O-N 2.84Å
172	M	83	Confident	83.1	Confident	7 Å²	7	52.1 Å²	52.1	3%	0.034	27%	0.271	C	S	.	.	H	α-helix	trans	-79.5	-23.8	176.6	-70.2	-174.6	60	0	0	112.3	F118 W165 T167 V169 R170 H176	F118-M172 HydrophobicContact CD2-SD 4.14Å; F118-M172 HydrophobicContact CE2-CE 3.71Å; F118-M172 HydrophobicContact CE2-SD 3.51Å; F118-M172 VanDerWaalsContact CE2-SD 3.51Å; F118-M172 HydrophobicContact CZ-CE 4.01Å; F118-M172 HydrophobicContact CZ-SD 4.22Å; W165-M172 HydrophobicContact CH2-CB 4.04Å; W165-M172 HydrophobicContact CH2-CE 4.46Å; W165-M172 HydrophobicContact CZ3-CB 4.49Å; W165-M172 WeakPolarHBondContact CZ3-O 3.43Å; T167-M172 HydrophobicContact CG2-CB 4.27Å; V169-M172 HydrophobicContact CB-CB 4.47Å; V169-M172 HydrophobicContact CB-CG 4.36Å; V169-M172 HydrophobicContact CG1-CG 4.16Å; V169-M172 PolarHBondContact O-N 2.79Å; R170-M172 PolarHBondContact O-N 3.3Å; M172-H176 VanDerWaalsContact O-CB 3.32Å; M172-H176 WeakPolarHBondContact O-CB 3.48Å; M172-H176 PolarHBondContact O-N 3.3Å; M172-H176 VanDerWaalsContact O-N 3.1Å
173	L	85.1	Confident	83	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-75.7	-36.4	168.6	-176.1	64.6	0	0	0	111.3	H158 C160 W165 T167 R170 H176 L177 V190	H158-L173 HydrophobicContact CB-CB 4.28Å; H158-L173 HydrophobicContact CB-CD2 3.58Å; C160-L173 HydrophobicContact CB-CD1 3.86Å; W165-L173 HydrophobicContact CE3-CD1 3.74Å; W165-L173 HydrophobicContact CZ3-CB 4.26Å; W165-L173 HydrophobicContact CZ3-CD1 4.2Å; T167-L173 HydrophobicContact CG2-CB 3.96Å; R170-L173 WeakPolarHBondContact O-CA 3.36Å; R170-L173 WeakPolarHBondContact O-CB 3.47Å; R170-L173 PolarHBondContact O-N 2.95Å; L173-H176 CarbonylContact O-C 3.5Å; L173-H176 WeakPolarHBondContact O-CB 3.46Å; L173-H176 PolarHBondContact O-N 3.09Å; L173-L177 HydrophobicContact CG-CD1 4.33Å; L173-L177 HydrophobicContact CG-CG 4.4Å; L173-L177 WeakPolarHBondContact O-CG 3.3Å; L173-L177 PolarHBondContact O-N 3.36Å; L173-V190 HydrophobicContact CD2-CB 4.04Å; L173-V190 HydrophobicContact CD2-CG1 3.75Å; L173-V190 HydrophobicContact CD2-CG2 3.79Å; L173-V190 HydrophobicContact CG-CG2 4.26Å
174	T	83.6	Confident	82.8	Confident	31 Å²	31	54 Å²	54	19%	0.19	28%	0.282	C	S	.	.	H	α-helix	trans	-72.9	-35.7	176	63.5	0	0	0	0	112.2	R170 N171 H176 L177 H178 E186	R170-T174 HydrophobicContact CG-CG2 4.32Å; R170-T174 PolarHBondContact O-N 3.11Å; N171-T174 WeakPolarHBondContact CA-OG1 3.46Å; N171-T174 PolarHBondContact O-OG1 2.66Å; T174-H176 VanDerWaalsContact C-N 3.33Å; T174-H176 PolarHBondContact O-N 3.2Å; T174-L177 PolarHBondContact O-N 2.83Å; T174-H178 WeakPolarHBondContact O-CB 3.41Å; T174-H178 PolarHBondContact O-N 3.47Å; T174-E186 HydrophobicContact CG2-CG 3.95Å; T174-E186 WeakPolarHBondContact CG2-OE1 3.14Å; T174-E186 WeakPolarHBondContact CG2-OE2 3.48Å
175	E	82.9	Confident	82.7	Confident	35 Å²	35	54.8 Å²	54.8	16%	0.164	28%	0.283	C	S	.	.	H	α-helix	trans	-54.5	-48.4	163	-78.2	177.5	-177.1	0	0	110.6	S59 N171 H178 D179	S59-E175 WeakPolarHBondContact CB-OE1 3.12Å; S59-E175 PolarHBondContact OG-OE1 3.07Å; N171-E175 WeakPolarHBondContact O-CB 3.49Å; N171-E175 WeakPolarHBondContact O-CG 3.47Å; N171-E175 PolarHBondContact O-N 2.84Å; E175-H178 PolarHBondContact O-N 2.91Å; E175-D179 WeakPolarHBondContact O-CB 3.23Å; E175-D179 VanDerWaalsContact O-CG 3.26Å; E175-D179 PolarHBondContact O-N 2.82Å
176	H	84.1	Confident	82.4	Confident	16 Å²	16	58.1 Å²	58.1	7%	0.074	30%	0.3	C	S	.	.	H	α-helix	trans	-63.9	-42.4	179	160.9	82.7	0	0	0	114	C163 W165 M172 L173 T174 D179 I180 H181	C163-H176 PolarHBondContact SG-CE1 2.87Å; C163-H176 PolarHBondContact SG-NE2 3.19Å; W165-H176 HydrophobicContact CD2-CB 4.44Å; W165-H176 HydrophobicContact CE3-CB 3.95Å; W165-H176 AromaticContact CE3-CG 3.84Å; W165-H176 AromaticContact CG-ND1 3.98Å; W165-H176 HydrophobicContact CZ3-CB 4.08Å; M172-H176 VanDerWaalsContact O-CB 3.32Å; M172-H176 WeakPolarHBondContact O-CB 3.48Å; M172-H176 PolarHBondContact O-N 3.3Å; M172-H176 VanDerWaalsContact O-N 3.1Å; L173-H176 CarbonylContact O-C 3.5Å; L173-H176 WeakPolarHBondContact O-CB 3.46Å; L173-H176 PolarHBondContact O-N 3.09Å; T174-H176 VanDerWaalsContact C-N 3.33Å; T174-H176 PolarHBondContact O-N 3.2Å; H176-D179 PolarHBondContact O-N 3.1Å; H176-I180 WeakPolarHBondContact O-CB 3.44Å; H176-I180 PolarHBondContact O-N 3.32Å; H176-H181 AromaticContact CE1-CD2 3.9Å; H176-H181 AromaticContact NE2-CD2 3.46Å; H176-H181 PolarHBondContact NE2-CD2 3.18Å; H176-H181 AromaticContact NE2-NE2 3.79Å
177	L	85.5	Confident	81.9	Confident	8 Å²	8	64.2 Å²	64.2	4%	0.042	33%	0.328	C	S	.	.	H	α-helix	trans	-63.2	-45.8	176.9	-72.2	170.5	0	0	0	110.3	L173 T174 D179 H181 L184 V190	L173-L177 HydrophobicContact CG-CD1 4.33Å; L173-L177 HydrophobicContact CG-CG 4.4Å; L173-L177 WeakPolarHBondContact O-CG 3.3Å; L173-L177 PolarHBondContact O-N 3.36Å; T174-L177 PolarHBondContact O-N 2.83Å; L177-D179 VanDerWaalsContact C-N 3.34Å; L177-D179 PolarHBondContact O-N 3.42Å; L177-H181 HydrophobicContact CD2-CB 4.22Å; L177-H181 CarbonylContact O-C 3.55Å; L177-H181 VanDerWaalsContact O-CA 3.27Å; L177-H181 WeakPolarHBondContact O-CA 3.29Å; L177-H181 PolarHBondContact O-N 2.9Å; L177-L184 HydrophobicContact CD2-CB 4.24Å; L177-L184 HydrophobicContact CD2-CD1 3.6Å; L177-V190 HydrophobicContact CD1-CG2 3.48Å; L177-V190 VanDerWaalsContact CD1-CG2 3.48Å
178	H	83.2	Confident	81.4	Confident	145 Å²	145	69.7 Å²	69.7	67%	0.671	36%	0.357	S	S	*	.	H	α-helix	trans	-62.6	-39	176.8	-174.2	-76.5	0	0	0	112.7	T174 E175	T174-H178 WeakPolarHBondContact O-CB 3.41Å; T174-H178 PolarHBondContact O-N 3.47Å; E175-H178 PolarHBondContact O-N 2.91Å
179	D	79.5	Confident	81	Confident	117 Å²	117	68.4 Å²	68.4	63%	0.626	35%	0.35	S	S	*	.	H	α-helix	trans	-83.3	-27.1	-176.1	-72	-7	0	0	0	114.3	E175 H176 L177	E175-D179 WeakPolarHBondContact O-CB 3.23Å; E175-D179 VanDerWaalsContact O-CG 3.26Å; E175-D179 PolarHBondContact O-N 2.82Å; H176-D179 PolarHBondContact O-N 3.1Å; L177-D179 VanDerWaalsContact C-N 3.34Å; L177-D179 PolarHBondContact O-N 3.42Å
180	I	81.2	Confident	81	Confident	106 Å²	106	68.3 Å²	68.3	54%	0.544	35%	0.35	S	S	.	.	H	α-helix	trans	-123.5	-31	-171.4	-57.6	-169.9	0	0	0	113.2	H176 P182	H176-I180 WeakPolarHBondContact O-CB 3.44Å; H176-I180 PolarHBondContact O-N 3.32Å; I180-P182 VanDerWaalsContact C-CD 3.42Å
181	H	82.4	Confident	80.9	Confident	38 Å²	38	67 Å²	67	18%	0.176	35%	0.349	C	S	.	.			trans	-128.6	55.9	-178.2	-60.3	-81.2	0	0	0	112.7	C163 H176 L177 L183 L184	C163-H181 WeakPolarHBondContact CB-NE2 3.2Å; C163-H181 PolarHBondContact SG-NE2 3.2Å; H176-H181 AromaticContact CE1-CD2 3.9Å; H176-H181 AromaticContact NE2-CD2 3.46Å; H176-H181 PolarHBondContact NE2-CD2 3.18Å; H176-H181 AromaticContact NE2-NE2 3.79Å; L177-H181 HydrophobicContact CD2-CB 4.22Å; L177-H181 CarbonylContact O-C 3.55Å; L177-H181 VanDerWaalsContact O-CA 3.27Å; L177-H181 WeakPolarHBondContact O-CA 3.29Å; L177-H181 PolarHBondContact O-N 2.9Å; H181-L183 PolarHBondContact O-N 2.86Å; H181-L184 HydrophobicContact CB-CB 4.45Å; H181-L184 HydrophobicContact CB-CD1 3.58Å; H181-L184 HydrophobicContact CB-CG 4.03Å; H181-L184 PolarHBondContact O-N 3.18Å
182	P	79.5	Confident	81	Confident	98 Å²	98	67.2 Å²	67.2	64%	0.636	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	2	-172	28.7	-38	0	0	0	115.3	I180	I180-P182 VanDerWaalsContact C-CD 3.42Å
183	L	77.3	Confident	81	Confident	174 Å²	174	70.7 Å²	70.7	91%	0.911	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-10.7	174.2	-59.3	178.3	0	0	0	113.3	H181	H181-L183 PolarHBondContact O-N 2.86Å
184	L	76.7	Confident	81	Confident	44 Å²	44	76.6 Å²	76.6	23%	0.23	40%	0.4	C	S	.	.	S	Bend	trans	-84.6	139.6	173.9	-68.1	174	0	0	0	110.6	E162 L177 H181	E162-L184 HydrophobicContact CB-CD1 4.16Å; E162-L184 HydrophobicContact CG-CD1 3.64Å; E162-L184 HydrophobicContact CG-CD2 3.99Å; E162-L184 HydrophobicContact CG-CG 4.21Å; L177-L184 HydrophobicContact CD2-CB 4.24Å; L177-L184 HydrophobicContact CD2-CD1 3.6Å; H181-L184 HydrophobicContact CB-CB 4.45Å; H181-L184 HydrophobicContact CB-CD1 3.58Å; H181-L184 HydrophobicContact CB-CG 4.03Å; H181-L184 PolarHBondContact O-N 3.18Å
185	S	76.9	Confident	81	Confident	44 Å²	44	77.7 Å²	77.7	31%	0.308	40%	0.402	S	S	.	.			trans	-72.5	164.7	165.5	82.9	0	0	0	0	111.1	E187 D188 G189	S185-E187 PolarHBondContact O-N 3.04Å; S185-E187 PolarHBondContact OG-N 2.98Å; S185-E187 VanDerWaalsContact OG-N 3.08Å; S185-D188 WeakPolarHBondContact CB-OD2 3.38Å; S185-D188 VanDerWaalsContact OG-CG 3.31Å; S185-D188 PolarHBondContact OG-N 2.84Å; S185-D188 PolarHBondContact OG-OD2 3.25Å; S185-G189 WeakPolarHBondContact O-CA 3.49Å; S185-G189 PolarHBondContact O-N 2.86Å
186	E	76.3	Confident	81	Confident	102 Å²	102	79.5 Å²	79.5	48%	0.477	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-11.7	169.2	-85.6	-152.2	-151.6	0	0	113.8	R170 T174 V190	R170-E186 IonicContact CZ-OE2 2.69Å; R170-E186 IonicContact NE-OE2 2.9Å; R170-E186 PolarHBondContact NH2-O 3.31Å; R170-E186 VanDerWaalsContact NH2-O 3.13Å; R170-E186 IonicContact NH2-OE2 2.75Å; R170-E186 PolarHBondContact NH2-OE2 3.14Å; R170-E186 VanDerWaalsContact NH2-OE2 3.14Å; T174-E186 HydrophobicContact CG2-CG 3.95Å; T174-E186 WeakPolarHBondContact CG2-OE1 3.14Å; T174-E186 WeakPolarHBondContact CG2-OE2 3.48Å; E186-V190 WeakPolarHBondContact O-CB 3.48Å; E186-V190 WeakPolarHBondContact O-CG2 3.37Å
187	E	75.7	Confident	80.8	Confident	180 Å²	180	79.2 Å²	79.2	84%	0.841	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-43.9	-177.5	-59.6	-179	-150	0	0	110.3	S185	S185-E187 PolarHBondContact O-N 3.04Å; S185-E187 PolarHBondContact OG-N 2.98Å; S185-E187 VanDerWaalsContact OG-N 3.08Å
188	D	77.6	Confident	80.3	Confident	114 Å²	114	83.7 Å²	83.7	61%	0.61	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-28.3	175.2	-50.6	-67.5	0	0	0	112.5	S161 S185	S161-D188 WeakPolarHBondContact CB-O 3.47Å; S161-D188 PolarHBondContact OG-O 3.03Å; S185-D188 WeakPolarHBondContact CB-OD2 3.38Å; S185-D188 VanDerWaalsContact OG-CG 3.31Å; S185-D188 PolarHBondContact OG-N 2.84Å; S185-D188 PolarHBondContact OG-OD2 3.25Å
189	G	78.2	Confident	79.7	Confident	0 Å²	0	77.5 Å²	77.5	0%	0	42%	0.417	C	S	.	.	S	Bend	trans	-83	-22.7	-174.1	0	0	0	0	0	115.4	C160 S161 S185	C160-G189 WeakPolarHBondContact CA-O 3.47Å; S161-G189 PolarHBondContact N-O 3.36Å; S161-G189 WeakPolarHBondContact OG-CA 3.3Å; S185-G189 WeakPolarHBondContact O-CA 3.49Å; S185-G189 PolarHBondContact O-N 2.86Å
190	V	84	Confident	78.8	Confident	13 Å²	13	74.5 Å²	74.5	8%	0.079	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	96.8	-171.8	-179.9	0	0	0	0	111.6	H158 L173 L177 E186 T192	H158-V190 HydrophobicContact CB-CG1 4.36Å; L173-V190 HydrophobicContact CD2-CB 4.04Å; L173-V190 HydrophobicContact CD2-CG1 3.75Å; L173-V190 HydrophobicContact CD2-CG2 3.79Å; L173-V190 HydrophobicContact CG-CG2 4.26Å; L177-V190 HydrophobicContact CD1-CG2 3.48Å; L177-V190 VanDerWaalsContact CD1-CG2 3.48Å; E186-V190 WeakPolarHBondContact O-CB 3.48Å; E186-V190 WeakPolarHBondContact O-CG2 3.37Å; V190-T192 HydrophobicContact CG1-CG2 4.42Å
191	I	82.6	Confident	77.7	Confident	63 Å²	63	74.4 Å²	74.4	32%	0.323	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	130.5	169.5	-49.1	168.4	0	0	0	108.9	H158 R159	H158-I191 WeakPolarHBondContact CA-O 3.49Å; R159-I191 HydrophobicContact CG-CB 3.72Å; R159-I191 HydrophobicContact CG-CD1 4.42Å; R159-I191 HydrophobicContact CG-CG2 4.35Å; R159-I191 PolarHBondContact N-O 3.34Å; R159-I191 PolarHBondContact O-N 3.28Å
192	T	85.8	Confident	76.4	Confident	77 Å²	77	76.5 Å²	76.5	47%	0.472	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	139	178.8	44.2	0	0	0	0	112.7	V156 L157 H158 V190	V156-T192 HydrophobicContact CG1-CG2 4.04Å; L157-T192 CarbonylContact O-C 3.52Å; L157-T192 WeakPolarHBondContact O-CA 3.33Å; H158-T192 WeakPolarHBondContact ND1-CG2 3.45Å; V190-T192 HydrophobicContact CG1-CG2 4.42Å
193	E	82.8	Confident	75.2	Confident	80 Å²	80	73 Å²	73	37%	0.374	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	136.5	176.3	-63.1	-174.1	119.1	0	0	111.4	L157 R159 F195	L157-E193 PolarHBondContact N-O 3.11Å; L157-E193 PolarHBondContact O-N 3Å; R159-E193 VanDerWaalsContact CZ-CD 3.45Å; R159-E193 IonicContact CZ-OE1 2.75Å; R159-E193 IonicContact CZ-OE2 3.56Å; R159-E193 IonicContact NE-OE2 2.67Å; R159-E193 IonicContact NH1-OE1 3.68Å; R159-E193 PolarHBondContact NH1-OE1 2.81Å; R159-E193 IonicContact NH1-OE2 3.88Å; R159-E193 PolarHBondContact NH1-OE2 3.27Å; R159-E193 IonicContact NH2-OE1 3.14Å; E193-F195 PolarHBondContact O-N 2.99Å
194	D	84.9	Confident	74.1	Confident	124 Å²	124	65.9 Å²	65.9	66%	0.663	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	109.7	177.3	-79.4	-35.1	0	0	0	111.5	T154	T154-D194 HydrophobicContact CG2-CB 4.24Å
195	F	84.1	Confident	72.9	Confident	53 Å²	53	67.4 Å²	67.4	23%	0.232	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	108.5	178.2	-174.1	-105.8	0	0	0	110.4	L129 A133 C155 L157 E193 V197	L129-F195 HydrophobicContact CD1-CD1 4.11Å; L129-F195 HydrophobicContact CD1-CD2 4.31Å; L129-F195 HydrophobicContact CD1-CE1 3.7Å; L129-F195 HydrophobicContact CD1-CE2 3.94Å; L129-F195 HydrophobicContact CD1-CG 4.4Å; L129-F195 HydrophobicContact CD1-CZ 3.61Å; L129-F195 HydrophobicContact CD2-CD2 4.29Å; L129-F195 HydrophobicContact CD2-CE2 3.76Å; L129-F195 HydrophobicContact CD2-CZ 4.13Å; L129-F195 HydrophobicContact CG-CE1 4.3Å; L129-F195 HydrophobicContact CG-CE2 3.89Å; L129-F195 HydrophobicContact CG-CZ 3.71Å; A133-F195 HydrophobicContact CB-CE1 3.9Å; A133-F195 HydrophobicContact CB-CZ 3.89Å; C155-F195 PolarHBondContact N-O 3.04Å; C155-F195 WeakPolarHBondContact O-CB 3.46Å; C155-F195 PolarHBondContact O-N 3.17Å; L157-F195 HydrophobicContact CD1-CB 3.7Å; L157-F195 HydrophobicContact CD1-CD2 4.11Å; L157-F195 HydrophobicContact CD1-CG 3.91Å; L157-F195 HydrophobicContact CD2-CB 4.37Å; L157-F195 HydrophobicContact CG-CB 3.66Å; L157-F195 HydrophobicContact CG-CG 4.31Å; E193-F195 PolarHBondContact O-N 2.99Å; F195-V197 HydrophobicContact CD1-CG2 3.88Å; F195-V197 HydrophobicContact CE1-CG2 3.44Å; F195-V197 VanDerWaalsContact CE1-CG2 3.44Å; F195-V197 HydrophobicContact CZ-CG2 4.24Å
196	T	83	Confident	71.6	Confident	73 Å²	73	72.3 Å²	72.3	45%	0.448	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	122.2	-178.2	-61.6	0	0	0	0	111.3	T154	T154-T196 WeakPolarHBondContact CG2-OG1 3.46Å; T154-T196 WeakPolarHBondContact OG1-CG2 3.45Å; T154-T196 PolarHBondContact OG1-OG1 2.97Å
197	V	79.9	Confident	70.2	Confident	10 Å²	10	68.4 Å²	68.4	6%	0.061	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	119.2	178.5	-177	0	0	0	0	109.1	A133 L136 A137 S152 V153 F195	A133-V197 HydrophobicContact CB-CG1 4.26Å; A133-V197 HydrophobicContact CB-CG2 3.89Å; A133-V197 WeakPolarHBondContact O-CG1 3.17Å; L136-V197 HydrophobicContact CB-CG2 4.32Å; L136-V197 HydrophobicContact CD1-CG2 3.93Å; A137-V197 HydrophobicContact CB-CG1 3.99Å; S152-V197 CarbonylContact C-O 3.48Å; S152-V197 WeakPolarHBondContact CA-O 3.36Å; S152-V197 WeakPolarHBondContact CB-O 3.3Å; V153-V197 PolarHBondContact N-O 2.94Å; V153-V197 PolarHBondContact O-N 3.37Å; F195-V197 HydrophobicContact CD1-CG2 3.88Å; F195-V197 HydrophobicContact CE1-CG2 3.44Å; F195-V197 VanDerWaalsContact CE1-CG2 3.44Å; F195-V197 HydrophobicContact CZ-CG2 4.24Å
198	P	75.6	Confident	68.7	Low	103 Å²	103	66.8 Å²	66.8	67%	0.669	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69	140.5	174.6	28.3	-33.4	0	0	0	111.4	L151	L151-P198 WeakPolarHBondContact O-CA 3.38Å
199	I	69.5	Low	67.4	Low	15 Å²	15	65.9 Å²	65.9	8%	0.077	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-101.8	130	174.4	-50.4	170.8	0	0	0	107.7	I148 L151 V153 S203 I204	I148-I199 HydrophobicContact CG2-CD1 4.03Å; L151-I199 PolarHBondContact O-N 3.37Å; V153-I199 HydrophobicContact CG2-CD1 3.63Å; V153-I199 HydrophobicContact CG2-CG1 3.88Å; I199-S203 WeakPolarHBondContact CG2-OG 3.41Å; I199-I204 HydrophobicContact CB-CD1 4.45Å; I199-I204 HydrophobicContact CG2-CD1 4.01Å; I199-I204 HydrophobicContact CG2-CG1 3.59Å
200	S	61.3	Low	65.7	Low	54 Å²	54	71.1 Å²	71.1	38%	0.378	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-79.5	140.9	173.8	66.8	0	0	0	0	111.5	E202 S203 I204	S200-E202 PolarHBondContact O-N 2.92Å; S200-S203 PolarHBondContact O-N 3.46Å; S200-S203 PolarHBondContact O-OG 3.13Å; S200-S203 PolarHBondContact OG-N 3.01Å; S200-I204 PolarHBondContact O-N 3.5Å; S200-I204 VanDerWaalsContact O-N 3.15Å
201	D	58.2	Low	64	Low	104 Å²	104	73.3 Å²	73.3	56%	0.556	38%	0.384	S	S	*	.	H	α-helix	trans	-53	-28.1	173.6	-70.2	-49.1	0	0	0	112.9	L151 I204 T205	L151-D201 WeakPolarHBondContact CD2-OD1 3.41Å; D201-I204 PolarHBondContact O-N 3.11Å; D201-T205 WeakPolarHBondContact O-CB 3.47Å; D201-T205 WeakPolarHBondContact O-CG2 3.46Å; D201-T205 PolarHBondContact O-N 3.49Å; D201-T205 PolarHBondContact O-OG1 3.38Å
202	E	54.4	Low	62.1	Low	82 Å²	82	72.1 Å²	72.1	38%	0.383	38%	0.381	S	S	.	.	H	α-helix	trans	-62.1	-47.3	174.9	-67.5	151.9	-171.7	0	0	111	S200 T205 E206 R646	S200-E202 PolarHBondContact O-N 2.92Å; E202-T205 PolarHBondContact O-N 3.33Å; E202-T205 PolarHBondContact O-OG1 3.41Å; E202-E206 PolarHBondContact O-N 2.87Å; E202-R646 IonicContact OE1-CZ 3.43Å; E202-R646 VanDerWaalsContact OE1-CZ 3.26Å; E202-R646 IonicContact OE1-NE 3.79Å; E202-R646 PolarHBondContact OE1-NE 2.92Å; E202-R646 IonicContact OE1-NH2 3.34Å; E202-R646 PolarHBondContact OE1-NH2 2.83Å; E202-R646 IonicContact OE2-NH2 3.47Å
203	S	53.8	Low	60.1	Low	23 Å²	23	74.5 Å²	74.5	16%	0.161	39%	0.385	C	S	.	.	H	α-helix	trans	-70.4	-30.5	175.9	70.4	0	0	0	0	113.2	I199 S200 N207	I199-S203 WeakPolarHBondContact CG2-OG 3.41Å; S200-S203 PolarHBondContact O-N 3.46Å; S200-S203 PolarHBondContact O-OG 3.13Å; S200-S203 PolarHBondContact OG-N 3.01Å; S203-N207 WeakPolarHBondContact O-CB 3.18Å; S203-N207 PolarHBondContact O-N 3.21Å; S203-N207 PolarHBondContact O-ND2 3.36Å
204	I	54.5	Low	58.3	Low	25 Å²	25	74.1 Å²	74.1	13%	0.128	39%	0.385	C	S	.	.	H	α-helix	trans	-68.4	-48.3	172.7	-58.1	176.2	0	0	0	109.4	I148 L151 I199 S200 D201 N207 Y208	I148-I204 HydrophobicContact CD1-CG1 4.12Å; I148-I204 HydrophobicContact CD1-CG2 4.42Å; I148-I204 HydrophobicContact CG2-CD1 3.85Å; I148-I204 HydrophobicContact CG2-CG1 4.37Å; L151-I204 HydrophobicContact CD2-CD1 3.76Å; I199-I204 HydrophobicContact CB-CD1 4.45Å; I199-I204 HydrophobicContact CG2-CD1 4.01Å; I199-I204 HydrophobicContact CG2-CG1 3.59Å; S200-I204 PolarHBondContact O-N 3.5Å; S200-I204 VanDerWaalsContact O-N 3.15Å; D201-I204 PolarHBondContact O-N 3.11Å; I204-N207 PolarHBondContact O-N 2.91Å; I204-Y208 WeakPolarHBondContact O-CB 3.48Å; I204-Y208 PolarHBondContact O-N 2.83Å
205	T	51.5	Low	56.2	Low	77 Å²	77	73.6 Å²	73.6	47%	0.472	38%	0.38	S	S	.	.	H	α-helix	trans	-71.7	-31.7	-176.9	49.9	0	0	0	0	113.5	D201 E202 N209	D201-T205 WeakPolarHBondContact O-CB 3.47Å; D201-T205 WeakPolarHBondContact O-CG2 3.46Å; D201-T205 PolarHBondContact O-N 3.49Å; D201-T205 PolarHBondContact O-OG1 3.38Å; E202-T205 PolarHBondContact O-N 3.33Å; E202-T205 PolarHBondContact O-OG1 3.41Å; T205-N209 WeakPolarHBondContact O-CB 3.07Å; T205-N209 PolarHBondContact O-N 2.89Å; T205-N209 PolarHBondContact O-ND2 2.73Å
206	E	50	Low	54	Low	146 Å²	146	76.2 Å²	76.2	68%	0.682	39%	0.393	S	S	*	.	H	α-helix	trans	-63.5	-47.8	168.2	-76.2	-162.7	165.5	0	0	111.4	E202 Y208 N209 F210	E202-E206 PolarHBondContact O-N 2.87Å; E206-Y208 PolarHBondContact O-N 2.79Å; E206-N209 PolarHBondContact O-N 3.19Å; E206-F210 WeakPolarHBondContact O-CB 3.43Å; E206-F210 PolarHBondContact O-N 3.49Å
207	N	46.4	Very low	52.1	Low	21 Å²	21	76.6 Å²	76.6	11%	0.112	40%	0.396	C	S	.	.	H	α-helix	trans	-66	-37.1	177.1	-77.6	-58	0	0	0	112.3	S143 S203 I204 F210 I211	S143-N207 PolarHBondContact OG-ND2 3.47Å; S203-N207 WeakPolarHBondContact O-CB 3.18Å; S203-N207 PolarHBondContact O-N 3.21Å; S203-N207 PolarHBondContact O-ND2 3.36Å; I204-N207 PolarHBondContact O-N 2.91Å; N207-F210 CarbonylContact O-C 3.51Å; N207-F210 PolarHBondContact O-N 2.86Å; N207-I211 VanDerWaalsContact O-CB 3.3Å; N207-I211 WeakPolarHBondContact O-CB 3.26Å; N207-I211 WeakPolarHBondContact O-CG1 3.27Å; N207-I211 PolarHBondContact O-N 2.86Å
208	Y	45.8	Very low	49.9	Very low	146 Å²	146	82.5 Å²	82.5	57%	0.573	43%	0.426	S	S	*	.	H	α-helix	trans	-67.8	-39.3	176.7	-145.8	-82.3	0	0	0	111.3	I204 E206 F210 I211 S212	I204-Y208 WeakPolarHBondContact O-CB 3.48Å; I204-Y208 PolarHBondContact O-N 2.83Å; E206-Y208 PolarHBondContact O-N 2.79Å; Y208-F210 VanDerWaalsContact C-N 3.31Å; Y208-F210 PolarHBondContact O-N 2.98Å; Y208-I211 PolarHBondContact O-N 2.91Å; Y208-S212 VanDerWaalsContact O-CB 3.29Å; Y208-S212 WeakPolarHBondContact O-CB 3.31Å; Y208-S212 PolarHBondContact O-N 3.05Å; Y208-S212 PolarHBondContact O-OG 3.16Å
209	N	48.3	Very low	48	Very low	94 Å²	94	88 Å²	88	50%	0.503	43%	0.433	S	S	.	.	H	α-helix	trans	-66	-32.9	171.5	-83.6	-78.9	0	0	0	112.4	T205 E206 K213	T205-N209 WeakPolarHBondContact O-CB 3.07Å; T205-N209 PolarHBondContact O-N 2.89Å; T205-N209 PolarHBondContact O-ND2 2.73Å; E206-N209 PolarHBondContact O-N 3.19Å; N209-K213 VanDerWaalsContact O-CB 3.24Å; N209-K213 WeakPolarHBondContact O-CB 3.4Å; N209-K213 WeakPolarHBondContact O-CG 3.45Å; N209-K213 PolarHBondContact O-N 3.02Å
210	F	43.7	Very low	46.3	Very low	111 Å²	111	93.7 Å²	93.7	49%	0.487	46%	0.464	S	S	.	.	H	α-helix	trans	-77.4	-37	176.9	-152.3	-96.9	0	0	0	112.2	E206 N207 Y208 N214	E206-F210 WeakPolarHBondContact O-CB 3.43Å; E206-F210 PolarHBondContact O-N 3.49Å; N207-F210 CarbonylContact O-C 3.51Å; N207-F210 PolarHBondContact O-N 2.86Å; Y208-F210 VanDerWaalsContact C-N 3.31Å; Y208-F210 PolarHBondContact O-N 2.98Å; F210-N214 VanDerWaalsContact CD1-ND2 3.27Å; F210-N214 WeakPolarHBondContact CD1-ND2 3.2Å; F210-N214 VanDerWaalsContact CE1-ND2 3.26Å; F210-N214 WeakPolarHBondContact CE1-ND2 3.22Å; F210-N214 WeakPolarHBondContact O-CB 3.46Å; F210-N214 PolarHBondContact O-N 3.35Å; F210-N214 PolarHBondContact O-ND2 3.38Å
211	I	47.1	Very low	44.7	Very low	59 Å²	59	94.4 Å²	94.4	30%	0.303	47%	0.469	S	S	.	.	H	α-helix	trans	-71.2	-46.6	175.9	-70.4	165.6	0	0	0	110	S143 N207 Y208 K213 N214 M215	S143-I211 WeakPolarHBondContact O-CD1 3.47Å; N207-I211 VanDerWaalsContact O-CB 3.3Å; N207-I211 WeakPolarHBondContact O-CB 3.26Å; N207-I211 WeakPolarHBondContact O-CG1 3.27Å; N207-I211 PolarHBondContact O-N 2.86Å; Y208-I211 PolarHBondContact O-N 2.91Å; I211-K213 PolarHBondContact O-N 2.91Å; I211-N214 PolarHBondContact O-N 3.01Å; I211-M215 HydrophobicContact CG2-CG 4.12Å; I211-M215 VanDerWaalsContact O-CB 3.27Å; I211-M215 WeakPolarHBondContact O-CB 3.45Å; I211-M215 VanDerWaalsContact O-CG 3.23Å; I211-M215 WeakPolarHBondContact O-CG 3.16Å; I211-M215 PolarHBondContact O-N 2.69Å
212	S	43.2	Very low	43.2	Very low	38 Å²	38	95.5 Å²	95.5	27%	0.266	48%	0.482	S	S	.	.	H	α-helix	trans	-56.6	-51.5	170.9	-72.1	0	0	0	0	110.6	Y208 N214 M215 E216	Y208-S212 VanDerWaalsContact O-CB 3.29Å; Y208-S212 WeakPolarHBondContact O-CB 3.31Å; Y208-S212 PolarHBondContact O-N 3.05Å; Y208-S212 PolarHBondContact O-OG 3.16Å; S212-N214 VanDerWaalsContact C-N 3.3Å; S212-N214 PolarHBondContact O-N 3.29Å; S212-M215 CarbonylContact O-C 3.42Å; S212-M215 PolarHBondContact O-N 3.3Å; S212-M215 VanDerWaalsContact O-N 3.14Å; S212-E216 WeakPolarHBondContact O-CB 3.48Å; S212-E216 WeakPolarHBondContact O-CG 3.35Å; S212-E216 PolarHBondContact O-N 2.8Å
213	K	45	Very low	42	Very low	126 Å²	126	98.8 Å²	98.8	55%	0.548	50%	0.501	S	S	.	.	H	α-helix	trans	-61.8	-32.6	-179.8	-75.5	175.8	-179.8	-179.7	0	114.2	N209 I211 T217	N209-K213 VanDerWaalsContact O-CB 3.24Å; N209-K213 WeakPolarHBondContact O-CB 3.4Å; N209-K213 WeakPolarHBondContact O-CG 3.45Å; N209-K213 PolarHBondContact O-N 3.02Å; I211-K213 PolarHBondContact O-N 2.91Å; K213-T217 WeakPolarHBondContact O-CG2 3.42Å; K213-T217 PolarHBondContact O-N 3.44Å; K213-T217 PolarHBondContact O-OG1 2.93Å
214	N	44	Very low	40.9	Very low	72 Å²	72	107.3 Å²	107.3	39%	0.385	54%	0.538	S	S	.	.	H	α-helix	trans	-78.8	-36.8	173.6	-78.3	-82.7	0	0	0	112.9	F210 I211 S212 E216 T217 L218	F210-N214 VanDerWaalsContact CD1-ND2 3.27Å; F210-N214 WeakPolarHBondContact CD1-ND2 3.2Å; F210-N214 VanDerWaalsContact CE1-ND2 3.26Å; F210-N214 WeakPolarHBondContact CE1-ND2 3.22Å; F210-N214 WeakPolarHBondContact O-CB 3.46Å; F210-N214 PolarHBondContact O-N 3.35Å; F210-N214 PolarHBondContact O-ND2 3.38Å; I211-N214 PolarHBondContact O-N 3.01Å; S212-N214 VanDerWaalsContact C-N 3.3Å; S212-N214 PolarHBondContact O-N 3.29Å; N214-E216 VanDerWaalsContact C-N 3.29Å; N214-E216 PolarHBondContact O-N 3.24Å; N214-T217 WeakPolarHBondContact CA-OG1 3.43Å; N214-T217 PolarHBondContact O-OG1 3.47Å; N214-L218 WeakPolarHBondContact O-CB 3.41Å; N214-L218 WeakPolarHBondContact O-CD1 3.3Å; N214-L218 WeakPolarHBondContact O-CG 3.22Å; N214-L218 PolarHBondContact O-N 3.3Å
215	M	40	Very low	39.8	Very low	113 Å²	113	114.1 Å²	114.1	56%	0.557	57%	0.57	S	S	*	*	H	α-helix	trans	-69.6	-28	174	-70.8	-69.1	178.5	0	0	112	I211 S212 R219	I211-M215 HydrophobicContact CG2-CG 4.12Å; I211-M215 VanDerWaalsContact O-CB 3.27Å; I211-M215 WeakPolarHBondContact O-CB 3.45Å; I211-M215 VanDerWaalsContact O-CG 3.23Å; I211-M215 WeakPolarHBondContact O-CG 3.16Å; I211-M215 PolarHBondContact O-N 2.69Å; S212-M215 CarbonylContact O-C 3.42Å; S212-M215 PolarHBondContact O-N 3.3Å; S212-M215 VanDerWaalsContact O-N 3.14Å; M215-R219 VanDerWaalsContact O-CB 3.24Å; M215-R219 WeakPolarHBondContact O-CB 3.46Å; M215-R219 VanDerWaalsContact O-CG 3.26Å; M215-R219 WeakPolarHBondContact O-CG 3.35Å; M215-R219 PolarHBondContact O-N 2.89Å
216	E	39.5	Very low	38.6	Very low	108 Å²	108	117.4 Å²	117.4	51%	0.505	58%	0.584	S	S	.	*	H	α-helix	trans	-84	-31.8	177.5	-70.3	170.2	150.6	0	0	112.1	S212 N214 R219 N220	S212-E216 WeakPolarHBondContact O-CB 3.48Å; S212-E216 WeakPolarHBondContact O-CG 3.35Å; S212-E216 PolarHBondContact O-N 2.8Å; N214-E216 VanDerWaalsContact C-N 3.29Å; N214-E216 PolarHBondContact O-N 3.24Å; E216-R219 PolarHBondContact O-N 3.04Å; E216-N220 WeakPolarHBondContact O-CB 3.35Å; E216-N220 PolarHBondContact O-N 2.94Å; E216-N220 PolarHBondContact O-ND2 3.14Å
217	T	42	Very low	37.5	Very low	82 Å²	82	114.8 Å²	114.8	50%	0.503	58%	0.579	S	S	.	*	H	α-helix	trans	-73.9	-32.8	166	52.6	0	0	0	0	112.3	K213 N214 R219 S221	K213-T217 WeakPolarHBondContact O-CG2 3.42Å; K213-T217 PolarHBondContact O-N 3.44Å; K213-T217 PolarHBondContact O-OG1 2.93Å; N214-T217 WeakPolarHBondContact CA-OG1 3.43Å; N214-T217 PolarHBondContact O-OG1 3.47Å; T217-R219 VanDerWaalsContact C-N 3.29Å; T217-R219 PolarHBondContact O-N 3.15Å; T217-S221 WeakPolarHBondContact O-CB 3.35Å; T217-S221 PolarHBondContact O-N 3.25Å; T217-S221 PolarHBondContact O-OG 3.19Å
218	L	35	Very low	36.6	Very low	134 Å²	134	120.9 Å²	120.9	70%	0.702	61%	0.612	S	S	*	*	H	α-helix	trans	-69.5	-22.4	169.1	-75.1	166.7	0	0	0	113.3	N214	N214-L218 WeakPolarHBondContact O-CB 3.41Å; N214-L218 WeakPolarHBondContact O-CD1 3.3Å; N214-L218 WeakPolarHBondContact O-CG 3.22Å; N214-L218 PolarHBondContact O-N 3.3Å
219	R	34.8	Very low	35.7	Very low	217 Å²	217	121.6 Å²	121.6	82%	0.819	62%	0.618	S	S	*	*	H	α-helix	trans	-93.4	-20.1	174.5	-81.6	179.6	165.7	-171.5	-4.1	115.2	M215 E216 T217	M215-R219 VanDerWaalsContact O-CB 3.24Å; M215-R219 WeakPolarHBondContact O-CB 3.46Å; M215-R219 VanDerWaalsContact O-CG 3.26Å; M215-R219 WeakPolarHBondContact O-CG 3.35Å; M215-R219 PolarHBondContact O-N 2.89Å; E216-R219 PolarHBondContact O-N 3.04Å; T217-R219 VanDerWaalsContact C-N 3.29Å; T217-R219 PolarHBondContact O-N 3.15Å
220	N	32.8	Very low	34.7	Very low	135 Å²	135	126.5 Å²	126.5	72%	0.722	64%	0.635	S	S	*	*	S	Bend	trans	-114.8	20.8	-178.8	-63.3	-68.1	0	0	0	113.9	E216	E216-N220 WeakPolarHBondContact O-CB 3.35Å; E216-N220 PolarHBondContact O-N 2.94Å; E216-N220 PolarHBondContact O-ND2 3.14Å
221	S	28.8	Very low	33.9	Very low	69 Å²	69	126.3 Å²	126.3	48%	0.483	65%	0.648	S	S	.	*	S	Bend	trans	-93	126.3	167.1	-66.2	0	0	0	0	110.1	T217 L223	T217-S221 WeakPolarHBondContact O-CB 3.35Å; T217-S221 PolarHBondContact O-N 3.25Å; T217-S221 PolarHBondContact O-OG 3.19Å; S221-L223 VanDerWaalsContact C-N 3.28Å; S221-L223 PolarHBondContact O-N 3.4Å
222	P	27.5	Very low	33.1	Very low	128 Å²	128	129.1 Å²	129.1	83%	0.831	67%	0.673	S	S	*	*			trans	-77	76.1	-179.8	32	-35.5	0	0	0	111.6
223	L	28.3	Very low	32.4	Very low	150 Å²	150	130.7 Å²	130.7	79%	0.785	70%	0.695	S	S	*	*			trans	-118.8	33.4	171.3	-72.9	176.3	0	0	0	112.8	S221 Q225	S221-L223 VanDerWaalsContact C-N 3.28Å; S221-L223 PolarHBondContact O-N 3.4Å; L223-Q225 PolarHBondContact O-N 2.8Å
224	Q	31	Very low	31.6	Very low	202 Å²	202	132.1 Å²	132.1	94%	0.944	71%	0.709	S	S	*	*			trans	-74.3	53.1	153.9	-77.1	-166.5	-23.5	0	0	111
225	Q	30.7	Very low	30.9	Very low	168 Å²	168	133.2 Å²	133.2	79%	0.785	72%	0.722	S	S	*	*			trans	-158.2	54.2	176.5	-125.9	172.5	26.1	0	0	113.1	L223	L223-Q225 PolarHBondContact O-N 2.8Å
226	L	27	Very low	30.4	Very low	146 Å²	146	133.6 Å²	133.6	76%	0.764	73%	0.731	S	S	*	*			trans	-170.5	84.4	149	-107.7	167.5	0	0	0	111.8	F229	L226-F229 HydrophobicContact CD2-CD2 4.16Å
227	P	26.9	Very low	29.9	Very low	91 Å²	91	134.9 Å²	134.9	59%	0.591	74%	0.741	S	S	*	*			trans	-78.6	162.2	159.8	34.3	-33.4	0	0	0	111.2
228	N	27.1	Very low	29.2	Very low	149 Å²	149	137.3 Å²	137.3	80%	0.797	75%	0.75	S	S	*	*	S	Bend	trans	72.2	26.4	156	-56.5	-6.9	0	0	0	120.4
229	F	26.9	Very low	28.9	Very low	161 Å²	161	137.6 Å²	137.6	71%	0.706	75%	0.747	S	S	*	*			trans	-138.3	124.3	159.1	-58.7	-84.4	0	0	0	109.8	L226	L226-F229 HydrophobicContact CD2-CD2 4.16Å
230	F	27.6	Very low	28.6	Very low	197 Å²	197	132.9 Å²	132.9	86%	0.864	74%	0.738	S	S	*	*	S	Bend	cis	-127.7	126.9	8.6	-72.4	-96.5	0	0	0	112.6
231	S	27.1	Very low	28.5	Very low	107 Å²	107	132 Å²	132	75%	0.748	73%	0.734	S	S	*	*	S	Bend	trans	-138.5	110.9	145.6	-178.2	0	0	0	0	107.8
232	S	29	Very low	28.7	Very low	118 Å²	118	135.5 Å²	135.5	83%	0.825	75%	0.747	S	S	*	*	S	Bend	trans	66.6	144	175.8	-47	0	0	0	0	117.5
233	G	29	Very low	28.9	Very low	71 Å²	71	131.5 Å²	131.5	73%	0.732	73%	0.729	S	S	*	*			trans	103.8	82	152.6	0	0	0	0	0	119.5
234	N	28.7	Very low	29	Very low	156 Å²	156	131 Å²	131	83%	0.834	73%	0.732	S	S	*	*			trans	43.5	128.8	136.7	-62.8	-1.2	0	0	0	123.4
235	S	28.4	Very low	29	Very low	95 Å²	95	127.1 Å²	127.1	66%	0.664	72%	0.722	S	S	*	*			trans	77.4	112.5	132.1	-64.3	0	0	0	0	122.6
236	T	30.7	Very low	29	Very low	121 Å²	121	126.1 Å²	126.1	74%	0.742	72%	0.721	S	S	*	*				69.2	149.5	129.5	63.8	0	0	0	0	120.3
237	L	28	Very low	29.1	Very low	136 Å²	136	126.2 Å²	126.2	71%	0.712	72%	0.718	S	S	*	*			cis	-168.6	145.3	-13.2	-108.8	168.8	0	0	0	108.8
238	L	27.2	Very low	29.3	Very low	132 Å²	132	127.8 Å²	127.8	69%	0.691	72%	0.721	S	S	*	*			trans	65.1	164.7	153.4	-55.9	171.8	0	0	0	117.6
239	H	29.6	Very low	29.5	Very low	140 Å²	140	127.6 Å²	127.6	65%	0.648	72%	0.72	S	S	*	*			cis	-151.2	155.2	-9.3	-126	-44.1	0	0	0	109.6
240	N	29.2	Very low	29.4	Very low	118 Å²	118	126.5 Å²	126.5	63%	0.631	72%	0.721	S	S	*	*			trans	20.8	156.3	134.6	-66.9	41.3	0	0	0	121.2
241	N	29.9	Very low	29.4	Very low	117 Å²	117	123 Å²	123	63%	0.626	72%	0.718	S	S	*	*			cis	-167.7	-172.1	-5.5	-108.3	22.9	0	0	0	106.5
242	D	33.2	Very low	29.4	Very low	143 Å²	143	124.7 Å²	124.7	77%	0.765	72%	0.718	S	S	*	*			cis	-155.1	-175.9	-0.2	-123.4	-40.4	0	0	0	107
243	G	32.1	Very low	29.3	Very low	43 Å²	43	126.8 Å²	126.8	44%	0.443	72%	0.719	S	S	.	*			cis	169.7	155.2	-4.7	0	0	0	0	0	111.8
244	T	30.7	Very low	29.1	Very low	140 Å²	140	128.4 Å²	128.4	86%	0.859	72%	0.718	S	S	*	*			trans	61.9	141.6	167.4	61.9	0	0	0	0	117.4
245	T	31	Very low	29	Very low	120 Å²	120	126.5 Å²	126.5	74%	0.736	72%	0.717	S	S	*	*			cis	-172.9	168.2	-2.2	21.1	0	0	0	0	105.8
246	L	30	Very low	29	Very low	147 Å²	147	126.6 Å²	126.6	77%	0.77	71%	0.714	S	S	*	*			cis	-166	159.8	-1.1	-100.3	160.3	0	0	0	104.1
247	H	29.4	Very low	28.8	Very low	149 Å²	149	126.2 Å²	126.2	69%	0.69	72%	0.722	S	S	*	*			cis	-163.8	179.7	-15.3	-156.2	-118.4	0	0	0	108
248	N	30.5	Very low	28.8	Very low	124 Å²	124	124.1 Å²	124.1	66%	0.663	72%	0.719	S	S	*	*			trans	59.8	132	174	-59.9	6	0	0	0	117.8
249	D	30.7	Very low	28.9	Very low	145 Å²	145	122.7 Å²	122.7	78%	0.775	71%	0.713	S	S	*	*			cis	-157.9	135	-22.4	-118.2	-26.2	0	0	0	109
250	L	25.3	Very low	28.9	Very low	138 Å²	138	123.2 Å²	123.2	72%	0.723	72%	0.719	S	S	*	*			trans	-160.1	123.1	-169.9	-146.7	179.7	0	0	0	111.5	L252	L250-L252 HydrophobicContact CD2-CG 4.4Å
251	P	28.3	Very low	29.1	Very low	123 Å²	123	122.1 Å²	122.1	80%	0.799	72%	0.721	S	S	*	*			trans	-98.5	94.6	165.7	33.2	-28	0	0	0	111.7
252	L	26.5	Very low	29.3	Very low	142 Å²	142	118.8 Å²	118.8	74%	0.743	71%	0.709	S	S	*	*			trans	-64.5	126.6	151.5	-75.2	126.9	0	0	0	108.8	L250	L250-L252 HydrophobicContact CD2-CG 4.4Å
253	L	26.7	Very low	29.2	Very low	162 Å²	162	116.8 Å²	116.8	85%	0.848	70%	0.696	S	S	*	*			trans	-148.3	107.6	147.6	-76	-173.7	0	0	0	107.5
254	C	25.3	Very low	29.4	Very low	105 Å²	105	119.2 Å²	119.2	71%	0.709	70%	0.701	S	S	*	*				94.2	114.5	65.7	-81.5	0	0	0	0	113.1
255	S	25.9	Very low	29.6	Very low	117 Å²	117	117 Å²	117	82%	0.818	69%	0.688	S	S	*	*			trans	-40	127.5	167.3	-45	0	0	0	0	114.7
256	T	28.6	Very low	29.8	Very low	97 Å²	97	118 Å²	118	60%	0.595	68%	0.682	S	S	*	*			trans	-138.5	58.8	158.1	47.3	0	0	0	0	111.6	S258	T256-S258 PolarHBondContact O-N 3.39Å
257	A	26	Very low	30.2	Very low	112 Å²	112	118.7 Å²	118.7	93%	0.926	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	43.4	161.9	0	0	0	0	0	111.3
258	S	29.7	Very low	30.4	Very low	93 Å²	93	117.4 Å²	117.4	65%	0.65	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-170.3	34	-157.6	51.5	0	0	0	0	114.1	T256	T256-S258 PolarHBondContact O-N 3.39Å
259	N	28.4	Very low	30.4	Very low	102 Å²	102	115.8 Å²	115.8	55%	0.545	68%	0.677	S	S	.	*			trans	-144.2	-20.8	174.4	-100.6	-42.7	0	0	0	117.1	S261 A262	N259-S261 PolarHBondContact O-N 2.73Å; N259-A262 PolarHBondContact O-N 2.95Å
260	L	29.4	Very low	30.4	Very low	150 Å²	150	113.9 Å²	113.9	79%	0.785	68%	0.675	S	S	*	*	H	α-helix	trans	-67.4	-8	-175.1	-73	172.5	0	0	0	115.4	V264	L260-V264 WeakPolarHBondContact O-CG2 3.35Å
261	S	33.7	Very low	30.5	Very low	96 Å²	96	113.8 Å²	113.8	67%	0.671	67%	0.674	S	S	*	*	H	α-helix	trans	-73.8	-26.5	170.9	-148.9	0	0	0	0	112.9	N259 T265	N259-S261 PolarHBondContact O-N 2.73Å; S261-T265 PolarHBondContact O-OG1 3.38Å
262	A	33.1	Very low	30.7	Very low	46 Å²	46	116.4 Å²	116.4	38%	0.38	68%	0.675	S	S	.	*	H	α-helix	trans	-80.8	-40.5	-179.3	0	0	0	0	0	112.5	N259 V264 T265 K266	N259-A262 PolarHBondContact O-N 2.95Å; A262-V264 PolarHBondContact O-N 3.2Å; A262-T265 WeakPolarHBondContact O-CB 3.47Å; A262-T265 PolarHBondContact O-N 2.93Å; A262-K266 PolarHBondContact O-N 2.95Å; A262-K266 VanDerWaalsContact O-N 3.15Å
263	E	32.8	Very low	30.6	Very low	102 Å²	102	113.7 Å²	113.7	48%	0.477	67%	0.673	S	S	.	*	H	α-helix	trans	-68.9	-35.2	-174.6	-142.3	64.1	-167.5	0	0	112.5	T265 K266 H267	E263-T265 PolarHBondContact O-N 3.47Å; E263-K266 PolarHBondContact O-N 3.49Å; E263-H267 PolarHBondContact O-N 2.76Å
264	V	35.4	Very low	30.8	Very low	93 Å²	93	111.2 Å²	111.2	56%	0.564	67%	0.667	S	S	*	*	H	α-helix	trans	-66.7	-26.5	172.8	178	0	0	0	0	111.7	L260 A262	L260-V264 WeakPolarHBondContact O-CG2 3.35Å; A262-V264 PolarHBondContact O-N 3.2Å
265	T	35.7	Very low	30.9	Very low	94 Å²	94	110.9 Å²	110.9	58%	0.577	67%	0.665	S	S	*	*	H	α-helix	trans	-80.2	-31.1	178.2	-55.2	0	0	0	0	112.1	S261 A262 E263 L268	S261-T265 PolarHBondContact O-OG1 3.38Å; A262-T265 WeakPolarHBondContact O-CB 3.47Å; A262-T265 PolarHBondContact O-N 2.93Å; E263-T265 PolarHBondContact O-N 3.47Å; T265-L268 PolarHBondContact O-N 2.74Å
266	K	34.8	Very low	31.3	Very low	140 Å²	140	110.1 Å²	110.1	61%	0.609	66%	0.66	S	S	*	*	H	α-helix	trans	-73	-26.7	176.3	-72.7	179.2	-178.7	168.3	0	114.2	A262 E263 L268	A262-K266 PolarHBondContact O-N 2.95Å; A262-K266 VanDerWaalsContact O-N 3.15Å; E263-K266 PolarHBondContact O-N 3.49Å; K266-L268 PolarHBondContact O-N 3.29Å
267	H	37.8	Very low	31.4	Very low	162 Å²	162	113 Å²	113	75%	0.75	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	8.6	175.7	-89.1	-65.1	0	0	0	114.1	E263	E263-H267 PolarHBondContact O-N 2.76Å
268	L	34.7	Very low	31.7	Very low	122 Å²	122	114.1 Å²	114.1	64%	0.639	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.3	7.8	-177.6	-134.4	75	0	0	0	114.4	T265 K266	T265-L268 PolarHBondContact O-N 2.74Å; K266-L268 PolarHBondContact O-N 3.29Å
269	S	30.2	Very low	32	Very low	90 Å²	90	114 Å²	114	63%	0.629	66%	0.66	S	S	*	*	S	Bend	trans	-136.7	35.4	-169.5	50.8	0	0	0	0	114.4
270	S	29.6	Very low	32	Very low	106 Å²	106	114.1 Å²	114.1	74%	0.741	67%	0.668	S	S	*	*			trans	-161.3	128.5	167.7	-171.7	0	0	0	0	109.8
271	I	28.6	Very low	32.4	Very low	135 Å²	135	115.4 Å²	115.4	69%	0.692	67%	0.67	S	S	*	*			cis	-172.2	132.8	-15.9	-113.7	152	0	0	0	104
272	H	31.2	Very low	32.4	Very low	178 Å²	178	114.8 Å²	114.8	82%	0.824	67%	0.67	S	S	*	*			trans	42.3	124.6	157.5	-67.6	-90.8	0	0	0	123.3
273	A	24	Very low	32.5	Very low	85 Å²	85	120.4 Å²	120.4	70%	0.702	69%	0.694	S	S	*	*			trans	-71.2	169.3	144.2	0	0	0	0	0	109.8
274	P	31.1	Very low	32.8	Very low	110 Å²	110	124.3 Å²	124.3	71%	0.714	71%	0.712	S	S	*	*			cis	-155.3	178.7	43.4	40.1	-16.5	0	0	0	120
275	S	28.4	Very low	33	Very low	98 Å²	98	126.6 Å²	126.6	69%	0.685	73%	0.726	S	S	*	*			trans	65.8	160.4	140.5	60	0	0	0	0	123.8
276	S	33.6	Very low	33.1	Very low	102 Å²	102	125 Å²	125	71%	0.713	73%	0.728	S	S	*	*			trans	84.4	129.2	168.5	-31.7	0	0	0	0	115.5
277	I	31.9	Very low	33.2	Very low	157 Å²	157	124.8 Å²	124.8	81%	0.805	73%	0.734	S	S	*	*				74.2	122.9	53.8	-67.5	171.4	0	0	0	110.1
278	D	31.5	Very low	33.2	Very low	135 Å²	135	123.9 Å²	123.9	72%	0.722	74%	0.735	S	S	*	*			cis	-164.9	176	-0.2	-146.5	-51.9	0	0	0	111.5
279	S	35.9	Very low	33.4	Very low	90 Å²	90	126.7 Å²	126.7	63%	0.629	75%	0.745	S	S	*	*			trans	66	133.2	143.1	-61.2	0	0	0	0	124.1
280	C	29.6	Very low	33.8	Very low	106 Å²	106	130.1 Å²	130.1	72%	0.716	75%	0.751	S	S	*	*			trans	49.2	154.2	133.5	-55.1	0	0	0	0	122.3
281	E	35.9	Very low	34.2	Very low	177 Å²	177	131.6 Å²	131.6	83%	0.827	75%	0.745	S	S	*	*			cis	-161.9	176.7	-8.2	-128.9	153.1	-136.6	0	0	113
282	A	33.9	Very low	34.5	Very low	82 Å²	82	131.7 Å²	131.7	68%	0.678	75%	0.746	S	S	*	*			trans	15.5	143.2	159	0	0	0	0	0	125.2
283	D	35.7	Very low	34.6	Very low	165 Å²	165	126.6 Å²	126.6	88%	0.882	74%	0.741	S	S	*	*				-167.3	166.2	119.1	-102.9	-20.3	0	0	0	111.5
284	E	39.6	Very low	35.3	Very low	183 Å²	183	128.5 Å²	128.5	86%	0.855	74%	0.744	S	S	*	*			trans	-113.8	-162.1	-152.9	-51.5	-170.6	125.1	0	0	118.4
285	V	39.7	Very low	35.4	Very low	141 Å²	141	132.6 Å²	132.6	86%	0.855	75%	0.754	S	S	*	*			trans	79.5	134.1	178.4	-167.3	0	0	0	0	115.2
286	G	37.6	Very low	35.8	Very low	61 Å²	61	131.8 Å²	131.8	63%	0.629	76%	0.761	S	S	*	*			cis	156.3	163.1	-0.8	0	0	0	0	0	110.7
287	D	36.9	Very low	35.9	Very low	136 Å²	136	134.1 Å²	134.1	73%	0.727	77%	0.765	S	S	*	*			cis	-163.3	147	-9.1	-63.3	-57.4	0	0	0	110.6
288	N	37.5	Very low	36.1	Very low	143 Å²	143	134.6 Å²	134.6	77%	0.765	77%	0.77	S	S	*	*			trans	59.7	149.7	163.9	-47.8	-29.3	0	0	0	119.4
289	E	39.2	Very low	36.3	Very low	181 Å²	181	135.4 Å²	135.4	85%	0.846	77%	0.774	S	S	*	*			cis	85.8	140	15	-55.9	-174.1	148	0	0	115.4
290	E	37.6	Very low	36.2	Very low	161 Å²	161	138.5 Å²	138.5	75%	0.752	78%	0.778	S	S	*	*			cis	-155.5	-165.9	6.8	-135	-151	149.4	0	0	110.5
291	H	38.5	Very low	36.6	Very low	137 Å²	137	139.2 Å²	139.2	63%	0.634	77%	0.774	S	S	*	*			cis	-149.5	-102.8	10.7	-175.5	59.3	0	0	0	113.6
292	I	34.8	Very low	36.6	Very low	138 Å²	138	139.9 Å²	139.9	71%	0.708	78%	0.775	S	S	*	*			trans	-154.4	158.5	-158.5	-69.8	178.5	0	0	0	112.8
293	G	34.5	Very low	36.5	Very low	70 Å²	70	145.7 Å²	145.7	72%	0.722	78%	0.784	S	S	*	*			trans	161.5	88.1	150.4	0	0	0	0	0	123.6
294	V	37.3	Very low	36.6	Very low	126 Å²	126	144.1 Å²	144.1	76%	0.764	78%	0.783	S	S	*	*			trans	40.7	122.3	136.8	-175.4	0	0	0	0	124.2
295	E	34.3	Very low	36.3	Very low	195 Å²	195	138.5 Å²	138.5	91%	0.911	77%	0.774	S	S	*	*			trans	34.2	140.7	141.5	-56	176.2	161.3	0	0	125.1
296	G	36.3	Very low	36.1	Very low	81 Å²	81	137.9 Å²	137.9	84%	0.835	77%	0.771	S	S	*	*			trans	161.6	130.6	159.7	0	0	0	0	0	116.1
297	D	35.3	Very low	35.9	Very low	152 Å²	152	141.8 Å²	141.8	81%	0.813	78%	0.778	S	S	*	*			trans	-75.8	156	176.4	-75.1	-56.3	0	0	0	114.3
298	N	36.7	Very low	36.1	Very low	167 Å²	167	144.1 Å²	144.1	89%	0.893	79%	0.787	S	S	*	*				164.6	178.6	118.8	-89.8	-80.6	0	0	0	113.7
299	D	35.6	Very low	36	Very low	151 Å²	151	144 Å²	144	81%	0.807	79%	0.786	S	S	*	*			trans	-102	166.4	-146.6	-129.8	-30.4	0	0	0	119.1
300	E	34.7	Very low	35.8	Very low	155 Å²	155	142 Å²	142	72%	0.724	78%	0.78	S	S	*	*			trans	50.5	131.9	154.3	-70.1	-146.7	113.6	0	0	126
301	L	38.2	Very low	35.7	Very low	121 Å²	121	140 Å²	140	63%	0.634	78%	0.775	S	S	*	*			trans	94.5	130.2	133.2	-111.2	71	0	0	0	125.3
302	K	34	Very low	35.4	Very low	192 Å²	192	140.1 Å²	140.1	84%	0.835	78%	0.78	S	S	*	*			trans	92.5	135.6	145.6	-81.3	166.3	-177.4	163.3	0	123.3
303	K	33	Very low	35.4	Very low	203 Å²	203	143.6 Å²	143.6	88%	0.883	78%	0.784	S	S	*	*			trans	-64.1	169.3	174.7	-69.2	177.1	178.4	179.6	0	113.8
304	P	37.4	Very low	35.3	Very low	132 Å²	132	145.8 Å²	145.8	86%	0.857	79%	0.786	S	S	*	*			cis	-135.9	-154	27.6	47.9	-28.9	0	0	0	113.9
305	G	34.1	Very low	35.2	Very low	65 Å²	65	145.9 Å²	145.9	67%	0.67	79%	0.786	S	S	*	*			cis	175.4	-163.3	6.4	0	0	0	0	0	115.6
306	T	35.1	Very low	35	Very low	128 Å²	128	142.6 Å²	142.6	79%	0.785	78%	0.78	S	S	*	*			trans	77.6	93.9	157.4	-44.9	0	0	0	0	121.5
307	D	33.1	Very low	34.9	Very low	143 Å²	143	143.6 Å²	143.6	77%	0.765	77%	0.774	S	S	*	*				38.7	135.3	126.3	-45.3	-23.1	0	0	0	124.2
308	M	41	Very low	34.8	Very low	186 Å²	186	143.4 Å²	143.4	92%	0.916	77%	0.773	S	S	*	*				-160	170.4	118.4	-101.2	-57.8	157.5	0	0	111.6
309	N	35.3	Very low	34.6	Very low	139 Å²	139	143.5 Å²	143.5	74%	0.743	77%	0.773	S	S	*	*			trans	-138	-172	-133.2	-163	-2.6	0	0	0	115.3
310	L	34.9	Very low	34.4	Very low	140 Å²	140	141.8 Å²	141.8	73%	0.733	77%	0.77	S	S	*	*			trans	94.9	134.5	163.9	-50.9	175.8	0	0	0	116.2
311	N	35.2	Very low	34.5	Very low	120 Å²	120	139.8 Å²	139.8	64%	0.642	77%	0.77	S	S	*	*			cis	-161.9	165.9	-3.6	-137.7	-12	0	0	0	115.3
312	N	33.8	Very low	34.4	Very low	139 Å²	139	141 Å²	141	74%	0.743	78%	0.778	S	S	*	*			trans	68.3	143.7	162.2	-56.5	-39.6	0	0	0	119.4
313	R	33.1	Very low	34.5	Very low	210 Å²	210	138.5 Å²	138.5	79%	0.792	77%	0.772	S	S	*	*			cis	-168.2	130.3	-20.6	173.7	179.4	176.8	-177.1	0.6	109.9
314	P	33.1	Very low	34.6	Very low	117 Å²	117	134.7 Å²	134.7	76%	0.76	77%	0.765	S	S	*	*			trans	-103.5	159.8	172.8	38	-33	0	0	0	114.1
315	V	34.4	Very low	34.4	Very low	127 Å²	127	135.1 Å²	135.1	77%	0.77	76%	0.76	S	S	*	*			trans	-147.6	149.2	163	-176.8	0	0	0	0	109.6
316	T	30.5	Very low	34.4	Very low	127 Å²	127	136.3 Å²	136.3	78%	0.779	76%	0.758	S	S	*	*			trans	-124.2	149.8	-169.7	52.9	0	0	0	0	113.6
317	S	34.7	Very low	34.2	Very low	102 Å²	102	138.7 Å²	138.7	71%	0.713	76%	0.758	S	S	*	*			trans	-166.6	111.4	153.4	57.4	0	0	0	0	116
318	N	32.2	Very low	34	Very low	147 Å²	147	140.3 Å²	140.3	79%	0.786	76%	0.761	S	S	*	*				44	119	127.9	-43.1	-20.4	0	0	0	121.5
319	L	34.2	Very low	33.5	Very low	169 Å²	169	140.6 Å²	140.6	89%	0.885	76%	0.76	S	S	*	*				178.5	148.8	100.8	-94.2	158.8	0	0	0	112.1
320	P	31.3	Very low	33.1	Very low	116 Å²	116	139.1 Å²	139.1	75%	0.753	76%	0.761	S	S	*	*			trans	-119	-153.7	-175.6	45.5	-31.1	0	0	0	113.1
321	P	36.8	Very low	33.1	Very low	113 Å²	113	139.1 Å²	139.1	73%	0.734	77%	0.766	S	S	*	*				-105.8	169.3	-114.3	40.9	-26.7	0	0	0	115.1
322	D	34.6	Very low	32.9	Very low	147 Å²	147	138.8 Å²	138.8	79%	0.786	77%	0.768	S	S	*	*			trans	-168.5	160.1	134	-121.1	-28.4	0	0	0	115.8
323	I	36.9	Very low	32.5	Very low	138 Å²	138	141.6 Å²	141.6	71%	0.708	78%	0.777	S	S	*	*			trans	68.8	99.5	147.8	-69.7	164.9	0	0	0	121.1
324	V	35.4	Very low	32.5	Very low	124 Å²	124	137.7 Å²	137.7	75%	0.752	78%	0.777	S	S	*	*				87.2	116.3	122.8	172.9	0	0	0	0	123.1
325	D	33.1	Very low	32.6	Very low	141 Å²	141	136.7 Å²	136.7	75%	0.754	78%	0.779	S	S	*	*			trans	92.1	126.6	141.1	-103.4	-50.6	0	0	0	127.2
326	S	32.8	Very low	32.8	Very low	89 Å²	89	135.5 Å²	135.5	62%	0.622	78%	0.782	S	S	*	*			trans	71.5	107.2	137.4	-81.6	0	0	0	0	124.5
327	K	32.7	Very low	34	Very low	179 Å²	179	136.4 Å²	136.4	78%	0.778	78%	0.777	S	S	*	*			trans	72.3	98.2	132.1	-69.9	-177.8	177.1	176.6	0	120.9
328	Q	27.9	Very low	35.7	Very low	177 Å²	177	135.1 Å²	135.1	83%	0.827	76%	0.76	S	S	*	*				58.9	97.1	104.4	-170.9	-178.1	13.9	0	0	118.3
329	E	31.5	Very low	37.9	Very low	191 Å²	191	133.8 Å²	133.8	89%	0.893	75%	0.745	S	S	*	*			trans	-155.9	153	133.8	-125.7	170.6	-154.8	0	0	112
330	S	26.7	Very low	39.8	Very low	109 Å²	109	127.7 Å²	127.7	76%	0.762	71%	0.714	S	S	*	*			trans	-96.5	105.8	-173.5	55.1	0	0	0	0	111.7	T332	S330-T332 PolarHBondContact O-N 2.79Å
331	V	34.5	Very low	42.1	Very low	139 Å²	139	126.3 Å²	126.3	84%	0.842	70%	0.698	S	S	*	*			trans	-79.9	104.3	-179.8	-176.7	0	0	0	0	110.8
332	T	30	Very low	44.2	Very low	113 Å²	113	121.2 Å²	121.2	69%	0.693	67%	0.665	S	S	*	*			trans	-62.9	147.7	167.9	47.2	0	0	0	0	112.1	S330 T334	S330-T332 PolarHBondContact O-N 2.79Å; T332-T334 PolarHBondContact O-N 2.97Å; T332-T334 VanDerWaalsContact O-N 3.13Å
333	E	26.7	Very low	46.4	Very low	198 Å²	198	120.3 Å²	120.3	93%	0.925	65%	0.651	S	S	*	*			trans	-54	115.6	174.1	-66.6	177.8	105	0	0	112.1	A335	E333-A335 PolarHBondContact O-N 3.23Å
334	T	33.6	Very low	48.7	Very low	128 Å²	128	114.6 Å²	114.6	79%	0.785	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-77.9	117	-179.9	49	0	0	0	0	111.1	T332 A336	T332-T334 PolarHBondContact O-N 2.97Å; T332-T334 VanDerWaalsContact O-N 3.13Å; T334-A336 PolarHBondContact O-N 3.31Å
335	A	35.2	Very low	51.1	Low	97 Å²	97	111.6 Å²	111.6	80%	0.802	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-59.4	133.9	176.9	0	0	0	0	0	112	E333 E337	E333-A335 PolarHBondContact O-N 3.23Å; A335-E337 PolarHBondContact O-N 3.05Å
336	A	38.2	Very low	53.5	Low	101 Å²	101	107.9 Å²	107.9	84%	0.835	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-66.5	124.3	-176.4	0	0	0	0	0	112.6	T334 E338	T334-A336 PolarHBondContact O-N 3.31Å; A336-E338 PolarHBondContact O-N 3.5Å
337	E	55.6	Low	55.9	Low	146 Å²	146	110.4 Å²	110.4	68%	0.682	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-70.9	118.1	177.3	-63.5	-168.9	141	0	0	111.8	A335 Y339	A335-E337 PolarHBondContact O-N 3.05Å; E337-Y339 HydrophobicContact CB-CD2 4.3Å; E337-Y339 HydrophobicContact CB-CE2 3.57Å; E337-Y339 WeakPolarHBondContact O-CD2 3.23Å; E337-Y339 PolarHBondContact OE2-OH 3.49Å
338	E	70.9	Confident	58.2	Low	75 Å²	75	103 Å²	103	35%	0.35	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-91.3	127.9	179.6	-171.7	178.4	-132.8	0	0	111.7	A336 I387 R395	A336-E338 PolarHBondContact O-N 3.5Å; E338-I387 HydrophobicContact CB-CB 4.24Å; E338-I387 HydrophobicContact CB-CG1 4.37Å; E338-I387 HydrophobicContact CG-CG1 4.26Å; E338-I387 WeakPolarHBondContact O-CB 3.24Å; E338-I387 WeakPolarHBondContact O-CG1 3.29Å; E338-I387 PolarHBondContact O-N 3.24Å; E338-R395 IonicContact OE1-CZ 2.69Å; E338-R395 IonicContact OE1-NH1 3.86Å; E338-R395 PolarHBondContact OE1-NH1 2.81Å; E338-R395 IonicContact OE1-NH2 4Å; E338-R395 PolarHBondContact OE1-NH2 2.79Å; E338-R395 IonicContact OE2-CZ 3.46Å; E338-R395 IonicContact OE2-NE 3.56Å; E338-R395 PolarHBondContact OE2-NE 3.05Å; E338-R395 IonicContact OE2-NH1 3.28Å; E338-R395 PolarHBondContact OE2-NH1 2.99Å; E338-R395 IonicContact OE2-NH2 3.62Å; E338-R395 PolarHBondContact OE2-NH2 3.32Å
339	Y	76.9	Confident	61	Low	119 Å²	119	94.6 Å²	94.6	47%	0.467	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	150.5	-178.4	-67.6	-91.1	0	0	0	112.5	E337 R384 V385 P386	E337-Y339 HydrophobicContact CB-CD2 4.3Å; E337-Y339 HydrophobicContact CB-CE2 3.57Å; E337-Y339 WeakPolarHBondContact O-CD2 3.23Å; E337-Y339 PolarHBondContact OE2-OH 3.49Å; Y339-R384 HydrophobicContact CD1-CB 4.09Å; Y339-V385 CarbonylContact C-O 3.59Å; Y339-V385 WeakPolarHBondContact CA-O 3.27Å; Y339-P386 HydrophobicContact CD1-CB 4.14Å; Y339-P386 HydrophobicContact CE1-CB 3.95Å
340	V	74.1	Confident	63.5	Low	41 Å²	41	87.3 Å²	87.3	25%	0.248	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	120.6	175.6	-178.4	0	0	0	0	110.4	V385 I387 F410	V340-V385 HydrophobicContact CB-CB 4.34Å; V340-V385 PolarHBondContact N-O 2.99Å; V340-V385 WeakPolarHBondContact O-CB 3.33Å; V340-V385 PolarHBondContact O-N 3.05Å; V340-I387 HydrophobicContact CG2-CD1 3.93Å; V340-I387 HydrophobicContact CG2-CG1 4.2Å; V340-F410 HydrophobicContact CB-CE2 4.5Å; V340-F410 HydrophobicContact CB-CZ 4.29Å; V340-F410 HydrophobicContact CG1-CE1 4.42Å; V340-F410 HydrophobicContact CG1-CE2 4.22Å; V340-F410 HydrophobicContact CG1-CZ 3.63Å
341	Q	79.7	Confident	66.2	Low	87 Å²	87	84.8 Å²	84.8	41%	0.407	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	144.8	175.6	-165.5	68.2	47.6	0	0	111.3	A381 S382 Y383	Q341-A381 PolarHBondContact NE2-O 3.05Å; Q341-S382 PolarHBondContact NE2-O 2.73Å; Q341-Y383 PolarHBondContact NE2-O 2.96Å
342	L	82	Confident	68.4	Low	7 Å²	7	79.4 Å²	79.4	4%	0.037	43%	0.432	C	S	.	.			trans	-89.8	161.2	171.4	-60.3	-170.6	0	0	0	112	F380 A381 Y383 V385 F410 L417	L342-F380 HydrophobicContact CB-CD1 4.39Å; L342-F380 HydrophobicContact CB-CE1 4.06Å; L342-F380 WeakPolarHBondContact CB-O 3.2Å; L342-F380 HydrophobicContact CD1-CD1 4.44Å; L342-F380 HydrophobicContact CD1-CD2 4.29Å; L342-F380 HydrophobicContact CD1-CE1 3.98Å; L342-F380 HydrophobicContact CD1-CE2 3.85Å; L342-F380 HydrophobicContact CD1-CZ 3.7Å; L342-A381 VanDerWaalsContact O-O 3.08Å; L342-Y383 PolarHBondContact N-O 3.14Å; L342-V385 HydrophobicContact CD1-CG2 4.15Å; L342-V385 HydrophobicContact CD2-CG2 3.97Å; L342-V385 HydrophobicContact CG-CG2 4.01Å; L342-F410 HydrophobicContact CD2-CE1 3.79Å; L342-F410 HydrophobicContact CD2-CZ 3.59Å; L342-L417 HydrophobicContact CD1-CD1 3.68Å
343	Y	80.9	Confident	70.9	Confident	128 Å²	128	74.1 Å²	74.1	50%	0.502	40%	0.4	S	S	.	.			trans	-143.1	153.9	-178.6	177.5	-93.5	0	0	0	110.2	N345 T436 H437	Y343-N345 HydrophobicContact CE1-CB 4.18Å; Y343-T436 CarbonylContact O-C 3.56Å; Y343-T436 VanDerWaalsContact O-C 3.31Å; Y343-T436 WeakPolarHBondContact O-CA 3.2Å; Y343-H437 WeakPolarHBondContact CD1-O 3.41Å
344	F	84.4	Confident	73.4	Confident	18 Å²	18	69.2 Å²	69.2	8%	0.079	38%	0.378	C	S	.	.			trans	-144.7	131.6	-179.1	169.7	-123.1	0	0	0	110.2	E346 F349 L374 L377 A381 F435 T436	F344-E346 HydrophobicContact CD1-CB 4.15Å; F344-E346 HydrophobicContact CE1-CB 3.62Å; F344-E346 HydrophobicContact CE1-CG 4.02Å; F344-E346 HydrophobicContact CZ-CB 4.2Å; F344-F349 HydrophobicContact CE2-CB 3.63Å; F344-F349 HydrophobicContact CE2-CD1 4.31Å; F344-F349 HydrophobicContact CE2-CD2 4.41Å; F344-F349 AromaticContact CE2-CG 3.86Å; F344-F349 HydrophobicContact CE2-CG 3.86Å; F344-F349 HydrophobicContact CZ-CB 3.77Å; F344-F349 AromaticContact CZ-CD1 3.9Å; F344-F349 HydrophobicContact CZ-CD1 3.9Å; F344-F349 AromaticContact CZ-CG 3.91Å; F344-F349 HydrophobicContact CZ-CG 3.91Å; F344-L374 HydrophobicContact CE1-CD2 4.12Å; F344-L374 HydrophobicContact CZ-CD2 3.94Å; F344-L377 HydrophobicContact CD1-CB 3.71Å; F344-L377 HydrophobicContact CD2-CB 4.08Å; F344-L377 HydrophobicContact CD2-CD1 4.49Å; F344-L377 HydrophobicContact CE1-CB 3.51Å; F344-L377 HydrophobicContact CE1-CD1 4.32Å; F344-L377 HydrophobicContact CE2-CB 3.91Å; F344-L377 HydrophobicContact CE2-CD1 3.69Å; F344-L377 HydrophobicContact CE2-CG 4.25Å; F344-L377 HydrophobicContact CG-CB 3.99Å; F344-L377 HydrophobicContact CZ-CB 3.62Å; F344-L377 HydrophobicContact CZ-CD1 3.57Å; F344-L377 HydrophobicContact CZ-CG 4.2Å; F344-A381 HydrophobicContact CB-CB 4.15Å; F344-F435 HydrophobicContact CD2-CB 4.47Å; F344-F435 HydrophobicContact CE2-CB 4.36Å; F344-T436 HydrophobicContact CD2-CG2 4.48Å
345	N	85.1	Confident	75.5	Confident	60 Å²	60	71 Å²	71	32%	0.321	38%	0.375	S	S	.	.			trans	-97.4	92	173.4	-170.8	-35.6	0	0	0	110.5	Y343 Q347 A348 F349 F435	Y343-N345 HydrophobicContact CE1-CB 4.18Å; N345-Q347 PolarHBondContact OD1-N 3.48Å; N345-A348 HydrophobicContact CB-CB 4.13Å; N345-A348 PolarHBondContact O-N 3.26Å; N345-A348 VanDerWaalsContact OD1-CB 3.28Å; N345-A348 WeakPolarHBondContact OD1-CB 3.39Å; N345-A348 PolarHBondContact OD1-N 3.43Å; N345-F349 WeakPolarHBondContact O-CB 3.48Å; N345-F349 PolarHBondContact O-N 2.95Å; N345-F435 PolarHBondContact N-O 2.72Å
346	E	84.6	Confident	77.2	Confident	64 Å²	64	68.3 Å²	68.3	30%	0.299	35%	0.347	S	S	.	.	H	α-helix	trans	-58.8	-48.1	-178.5	-175.7	156.8	153.8	0	0	112.5	F344 A348 F349 V350 L374 R378	F344-E346 HydrophobicContact CD1-CB 4.15Å; F344-E346 HydrophobicContact CE1-CB 3.62Å; F344-E346 HydrophobicContact CE1-CG 4.02Å; F344-E346 HydrophobicContact CZ-CB 4.2Å; E346-A348 PolarHBondContact O-N 2.87Å; E346-F349 PolarHBondContact O-N 3.4Å; E346-V350 HydrophobicContact CG-CG2 4.38Å; E346-V350 WeakPolarHBondContact O-CG2 3.26Å; E346-V350 PolarHBondContact O-N 2.74Å; E346-L374 HydrophobicContact CG-CD2 3.82Å; E346-R378 IonicContact OE1-CZ 3.32Å; E346-R378 IonicContact OE1-NE 2.72Å; E346-R378 IonicContact OE1-NH2 3.86Å; E346-R378 PolarHBondContact OE1-NH2 2.82Å; E346-R378 IonicContact OE2-CZ 2.68Å; E346-R378 IonicContact OE2-NE 3.49Å; E346-R378 PolarHBondContact OE2-NE 3.31Å; E346-R378 IonicContact OE2-NH2 2.68Å
347	Q	82.4	Confident	78.5	Confident	141 Å²	141	69.6 Å²	69.6	66%	0.659	34%	0.336	S	S	*	.	H	α-helix	trans	-62	-41.2	-177.3	-171	64.6	13.4	0	0	112.7	N345 T351	N345-Q347 PolarHBondContact OD1-N 3.48Å; Q347-T351 VanDerWaalsContact O-CB 3.27Å; Q347-T351 WeakPolarHBondContact O-CB 3.24Å; Q347-T351 PolarHBondContact O-N 3.07Å; Q347-T351 VanDerWaalsContact O-N 3.08Å; Q347-T351 PolarHBondContact O-OG1 3.08Å
348	A	82	Confident	79	Confident	25 Å²	25	70.9 Å²	70.9	21%	0.207	34%	0.339	C	S	.	.	H	α-helix	trans	-69	-40	176.7	0	0	0	0	0	111.7	N345 E346 A352 F435	N345-A348 HydrophobicContact CB-CB 4.13Å; N345-A348 PolarHBondContact O-N 3.26Å; N345-A348 VanDerWaalsContact OD1-CB 3.28Å; N345-A348 WeakPolarHBondContact OD1-CB 3.39Å; N345-A348 PolarHBondContact OD1-N 3.43Å; E346-A348 PolarHBondContact O-N 2.87Å; A348-A352 WeakPolarHBondContact O-CB 3.18Å; A348-A352 PolarHBondContact O-N 3.04Å; A348-F435 HydrophobicContact CB-CD1 3.73Å; A348-F435 HydrophobicContact CB-CE1 4.03Å; A348-F435 WeakPolarHBondContact O-CE1 3.44Å
349	F	86.4	Confident	78.8	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-63.1	-50.4	176.3	175.7	-100	0	0	0	111.9	F344 N345 E346 T351 A352 Y353 L370 V373 L374 L377 F431 T432 F435	F344-F349 HydrophobicContact CE2-CB 3.63Å; F344-F349 HydrophobicContact CE2-CD1 4.31Å; F344-F349 HydrophobicContact CE2-CD2 4.41Å; F344-F349 AromaticContact CE2-CG 3.86Å; F344-F349 HydrophobicContact CE2-CG 3.86Å; F344-F349 HydrophobicContact CZ-CB 3.77Å; F344-F349 AromaticContact CZ-CD1 3.9Å; F344-F349 HydrophobicContact CZ-CD1 3.9Å; F344-F349 AromaticContact CZ-CG 3.91Å; F344-F349 HydrophobicContact CZ-CG 3.91Å; N345-F349 WeakPolarHBondContact O-CB 3.48Å; N345-F349 PolarHBondContact O-N 2.95Å; E346-F349 PolarHBondContact O-N 3.4Å; F349-T351 PolarHBondContact O-N 2.96Å; F349-A352 PolarHBondContact O-N 3.38Å; F349-A352 VanDerWaalsContact O-N 3.16Å; F349-Y353 HydrophobicContact CE1-CD2 4.22Å; F349-Y353 HydrophobicContact CE2-CD2 4.3Å; F349-Y353 AromaticContact CZ-CD2 3.71Å; F349-Y353 HydrophobicContact CZ-CD2 3.71Å; F349-Y353 HydrophobicContact CZ-CE2 4.3Å; F349-Y353 HydrophobicContact CZ-CG 4.49Å; F349-Y353 WeakPolarHBondContact O-CB 3.47Å; F349-Y353 PolarHBondContact O-N 2.92Å; F349-L370 HydrophobicContact CD1-CD1 4.44Å; F349-L370 HydrophobicContact CE1-CD1 3.78Å; F349-V373 HydrophobicContact CE1-CG1 3.97Å; F349-V373 HydrophobicContact CZ-CG1 3.67Å; F349-L374 HydrophobicContact CD1-CD2 3.65Å; F349-L374 HydrophobicContact CE1-CD2 3.96Å; F349-L377 HydrophobicContact CD1-CD1 4.23Å; F349-L377 HydrophobicContact CE1-CD1 3.96Å; F349-L377 HydrophobicContact CE2-CD1 4.32Å; F349-L377 HydrophobicContact CZ-CD1 4.02Å; F349-F431 HydrophobicContact CD2-CD1 4.48Å; F349-F431 HydrophobicContact CD2-CE1 4.14Å; F349-F431 AromaticContact CE2-CD1 3.9Å; F349-F431 HydrophobicContact CE2-CD1 3.9Å; F349-F431 AromaticContact CE2-CE1 3.81Å; F349-F431 HydrophobicContact CE2-CE1 3.81Å; F349-T432 HydrophobicContact CD2-CG2 4.01Å; F349-T432 HydrophobicContact CE2-CG2 3.83Å; F349-T432 WeakPolarHBondContact CE2-OG1 3.19Å; F349-F435 HydrophobicContact CB-CB 4.17Å; F349-F435 HydrophobicContact CB-CD1 4.21Å; F349-F435 HydrophobicContact CB-CD2 4.36Å; F349-F435 HydrophobicContact CB-CG 3.97Å; F349-F435 AromaticContact CD2-CD2 3.82Å; F349-F435 HydrophobicContact CD2-CD2 3.82Å; F349-F435 HydrophobicContact CD2-CE2 4.25Å; F349-F435 HydrophobicContact CD2-CG 4.26Å
350	V	83.9	Confident	77.9	Confident	38 Å²	38	65.4 Å²	65.4	23%	0.23	32%	0.319	C	S	.	.	H	α-helix	trans	-58.5	-47.2	177.2	174.1	0	0	0	0	110.8	E346 A352 Y353 M354 L374	E346-V350 HydrophobicContact CG-CG2 4.38Å; E346-V350 WeakPolarHBondContact O-CG2 3.26Å; E346-V350 PolarHBondContact O-N 2.74Å; V350-A352 PolarHBondContact O-N 3.29Å; V350-Y353 PolarHBondContact O-N 3.29Å; V350-M354 HydrophobicContact CG1-CG 4.32Å; V350-M354 WeakPolarHBondContact O-CB 3.48Å; V350-M354 VanDerWaalsContact O-CG 3.31Å; V350-M354 WeakPolarHBondContact O-CG 3.37Å; V350-M354 PolarHBondContact O-N 3.13Å; V350-L374 HydrophobicContact CG2-CD1 3.98Å; V350-L374 HydrophobicContact CG2-CD2 3.96Å
351	T	82.6	Confident	77	Confident	56 Å²	56	68.2 Å²	68.2	34%	0.344	34%	0.338	S	S	.	.	H	α-helix	trans	-59.3	-34.9	178.4	-60	0	0	0	0	112.5	Q347 F349 K355	Q347-T351 VanDerWaalsContact O-CB 3.27Å; Q347-T351 WeakPolarHBondContact O-CB 3.24Å; Q347-T351 PolarHBondContact O-N 3.07Å; Q347-T351 VanDerWaalsContact O-N 3.08Å; Q347-T351 PolarHBondContact O-OG1 3.08Å; F349-T351 PolarHBondContact O-N 2.96Å; T351-K355 HydrophobicContact CG2-CD 4.49Å; T351-K355 VanDerWaalsContact O-CD 3.31Å; T351-K355 WeakPolarHBondContact O-CD 3.33Å; T351-K355 VanDerWaalsContact O-CG 3.26Å; T351-K355 WeakPolarHBondContact O-CG 3.47Å
352	A	81.8	Confident	75.8	Confident	25 Å²	25	69.3 Å²	69.3	21%	0.207	35%	0.347	C	S	.	.	H	α-helix	trans	-83.2	-35.9	178.8	0	0	0	0	0	112.8	A348 F349 V350 K355 N356 F431 F435	A348-A352 WeakPolarHBondContact O-CB 3.18Å; A348-A352 PolarHBondContact O-N 3.04Å; F349-A352 PolarHBondContact O-N 3.38Å; F349-A352 VanDerWaalsContact O-N 3.16Å; V350-A352 PolarHBondContact O-N 3.29Å; A352-K355 PolarHBondContact O-N 3.01Å; A352-N356 WeakPolarHBondContact O-CB 3.43Å; A352-N356 PolarHBondContact O-N 3.36Å; A352-F431 HydrophobicContact CB-CE2 4.26Å; A352-F431 HydrophobicContact CB-CZ 3.67Å; A352-F435 HydrophobicContact CB-CE1 3.81Å; A352-F435 HydrophobicContact CB-CE2 4.27Å; A352-F435 HydrophobicContact CB-CZ 3.34Å
353	Y	82.4	Confident	74.5	Confident	2 Å²	2	74.8 Å²	74.8	1%	0.008	38%	0.376	C	S	.	.	H	α-helix	trans	-63.1	-49.3	177.8	-166.6	-86.5	0	0	0	110.5	F349 V350 K355 N356 F359 L370 F431	F349-Y353 HydrophobicContact CE1-CD2 4.22Å; F349-Y353 HydrophobicContact CE2-CD2 4.3Å; F349-Y353 AromaticContact CZ-CD2 3.71Å; F349-Y353 HydrophobicContact CZ-CD2 3.71Å; F349-Y353 HydrophobicContact CZ-CE2 4.3Å; F349-Y353 HydrophobicContact CZ-CG 4.49Å; F349-Y353 WeakPolarHBondContact O-CB 3.47Å; F349-Y353 PolarHBondContact O-N 2.92Å; V350-Y353 PolarHBondContact O-N 3.29Å; Y353-K355 PolarHBondContact O-N 2.6Å; Y353-K355 VanDerWaalsContact O-N 3.17Å; Y353-N356 WeakPolarHBondContact O-CB 3.32Å; Y353-N356 PolarHBondContact O-N 3.03Å; Y353-F359 HydrophobicContact CD1-CB 4.48Å; Y353-F359 HydrophobicContact CD2-CB 4.47Å; Y353-F359 HydrophobicContact CD2-CD2 4.23Å; Y353-F359 HydrophobicContact CE1-CB 3.96Å; Y353-F359 HydrophobicContact CE2-CB 3.94Å; Y353-F359 HydrophobicContact CE2-CD2 4.12Å; Y353-F359 HydrophobicContact CE2-CG 4.03Å; Y353-L370 HydrophobicContact CD1-CD1 3.92Å; Y353-L370 HydrophobicContact CD2-CD1 4.41Å; Y353-L370 HydrophobicContact CE1-CB 4.23Å; Y353-L370 HydrophobicContact CE1-CD1 4.22Å; Y353-L370 HydrophobicContact CG-CD1 4.02Å; Y353-F431 HydrophobicContact CD2-CE1 4.17Å
354	M	79	Confident	73.1	Confident	95 Å²	95	75.5 Å²	75.5	47%	0.468	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-24.3	175.6	-67.4	-75.6	95.4	0	0	114	V350 L370	V350-M354 HydrophobicContact CG1-CG 4.32Å; V350-M354 WeakPolarHBondContact O-CB 3.48Å; V350-M354 VanDerWaalsContact O-CG 3.31Å; V350-M354 WeakPolarHBondContact O-CG 3.37Å; V350-M354 PolarHBondContact O-N 3.13Å; M354-L370 HydrophobicContact CE-CD2 4.13Å
355	K	77.3	Confident	71.5	Confident	166 Å²	166	79 Å²	79	72%	0.722	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-1.9	177.1	-72.3	175.7	-175.4	176.2	0	113.8	T351 A352 Y353	T351-K355 HydrophobicContact CG2-CD 4.49Å; T351-K355 VanDerWaalsContact O-CD 3.31Å; T351-K355 WeakPolarHBondContact O-CD 3.33Å; T351-K355 VanDerWaalsContact O-CG 3.26Å; T351-K355 WeakPolarHBondContact O-CG 3.47Å; A352-K355 PolarHBondContact O-N 3.01Å; Y353-K355 PolarHBondContact O-N 2.6Å; Y353-K355 VanDerWaalsContact O-N 3.17Å
356	N	71.7	Confident	70.3	Confident	40 Å²	40	76.4 Å²	76.4	21%	0.214	40%	0.398	C	S	.	.			trans	-107.4	99.3	-169.8	-166.4	-11	0	0	0	111.6	A352 Y353 K358 F359	A352-N356 WeakPolarHBondContact O-CB 3.43Å; A352-N356 PolarHBondContact O-N 3.36Å; Y353-N356 WeakPolarHBondContact O-CB 3.32Å; Y353-N356 PolarHBondContact O-N 3.03Å; N356-K358 PolarHBondContact O-N 2.8Å; N356-K358 PolarHBondContact OD1-N 3.4Å; N356-F359 HydrophobicContact CB-CD2 4.14Å; N356-F359 WeakPolarHBondContact ND2-CE2 3.06Å; N356-F359 PolarHBondContact O-N 2.9Å
357	E	65.2	Low	69.4	Low	129 Å²	129	76.1 Å²	76.1	60%	0.603	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.3	-24.2	179.9	-53.5	153.6	128.5	0	0	114.3	F359 R480	E357-F359 VanDerWaalsContact C-N 3.29Å; E357-F359 PolarHBondContact O-N 3.25Å; E357-R480 IonicContact OE1-CZ 2.68Å; E357-R480 IonicContact OE1-NH1 2.77Å; E357-R480 PolarHBondContact OE1-NH1 3.42Å; E357-R480 IonicContact OE1-NH2 3.86Å; E357-R480 IonicContact OE2-CZ 3.56Å; E357-R480 IonicContact OE2-NH1 3.91Å; E357-R480 PolarHBondContact OE2-NH1 3.21Å; E357-R480 IonicContact OE2-NH2 3.44Å; E357-R480 PolarHBondContact OE2-NH2 2.8Å
358	K	65.9	Low	69.1	Low	172 Å²	172	75 Å²	75	75%	0.748	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-17.9	179.6	-69	-168.5	171	-166.7	0	114.7	N356	N356-K358 PolarHBondContact O-N 2.8Å; N356-K358 PolarHBondContact OD1-N 3.4Å
359	F	65.4	Low	68.9	Low	25 Å²	25	78.3 Å²	78.3	11%	0.11	41%	0.413	C	S	.	.	S	Bend	trans	-119.7	4.7	-175.8	-56.7	-55.2	0	0	0	113.1	Y353 N356 E357 T366 I428 F431	Y353-F359 HydrophobicContact CD1-CB 4.48Å; Y353-F359 HydrophobicContact CD2-CB 4.47Å; Y353-F359 HydrophobicContact CD2-CD2 4.23Å; Y353-F359 HydrophobicContact CE1-CB 3.96Å; Y353-F359 HydrophobicContact CE2-CB 3.94Å; Y353-F359 HydrophobicContact CE2-CD2 4.12Å; Y353-F359 HydrophobicContact CE2-CG 4.03Å; N356-F359 HydrophobicContact CB-CD2 4.14Å; N356-F359 WeakPolarHBondContact ND2-CE2 3.06Å; N356-F359 PolarHBondContact O-N 2.9Å; E357-F359 VanDerWaalsContact C-N 3.29Å; E357-F359 PolarHBondContact O-N 3.25Å; F359-T366 WeakPolarHBondContact O-CG2 3.19Å; F359-I428 HydrophobicContact CD1-CG1 4.37Å; F359-I428 HydrophobicContact CE1-CG1 3.78Å; F359-I428 HydrophobicContact CZ-CG1 4.1Å; F359-F431 HydrophobicContact CE2-CB 4.44Å; F359-F431 HydrophobicContact CE2-CD1 4.04Å; F359-F431 HydrophobicContact CE2-CE1 4.49Å; F359-F431 HydrophobicContact CE2-CG 4.19Å
360	N	59.3	Low	68.7	Low	55 Å²	55	79.1 Å²	79.1	29%	0.294	42%	0.417	S	S	.	.			trans	-123.9	85	169.5	-172	2.2	0	0	0	112.2	N362 N363	N360-N362 PolarHBondContact OD1-N 3.12Å; N360-N362 PolarHBondContact OD1-O 2.94Å; N360-N363 PolarHBondContact ND2-OD1 2.7Å; N360-N363 VanDerWaalsContact ND2-OD1 3.11Å
361	P	54.5	Low	68.7	Low	100 Å²	100	81.1 Å²	81.1	65%	0.649	43%	0.427	S	S	*	.	S	Bend	trans	-89.7	-20.1	168.9	34.8	-34.5	0	0	0	114.1
362	N	54.9	Low	68.8	Low	110 Å²	110	80.2 Å²	80.2	59%	0.588	43%	0.428	S	S	*	.	S	Bend	trans	-154.5	136.2	178.9	-77.5	-53.2	0	0	0	109.3	N360 D364 T366	N360-N362 PolarHBondContact OD1-N 3.12Å; N360-N362 PolarHBondContact OD1-O 2.94Å; N362-D364 PolarHBondContact O-N 2.8Å; N362-T366 WeakPolarHBondContact O-CB 3.17Å; N362-T366 WeakPolarHBondContact O-CG2 3.34Å; N362-T366 PolarHBondContact O-OG1 3.25Å
363	N	53.6	Low	69	Low	122 Å²	122	79.7 Å²	79.7	65%	0.652	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-32.1	-170.8	-78.5	-22.2	0	0	0	114.6	N360 T366	N360-N363 PolarHBondContact ND2-OD1 2.7Å; N360-N363 VanDerWaalsContact ND2-OD1 3.11Å; N363-T366 PolarHBondContact O-OG1 3.02Å
364	D	51.8	Low	69.2	Low	143 Å²	143	79.9 Å²	79.9	77%	0.765	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-44.3	-169.6	-52.6	-52.5	0	0	0	112.7	N362 T366	N362-D364 PolarHBondContact O-N 2.8Å; D364-T366 VanDerWaalsContact C-N 3.29Å; D364-T366 PolarHBondContact O-N 3.41Å
365	T	52.4	Low	69.6	Low	90 Å²	90	78.8 Å²	78.8	55%	0.552	42%	0.417	S	S	*	.	H	α-helix	trans	-76.2	-13.4	-179.1	53.8	0	0	0	0	114.2	S367	T365-S367 VanDerWaalsContact C-N 3.34Å
366	T	59.7	Low	70.2	Confident	6 Å²	6	74.5 Å²	74.5	4%	0.037	40%	0.398	C	S	.	.	H	α-helix	trans	-80.5	-15.7	-179.5	47.8	0	0	0	0	113.4	F359 N362 N363 D364 L370	F359-T366 WeakPolarHBondContact O-CG2 3.19Å; N362-T366 WeakPolarHBondContact O-CB 3.17Å; N362-T366 WeakPolarHBondContact O-CG2 3.34Å; N362-T366 PolarHBondContact O-OG1 3.25Å; N363-T366 PolarHBondContact O-OG1 3.02Å; D364-T366 VanDerWaalsContact C-N 3.29Å; D364-T366 PolarHBondContact O-N 3.41Å; T366-L370 VanDerWaalsContact O-CB 3.25Å; T366-L370 WeakPolarHBondContact O-CB 3.28Å; T366-L370 PolarHBondContact O-N 3.39Å; T366-L370 VanDerWaalsContact O-N 3.1Å
367	S	65.7	Low	70.9	Confident	58 Å²	58	72.6 Å²	72.6	41%	0.406	39%	0.388	S	S	.	.	H	α-helix	trans	-63.6	-48.3	171.4	-173.3	0	0	0	0	111.5	T365 L370 N371	T365-S367 VanDerWaalsContact C-N 3.34Å; S367-L370 WeakPolarHBondContact O-CB 3.48Å; S367-L370 PolarHBondContact O-N 3.03Å; S367-N371 WeakPolarHBondContact O-CB 3.23Å; S367-N371 VanDerWaalsContact O-CG 3.27Å; S367-N371 PolarHBondContact O-N 3.48Å; S367-N371 PolarHBondContact O-ND2 2.94Å; S367-N371 VanDerWaalsContact O-ND2 3.11Å; S367-N371 PolarHBondContact OG-ND2 3.13Å
368	D	75	Confident	71.9	Confident	119 Å²	119	71.7 Å²	71.7	64%	0.636	38%	0.379	S	S	*	.	H	α-helix	trans	-72.7	-38.5	-176.1	-65.5	-27.9	0	0	0	112.7	L370 N371 G372	D368-L370 VanDerWaalsContact C-N 3.3Å; D368-L370 PolarHBondContact O-N 3.18Å; D368-N371 PolarHBondContact O-N 3.2Å; D368-G372 PolarHBondContact O-N 3.03Å
369	E	78.6	Confident	72.9	Confident	94 Å²	94	70.1 Å²	70.1	44%	0.439	37%	0.369	S	S	.	.	H	α-helix	trans	-60.8	-40.7	170.2	-75.5	-154.7	136.7	0	0	111.3	V373 R425	E369-V373 WeakPolarHBondContact O-CB 3.39Å; E369-V373 VanDerWaalsContact O-CG2 3.26Å; E369-V373 WeakPolarHBondContact O-CG2 3.35Å; E369-V373 PolarHBondContact O-N 2.95Å; E369-R425 IonicContact OE1-NH1 2.92Å
370	L	82.8	Confident	73.9	Confident	16 Å²	16	68.9 Å²	68.9	8%	0.084	36%	0.363	C	S	.	.	H	α-helix	trans	-64.8	-48.6	176	176.2	61.6	0	0	0	111.4	F349 Y353 M354 T366 S367 D368 G372 V373 L374	F349-L370 HydrophobicContact CD1-CD1 4.44Å; F349-L370 HydrophobicContact CE1-CD1 3.78Å; Y353-L370 HydrophobicContact CD1-CD1 3.92Å; Y353-L370 HydrophobicContact CD2-CD1 4.41Å; Y353-L370 HydrophobicContact CE1-CB 4.23Å; Y353-L370 HydrophobicContact CE1-CD1 4.22Å; Y353-L370 HydrophobicContact CG-CD1 4.02Å; M354-L370 HydrophobicContact CE-CD2 4.13Å; T366-L370 VanDerWaalsContact O-CB 3.25Å; T366-L370 WeakPolarHBondContact O-CB 3.28Å; T366-L370 PolarHBondContact O-N 3.39Å; T366-L370 VanDerWaalsContact O-N 3.1Å; S367-L370 WeakPolarHBondContact O-CB 3.48Å; S367-L370 PolarHBondContact O-N 3.03Å; D368-L370 VanDerWaalsContact C-N 3.3Å; D368-L370 PolarHBondContact O-N 3.18Å; L370-G372 PolarHBondContact O-N 3.19Å; L370-V373 CarbonylContact O-C 3.56Å; L370-V373 PolarHBondContact O-N 3.2Å; L370-V373 VanDerWaalsContact O-N 3.12Å; L370-L374 HydrophobicContact CD1-CD1 4.23Å; L370-L374 HydrophobicContact CD1-CD2 4.47Å; L370-L374 HydrophobicContact CD1-CG 4.01Å; L370-L374 HydrophobicContact CG-CD1 4.06Å; L370-L374 HydrophobicContact CG-CG 4.26Å; L370-L374 WeakPolarHBondContact O-CB 3.49Å; L370-L374 WeakPolarHBondContact O-CG 3.09Å; L370-L374 PolarHBondContact O-N 3.36Å
371	N	83.6	Confident	75.2	Confident	81 Å²	81	67.6 Å²	67.6	43%	0.433	36%	0.36	S	S	.	.	H	α-helix	trans	-60.2	-44.8	179.2	-72.2	-36.5	0	0	0	111.7	S367 D368 V373 L374 E375	S367-N371 WeakPolarHBondContact O-CB 3.23Å; S367-N371 VanDerWaalsContact O-CG 3.27Å; S367-N371 PolarHBondContact O-N 3.48Å; S367-N371 PolarHBondContact O-ND2 2.94Å; S367-N371 VanDerWaalsContact O-ND2 3.11Å; S367-N371 PolarHBondContact OG-ND2 3.13Å; D368-N371 PolarHBondContact O-N 3.2Å; N371-V373 VanDerWaalsContact C-N 3.27Å; N371-V373 PolarHBondContact O-N 2.87Å; N371-L374 PolarHBondContact O-N 2.95Å; N371-E375 WeakPolarHBondContact O-CB 3.28Å; N371-E375 PolarHBondContact O-N 2.88Å
372	G	84.6	Confident	76.5	Confident	36 Å²	36	66.6 Å²	66.6	37%	0.371	36%	0.356	S	S	.	.	H	α-helix	trans	-65.5	-25.9	175.5	0	0	0	0	0	114.1	D368 L370 K376	D368-G372 PolarHBondContact O-N 3.03Å; L370-G372 PolarHBondContact O-N 3.19Å; G372-K376 WeakPolarHBondContact O-CD 3.34Å; G372-K376 WeakPolarHBondContact O-CG 3.41Å
373	V	85.1	Confident	77.9	Confident	14 Å²	14	63.2 Å²	63.2	9%	0.085	34%	0.335	C	S	.	.	H	α-helix	trans	-80.9	-42.5	171.6	168.6	0	0	0	0	111.5	F349 E369 L370 N371 E375 K376 L377 I428	F349-V373 HydrophobicContact CE1-CG1 3.97Å; F349-V373 HydrophobicContact CZ-CG1 3.67Å; E369-V373 WeakPolarHBondContact O-CB 3.39Å; E369-V373 VanDerWaalsContact O-CG2 3.26Å; E369-V373 WeakPolarHBondContact O-CG2 3.35Å; E369-V373 PolarHBondContact O-N 2.95Å; L370-V373 CarbonylContact O-C 3.56Å; L370-V373 PolarHBondContact O-N 3.2Å; L370-V373 VanDerWaalsContact O-N 3.12Å; N371-V373 VanDerWaalsContact C-N 3.27Å; N371-V373 PolarHBondContact O-N 2.87Å; V373-E375 VanDerWaalsContact C-N 3.35Å; V373-E375 PolarHBondContact O-N 3.25Å; V373-K376 WeakPolarHBondContact O-CB 3.42Å; V373-K376 PolarHBondContact O-N 3.36Å; V373-L377 HydrophobicContact CG1-CD1 3.68Å; V373-L377 HydrophobicContact CG1-CG 4.46Å; V373-L377 WeakPolarHBondContact O-CD1 3.46Å; V373-L377 WeakPolarHBondContact O-CG 3.38Å; V373-L377 PolarHBondContact O-N 2.69Å; V373-L377 VanDerWaalsContact O-N 3.14Å; V373-I428 HydrophobicContact CG1-CG2 4.03Å; V373-I428 HydrophobicContact CG2-CD1 4.17Å; V373-I428 HydrophobicContact CG2-CG2 4.41Å
374	L	87.5	Confident	79.3	Confident	7 Å²	7	65.4 Å²	65.4	4%	0.037	33%	0.334	C	S	.	.	H	α-helix	trans	-58.8	-44.7	176.5	-75.2	179.2	0	0	0	112	F344 E346 F349 V350 L370 N371 K376 L377 R378	F344-L374 HydrophobicContact CE1-CD2 4.12Å; F344-L374 HydrophobicContact CZ-CD2 3.94Å; E346-L374 HydrophobicContact CG-CD2 3.82Å; F349-L374 HydrophobicContact CD1-CD2 3.65Å; F349-L374 HydrophobicContact CE1-CD2 3.96Å; V350-L374 HydrophobicContact CG2-CD1 3.98Å; V350-L374 HydrophobicContact CG2-CD2 3.96Å; L370-L374 HydrophobicContact CD1-CD1 4.23Å; L370-L374 HydrophobicContact CD1-CD2 4.47Å; L370-L374 HydrophobicContact CD1-CG 4.01Å; L370-L374 HydrophobicContact CG-CD1 4.06Å; L370-L374 HydrophobicContact CG-CG 4.26Å; L370-L374 WeakPolarHBondContact O-CB 3.49Å; L370-L374 WeakPolarHBondContact O-CG 3.09Å; L370-L374 PolarHBondContact O-N 3.36Å; N371-L374 PolarHBondContact O-N 2.95Å; L374-K376 VanDerWaalsContact C-N 3.33Å; L374-K376 PolarHBondContact O-N 2.99Å; L374-L377 CarbonylContact O-C 3.55Å; L374-L377 WeakPolarHBondContact O-CA 3.29Å; L374-L377 WeakPolarHBondContact O-CB 3.34Å; L374-L377 PolarHBondContact O-N 2.52Å; L374-R378 PolarHBondContact O-N 3.13Å
375	E	87.8	Confident	80.9	Confident	72 Å²	72	58.6 Å²	58.6	34%	0.336	30%	0.297	S	S	.	.	H	α-helix	trans	-60.3	-42.2	177.6	176.3	52.8	-158.7	0	0	112.2	N371 V373 L377 R378 R379	N371-E375 WeakPolarHBondContact O-CB 3.28Å; N371-E375 PolarHBondContact O-N 2.88Å; V373-E375 VanDerWaalsContact C-N 3.35Å; V373-E375 PolarHBondContact O-N 3.25Å; E375-L377 PolarHBondContact O-N 2.8Å; E375-R378 PolarHBondContact O-N 3.13Å; E375-R378 IonicContact OE2-NH1 3.49Å; E375-R379 WeakPolarHBondContact O-CG 3.31Å; E375-R379 PolarHBondContact O-N 3.04Å; E375-R379 VanDerWaalsContact O-N 3.13Å; E375-R379 IonicContact OE1-CZ 2.68Å; E375-R379 IonicContact OE1-NE 2.75Å; E375-R379 PolarHBondContact OE1-NE 2.95Å; E375-R379 IonicContact OE1-NH2 2.93Å; E375-R379 PolarHBondContact OE1-NH2 3.11Å
376	K	88.6	Confident	82.3	Confident	75 Å²	75	55.3 Å²	55.3	33%	0.326	28%	0.278	S	S	.	.	H	α-helix	trans	-61.7	-25.3	172	-72.7	169.3	173.3	-177.1	0	112.8	G372 V373 L374 F380 L422 G423 V424	G372-K376 WeakPolarHBondContact O-CD 3.34Å; G372-K376 WeakPolarHBondContact O-CG 3.41Å; V373-K376 WeakPolarHBondContact O-CB 3.42Å; V373-K376 PolarHBondContact O-N 3.36Å; L374-K376 VanDerWaalsContact C-N 3.33Å; L374-K376 PolarHBondContact O-N 2.99Å; K376-F380 PolarHBondContact O-N 3.44Å; K376-L422 HydrophobicContact CB-CB 4.47Å; K376-L422 WeakPolarHBondContact CD-O 3.36Å; K376-L422 WeakPolarHBondContact CE-O 3.45Å; K376-L422 WeakPolarHBondContact O-CD1 3.37Å; K376-G423 PolarHBondContact NZ-O 3.26Å; K376-V424 HydrophobicContact CB-CG2 4.06Å; K376-V424 HydrophobicContact CD-CG2 4.07Å
377	L	86.7	Confident	83.3	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-91.4	-26.1	-178.2	-64	166	0	0	0	113.8	F344 F349 V373 L374 E375 F380 A381 L418 T432	F344-L377 HydrophobicContact CD1-CB 3.71Å; F344-L377 HydrophobicContact CD2-CB 4.08Å; F344-L377 HydrophobicContact CD2-CD1 4.49Å; F344-L377 HydrophobicContact CE1-CB 3.51Å; F344-L377 HydrophobicContact CE1-CD1 4.32Å; F344-L377 HydrophobicContact CE2-CB 3.91Å; F344-L377 HydrophobicContact CE2-CD1 3.69Å; F344-L377 HydrophobicContact CE2-CG 4.25Å; F344-L377 HydrophobicContact CG-CB 3.99Å; F344-L377 HydrophobicContact CZ-CB 3.62Å; F344-L377 HydrophobicContact CZ-CD1 3.57Å; F344-L377 HydrophobicContact CZ-CG 4.2Å; F349-L377 HydrophobicContact CD1-CD1 4.23Å; F349-L377 HydrophobicContact CE1-CD1 3.96Å; F349-L377 HydrophobicContact CE2-CD1 4.32Å; F349-L377 HydrophobicContact CZ-CD1 4.02Å; V373-L377 HydrophobicContact CG1-CD1 3.68Å; V373-L377 HydrophobicContact CG1-CG 4.46Å; V373-L377 WeakPolarHBondContact O-CD1 3.46Å; V373-L377 WeakPolarHBondContact O-CG 3.38Å; V373-L377 PolarHBondContact O-N 2.69Å; V373-L377 VanDerWaalsContact O-N 3.14Å; L374-L377 CarbonylContact O-C 3.55Å; L374-L377 WeakPolarHBondContact O-CA 3.29Å; L374-L377 WeakPolarHBondContact O-CB 3.34Å; L374-L377 PolarHBondContact O-N 2.52Å; E375-L377 PolarHBondContact O-N 2.8Å; L377-F380 HydrophobicContact CD2-CB 4.38Å; L377-F380 WeakPolarHBondContact O-CB 3.44Å; L377-F380 PolarHBondContact O-N 2.96Å; L377-A381 PolarHBondContact O-N 2.86Å; L377-A381 VanDerWaalsContact O-N 3.12Å; L377-L418 HydrophobicContact CD2-CD2 3.47Å; L377-L418 VanDerWaalsContact CD2-CD2 3.47Å; L377-T432 HydrophobicContact CD1-CG2 3.44Å; L377-T432 VanDerWaalsContact CD1-CG2 3.44Å; L377-T432 HydrophobicContact CD2-CG2 3.34Å; L377-T432 HydrophobicContact CG-CG2 4.01Å
378	R	87.3	Confident	83.9	Confident	111 Å²	111	56.9 Å²	56.9	42%	0.419	28%	0.281	S	S	.	.	H	α-helix	trans	-65.1	-44.9	163.7	-62.9	178	-161.2	134	-2.7	110.1	E346 L374 E375 F380 A381 S382	E346-R378 IonicContact OE1-CZ 3.32Å; E346-R378 IonicContact OE1-NE 2.72Å; E346-R378 IonicContact OE1-NH2 3.86Å; E346-R378 PolarHBondContact OE1-NH2 2.82Å; E346-R378 IonicContact OE2-CZ 2.68Å; E346-R378 IonicContact OE2-NE 3.49Å; E346-R378 PolarHBondContact OE2-NE 3.31Å; E346-R378 IonicContact OE2-NH2 2.68Å; L374-R378 PolarHBondContact O-N 3.13Å; E375-R378 PolarHBondContact O-N 3.13Å; E375-R378 IonicContact OE2-NH1 3.49Å; R378-F380 VanDerWaalsContact C-N 3.3Å; R378-F380 PolarHBondContact O-N 2.95Å; R378-A381 PolarHBondContact O-N 2.73Å; R378-A381 VanDerWaalsContact O-N 3.08Å; R378-S382 PolarHBondContact O-N 2.91Å
379	R	85.8	Confident	83.8	Confident	138 Å²	138	52.9 Å²	52.9	52%	0.521	27%	0.267	S	S	.	.	H	α-helix	trans	-61	-35.7	170.9	-65.5	178	-163.3	-155.6	0.8	113.1	E375 A381 S382 Y383 L422	E375-R379 WeakPolarHBondContact O-CG 3.31Å; E375-R379 PolarHBondContact O-N 3.04Å; E375-R379 VanDerWaalsContact O-N 3.13Å; E375-R379 IonicContact OE1-CZ 2.68Å; E375-R379 IonicContact OE1-NE 2.75Å; E375-R379 PolarHBondContact OE1-NE 2.95Å; E375-R379 IonicContact OE1-NH2 2.93Å; E375-R379 PolarHBondContact OE1-NH2 3.11Å; R379-A381 VanDerWaalsContact C-N 3.32Å; R379-A381 PolarHBondContact O-N 2.87Å; R379-S382 WeakPolarHBondContact CA-OG 3.43Å; R379-S382 PolarHBondContact O-N 3.43Å; R379-S382 PolarHBondContact O-OG 3.14Å; R379-Y383 VanDerWaalsContact O-CD2 3.31Å; R379-Y383 WeakPolarHBondContact O-CD2 3.44Å; R379-Y383 WeakPolarHBondContact O-CE2 3.32Å; R379-L422 HydrophobicContact CB-CD2 3.72Å
380	F	87.4	Confident	83.3	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.1	-40.8	172.1	178.6	-91	0	0	0	112.4	L342 K376 L377 R378 K414 L417 L418 L422 T436	L342-F380 HydrophobicContact CB-CD1 4.39Å; L342-F380 HydrophobicContact CB-CE1 4.06Å; L342-F380 WeakPolarHBondContact CB-O 3.2Å; L342-F380 HydrophobicContact CD1-CD1 4.44Å; L342-F380 HydrophobicContact CD1-CD2 4.29Å; L342-F380 HydrophobicContact CD1-CE1 3.98Å; L342-F380 HydrophobicContact CD1-CE2 3.85Å; L342-F380 HydrophobicContact CD1-CZ 3.7Å; K376-F380 PolarHBondContact O-N 3.44Å; L377-F380 HydrophobicContact CD2-CB 4.38Å; L377-F380 WeakPolarHBondContact O-CB 3.44Å; L377-F380 PolarHBondContact O-N 2.96Å; R378-F380 VanDerWaalsContact C-N 3.3Å; R378-F380 PolarHBondContact O-N 2.95Å; F380-K414 HydrophobicContact CE2-CB 4.19Å; F380-K414 HydrophobicContact CE2-CG 4.3Å; F380-K414 HydrophobicContact CZ-CB 3.95Å; F380-K414 HydrophobicContact CZ-CD 3.93Å; F380-K414 HydrophobicContact CZ-CG 3.72Å; F380-L417 HydrophobicContact CD2-CB 4.29Å; F380-L417 HydrophobicContact CE2-CB 4.17Å; F380-L418 HydrophobicContact CB-CD2 4.21Å; F380-L418 HydrophobicContact CD2-CD2 3.46Å; F380-L418 VanDerWaalsContact CD2-CD2 3.46Å; F380-L418 HydrophobicContact CD2-CG 3.69Å; F380-L418 HydrophobicContact CE2-CD1 4.21Å; F380-L418 HydrophobicContact CE2-CD2 3.97Å; F380-L418 HydrophobicContact CE2-CG 3.71Å; F380-L418 HydrophobicContact CG-CD2 3.92Å; F380-L422 HydrophobicContact CB-CD1 3.62Å; F380-L422 HydrophobicContact CD2-CD1 3.87Å; F380-L422 HydrophobicContact CG-CD1 4.24Å; F380-T436 HydrophobicContact CD1-CG2 4.06Å; F380-T436 HydrophobicContact CE1-CG2 3.59Å; F380-T436 HydrophobicContact CZ-CG2 4.08Å
381	A	85.3	Confident	82.2	Confident	27 Å²	27	56 Å²	56	22%	0.223	28%	0.277	C	S	.	.	H	α-helix	trans	-71.7	-26.5	180	0	0	0	0	0	113.6	Q341 L342 F344 L377 R378 R379 Y383	Q341-A381 PolarHBondContact NE2-O 3.05Å; L342-A381 VanDerWaalsContact O-O 3.08Å; F344-A381 HydrophobicContact CB-CB 4.15Å; L377-A381 PolarHBondContact O-N 2.86Å; L377-A381 VanDerWaalsContact O-N 3.12Å; R378-A381 PolarHBondContact O-N 2.73Å; R378-A381 VanDerWaalsContact O-N 3.08Å; R379-A381 VanDerWaalsContact C-N 3.32Å; R379-A381 PolarHBondContact O-N 2.87Å; A381-Y383 VanDerWaalsContact C-N 3.31Å; A381-Y383 PolarHBondContact O-N 2.87Å
382	S	82.7	Confident	80.8	Confident	80 Å²	80	58.8 Å²	58.8	56%	0.559	29%	0.292	S	S	*	.	H	α-helix	trans	-70.3	-19.5	177.5	42	0	0	0	0	114.9	Q341 R378 R379 R384	Q341-S382 PolarHBondContact NE2-O 2.73Å; R378-S382 PolarHBondContact O-N 2.91Å; R379-S382 WeakPolarHBondContact CA-OG 3.43Å; R379-S382 PolarHBondContact O-N 3.43Å; R379-S382 PolarHBondContact O-OG 3.14Å; S382-R384 PolarHBondContact O-N 3.45Å
383	Y	84.3	Confident	79.6	Confident	38 Å²	38	61.9 Å²	61.9	15%	0.149	30%	0.297	C	S	.	.			trans	-65.4	131.3	-177.6	-75.4	-66.7	0	0	0	114	Q341 L342 R379 A381 P400 E401 L417 L422	Q341-Y383 PolarHBondContact NE2-O 2.96Å; L342-Y383 PolarHBondContact N-O 3.14Å; R379-Y383 VanDerWaalsContact O-CD2 3.31Å; R379-Y383 WeakPolarHBondContact O-CD2 3.44Å; R379-Y383 WeakPolarHBondContact O-CE2 3.32Å; A381-Y383 VanDerWaalsContact C-N 3.31Å; A381-Y383 PolarHBondContact O-N 2.87Å; Y383-P400 HydrophobicContact CD1-CB 4.28Å; Y383-P400 HydrophobicContact CD1-CG 3.59Å; Y383-P400 HydrophobicContact CE1-CG 4.29Å; Y383-P400 HydrophobicContact CG-CG 4.13Å; Y383-E401 HydrophobicContact CE1-CG 3.65Å; Y383-E401 WeakPolarHBondContact CE1-OE1 3.15Å; Y383-E401 VanDerWaalsContact CZ-OE1 3.25Å; Y383-E401 PolarHBondContact OH-OE1 3.31Å; Y383-L417 HydrophobicContact CD1-CD2 4.45Å; Y383-L417 HydrophobicContact CD2-CD2 4.09Å; Y383-L417 HydrophobicContact CE1-CD2 4.39Å; Y383-L417 HydrophobicContact CE2-CD2 4.03Å; Y383-L417 HydrophobicContact CG-CD2 4.31Å; Y383-L422 HydrophobicContact CE2-CD1 4.09Å; Y383-L422 HydrophobicContact CE2-CD2 4.15Å; Y383-L422 HydrophobicContact CE2-CG 4.19Å
384	R	82.6	Confident	78.6	Confident	168 Å²	168	68.2 Å²	68.2	63%	0.634	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.6	123.3	163.5	-71	176.8	179.2	-177.7	1.4	109.2	Y339 S382 P400	Y339-R384 HydrophobicContact CD1-CB 4.09Å; S382-R384 PolarHBondContact O-N 3.45Å; R384-P400 WeakPolarHBondContact O-CB 3.41Å
385	V	85.1	Confident	77.8	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	113.8	-177.3	169	0	0	0	0	109.6	Y339 V340 L342 A397 G398 F410 L413	Y339-V385 CarbonylContact C-O 3.59Å; Y339-V385 WeakPolarHBondContact CA-O 3.27Å; V340-V385 HydrophobicContact CB-CB 4.34Å; V340-V385 PolarHBondContact N-O 2.99Å; V340-V385 WeakPolarHBondContact O-CB 3.33Å; V340-V385 PolarHBondContact O-N 3.05Å; L342-V385 HydrophobicContact CD1-CG2 4.15Å; L342-V385 HydrophobicContact CD2-CG2 3.97Å; L342-V385 HydrophobicContact CG-CG2 4.01Å; V385-A397 HydrophobicContact CG1-CB 3.79Å; V385-G398 WeakPolarHBondContact CG1-O 3.35Å; V385-F410 HydrophobicContact CB-CE2 4.47Å; V385-F410 HydrophobicContact CG1-CE2 3.95Å; V385-L413 HydrophobicContact CB-CD2 4.33Å; V385-L413 HydrophobicContact CG1-CD2 3.42Å; V385-L413 VanDerWaalsContact CG1-CD2 3.42Å; V385-L413 HydrophobicContact CG2-CD2 3.9Å
386	P	82.6	Confident	77.4	Confident	22 Å²	22	71.1 Å²	71.1	14%	0.143	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	149	176.6	28.7	-35	0	0	0	112.1	Y339 G398	Y339-P386 HydrophobicContact CD1-CB 4.14Å; Y339-P386 HydrophobicContact CE1-CB 3.95Å; P386-G398 PolarHBondContact O-N 3.08Å
387	I	81.4	Confident	77.1	Confident	30 Å²	30	67.9 Å²	67.9	15%	0.154	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	108.4	172.2	-58.9	-55.7	0	0	0	109.8	E338 V340 G389 R395 V396 A397	E338-I387 HydrophobicContact CB-CB 4.24Å; E338-I387 HydrophobicContact CB-CG1 4.37Å; E338-I387 HydrophobicContact CG-CG1 4.26Å; E338-I387 WeakPolarHBondContact O-CB 3.24Å; E338-I387 WeakPolarHBondContact O-CG1 3.29Å; E338-I387 PolarHBondContact O-N 3.24Å; V340-I387 HydrophobicContact CG2-CD1 3.93Å; V340-I387 HydrophobicContact CG2-CG1 4.2Å; I387-G389 PolarHBondContact O-N 3.44Å; I387-G389 VanDerWaalsContact O-N 3.07Å; I387-R395 HydrophobicContact CD1-CB 4.39Å; I387-R395 HydrophobicContact CG2-CB 3.88Å; I387-R395 HydrophobicContact CG2-CG 4.23Å; I387-V396 CarbonylContact C-O 3.48Å; I387-V396 WeakPolarHBondContact CA-O 3.39Å; I387-A397 HydrophobicContact CD1-CB 4.3Å
388	L	77.4	Confident	77	Confident	67 Å²	67	67.9 Å²	67.9	35%	0.351	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	22.9	-176	-53.8	173.6	0	0	0	113.7	V396 G398 L403 P405	L388-V396 HydrophobicContact CB-CB 4.46Å; L388-V396 HydrophobicContact CB-CG1 4.22Å; L388-V396 PolarHBondContact N-O 3.14Å; L388-G398 VanDerWaalsContact CD1-CA 3.46Å; L388-L403 VanDerWaalsContact CD1-O 3.28Å; L388-L403 WeakPolarHBondContact CD1-O 3.43Å; L388-P405 HydrophobicContact CD1-CB 4.04Å
389	G	73.7	Confident	77	Confident	34 Å²	34	62.6 Å²	62.6	35%	0.351	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	106.8	-165.1	-178.3	0	0	0	0	0	115.4	I387 R395 V396	I387-G389 PolarHBondContact O-N 3.44Å; I387-G389 VanDerWaalsContact O-N 3.07Å; G389-R395 WeakPolarHBondContact O-CA 3.48Å; G389-V396 PolarHBondContact O-N 3.08Å
390	R	68.2	Low	76.9	Confident	162 Å²	162	58 Å²	58	61%	0.611	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113	132.8	179.7	-59.8	-173.8	-173.7	-157.9	5.3	110.8	R394 D797	R390-R394 CarbonylContact C-O 3.44Å; R390-R394 WeakPolarHBondContact CA-O 3.22Å; R390-D797 IonicContact NH1-OD2 3.77Å; R390-D797 PolarHBondContact NH1-OD2 2.91Å
391	A	59.6	Low	76.7	Confident	15 Å²	15	62.7 Å²	62.7	12%	0.124	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	129.2	172.3	0	0	0	0	0	110.5	Q393 R394 V396 N407 L982	A391-Q393 PolarHBondContact O-N 2.8Å; A391-R394 PolarHBondContact N-O 2.95Å; A391-R394 PolarHBondContact O-N 3.27Å; A391-V396 HydrophobicContact CB-CG2 3.62Å; A391-N407 WeakPolarHBondContact CB-ND2 3.17Å; A391-L982 HydrophobicContact CB-CD2 4.37Å
392	N	54.4	Low	76.8	Confident	139 Å²	139	64 Å²	64	74%	0.743	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	44.7	-169.6	-57.6	-23.9	0	0	0	111.8	R394	N392-R394 PolarHBondContact O-N 3.32Å; N392-R394 VanDerWaalsContact O-N 3.08Å
393	Q	57.8	Low	76.6	Confident	100 Å²	100	65.9 Å²	65.9	47%	0.467	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	16.1	-172.5	-57.7	-171.4	-6	0	0	116.4	A391 L795	A391-Q393 PolarHBondContact O-N 2.8Å; Q393-L795 HydrophobicContact CB-CD2 4.19Å; Q393-L795 HydrophobicContact CG-CD2 4.19Å
394	R	63.8	Low	76.6	Confident	147 Å²	147	67.6 Å²	67.6	56%	0.555	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105	135.3	173.4	-62.7	-177.7	-178.8	-154.2	-3.1	110.7	R390 A391 N392 V396	R390-R394 CarbonylContact C-O 3.44Å; R390-R394 WeakPolarHBondContact CA-O 3.22Å; A391-R394 PolarHBondContact N-O 2.95Å; A391-R394 PolarHBondContact O-N 3.27Å; N392-R394 PolarHBondContact O-N 3.32Å; N392-R394 VanDerWaalsContact O-N 3.08Å; R394-V396 PolarHBondContact O-N 3.46Å
395	R	72.6	Confident	76.5	Confident	136 Å²	136	60.2 Å²	60.2	51%	0.513	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	126.4	169.6	-68.2	-179.1	178.1	-161.1	-15	109.8	E338 I387 G389 A397	E338-R395 IonicContact OE1-CZ 2.69Å; E338-R395 IonicContact OE1-NH1 3.86Å; E338-R395 PolarHBondContact OE1-NH1 2.81Å; E338-R395 IonicContact OE1-NH2 4Å; E338-R395 PolarHBondContact OE1-NH2 2.79Å; E338-R395 IonicContact OE2-CZ 3.46Å; E338-R395 IonicContact OE2-NE 3.56Å; E338-R395 PolarHBondContact OE2-NE 3.05Å; E338-R395 IonicContact OE2-NH1 3.28Å; E338-R395 PolarHBondContact OE2-NH1 2.99Å; E338-R395 IonicContact OE2-NH2 3.62Å; E338-R395 PolarHBondContact OE2-NH2 3.32Å; I387-R395 HydrophobicContact CD1-CB 4.39Å; I387-R395 HydrophobicContact CG2-CB 3.88Å; I387-R395 HydrophobicContact CG2-CG 4.23Å; G389-R395 WeakPolarHBondContact O-CA 3.48Å; R395-A397 PolarHBondContact O-N 3.17Å
396	V	78.6	Confident	76.4	Confident	5 Å²	5	61.7 Å²	61.7	3%	0.03	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	101.3	-177.9	178.6	0	0	0	0	109	I387 L388 G389 A391 R394 G398 P405 N407	I387-V396 CarbonylContact C-O 3.48Å; I387-V396 WeakPolarHBondContact CA-O 3.39Å; L388-V396 HydrophobicContact CB-CB 4.46Å; L388-V396 HydrophobicContact CB-CG1 4.22Å; L388-V396 PolarHBondContact N-O 3.14Å; G389-V396 PolarHBondContact O-N 3.08Å; A391-V396 HydrophobicContact CB-CG2 3.62Å; R394-V396 PolarHBondContact O-N 3.46Å; V396-G398 PolarHBondContact O-N 3.07Å; V396-P405 HydrophobicContact CG1-CB 3.43Å; V396-P405 VanDerWaalsContact CG1-CB 3.43Å; V396-N407 VanDerWaalsContact CG1-OD1 3.31Å; V396-N407 WeakPolarHBondContact CG1-OD1 3.33Å; V396-N407 HydrophobicContact CG2-CB 4.29Å
397	A	82.7	Confident	75.8	Confident	6 Å²	6	61.2 Å²	61.2	5%	0.05	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	125	174.4	0	0	0	0	0	110.9	V385 I387 R395 F406 F410 L413	V385-A397 HydrophobicContact CG1-CB 3.79Å; I387-A397 HydrophobicContact CD1-CB 4.3Å; R395-A397 PolarHBondContact O-N 3.17Å; A397-F406 PolarHBondContact O-N 2.87Å; A397-F410 HydrophobicContact CB-CD2 3.85Å; A397-F410 HydrophobicContact CB-CE2 4.06Å; A397-L413 HydrophobicContact CB-CD2 3.74Å
398	G	83.3	Confident	75.1	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-91.6	147.5	172.5	0	0	0	0	0	112	V385 P386 L388 V396 K404	V385-G398 WeakPolarHBondContact CG1-O 3.35Å; P386-G398 PolarHBondContact O-N 3.08Å; L388-G398 VanDerWaalsContact CD1-CA 3.46Å; V396-G398 PolarHBondContact O-N 3.07Å; G398-K404 CarbonylContact C-O 3.58Å; G398-K404 WeakPolarHBondContact CA-O 3.48Å
399	C	87.5	Confident	74.8	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-74.5	123.9	171.6	-167.8	0	0	0	0	110.4	E401 C402 L403 K404 F406 L413 H416 H421	C399-E401 PolarHBondContact O-N 2.84Å; C399-C402 PolarHBondContact O-N 3.14Å; C399-L403 WeakPolarHBondContact O-CA 3.39Å; C399-L403 PolarHBondContact O-N 3.03Å; C399-K404 HydrophobicContact CB-CB 4.33Å; C399-K404 PolarHBondContact N-O 3.25Å; C399-F406 HydrophobicContact CB-CE2 4.21Å; C399-L413 HydrophobicContact CB-CD1 3.8Å; C399-H416 PolarHBondContact SG-CD2 2.95Å; C399-H416 PolarHBondContact SG-NE2 2.86Å; C399-H416 VanDerWaalsContact SG-NE2 3.41Å; C399-H421 VanDerWaalsContact SG-CD2 3.59Å; C399-H421 PolarHBondContact SG-NE2 3.32Å
400	P	84.4	Confident	75.1	Confident	42 Å²	42	65.4 Å²	65.4	27%	0.273	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-29.1	-179.3	20.5	-31.2	0	0	0	114	Y383 R384 L417	Y383-P400 HydrophobicContact CD1-CB 4.28Å; Y383-P400 HydrophobicContact CD1-CG 3.59Å; Y383-P400 HydrophobicContact CE1-CG 4.29Å; Y383-P400 HydrophobicContact CG-CG 4.13Å; R384-P400 WeakPolarHBondContact O-CB 3.41Å; P400-L417 HydrophobicContact CG-CD2 4.16Å
401	E	83.5	Confident	75.8	Confident	98 Å²	98	61.1 Å²	61.1	46%	0.458	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-16.6	-177.1	-70.2	-81.1	-176.8	0	0	114.3	Y383 C399 L417 H421	Y383-E401 HydrophobicContact CE1-CG 3.65Å; Y383-E401 WeakPolarHBondContact CE1-OE1 3.15Å; Y383-E401 VanDerWaalsContact CZ-OE1 3.25Å; Y383-E401 PolarHBondContact OH-OE1 3.31Å; C399-E401 PolarHBondContact O-N 2.84Å; E401-L417 HydrophobicContact CG-CD2 4.28Å; E401-H421 HydrophobicContact CB-CB 4.42Å; E401-H421 VanDerWaalsContact CB-CD2 3.49Å; E401-H421 WeakPolarHBondContact CB-CD2 3.47Å; E401-H421 HydrophobicContact CG-CB 4.08Å
402	C	86.5	Confident	77.1	Confident	56 Å²	56	63.6 Å²	63.6	38%	0.378	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-154.8	16.2	-177.1	68.2	0	0	0	0	115.3	C399 K404 H416 H421	C399-C402 PolarHBondContact O-N 3.14Å; C402-K404 PolarHBondContact O-N 3.29Å; C402-H416 PolarHBondContact SG-NE2 3.49Å; C402-H421 VanDerWaalsContact CB-CE1 3.42Å; C402-H421 WeakPolarHBondContact CB-CE1 3.37Å; C402-H421 WeakPolarHBondContact CB-NE2 3.36Å; C402-H421 PolarHBondContact SG-NE2 3.24Å
403	L	79.7	Confident	78.6	Confident	119 Å²	119	57 Å²	57	62%	0.623	28%	0.28	S	S	*	.			trans	52.4	7.2	176.4	-56.2	178.9	0	0	0	117.2	L388 C399	L388-L403 VanDerWaalsContact CD1-O 3.28Å; L388-L403 WeakPolarHBondContact CD1-O 3.43Å; C399-L403 WeakPolarHBondContact O-CA 3.39Å; C399-L403 PolarHBondContact O-N 3.03Å
404	K	83	Confident	80.1	Confident	73 Å²	73	52.7 Å²	52.7	32%	0.317	26%	0.26	S	S	.	.			trans	-63.4	131.3	-178.3	179.4	172.6	-177.5	-177.3	0	113.3	G398 C399 C402 F406	G398-K404 CarbonylContact C-O 3.58Å; G398-K404 WeakPolarHBondContact CA-O 3.48Å; C399-K404 HydrophobicContact CB-CB 4.33Å; C399-K404 PolarHBondContact N-O 3.25Å; C402-K404 PolarHBondContact O-N 3.29Å; K404-F406 HydrophobicContact CB-CE2 4.1Å; K404-F406 HydrophobicContact CD-CE2 4.11Å; K404-F406 HydrophobicContact CD-CZ 4.02Å; K404-F406 HydrophobicContact CG-CE2 3.8Å; K404-F406 HydrophobicContact CG-CZ 4.18Å; K404-F406 WeakPolarHBondContact O-CD2 3.46Å; K404-F406 WeakPolarHBondContact O-CE2 3.41Å
405	P	82	Confident	81.2	Confident	14 Å²	14	49.9 Å²	49.9	9%	0.091	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-84.6	145.8	-177.4	33.7	-36.7	0	0	0	114.4	L388 V396 A981 E984	L388-P405 HydrophobicContact CD1-CB 4.04Å; V396-P405 HydrophobicContact CG1-CB 3.43Å; V396-P405 VanDerWaalsContact CG1-CB 3.43Å; P405-A981 HydrophobicContact CB-CB 4.31Å; P405-A981 HydrophobicContact CG-CB 4.06Å; P405-E984 WeakPolarHBondContact CD-OE2 3.49Å; P405-E984 HydrophobicContact CG-CB 3.73Å; P405-E984 HydrophobicContact CG-CG 4.03Å
406	F	81.4	Confident	82	Confident	31 Å²	31	44.6 Å²	44.6	14%	0.136	23%	0.232	C	C	.	.			trans	-127	56.5	-175.9	-74.5	-93.1	0	0	0	114.6	A397 C399 K404 H408 G409 D412 L413 H416	A397-F406 PolarHBondContact O-N 2.87Å; C399-F406 HydrophobicContact CB-CE2 4.21Å; K404-F406 HydrophobicContact CB-CE2 4.1Å; K404-F406 HydrophobicContact CD-CE2 4.11Å; K404-F406 HydrophobicContact CD-CZ 4.02Å; K404-F406 HydrophobicContact CG-CE2 3.8Å; K404-F406 HydrophobicContact CG-CZ 4.18Å; K404-F406 WeakPolarHBondContact O-CD2 3.46Å; K404-F406 WeakPolarHBondContact O-CE2 3.41Å; F406-H408 PolarHBondContact O-N 3.37Å; F406-G409 PolarHBondContact O-N 3.49Å; F406-D412 HydrophobicContact CD1-CB 3.97Å; F406-D412 HydrophobicContact CE1-CB 4.36Å; F406-D412 WeakPolarHBondContact CE1-O 3.28Å; F406-L413 HydrophobicContact CB-CB 4.02Å; F406-L413 HydrophobicContact CD1-CB 4.13Å; F406-L413 HydrophobicContact CD2-CB 3.91Å; F406-L413 HydrophobicContact CD2-CD1 3.8Å; F406-L413 HydrophobicContact CD2-CG 4.37Å; F406-L413 HydrophobicContact CE2-CB 4.47Å; F406-L413 HydrophobicContact CE2-CD1 3.85Å; F406-L413 HydrophobicContact CG-CB 3.74Å; F406-H416 HydrophobicContact CE1-CB 3.99Å; F406-H416 HydrophobicContact CE2-CB 4.48Å; F406-H416 AromaticContact CE2-CD2 3.55Å; F406-H416 HydrophobicContact CZ-CB 3.59Å; F406-H416 AromaticContact CZ-CD2 3.31Å; F406-H416 WeakPolarHBondContact CZ-CD2 3.47Å; F406-H416 AromaticContact CZ-CG 3.61Å
407	N	70.7	Confident	82.5	Confident	12 Å²	12	44.3 Å²	44.3	6%	0.064	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-13.6	-172.5	-38.1	26.6	0	0	0	114.7	A391 V396 Q985	A391-N407 WeakPolarHBondContact CB-ND2 3.17Å; V396-N407 VanDerWaalsContact CG1-OD1 3.31Å; V396-N407 WeakPolarHBondContact CG1-OD1 3.33Å; V396-N407 HydrophobicContact CG2-CB 4.29Å; N407-Q985 VanDerWaalsContact ND2-CD 3.33Å; N407-Q985 PolarHBondContact ND2-OE1 3.3Å; N407-Q985 VanDerWaalsContact ND2-OE1 3.13Å
408	H	65.9	Low	82.8	Confident	135 Å²	135	44 Å²	44	63%	0.625	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-11.9	-178.8	-63.7	-39.4	0	0	0	114.8	F406 Q985	F406-H408 PolarHBondContact O-N 3.37Å; H408-Q985 PolarHBondContact NE2-NE2 3.1Å
409	G	71	Confident	83.1	Confident	21 Å²	21	46 Å²	46	22%	0.216	24%	0.241	C	C	.	.			trans	161.9	136	172.2	0	0	0	0	0	114.8	F406 T411 D412	F406-G409 PolarHBondContact O-N 3.49Å; G409-T411 PolarHBondContact O-N 3.28Å; G409-T411 VanDerWaalsContact O-N 3.12Å; G409-D412 PolarHBondContact O-N 3.05Å
410	F	81.3	Confident	83.1	Confident	62 Å²	62	50.1 Å²	50.1	27%	0.272	27%	0.265	S	S	.	.	H	α-helix	trans	-56.3	-28.2	175.2	-157.5	-119.3	0	0	0	112.7	V340 L342 V385 A397 D412 L413 K414	V340-F410 HydrophobicContact CB-CE2 4.5Å; V340-F410 HydrophobicContact CB-CZ 4.29Å; V340-F410 HydrophobicContact CG1-CE1 4.42Å; V340-F410 HydrophobicContact CG1-CE2 4.22Å; V340-F410 HydrophobicContact CG1-CZ 3.63Å; L342-F410 HydrophobicContact CD2-CE1 3.79Å; L342-F410 HydrophobicContact CD2-CZ 3.59Å; V385-F410 HydrophobicContact CB-CE2 4.47Å; V385-F410 HydrophobicContact CG1-CE2 3.95Å; A397-F410 HydrophobicContact CB-CD2 3.85Å; A397-F410 HydrophobicContact CB-CE2 4.06Å; F410-D412 VanDerWaalsContact C-N 3.3Å; F410-D412 PolarHBondContact O-N 2.86Å; F410-L413 HydrophobicContact CD2-CD2 4.25Å; F410-L413 HydrophobicContact CE2-CD2 4.12Å; F410-L413 PolarHBondContact O-N 3.07Å; F410-K414 HydrophobicContact CD1-CD 4.36Å; F410-K414 VanDerWaalsContact CD1-CE 3.45Å; F410-K414 WeakPolarHBondContact O-CG 3.5Å; F410-K414 PolarHBondContact O-N 3.26Å
411	T	83.4	Confident	83.3	Confident	72 Å²	72	51.6 Å²	51.6	44%	0.442	27%	0.268	S	S	.	.	H	α-helix	trans	-64.9	-27.5	175	47.9	0	0	0	0	114	G409 K415	G409-T411 PolarHBondContact O-N 3.28Å; G409-T411 VanDerWaalsContact O-N 3.12Å; T411-K415 WeakPolarHBondContact O-CG 3.37Å; T411-K415 PolarHBondContact O-N 3.18Å; T411-K415 VanDerWaalsContact O-N 3.13Å
412	D	85.1	Confident	83.5	Confident	67 Å²	67	47.7 Å²	47.7	36%	0.358	25%	0.251	S	S	.	.	H	α-helix	trans	-82.5	-30.3	177.3	-71.6	-22.5	0	0	0	112.1	F406 G409 F410 K415 H416	F406-D412 HydrophobicContact CD1-CB 3.97Å; F406-D412 HydrophobicContact CE1-CB 4.36Å; F406-D412 WeakPolarHBondContact CE1-O 3.28Å; G409-D412 PolarHBondContact O-N 3.05Å; F410-D412 VanDerWaalsContact C-N 3.3Å; F410-D412 PolarHBondContact O-N 2.86Å; D412-K415 PolarHBondContact O-N 3.21Å; D412-K415 WeakPolarHBondContact OD1-CD 3.44Å; D412-K415 WeakPolarHBondContact OD1-CE 3.36Å; D412-K415 IonicContact OD1-NZ 2.77Å; D412-K415 PolarHBondContact OD1-NZ 3.12Å; D412-H416 WeakPolarHBondContact O-CB 3.45Å; D412-H416 PolarHBondContact O-N 3.14Å
413	L	87.4	Confident	83.4	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-61.2	-46	165	171.7	60.4	0	0	0	110.9	V385 A397 C399 F406 F410 K415 H416 L417	V385-L413 HydrophobicContact CB-CD2 4.33Å; V385-L413 HydrophobicContact CG1-CD2 3.42Å; V385-L413 VanDerWaalsContact CG1-CD2 3.42Å; V385-L413 HydrophobicContact CG2-CD2 3.9Å; A397-L413 HydrophobicContact CB-CD2 3.74Å; C399-L413 HydrophobicContact CB-CD1 3.8Å; F406-L413 HydrophobicContact CB-CB 4.02Å; F406-L413 HydrophobicContact CD1-CB 4.13Å; F406-L413 HydrophobicContact CD2-CB 3.91Å; F406-L413 HydrophobicContact CD2-CD1 3.8Å; F406-L413 HydrophobicContact CD2-CG 4.37Å; F406-L413 HydrophobicContact CE2-CB 4.47Å; F406-L413 HydrophobicContact CE2-CD1 3.85Å; F406-L413 HydrophobicContact CG-CB 3.74Å; F410-L413 HydrophobicContact CD2-CD2 4.25Å; F410-L413 HydrophobicContact CE2-CD2 4.12Å; F410-L413 PolarHBondContact O-N 3.07Å; L413-K415 VanDerWaalsContact C-N 3.34Å; L413-K415 PolarHBondContact O-N 3.02Å; L413-H416 WeakPolarHBondContact O-CB 3.22Å; L413-H416 PolarHBondContact O-N 3.42Å; L413-L417 HydrophobicContact CD1-CD1 3.91Å; L413-L417 HydrophobicContact CD1-CG 4.15Å; L413-L417 HydrophobicContact CG-CD1 4.07Å; L413-L417 PolarHBondContact O-N 2.97Å
414	K	87.9	Confident	83.6	Confident	10 Å²	10	41.7 Å²	41.7	4%	0.043	23%	0.226	C	C	.	.	H	α-helix	trans	-60	-42.3	177.3	-66	-172.2	173.1	178	0	112.2	F380 F410 H416 L418 T436 S438	F380-K414 HydrophobicContact CE2-CB 4.19Å; F380-K414 HydrophobicContact CE2-CG 4.3Å; F380-K414 HydrophobicContact CZ-CB 3.95Å; F380-K414 HydrophobicContact CZ-CD 3.93Å; F380-K414 HydrophobicContact CZ-CG 3.72Å; F410-K414 HydrophobicContact CD1-CD 4.36Å; F410-K414 VanDerWaalsContact CD1-CE 3.45Å; F410-K414 WeakPolarHBondContact O-CG 3.5Å; F410-K414 PolarHBondContact O-N 3.26Å; K414-H416 VanDerWaalsContact C-N 3.31Å; K414-H416 PolarHBondContact O-N 3.23Å; K414-L418 WeakPolarHBondContact O-CB 3.49Å; K414-L418 WeakPolarHBondContact O-CD1 3.44Å; K414-L418 VanDerWaalsContact O-CG 3.25Å; K414-L418 WeakPolarHBondContact O-CG 3.18Å; K414-L418 PolarHBondContact O-N 2.91Å; K414-T436 PolarHBondContact NZ-O 3.24Å; K414-S438 PolarHBondContact NZ-OG 3.36Å; K414-S438 VanDerWaalsContact NZ-OG 3.08Å
415	K	87.6	Confident	83.7	Confident	88 Å²	88	44.2 Å²	44.2	38%	0.383	23%	0.234	S	C	.	.	H	α-helix	trans	-58	-42.6	171.6	-70.9	164.4	-156.2	162.3	0	112	T411 D412 L413 V419 I433	T411-K415 WeakPolarHBondContact O-CG 3.37Å; T411-K415 PolarHBondContact O-N 3.18Å; T411-K415 VanDerWaalsContact O-N 3.13Å; D412-K415 PolarHBondContact O-N 3.21Å; D412-K415 WeakPolarHBondContact OD1-CD 3.44Å; D412-K415 WeakPolarHBondContact OD1-CE 3.36Å; D412-K415 IonicContact OD1-NZ 2.77Å; D412-K415 PolarHBondContact OD1-NZ 3.12Å; L413-K415 VanDerWaalsContact C-N 3.34Å; L413-K415 PolarHBondContact O-N 3.02Å; K415-V419 VanDerWaalsContact O-CB 3.25Å; K415-V419 WeakPolarHBondContact O-CB 3.41Å; K415-V419 VanDerWaalsContact O-CG2 3.31Å; K415-V419 WeakPolarHBondContact O-CG2 3.36Å; K415-V419 PolarHBondContact O-N 2.84Å; K415-I433 HydrophobicContact CB-CD1 4.34Å; K415-I433 HydrophobicContact CD-CD1 4.33Å; K415-I433 HydrophobicContact CG-CD1 3.29Å
416	H	89.3	Confident	83.6	Confident	24 Å²	24	52.8 Å²	52.8	11%	0.111	26%	0.264	C	S	.	.	H	α-helix	trans	-68.5	-47.7	-178.5	171.6	44.9	0	0	0	112.6	C399 C402 F406 D412 L413 K414 L418 V419 T420 H421	C399-H416 PolarHBondContact SG-CD2 2.95Å; C399-H416 PolarHBondContact SG-NE2 2.86Å; C399-H416 VanDerWaalsContact SG-NE2 3.41Å; C402-H416 PolarHBondContact SG-NE2 3.49Å; F406-H416 HydrophobicContact CE1-CB 3.99Å; F406-H416 HydrophobicContact CE2-CB 4.48Å; F406-H416 AromaticContact CE2-CD2 3.55Å; F406-H416 HydrophobicContact CZ-CB 3.59Å; F406-H416 AromaticContact CZ-CD2 3.31Å; F406-H416 WeakPolarHBondContact CZ-CD2 3.47Å; F406-H416 AromaticContact CZ-CG 3.61Å; D412-H416 WeakPolarHBondContact O-CB 3.45Å; D412-H416 PolarHBondContact O-N 3.14Å; L413-H416 WeakPolarHBondContact O-CB 3.22Å; L413-H416 PolarHBondContact O-N 3.42Å; K414-H416 VanDerWaalsContact C-N 3.31Å; K414-H416 PolarHBondContact O-N 3.23Å; H416-L418 PolarHBondContact O-N 3.48Å; H416-V419 PolarHBondContact O-N 2.92Å; H416-T420 VanDerWaalsContact ND1-CB 3.31Å; H416-T420 WeakPolarHBondContact ND1-CB 3.06Å; H416-T420 PolarHBondContact ND1-OG1 2.85Å; H416-T420 WeakPolarHBondContact O-CA 3.49Å; H416-T420 WeakPolarHBondContact O-CB 3.47Å; H416-T420 PolarHBondContact O-N 3Å; H416-T420 PolarHBondContact O-OG1 2.96Å; H416-H421 AromaticContact CD2-NE2 3.78Å; H416-H421 AromaticContact CE1-CD2 3.88Å; H416-H421 AromaticContact CE1-NE2 3.17Å; H416-H421 PolarHBondContact CE1-NE2 3.05Å; H416-H421 AromaticContact NE2-CD2 3.89Å; H416-H421 AromaticContact NE2-NE2 2.78Å; H416-H421 PolarHBondContact NE2-NE2 3.18Å
417	L	89.4	Confident	83.4	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.276	C	S	.	.	I	π-helix	trans	-57.6	-49.2	174.5	-79.7	162.5	0	0	0	111.4	L342 F380 Y383 P400 E401 L413 V419 H421 L422	L342-L417 HydrophobicContact CD1-CD1 3.68Å; F380-L417 HydrophobicContact CD2-CB 4.29Å; F380-L417 HydrophobicContact CE2-CB 4.17Å; Y383-L417 HydrophobicContact CD1-CD2 4.45Å; Y383-L417 HydrophobicContact CD2-CD2 4.09Å; Y383-L417 HydrophobicContact CE1-CD2 4.39Å; Y383-L417 HydrophobicContact CE2-CD2 4.03Å; Y383-L417 HydrophobicContact CG-CD2 4.31Å; P400-L417 HydrophobicContact CG-CD2 4.16Å; E401-L417 HydrophobicContact CG-CD2 4.28Å; L413-L417 HydrophobicContact CD1-CD1 3.91Å; L413-L417 HydrophobicContact CD1-CG 4.15Å; L413-L417 HydrophobicContact CG-CD1 4.07Å; L413-L417 PolarHBondContact O-N 2.97Å; L417-V419 PolarHBondContact O-N 3.37Å; L417-H421 PolarHBondContact O-N 3.31Å; L417-L422 PolarHBondContact O-N 3.1Å
418	L	88.9	Confident	84	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.273	C	S	.	.	I	π-helix	trans	-62.2	-45	179.3	-69.5	169.9	0	0	0	113.1	L377 F380 K414 H416 L422 G423 V424 I433	L377-L418 HydrophobicContact CD2-CD2 3.47Å; L377-L418 VanDerWaalsContact CD2-CD2 3.47Å; F380-L418 HydrophobicContact CB-CD2 4.21Å; F380-L418 HydrophobicContact CD2-CD2 3.46Å; F380-L418 VanDerWaalsContact CD2-CD2 3.46Å; F380-L418 HydrophobicContact CD2-CG 3.69Å; F380-L418 HydrophobicContact CE2-CD1 4.21Å; F380-L418 HydrophobicContact CE2-CD2 3.97Å; F380-L418 HydrophobicContact CE2-CG 3.71Å; F380-L418 HydrophobicContact CG-CD2 3.92Å; K414-L418 WeakPolarHBondContact O-CB 3.49Å; K414-L418 WeakPolarHBondContact O-CD1 3.44Å; K414-L418 VanDerWaalsContact O-CG 3.25Å; K414-L418 WeakPolarHBondContact O-CG 3.18Å; K414-L418 PolarHBondContact O-N 2.91Å; H416-L418 PolarHBondContact O-N 3.48Å; L418-L422 HydrophobicContact CD2-CD1 4.12Å; L418-G423 PolarHBondContact O-N 2.93Å; L418-V424 HydrophobicContact CB-CB 4.39Å; L418-V424 HydrophobicContact CB-CG2 4.47Å; L418-V424 HydrophobicContact CD2-CG2 4.17Å; L418-V424 VanDerWaalsContact O-CB 3.28Å; L418-V424 WeakPolarHBondContact O-CB 3.22Å; L418-V424 WeakPolarHBondContact O-CG2 3.44Å; L418-V424 PolarHBondContact O-N 2.76Å; L418-I433 HydrophobicContact CD1-CD1 4.39Å; L418-I433 HydrophobicContact CD1-CG1 3.67Å
419	V	89	Confident	84.8	Confident	42 Å²	42	48 Å²	48	26%	0.255	25%	0.245	S	C	.	.	I	π-helix	trans	-91.1	-32.1	-170.9	175.8	0	0	0	0	113.5	K415 H416 L417 R426 S429	K415-V419 VanDerWaalsContact O-CB 3.25Å; K415-V419 WeakPolarHBondContact O-CB 3.41Å; K415-V419 VanDerWaalsContact O-CG2 3.31Å; K415-V419 WeakPolarHBondContact O-CG2 3.36Å; K415-V419 PolarHBondContact O-N 2.84Å; H416-V419 PolarHBondContact O-N 2.92Å; L417-V419 PolarHBondContact O-N 3.37Å; V419-R426 HydrophobicContact CG1-CG 3.83Å; V419-R426 HydrophobicContact CG2-CG 4.39Å; V419-S429 WeakPolarHBondContact CG2-OG 3.43Å
420	T	87.2	Confident	85.3	Confident	85 Å²	85	56.3 Å²	56.3	52%	0.521	27%	0.27	S	S	.	.	I	π-helix	trans	-94.7	-44.9	-175.4	-53.6	0	0	0	0	112.5	H416	H416-T420 VanDerWaalsContact ND1-CB 3.31Å; H416-T420 WeakPolarHBondContact ND1-CB 3.06Å; H416-T420 PolarHBondContact ND1-OG1 2.85Å; H416-T420 WeakPolarHBondContact O-CA 3.49Å; H416-T420 WeakPolarHBondContact O-CB 3.47Å; H416-T420 PolarHBondContact O-N 3Å; H416-T420 PolarHBondContact O-OG1 2.96Å
421	H	89.6	Confident	85.4	Confident	73 Å²	73	55.3 Å²	55.3	34%	0.338	27%	0.265	S	S	.	.	I	π-helix	trans	-98.1	-43.7	-171.5	-62.5	-54.4	0	0	0	112.1	C399 E401 C402 H416 L417	C399-H421 VanDerWaalsContact SG-CD2 3.59Å; C399-H421 PolarHBondContact SG-NE2 3.32Å; E401-H421 HydrophobicContact CB-CB 4.42Å; E401-H421 VanDerWaalsContact CB-CD2 3.49Å; E401-H421 WeakPolarHBondContact CB-CD2 3.47Å; E401-H421 HydrophobicContact CG-CB 4.08Å; C402-H421 VanDerWaalsContact CB-CE1 3.42Å; C402-H421 WeakPolarHBondContact CB-CE1 3.37Å; C402-H421 WeakPolarHBondContact CB-NE2 3.36Å; C402-H421 PolarHBondContact SG-NE2 3.24Å; H416-H421 AromaticContact CD2-NE2 3.78Å; H416-H421 AromaticContact CE1-CD2 3.88Å; H416-H421 AromaticContact CE1-NE2 3.17Å; H416-H421 PolarHBondContact CE1-NE2 3.05Å; H416-H421 AromaticContact NE2-CD2 3.89Å; H416-H421 AromaticContact NE2-NE2 2.78Å; H416-H421 PolarHBondContact NE2-NE2 3.18Å; L417-H421 PolarHBondContact O-N 3.31Å
422	L	87.2	Confident	85.4	Confident	16 Å²	16	51.9 Å²	51.9	8%	0.084	24%	0.244	C	C	.	.	S	Bend	trans	-87	-7.9	178.7	-66	163.9	0	0	0	114.3	K376 R379 F380 Y383 L417 L418 V424	K376-L422 HydrophobicContact CB-CB 4.47Å; K376-L422 WeakPolarHBondContact CD-O 3.36Å; K376-L422 WeakPolarHBondContact CE-O 3.45Å; K376-L422 WeakPolarHBondContact O-CD1 3.37Å; R379-L422 HydrophobicContact CB-CD2 3.72Å; F380-L422 HydrophobicContact CB-CD1 3.62Å; F380-L422 HydrophobicContact CD2-CD1 3.87Å; F380-L422 HydrophobicContact CG-CD1 4.24Å; Y383-L422 HydrophobicContact CE2-CD1 4.09Å; Y383-L422 HydrophobicContact CE2-CD2 4.15Å; Y383-L422 HydrophobicContact CE2-CG 4.19Å; L417-L422 PolarHBondContact O-N 3.1Å; L418-L422 HydrophobicContact CD2-CD1 4.12Å; L422-V424 VanDerWaalsContact C-N 3.33Å; L422-V424 HydrophobicContact CB-CG2 4.23Å; L422-V424 PolarHBondContact O-N 3.35Å
423	G	84.7	Confident	85.3	Confident	44 Å²	44	49.4 Å²	49.4	45%	0.454	23%	0.231	S	C	.	.			trans	57.9	40.4	177.9	0	0	0	0	0	114	K376 L418	K376-G423 PolarHBondContact NZ-O 3.26Å; L418-G423 PolarHBondContact O-N 2.93Å
424	V	84.9	Confident	84.9	Confident	5 Å²	5	52.2 Å²	52.2	3%	0.03	25%	0.246	C	C	.	.			trans	-82.4	131.3	171.3	-176.3	0	0	0	0	109.1	K376 L418 L422 I428	K376-V424 HydrophobicContact CB-CG2 4.06Å; K376-V424 HydrophobicContact CD-CG2 4.07Å; L418-V424 HydrophobicContact CB-CB 4.39Å; L418-V424 HydrophobicContact CB-CG2 4.47Å; L418-V424 HydrophobicContact CD2-CG2 4.17Å; L418-V424 VanDerWaalsContact O-CB 3.28Å; L418-V424 WeakPolarHBondContact O-CB 3.22Å; L418-V424 WeakPolarHBondContact O-CG2 3.44Å; L418-V424 PolarHBondContact O-N 2.76Å; L422-V424 VanDerWaalsContact C-N 3.33Å; L422-V424 HydrophobicContact CB-CG2 4.23Å; L422-V424 PolarHBondContact O-N 3.35Å; V424-I428 HydrophobicContact CG1-CB 4.09Å; V424-I428 HydrophobicContact CG1-CG2 3.81Å
425	R	83.4	Confident	84.8	Confident	127 Å²	127	52.8 Å²	52.8	48%	0.479	25%	0.248	S	C	.	.			trans	-56.5	144.3	179.8	-63.3	166.3	45	161.6	-2.5	111.1	E369 D427 I428 S429	E369-R425 IonicContact OE1-NH1 2.92Å; R425-D427 VanDerWaalsContact C-N 3.26Å; R425-D427 WeakPolarHBondContact CB-OD1 3.47Å; R425-D427 IonicContact CZ-OD2 3.35Å; R425-D427 IonicContact NE-OD1 2.68Å; R425-D427 PolarHBondContact NE-OD1 3.31Å; R425-D427 IonicContact NE-OD2 3.97Å; R425-D427 IonicContact NH2-OD1 3.12Å; R425-D427 IonicContact NH2-OD2 3.59Å; R425-D427 PolarHBondContact NH2-OD2 3.17Å; R425-D427 PolarHBondContact O-N 3.05Å; R425-I428 HydrophobicContact CB-CB 4.46Å; R425-I428 HydrophobicContact CB-CD1 4.27Å; R425-I428 HydrophobicContact CB-CG1 4.36Å; R425-I428 PolarHBondContact O-N 2.99Å; R425-S429 WeakPolarHBondContact O-CB 3.47Å; R425-S429 PolarHBondContact O-N 3.16Å; R425-S429 PolarHBondContact O-OG 3.06Å
426	R	81.1	Confident	84.2	Confident	194 Å²	194	48.6 Å²	48.6	73%	0.732	23%	0.23	S	C	*	.	H	α-helix	trans	-68.5	-19.6	-170.9	-62.4	-175.9	-172.3	125.6	1.4	115.1	V419 R430	V419-R426 HydrophobicContact CG1-CG 3.83Å; V419-R426 HydrophobicContact CG2-CG 4.39Å; R426-R430 WeakPolarHBondContact O-CD 3.08Å; R426-R430 WeakPolarHBondContact O-CG 3.45Å
427	D	77.4	Confident	83	Confident	70 Å²	70	49.9 Å²	49.9	37%	0.374	24%	0.236	S	C	.	.	H	α-helix	trans	-76.6	-49.9	171.5	48.9	-5.6	0	0	0	110.8	R425	R425-D427 VanDerWaalsContact C-N 3.26Å; R425-D427 WeakPolarHBondContact CB-OD1 3.47Å; R425-D427 IonicContact CZ-OD2 3.35Å; R425-D427 IonicContact NE-OD1 2.68Å; R425-D427 PolarHBondContact NE-OD1 3.31Å; R425-D427 IonicContact NE-OD2 3.97Å; R425-D427 IonicContact NH2-OD1 3.12Å; R425-D427 IonicContact NH2-OD2 3.59Å; R425-D427 PolarHBondContact NH2-OD2 3.17Å; R425-D427 PolarHBondContact O-N 3.05Å
428	I	82.7	Confident	81	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.015	25%	0.252	C	S	.	.	H	α-helix	trans	-64.5	-46.1	176.6	-61.9	176.9	0	0	0	110.9	F359 V373 V424 R425 R430 F431 T432	F359-I428 HydrophobicContact CD1-CG1 4.37Å; F359-I428 HydrophobicContact CE1-CG1 3.78Å; F359-I428 HydrophobicContact CZ-CG1 4.1Å; V373-I428 HydrophobicContact CG1-CG2 4.03Å; V373-I428 HydrophobicContact CG2-CD1 4.17Å; V373-I428 HydrophobicContact CG2-CG2 4.41Å; V424-I428 HydrophobicContact CG1-CB 4.09Å; V424-I428 HydrophobicContact CG1-CG2 3.81Å; R425-I428 HydrophobicContact CB-CB 4.46Å; R425-I428 HydrophobicContact CB-CD1 4.27Å; R425-I428 HydrophobicContact CB-CG1 4.36Å; R425-I428 PolarHBondContact O-N 2.99Å; I428-R430 VanDerWaalsContact C-N 3.29Å; I428-R430 PolarHBondContact O-N 3.17Å; I428-F431 CarbonylContact O-C 3.56Å; I428-F431 WeakPolarHBondContact O-CB 3.38Å; I428-F431 PolarHBondContact O-N 3.35Å; I428-T432 WeakPolarHBondContact CG2-OG1 3.44Å; I428-T432 WeakPolarHBondContact O-CB 3.5Å; I428-T432 PolarHBondContact O-N 2.7Å; I428-T432 PolarHBondContact O-OG1 2.74Å
429	S	82.9	Confident	78.5	Confident	4 Å²	4	55.6 Å²	55.6	3%	0.028	29%	0.288	C	S	.	.	H	α-helix	trans	-62.4	-34.6	-175.1	69.8	0	0	0	0	113	V419 R425 T432 I433	V419-S429 WeakPolarHBondContact CG2-OG 3.43Å; R425-S429 WeakPolarHBondContact O-CB 3.47Å; R425-S429 PolarHBondContact O-N 3.16Å; R425-S429 PolarHBondContact O-OG 3.06Å; S429-T432 PolarHBondContact O-N 3.17Å; S429-I433 VanDerWaalsContact O-CD1 3.22Å; S429-I433 WeakPolarHBondContact O-CD1 3.5Å; S429-I433 VanDerWaalsContact O-CG1 3.22Å; S429-I433 WeakPolarHBondContact O-CG1 3.33Å; S429-I433 PolarHBondContact O-N 3.09Å; S429-I433 VanDerWaalsContact O-N 3.11Å
430	R	81.2	Confident	75.8	Confident	196 Å²	196	64 Å²	64	74%	0.74	32%	0.315	S	S	*	.	H	α-helix	trans	-61.7	-42	173	-76.1	175.2	178.4	-173.2	0.7	112.7	R426 I428	R426-R430 WeakPolarHBondContact O-CD 3.08Å; R426-R430 WeakPolarHBondContact O-CG 3.45Å; I428-R430 VanDerWaalsContact C-N 3.29Å; I428-R430 PolarHBondContact O-N 3.17Å
431	F	82.9	Confident	73.1	Confident	41 Å²	41	64.4 Å²	64.4	18%	0.18	32%	0.321	C	S	.	.	H	α-helix	trans	-71.2	-34.9	175.6	170.6	-106.4	0	0	0	111.5	F349 A352 Y353 F359 I428 F435	F349-F431 HydrophobicContact CD2-CD1 4.48Å; F349-F431 HydrophobicContact CD2-CE1 4.14Å; F349-F431 AromaticContact CE2-CD1 3.9Å; F349-F431 HydrophobicContact CE2-CD1 3.9Å; F349-F431 AromaticContact CE2-CE1 3.81Å; F349-F431 HydrophobicContact CE2-CE1 3.81Å; A352-F431 HydrophobicContact CB-CE2 4.26Å; A352-F431 HydrophobicContact CB-CZ 3.67Å; Y353-F431 HydrophobicContact CD2-CE1 4.17Å; F359-F431 HydrophobicContact CE2-CB 4.44Å; F359-F431 HydrophobicContact CE2-CD1 4.04Å; F359-F431 HydrophobicContact CE2-CE1 4.49Å; F359-F431 HydrophobicContact CE2-CG 4.19Å; I428-F431 CarbonylContact O-C 3.56Å; I428-F431 WeakPolarHBondContact O-CB 3.38Å; I428-F431 PolarHBondContact O-N 3.35Å; F431-F435 HydrophobicContact CD1-CE2 4.47Å; F431-F435 HydrophobicContact CD2-CE2 4.4Å; F431-F435 HydrophobicContact CE1-CE2 4.16Å; F431-F435 HydrophobicContact CE2-CE2 4.1Å; F431-F435 HydrophobicContact CE2-CZ 4.38Å; F431-F435 AromaticContact CZ-CE2 3.98Å; F431-F435 HydrophobicContact CZ-CE2 3.98Å; F431-F435 HydrophobicContact CZ-CZ 4.24Å; F431-F435 WeakPolarHBondContact O-CD2 3.18Å; F431-F435 VanDerWaalsContact O-CE2 3.24Å; F431-F435 WeakPolarHBondContact O-CE2 3.33Å
432	T	82.9	Confident	70.3	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-75.5	-30.9	-173.8	-50.4	0	0	0	0	113.6	F349 L377 I428 S429 D434 F435	F349-T432 HydrophobicContact CD2-CG2 4.01Å; F349-T432 HydrophobicContact CE2-CG2 3.83Å; F349-T432 WeakPolarHBondContact CE2-OG1 3.19Å; L377-T432 HydrophobicContact CD1-CG2 3.44Å; L377-T432 VanDerWaalsContact CD1-CG2 3.44Å; L377-T432 HydrophobicContact CD2-CG2 3.34Å; L377-T432 HydrophobicContact CG-CG2 4.01Å; I428-T432 WeakPolarHBondContact CG2-OG1 3.44Å; I428-T432 WeakPolarHBondContact O-CB 3.5Å; I428-T432 PolarHBondContact O-N 2.7Å; I428-T432 PolarHBondContact O-OG1 2.74Å; S429-T432 PolarHBondContact O-N 3.17Å; T432-D434 PolarHBondContact O-N 3.45Å; T432-D434 VanDerWaalsContact O-N 3.15Å; T432-F435 PolarHBondContact O-N 3.18Å
433	I	83.4	Confident	67.7	Low	15 Å²	15	76.7 Å²	76.7	8%	0.077	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-56.5	-33.2	-179.8	-74.1	154.3	0	0	0	112.2	K415 L418 S429 F435 T436	K415-I433 HydrophobicContact CB-CD1 4.34Å; K415-I433 HydrophobicContact CD-CD1 4.33Å; K415-I433 HydrophobicContact CG-CD1 3.29Å; L418-I433 HydrophobicContact CD1-CD1 4.39Å; L418-I433 HydrophobicContact CD1-CG1 3.67Å; S429-I433 VanDerWaalsContact O-CD1 3.22Å; S429-I433 WeakPolarHBondContact O-CD1 3.5Å; S429-I433 VanDerWaalsContact O-CG1 3.22Å; S429-I433 WeakPolarHBondContact O-CG1 3.33Å; S429-I433 PolarHBondContact O-N 3.09Å; S429-I433 VanDerWaalsContact O-N 3.11Å; I433-F435 PolarHBondContact O-N 2.64Å; I433-T436 PolarHBondContact O-N 2.75Å; I433-T436 PolarHBondContact O-OG1 3.44Å
434	D	80.4	Confident	65.1	Low	60 Å²	60	79.6 Å²	79.6	32%	0.321	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-64.2	-3.7	176.6	-66	-22.5	0	0	0	113.8	T432 H437 V655	T432-D434 PolarHBondContact O-N 3.45Å; T432-D434 VanDerWaalsContact O-N 3.15Å; D434-H437 PolarHBondContact O-NE2 3.13Å; D434-V655 HydrophobicContact CB-CG1 3.68Å; D434-V655 WeakPolarHBondContact O-CG1 3.39Å
435	F	83.9	Confident	62.6	Low	21 Å²	21	85.2 Å²	85.2	9%	0.092	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-117.8	10.6	177.3	-55.4	-84	0	0	0	113.2	F344 N345 A348 F349 A352 F431 T432 I433	F344-F435 HydrophobicContact CD2-CB 4.47Å; F344-F435 HydrophobicContact CE2-CB 4.36Å; N345-F435 PolarHBondContact N-O 2.72Å; A348-F435 HydrophobicContact CB-CD1 3.73Å; A348-F435 HydrophobicContact CB-CE1 4.03Å; A348-F435 WeakPolarHBondContact O-CE1 3.44Å; F349-F435 HydrophobicContact CB-CB 4.17Å; F349-F435 HydrophobicContact CB-CD1 4.21Å; F349-F435 HydrophobicContact CB-CD2 4.36Å; F349-F435 HydrophobicContact CB-CG 3.97Å; F349-F435 AromaticContact CD2-CD2 3.82Å; F349-F435 HydrophobicContact CD2-CD2 3.82Å; F349-F435 HydrophobicContact CD2-CE2 4.25Å; F349-F435 HydrophobicContact CD2-CG 4.26Å; A352-F435 HydrophobicContact CB-CE1 3.81Å; A352-F435 HydrophobicContact CB-CE2 4.27Å; A352-F435 HydrophobicContact CB-CZ 3.34Å; F431-F435 HydrophobicContact CD1-CE2 4.47Å; F431-F435 HydrophobicContact CD2-CE2 4.4Å; F431-F435 HydrophobicContact CE1-CE2 4.16Å; F431-F435 HydrophobicContact CE2-CE2 4.1Å; F431-F435 HydrophobicContact CE2-CZ 4.38Å; F431-F435 AromaticContact CZ-CE2 3.98Å; F431-F435 HydrophobicContact CZ-CE2 3.98Å; F431-F435 HydrophobicContact CZ-CZ 4.24Å; F431-F435 WeakPolarHBondContact O-CD2 3.18Å; F431-F435 VanDerWaalsContact O-CE2 3.24Å; F431-F435 WeakPolarHBondContact O-CE2 3.33Å; T432-F435 PolarHBondContact O-N 3.18Å; I433-F435 PolarHBondContact O-N 2.64Å
436	T	76.3	Confident	60	Low	1 Å²	1	86 Å²	86	1%	0.006	44%	0.438	C	S	.	.			trans	-113.4	25.1	-169.6	63.4	0	0	0	0	115.1	Y343 F344 F380 K414 I433	Y343-T436 CarbonylContact O-C 3.56Å; Y343-T436 VanDerWaalsContact O-C 3.31Å; Y343-T436 WeakPolarHBondContact O-CA 3.2Å; F344-T436 HydrophobicContact CD2-CG2 4.48Å; F380-T436 HydrophobicContact CD1-CG2 4.06Å; F380-T436 HydrophobicContact CE1-CG2 3.59Å; F380-T436 HydrophobicContact CZ-CG2 4.08Å; K414-T436 PolarHBondContact NZ-O 3.24Å; I433-T436 PolarHBondContact O-N 2.75Å; I433-T436 PolarHBondContact O-OG1 3.44Å
437	H	62.7	Low	57.5	Low	50 Å²	50	82.6 Å²	82.6	23%	0.231	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-72.3	137	-168.9	-66.7	-77.5	0	0	0	113.7	Y343 D434 P656	Y343-H437 WeakPolarHBondContact CD1-O 3.41Å; D434-H437 PolarHBondContact O-NE2 3.13Å; H437-P656 PolarHBondContact CD2-O 2.89Å; H437-P656 PolarHBondContact NE2-O 2.2Å
438	S	49.4	Very low	55.2	Low	47 Å²	47	83.9 Å²	83.9	33%	0.329	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-91.9	134.6	-176.2	-59.2	0	0	0	0	111.4	K414	K414-S438 PolarHBondContact NZ-OG 3.36Å; K414-S438 VanDerWaalsContact NZ-OG 3.08Å
439	G	34.4	Very low	52.8	Low	73 Å²	73	92 Å²	92	75%	0.753	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-71.4	162.9	167.7	0	0	0	0	0	112.3
440	R	32.5	Very low	50.4	Low	219 Å²	219	97.1 Å²	97.1	83%	0.826	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-70.8	147.9	166.9	-89	-173.1	170.3	-171	-3.6	109.7
441	S	31.3	Very low	48	Very low	93 Å²	93	94.2 Å²	94.2	65%	0.65	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-65.5	132.7	176	42.5	0	0	0	0	111.7
442	H	30	Very low	45.4	Very low	184 Å²	184	99.5 Å²	99.5	85%	0.852	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-76.1	132.2	158.8	-75.3	-107.3	0	0	0	108.5	S444	H442-S444 PolarHBondContact O-N 2.92Å
443	H	32.9	Very low	43	Very low	163 Å²	163	105 Å²	105	76%	0.755	59%	0.592	S	S	*	*			trans	-84.7	107.9	165.7	-71.4	-98.5	0	0	0	108.2	T445	H443-T445 PolarHBondContact O-N 3.16Å
444	S	31	Very low	40.4	Very low	105 Å²	105	111.3 Å²	111.3	73%	0.734	63%	0.626	S	S	*	*			trans	-90.6	81	175.4	56.9	0	0	0	0	110.3	H442 L446	H442-S444 PolarHBondContact O-N 2.92Å; S444-L446 PolarHBondContact O-N 3.05Å
445	T	31.5	Very low	38.1	Very low	123 Å²	123	115.6 Å²	115.6	76%	0.755	65%	0.647	S	S	*	*			trans	-70.7	120.1	170.6	-45.9	0	0	0	0	109.1	H443	H443-T445 PolarHBondContact O-N 3.16Å
446	L	28.3	Very low	35.6	Very low	143 Å²	143	124.6 Å²	124.6	75%	0.749	68%	0.682	S	S	*	*			trans	-75	141.6	171.3	-79.6	76.4	0	0	0	110.3	S444	S444-L446 PolarHBondContact O-N 3.05Å
447	P	30.5	Very low	33.6	Very low	123 Å²	123	129.9 Å²	129.9	80%	0.799	72%	0.716	S	S	*	*			trans	-105.8	128	140.2	33	-26.8	0	0	0	109.8
448	S	27.8	Very low	32	Very low	97 Å²	97	134 Å²	134	68%	0.678	74%	0.74	S	S	*	*			trans	-73.4	138.2	175.1	-53	0	0	0	0	111.5
449	Q	33.6	Very low	31.2	Very low	174 Å²	174	138.5 Å²	138.5	81%	0.813	76%	0.76	S	S	*	*				178.1	127	119.4	-96.8	161.8	92	0	0	115.8
450	T	31.7	Very low	31	Very low	112 Å²	112	140 Å²	140	69%	0.687	76%	0.759	S	S	*	*			trans	62.6	126.9	138.2	59	0	0	0	0	124.2
451	N	31	Very low	31.1	Very low	135 Å²	135	134.6 Å²	134.6	72%	0.722	75%	0.752	S	S	*	*			trans	88.9	90.3	135	-61.9	-5.3	0	0	0	122.3
452	N	28.6	Very low	31.1	Very low	152 Å²	152	138.2 Å²	138.2	81%	0.813	76%	0.759	S	S	*	*				35.4	109.3	113.6	-58.6	-5	0	0	0	121
453	S	31.6	Very low	31.1	Very low	114 Å²	114	133.8 Å²	133.8	80%	0.797	75%	0.749	S	S	*	*				174	113.8	109.4	58.7	0	0	0	0	109.7
454	L	29.4	Very low	31.1	Very low	148 Å²	148	135 Å²	135	78%	0.775	75%	0.752	S	S	*	*				70.8	101.7	69.5	-148.5	159.2	0	0	0	113.2
455	I	32.3	Very low	30.9	Very low	150 Å²	150	138.2 Å²	138.2	77%	0.769	76%	0.755	S	S	*	*			trans	176.5	115	132	-87.8	156.3	0	0	0	111.4
456	Y	31.7	Very low	30.8	Very low	211 Å²	211	137.7 Å²	137.7	83%	0.827	76%	0.756	S	S	*	*			trans	36.3	149.1	150.7	-75.2	-98.2	0	0	0	125.2
457	P	32.7	Very low	30.8	Very low	111 Å²	111	139.8 Å²	139.8	72%	0.721	76%	0.76	S	S	*	*			trans	-103.7	175.2	179.7	42.4	-34.9	0	0	0	113.4
458	D	30.5	Very low	30.8	Very low	137 Å²	137	137.9 Å²	137.9	73%	0.733	76%	0.762	S	S	*	*			trans	-158	157.9	138.8	-144.3	-4.9	0	0	0	115.5
459	N	32.6	Very low	30.9	Very low	141 Å²	141	139.7 Å²	139.7	75%	0.754	76%	0.763	S	S	*	*			trans	58.9	138.5	159.8	-68.5	-56.6	0	0	0	123.4
460	S	29	Very low	30.7	Very low	105 Å²	105	143.3 Å²	143.3	73%	0.734	77%	0.769	S	S	*	*			trans	-144.8	-174.5	173.8	71.7	0	0	0	0	107.9
461	P	35	Very low	30.5	Very low	105 Å²	105	145.1 Å²	145.1	68%	0.682	78%	0.775	S	S	*	*			cis	-133.6	-161.8	-15.1	25.3	0.5	0	0	0	113
462	Q	31.7	Very low	30.6	Very low	170 Å²	170	142.6 Å²	142.6	79%	0.794	78%	0.78	S	S	*	*			trans	94.7	87.1	152.9	-55.6	-159.1	4.1	0	0	123.1
463	S	30.7	Very low	30.7	Very low	90 Å²	90	146.3 Å²	146.3	63%	0.629	78%	0.783	S	S	*	*				101.6	153.9	107.2	84.7	0	0	0	0	122.5
464	K	32.3	Very low	30.6	Very low	189 Å²	189	148.1 Å²	148.1	82%	0.822	78%	0.783	S	S	*	*			trans	85.6	81.1	156.7	-67.1	163.2	-172.5	168.9	0	120.4
465	H	27.4	Very low	30.7	Very low	173 Å²	173	146.5 Å²	146.5	80%	0.801	78%	0.784	S	S	*	*				38.3	131.3	118.3	-94.4	-82.3	0	0	0	121.3
466	S	29.4	Very low	30.7	Very low	112 Å²	112	142.6 Å²	142.6	78%	0.783	78%	0.78	S	S	*	*				-153.5	136.6	115.5	-166.3	0	0	0	0	111.9
467	F	26.4	Very low	30.8	Very low	187 Å²	187	141.8 Å²	141.8	82%	0.82	78%	0.781	S	S	*	*			trans	-128.6	125.4	169.8	-96.1	-80.4	0	0	0	108.3
468	G	32	Very low	30.7	Very low	82 Å²	82	140.3 Å²	140.3	85%	0.845	78%	0.778	S	S	*	*			trans	-84.7	130.7	-175.3	0	0	0	0	0	113.8
469	I	28.9	Very low	30.6	Very low	135 Å²	135	143.5 Å²	143.5	69%	0.692	79%	0.786	S	S	*	*			trans	-97.6	144	176	-63.1	169.9	0	0	0	110.3
470	R	29	Very low	30.4	Very low	250 Å²	250	143.1 Å²	143.1	94%	0.943	77%	0.774	S	S	*	*			trans	-128.6	124.4	147.7	-82.8	-166.5	172.8	-169.5	-0.5	110.9
471	N	28	Very low	30.5	Very low	151 Å²	151	147.3 Å²	147.3	81%	0.807	77%	0.774	S	S	*	*			trans	-94.8	142.8	178.6	-81	-38.9	0	0	0	111.5
472	G	32.7	Very low	30.2	Very low	81 Å²	81	152 Å²	152	84%	0.835	78%	0.783	S	S	*	*			trans	-114.3	126.8	164	0	0	0	0	0	111
473	R	30.8	Very low	30.5	Very low	231 Å²	231	148.5 Å²	148.5	87%	0.872	78%	0.776	S	S	*	*			trans	-92	165.8	179.1	-66.2	-179.9	179.5	-162.5	1.8	110.4
474	L	31.1	Very low	30.6	Very low	152 Å²	152	154 Å²	154	80%	0.796	79%	0.788	S	S	*	*			cis	-172.2	169.4	-21.9	-104.2	171	0	0	0	107.4
475	S	31.1	Very low	30.9	Very low	114 Å²	114	150.2 Å²	150.2	80%	0.797	78%	0.783	S	S	*	*			trans	71.6	146.1	169.4	-164.1	0	0	0	0	115.4
476	G	31.5	Very low	31.2	Very low	67 Å²	67	150.5 Å²	150.5	69%	0.691	79%	0.789	S	S	*	*			cis	157.1	155.6	-1.5	0	0	0	0	0	108.9
477	K	34.5	Very low	31.3	Very low	194 Å²	194	149.5 Å²	149.5	84%	0.843	79%	0.788	S	S	*	*			cis	-146.5	-176.7	8.3	-66.8	175.7	179.3	172.6	0	109.9
478	A	30.2	Very low	31.9	Very low	81 Å²	81	146.2 Å²	146.2	67%	0.669	79%	0.785	S	S	*	*			trans	-68.7	178	176.1	0	0	0	0	0	113.3
479	F	29.3	Very low	31.8	Very low	204 Å²	204	150.5 Å²	150.5	90%	0.895	79%	0.787	S	S	*	*				-161.8	179.7	76.9	-106	-81.6	0	0	0	116.6
480	R	28	Very low	32.1	Very low	133 Å²	133	148.9 Å²	148.9	50%	0.502	79%	0.786	S	S	.	*			trans	-122.6	155.7	-169.8	-107.3	-179.1	-180	171.7	4.3	111.3	E357	E357-R480 IonicContact OE1-CZ 2.68Å; E357-R480 IonicContact OE1-NH1 2.77Å; E357-R480 PolarHBondContact OE1-NH1 3.42Å; E357-R480 IonicContact OE1-NH2 3.86Å; E357-R480 IonicContact OE2-CZ 3.56Å; E357-R480 IonicContact OE2-NH1 3.91Å; E357-R480 PolarHBondContact OE2-NH1 3.21Å; E357-R480 IonicContact OE2-NH2 3.44Å; E357-R480 PolarHBondContact OE2-NH2 2.8Å
481	R	30.7	Very low	32.4	Very low	193 Å²	193	142.1 Å²	142.1	73%	0.728	78%	0.777	S	S	*	*			trans	62.4	117.4	147.8	-65.7	172	-177.5	154.6	2.8	120.3
482	K	28.5	Very low	32.9	Very low	202 Å²	202	140.1 Å²	140.1	88%	0.878	77%	0.772	S	S	*	*				19.4	151.2	115.5	-99.6	-159.4	172.9	-168.5	0	120.2
483	P	37.8	Very low	32.9	Very low	98 Å²	98	143.7 Å²	143.7	64%	0.636	77%	0.771	S	S	*	*				-132.6	175.9	-101.8	43.1	-28.9	0	0	0	114.4
484	F	32.9	Very low	32.9	Very low	204 Å²	204	137.3 Å²	137.3	90%	0.895	76%	0.761	S	S	*	*			trans	178.5	162.3	137.8	-91.7	-60	0	0	0	109.3
485	P	38.3	Very low	33	Very low	110 Å²	110	139.9 Å²	139.9	71%	0.714	77%	0.766	S	S	*	*			trans	-106.2	171	-161.4	40.9	-39	0	0	0	116.1
486	I	34.2	Very low	33.3	Very low	179 Å²	179	144 Å²	144	92%	0.918	76%	0.764	S	S	*	*			trans	-162.4	164.3	144.8	-102.7	153.6	0	0	0	109.6
487	A	31.3	Very low	33.5	Very low	92 Å²	92	146.8 Å²	146.8	76%	0.76	77%	0.77	S	S	*	*			trans	-86.3	171.2	-161.4	0	0	0	0	0	116.1
488	P	38.3	Very low	33.7	Very low	118 Å²	118	141.8 Å²	141.8	77%	0.766	76%	0.756	S	S	*	*			trans	-108.7	177.3	-165	42	-35.6	0	0	0	115.4
489	L	31.6	Very low	34.4	Very low	171 Å²	171	143.9 Å²	143.9	90%	0.895	76%	0.762	S	S	*	*			trans	179.7	163.8	139.2	-90.8	158.7	0	0	0	109.9
490	P	34.3	Very low	34.7	Very low	101 Å²	101	137.5 Å²	137.5	66%	0.656	75%	0.754	S	S	*	*			trans	-138.7	164.5	-146.8	43.3	-26.5	0	0	0	120
491	S	34.4	Very low	35	Very low	108 Å²	108	139.3 Å²	139.3	76%	0.755	77%	0.766	S	S	*	*			trans	71.3	176	157.9	-7.1	0	0	0	0	118
492	P	39.1	Very low	35.3	Very low	109 Å²	109	138.9 Å²	138.9	71%	0.708	77%	0.765	S	S	*	*			cis	-139.1	174.6	-18.3	36.4	-17.3	0	0	0	117.4
493	L	33.4	Very low	35.6	Very low	156 Å²	156	136.3 Å²	136.3	82%	0.817	76%	0.757	S	S	*	*			trans	77.9	150	139.7	-86.6	166.9	0	0	0	125.9
494	C	29.5	Very low	35.4	Very low	98 Å²	98	136.9 Å²	136.9	66%	0.662	75%	0.754	S	S	*	*			trans	74.7	145.3	155.6	-75.5	0	0	0	0	119.6
495	K	35.1	Very low	35.6	Very low	206 Å²	206	131 Å²	131	90%	0.896	74%	0.739	S	S	*	*			cis	-154.1	-169	13.5	-122.5	156.1	-167	175.1	0	113.5
496	R	36.6	Very low	35.4	Very low	200 Å²	200	135.5 Å²	135.5	76%	0.755	74%	0.741	S	S	*	*			trans	-115.7	170.9	-162.7	-144.8	-166.8	-165.1	166	3.4	114.1
497	P	36.3	Very low	35.4	Very low	125 Å²	125	137 Å²	137	81%	0.812	74%	0.741	S	S	*	*				-138.3	-175.7	115.5	24.4	-3.5	0	0	0	116.2
498	T	37.7	Very low	35.3	Very low	90 Å²	90	138 Å²	138	55%	0.552	74%	0.742	S	S	*	*			trans	-165.3	-169.4	-155	10.2	0	0	0	0	110.1
499	P	44.4	Very low	35.4	Very low	124 Å²	124	138.1 Å²	138.1	81%	0.805	74%	0.743	S	S	*	*			cis	-139	-175.3	-34	37.4	-19.2	0	0	0	115
500	G	36.2	Very low	35.6	Very low	71 Å²	71	136.9 Å²	136.9	73%	0.732	74%	0.743	S	S	*	*			trans	126.1	154.9	140.1	0	0	0	0	0	118.1
501	K	34.5	Very low	35.5	Very low	170 Å²	170	140.5 Å²	140.5	74%	0.739	75%	0.751	S	S	*	*			cis	-167.7	175.9	-15	-138	-164.9	179.1	-157.3	0	111.7
502	Y	37.2	Very low	35.5	Very low	184 Å²	184	140.4 Å²	140.4	72%	0.722	75%	0.748	S	S	*	*			trans	74.6	133.4	-180	-73.2	-93.3	0	0	0	116.4
503	E	35.7	Very low	35.1	Very low	148 Å²	148	143 Å²	143	69%	0.692	76%	0.755	S	S	*	*			cis	113.1	147.4	14.5	-84.2	-170.3	-176.3	0	0	112.7
504	D	33.5	Very low	34.7	Very low	111 Å²	111	139.8 Å²	139.8	59%	0.594	75%	0.751	S	S	*	*			cis	-162.5	173.6	-13.1	-179.5	39.1	0	0	0	110.6	R506	D504-R506 IonicContact OD2-NE 2.86Å; D504-R506 IonicContact OD2-NH2 2.78Å
505	S	36.5	Very low	34.9	Very low	80 Å²	80	141.6 Å²	141.6	56%	0.559	76%	0.759	S	S	*	*			trans	102	90.5	139.6	-98.7	0	0	0	0	123.6
506	R	33.3	Very low	34.7	Very low	204 Å²	204	137.8 Å²	137.8	77%	0.77	75%	0.753	S	S	*	*				49.8	131.4	115.4	-56	163.4	-154.7	-149.8	5.5	121.3	D504	D504-R506 IonicContact OD2-NE 2.86Å; D504-R506 IonicContact OD2-NH2 2.78Å
507	K	34.1	Very low	34.5	Very low	211 Å²	211	133.9 Å²	133.9	92%	0.917	76%	0.756	S	S	*	*				-174.9	171.7	103.1	-99.6	171.7	-174.6	178	0	114.7
508	S	30	Very low	34.4	Very low	112 Å²	112	132.6 Å²	132.6	78%	0.783	75%	0.75	S	S	*	*			trans	-107.7	175.6	-157.3	49.6	0	0	0	0	115.3
509	P	40.6	Very low	34.1	Very low	122 Å²	122	136.2 Å²	136.2	79%	0.792	77%	0.766	S	S	*	*			trans	-109.7	175.5	-160	42.4	-36.3	0	0	0	116.9
510	T	35	Very low	33.4	Very low	144 Å²	144	133.6 Å²	133.6	88%	0.883	76%	0.762	S	S	*	*			trans	-149	153.4	165.9	-46.2	0	0	0	0	111.3
511	E	33.3	Very low	33	Very low	178 Å²	178	138.5 Å²	138.5	83%	0.832	77%	0.771	S	S	*	*			trans	-91.2	-159.2	177.1	-47.1	-173	119	0	0	112.3
512	P	34.7	Very low	32.5	Very low	106 Å²	106	135.8 Å²	135.8	69%	0.688	77%	0.77	S	S	*	*			cis	-142.3	-164.2	-5	34.1	-8.4	0	0	0	117.2
513	L	29.6	Very low	32	Very low	162 Å²	162	133.2 Å²	133.2	85%	0.848	77%	0.774	S	S	*	*			trans	97.1	84.4	155.2	-70.4	152.1	0	0	0	121.8
514	A	26.2	Very low	31.6	Very low	89 Å²	89	134 Å²	134	74%	0.736	78%	0.782	S	S	*	*			trans	1.2	147.2	143	0	0	0	0	0	124
515	T	32.1	Very low	31.2	Very low	137 Å²	137	133.9 Å²	133.9	84%	0.84	79%	0.785	S	S	*	*				-166.3	114.6	116.8	12.5	0	0	0	0	115.4
516	V	30.6	Very low	30.8	Very low	125 Å²	125	135.9 Å²	135.9	76%	0.758	79%	0.794	S	S	*	*			trans	52.4	112.7	139.7	-175.1	0	0	0	0	122.6
517	S	32.6	Very low	30.5	Very low	118 Å²	118	131.9 Å²	131.9	83%	0.825	80%	0.798	S	S	*	*			trans	52.4	146.9	141.4	-54.3	0	0	0	0	122.3
518	S	34.5	Very low	30.3	Very low	99 Å²	99	125.7 Å²	125.7	69%	0.692	79%	0.793	S	S	*	*			cis	-145.6	145.9	22	52.9	0	0	0	0	114.6
519	D	32.5	Very low	30.2	Very low	165 Å²	165	125.7 Å²	125.7	88%	0.882	79%	0.794	S	S	*	*			trans	46.1	133.5	157.2	-50.7	-19	0	0	0	120.9
520	G	29.1	Very low	29.6	Very low	70 Å²	70	125.2 Å²	125.2	72%	0.722	79%	0.793	S	S	*	*			cis	-179.7	84	1	0	0	0	0	0	114.6
521	L	27.2	Very low	29.2	Very low	174 Å²	174	129.7 Å²	129.7	91%	0.911	80%	0.795	S	S	*	*			trans	57.4	111.6	157.5	-72.1	165.5	0	0	0	121.3
522	P	25.1	Very low	29	Very low	113 Å²	113	126.9 Å²	126.9	73%	0.734	80%	0.795	S	S	*	*			trans	-106.3	143.2	155.6	36.2	-28.7	0	0	0	114.2
523	T	26.2	Very low	28.7	Very low	130 Å²	130	125.7 Å²	125.7	80%	0.798	80%	0.802	S	S	*	*			trans	64.1	122.8	151.9	-46.9	0	0	0	0	121.2
524	L	26.2	Very low	28.6	Very low	163 Å²	163	122 Å²	122	85%	0.853	80%	0.803	S	S	*	*			trans	-149.8	108.7	139.1	-99	-177.5	0	0	0	112.8
525	V	25.9	Very low	28.7	Very low	110 Å²	110	121.4 Å²	121.4	67%	0.667	80%	0.798	S	S	*	*			trans	42.2	123.4	132.9	-172.1	0	0	0	0	118
526	T	28.2	Very low	28.6	Very low	122 Å²	122	121.2 Å²	121.2	75%	0.748	80%	0.799	S	S	*	*				-161.5	128.6	70.2	-43.8	0	0	0	0	115.4
527	S	27.9	Very low	28.7	Very low	120 Å²	120	119.9 Å²	119.9	84%	0.839	79%	0.791	S	S	*	*			trans	20.2	127.5	152.4	-49.1	0	0	0	0	123.3
528	G	28.5	Very low	28.7	Very low	80 Å²	80	121.3 Å²	121.3	83%	0.825	79%	0.785	S	S	*	*			trans	-163.2	16	177.4	0	0	0	0	0	121.7
529	S	28.7	Very low	28.8	Very low	113 Å²	113	123.1 Å²	123.1	79%	0.79	78%	0.776	S	S	*	*			trans	58.8	82.4	167.9	-173.5	0	0	0	0	120.1
530	S	27.4	Very low	29	Very low	111 Å²	111	118 Å²	118	78%	0.776	75%	0.751	S	S	*	*				44.1	99.2	129.8	-51.2	0	0	0	0	121.9
531	Y	27.3	Very low	29.3	Very low	239 Å²	239	115.9 Å²	115.9	94%	0.937	72%	0.723	S	S	*	*				-157.4	132.2	123.1	-133.7	-93.9	0	0	0	109.7
532	S	27.8	Very low	29.5	Very low	119 Å²	119	111 Å²	111	83%	0.832	70%	0.701	S	S	*	*			trans	-123.3	136.4	-175.4	46.7	0	0	0	0	111.6
533	G	29.8	Very low	30.1	Very low	80 Å²	80	108.7 Å²	108.7	83%	0.825	70%	0.699	S	S	*	*			trans	161	48.4	-175.2	0	0	0	0	0	114.2	A535	G533-A535 PolarHBondContact O-N 3.36Å
534	G	26.5	Very low	30.7	Very low	84 Å²	84	104.3 Å²	104.3	87%	0.866	67%	0.671	S	S	*	*			trans	-82.5	110.4	177.3	0	0	0	0	0	111.9
535	A	29	Very low	31.1	Very low	78 Å²	78	100.1 Å²	100.1	65%	0.645	67%	0.668	S	S	*	*			trans	-91.2	143	166.1	0	0	0	0	0	110.2	G533 V537	G533-A535 PolarHBondContact O-N 3.36Å; A535-V537 WeakPolarHBondContact O-CG2 3.39Å; A535-V537 PolarHBondContact O-N 3.21Å
536	P	29.2	Very low	31.5	Very low	132 Å²	132	99.8 Å²	99.8	86%	0.857	67%	0.666	S	S	*	*			trans	-66.4	128.4	176.1	-18.4	31.9	0	0	0	111.1
537	V	34.2	Very low	32	Very low	97 Å²	97	94.9 Å²	94.9	59%	0.588	64%	0.637	S	S	*	*			trans	-118.3	74.7	-178.9	-172	0	0	0	0	110.1	A535 R539	A535-V537 WeakPolarHBondContact O-CG2 3.39Å; A535-V537 PolarHBondContact O-N 3.21Å; V537-R539 HydrophobicContact CG1-CG 3.71Å; V537-R539 PolarHBondContact O-N 3.4Å; V537-R539 VanDerWaalsContact O-N 3.14Å
538	H	31.3	Very low	32.6	Very low	149 Å²	149	92.5 Å²	92.5	69%	0.69	62%	0.615	S	S	*	*			trans	-65.8	105.5	163.8	-108.7	-139.4	0	0	0	108.9	V540 D548	H538-V540 PolarHBondContact O-N 3.16Å; H538-D548 IonicContact CE1-OD1 3.47Å; H538-D548 PolarHBondContact CE1-OD1 2.82Å; H538-D548 IonicContact CE1-OD2 2.71Å; H538-D548 IonicContact CG-OD2 3.12Å; H538-D548 IonicContact ND1-OD1 3.38Å; H538-D548 PolarHBondContact ND1-OD1 3.41Å; H538-D548 IonicContact ND1-OD2 2.82Å; H538-D548 PolarHBondContact ND1-OD2 2.61Å
539	R	37.2	Very low	33.4	Very low	136 Å²	136	96.9 Å²	96.9	51%	0.513	61%	0.613	S	S	.	*			trans	-89.7	86.5	-177.9	-68.3	-176.7	178.9	148.4	5	110.6	V537 I541 V1236 H1239	V537-R539 HydrophobicContact CG1-CG 3.71Å; V537-R539 PolarHBondContact O-N 3.4Å; V537-R539 VanDerWaalsContact O-N 3.14Å; R539-I541 PolarHBondContact O-N 3.13Å; R539-I541 VanDerWaalsContact O-N 3.13Å; R539-V1236 PolarHBondContact NH1-O 3.31Å; R539-H1239 PolarHBondContact NH1-NE2 3.39Å
540	V	35.7	Very low	34.3	Very low	57 Å²	57	101.3 Å²	101.3	35%	0.345	61%	0.614	S	S	.	*			trans	-58.3	116.3	164.8	179.5	0	0	0	0	108.7	H538	H538-V540 PolarHBondContact O-N 3.16Å
541	I	35.9	Very low	35.4	Very low	26 Å²	26	100.3 Å²	100.3	13%	0.133	60%	0.597	C	S	.	*			trans	-85.7	135.4	-178.9	-72.2	138.1	0	0	0	109.5	R539 G543 T544 C1218 T1220	R539-I541 PolarHBondContact O-N 3.13Å; R539-I541 VanDerWaalsContact O-N 3.13Å; I541-G543 PolarHBondContact O-N 3.47Å; I541-T544 HydrophobicContact CB-CG2 3.77Å; I541-T544 HydrophobicContact CD1-CG2 4.25Å; I541-T544 HydrophobicContact CG2-CG2 3.68Å; I541-T544 PolarHBondContact O-N 3.16Å; I541-T544 PolarHBondContact O-OG1 2.9Å; I541-C1218 HydrophobicContact CD1-CB 3.68Å; I541-T1220 WeakPolarHBondContact CD1-OG1 3.31Å; I541-T1220 HydrophobicContact CG2-CG2 4.04Å; I541-T1220 WeakPolarHBondContact CG2-OG1 3.31Å
542	P	31.8	Very low	36.5	Very low	71 Å²	71	92.4 Å²	92.4	46%	0.461	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.2	93.9	174.6	-20.1	33.4	0	0	0	111.5	G689	P542-G689 WeakPolarHBondContact CG-O 3.19Å
543	G	36.7	Very low	37.6	Very low	66 Å²	66	94.3 Å²	94.3	68%	0.68	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	122.5	5.4	174.3	0	0	0	0	0	116.9	I541	I541-G543 PolarHBondContact O-N 3.47Å
544	T	39.6	Very low	39.3	Very low	37 Å²	37	95 Å²	95	23%	0.227	55%	0.546	C	S	.	.	S	Bend	trans	-90.1	-12.1	179.3	48.6	0	0	0	0	115.3	I541 V546	I541-T544 HydrophobicContact CB-CG2 3.77Å; I541-T544 HydrophobicContact CD1-CG2 4.25Å; I541-T544 HydrophobicContact CG2-CG2 3.68Å; I541-T544 PolarHBondContact O-N 3.16Å; I541-T544 PolarHBondContact O-OG1 2.9Å; T544-V546 PolarHBondContact O-N 2.91Å; T544-V546 VanDerWaalsContact O-N 3.17Å
545	G	34.4	Very low	41.5	Very low	76 Å²	76	93.8 Å²	93.8	78%	0.784	52%	0.524	S	S	*	.			trans	68.9	7.1	179.7	0	0	0	0	0	115.3
546	V	33.8	Very low	43.7	Very low	102 Å²	102	91 Å²	91	62%	0.618	50%	0.498	S	S	*	.			trans	-99.9	84.1	174.6	-171.3	0	0	0	0	108.6	T544	T544-V546 PolarHBondContact O-N 2.91Å; T544-V546 VanDerWaalsContact O-N 3.17Å
547	S	39.6	Very low	46	Very low	20 Å²	20	92 Å²	92	14%	0.14	49%	0.492	C	S	.	.			trans	-71.6	146.6	153.6	-25.6	0	0	0	0	107.8	H549 D552 Q636	S547-H549 PolarHBondContact O-N 3.32Å; S547-D552 WeakPolarHBondContact CB-OD2 3.35Å; S547-D552 VanDerWaalsContact OG-CG 3.28Å; S547-D552 PolarHBondContact OG-OD1 3.41Å; S547-D552 PolarHBondContact OG-OD2 3.29Å; S547-Q636 PolarHBondContact OG-NE2 3.27Å; S547-Q636 VanDerWaalsContact OG-NE2 3.08Å
548	D	40.4	Very low	48	Very low	70 Å²	70	91.3 Å²	91.3	37%	0.374	48%	0.482	S	S	.	.			trans	-65.6	130.1	162.1	-71.6	-54.7	0	0	0	107.7	H538 Y550 E551	H538-D548 IonicContact CE1-OD1 3.47Å; H538-D548 PolarHBondContact CE1-OD1 2.82Å; H538-D548 IonicContact CE1-OD2 2.71Å; H538-D548 IonicContact CG-OD2 3.12Å; H538-D548 IonicContact ND1-OD1 3.38Å; H538-D548 PolarHBondContact ND1-OD1 3.41Å; H538-D548 IonicContact ND1-OD2 2.82Å; H538-D548 PolarHBondContact ND1-OD2 2.61Å; D548-Y550 PolarHBondContact O-N 2.89Å; D548-E551 PolarHBondContact O-N 3.19Å
549	H	44.6	Very low	50.2	Low	172 Å²	172	84.2 Å²	84.2	80%	0.796	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-11.3	-158.5	-138	-34.8	0	0	0	115.6	S547	S547-H549 PolarHBondContact O-N 3.32Å
550	Y	47.9	Very low	52.1	Low	206 Å²	206	79 Å²	79	81%	0.808	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-23.4	175	-92.8	-97.6	0	0	0	114.8	D548	D548-Y550 PolarHBondContact O-N 2.89Å
551	E	50.2	Low	53.9	Low	90 Å²	90	80.3 Å²	80.3	42%	0.421	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-74.2	-33.8	-178.8	-72.3	-150.8	144.4	0	0	112.8	D548 M553	D548-E551 PolarHBondContact O-N 3.19Å; E551-M553 PolarHBondContact O-N 3.33Å
552	D	51.2	Low	55.6	Low	72 Å²	72	82.2 Å²	82.2	39%	0.385	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-75.3	-5.9	179.5	-70.3	-33.1	0	0	0	113.3	S547 Q636	S547-D552 WeakPolarHBondContact CB-OD2 3.35Å; S547-D552 VanDerWaalsContact OG-CG 3.28Å; S547-D552 PolarHBondContact OG-OD1 3.41Å; S547-D552 PolarHBondContact OG-OD2 3.29Å; D552-Q636 PolarHBondContact OD1-NE2 2.94Å
553	M	51.2	Low	57.3	Low	159 Å²	159	79.8 Å²	79.8	78%	0.783	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-83.4	-13.4	177.3	-72	-73.6	-69.2	0	0	113.8	E551	E551-M553 PolarHBondContact O-N 3.33Å
554	R	64.4	Low	58.7	Low	95 Å²	95	78.7 Å²	78.7	36%	0.358	43%	0.426	S	S	.	.	S	Bend	trans	-82.5	143	-175.5	-66.9	-168.7	162.9	161.6	4.8	112.6	E558 V559	R554-E558 WeakPolarHBondContact CA-OE2 3.17Å; R554-E558 VanDerWaalsContact CB-OE2 3.3Å; R554-E558 WeakPolarHBondContact CB-OE2 3.41Å; R554-E558 WeakPolarHBondContact CD-OE1 3.39Å; R554-E558 WeakPolarHBondContact CG-OE1 3.42Å; R554-E558 WeakPolarHBondContact CG-OE2 3.3Å; R554-E558 IonicContact CZ-OE1 3.4Å; R554-E558 IonicContact NE-OE1 3.33Å; R554-E558 PolarHBondContact NE-OE1 3.21Å; R554-V559 HydrophobicContact CB-CG2 3.84Å
555	S	74	Confident	59.8	Low	58 Å²	58	84 Å²	84	41%	0.406	45%	0.452	S	S	.	.			trans	-73.2	155.3	175.5	86.6	0	0	0	0	111.6	E557 E558 V559	S555-E557 PolarHBondContact O-N 2.78Å; S555-E557 PolarHBondContact OG-N 3.4Å; S555-E558 PolarHBondContact N-OE2 3.18Å; S555-E558 PolarHBondContact O-N 3.03Å; S555-E558 WeakPolarHBondContact OG-CB 3.45Å; S555-E558 PolarHBondContact OG-N 3.45Å; S555-V559 PolarHBondContact O-N 3.21Å
556	L	74.8	Confident	61.1	Low	19 Å²	19	81.5 Å²	81.5	10%	0.099	43%	0.426	C	S	.	.	H	α-helix	trans	-59.9	-30.5	174.1	-174.9	65.8	0	0	0	111.6	S560 M631 R634 I635 V638	L556-S560 VanDerWaalsContact O-CB 3.31Å; L556-S560 WeakPolarHBondContact O-CB 3.31Å; L556-S560 PolarHBondContact O-N 2.98Å; L556-M631 HydrophobicContact CB-CE 3.68Å; L556-M631 HydrophobicContact CD2-CE 3.68Å; L556-M631 HydrophobicContact CD2-SD 3.97Å; L556-M631 HydrophobicContact CG-CE 4.32Å; L556-R634 HydrophobicContact CD1-CB 4.02Å; L556-R634 HydrophobicContact CD2-CB 4.45Å; L556-I635 HydrophobicContact CB-CG1 4.05Å; L556-I635 HydrophobicContact CD1-CG1 4.05Å; L556-V638 HydrophobicContact CD1-CB 4.4Å; L556-V638 HydrophobicContact CD1-CG2 3.83Å
557	E	76.3	Confident	62.6	Low	155 Å²	155	79.5 Å²	79.5	72%	0.724	41%	0.407	S	S	*	.	H	α-helix	trans	-72.7	-46.8	177.4	-172.8	167.7	-158.8	0	0	111.7	S555 V559 S560 A561	S555-E557 PolarHBondContact O-N 2.78Å; S555-E557 PolarHBondContact OG-N 3.4Å; E557-V559 VanDerWaalsContact C-N 3.28Å; E557-V559 PolarHBondContact O-N 3.48Å; E557-S560 WeakPolarHBondContact CA-OG 3.37Å; E557-S560 WeakPolarHBondContact O-CA 3.33Å; E557-S560 WeakPolarHBondContact O-CB 3.15Å; E557-S560 PolarHBondContact O-N 3.13Å; E557-S560 PolarHBondContact O-OG 3.42Å; E557-A561 PolarHBondContact O-N 2.95Å
558	E	77.1	Confident	63.9	Low	81 Å²	81	78.6 Å²	78.6	38%	0.379	40%	0.402	S	S	.	.	H	α-helix	trans	-57.8	-41.2	174.1	-172.9	-160.3	155.8	0	0	111.6	R554 S555 Q562	R554-E558 WeakPolarHBondContact CA-OE2 3.17Å; R554-E558 VanDerWaalsContact CB-OE2 3.3Å; R554-E558 WeakPolarHBondContact CB-OE2 3.41Å; R554-E558 WeakPolarHBondContact CD-OE1 3.39Å; R554-E558 WeakPolarHBondContact CG-OE1 3.42Å; R554-E558 WeakPolarHBondContact CG-OE2 3.3Å; R554-E558 IonicContact CZ-OE1 3.4Å; R554-E558 IonicContact NE-OE1 3.33Å; R554-E558 PolarHBondContact NE-OE1 3.21Å; S555-E558 PolarHBondContact N-OE2 3.18Å; S555-E558 PolarHBondContact O-N 3.03Å; S555-E558 WeakPolarHBondContact OG-CB 3.45Å; S555-E558 PolarHBondContact OG-N 3.45Å; E558-Q562 PolarHBondContact O-NE2 3.36Å
559	V	77	Confident	65.4	Low	0 Å²	0	75.3 Å²	75.3	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-70.8	-33.2	174.9	163.8	0	0	0	0	111.8	R554 S555 E557 Q562 I635 V638 N639 N642	R554-V559 HydrophobicContact CB-CG2 3.84Å; S555-V559 PolarHBondContact O-N 3.21Å; E557-V559 VanDerWaalsContact C-N 3.28Å; E557-V559 PolarHBondContact O-N 3.48Å; V559-Q562 PolarHBondContact O-N 3.48Å; V559-I635 HydrophobicContact CG2-CG2 4.07Å; V559-V638 HydrophobicContact CG1-CB 3.71Å; V559-V638 HydrophobicContact CG1-CG1 3.6Å; V559-N639 HydrophobicContact CG1-CB 4.46Å; V559-N639 WeakPolarHBondContact CG1-OD1 3.44Å; V559-N639 WeakPolarHBondContact CG2-OD1 3.5Å; V559-N642 PolarHBondContact O-ND2 3.29Å
560	S	76.5	Confident	66.7	Low	26 Å²	26	67.3 Å²	67.3	18%	0.182	35%	0.347	C	S	.	.	H	α-helix	trans	-69.1	-35	174.5	79.5	0	0	0	0	113.1	L556 E557 Q562 A563 F617	L556-S560 VanDerWaalsContact O-CB 3.31Å; L556-S560 WeakPolarHBondContact O-CB 3.31Å; L556-S560 PolarHBondContact O-N 2.98Å; E557-S560 WeakPolarHBondContact CA-OG 3.37Å; E557-S560 WeakPolarHBondContact O-CA 3.33Å; E557-S560 WeakPolarHBondContact O-CB 3.15Å; E557-S560 PolarHBondContact O-N 3.13Å; E557-S560 PolarHBondContact O-OG 3.42Å; S560-Q562 PolarHBondContact O-N 2.93Å; S560-Q562 VanDerWaalsContact O-N 3.16Å; S560-A563 WeakPolarHBondContact O-CB 3.21Å; S560-A563 PolarHBondContact O-N 2.94Å; S560-F617 VanDerWaalsContact CB-CE2 3.46Å
561	A	73.8	Confident	67.7	Low	86 Å²	86	57.7 Å²	57.7	71%	0.711	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-17.6	176.8	0	0	0	0	0	113.1	E557	E557-A561 PolarHBondContact O-N 2.95Å
562	Q	72	Confident	68.2	Low	65 Å²	65	55.3 Å²	55.3	30%	0.304	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	5	176.5	-62.6	173.5	41.2	0	0	113.4	E558 V559 S560 R646	E558-Q562 PolarHBondContact O-NE2 3.36Å; V559-Q562 PolarHBondContact O-N 3.48Å; S560-Q562 PolarHBondContact O-N 2.93Å; S560-Q562 VanDerWaalsContact O-N 3.16Å; Q562-R646 PolarHBondContact O-NH2 2.9Å
563	A	67.7	Low	68.9	Low	21 Å²	21	53.5 Å²	53.5	17%	0.174	29%	0.292	C	S	.	.	S	Bend	trans	-73.3	126.9	176.9	0	0	0	0	0	111.6	S560 I565 N642	S560-A563 WeakPolarHBondContact O-CB 3.21Å; S560-A563 PolarHBondContact O-N 2.94Å; A563-I565 PolarHBondContact O-N 3.02Å; A563-I565 VanDerWaalsContact O-N 3.13Å; A563-N642 VanDerWaalsContact CA-OD1 3.28Å; A563-N642 WeakPolarHBondContact CA-OD1 3.43Å; A563-N642 WeakPolarHBondContact CB-OD1 3.03Å
564	P	66.7	Low	69.5	Low	43 Å²	43	49.1 Å²	49.1	28%	0.279	27%	0.272	S	S	.	.			trans	-59	117.5	178.7	-28.2	37.2	0	0	0	112.8	G566 A645 R646	P564-G566 PolarHBondContact O-N 3.41Å; P564-A645 HydrophobicContact CB-CB 4.16Å; P564-A645 HydrophobicContact CG-CB 3.72Å; P564-R646 HydrophobicContact CG-CG 4.04Å
565	I	61.6	Low	69.1	Low	148 Å²	148	54.6 Å²	54.6	76%	0.759	30%	0.302	S	S	*	.			trans	-72.5	98.9	177.5	-55.7	174.3	0	0	0	108.2	A563	A563-I565 PolarHBondContact O-N 3.02Å; A563-I565 VanDerWaalsContact O-N 3.13Å
566	G	61.2	Low	68.3	Low	24 Å²	24	59.6 Å²	59.6	25%	0.247	32%	0.32	C	S	.	.			trans	179	145.1	172.1	0	0	0	0	0	114.5	P564 G568 G588 A614	P564-G566 PolarHBondContact O-N 3.41Å; G566-G568 VanDerWaalsContact C-N 3.31Å; G566-G588 WeakPolarHBondContact CA-O 3.5Å; G566-A614 WeakPolarHBondContact O-CB 3.39Å
567	R	67.2	Low	67.7	Low	59 Å²	59	60 Å²	60	22%	0.223	33%	0.329	C	S	.	.			trans	-88.7	6.7	176.2	-74.2	-169.2	172.4	162.8	0.2	113.5	R710 L711 D714	R567-R710 CarbonylContact O-C 3.57Å; R567-R710 WeakPolarHBondContact O-CA 3.21Å; R567-L711 HydrophobicContact CB-CB 4.19Å; R567-L711 HydrophobicContact CG-CB 4.4Å; R567-L711 WeakPolarHBondContact O-CB 3.4Å; R567-L711 PolarHBondContact O-N 2.81Å; R567-D714 IonicContact CZ-OD2 2.71Å; R567-D714 IonicContact NE-OD2 2.66Å; R567-D714 IonicContact NH2-OD2 3.66Å; R567-D714 PolarHBondContact NH2-OD2 3.25Å
568	G	66.2	Low	67.1	Low	2 Å²	2	55.9 Å²	55.9	2%	0.021	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	71.1	-159.4	175.4	0	0	0	0	0	113.2	G566 A587	G566-G568 VanDerWaalsContact C-N 3.31Å; G568-A587 PolarHBondContact N-O 2.8Å; G568-A587 VanDerWaalsContact N-O 3.08Å
569	G	71.8	Confident	66.5	Low	0 Å²	0	54.2 Å²	54.2	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	134.4	-173.7	-178.5	0	0	0	0	0	113.8	V611 Q612 Y709	G569-V611 WeakPolarHBondContact O-CA 3.39Å; G569-Q612 PolarHBondContact O-N 3.03Å; G569-Y709 WeakPolarHBondContact CA-O 3.42Å; G569-Y709 PolarHBondContact N-O 2.68Å
570	I	71.6	Confident	65.8	Low	4 Å²	4	58 Å²	58	2%	0.021	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	120.6	175.6	-51.4	-177.6	0	0	0	110.3	P572 F602 P604 Q609 M651 Y709	I570-P572 WeakPolarHBondContact O-CD 3.28Å; I570-F602 WeakPolarHBondContact CD1-O 3.3Å; I570-P604 HydrophobicContact CD1-CB 4.03Å; I570-P604 HydrophobicContact CD1-CG 3.64Å; I570-Q609 HydrophobicContact CG2-CB 3.88Å; I570-Q609 HydrophobicContact CG2-CG 3.83Å; I570-M651 HydrophobicContact CD1-CE 4.23Å; I570-M651 HydrophobicContact CG1-CE 4.4Å; I570-Y709 HydrophobicContact CD1-CD2 3.84Å; I570-Y709 HydrophobicContact CG1-CD2 3.99Å; I570-Y709 HydrophobicContact CG1-CG 4.25Å
571	V	68.9	Low	65.1	Low	5 Å²	5	61.5 Å²	61.5	3%	0.03	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	104.2	169.3	-178.2	0	0	0	0	108.5	P579 A583 V584 A587 R610	V571-P579 HydrophobicContact CG1-CB 3.49Å; V571-P579 VanDerWaalsContact CG1-CB 3.49Å; V571-A583 HydrophobicContact CG1-CB 4.46Å; V571-V584 HydrophobicContact CG1-CG2 3.78Å; V571-A587 HydrophobicContact CG2-CB 4.11Å; V571-R610 HydrophobicContact CB-CB 4.35Å; V571-R610 PolarHBondContact N-O 2.92Å; V571-R610 PolarHBondContact O-N 3.07Å
572	P	62	Low	64.3	Low	39 Å²	39	61 Å²	61	25%	0.253	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	153.3	168.6	24.8	-35.4	0	0	0	112.1	I570 I580 A583	I570-P572 WeakPolarHBondContact O-CD 3.28Å; P572-I580 HydrophobicContact CB-CD1 4.1Å; P572-I580 HydrophobicContact CG-CD1 4.14Å; P572-I580 PolarHBondContact O-N 3.02Å; P572-A583 HydrophobicContact CG-CB 3.87Å
573	L	64.1	Low	63.6	Low	34 Å²	34	58.4 Å²	58.4	18%	0.178	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-108.8	153.6	-178.8	-53.4	-177.3	0	0	0	111	N578 P579 R608 R610	L573-N578 CarbonylContact C-O 3.47Å; L573-N578 WeakPolarHBondContact CA-O 3.19Å; L573-P579 HydrophobicContact CD2-CB 4.31Å; L573-R608 HydrophobicContact CD1-CG 4.18Å; L573-R610 HydrophobicContact CD1-CG 4.39Å; L573-R610 HydrophobicContact CD2-CB 4.38Å; L573-R610 HydrophobicContact CD2-CG 3.83Å
574	D	63.9	Low	63.3	Low	67 Å²	67	60.6 Å²	60.6	36%	0.358	34%	0.344	S	S	.	.			trans	-75.1	176.1	164.6	70.2	12.9	0	0	0	111.6	M576 G577 N578	D574-M576 PolarHBondContact O-N 2.86Å; D574-M576 VanDerWaalsContact OD1-C 3.29Å; D574-M576 WeakPolarHBondContact OD1-CA 3.48Å; D574-M576 WeakPolarHBondContact OD1-CB 3.17Å; D574-M576 PolarHBondContact OD1-N 3.47Å; D574-G577 PolarHBondContact O-N 3.37Å; D574-G577 PolarHBondContact OD1-N 3.17Å; D574-N578 PolarHBondContact N-O 2.79Å; D574-N578 PolarHBondContact OD1-N 3.18Å; D574-N578 PolarHBondContact OD1-ND2 3.06Å; D574-N578 WeakPolarHBondContact OD2-CB 3.39Å; D574-N578 PolarHBondContact OD2-ND2 3.25Å
575	E	57.4	Low	62.9	Low	211 Å²	211	62.2 Å²	62.2	99%	0.986	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-16.6	179.4	-58	-170.3	147.4	0	0	113.4
576	M	57.6	Low	62.7	Low	163 Å²	163	56.5 Å²	56.5	80%	0.803	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-6.3	175.5	-61.6	172.8	68.2	0	0	112.5	D574 N578	D574-M576 PolarHBondContact O-N 2.86Å; D574-M576 VanDerWaalsContact OD1-C 3.29Å; D574-M576 WeakPolarHBondContact OD1-CA 3.48Å; D574-M576 WeakPolarHBondContact OD1-CB 3.17Å; D574-M576 PolarHBondContact OD1-N 3.47Å; M576-N578 WeakPolarHBondContact CB-ND2 3.34Å
577	G	61.4	Low	62.5	Low	26 Å²	26	55.6 Å²	55.6	27%	0.268	32%	0.318	S	S	.	.	S	Bend	trans	86.6	7.2	-179.1	0	0	0	0	0	115.2	D574 R610	D574-G577 PolarHBondContact O-N 3.37Å; D574-G577 PolarHBondContact OD1-N 3.17Å; G577-R610 PolarHBondContact O-NH2 2.9Å
578	N	64.1	Low	62	Low	70 Å²	70	54.2 Å²	54.2	37%	0.374	32%	0.322	S	S	.	.			trans	-78.1	149.9	173.7	-47.4	-63.2	0	0	0	110.4	L573 D574 M576	L573-N578 CarbonylContact C-O 3.47Å; L573-N578 WeakPolarHBondContact CA-O 3.19Å; D574-N578 PolarHBondContact N-O 2.79Å; D574-N578 PolarHBondContact OD1-N 3.18Å; D574-N578 PolarHBondContact OD1-ND2 3.06Å; D574-N578 WeakPolarHBondContact OD2-CB 3.39Å; D574-N578 PolarHBondContact OD2-ND2 3.25Å; M576-N578 WeakPolarHBondContact CB-ND2 3.34Å
579	P	62.9	Low	61.3	Low	46 Å²	46	59.1 Å²	59.1	30%	0.299	34%	0.344	S	S	.	.	B	Isolated β-bridge	trans	-68.7	135.9	173.6	30.3	-34.8	0	0	0	111.7	V571 L573 V581 V584	V571-P579 HydrophobicContact CG1-CB 3.49Å; V571-P579 VanDerWaalsContact CG1-CB 3.49Å; L573-P579 HydrophobicContact CD2-CB 4.31Å; P579-V581 PolarHBondContact O-N 2.89Å; P579-V581 VanDerWaalsContact O-N 3.12Å; P579-V584 HydrophobicContact CB-CG2 3.64Å; P579-V584 HydrophobicContact CG-CG2 4.13Å
580	I	63.1	Low	60.5	Low	78 Å²	78	63 Å²	63	40%	0.4	37%	0.369	S	S	.	.			trans	-66.7	112.4	171.2	-62.1	178.7	0	0	0	108	P572 A582 A583 V584	P572-I580 HydrophobicContact CB-CD1 4.1Å; P572-I580 HydrophobicContact CG-CD1 4.14Å; P572-I580 PolarHBondContact O-N 3.02Å; I580-A582 VanDerWaalsContact C-N 3.29Å; I580-A582 PolarHBondContact O-N 2.79Å; I580-A583 HydrophobicContact CB-CB 4.47Å; I580-A583 WeakPolarHBondContact O-CA 3.43Å; I580-A583 WeakPolarHBondContact O-CB 3.07Å; I580-A583 PolarHBondContact O-N 2.8Å; I580-V584 PolarHBondContact O-N 2.97Å
581	V	62.3	Low	59.4	Low	101 Å²	101	69.1 Å²	69.1	61%	0.612	40%	0.398	S	S	*	.	H	α-helix	trans	-53.3	-43	-170.3	-178.1	0	0	0	0	112.5	P579 A583 V584 V585	P579-V581 PolarHBondContact O-N 2.89Å; P579-V581 VanDerWaalsContact O-N 3.12Å; V581-A583 PolarHBondContact O-N 2.86Å; V581-V584 WeakPolarHBondContact O-CB 3.44Å; V581-V584 PolarHBondContact O-N 3.38Å; V581-V585 PolarHBondContact O-N 2.96Å
582	A	56.2	Low	57.7	Low	76 Å²	76	74.1 Å²	74.1	63%	0.628	43%	0.429	S	S	*	.	H	α-helix	trans	-57.8	-33.4	176.8	0	0	0	0	0	113.3	I580 A586	I580-A582 VanDerWaalsContact C-N 3.29Å; I580-A582 PolarHBondContact O-N 2.79Å; A582-A586 WeakPolarHBondContact O-CB 3.44Å; A582-A586 PolarHBondContact O-N 3.32Å
583	A	58.7	Low	56.3	Low	9 Å²	9	78.3 Å²	78.3	7%	0.074	46%	0.459	C	S	.	.	H	α-helix	trans	-83.9	-21.5	177.2	0	0	0	0	0	113.6	V571 P572 I580 V581 A587	V571-A583 HydrophobicContact CG1-CB 4.46Å; P572-A583 HydrophobicContact CG-CB 3.87Å; I580-A583 HydrophobicContact CB-CB 4.47Å; I580-A583 WeakPolarHBondContact O-CA 3.43Å; I580-A583 WeakPolarHBondContact O-CB 3.07Å; I580-A583 PolarHBondContact O-N 2.8Å; V581-A583 PolarHBondContact O-N 2.86Å; A583-A587 WeakPolarHBondContact O-CB 3.44Å; A583-A587 PolarHBondContact O-N 2.85Å; A583-A587 VanDerWaalsContact O-N 3.14Å
584	V	59.8	Low	54.8	Low	68 Å²	68	82.3 Å²	82.3	41%	0.412	49%	0.485	S	S	.	.	H	α-helix	trans	-65.1	-50.8	165.6	-177.4	0	0	0	0	109.1	V571 P579 I580 V581 A586 A587 G588	V571-V584 HydrophobicContact CG1-CG2 3.78Å; P579-V584 HydrophobicContact CB-CG2 3.64Å; P579-V584 HydrophobicContact CG-CG2 4.13Å; I580-V584 PolarHBondContact O-N 2.97Å; V581-V584 WeakPolarHBondContact O-CB 3.44Å; V581-V584 PolarHBondContact O-N 3.38Å; V584-A586 VanDerWaalsContact C-N 3.34Å; V584-A586 PolarHBondContact O-N 3.16Å; V584-A587 PolarHBondContact O-N 3.2Å; V584-G588 PolarHBondContact O-N 2.74Å
585	V	60.1	Low	53.4	Low	76 Å²	76	88.6 Å²	88.6	46%	0.461	51%	0.505	S	S	.	.	H	α-helix	trans	-57.8	-45.8	177.4	176.5	0	0	0	0	110.9	V581 A587 G588 Q589	V581-V585 PolarHBondContact O-N 2.96Å; V585-A587 PolarHBondContact O-N 3.4Å; V585-G588 PolarHBondContact O-N 3.29Å; V585-G588 VanDerWaalsContact O-N 3.12Å; V585-Q589 HydrophobicContact CG1-CG 4.37Å; V585-Q589 WeakPolarHBondContact O-CG 3.49Å; V585-Q589 PolarHBondContact O-N 2.8Å
586	A	57	Low	52	Low	29 Å²	29	85 Å²	85	24%	0.24	50%	0.503	C	S	.	.	H	α-helix	trans	-74.3	-3.7	178.1	0	0	0	0	0	115.2	A582 V584 F602 R710	A582-A586 WeakPolarHBondContact O-CB 3.44Å; A582-A586 PolarHBondContact O-N 3.32Å; V584-A586 VanDerWaalsContact C-N 3.34Å; V584-A586 PolarHBondContact O-N 3.16Å; A586-F602 HydrophobicContact CB-CE1 4.41Å; A586-F602 HydrophobicContact CB-CZ 3.84Å; A586-R710 PolarHBondContact O-NH2 2.82Å
587	A	56.9	Low	50.7	Low	5 Å²	5	80.2 Å²	80.2	4%	0.041	50%	0.495	C	S	.	.	H	α-helix	trans	-98.7	-24.4	166.6	0	0	0	0	0	112.4	G568 V571 A583 V584 V585	G568-A587 PolarHBondContact N-O 2.8Å; G568-A587 VanDerWaalsContact N-O 3.08Å; V571-A587 HydrophobicContact CG2-CB 4.11Å; A583-A587 WeakPolarHBondContact O-CB 3.44Å; A583-A587 PolarHBondContact O-N 2.85Å; A583-A587 VanDerWaalsContact O-N 3.14Å; V584-A587 PolarHBondContact O-N 3.2Å; V585-A587 PolarHBondContact O-N 3.4Å
588	G	55.4	Low	49.3	Very low	29 Å²	29	82 Å²	82	30%	0.299	51%	0.514	S	S	.	.	H	α-helix	trans	-80.4	-32.6	171.9	0	0	0	0	0	113.9	G566 V584 V585	G566-G588 WeakPolarHBondContact CA-O 3.5Å; V584-G588 PolarHBondContact O-N 2.74Å; V585-G588 PolarHBondContact O-N 3.29Å; V585-G588 VanDerWaalsContact O-N 3.12Å
589	Q	53.3	Low	47.7	Very low	106 Å²	106	86.1 Å²	86.1	50%	0.495	54%	0.542	S	S	.	.	S	Bend	trans	-61.9	130	-177	-81.1	178.4	-28.1	0	0	112.9	V585	V585-Q589 HydrophobicContact CG1-CG 4.37Å; V585-Q589 WeakPolarHBondContact O-CG 3.49Å; V585-Q589 PolarHBondContact O-N 2.8Å
590	P	53.1	Low	46.5	Very low	81 Å²	81	91.2 Å²	91.2	53%	0.526	56%	0.562	S	S	.	*			trans	-67	146.4	165.8	30.1	-33.8	0	0	0	109.6	T592	P590-T592 PolarHBondContact O-N 3.4Å
591	Q	48.5	Very low	45.8	Very low	132 Å²	132	92.6 Å²	92.6	62%	0.617	57%	0.569	S	S	*	*			trans	-74.5	98	-179.3	-70.5	176.2	-65.7	0	0	111
592	T	35	Very low	45.6	Very low	110 Å²	110	89.7 Å²	89.7	68%	0.675	55%	0.548	S	S	*	.			trans	-84.7	139.3	156.9	50	0	0	0	0	109.5	P590 T594	P590-T592 PolarHBondContact O-N 3.4Å; T592-T594 PolarHBondContact O-N 3.06Å
593	S	32.7	Very low	45.9	Very low	127 Å²	127	92.3 Å²	92.3	89%	0.888	55%	0.551	S	S	*	*	S	Bend	trans	-82.3	39.7	-164.1	47.8	0	0	0	0	115.2
594	T	31.7	Very low	46.1	Very low	118 Å²	118	93.2 Å²	93.2	72%	0.724	56%	0.556	S	S	*	*			trans	-147	89.7	172.9	42.3	0	0	0	0	110.8	T592	T592-T594 PolarHBondContact O-N 3.06Å
595	Y	34.6	Very low	46.4	Very low	200 Å²	200	95.7 Å²	95.7	78%	0.784	56%	0.561	S	S	*	*			trans	-137	77.1	167.6	-137.8	-78.3	0	0	0	110.3	G597	Y595-G597 PolarHBondContact O-N 3.48Å
596	S	28.2	Very low	46.8	Very low	136 Å²	136	96.3 Å²	96.3	95%	0.951	57%	0.565	S	S	*	*			trans	-83.4	108.1	175.5	-169.1	0	0	0	0	109.8
597	G	30.3	Very low	47.5	Very low	61 Å²	61	96.5 Å²	96.5	63%	0.629	57%	0.57	S	S	*	*	S	Bend	trans	145.4	120.8	174.5	0	0	0	0	0	114.2	Y595	Y595-G597 PolarHBondContact O-N 3.48Å
598	G	31.6	Very low	48.5	Very low	65 Å²	65	102.5 Å²	102.5	67%	0.67	59%	0.591	S	S	*	*			trans	84.6	67.5	166.5	0	0	0	0	0	116.3	E600	G598-E600 VanDerWaalsContact C-N 3.26Å; G598-E600 PolarHBondContact O-N 3.44Å
599	T	29.7	Very low	49.7	Very low	156 Å²	156	101.5 Å²	101.5	96%	0.957	58%	0.579	S	S	*	*			trans	-73.7	59.7	178.7	51	0	0	0	0	114
600	E	37.9	Very low	51.2	Low	153 Å²	153	99.5 Å²	99.5	72%	0.715	57%	0.567	S	S	*	*			trans	-140.4	15.5	-170.6	-130	-157.7	-117.2	0	0	117.4	G598	G598-E600 VanDerWaalsContact C-N 3.26Å; G598-E600 PolarHBondContact O-N 3.44Å
601	I	48	Very low	52.7	Low	107 Å²	107	95.7 Å²	95.7	55%	0.549	54%	0.542	S	S	.	.			trans	-126.3	157.9	-170.6	-45.9	-176.8	0	0	0	111.7
602	F	59	Low	54.5	Low	39 Å²	39	92 Å²	92	17%	0.171	53%	0.525	C	S	.	.	S	Bend	trans	78.7	5.4	175.4	-42.9	-71.3	0	0	0	118.6	I570 A586 R710	I570-F602 WeakPolarHBondContact CD1-O 3.3Å; A586-F602 HydrophobicContact CB-CE1 4.41Å; A586-F602 HydrophobicContact CB-CZ 3.84Å; F602-R710 VanDerWaalsContact CD2-NH1 3.28Å; F602-R710 VanDerWaalsContact CE1-NH2 3.29Å; F602-R710 VanDerWaalsContact CE2-NH2 3.3Å
603	L	61.9	Low	57.1	Low	131 Å²	131	86.9 Å²	86.9	69%	0.686	49%	0.493	S	S	*	.	S	Bend	trans	-81.6	144.4	159.4	-72.8	177.6	0	0	0	111.1	K605	L603-K605 PolarHBondContact O-N 3.47Å; L603-K605 VanDerWaalsContact O-N 3.07Å
604	P	64.1	Low	59.7	Low	29 Å²	29	81 Å²	81	19%	0.188	45%	0.452	C	S	.	.			trans	-63.4	109.9	176.2	-16.2	26.5	0	0	0	111.6	I570 M651 V653 Y709	I570-P604 HydrophobicContact CD1-CB 4.03Å; I570-P604 HydrophobicContact CD1-CG 3.64Å; P604-M651 HydrophobicContact CB-SD 4.21Å; P604-V653 HydrophobicContact CB-CG2 4.01Å; P604-Y709 HydrophobicContact CG-CE2 4.03Å
605	K	66.3	Low	62.5	Low	120 Å²	120	76.2 Å²	76.2	52%	0.522	42%	0.421	S	S	.	.			trans	-76.1	172.5	172.4	-58.2	-165.6	179.1	-167.5	0	109.3	L603 Q609 V653	L603-K605 PolarHBondContact O-N 3.47Å; L603-K605 VanDerWaalsContact O-N 3.07Å; K605-Q609 VanDerWaalsContact C-NE2 3.3Å; K605-Q609 PolarHBondContact O-NE2 3.41Å; K605-V653 VanDerWaalsContact O-CB 3.25Å; K605-V653 WeakPolarHBondContact O-CB 3.38Å; K605-V653 WeakPolarHBondContact O-CG1 3.48Å; K605-V653 WeakPolarHBondContact O-CG2 3.25Å
606	V	68.3	Low	65.1	Low	89 Å²	89	66.9 Å²	66.9	54%	0.539	39%	0.385	S	S	.	.	S	Bend	trans	-72.8	150.8	176.1	-177.7	0	0	0	0	110.4	P656	V606-P656 HydrophobicContact CG2-CB 4.02Å; V606-P656 HydrophobicContact CG2-CG 4.04Å
607	G	70.6	Confident	68	Low	33 Å²	33	62.8 Å²	62.8	34%	0.34	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	93.8	-154.1	176.9	0	0	0	0	0	113.5	V653	G607-V653 PolarHBondContact N-O 3.39Å; G607-V653 PolarHBondContact O-N 3.34Å
608	R	78.8	Confident	70.6	Confident	131 Å²	131	63.3 Å²	63.3	49%	0.494	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	123.7	-169.3	-167.2	170.7	-141.6	-146.4	-2.3	111	L573 I650 D652	L573-R608 HydrophobicContact CD1-CG 4.18Å; R608-I650 HydrophobicContact CG-CG2 3.73Å; R608-D652 WeakPolarHBondContact CG-OD1 3.35Å; R608-D652 IonicContact NE-OD1 2.86Å; R608-D652 PolarHBondContact NE-OD1 3.03Å
609	Q	80.8	Confident	73.2	Confident	8 Å²	8	60.4 Å²	60.4	4%	0.037	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	158.7	176.8	-81.9	134.6	67.6	0	0	110.7	I570 K605 I650 M651	I570-Q609 HydrophobicContact CG2-CB 3.88Å; I570-Q609 HydrophobicContact CG2-CG 3.83Å; K605-Q609 VanDerWaalsContact C-NE2 3.3Å; K605-Q609 PolarHBondContact O-NE2 3.41Å; Q609-I650 CarbonylContact O-C 3.57Å; Q609-I650 WeakPolarHBondContact O-CA 3.37Å; Q609-M651 PolarHBondContact N-O 2.92Å; Q609-M651 PolarHBondContact O-N 3.07Å
610	R	84.3	Confident	76.1	Confident	64 Å²	64	53 Å²	53	24%	0.242	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	142.8	165.7	-68.6	171.8	-156.8	-145.2	13.1	109.2	V571 L573 G577 H648 V649	V571-R610 HydrophobicContact CB-CB 4.35Å; V571-R610 PolarHBondContact N-O 2.92Å; V571-R610 PolarHBondContact O-N 3.07Å; L573-R610 HydrophobicContact CD1-CG 4.39Å; L573-R610 HydrophobicContact CD2-CB 4.38Å; L573-R610 HydrophobicContact CD2-CG 3.83Å; G577-R610 PolarHBondContact O-NH2 2.9Å; R610-H648 PolarHBondContact NH1-CE1 3.17Å; R610-H648 PolarHBondContact NH1-NE2 2.95Å; R610-V649 CarbonylContact C-O 3.31Å; R610-V649 WeakPolarHBondContact CA-O 3.46Å
611	V	85.3	Confident	78.5	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	115.3	167.4	173.6	0	0	0	0	106.4	G569 H648 V649 M651 Y709	G569-V611 WeakPolarHBondContact O-CA 3.39Å; V611-H648 CarbonylContact O-C 3.59Å; V611-H648 VanDerWaalsContact O-CA 3.28Å; V611-H648 WeakPolarHBondContact O-CA 3.37Å; V611-H648 WeakPolarHBondContact O-CB 3.35Å; V611-V649 HydrophobicContact CB-CB 4.42Å; V611-V649 PolarHBondContact N-O 2.97Å; V611-V649 PolarHBondContact O-N 3.05Å; V611-M651 HydrophobicContact CG2-CB 4.27Å; V611-M651 HydrophobicContact CG2-CE 3.42Å; V611-M651 VanDerWaalsContact CG2-CE 3.42Å; V611-Y709 HydrophobicContact CG1-CD1 4.16Å; V611-Y709 HydrophobicContact CG1-CG 4.42Å; V611-Y709 HydrophobicContact CG2-CD1 4Å; V611-Y709 HydrophobicContact CG2-CG 4.17Å
612	Q	85.4	Confident	80.2	Confident	55 Å²	55	48.6 Å²	48.6	26%	0.257	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	135.1	173.9	-168.2	61.7	26.6	0	0	109.2	G569 A645 R646 M647	G569-Q612 PolarHBondContact O-N 3.03Å; Q612-A645 PolarHBondContact NE2-O 2.88Å; Q612-R646 PolarHBondContact NE2-O 3.06Å; Q612-M647 PolarHBondContact NE2-O 3.38Å
613	L	89.1	Confident	81.6	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.01	23%	0.231	C	C	.	.			trans	-87.4	132.2	177.4	-60.3	176.6	0	0	0	110	Y644 A645 M647 V649 R680 I683	L613-Y644 HydrophobicContact CB-CE1 4.01Å; L613-Y644 HydrophobicContact CD1-CD2 4.25Å; L613-Y644 HydrophobicContact CD1-CE2 3.7Å; L613-A645 WeakPolarHBondContact O-CA 3.39Å; L613-M647 VanDerWaalsContact CB-O 3.3Å; L613-M647 WeakPolarHBondContact CB-O 3.47Å; L613-M647 HydrophobicContact CD1-CB 4.22Å; L613-M647 WeakPolarHBondContact CG-O 3.29Å; L613-M647 PolarHBondContact N-O 3.29Å; L613-V649 HydrophobicContact CD1-CG2 4.11Å; L613-V649 HydrophobicContact CD2-CG2 3.89Å; L613-V649 HydrophobicContact CG-CG2 4.25Å; L613-R680 HydrophobicContact CD2-CG 3.85Å; L613-I683 HydrophobicContact CD1-CD1 3.85Å; L613-I683 HydrophobicContact CD1-CG2 4.42Å
614	A	87.8	Confident	82.9	Confident	4 Å²	4	40.6 Å²	40.6	3%	0.033	20%	0.198	C	C	.	.			trans	-125.6	161.4	176.4	0	0	0	0	0	111.8	G566 S702 H704 L711	G566-A614 WeakPolarHBondContact O-CB 3.39Å; A614-S702 WeakPolarHBondContact O-CB 3.23Å; A614-H704 PolarHBondContact N-CE1 2.84Å; A614-H704 PolarHBondContact N-NE2 3.2Å; A614-H704 VanDerWaalsContact N-NE2 3.16Å; A614-H704 PolarHBondContact O-CE1 2.92Å; A614-L711 HydrophobicContact CB-CB 4.15Å; A614-L711 HydrophobicContact CB-CD2 4.35Å
615	Y	90.9	Very high	83.9	Confident	18 Å²	18	43.4 Å²	43.4	7%	0.071	21%	0.209	C	C	.	.			trans	-146.7	157.9	166.8	83.7	-80.1	0	0	0	110.2	F617 F620 M641 N642 A645 A701	Y615-F617 HydrophobicContact CE2-CB 4.14Å; Y615-F620 HydrophobicContact CD2-CB 4.05Å; Y615-F620 HydrophobicContact CD2-CD1 4.5Å; Y615-F620 HydrophobicContact CD2-CG 4.38Å; Y615-F620 HydrophobicContact CE2-CB 4.04Å; Y615-F620 AromaticContact CE2-CD1 4Å; Y615-F620 HydrophobicContact CE2-CD1 4Å; Y615-F620 HydrophobicContact CE2-CG 4.27Å; Y615-M641 HydrophobicContact CD1-CB 4.24Å; Y615-M641 HydrophobicContact CD1-CE 4.03Å; Y615-M641 HydrophobicContact CD2-CB 4.43Å; Y615-M641 HydrophobicContact CD2-CE 3.73Å; Y615-M641 HydrophobicContact CE1-CB 3.83Å; Y615-M641 WeakPolarHBondContact CE1-O 3.34Å; Y615-M641 HydrophobicContact CE2-CB 4.02Å; Y615-M641 HydrophobicContact CE2-CE 4.43Å; Y615-M641 HydrophobicContact CG-CE 3.49Å; Y615-M641 VanDerWaalsContact CG-CE 3.49Å; Y615-N642 PolarHBondContact OH-OD1 2.95Å; Y615-A645 HydrophobicContact CD1-CB 4.01Å; Y615-A645 HydrophobicContact CE1-CB 4.17Å; Y615-A701 CarbonylContact C-O 3.55Å; Y615-A701 VanDerWaalsContact CA-O 3.32Å; Y615-A701 WeakPolarHBondContact CA-O 3.45Å
616	S	88.4	Confident	84.5	Confident	4 Å²	4	40.4 Å²	40.4	3%	0.028	21%	0.206	C	C	.	.			trans	-92.8	116.9	173	166.2	0	0	0	0	109.7	P618 V619 F620 A701 D714 M717	S616-P618 WeakPolarHBondContact OG-CD 3.43Å; S616-V619 WeakPolarHBondContact OG-CB 3.5Å; S616-V619 VanDerWaalsContact OG-CG2 3.28Å; S616-V619 WeakPolarHBondContact OG-CG2 3.2Å; S616-V619 PolarHBondContact OG-N 3.41Å; S616-V619 VanDerWaalsContact OG-N 3.13Å; S616-F620 VanDerWaalsContact O-CB 3.29Å; S616-F620 WeakPolarHBondContact O-CB 3.25Å; S616-F620 PolarHBondContact O-N 3.11Å; S616-A701 PolarHBondContact N-O 2.99Å; S616-D714 WeakPolarHBondContact CB-OD1 3.3Å; S616-D714 PolarHBondContact OG-OD1 3.05Å; S616-M717 VanDerWaalsContact CB-CE 3.47Å
617	F	88.7	Confident	85.2	Confident	49 Å²	49	39 Å²	39	22%	0.215	19%	0.192	C	C	.	.	H	α-helix	trans	-63.4	-45.7	171.7	175	-98.3	0	0	0	112.6	S560 Y615 V619 F620 N621 V638	S560-F617 VanDerWaalsContact CB-CE2 3.46Å; Y615-F617 HydrophobicContact CE2-CB 4.14Å; F617-V619 VanDerWaalsContact C-N 3.33Å; F617-V619 PolarHBondContact O-N 3.35Å; F617-F620 PolarHBondContact O-N 3.28Å; F617-N621 HydrophobicContact CE1-CB 4.35Å; F617-N621 HydrophobicContact CE2-CB 4.33Å; F617-N621 HydrophobicContact CZ-CB 4.02Å; F617-N621 PolarHBondContact O-N 3.2Å; F617-V638 HydrophobicContact CD2-CG1 4.04Å; F617-V638 HydrophobicContact CD2-CG2 4.45Å; F617-V638 HydrophobicContact CE2-CG1 3.99Å; F617-V638 HydrophobicContact CE2-CG2 4Å
618	P	85.3	Confident	85.9	Confident	73 Å²	73	45.5 Å²	45.5	47%	0.474	21%	0.214	S	C	.	.	H	α-helix	trans	-56.1	-42.2	176.2	-28.2	35.9	0	0	0	113.9	S616 R622	S616-P618 WeakPolarHBondContact OG-CD 3.43Å; P618-R622 WeakPolarHBondContact O-CG 3.17Å; P618-R622 PolarHBondContact O-N 2.72Å
619	V	86.8	Confident	86.1	Confident	4 Å²	4	39.4 Å²	39.4	2%	0.024	19%	0.191	C	C	.	.	H	α-helix	trans	-69.5	-37.8	175.3	174.5	0	0	0	0	111.3	S616 F617 L623 A701 M717 I718 V721	S616-V619 WeakPolarHBondContact OG-CB 3.5Å; S616-V619 VanDerWaalsContact OG-CG2 3.28Å; S616-V619 WeakPolarHBondContact OG-CG2 3.2Å; S616-V619 PolarHBondContact OG-N 3.41Å; S616-V619 VanDerWaalsContact OG-N 3.13Å; F617-V619 VanDerWaalsContact C-N 3.33Å; F617-V619 PolarHBondContact O-N 3.35Å; V619-L623 HydrophobicContact CG1-CD1 3.98Å; V619-L623 WeakPolarHBondContact O-CB 3.47Å; V619-L623 WeakPolarHBondContact O-CG 3.26Å; V619-L623 PolarHBondContact O-N 3.5Å; V619-A701 HydrophobicContact CG1-CB 4.37Å; V619-M717 HydrophobicContact CG1-CB 4.15Å; V619-M717 HydrophobicContact CG2-CB 3.81Å; V619-M717 HydrophobicContact CG2-CE 4.19Å; V619-I718 HydrophobicContact CG2-CG1 4.03Å; V619-V721 HydrophobicContact CG1-CG2 4.4Å
620	F	90.5	Very high	86.3	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-67.5	-44.2	178.8	-165.7	-131.8	0	0	0	111.9	Y615 S616 F617 L623 L624 L637 V638 M641 L697 A701	Y615-F620 HydrophobicContact CD2-CB 4.05Å; Y615-F620 HydrophobicContact CD2-CD1 4.5Å; Y615-F620 HydrophobicContact CD2-CG 4.38Å; Y615-F620 HydrophobicContact CE2-CB 4.04Å; Y615-F620 AromaticContact CE2-CD1 4Å; Y615-F620 HydrophobicContact CE2-CD1 4Å; Y615-F620 HydrophobicContact CE2-CG 4.27Å; S616-F620 VanDerWaalsContact O-CB 3.29Å; S616-F620 WeakPolarHBondContact O-CB 3.25Å; S616-F620 PolarHBondContact O-N 3.11Å; F617-F620 PolarHBondContact O-N 3.28Å; F620-L623 CarbonylContact O-C 3.48Å; F620-L623 WeakPolarHBondContact O-CB 3.23Å; F620-L623 PolarHBondContact O-N 3.19Å; F620-L623 VanDerWaalsContact O-N 3.13Å; F620-L624 HydrophobicContact CD1-CD1 3.91Å; F620-L624 HydrophobicContact CD1-CG 4.49Å; F620-L624 HydrophobicContact CE1-CD1 3.74Å; F620-L624 HydrophobicContact CE1-CG 4.34Å; F620-L624 HydrophobicContact CE2-CD2 4.22Å; F620-L624 HydrophobicContact CE2-CG 4.36Å; F620-L624 HydrophobicContact CG-CD1 4.42Å; F620-L624 HydrophobicContact CZ-CD1 4.12Å; F620-L624 HydrophobicContact CZ-CD2 4.05Å; F620-L624 HydrophobicContact CZ-CG 4.27Å; F620-L624 WeakPolarHBondContact O-CG 3.46Å; F620-L624 PolarHBondContact O-N 3.41Å; F620-L637 HydrophobicContact CE1-CB 4.23Å; F620-L637 HydrophobicContact CZ-CB 4.06Å; F620-V638 HydrophobicContact CD1-CG2 3.97Å; F620-V638 HydrophobicContact CE1-CG2 3.92Å; F620-M641 HydrophobicContact CD1-CG 4.22Å; F620-M641 HydrophobicContact CE1-CB 4.15Å; F620-M641 HydrophobicContact CE1-CG 3.57Å; F620-M641 HydrophobicContact CE2-CG 4.34Å; F620-M641 HydrophobicContact CZ-CG 3.64Å; F620-L697 HydrophobicContact CE2-CB 4.28Å; F620-A701 HydrophobicContact CB-CB 3.66Å; F620-A701 HydrophobicContact CD2-CB 3.68Å; F620-A701 HydrophobicContact CG-CB 4.03Å
621	N	88.2	Confident	86.2	Confident	30 Å²	30	44.2 Å²	44.2	16%	0.16	22%	0.224	C	C	.	.	H	α-helix	trans	-63	-47.6	177.9	-171.7	51.2	0	0	0	111.4	F617 L623 L624 E625	F617-N621 HydrophobicContact CE1-CB 4.35Å; F617-N621 HydrophobicContact CE2-CB 4.33Å; F617-N621 HydrophobicContact CZ-CB 4.02Å; F617-N621 PolarHBondContact O-N 3.2Å; N621-L623 PolarHBondContact O-N 3.35Å; N621-L624 PolarHBondContact O-N 3.11Å; N621-E625 VanDerWaalsContact ND2-CD 3.34Å; N621-E625 PolarHBondContact ND2-OE1 2.97Å; N621-E625 WeakPolarHBondContact O-CG 3.33Å; N621-E625 PolarHBondContact O-N 2.91Å
622	R	84.8	Confident	86.1	Confident	138 Å²	138	47.9 Å²	47.9	52%	0.521	25%	0.247	S	C	.	.	H	α-helix	trans	-56.2	-34.3	172.6	-72	-176.5	-174.9	-166	4.7	113	P618 E625 A626	P618-R622 WeakPolarHBondContact O-CG 3.17Å; P618-R622 PolarHBondContact O-N 2.72Å; R622-E625 WeakPolarHBondContact CA-OE2 3.33Å; R622-A626 WeakPolarHBondContact O-CB 3.42Å; R622-A626 PolarHBondContact O-N 2.95Å
623	L	87.3	Confident	86.1	Confident	1 Å²	1	48 Å²	48	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-72.8	-36.9	174.1	-82.3	168.4	0	0	0	113.1	V619 F620 N621 Y627 L697 R700 A701 V721	V619-L623 HydrophobicContact CG1-CD1 3.98Å; V619-L623 WeakPolarHBondContact O-CB 3.47Å; V619-L623 WeakPolarHBondContact O-CG 3.26Å; V619-L623 PolarHBondContact O-N 3.5Å; F620-L623 CarbonylContact O-C 3.48Å; F620-L623 WeakPolarHBondContact O-CB 3.23Å; F620-L623 PolarHBondContact O-N 3.19Å; F620-L623 VanDerWaalsContact O-N 3.13Å; N621-L623 PolarHBondContact O-N 3.35Å; L623-Y627 HydrophobicContact CD2-CD2 4.28Å; L623-Y627 HydrophobicContact CD2-CE2 4.01Å; L623-Y627 WeakPolarHBondContact O-CB 3.38Å; L623-Y627 WeakPolarHBondContact O-CD2 3.46Å; L623-Y627 PolarHBondContact O-N 3.27Å; L623-L697 HydrophobicContact CB-CD2 4.49Å; L623-L697 HydrophobicContact CD2-CD2 4.19Å; L623-R700 HydrophobicContact CD1-CB 3.76Å; L623-A701 HydrophobicContact CD1-CB 4.32Å; L623-V721 HydrophobicContact CD1-CG2 4.1Å; L623-V721 HydrophobicContact CD2-CB 4.43Å; L623-V721 HydrophobicContact CD2-CG1 3.62Å; L623-V721 HydrophobicContact CD2-CG2 3.85Å; L623-V721 HydrophobicContact CG-CG1 4.26Å; L623-V721 HydrophobicContact CG-CG2 4.09Å
624	L	88.9	Confident	86.1	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-69.9	-35.7	175.7	-67.2	173.8	0	0	0	111.5	F620 N621 Q628 V629 R634 L637 V638 L697	F620-L624 HydrophobicContact CD1-CD1 3.91Å; F620-L624 HydrophobicContact CD1-CG 4.49Å; F620-L624 HydrophobicContact CE1-CD1 3.74Å; F620-L624 HydrophobicContact CE1-CG 4.34Å; F620-L624 HydrophobicContact CE2-CD2 4.22Å; F620-L624 HydrophobicContact CE2-CG 4.36Å; F620-L624 HydrophobicContact CG-CD1 4.42Å; F620-L624 HydrophobicContact CZ-CD1 4.12Å; F620-L624 HydrophobicContact CZ-CD2 4.05Å; F620-L624 HydrophobicContact CZ-CG 4.27Å; F620-L624 WeakPolarHBondContact O-CG 3.46Å; F620-L624 PolarHBondContact O-N 3.41Å; N621-L624 PolarHBondContact O-N 3.11Å; L624-Q628 PolarHBondContact O-N 3.5Å; L624-V629 HydrophobicContact CB-CB 4.35Å; L624-V629 HydrophobicContact CB-CG2 4.42Å; L624-V629 HydrophobicContact CD2-CB 4.1Å; L624-V629 HydrophobicContact CD2-CG1 4.14Å; L624-V629 HydrophobicContact CD2-CG2 3.82Å; L624-V629 WeakPolarHBondContact O-CB 3.42Å; L624-V629 PolarHBondContact O-N 2.89Å; L624-R634 HydrophobicContact CB-CG 4.02Å; L624-R634 HydrophobicContact CD1-CB 3.99Å; L624-R634 HydrophobicContact CD1-CG 4.1Å; L624-R634 HydrophobicContact CG-CG 4.49Å; L624-L637 HydrophobicContact CD2-CD1 3.77Å; L624-V638 HydrophobicContact CD1-CG2 4.1Å; L624-L697 HydrophobicContact CD2-CD1 4.37Å
625	E	84.9	Confident	86	Confident	88 Å²	88	50.7 Å²	50.7	41%	0.411	26%	0.258	S	S	.	.	H	α-helix	trans	-65.6	-55.4	171.9	-71.5	163.3	169.4	0	0	111.5	N621 R622 Y627 Q628	N621-E625 VanDerWaalsContact ND2-CD 3.34Å; N621-E625 PolarHBondContact ND2-OE1 2.97Å; N621-E625 WeakPolarHBondContact O-CG 3.33Å; N621-E625 PolarHBondContact O-N 2.91Å; R622-E625 WeakPolarHBondContact CA-OE2 3.33Å; E625-Y627 PolarHBondContact O-N 3.25Å; E625-Q628 PolarHBondContact O-N 2.71Å
626	A	80.5	Confident	85.7	Confident	57 Å²	57	52 Å²	52	47%	0.471	27%	0.265	S	S	.	.	H	α-helix	trans	-63.7	-24.9	-176.7	0	0	0	0	0	114.1	R622	R622-A626 WeakPolarHBondContact O-CB 3.42Å; R622-A626 PolarHBondContact O-N 2.95Å
627	Y	82.9	Confident	85.8	Confident	60 Å²	60	52 Å²	52	24%	0.235	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	16.9	174	-76.3	-91.2	0	0	0	113.3	L623 E625 V629 L697 R700 Q728	L623-Y627 HydrophobicContact CD2-CD2 4.28Å; L623-Y627 HydrophobicContact CD2-CE2 4.01Å; L623-Y627 WeakPolarHBondContact O-CB 3.38Å; L623-Y627 WeakPolarHBondContact O-CD2 3.46Å; L623-Y627 PolarHBondContact O-N 3.27Å; E625-Y627 PolarHBondContact O-N 3.25Å; Y627-V629 PolarHBondContact O-N 2.78Å; Y627-V629 VanDerWaalsContact O-N 3.11Å; Y627-L697 HydrophobicContact CD1-CD2 4.32Å; Y627-L697 HydrophobicContact CD2-CD2 3.37Å; Y627-L697 HydrophobicContact CE2-CD2 3.58Å; Y627-L697 HydrophobicContact CG-CD1 4.44Å; Y627-L697 HydrophobicContact CG-CD2 3.77Å; Y627-R700 PolarHBondContact OH-NH1 3.08Å; Y627-Q728 PolarHBondContact OH-OE1 2.92Å; Y627-Q728 VanDerWaalsContact OH-OE1 3.05Å
628	Q	83.6	Confident	85.9	Confident	170 Å²	170	49.7 Å²	49.7	79%	0.794	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	39.3	173.3	-58.1	-177.6	12.1	0	0	113.9	L624 E625	L624-Q628 PolarHBondContact O-N 3.5Å; E625-Q628 PolarHBondContact O-N 2.71Å
629	V	84.1	Confident	86	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.012	24%	0.239	C	C	.	.			trans	-67.9	131.4	-178.6	-178.4	0	0	0	0	109.4	L624 Y627 E633 R634 L637 L697	L624-V629 HydrophobicContact CB-CB 4.35Å; L624-V629 HydrophobicContact CB-CG2 4.42Å; L624-V629 HydrophobicContact CD2-CB 4.1Å; L624-V629 HydrophobicContact CD2-CG1 4.14Å; L624-V629 HydrophobicContact CD2-CG2 3.82Å; L624-V629 WeakPolarHBondContact O-CB 3.42Å; L624-V629 PolarHBondContact O-N 2.89Å; Y627-V629 PolarHBondContact O-N 2.78Å; Y627-V629 VanDerWaalsContact O-N 3.11Å; V629-E633 HydrophobicContact CG1-CB 3.86Å; V629-E633 HydrophobicContact CG1-CG 4.16Å; V629-R634 HydrophobicContact CB-CG 4.03Å; V629-R634 HydrophobicContact CG1-CG 3.93Å; V629-R634 PolarHBondContact O-NE 3.09Å; V629-R634 PolarHBondContact O-NH2 2.89Å; V629-L637 HydrophobicContact CG1-CD1 4.1Å; V629-L697 HydrophobicContact CG2-CD1 4.25Å
630	P	84.8	Confident	86.2	Confident	76 Å²	76	49.7 Å²	49.7	49%	0.494	25%	0.247	S	C	.	.			trans	-57.9	140.1	177.3	-25.8	35	0	0	0	112	E633 R634	P630-E633 CarbonylContact O-C 3.6Å; P630-E633 WeakPolarHBondContact O-CA 3.29Å; P630-E633 WeakPolarHBondContact O-CB 3.46Å; P630-E633 PolarHBondContact O-N 2.73Å; P630-R634 PolarHBondContact O-N 3.21Å
631	M	82.7	Confident	86.2	Confident	97 Å²	97	49.7 Å²	49.7	48%	0.478	25%	0.247	S	C	.	.	H	α-helix	trans	-51.9	-45.7	-174.3	-162	61.9	163.9	0	0	115.2	L556 E633 R634 I635	L556-M631 HydrophobicContact CB-CE 3.68Å; L556-M631 HydrophobicContact CD2-CE 3.68Å; L556-M631 HydrophobicContact CD2-SD 3.97Å; L556-M631 HydrophobicContact CG-CE 4.32Å; M631-E633 VanDerWaalsContact C-N 3.33Å; M631-E633 PolarHBondContact O-N 3.02Å; M631-R634 WeakPolarHBondContact O-CB 3.23Å; M631-R634 PolarHBondContact O-N 3.41Å; M631-R634 VanDerWaalsContact O-N 3.07Å; M631-I635 HydrophobicContact CG-CD1 4.47Å; M631-I635 WeakPolarHBondContact O-CG1 3.41Å; M631-I635 PolarHBondContact O-N 2.79Å; M631-I635 VanDerWaalsContact O-N 3.08Å
632	P	82.1	Confident	86.2	Confident	77 Å²	77	48.3 Å²	48.3	50%	0.5	24%	0.24	S	C	.	.	H	α-helix	trans	-63.2	-36.2	174.9	23.6	-34.1	0	0	0	112.9	R634 I635 Q636	P632-R634 VanDerWaalsContact C-N 3.3Å; P632-R634 PolarHBondContact O-N 3.46Å; P632-I635 PolarHBondContact O-N 3.18Å; P632-Q636 WeakPolarHBondContact O-CG 3.4Å; P632-Q636 PolarHBondContact O-N 2.84Å
633	E	86.6	Confident	86.3	Confident	58 Å²	58	45.8 Å²	45.8	27%	0.271	23%	0.234	S	C	.	.	H	α-helix	trans	-67.5	-32	173.8	-160.5	-166.3	166.2	0	0	111.3	V629 P630 M631 L637 R694	V629-E633 HydrophobicContact CG1-CB 3.86Å; V629-E633 HydrophobicContact CG1-CG 4.16Å; P630-E633 CarbonylContact O-C 3.6Å; P630-E633 WeakPolarHBondContact O-CA 3.29Å; P630-E633 WeakPolarHBondContact O-CB 3.46Å; P630-E633 PolarHBondContact O-N 2.73Å; M631-E633 VanDerWaalsContact C-N 3.33Å; M631-E633 PolarHBondContact O-N 3.02Å; E633-L637 HydrophobicContact CG-CD1 3.97Å; E633-L637 HydrophobicContact CG-CG 4.3Å; E633-L637 WeakPolarHBondContact O-CB 3.46Å; E633-L637 WeakPolarHBondContact O-CD1 3.13Å; E633-L637 WeakPolarHBondContact O-CG 3.34Å; E633-L637 PolarHBondContact O-N 2.64Å; E633-R694 WeakPolarHBondContact OE1-CG 3.38Å; E633-R694 IonicContact OE1-CZ 2.94Å; E633-R694 IonicContact OE1-NE 2.94Å; E633-R694 PolarHBondContact OE1-NE 3.29Å; E633-R694 IonicContact OE1-NH2 3.93Å; E633-R694 PolarHBondContact OE1-NH2 3.19Å; E633-R694 IonicContact OE2-CZ 2.79Å; E633-R694 IonicContact OE2-NE 3.26Å; E633-R694 IonicContact OE2-NH2 3.77Å; E633-R694 PolarHBondContact OE2-NH2 3.19Å
634	R	88.1	Confident	86.5	Confident	43 Å²	43	45.8 Å²	45.8	16%	0.162	23%	0.233	C	C	.	.	H	α-helix	trans	-61.6	-50.4	172.1	-58.6	-168.2	-168	176.2	7.6	111.5	L556 L624 V629 P630 M631 P632 Q636 L637 V638	L556-R634 HydrophobicContact CD1-CB 4.02Å; L556-R634 HydrophobicContact CD2-CB 4.45Å; L624-R634 HydrophobicContact CB-CG 4.02Å; L624-R634 HydrophobicContact CD1-CB 3.99Å; L624-R634 HydrophobicContact CD1-CG 4.1Å; L624-R634 HydrophobicContact CG-CG 4.49Å; V629-R634 HydrophobicContact CB-CG 4.03Å; V629-R634 HydrophobicContact CG1-CG 3.93Å; V629-R634 PolarHBondContact O-NE 3.09Å; V629-R634 PolarHBondContact O-NH2 2.89Å; P630-R634 PolarHBondContact O-N 3.21Å; M631-R634 WeakPolarHBondContact O-CB 3.23Å; M631-R634 PolarHBondContact O-N 3.41Å; M631-R634 VanDerWaalsContact O-N 3.07Å; P632-R634 VanDerWaalsContact C-N 3.3Å; P632-R634 PolarHBondContact O-N 3.46Å; R634-Q636 PolarHBondContact O-N 2.87Å; R634-L637 PolarHBondContact O-N 2.79Å; R634-L637 VanDerWaalsContact O-N 3.14Å; R634-V638 WeakPolarHBondContact O-CG2 3.14Å; R634-V638 PolarHBondContact O-N 2.88Å
635	I	85.1	Confident	86.4	Confident	19 Å²	19	46 Å²	46	10%	0.097	24%	0.235	C	C	.	.	H	α-helix	trans	-57.4	-50.4	-179.7	-64.4	162.7	0	0	0	109.7	L556 V559 M631 P632 L637 V638 N639	L556-I635 HydrophobicContact CB-CG1 4.05Å; L556-I635 HydrophobicContact CD1-CG1 4.05Å; V559-I635 HydrophobicContact CG2-CG2 4.07Å; M631-I635 HydrophobicContact CG-CD1 4.47Å; M631-I635 WeakPolarHBondContact O-CG1 3.41Å; M631-I635 PolarHBondContact O-N 2.79Å; M631-I635 VanDerWaalsContact O-N 3.08Å; P632-I635 PolarHBondContact O-N 3.18Å; I635-L637 VanDerWaalsContact C-N 3.34Å; I635-L637 PolarHBondContact O-N 3.23Å; I635-V638 PolarHBondContact O-N 3.05Å; I635-N639 PolarHBondContact O-N 3.21Å
636	Q	86.5	Confident	86.4	Confident	46 Å²	46	46.7 Å²	46.7	22%	0.215	23%	0.234	C	C	.	.	H	α-helix	trans	-63.1	-35.4	176.9	-66.8	-171.8	10.6	0	0	113.3	S547 D552 P632 R634 R640	S547-Q636 PolarHBondContact OG-NE2 3.27Å; S547-Q636 VanDerWaalsContact OG-NE2 3.08Å; D552-Q636 PolarHBondContact OD1-NE2 2.94Å; P632-Q636 WeakPolarHBondContact O-CG 3.4Å; P632-Q636 PolarHBondContact O-N 2.84Å; R634-Q636 PolarHBondContact O-N 2.87Å; Q636-R640 VanDerWaalsContact O-CG 3.22Å; Q636-R640 WeakPolarHBondContact O-CG 3.48Å; Q636-R640 PolarHBondContact O-N 2.89Å; Q636-R640 VanDerWaalsContact O-N 3.14Å
637	L	90.3	Very high	86.6	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-71.4	-37	176.3	-78.4	168.3	0	0	0	112.9	F620 L624 V629 E633 R634 I635 R640 M641 I690 R694	F620-L637 HydrophobicContact CE1-CB 4.23Å; F620-L637 HydrophobicContact CZ-CB 4.06Å; L624-L637 HydrophobicContact CD2-CD1 3.77Å; V629-L637 HydrophobicContact CG1-CD1 4.1Å; E633-L637 HydrophobicContact CG-CD1 3.97Å; E633-L637 HydrophobicContact CG-CG 4.3Å; E633-L637 WeakPolarHBondContact O-CB 3.46Å; E633-L637 WeakPolarHBondContact O-CD1 3.13Å; E633-L637 WeakPolarHBondContact O-CG 3.34Å; E633-L637 PolarHBondContact O-N 2.64Å; R634-L637 PolarHBondContact O-N 2.79Å; R634-L637 VanDerWaalsContact O-N 3.14Å; I635-L637 VanDerWaalsContact C-N 3.34Å; I635-L637 PolarHBondContact O-N 3.23Å; L637-R640 PolarHBondContact O-N 2.76Å; L637-M641 WeakPolarHBondContact O-CB 3.43Å; L637-M641 VanDerWaalsContact O-CG 3.31Å; L637-M641 WeakPolarHBondContact O-CG 3.36Å; L637-M641 PolarHBondContact O-N 3.48Å; L637-I690 HydrophobicContact CD2-CG2 4.17Å; L637-R694 HydrophobicContact CD1-CB 4.39Å; L637-R694 HydrophobicContact CD1-CG 3.92Å; L637-R694 HydrophobicContact CD2-CB 3.91Å; L637-R694 HydrophobicContact CD2-CG 4.06Å
638	V	89.7	Confident	86.9	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-70.1	-42.1	176	-178.7	0	0	0	0	110.4	L556 V559 F617 F620 L624 R634 I635 R640 M641 N642	L556-V638 HydrophobicContact CD1-CB 4.4Å; L556-V638 HydrophobicContact CD1-CG2 3.83Å; V559-V638 HydrophobicContact CG1-CB 3.71Å; V559-V638 HydrophobicContact CG1-CG1 3.6Å; F617-V638 HydrophobicContact CD2-CG1 4.04Å; F617-V638 HydrophobicContact CD2-CG2 4.45Å; F617-V638 HydrophobicContact CE2-CG1 3.99Å; F617-V638 HydrophobicContact CE2-CG2 4Å; F620-V638 HydrophobicContact CD1-CG2 3.97Å; F620-V638 HydrophobicContact CE1-CG2 3.92Å; L624-V638 HydrophobicContact CD1-CG2 4.1Å; R634-V638 WeakPolarHBondContact O-CG2 3.14Å; R634-V638 PolarHBondContact O-N 2.88Å; I635-V638 PolarHBondContact O-N 3.05Å; V638-R640 VanDerWaalsContact C-N 3.3Å; V638-R640 PolarHBondContact O-N 3.27Å; V638-M641 CarbonylContact O-C 3.58Å; V638-M641 PolarHBondContact O-N 3.29Å; V638-N642 VanDerWaalsContact O-CG 3.26Å; V638-N642 PolarHBondContact O-N 2.69Å; V638-N642 PolarHBondContact O-OD1 3.14Å
639	N	88.1	Confident	87.1	Confident	27 Å²	27	36.1 Å²	36.1	14%	0.144	18%	0.177	C	C	.	.	H	α-helix	trans	-53.7	-46.2	170.7	-86.1	-23.2	0	0	0	112	V559 I635 M641 N642 H643	V559-N639 HydrophobicContact CG1-CB 4.46Å; V559-N639 WeakPolarHBondContact CG1-OD1 3.44Å; V559-N639 WeakPolarHBondContact CG2-OD1 3.5Å; I635-N639 PolarHBondContact O-N 3.21Å; N639-M641 VanDerWaalsContact C-N 3.35Å; N639-M641 PolarHBondContact O-N 3.25Å; N639-N642 PolarHBondContact O-N 3.29Å; N639-H643 PolarHBondContact O-N 3.44Å
640	R	90.3	Very high	87.2	Confident	50 Å²	50	36.7 Å²	36.7	19%	0.189	18%	0.18	C	C	.	.	H	α-helix	trans	-68.5	-30.1	177.3	-67.9	173.4	-155.3	176	18.1	113.1	Q636 L637 V638 Y644 C688 G689 I690	Q636-R640 VanDerWaalsContact O-CG 3.22Å; Q636-R640 WeakPolarHBondContact O-CG 3.48Å; Q636-R640 PolarHBondContact O-N 2.89Å; Q636-R640 VanDerWaalsContact O-N 3.14Å; L637-R640 PolarHBondContact O-N 2.76Å; V638-R640 VanDerWaalsContact C-N 3.3Å; V638-R640 PolarHBondContact O-N 3.27Å; R640-Y644 WeakPolarHBondContact O-CB 3.16Å; R640-Y644 PolarHBondContact O-N 3.02Å; R640-C688 WeakPolarHBondContact CB-O 3.5Å; R640-C688 VanDerWaalsContact CD-O 3.31Å; R640-C688 WeakPolarHBondContact CD-O 3.49Å; R640-C688 WeakPolarHBondContact CG-O 3.43Å; R640-G689 PolarHBondContact NH1-O 3.17Å; R640-I690 HydrophobicContact CB-CD1 4.23Å; R640-I690 HydrophobicContact CB-CG1 3.79Å
641	M	91	Very high	87.3	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-76.4	-31.4	173.4	-74.8	-66	-69.4	0	0	113.1	Y615 F620 L637 V638 N639 Y644 A645 M684 I690 C698	Y615-M641 HydrophobicContact CD1-CB 4.24Å; Y615-M641 HydrophobicContact CD1-CE 4.03Å; Y615-M641 HydrophobicContact CD2-CB 4.43Å; Y615-M641 HydrophobicContact CD2-CE 3.73Å; Y615-M641 HydrophobicContact CE1-CB 3.83Å; Y615-M641 WeakPolarHBondContact CE1-O 3.34Å; Y615-M641 HydrophobicContact CE2-CB 4.02Å; Y615-M641 HydrophobicContact CE2-CE 4.43Å; Y615-M641 HydrophobicContact CG-CE 3.49Å; Y615-M641 VanDerWaalsContact CG-CE 3.49Å; F620-M641 HydrophobicContact CD1-CG 4.22Å; F620-M641 HydrophobicContact CE1-CB 4.15Å; F620-M641 HydrophobicContact CE1-CG 3.57Å; F620-M641 HydrophobicContact CE2-CG 4.34Å; F620-M641 HydrophobicContact CZ-CG 3.64Å; L637-M641 WeakPolarHBondContact O-CB 3.43Å; L637-M641 VanDerWaalsContact O-CG 3.31Å; L637-M641 WeakPolarHBondContact O-CG 3.36Å; L637-M641 PolarHBondContact O-N 3.48Å; V638-M641 CarbonylContact O-C 3.58Å; V638-M641 PolarHBondContact O-N 3.29Å; N639-M641 VanDerWaalsContact C-N 3.35Å; N639-M641 PolarHBondContact O-N 3.25Å; M641-Y644 HydrophobicContact CE-CD1 4.07Å; M641-Y644 HydrophobicContact CE-CE1 4.46Å; M641-Y644 WeakPolarHBondContact O-CB 3.43Å; M641-Y644 PolarHBondContact O-N 3.18Å; M641-Y644 HydrophobicContact SD-CD1 4.25Å; M641-Y644 HydrophobicContact SD-CG 4.38Å; M641-A645 PolarHBondContact O-N 2.95Å; M641-M684 HydrophobicContact SD-CE 4.37Å; M641-I690 HydrophobicContact CG-CD1 4.31Å; M641-I690 HydrophobicContact SD-CD1 3.79Å; M641-C698 HydrophobicContact CE-CB 4.25Å; M641-C698 HydrophobicContact SD-CB 3.65Å
642	N	88.2	Confident	87.3	Confident	2 Å²	2	30.2 Å²	30.2	1%	0.011	14%	0.143	C	C	.	.	H	α-helix	trans	-63.9	-44.3	169.8	-67.2	-12.7	0	0	0	110.6	V559 A563 Y615 V638 N639 Y644 A645 R646	V559-N642 PolarHBondContact O-ND2 3.29Å; A563-N642 VanDerWaalsContact CA-OD1 3.28Å; A563-N642 WeakPolarHBondContact CA-OD1 3.43Å; A563-N642 WeakPolarHBondContact CB-OD1 3.03Å; Y615-N642 PolarHBondContact OH-OD1 2.95Å; V638-N642 VanDerWaalsContact O-CG 3.26Å; V638-N642 PolarHBondContact O-N 2.69Å; V638-N642 PolarHBondContact O-OD1 3.14Å; N639-N642 PolarHBondContact O-N 3.29Å; N642-Y644 PolarHBondContact O-N 2.8Å; N642-A645 PolarHBondContact O-N 3.36Å; N642-R646 PolarHBondContact O-N 2.93Å
643	H	86.4	Confident	87.2	Confident	85 Å²	85	26.7 Å²	26.7	39%	0.394	12%	0.12	S	C	.	.	H	α-helix	trans	-61.5	-42	171.6	-173.1	78.5	0	0	0	111.8	N639 A645 R646 M647	N639-H643 PolarHBondContact O-N 3.44Å; H643-A645 VanDerWaalsContact C-N 3.31Å; H643-A645 PolarHBondContact O-N 3.43Å; H643-R646 PolarHBondContact O-N 3.43Å; H643-M647 WeakPolarHBondContact O-CG 3.24Å
644	Y	91.2	Very high	86.5	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-57.7	-39	174	169.4	-92.7	0	0	0	113.3	L613 R640 M641 N642 R646 M647 R680 I683 M684 C688	L613-Y644 HydrophobicContact CB-CE1 4.01Å; L613-Y644 HydrophobicContact CD1-CD2 4.25Å; L613-Y644 HydrophobicContact CD1-CE2 3.7Å; R640-Y644 WeakPolarHBondContact O-CB 3.16Å; R640-Y644 PolarHBondContact O-N 3.02Å; M641-Y644 HydrophobicContact CE-CD1 4.07Å; M641-Y644 HydrophobicContact CE-CE1 4.46Å; M641-Y644 WeakPolarHBondContact O-CB 3.43Å; M641-Y644 PolarHBondContact O-N 3.18Å; M641-Y644 HydrophobicContact SD-CD1 4.25Å; M641-Y644 HydrophobicContact SD-CG 4.38Å; N642-Y644 PolarHBondContact O-N 2.8Å; Y644-R646 VanDerWaalsContact C-N 3.34Å; Y644-R646 PolarHBondContact O-N 2.84Å; Y644-M647 WeakPolarHBondContact O-CB 3.49Å; Y644-M647 PolarHBondContact O-N 2.94Å; Y644-R680 HydrophobicContact CE2-CB 4.43Å; Y644-R680 HydrophobicContact CE2-CG 4.46Å; Y644-R680 WeakPolarHBondContact OH-CD 3.38Å; Y644-R680 WeakPolarHBondContact OH-CG 3.4Å; Y644-R680 PolarHBondContact OH-NE 2.88Å; Y644-I683 HydrophobicContact CD2-CG2 4.1Å; Y644-M684 HydrophobicContact CD1-CE 4.46Å; Y644-M684 HydrophobicContact CD2-CE 4.01Å; Y644-M684 HydrophobicContact CD2-CG 3.66Å; Y644-M684 HydrophobicContact CE1-CE 4.07Å; Y644-M684 HydrophobicContact CE2-CE 3.53Å; Y644-M684 HydrophobicContact CE2-CG 3.77Å; Y644-M684 HydrophobicContact CE2-SD 4.44Å; Y644-M684 HydrophobicContact CG-CE 4.45Å; Y644-C688 VanDerWaalsContact CA-SG 3.59Å
645	A	87.3	Confident	85.5	Confident	5 Å²	5	26.7 Å²	26.7	4%	0.041	13%	0.126	C	C	.	.	H	α-helix	trans	-71.9	-23.6	179.6	0	0	0	0	0	114.2	P564 Q612 L613 Y615 M641 N642 H643 M647	P564-A645 HydrophobicContact CB-CB 4.16Å; P564-A645 HydrophobicContact CG-CB 3.72Å; Q612-A645 PolarHBondContact NE2-O 2.88Å; L613-A645 WeakPolarHBondContact O-CA 3.39Å; Y615-A645 HydrophobicContact CD1-CB 4.01Å; Y615-A645 HydrophobicContact CE1-CB 4.17Å; M641-A645 PolarHBondContact O-N 2.95Å; N642-A645 PolarHBondContact O-N 3.36Å; H643-A645 VanDerWaalsContact C-N 3.31Å; H643-A645 PolarHBondContact O-N 3.43Å; A645-M647 VanDerWaalsContact C-N 3.27Å
646	R	84	Confident	84.1	Confident	102 Å²	102	28.5 Å²	28.5	39%	0.385	14%	0.138	S	C	.	.	H	α-helix	trans	-73	-22.3	171.6	-69.3	173.1	168.9	103.3	24.5	112.1	E202 Q562 P564 Q612 N642 H643 Y644	E202-R646 IonicContact OE1-CZ 3.43Å; E202-R646 VanDerWaalsContact OE1-CZ 3.26Å; E202-R646 IonicContact OE1-NE 3.79Å; E202-R646 PolarHBondContact OE1-NE 2.92Å; E202-R646 IonicContact OE1-NH2 3.34Å; E202-R646 PolarHBondContact OE1-NH2 2.83Å; E202-R646 IonicContact OE2-NH2 3.47Å; Q562-R646 PolarHBondContact O-NH2 2.9Å; P564-R646 HydrophobicContact CG-CG 4.04Å; Q612-R646 PolarHBondContact NE2-O 3.06Å; N642-R646 PolarHBondContact O-N 2.93Å; H643-R646 PolarHBondContact O-N 3.43Å; Y644-R646 VanDerWaalsContact C-N 3.34Å; Y644-R646 PolarHBondContact O-N 2.84Å
647	M	86.4	Confident	82.7	Confident	28 Å²	28	28.9 Å²	28.9	14%	0.138	16%	0.155	C	C	.	.			trans	-81	154.6	-177.9	-62.1	-66.8	-103.3	0	0	112.9	Q612 L613 H643 Y644 A645 T667 I683 H687	Q612-M647 PolarHBondContact NE2-O 3.38Å; L613-M647 VanDerWaalsContact CB-O 3.3Å; L613-M647 WeakPolarHBondContact CB-O 3.47Å; L613-M647 HydrophobicContact CD1-CB 4.22Å; L613-M647 WeakPolarHBondContact CG-O 3.29Å; L613-M647 PolarHBondContact N-O 3.29Å; H643-M647 WeakPolarHBondContact O-CG 3.24Å; Y644-M647 WeakPolarHBondContact O-CB 3.49Å; Y644-M647 PolarHBondContact O-N 2.94Å; A645-M647 VanDerWaalsContact C-N 3.27Å; M647-T667 HydrophobicContact CE-CG2 4.46Å; M647-T667 WeakPolarHBondContact CE-OG1 3.48Å; M647-I683 HydrophobicContact CB-CG2 4.2Å; M647-I683 HydrophobicContact CG-CG2 4.34Å; M647-H687 HydrophobicContact CE-CB 3.89Å
648	H	87.7	Confident	81.3	Confident	37 Å²	37	29.3 Å²	29.3	17%	0.171	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	165.4	176.3	61.1	-87.4	0	0	0	111.5	R610 V611 P666	R610-H648 PolarHBondContact NH1-CE1 3.17Å; R610-H648 PolarHBondContact NH1-NE2 2.95Å; V611-H648 CarbonylContact O-C 3.59Å; V611-H648 VanDerWaalsContact O-CA 3.28Å; V611-H648 WeakPolarHBondContact O-CA 3.37Å; V611-H648 WeakPolarHBondContact O-CB 3.35Å; H648-P666 WeakPolarHBondContact O-CD 3.4Å; H648-P666 VanDerWaalsContact O-CG 3.24Å; H648-P666 WeakPolarHBondContact O-CG 3.41Å
649	V	88.7	Confident	80	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	136	172.4	174.1	0	0	0	0	109	R610 V611 L613 F663 L676 I679 I683	R610-V649 CarbonylContact C-O 3.31Å; R610-V649 WeakPolarHBondContact CA-O 3.46Å; V611-V649 HydrophobicContact CB-CB 4.42Å; V611-V649 PolarHBondContact N-O 2.97Å; V611-V649 PolarHBondContact O-N 3.05Å; L613-V649 HydrophobicContact CD1-CG2 4.11Å; L613-V649 HydrophobicContact CD2-CG2 3.89Å; L613-V649 HydrophobicContact CG-CG2 4.25Å; V649-F663 HydrophobicContact CG1-CB 3.94Å; V649-F663 HydrophobicContact CG1-CD1 4.08Å; V649-F663 HydrophobicContact CG1-CG 4.5Å; V649-L676 HydrophobicContact CB-CD1 4.12Å; V649-L676 HydrophobicContact CG1-CD1 3.92Å; V649-L676 HydrophobicContact CG2-CD1 4.17Å; V649-I679 HydrophobicContact CB-CG2 4.4Å; V649-I679 HydrophobicContact CG1-CB 4.42Å; V649-I679 HydrophobicContact CG1-CG2 3.93Å; V649-I679 HydrophobicContact CG2-CB 4.41Å; V649-I679 HydrophobicContact CG2-CG2 3.59Å; V649-I683 HydrophobicContact CG2-CD1 3.73Å
650	I	86.8	Confident	79.1	Confident	14 Å²	14	36 Å²	36	7%	0.072	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	121.7	173	-66	175.2	0	0	0	108.2	R608 Q609 F663 S664 P666	R608-I650 HydrophobicContact CG-CG2 3.73Å; Q609-I650 CarbonylContact O-C 3.57Å; Q609-I650 WeakPolarHBondContact O-CA 3.37Å; I650-F663 CarbonylContact O-C 3.56Å; I650-F663 WeakPolarHBondContact O-CA 3.24Å; I650-S664 WeakPolarHBondContact CB-OG 3.06Å; I650-S664 PolarHBondContact N-O 3.31Å; I650-S664 PolarHBondContact O-N 2.29Å; I650-P666 HydrophobicContact CD1-CB 3.96Å; I650-P666 HydrophobicContact CG1-CB 4.28Å
651	M	86.4	Confident	78.5	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	114	172	-167.4	-167.4	-32.8	0	0	109	I570 P604 Q609 V611 V653 K661 R662 F663 Y709	I570-M651 HydrophobicContact CD1-CE 4.23Å; I570-M651 HydrophobicContact CG1-CE 4.4Å; P604-M651 HydrophobicContact CB-SD 4.21Å; Q609-M651 PolarHBondContact N-O 2.92Å; Q609-M651 PolarHBondContact O-N 3.07Å; V611-M651 HydrophobicContact CG2-CB 4.27Å; V611-M651 HydrophobicContact CG2-CE 3.42Å; V611-M651 VanDerWaalsContact CG2-CE 3.42Å; M651-V653 HydrophobicContact CG-CG2 4.05Å; M651-V653 HydrophobicContact SD-CG2 3.68Å; M651-K661 HydrophobicContact CG-CB 4.35Å; M651-K661 HydrophobicContact CG-CG 4.47Å; M651-K661 HydrophobicContact SD-CB 4.46Å; M651-K661 HydrophobicContact SD-CD 3.77Å; M651-K661 HydrophobicContact SD-CG 4Å; M651-R662 WeakPolarHBondContact CA-O 3.3Å; M651-F663 HydrophobicContact CB-CD1 4.32Å; M651-F663 HydrophobicContact CB-CE1 4.3Å; M651-F663 HydrophobicContact CE-CE1 4.23Å; M651-F663 HydrophobicContact CG-CD1 4.07Å; M651-F663 HydrophobicContact CG-CE1 3.7Å; M651-F663 HydrophobicContact CG-CZ 4.41Å; M651-F663 HydrophobicContact SD-CE1 4.13Å; M651-Y709 HydrophobicContact CE-CD1 3.94Å; M651-Y709 HydrophobicContact CE-CD2 3.78Å; M651-Y709 HydrophobicContact CE-CE1 3.82Å; M651-Y709 HydrophobicContact CE-CE2 3.65Å; M651-Y709 HydrophobicContact CE-CG 3.95Å; M651-Y709 HydrophobicContact SD-CE2 4.39Å
652	D	82.8	Confident	78.1	Confident	37 Å²	37	41.1 Å²	41.1	20%	0.198	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	108	168.9	-55.2	-54.9	0	0	0	108.3	R608 L654 R662	R608-D652 WeakPolarHBondContact CG-OD1 3.35Å; R608-D652 IonicContact NE-OD1 2.86Å; R608-D652 PolarHBondContact NE-OD1 3.03Å; D652-L654 HydrophobicContact CB-CD2 4.42Å; D652-L654 PolarHBondContact O-N 2.75Å; D652-R662 HydrophobicContact CB-CB 4.39Å; D652-R662 PolarHBondContact N-O 2.74Å; D652-R662 PolarHBondContact O-N 2.61Å
653	V	80.3	Confident	78.1	Confident	3 Å²	3	41.6 Å²	41.6	2%	0.018	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	100	175.7	-177.8	0	0	0	0	108.5	P604 K605 G607 M651 K661	P604-V653 HydrophobicContact CB-CG2 4.01Å; K605-V653 VanDerWaalsContact O-CB 3.25Å; K605-V653 WeakPolarHBondContact O-CB 3.38Å; K605-V653 WeakPolarHBondContact O-CG1 3.48Å; K605-V653 WeakPolarHBondContact O-CG2 3.25Å; G607-V653 PolarHBondContact N-O 3.39Å; G607-V653 PolarHBondContact O-N 3.34Å; M651-V653 HydrophobicContact CG-CG2 4.05Å; M651-V653 HydrophobicContact SD-CG2 3.68Å; V653-K661 HydrophobicContact CG2-CG 4.47Å
654	L	72.1	Confident	78.1	Confident	89 Å²	89	37.7 Å²	37.7	47%	0.466	21%	0.208	S	C	.	.			trans	-81.6	-13.3	-169.8	-62.2	176.9	0	0	0	114.4	D652 Q660 R662	D652-L654 HydrophobicContact CB-CD2 4.42Å; D652-L654 PolarHBondContact O-N 2.75Å; L654-Q660 HydrophobicContact CD1-CG 4.42Å; L654-Q660 PolarHBondContact N-O 2.93Å; L654-Q660 VanDerWaalsContact N-O 3.12Å; L654-R662 HydrophobicContact CD1-CG 3.99Å
655	V	65.9	Low	78	Confident	13 Å²	13	37.7 Å²	37.7	8%	0.079	21%	0.208	C	C	.	.	S	Bend	trans	-137.5	133.7	-170.5	177.4	0	0	0	0	110.6	D434 G657 G658 Q660	D434-V655 HydrophobicContact CB-CG1 3.68Å; D434-V655 WeakPolarHBondContact O-CG1 3.39Å; V655-G657 PolarHBondContact O-N 3.35Å; V655-G658 PolarHBondContact O-N 3.27Å; V655-Q660 HydrophobicContact CG2-CB 4.19Å
656	P	56.4	Low	77.8	Confident	56 Å²	56	39 Å²	39	36%	0.364	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	117.7	169	-22.9	33.3	0	0	0	112	H437 V606	H437-P656 PolarHBondContact CD2-O 2.89Å; H437-P656 PolarHBondContact NE2-O 2.2Å; V606-P656 HydrophobicContact CG2-CB 4.02Å; V606-P656 HydrophobicContact CG2-CG 4.04Å
657	G	56.9	Low	77.7	Confident	55 Å²	55	38 Å²	38	57%	0.567	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	98.1	2.8	-173.6	0	0	0	0	0	115	V655 A659	V655-G657 PolarHBondContact O-N 3.35Å; G657-A659 PolarHBondContact O-N 3.44Å
658	G	61.3	Low	77.6	Confident	13 Å²	13	37.6 Å²	37.6	13%	0.134	22%	0.221	C	C	.	.	S	Bend	trans	74.9	12.9	155.7	0	0	0	0	0	117.3	V655 K661	V655-G658 PolarHBondContact O-N 3.27Å; G658-K661 VanDerWaalsContact O-CE 3.28Å; G658-K661 WeakPolarHBondContact O-CE 3.48Å; G658-K661 WeakPolarHBondContact O-CG 3.36Å
659	A	62.5	Low	77.3	Confident	71 Å²	71	40.8 Å²	40.8	59%	0.587	24%	0.237	S	C	*	.	S	Bend	trans	-70.8	-33.4	-179	0	0	0	0	0	114	G657	G657-A659 PolarHBondContact O-N 3.44Å
660	Q	67.9	Low	77.1	Confident	97 Å²	97	43.4 Å²	43.4	45%	0.453	25%	0.247	S	C	.	.	S	Bend	trans	-111.3	91.6	174.1	-165.3	160.5	53.2	0	0	111.5	L654 V655	L654-Q660 HydrophobicContact CD1-CG 4.42Å; L654-Q660 PolarHBondContact N-O 2.93Å; L654-Q660 VanDerWaalsContact N-O 3.12Å; V655-Q660 HydrophobicContact CG2-CB 4.19Å
661	K	78.1	Confident	77	Confident	44 Å²	44	46.6 Å²	46.6	19%	0.191	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	141.2	171.2	-61.9	168.7	177.7	172.2	0	109.4	M651 V653 G658 F663 Y709	M651-K661 HydrophobicContact CG-CB 4.35Å; M651-K661 HydrophobicContact CG-CG 4.47Å; M651-K661 HydrophobicContact SD-CB 4.46Å; M651-K661 HydrophobicContact SD-CD 3.77Å; M651-K661 HydrophobicContact SD-CG 4Å; V653-K661 HydrophobicContact CG2-CG 4.47Å; G658-K661 VanDerWaalsContact O-CE 3.28Å; G658-K661 WeakPolarHBondContact O-CE 3.48Å; G658-K661 WeakPolarHBondContact O-CG 3.36Å; K661-F663 HydrophobicContact CB-CE2 4.11Å; K661-F663 HydrophobicContact CB-CZ 4Å; K661-F663 HydrophobicContact CD-CZ 4.11Å; K661-Y709 VanDerWaalsContact CD-OH 3.29Å; K661-Y709 WeakPolarHBondContact CD-OH 3.5Å; K661-Y709 PolarHBondContact NZ-OH 3.42Å
662	R	82.7	Confident	76.7	Confident	112 Å²	112	46.9 Å²	46.9	42%	0.423	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	136.8	161.6	-63.8	-173.5	178.6	-153.7	0.1	108.8	M651 D652 L654	M651-R662 WeakPolarHBondContact CA-O 3.3Å; D652-R662 HydrophobicContact CB-CB 4.39Å; D652-R662 PolarHBondContact N-O 2.74Å; D652-R662 PolarHBondContact O-N 2.61Å; L654-R662 HydrophobicContact CD1-CG 3.99Å
663	F	87.4	Confident	76.1	Confident	13 Å²	13	49 Å²	49	6%	0.057	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	132.4	174	-57.7	-80	0	0	0	108.6	V649 I650 M651 K661 T671 S672 L676 I679 Y709	V649-F663 HydrophobicContact CG1-CB 3.94Å; V649-F663 HydrophobicContact CG1-CD1 4.08Å; V649-F663 HydrophobicContact CG1-CG 4.5Å; I650-F663 CarbonylContact O-C 3.56Å; I650-F663 WeakPolarHBondContact O-CA 3.24Å; M651-F663 HydrophobicContact CB-CD1 4.32Å; M651-F663 HydrophobicContact CB-CE1 4.3Å; M651-F663 HydrophobicContact CE-CE1 4.23Å; M651-F663 HydrophobicContact CG-CD1 4.07Å; M651-F663 HydrophobicContact CG-CE1 3.7Å; M651-F663 HydrophobicContact CG-CZ 4.41Å; M651-F663 HydrophobicContact SD-CE1 4.13Å; K661-F663 HydrophobicContact CB-CE2 4.11Å; K661-F663 HydrophobicContact CB-CZ 4Å; K661-F663 HydrophobicContact CD-CZ 4.11Å; F663-T671 WeakPolarHBondContact O-CA 3.34Å; F663-S672 PolarHBondContact N-O 3.31Å; F663-S672 PolarHBondContact O-N 3.35Å; F663-L676 HydrophobicContact CD1-CB 4.33Å; F663-L676 HydrophobicContact CD1-CD1 3.73Å; F663-L676 HydrophobicContact CE1-CB 4.21Å; F663-L676 HydrophobicContact CE1-CD1 4.03Å; F663-L676 HydrophobicContact CE2-CB 4.5Å; F663-L676 HydrophobicContact CG-CD1 4.39Å; F663-L676 HydrophobicContact CZ-CB 4.31Å; F663-I679 HydrophobicContact CB-CB 4.41Å; F663-I679 HydrophobicContact CB-CG1 3.49Å; F663-I679 VanDerWaalsContact CB-CG1 3.49Å; F663-Y709 AromaticContact CE1-CE1 3.69Å; F663-Y709 HydrophobicContact CE1-CE1 3.69Å; F663-Y709 AromaticContact CZ-CE1 3.91Å; F663-Y709 HydrophobicContact CZ-CE1 3.91Å
664	S	88.1	Confident	75.5	Confident	3 Å²	3	57.2 Å²	57.2	2%	0.021	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	141.2	175.6	57	0	0	0	0	112.6	I650 Y670	I650-S664 WeakPolarHBondContact CB-OG 3.06Å; I650-S664 PolarHBondContact N-O 3.31Å; I650-S664 PolarHBondContact O-N 2.29Å; S664-Y670 CarbonylContact C-O 3.58Å; S664-Y670 VanDerWaalsContact CA-O 3.23Å; S664-Y670 WeakPolarHBondContact CA-O 3.44Å
665	C	88.6	Confident	75.8	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	31%	0.311	C	S	.	.			trans	-75.4	125.2	171.1	-179.2	0	0	0	0	109.8	T667 M669 Y670 I679 H682 I683 H687	C665-T667 VanDerWaalsContact C-N 3.25Å; C665-T667 PolarHBondContact O-N 3.29Å; C665-M669 VanDerWaalsContact O-CA 3.3Å; C665-M669 WeakPolarHBondContact O-CA 3.33Å; C665-M669 PolarHBondContact O-N 3.17Å; C665-Y670 PolarHBondContact N-O 3.21Å; C665-I679 HydrophobicContact CB-CG2 4.34Å; C665-H682 PolarHBondContact SG-NE2 2.96Å; C665-H682 VanDerWaalsContact SG-NE2 3.42Å; C665-I683 HydrophobicContact CB-CG1 4.43Å; C665-H687 VanDerWaalsContact SG-CD2 3.56Å; C665-H687 PolarHBondContact SG-NE2 3.1Å; C665-H687 VanDerWaalsContact SG-NE2 3.35Å
666	P	83.2	Confident	76.7	Confident	33 Å²	33	54.9 Å²	54.9	21%	0.214	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-27.1	-179.5	28.3	-36.7	0	0	0	113.2	H648 I650 M669	H648-P666 WeakPolarHBondContact O-CD 3.4Å; H648-P666 VanDerWaalsContact O-CG 3.24Å; H648-P666 WeakPolarHBondContact O-CG 3.41Å; I650-P666 HydrophobicContact CD1-CB 3.96Å; I650-P666 HydrophobicContact CG1-CB 4.28Å; P666-M669 WeakPolarHBondContact O-CE 3.48Å
667	T	82.5	Confident	78	Confident	80 Å²	80	53.8 Å²	53.8	49%	0.491	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-20.1	-172.2	-42.1	0	0	0	0	113.8	M647 C665	M647-T667 HydrophobicContact CE-CG2 4.46Å; M647-T667 WeakPolarHBondContact CE-OG1 3.48Å; C665-T667 VanDerWaalsContact C-N 3.25Å; C665-T667 PolarHBondContact O-N 3.29Å
668	C	83.4	Confident	79.4	Confident	20 Å²	20	53 Å²	53	14%	0.135	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-151.1	9	-173.9	75.6	0	0	0	0	114.9	Y670 H682 H687 C1440	C668-Y670 PolarHBondContact O-N 3.25Å; C668-H682 VanDerWaalsContact SG-CE1 3.56Å; C668-H682 PolarHBondContact SG-NE2 2.85Å; C668-H687 PolarHBondContact SG-NE2 3.05Å; C668-H687 VanDerWaalsContact SG-NE2 3.44Å; C668-C1440 HydrophobicContact CB-CB 3.88Å; C668-C1440 PolarHBondContact O-SG 3.05Å; C668-C1440 WeakPolarHBondContact SG-CB 3.24Å; C668-C1440 VanDerWaalsContact SG-SG 3.6Å
669	M	82.1	Confident	80.7	Confident	104 Å²	104	52.4 Å²	52.4	51%	0.512	28%	0.284	S	S	.	.			trans	54.7	22.9	-178.2	-58.2	-62.6	119.4	0	0	115.5	C665 P666 T671	C665-M669 VanDerWaalsContact O-CA 3.3Å; C665-M669 WeakPolarHBondContact O-CA 3.33Å; C665-M669 PolarHBondContact O-N 3.17Å; P666-M669 WeakPolarHBondContact O-CE 3.48Å; M669-T671 PolarHBondContact O-N 2.9Å
670	Y	84.5	Confident	82.1	Confident	55 Å²	55	49.8 Å²	49.8	22%	0.216	26%	0.259	C	S	.	.			trans	-61.1	123	172.2	-176.8	-116.3	0	0	0	109.3	S664 C665 C668 I679 H682 C1440	S664-Y670 CarbonylContact C-O 3.58Å; S664-Y670 VanDerWaalsContact CA-O 3.23Å; S664-Y670 WeakPolarHBondContact CA-O 3.44Å; C665-Y670 PolarHBondContact N-O 3.21Å; C668-Y670 PolarHBondContact O-N 3.25Å; Y670-I679 HydrophobicContact CD1-CD1 3.41Å; Y670-I679 VanDerWaalsContact CD1-CD1 3.41Å; Y670-I679 HydrophobicContact CE1-CD1 3.81Å; Y670-I679 HydrophobicContact CG-CD1 4.36Å; Y670-I679 WeakPolarHBondContact O-CD1 3.42Å; Y670-H682 HydrophobicContact CD1-CB 3.47Å; Y670-H682 VanDerWaalsContact CD1-CB 3.47Å; Y670-H682 AromaticContact CD1-CD2 3.9Å; Y670-H682 AromaticContact CD1-CG 3.31Å; Y670-H682 AromaticContact CD1-ND1 3.72Å; Y670-H682 HydrophobicContact CE1-CB 3.77Å; Y670-H682 HydrophobicContact CG-CB 4.36Å; Y670-H682 AromaticContact CG-CG 3.74Å; Y670-H682 AromaticContact CG-ND1 3.74Å; Y670-C1440 VanDerWaalsContact CA-SG 3.54Å; Y670-C1440 WeakPolarHBondContact CB-SG 3.47Å
671	T	83.5	Confident	83.1	Confident	81 Å²	81	47.8 Å²	47.8	50%	0.497	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	136.3	-176.4	34.3	0	0	0	0	111.9	F663 M669	F663-T671 WeakPolarHBondContact O-CA 3.34Å; M669-T671 PolarHBondContact O-N 2.9Å
672	S	79.9	Confident	83.6	Confident	5 Å²	5	46.5 Å²	46.5	4%	0.035	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	135.8	169.9	-174.6	0	0	0	0	110.3	F663 H674	F663-S672 PolarHBondContact N-O 3.31Å; F663-S672 PolarHBondContact O-N 3.35Å; S672-H674 PolarHBondContact OG-N 2.94Å
673	V	71.7	Confident	84	Confident	82 Å²	82	41.2 Å²	41.2	50%	0.497	22%	0.223	S	C	.	.	S	Bend	trans	-100.8	-7.9	172.5	-165.6	0	0	0	0	110.5
674	H	67	Low	84.1	Confident	175 Å²	175	40.6 Å²	40.6	81%	0.81	22%	0.22	S	C	*	.	S	Bend	trans	-89.8	-50.9	-173	-62.4	-64.5	0	0	0	112.7	S672	S672-H674 PolarHBondContact OG-N 2.94Å
675	S	78	Confident	84.2	Confident	35 Å²	35	41.9 Å²	41.9	25%	0.245	24%	0.235	C	C	.	.			trans	-161.5	159	-179.5	77.9	0	0	0	0	113.4	A677 D678	S675-A677 PolarHBondContact O-N 3.28Å; S675-A677 WeakPolarHBondContact OG-CB 3.49Å; S675-A677 PolarHBondContact OG-N 3.17Å; S675-A677 VanDerWaalsContact OG-N 3.17Å; S675-D678 PolarHBondContact N-OD2 3.44Å; S675-D678 PolarHBondContact O-N 2.66Å; S675-D678 PolarHBondContact OG-N 3.24Å; S675-D678 VanDerWaalsContact OG-N 3.08Å; S675-D678 PolarHBondContact OG-OD2 3.5Å
676	L	84.2	Confident	84.1	Confident	19 Å²	19	44.6 Å²	44.6	10%	0.099	25%	0.253	C	S	.	.	H	α-helix	trans	-59.6	-34.5	163.8	-179.2	73	0	0	0	111.4	V649 F663 D678 I679 R680 Y709	V649-L676 HydrophobicContact CB-CD1 4.12Å; V649-L676 HydrophobicContact CG1-CD1 3.92Å; V649-L676 HydrophobicContact CG2-CD1 4.17Å; F663-L676 HydrophobicContact CD1-CB 4.33Å; F663-L676 HydrophobicContact CD1-CD1 3.73Å; F663-L676 HydrophobicContact CE1-CB 4.21Å; F663-L676 HydrophobicContact CE1-CD1 4.03Å; F663-L676 HydrophobicContact CE2-CB 4.5Å; F663-L676 HydrophobicContact CG-CD1 4.39Å; F663-L676 HydrophobicContact CZ-CB 4.31Å; L676-D678 PolarHBondContact O-N 3.43Å; L676-I679 PolarHBondContact O-N 3.28Å; L676-R680 HydrophobicContact CG-CG 4.31Å; L676-R680 WeakPolarHBondContact O-CG 3.36Å; L676-R680 PolarHBondContact O-N 2.99Å; L676-Y709 HydrophobicContact CD2-CD1 3.87Å; L676-Y709 HydrophobicContact CD2-CE1 4.13Å
677	A	85.3	Confident	84.3	Confident	32 Å²	32	45.4 Å²	45.4	26%	0.264	25%	0.254	S	S	.	.	H	α-helix	trans	-63.2	-29.2	-177.7	0	0	0	0	0	112.4	S675 R680 K681	S675-A677 PolarHBondContact O-N 3.28Å; S675-A677 WeakPolarHBondContact OG-CB 3.49Å; S675-A677 PolarHBondContact OG-N 3.17Å; S675-A677 VanDerWaalsContact OG-N 3.17Å; A677-R680 PolarHBondContact O-N 3Å; A677-K681 VanDerWaalsContact O-CG 3.24Å; A677-K681 WeakPolarHBondContact O-CG 3.33Å; A677-K681 PolarHBondContact O-N 3.2Å
678	D	86.3	Confident	84.6	Confident	40 Å²	40	41.9 Å²	41.9	21%	0.214	23%	0.233	C	C	.	.	H	α-helix	trans	-76.5	-33.5	177.4	-54.9	-49.9	0	0	0	112.5	S675 L676 K681 H682	S675-D678 PolarHBondContact N-OD2 3.44Å; S675-D678 PolarHBondContact O-N 2.66Å; S675-D678 PolarHBondContact OG-N 3.24Å; S675-D678 VanDerWaalsContact OG-N 3.08Å; S675-D678 PolarHBondContact OG-OD2 3.5Å; L676-D678 PolarHBondContact O-N 3.43Å; D678-K681 IonicContact OD1-NZ 3.21Å; D678-K681 PolarHBondContact OD1-NZ 3.16Å; D678-H682 WeakPolarHBondContact O-CB 3.28Å; D678-H682 PolarHBondContact O-N 3.44Å
679	I	88.2	Confident	84.7	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-68.7	-39.3	168.1	-60	-52.9	0	0	0	110.8	V649 F663 C665 Y670 L676 H682 I683	V649-I679 HydrophobicContact CB-CG2 4.4Å; V649-I679 HydrophobicContact CG1-CB 4.42Å; V649-I679 HydrophobicContact CG1-CG2 3.93Å; V649-I679 HydrophobicContact CG2-CB 4.41Å; V649-I679 HydrophobicContact CG2-CG2 3.59Å; F663-I679 HydrophobicContact CB-CB 4.41Å; F663-I679 HydrophobicContact CB-CG1 3.49Å; F663-I679 VanDerWaalsContact CB-CG1 3.49Å; C665-I679 HydrophobicContact CB-CG2 4.34Å; Y670-I679 HydrophobicContact CD1-CD1 3.41Å; Y670-I679 VanDerWaalsContact CD1-CD1 3.41Å; Y670-I679 HydrophobicContact CE1-CD1 3.81Å; Y670-I679 HydrophobicContact CG-CD1 4.36Å; Y670-I679 WeakPolarHBondContact O-CD1 3.42Å; L676-I679 PolarHBondContact O-N 3.28Å; I679-H682 WeakPolarHBondContact O-CB 3.29Å; I679-H682 PolarHBondContact O-N 3.25Å; I679-I683 HydrophobicContact CG2-CD1 3.77Å; I679-I683 HydrophobicContact CG2-CG1 4.23Å; I679-I683 WeakPolarHBondContact O-CG1 3.36Å; I679-I683 PolarHBondContact O-N 3.35Å
680	R	90.5	Very high	85	Confident	16 Å²	16	37.1 Å²	37.1	6%	0.06	21%	0.212	C	C	.	.	H	α-helix	trans	-61.9	-46.1	175.5	-72.8	172.1	49.1	-140.9	-13.5	112.1	L613 Y644 L676 A677 H682 I683 M684 L699 S702	L613-R680 HydrophobicContact CD2-CG 3.85Å; Y644-R680 HydrophobicContact CE2-CB 4.43Å; Y644-R680 HydrophobicContact CE2-CG 4.46Å; Y644-R680 WeakPolarHBondContact OH-CD 3.38Å; Y644-R680 WeakPolarHBondContact OH-CG 3.4Å; Y644-R680 PolarHBondContact OH-NE 2.88Å; L676-R680 HydrophobicContact CG-CG 4.31Å; L676-R680 WeakPolarHBondContact O-CG 3.36Å; L676-R680 PolarHBondContact O-N 2.99Å; A677-R680 PolarHBondContact O-N 3Å; R680-H682 VanDerWaalsContact C-N 3.33Å; R680-H682 PolarHBondContact O-N 3.24Å; R680-I683 PolarHBondContact O-N 3.43Å; R680-M684 WeakPolarHBondContact O-CB 3.36Å; R680-M684 VanDerWaalsContact O-CG 3.23Å; R680-M684 WeakPolarHBondContact O-CG 3.38Å; R680-M684 PolarHBondContact O-N 3.05Å; R680-L699 HydrophobicContact CB-CD2 4.19Å; R680-L699 PolarHBondContact NH2-O 3.04Å; R680-L699 VanDerWaalsContact NH2-O 3.09Å; R680-S702 PolarHBondContact NH1-O 3.43Å; R680-S702 PolarHBondContact NH2-O 3.14Å; R680-S702 PolarHBondContact NH2-OG 2.89Å
681	K	90.2	Very high	85	Confident	54 Å²	54	36.4 Å²	36.4	24%	0.235	22%	0.216	C	C	.	.	H	α-helix	trans	-56.1	-45.3	170.5	-71.6	166	-159.9	161.9	0	111.9	A677 D678 G685 F695 L699	A677-K681 VanDerWaalsContact O-CG 3.24Å; A677-K681 WeakPolarHBondContact O-CG 3.33Å; A677-K681 PolarHBondContact O-N 3.2Å; D678-K681 IonicContact OD1-NZ 3.21Å; D678-K681 PolarHBondContact OD1-NZ 3.16Å; K681-G685 PolarHBondContact O-N 2.91Å; K681-F695 HydrophobicContact CB-CE2 4.32Å; K681-F695 HydrophobicContact CG-CD2 4.44Å; K681-L699 HydrophobicContact CG-CD1 3.87Å; K681-L699 HydrophobicContact CG-CD2 4.35Å
682	H	89	Confident	85	Confident	17 Å²	17	37.4 Å²	37.4	8%	0.079	22%	0.221	C	C	.	.	H	α-helix	trans	-59.8	-46	177.3	167.2	75.8	0	0	0	111.9	C665 C668 Y670 D678 I679 R680 S686 H687 C1440	C665-H682 PolarHBondContact SG-NE2 2.96Å; C665-H682 VanDerWaalsContact SG-NE2 3.42Å; C668-H682 VanDerWaalsContact SG-CE1 3.56Å; C668-H682 PolarHBondContact SG-NE2 2.85Å; Y670-H682 HydrophobicContact CD1-CB 3.47Å; Y670-H682 VanDerWaalsContact CD1-CB 3.47Å; Y670-H682 AromaticContact CD1-CD2 3.9Å; Y670-H682 AromaticContact CD1-CG 3.31Å; Y670-H682 AromaticContact CD1-ND1 3.72Å; Y670-H682 HydrophobicContact CE1-CB 3.77Å; Y670-H682 HydrophobicContact CG-CB 4.36Å; Y670-H682 AromaticContact CG-CG 3.74Å; Y670-H682 AromaticContact CG-ND1 3.74Å; D678-H682 WeakPolarHBondContact O-CB 3.28Å; D678-H682 PolarHBondContact O-N 3.44Å; I679-H682 WeakPolarHBondContact O-CB 3.29Å; I679-H682 PolarHBondContact O-N 3.25Å; R680-H682 VanDerWaalsContact C-N 3.33Å; R680-H682 PolarHBondContact O-N 3.24Å; H682-S686 WeakPolarHBondContact CE1-CB 3.33Å; H682-S686 PolarHBondContact CE1-OG 3.38Å; H682-S686 PolarHBondContact ND1-OG 3.03Å; H682-S686 WeakPolarHBondContact O-CA 3.41Å; H682-S686 WeakPolarHBondContact O-CB 3.25Å; H682-S686 PolarHBondContact O-N 3.08Å; H682-S686 PolarHBondContact O-OG 2.99Å; H682-H687 AromaticContact NE2-CD2 2.93Å; H682-H687 PolarHBondContact NE2-CD2 3.02Å; H682-H687 AromaticContact NE2-CE1 3.27Å; H682-H687 PolarHBondContact NE2-CE1 2.69Å; H682-H687 VanDerWaalsContact NE2-CE1 3.27Å; H682-H687 AromaticContact NE2-NE2 2.2Å; H682-H687 PolarHBondContact NE2-NE2 3.47Å; H682-C1440 WeakPolarHBondContact CE1-CB 3.42Å
683	I	89.9	Confident	85.2	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-65.7	-49.4	179	-69.4	171.2	0	0	0	110.4	L613 Y644 M647 V649 C665 I679 R680 G685 S686 H687 C688	L613-I683 HydrophobicContact CD1-CD1 3.85Å; L613-I683 HydrophobicContact CD1-CG2 4.42Å; Y644-I683 HydrophobicContact CD2-CG2 4.1Å; M647-I683 HydrophobicContact CB-CG2 4.2Å; M647-I683 HydrophobicContact CG-CG2 4.34Å; V649-I683 HydrophobicContact CG2-CD1 3.73Å; C665-I683 HydrophobicContact CB-CG1 4.43Å; I679-I683 HydrophobicContact CG2-CD1 3.77Å; I679-I683 HydrophobicContact CG2-CG1 4.23Å; I679-I683 WeakPolarHBondContact O-CG1 3.36Å; I679-I683 PolarHBondContact O-N 3.35Å; R680-I683 PolarHBondContact O-N 3.43Å; I683-G685 VanDerWaalsContact C-N 3.3Å; I683-G685 PolarHBondContact O-N 3.09Å; I683-S686 PolarHBondContact O-N 2.93Å; I683-H687 HydrophobicContact CG2-CB 4.46Å; I683-H687 WeakPolarHBondContact O-CA 3.23Å; I683-H687 PolarHBondContact O-N 2.89Å; I683-C688 PolarHBondContact O-N 3.15Å; I683-C688 PolarHBondContact O-SG 3.18Å
684	M	90.8	Very high	86	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-53.2	-45.4	177.2	-72.9	174.3	173.4	0	0	112.1	M641 Y644 R680 C688 G689 I690 F695 C698 L699 S702	M641-M684 HydrophobicContact SD-CE 4.37Å; Y644-M684 HydrophobicContact CD1-CE 4.46Å; Y644-M684 HydrophobicContact CD2-CE 4.01Å; Y644-M684 HydrophobicContact CD2-CG 3.66Å; Y644-M684 HydrophobicContact CE1-CE 4.07Å; Y644-M684 HydrophobicContact CE2-CE 3.53Å; Y644-M684 HydrophobicContact CE2-CG 3.77Å; Y644-M684 HydrophobicContact CE2-SD 4.44Å; Y644-M684 HydrophobicContact CG-CE 4.45Å; R680-M684 WeakPolarHBondContact O-CB 3.36Å; R680-M684 VanDerWaalsContact O-CG 3.23Å; R680-M684 WeakPolarHBondContact O-CG 3.38Å; R680-M684 PolarHBondContact O-N 3.05Å; M684-C688 CarbonylContact O-C 3.44Å; M684-C688 WeakPolarHBondContact O-CB 3.41Å; M684-G689 PolarHBondContact O-N 3.35Å; M684-I690 HydrophobicContact CB-CB 4.35Å; M684-I690 HydrophobicContact CB-CD1 4.17Å; M684-I690 HydrophobicContact CG-CD1 4.13Å; M684-I690 WeakPolarHBondContact O-CB 3.44Å; M684-I690 PolarHBondContact O-N 2.87Å; M684-F695 HydrophobicContact CB-CD1 4.23Å; M684-F695 HydrophobicContact CB-CE1 3.87Å; M684-C698 HydrophobicContact CE-CB 3.8Å; M684-C698 HydrophobicContact SD-CB 3.86Å; M684-L699 HydrophobicContact CE-CD2 4.02Å; M684-L699 HydrophobicContact CE-CG 4.43Å; M684-L699 HydrophobicContact SD-CD2 3.82Å; M684-L699 HydrophobicContact SD-CG 4.02Å; M684-S702 WeakPolarHBondContact CE-OG 3.38Å
685	G	89.8	Confident	87	Confident	31 Å²	31	33.7 Å²	33.7	32%	0.32	20%	0.195	S	C	.	.	H	α-helix	trans	-80.4	-40.5	179.9	0	0	0	0	0	115.4	K681 I683	K681-G685 PolarHBondContact O-N 2.91Å; I683-G685 VanDerWaalsContact C-N 3.3Å; I683-G685 PolarHBondContact O-N 3.09Å
686	S	85.9	Confident	87.4	Confident	56 Å²	56	34.7 Å²	34.7	39%	0.392	19%	0.193	S	C	.	.	H	α-helix	trans	-98.3	-16.8	-167.7	-46	0	0	0	0	114.6	H682 I683	H682-S686 WeakPolarHBondContact CE1-CB 3.33Å; H682-S686 PolarHBondContact CE1-OG 3.38Å; H682-S686 PolarHBondContact ND1-OG 3.03Å; H682-S686 WeakPolarHBondContact O-CA 3.41Å; H682-S686 WeakPolarHBondContact O-CB 3.25Å; H682-S686 PolarHBondContact O-N 3.08Å; H682-S686 PolarHBondContact O-OG 2.99Å; I683-S686 PolarHBondContact O-N 2.93Å
687	H	88.7	Confident	87.6	Confident	50 Å²	50	34 Å²	34	23%	0.231	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.8	-36.9	-179.1	-58.2	-52.7	0	0	0	111.8	M647 C665 C668 H682 I683	M647-H687 HydrophobicContact CE-CB 3.89Å; C665-H687 VanDerWaalsContact SG-CD2 3.56Å; C665-H687 PolarHBondContact SG-NE2 3.1Å; C665-H687 VanDerWaalsContact SG-NE2 3.35Å; C668-H687 PolarHBondContact SG-NE2 3.05Å; C668-H687 VanDerWaalsContact SG-NE2 3.44Å; H682-H687 AromaticContact NE2-CD2 2.93Å; H682-H687 PolarHBondContact NE2-CD2 3.02Å; H682-H687 AromaticContact NE2-CE1 3.27Å; H682-H687 PolarHBondContact NE2-CE1 2.69Å; H682-H687 VanDerWaalsContact NE2-CE1 3.27Å; H682-H687 AromaticContact NE2-NE2 2.2Å; H682-H687 PolarHBondContact NE2-NE2 3.47Å; I683-H687 HydrophobicContact CG2-CB 4.46Å; I683-H687 WeakPolarHBondContact O-CA 3.23Å; I683-H687 PolarHBondContact O-N 2.89Å
688	C	87.8	Confident	87.8	Confident	7 Å²	7	32.5 Å²	32.5	5%	0.047	18%	0.177	C	C	.	.	S	Bend	trans	-93.6	-3.1	179.4	-44.7	0	0	0	0	114.5	R640 Y644 I683 M684 I690	R640-C688 WeakPolarHBondContact CB-O 3.5Å; R640-C688 VanDerWaalsContact CD-O 3.31Å; R640-C688 WeakPolarHBondContact CD-O 3.49Å; R640-C688 WeakPolarHBondContact CG-O 3.43Å; Y644-C688 VanDerWaalsContact CA-SG 3.59Å; I683-C688 PolarHBondContact O-N 3.15Å; I683-C688 PolarHBondContact O-SG 3.18Å; M684-C688 CarbonylContact O-C 3.44Å; M684-C688 WeakPolarHBondContact O-CB 3.41Å; C688-I690 HydrophobicContact CB-CD1 4.03Å; C688-I690 HydrophobicContact CB-CG1 4.01Å; C688-I690 PolarHBondContact O-N 3.25Å; C688-I690 VanDerWaalsContact O-N 3.16Å
689	G	85.8	Confident	88.1	Confident	18 Å²	18	32.4 Å²	32.4	19%	0.186	18%	0.176	C	C	.	.			trans	60.7	25.5	178	0	0	0	0	0	115.2	P542 R640 M684	P542-G689 WeakPolarHBondContact CG-O 3.19Å; R640-G689 PolarHBondContact NH1-O 3.17Å; M684-G689 PolarHBondContact O-N 3.35Å
690	I	87.6	Confident	88	Confident	5 Å²	5	35.1 Å²	35.1	3%	0.026	19%	0.186	C	C	.	.			trans	-81.2	135.6	179.1	-58.8	175.8	0	0	0	108.9	L637 R640 M641 M684 C688 R694 F695	L637-I690 HydrophobicContact CD2-CG2 4.17Å; R640-I690 HydrophobicContact CB-CD1 4.23Å; R640-I690 HydrophobicContact CB-CG1 3.79Å; M641-I690 HydrophobicContact CG-CD1 4.31Å; M641-I690 HydrophobicContact SD-CD1 3.79Å; M684-I690 HydrophobicContact CB-CB 4.35Å; M684-I690 HydrophobicContact CB-CD1 4.17Å; M684-I690 HydrophobicContact CG-CD1 4.13Å; M684-I690 WeakPolarHBondContact O-CB 3.44Å; M684-I690 PolarHBondContact O-N 2.87Å; C688-I690 HydrophobicContact CB-CD1 4.03Å; C688-I690 HydrophobicContact CB-CG1 4.01Å; C688-I690 PolarHBondContact O-N 3.25Å; C688-I690 VanDerWaalsContact O-N 3.16Å; I690-R694 HydrophobicContact CG2-CB 4.13Å; I690-F695 HydrophobicContact CB-CD1 4.46Å; I690-F695 HydrophobicContact CB-CE1 4.3Å; I690-F695 HydrophobicContact CG2-CD1 4.01Å; I690-F695 HydrophobicContact CG2-CE1 4.34Å; I690-F695 VanDerWaalsContact O-CE1 3.29Å; I690-F695 WeakPolarHBondContact O-CE1 3.38Å
691	S	86	Confident	88	Confident	41 Å²	41	34.3 Å²	34.3	29%	0.287	18%	0.183	S	C	.	.			trans	-71.4	150.4	179.2	75.8	0	0	0	0	111.9	K693 R694 F695	S691-K693 PolarHBondContact O-N 3.15Å; S691-R694 PolarHBondContact O-N 3.44Å; S691-R694 WeakPolarHBondContact OG-CG 3.19Å; S691-F695 VanDerWaalsContact O-CD1 3.23Å; S691-F695 WeakPolarHBondContact O-CD1 3.46Å; S691-F695 PolarHBondContact O-N 3.35Å
692	T	83.4	Confident	88	Confident	101 Å²	101	31.8 Å²	31.8	62%	0.62	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-27.2	179.9	50.4	0	0	0	0	113.1	F695	T692-F695 HydrophobicContact CG2-CD2 4.3Å; T692-F695 HydrophobicContact CG2-CE2 3.85Å; T692-F695 HydrophobicContact CG2-CZ 4.09Å; T692-F695 WeakPolarHBondContact O-CB 3.39Å
693	K	84	Confident	87.9	Confident	104 Å²	104	34.1 Å²	34.1	45%	0.452	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-42.9	173.3	-61.3	-158.8	172.4	-142.2	0	111.2	S691 F695 E784	S691-K693 PolarHBondContact O-N 3.15Å; K693-F695 PolarHBondContact O-N 2.83Å; K693-E784 IonicContact NZ-OE1 2.73Å; K693-E784 PolarHBondContact NZ-OE1 3.47Å
694	R	87	Confident	87.7	Confident	45 Å²	45	34.7 Å²	34.7	17%	0.17	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-9.4	-177.9	-58.1	-61.8	-175.9	-157.8	4.7	114.4	E633 L637 I690 S691 R696 L697 C698	E633-R694 WeakPolarHBondContact OE1-CG 3.38Å; E633-R694 IonicContact OE1-CZ 2.94Å; E633-R694 IonicContact OE1-NE 2.94Å; E633-R694 PolarHBondContact OE1-NE 3.29Å; E633-R694 IonicContact OE1-NH2 3.93Å; E633-R694 PolarHBondContact OE1-NH2 3.19Å; E633-R694 IonicContact OE2-CZ 2.79Å; E633-R694 IonicContact OE2-NE 3.26Å; E633-R694 IonicContact OE2-NH2 3.77Å; E633-R694 PolarHBondContact OE2-NH2 3.19Å; L637-R694 HydrophobicContact CD1-CB 4.39Å; L637-R694 HydrophobicContact CD1-CG 3.92Å; L637-R694 HydrophobicContact CD2-CB 3.91Å; L637-R694 HydrophobicContact CD2-CG 4.06Å; I690-R694 HydrophobicContact CG2-CB 4.13Å; S691-R694 PolarHBondContact O-N 3.44Å; S691-R694 WeakPolarHBondContact OG-CG 3.19Å; R694-R696 PolarHBondContact O-N 3.12Å; R694-L697 PolarHBondContact O-N 3.02Å; R694-L697 VanDerWaalsContact O-N 3.11Å; R694-C698 PolarHBondContact O-N 2.83Å; R694-C698 VanDerWaalsContact O-N 3.13Å; R694-C698 PolarHBondContact O-SG 3.4Å
695	F	89.2	Confident	87.3	Confident	35 Å²	35	36 Å²	36	15%	0.154	19%	0.19	C	C	.	.	H	α-helix	trans	-51.3	-39.4	175.6	-79.5	4.3	0	0	0	113.4	K681 M684 I690 S691 T692 K693 L697 C698 L699	K681-F695 HydrophobicContact CB-CE2 4.32Å; K681-F695 HydrophobicContact CG-CD2 4.44Å; M684-F695 HydrophobicContact CB-CD1 4.23Å; M684-F695 HydrophobicContact CB-CE1 3.87Å; I690-F695 HydrophobicContact CB-CD1 4.46Å; I690-F695 HydrophobicContact CB-CE1 4.3Å; I690-F695 HydrophobicContact CG2-CD1 4.01Å; I690-F695 HydrophobicContact CG2-CE1 4.34Å; I690-F695 VanDerWaalsContact O-CE1 3.29Å; I690-F695 WeakPolarHBondContact O-CE1 3.38Å; S691-F695 VanDerWaalsContact O-CD1 3.23Å; S691-F695 WeakPolarHBondContact O-CD1 3.46Å; S691-F695 PolarHBondContact O-N 3.35Å; T692-F695 HydrophobicContact CG2-CD2 4.3Å; T692-F695 HydrophobicContact CG2-CE2 3.85Å; T692-F695 HydrophobicContact CG2-CZ 4.09Å; T692-F695 WeakPolarHBondContact O-CB 3.39Å; K693-F695 PolarHBondContact O-N 2.83Å; F695-L697 VanDerWaalsContact C-N 3.33Å; F695-L697 PolarHBondContact O-N 2.92Å; F695-C698 PolarHBondContact O-N 3.08Å; F695-L699 VanDerWaalsContact O-CB 3.25Å; F695-L699 WeakPolarHBondContact O-CB 3.39Å; F695-L699 WeakPolarHBondContact O-CG 3.48Å; F695-L699 PolarHBondContact O-N 3.17Å
696	R	86.1	Confident	86.7	Confident	56 Å²	56	39.2 Å²	39.2	21%	0.211	20%	0.204	C	C	.	.	H	α-helix	trans	-60.3	-41.5	-179.9	-77.7	178.3	162.2	-137.4	-7	112.2	R694 R700 L786 E787 T790	R694-R696 PolarHBondContact O-N 3.12Å; R696-R700 WeakPolarHBondContact O-CD 3.29Å; R696-R700 VanDerWaalsContact O-CG 3.26Å; R696-R700 WeakPolarHBondContact O-CG 3.49Å; R696-R700 PolarHBondContact O-N 3.08Å; R696-L786 PolarHBondContact NH1-O 2.78Å; R696-L786 PolarHBondContact NH2-O 2.63Å; R696-E787 PolarHBondContact NE-O 2.77Å; R696-E787 VanDerWaalsContact NE-O 3.08Å; R696-E787 PolarHBondContact NH2-O 2.83Å; R696-T790 PolarHBondContact NH1-OG1 3.28Å; R696-T790 PolarHBondContact NH2-OG1 3.22Å
697	L	87.9	Confident	86.2	Confident	5 Å²	5	39.3 Å²	39.3	3%	0.026	20%	0.202	C	C	.	.	H	α-helix	trans	-70.7	-49.8	178.6	-52.2	-178.6	0	0	0	110.6	F620 L623 L624 Y627 V629 R694 F695 L699 R700 A701	F620-L697 HydrophobicContact CE2-CB 4.28Å; L623-L697 HydrophobicContact CB-CD2 4.49Å; L623-L697 HydrophobicContact CD2-CD2 4.19Å; L624-L697 HydrophobicContact CD2-CD1 4.37Å; Y627-L697 HydrophobicContact CD1-CD2 4.32Å; Y627-L697 HydrophobicContact CD2-CD2 3.37Å; Y627-L697 HydrophobicContact CE2-CD2 3.58Å; Y627-L697 HydrophobicContact CG-CD1 4.44Å; Y627-L697 HydrophobicContact CG-CD2 3.77Å; V629-L697 HydrophobicContact CG2-CD1 4.25Å; R694-L697 PolarHBondContact O-N 3.02Å; R694-L697 VanDerWaalsContact O-N 3.11Å; F695-L697 VanDerWaalsContact C-N 3.33Å; F695-L697 PolarHBondContact O-N 2.92Å; L697-L699 VanDerWaalsContact C-N 3.33Å; L697-L699 PolarHBondContact O-N 2.84Å; L697-R700 PolarHBondContact O-N 3.5Å; L697-R700 VanDerWaalsContact O-N 3.17Å; L697-A701 PolarHBondContact O-N 3.43Å
698	C	91	Very high	85.5	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60.2	-40.9	-178.9	-58.7	0	0	0	0	112.1	M641 M684 R694 F695 S702	M641-C698 HydrophobicContact CE-CB 4.25Å; M641-C698 HydrophobicContact SD-CB 3.65Å; M684-C698 HydrophobicContact CE-CB 3.8Å; M684-C698 HydrophobicContact SD-CB 3.86Å; R694-C698 PolarHBondContact O-N 2.83Å; R694-C698 VanDerWaalsContact O-N 3.13Å; R694-C698 PolarHBondContact O-SG 3.4Å; F695-C698 PolarHBondContact O-N 3.08Å; C698-S702 PolarHBondContact O-N 3.28Å; C698-S702 PolarHBondContact O-OG 3.35Å
699	L	90.5	Very high	85.1	Confident	38 Å²	38	39.3 Å²	39.3	20%	0.199	20%	0.204	C	C	.	.	H	α-helix	trans	-69.1	-32.1	178.3	-73.2	171.8	0	0	0	113.5	R680 K681 M684 F695 L697 S702 R703	R680-L699 HydrophobicContact CB-CD2 4.19Å; R680-L699 PolarHBondContact NH2-O 3.04Å; R680-L699 VanDerWaalsContact NH2-O 3.09Å; K681-L699 HydrophobicContact CG-CD1 3.87Å; K681-L699 HydrophobicContact CG-CD2 4.35Å; M684-L699 HydrophobicContact CE-CD2 4.02Å; M684-L699 HydrophobicContact CE-CG 4.43Å; M684-L699 HydrophobicContact SD-CD2 3.82Å; M684-L699 HydrophobicContact SD-CG 4.02Å; F695-L699 VanDerWaalsContact O-CB 3.25Å; F695-L699 WeakPolarHBondContact O-CB 3.39Å; F695-L699 WeakPolarHBondContact O-CG 3.48Å; F695-L699 PolarHBondContact O-N 3.17Å; L697-L699 VanDerWaalsContact C-N 3.33Å; L697-L699 PolarHBondContact O-N 2.84Å; L699-S702 CarbonylContact O-C 3.5Å; L699-R703 PolarHBondContact O-N 2.77Å
700	R	88	Confident	85	Confident	57 Å²	57	40.8 Å²	40.8	22%	0.215	20%	0.204	C	C	.	.	H	α-helix	trans	-69.8	-49.9	175.3	-76.3	170.8	-178.6	175.1	-0.2	111.3	L623 Y627 R696 L697 S702 R703 H724	L623-R700 HydrophobicContact CD1-CB 3.76Å; Y627-R700 PolarHBondContact OH-NH1 3.08Å; R696-R700 WeakPolarHBondContact O-CD 3.29Å; R696-R700 VanDerWaalsContact O-CG 3.26Å; R696-R700 WeakPolarHBondContact O-CG 3.49Å; R696-R700 PolarHBondContact O-N 3.08Å; L697-R700 PolarHBondContact O-N 3.5Å; L697-R700 VanDerWaalsContact O-N 3.17Å; R700-S702 PolarHBondContact O-N 3.45Å; R700-S702 VanDerWaalsContact O-N 3.17Å; R700-R703 WeakPolarHBondContact O-CB 3.46Å; R700-R703 PolarHBondContact O-N 2.89Å; R700-R703 VanDerWaalsContact O-N 3.16Å; R700-H724 PolarHBondContact NH2-CD2 3.29Å; R700-H724 PolarHBondContact NH2-CE1 2.8Å; R700-H724 PolarHBondContact NH2-NE2 3.32Å
701	A	89.3	Confident	84.9	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.5	-18.8	176.4	0	0	0	0	0	113.7	Y615 S616 V619 F620 L623 L697	Y615-A701 CarbonylContact C-O 3.55Å; Y615-A701 VanDerWaalsContact CA-O 3.32Å; Y615-A701 WeakPolarHBondContact CA-O 3.45Å; S616-A701 PolarHBondContact N-O 2.99Å; V619-A701 HydrophobicContact CG1-CB 4.37Å; F620-A701 HydrophobicContact CB-CB 3.66Å; F620-A701 HydrophobicContact CD2-CB 3.68Å; F620-A701 HydrophobicContact CG-CB 4.03Å; L623-A701 HydrophobicContact CD1-CB 4.32Å; L697-A701 PolarHBondContact O-N 3.43Å
702	S	90.7	Very high	84.8	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	35.6	174.3	56.3	0	0	0	0	113.1	A614 R680 M684 C698 L699 R700 H704	A614-S702 WeakPolarHBondContact O-CB 3.23Å; R680-S702 PolarHBondContact NH1-O 3.43Å; R680-S702 PolarHBondContact NH2-O 3.14Å; R680-S702 PolarHBondContact NH2-OG 2.89Å; M684-S702 WeakPolarHBondContact CE-OG 3.38Å; C698-S702 PolarHBondContact O-N 3.28Å; C698-S702 PolarHBondContact O-OG 3.35Å; L699-S702 CarbonylContact O-C 3.5Å; R700-S702 PolarHBondContact O-N 3.45Å; R700-S702 VanDerWaalsContact O-N 3.17Å; S702-H704 PolarHBondContact O-CE1 2.87Å; S702-H704 PolarHBondContact O-N 2.83Å; S702-H704 PolarHBondContact O-ND1 2.81Å
703	R	87.5	Confident	84.8	Confident	66 Å²	66	37.1 Å²	37.1	25%	0.249	18%	0.18	C	C	.	.			trans	-70.4	101.6	179.7	-165.4	-178.8	174.4	147.4	-3.3	110.6	L699 R700 H712 M717 F720 Y796	L699-R703 PolarHBondContact O-N 2.77Å; R700-R703 WeakPolarHBondContact O-CB 3.46Å; R700-R703 PolarHBondContact O-N 2.89Å; R700-R703 VanDerWaalsContact O-N 3.16Å; R703-H712 PolarHBondContact O-CD2 2.86Å; R703-H712 VanDerWaalsContact O-CD2 3.27Å; R703-H712 PolarHBondContact O-N 2.91Å; R703-H712 VanDerWaalsContact O-N 3.09Å; R703-M717 HydrophobicContact CB-CG 4.45Å; R703-M717 HydrophobicContact CB-SD 4.27Å; R703-F720 VanDerWaalsContact CZ-CE2 3.48Å; R703-Y796 PolarHBondContact NE-OH 2.92Å; R703-Y796 VanDerWaalsContact NH2-CZ 3.26Å; R703-Y796 PolarHBondContact NH2-OH 3.09Å; R703-Y796 VanDerWaalsContact NH2-OH 3.12Å
704	H	85.6	Confident	84.7	Confident	13 Å²	13	33.9 Å²	33.9	6%	0.06	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-86.3	147.3	174.5	-59.2	55	0	0	0	111	A614 S702 Y709 R710	A614-H704 PolarHBondContact N-CE1 2.84Å; A614-H704 PolarHBondContact N-NE2 3.2Å; A614-H704 VanDerWaalsContact N-NE2 3.16Å; A614-H704 PolarHBondContact O-CE1 2.92Å; S702-H704 PolarHBondContact O-CE1 2.87Å; S702-H704 PolarHBondContact O-N 2.83Å; S702-H704 PolarHBondContact O-ND1 2.81Å; H704-Y709 PolarHBondContact CD2-O 3.39Å; H704-R710 CarbonylContact C-O 3.52Å; H704-R710 WeakPolarHBondContact CA-O 3.43Å; H704-R710 WeakPolarHBondContact CB-O 3.31Å
705	D	81.7	Confident	84.5	Confident	27 Å²	27	36.5 Å²	36.5	14%	0.144	19%	0.185	C	C	.	.			trans	-63.9	141.9	165.1	166.1	32.2	0	0	0	111	T707 T708 Y709 R710	D705-T707 VanDerWaalsContact C-N 3.34Å; D705-T707 PolarHBondContact OD1-N 3Å; D705-T707 PolarHBondContact OD1-OG1 3.24Å; D705-T707 PolarHBondContact OD2-N 2.94Å; D705-T707 PolarHBondContact OD2-OG1 2.91Å; D705-T708 WeakPolarHBondContact OD2-CB 3.5Å; D705-T708 WeakPolarHBondContact OD2-CG2 3.5Å; D705-T708 PolarHBondContact OD2-N 3.24Å; D705-T708 PolarHBondContact OD2-OG1 2.91Å; D705-Y709 WeakPolarHBondContact O-CA 3.47Å; D705-Y709 PolarHBondContact O-N 2.89Å; D705-R710 PolarHBondContact N-O 3.2Å
706	T	77.7	Confident	84.2	Confident	100 Å²	100	36.7 Å²	36.7	61%	0.613	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-15	-179.7	65.1	0	0	0	0	114	Y709	T706-Y709 WeakPolarHBondContact O-CE2 3.49Å; T706-Y709 PolarHBondContact O-OH 3.47Å
707	T	74.4	Confident	84.1	Confident	58 Å²	58	34.2 Å²	34.2	36%	0.356	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-57.3	-178.1	73.2	0	0	0	0	112.6	D705 Y709	D705-T707 VanDerWaalsContact C-N 3.34Å; D705-T707 PolarHBondContact OD1-N 3Å; D705-T707 PolarHBondContact OD1-OG1 3.24Å; D705-T707 PolarHBondContact OD2-N 2.94Å; D705-T707 PolarHBondContact OD2-OG1 2.91Å; T707-Y709 WeakPolarHBondContact O-CD2 3.2Å
708	T	75.1	Confident	83.8	Confident	44 Å²	44	35.2 Å²	35.2	27%	0.27	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-14.4	-178.4	64	0	0	0	0	114.4	D705 R710	D705-T708 WeakPolarHBondContact OD2-CB 3.5Å; D705-T708 WeakPolarHBondContact OD2-CG2 3.5Å; D705-T708 PolarHBondContact OD2-N 3.24Å; D705-T708 PolarHBondContact OD2-OG1 2.91Å; T708-R710 PolarHBondContact O-N 2.68Å; T708-R710 PolarHBondContact OG1-N 2.78Å
709	Y	78.9	Confident	83.3	Confident	13 Å²	13	42.8 Å²	42.8	5%	0.051	21%	0.209	C	C	.	.			trans	59	21.8	-173.6	-62.9	-96.2	0	0	0	114.4	G569 I570 P604 V611 M651 K661 F663 L676 H704 D705 T706 T707	G569-Y709 WeakPolarHBondContact CA-O 3.42Å; G569-Y709 PolarHBondContact N-O 2.68Å; I570-Y709 HydrophobicContact CD1-CD2 3.84Å; I570-Y709 HydrophobicContact CG1-CD2 3.99Å; I570-Y709 HydrophobicContact CG1-CG 4.25Å; P604-Y709 HydrophobicContact CG-CE2 4.03Å; V611-Y709 HydrophobicContact CG1-CD1 4.16Å; V611-Y709 HydrophobicContact CG1-CG 4.42Å; V611-Y709 HydrophobicContact CG2-CD1 4Å; V611-Y709 HydrophobicContact CG2-CG 4.17Å; M651-Y709 HydrophobicContact CE-CD1 3.94Å; M651-Y709 HydrophobicContact CE-CD2 3.78Å; M651-Y709 HydrophobicContact CE-CE1 3.82Å; M651-Y709 HydrophobicContact CE-CE2 3.65Å; M651-Y709 HydrophobicContact CE-CG 3.95Å; M651-Y709 HydrophobicContact SD-CE2 4.39Å; K661-Y709 VanDerWaalsContact CD-OH 3.29Å; K661-Y709 WeakPolarHBondContact CD-OH 3.5Å; K661-Y709 PolarHBondContact NZ-OH 3.42Å; F663-Y709 AromaticContact CE1-CE1 3.69Å; F663-Y709 HydrophobicContact CE1-CE1 3.69Å; F663-Y709 AromaticContact CZ-CE1 3.91Å; F663-Y709 HydrophobicContact CZ-CE1 3.91Å; L676-Y709 HydrophobicContact CD2-CD1 3.87Å; L676-Y709 HydrophobicContact CD2-CE1 4.13Å; H704-Y709 PolarHBondContact CD2-O 3.39Å; D705-Y709 WeakPolarHBondContact O-CA 3.47Å; D705-Y709 PolarHBondContact O-N 2.89Å; T706-Y709 WeakPolarHBondContact O-CE2 3.49Å; T706-Y709 PolarHBondContact O-OH 3.47Å; T707-Y709 WeakPolarHBondContact O-CD2 3.2Å
710	R	83.1	Confident	82.7	Confident	48 Å²	48	43.7 Å²	43.7	18%	0.181	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-89.4	156.7	168.7	-68.2	-167.5	155.7	125.3	-5.5	111.6	R567 A586 F602 H704 D705 T708	R567-R710 CarbonylContact O-C 3.57Å; R567-R710 WeakPolarHBondContact O-CA 3.21Å; A586-R710 PolarHBondContact O-NH2 2.82Å; F602-R710 VanDerWaalsContact CD2-NH1 3.28Å; F602-R710 VanDerWaalsContact CE1-NH2 3.29Å; F602-R710 VanDerWaalsContact CE2-NH2 3.3Å; H704-R710 CarbonylContact C-O 3.52Å; H704-R710 WeakPolarHBondContact CA-O 3.43Å; H704-R710 WeakPolarHBondContact CB-O 3.31Å; D705-R710 PolarHBondContact N-O 3.2Å; T708-R710 PolarHBondContact O-N 2.68Å; T708-R710 PolarHBondContact OG1-N 2.78Å
711	L	86.3	Confident	82.2	Confident	11 Å²	11	42.4 Å²	42.4	6%	0.058	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-60.8	140.3	165.9	-167.2	69.7	0	0	0	109.9	R567 A614 M717	R567-L711 HydrophobicContact CB-CB 4.19Å; R567-L711 HydrophobicContact CG-CB 4.4Å; R567-L711 WeakPolarHBondContact O-CB 3.4Å; R567-L711 PolarHBondContact O-N 2.81Å; A614-L711 HydrophobicContact CB-CB 4.15Å; A614-L711 HydrophobicContact CB-CD2 4.35Å; L711-M717 HydrophobicContact CD1-CE 4.23Å; L711-M717 HydrophobicContact CD1-SD 3.89Å; L711-M717 HydrophobicContact CD2-CE 3.98Å; L711-M717 HydrophobicContact CG-CE 3.85Å; L711-M717 HydrophobicContact CG-SD 4.1Å
712	H	84.1	Confident	81.7	Confident	18 Å²	18	45.9 Å²	45.9	8%	0.083	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-62	163.4	169.6	-81	-71.6	0	0	0	111.3	R703 R716 M717 Y796	R703-H712 PolarHBondContact O-CD2 2.86Å; R703-H712 VanDerWaalsContact O-CD2 3.27Å; R703-H712 PolarHBondContact O-N 2.91Å; R703-H712 VanDerWaalsContact O-N 3.09Å; H712-R716 PolarHBondContact CE1-NH1 3.4Å; H712-M717 HydrophobicContact CB-CG 3.81Å; H712-M717 HydrophobicContact CB-SD 4.29Å; H712-M717 WeakPolarHBondContact O-CE 3.31Å; H712-Y796 AromaticContact CE1-CE1 3.95Å; H712-Y796 AromaticContact NE2-CE1 3.83Å; H712-Y796 AromaticContact NE2-CZ 3.64Å; H712-Y796 PolarHBondContact NE2-OH 2.89Å
713	S	81.9	Confident	81	Confident	41 Å²	41	48.6 Å²	48.6	29%	0.287	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-65.2	150.2	170	60	0	0	0	0	111.3	D715 R716 M717	S713-D715 VanDerWaalsContact C-N 3.31Å; S713-D715 PolarHBondContact O-N 2.78Å; S713-R716 PolarHBondContact O-N 3.02Å; S713-R716 VanDerWaalsContact O-N 3.1Å; S713-R716 WeakPolarHBondContact OG-CB 2.88Å; S713-M717 PolarHBondContact O-N 2.9Å
714	D	83.6	Confident	80.2	Confident	37 Å²	37	47.1 Å²	47.1	20%	0.198	24%	0.237	C	C	.	.	H	α-helix	trans	-58.8	-42.7	-176.2	-59.4	-82.6	0	0	0	111.3	R567 S616 R716 M717 I718	R567-D714 IonicContact CZ-OD2 2.71Å; R567-D714 IonicContact NE-OD2 2.66Å; R567-D714 IonicContact NH2-OD2 3.66Å; R567-D714 PolarHBondContact NH2-OD2 3.25Å; S616-D714 WeakPolarHBondContact CB-OD1 3.3Å; S616-D714 PolarHBondContact OG-OD1 3.05Å; D714-R716 VanDerWaalsContact C-N 3.3Å; D714-R716 PolarHBondContact O-N 2.97Å; D714-M717 CarbonylContact O-C 3.53Å; D714-M717 PolarHBondContact O-N 3.19Å; D714-M717 VanDerWaalsContact O-N 3.13Å; D714-I718 WeakPolarHBondContact O-CB 3.2Å; D714-I718 VanDerWaalsContact O-CG1 3.23Å; D714-I718 WeakPolarHBondContact O-CG1 3.28Å; D714-I718 PolarHBondContact O-N 3.2Å
715	D	81.5	Confident	79.6	Confident	100 Å²	100	53.7 Å²	53.7	54%	0.535	26%	0.261	S	S	.	.	H	α-helix	trans	-64.8	-32.6	177.8	-33.8	-78.8	0	0	0	112.7	S713 R719	S713-D715 VanDerWaalsContact C-N 3.31Å; S713-D715 PolarHBondContact O-N 2.78Å; D715-R719 WeakPolarHBondContact O-CB 3.37Å; D715-R719 WeakPolarHBondContact O-CG 3.43Å; D715-R719 PolarHBondContact O-N 3.32Å; D715-R719 PolarHBondContact O-NE 3.01Å
716	R	83	Confident	79.2	Confident	38 Å²	38	58.2 Å²	58.2	14%	0.143	28%	0.276	C	S	.	.	H	α-helix	trans	-73.8	-37.2	175.3	-167.4	172.2	-172	170.7	7.6	110.6	H712 S713 D714 F720 D798	H712-R716 PolarHBondContact CE1-NH1 3.4Å; S713-R716 PolarHBondContact O-N 3.02Å; S713-R716 VanDerWaalsContact O-N 3.1Å; S713-R716 WeakPolarHBondContact OG-CB 2.88Å; D714-R716 VanDerWaalsContact C-N 3.3Å; D714-R716 PolarHBondContact O-N 2.97Å; R716-F720 HydrophobicContact CG-CD2 4.41Å; R716-F720 HydrophobicContact CG-CE2 3.82Å; R716-F720 HydrophobicContact CG-CZ 4.19Å; R716-F720 WeakPolarHBondContact O-CD2 3.4Å; R716-F720 WeakPolarHBondContact O-CG 3.28Å; R716-F720 PolarHBondContact O-N 3.29Å; R716-D798 IonicContact CZ-OD1 3.45Å; R716-D798 IonicContact CZ-OD2 3.66Å; R716-D798 IonicContact NH1-OD1 3.98Å; R716-D798 PolarHBondContact NH1-OD1 3.5Å; R716-D798 IonicContact NH1-OD2 2.77Å; R716-D798 PolarHBondContact NH1-OD2 3.25Å; R716-D798 IonicContact NH2-OD1 3.74Å; R716-D798 PolarHBondContact NH2-OD1 3.41Å; R716-D798 IonicContact NH2-OD2 3Å; R716-D798 PolarHBondContact NH2-OD2 3.49Å
717	M	84.4	Confident	78.9	Confident	4 Å²	4	58.7 Å²	58.7	2%	0.02	27%	0.267	C	S	.	.	H	α-helix	trans	-70.7	-39.2	173.6	-70.1	-173.8	-66.5	0	0	112.7	S616 V619 R703 L711 H712 S713 D714 F720 V721	S616-M717 VanDerWaalsContact CB-CE 3.47Å; V619-M717 HydrophobicContact CG1-CB 4.15Å; V619-M717 HydrophobicContact CG2-CB 3.81Å; V619-M717 HydrophobicContact CG2-CE 4.19Å; R703-M717 HydrophobicContact CB-CG 4.45Å; R703-M717 HydrophobicContact CB-SD 4.27Å; L711-M717 HydrophobicContact CD1-CE 4.23Å; L711-M717 HydrophobicContact CD1-SD 3.89Å; L711-M717 HydrophobicContact CD2-CE 3.98Å; L711-M717 HydrophobicContact CG-CE 3.85Å; L711-M717 HydrophobicContact CG-SD 4.1Å; H712-M717 HydrophobicContact CB-CG 3.81Å; H712-M717 HydrophobicContact CB-SD 4.29Å; H712-M717 WeakPolarHBondContact O-CE 3.31Å; S713-M717 PolarHBondContact O-N 2.9Å; D714-M717 CarbonylContact O-C 3.53Å; D714-M717 PolarHBondContact O-N 3.19Å; D714-M717 VanDerWaalsContact O-N 3.13Å; M717-F720 PolarHBondContact O-N 3.38Å; M717-V721 WeakPolarHBondContact O-CG2 3.43Å; M717-V721 PolarHBondContact O-N 2.83Å
718	I	81.7	Confident	78.6	Confident	27 Å²	27	58.3 Å²	58.3	14%	0.138	26%	0.261	C	S	.	.	H	α-helix	trans	-58.3	-52.4	172.5	-70.9	161.2	0	0	0	109.6	V619 D714 F720 V721 E722	V619-I718 HydrophobicContact CG2-CG1 4.03Å; D714-I718 WeakPolarHBondContact O-CB 3.2Å; D714-I718 VanDerWaalsContact O-CG1 3.23Å; D714-I718 WeakPolarHBondContact O-CG1 3.28Å; D714-I718 PolarHBondContact O-N 3.2Å; I718-F720 VanDerWaalsContact C-N 3.29Å; I718-F720 PolarHBondContact O-N 2.84Å; I718-V721 WeakPolarHBondContact O-CA 3.5Å; I718-V721 WeakPolarHBondContact O-CB 3.42Å; I718-V721 PolarHBondContact O-N 2.97Å; I718-E722 HydrophobicContact CG2-CG 4.21Å; I718-E722 WeakPolarHBondContact CG2-OE1 3.43Å; I718-E722 WeakPolarHBondContact O-CG 3.5Å; I718-E722 PolarHBondContact O-N 3.44Å
719	R	80.9	Confident	78.3	Confident	158 Å²	158	59.1 Å²	59.1	60%	0.596	26%	0.263	S	S	*	.	H	α-helix	trans	-56.9	-38.5	177.2	-77.3	-176.5	-75	173.3	-7.4	113.2	D715 D723	D715-R719 WeakPolarHBondContact O-CB 3.37Å; D715-R719 WeakPolarHBondContact O-CG 3.43Å; D715-R719 PolarHBondContact O-N 3.32Å; D715-R719 PolarHBondContact O-NE 3.01Å; R719-D723 WeakPolarHBondContact O-CB 3.44Å; R719-D723 PolarHBondContact O-N 3.27Å
720	F	78.2	Confident	77.6	Confident	57 Å²	57	63.2 Å²	63.2	25%	0.25	28%	0.283	C	S	.	.	H	α-helix	trans	-66.9	-31.7	173.1	-69.5	-45.4	0	0	0	113.9	R703 R716 M717 I718 H724 Y796	R703-F720 VanDerWaalsContact CZ-CE2 3.48Å; R716-F720 HydrophobicContact CG-CD2 4.41Å; R716-F720 HydrophobicContact CG-CE2 3.82Å; R716-F720 HydrophobicContact CG-CZ 4.19Å; R716-F720 WeakPolarHBondContact O-CD2 3.4Å; R716-F720 WeakPolarHBondContact O-CG 3.28Å; R716-F720 PolarHBondContact O-N 3.29Å; M717-F720 PolarHBondContact O-N 3.38Å; I718-F720 VanDerWaalsContact C-N 3.29Å; I718-F720 PolarHBondContact O-N 2.84Å; F720-H724 PolarHBondContact O-N 3.03Å; F720-Y796 HydrophobicContact CZ-CE1 4.24Å
721	V	77.3	Confident	76.5	Confident	30 Å²	30	64.7 Å²	64.7	18%	0.182	29%	0.294	C	S	.	.	H	α-helix	trans	-75.6	-42.1	175.9	170.6	0	0	0	0	110.8	V619 L623 M717 I718 H724 R725	V619-V721 HydrophobicContact CG1-CG2 4.4Å; L623-V721 HydrophobicContact CD1-CG2 4.1Å; L623-V721 HydrophobicContact CD2-CB 4.43Å; L623-V721 HydrophobicContact CD2-CG1 3.62Å; L623-V721 HydrophobicContact CD2-CG2 3.85Å; L623-V721 HydrophobicContact CG-CG1 4.26Å; L623-V721 HydrophobicContact CG-CG2 4.09Å; M717-V721 WeakPolarHBondContact O-CG2 3.43Å; M717-V721 PolarHBondContact O-N 2.83Å; I718-V721 WeakPolarHBondContact O-CA 3.5Å; I718-V721 WeakPolarHBondContact O-CB 3.42Å; I718-V721 PolarHBondContact O-N 2.97Å; V721-H724 PolarHBondContact O-N 3.16Å; V721-R725 PolarHBondContact O-N 2.82Å
722	E	78	Confident	75	Confident	74 Å²	74	67.9 Å²	67.9	35%	0.346	31%	0.314	S	S	.	.	H	α-helix	trans	-67.5	-41.7	177.2	-70	178.2	-167.3	0	0	113.3	I718 H724 R725 R726	I718-E722 HydrophobicContact CG2-CG 4.21Å; I718-E722 WeakPolarHBondContact CG2-OE1 3.43Å; I718-E722 WeakPolarHBondContact O-CG 3.5Å; I718-E722 PolarHBondContact O-N 3.44Å; E722-H724 VanDerWaalsContact C-N 3.31Å; E722-H724 PolarHBondContact O-N 2.9Å; E722-R725 CarbonylContact O-C 3.58Å; E722-R725 WeakPolarHBondContact O-CA 3.4Å; E722-R725 WeakPolarHBondContact O-CB 3.47Å; E722-R725 PolarHBondContact O-N 2.89Å; E722-R726 WeakPolarHBondContact O-CG 3.47Å; E722-R726 PolarHBondContact O-N 3.05Å; E722-R726 IonicContact OE2-CZ 2.7Å; E722-R726 IonicContact OE2-NH1 2.66Å; E722-R726 PolarHBondContact OE2-NH1 3.34Å; E722-R726 IonicContact OE2-NH2 3.63Å; E722-R726 PolarHBondContact OE2-NH2 2.78Å
723	D	75.6	Confident	73.4	Confident	56 Å²	56	71 Å²	71	30%	0.299	33%	0.331	S	S	.	.	H	α-helix	trans	-59.5	-44.5	173.6	172.6	40.4	0	0	0	110.5	R719 R725 R726 R727	R719-D723 WeakPolarHBondContact O-CB 3.44Å; R719-D723 PolarHBondContact O-N 3.27Å; D723-R725 VanDerWaalsContact C-N 3.3Å; D723-R725 PolarHBondContact O-N 3.41Å; D723-R726 PolarHBondContact O-N 3.32Å; D723-R727 VanDerWaalsContact O-CG 3.3Å; D723-R727 WeakPolarHBondContact O-CG 3.42Å; D723-R727 PolarHBondContact O-N 3.09Å; D723-R727 IonicContact OD1-CZ 3.78Å; D723-R727 IonicContact OD1-NE 2.69Å; D723-R727 PolarHBondContact OD1-NE 3.14Å; D723-R727 IonicContact OD1-NH2 3.25Å; D723-R727 IonicContact OD2-CZ 2.77Å; D723-R727 IonicContact OD2-NE 3.89Å; D723-R727 PolarHBondContact OD2-NE 3.18Å; D723-R727 VanDerWaalsContact OD2-NE 3.1Å; D723-R727 IonicContact OD2-NH2 2.8Å; D723-R727 PolarHBondContact OD2-NH2 3.48Å
724	H	71.1	Confident	71.8	Confident	36 Å²	36	70.2 Å²	70.2	17%	0.167	33%	0.327	C	S	.	.	H	α-helix	trans	-59.9	-38.5	171.8	-172.8	-77.3	0	0	0	112.6	R700 F720 V721 E722 Q728	R700-H724 PolarHBondContact NH2-CD2 3.29Å; R700-H724 PolarHBondContact NH2-CE1 2.8Å; R700-H724 PolarHBondContact NH2-NE2 3.32Å; F720-H724 PolarHBondContact O-N 3.03Å; V721-H724 PolarHBondContact O-N 3.16Å; E722-H724 VanDerWaalsContact C-N 3.31Å; E722-H724 PolarHBondContact O-N 2.9Å; H724-Q728 VanDerWaalsContact CE1-CD 3.42Å; H724-Q728 PolarHBondContact CE1-OE1 2.81Å; H724-Q728 PolarHBondContact ND1-OE1 3.39Å; H724-Q728 WeakPolarHBondContact O-CB 3.49Å; H724-Q728 WeakPolarHBondContact O-CG 3.48Å; H724-Q728 PolarHBondContact O-N 3.3Å
725	R	72	Confident	70.1	Confident	151 Å²	151	73.6 Å²	73.6	57%	0.57	34%	0.337	S	S	*	.	H	α-helix	trans	-66.6	-42.9	174	175.9	177.2	157.4	113	1.1	111.8	V721 E722 D723 R727 Q728 I729	V721-R725 PolarHBondContact O-N 2.82Å; E722-R725 CarbonylContact O-C 3.58Å; E722-R725 WeakPolarHBondContact O-CA 3.4Å; E722-R725 WeakPolarHBondContact O-CB 3.47Å; E722-R725 PolarHBondContact O-N 2.89Å; D723-R725 VanDerWaalsContact C-N 3.3Å; D723-R725 PolarHBondContact O-N 3.41Å; R725-R727 PolarHBondContact O-N 3.4Å; R725-Q728 CarbonylContact O-C 3.6Å; R725-Q728 WeakPolarHBondContact O-CA 3.46Å; R725-Q728 PolarHBondContact O-N 3.37Å; R725-I729 HydrophobicContact CG-CD1 3.81Å; R725-I729 HydrophobicContact CG-CG1 4.28Å; R725-I729 WeakPolarHBondContact O-CG1 3.38Å; R725-I729 PolarHBondContact O-N 3.47Å
726	R	73.8	Confident	68.5	Low	122 Å²	122	71.7 Å²	71.7	46%	0.46	33%	0.332	S	S	.	.	H	α-helix	trans	-58.9	-46.2	175.3	-75.2	-177	-86.7	-94.3	-0.1	110.4	E722 D723 Q728 I729 Q730	E722-R726 WeakPolarHBondContact O-CG 3.47Å; E722-R726 PolarHBondContact O-N 3.05Å; E722-R726 IonicContact OE2-CZ 2.7Å; E722-R726 IonicContact OE2-NH1 2.66Å; E722-R726 PolarHBondContact OE2-NH1 3.34Å; E722-R726 IonicContact OE2-NH2 3.63Å; E722-R726 PolarHBondContact OE2-NH2 2.78Å; D723-R726 PolarHBondContact O-N 3.32Å; R726-Q728 VanDerWaalsContact C-N 3.31Å; R726-Q728 PolarHBondContact O-N 3.5Å; R726-I729 PolarHBondContact O-N 3.16Å; R726-Q730 WeakPolarHBondContact O-CB 3.37Å; R726-Q730 VanDerWaalsContact O-CG 3.25Å; R726-Q730 WeakPolarHBondContact O-CG 3.48Å; R726-Q730 PolarHBondContact O-N 3.14Å; R726-Q730 VanDerWaalsContact O-N 3.09Å
727	R	71.6	Confident	66.5	Low	110 Å²	110	74.6 Å²	74.6	42%	0.415	35%	0.35	S	S	.	.	H	α-helix	trans	-62.1	-31.9	172.6	-64.1	176.5	-163.7	-160.1	10.4	113.3	D723 R725 L731 D794	D723-R727 VanDerWaalsContact O-CG 3.3Å; D723-R727 WeakPolarHBondContact O-CG 3.42Å; D723-R727 PolarHBondContact O-N 3.09Å; D723-R727 IonicContact OD1-CZ 3.78Å; D723-R727 IonicContact OD1-NE 2.69Å; D723-R727 PolarHBondContact OD1-NE 3.14Å; D723-R727 IonicContact OD1-NH2 3.25Å; D723-R727 IonicContact OD2-CZ 2.77Å; D723-R727 IonicContact OD2-NE 3.89Å; D723-R727 PolarHBondContact OD2-NE 3.18Å; D723-R727 VanDerWaalsContact OD2-NE 3.1Å; D723-R727 IonicContact OD2-NH2 2.8Å; D723-R727 PolarHBondContact OD2-NH2 3.48Å; R725-R727 PolarHBondContact O-N 3.4Å; R727-L731 WeakPolarHBondContact O-CG 3.37Å; R727-L731 PolarHBondContact O-N 2.75Å; R727-D794 IonicContact CZ-OD1 3.62Å; R727-D794 IonicContact NH1-OD1 2.74Å; R727-D794 PolarHBondContact NH1-OD1 2.68Å; R727-D794 IonicContact NH1-OD2 3.52Å; R727-D794 IonicContact NH2-OD1 3.41Å
728	Q	67.4	Low	64.8	Low	50 Å²	50	78.9 Å²	78.9	23%	0.234	37%	0.372	C	S	.	.	H	α-helix	trans	-78.5	-37.6	175.1	-78.9	-165.9	-85	0	0	114.2	Y627 H724 R725 R726 Q730 L731 T732 L786	Y627-Q728 PolarHBondContact OH-OE1 2.92Å; Y627-Q728 VanDerWaalsContact OH-OE1 3.05Å; H724-Q728 VanDerWaalsContact CE1-CD 3.42Å; H724-Q728 PolarHBondContact CE1-OE1 2.81Å; H724-Q728 PolarHBondContact ND1-OE1 3.39Å; H724-Q728 WeakPolarHBondContact O-CB 3.49Å; H724-Q728 WeakPolarHBondContact O-CG 3.48Å; H724-Q728 PolarHBondContact O-N 3.3Å; R725-Q728 CarbonylContact O-C 3.6Å; R725-Q728 WeakPolarHBondContact O-CA 3.46Å; R725-Q728 PolarHBondContact O-N 3.37Å; R726-Q728 VanDerWaalsContact C-N 3.31Å; R726-Q728 PolarHBondContact O-N 3.5Å; Q728-Q730 VanDerWaalsContact C-N 3.3Å; Q728-L731 HydrophobicContact CG-CD1 4.45Å; Q728-L731 CarbonylContact O-C 3.57Å; Q728-L731 WeakPolarHBondContact O-CA 3.45Å; Q728-L731 VanDerWaalsContact O-CB 3.24Å; Q728-L731 WeakPolarHBondContact O-CB 3.36Å; Q728-L731 PolarHBondContact O-N 2.92Å; Q728-T732 PolarHBondContact O-N 2.99Å; Q728-T732 PolarHBondContact O-OG1 2.86Å; Q728-L786 VanDerWaalsContact NE2-CD2 3.33Å
729	I	69.2	Low	62.9	Low	61 Å²	61	86.6 Å²	86.6	31%	0.313	40%	0.404	S	S	.	.	H	α-helix	trans	-63.4	-43.4	174.5	-71.6	171.4	0	0	0	109.3	R725 R726 L731 T732 D733	R725-I729 HydrophobicContact CG-CD1 3.81Å; R725-I729 HydrophobicContact CG-CG1 4.28Å; R725-I729 WeakPolarHBondContact O-CG1 3.38Å; R725-I729 PolarHBondContact O-N 3.47Å; R726-I729 PolarHBondContact O-N 3.16Å; I729-L731 PolarHBondContact O-N 3.46Å; I729-L731 VanDerWaalsContact O-N 3.08Å; I729-T732 WeakPolarHBondContact CA-OG1 3.09Å; I729-T732 PolarHBondContact O-N 2.84Å; I729-T732 PolarHBondContact O-OG1 3.02Å; I729-D733 WeakPolarHBondContact CG2-OD2 3.41Å; I729-D733 PolarHBondContact O-N 3.38Å
730	Q	64.8	Low	60.9	Low	99 Å²	99	85 Å²	85	46%	0.463	41%	0.412	S	S	.	.	H	α-helix	trans	-59.6	-20.5	169.3	-66.6	168.8	12	0	0	113.8	R726 Q728 R909	R726-Q730 WeakPolarHBondContact O-CB 3.37Å; R726-Q730 VanDerWaalsContact O-CG 3.25Å; R726-Q730 WeakPolarHBondContact O-CG 3.48Å; R726-Q730 PolarHBondContact O-N 3.14Å; R726-Q730 VanDerWaalsContact O-N 3.09Å; Q728-Q730 VanDerWaalsContact C-N 3.3Å; Q730-R909 PolarHBondContact O-NE 2.72Å; Q730-R909 VanDerWaalsContact O-NE 3.16Å; Q730-R909 PolarHBondContact O-NH1 2.68Å; Q730-R909 PolarHBondContact O-NH2 3.44Å
731	L	59.3	Low	58.8	Low	79 Å²	79	86.9 Å²	86.9	41%	0.414	43%	0.429	S	S	.	.	H	α-helix	trans	-80.8	-37.5	170.4	-75.5	163.2	0	0	0	112.5	R727 Q728 I729 L786 R909	R727-L731 WeakPolarHBondContact O-CG 3.37Å; R727-L731 PolarHBondContact O-N 2.75Å; Q728-L731 HydrophobicContact CG-CD1 4.45Å; Q728-L731 CarbonylContact O-C 3.57Å; Q728-L731 WeakPolarHBondContact O-CA 3.45Å; Q728-L731 VanDerWaalsContact O-CB 3.24Å; Q728-L731 WeakPolarHBondContact O-CB 3.36Å; Q728-L731 PolarHBondContact O-N 2.92Å; I729-L731 PolarHBondContact O-N 3.46Å; I729-L731 VanDerWaalsContact O-N 3.08Å; L731-L786 HydrophobicContact CD1-CD2 4.31Å; L731-R909 VanDerWaalsContact CG-NH2 3.33Å
732	T	55.1	Low	56.8	Low	78 Å²	78	90.6 Å²	90.6	48%	0.479	46%	0.456	S	S	.	.	H	α-helix	trans	-81.5	-41.8	-175.1	48.3	0	0	0	0	113.3	Q728 I729 A734 R735 S736	Q728-T732 PolarHBondContact O-N 2.99Å; Q728-T732 PolarHBondContact O-OG1 2.86Å; I729-T732 WeakPolarHBondContact CA-OG1 3.09Å; I729-T732 PolarHBondContact O-N 2.84Å; I729-T732 PolarHBondContact O-OG1 3.02Å; T732-A734 PolarHBondContact O-N 2.69Å; T732-R735 CarbonylContact O-C 3.5Å; T732-R735 WeakPolarHBondContact O-CA 3.22Å; T732-R735 WeakPolarHBondContact O-CB 3.28Å; T732-R735 PolarHBondContact O-N 3.25Å; T732-S736 PolarHBondContact O-N 3.41Å
733	D	50.7	Low	54.9	Low	82 Å²	82	94.8 Å²	94.8	44%	0.439	48%	0.481	S	S	.	.	H	α-helix	trans	-71.5	-28.9	-173.5	-53.2	-1.7	0	0	0	110.5	I729 R735 S736 N737	I729-D733 WeakPolarHBondContact CG2-OD2 3.41Å; I729-D733 PolarHBondContact O-N 3.38Å; D733-R735 PolarHBondContact O-N 3.11Å; D733-S736 WeakPolarHBondContact CA-OG 3.17Å; D733-S736 PolarHBondContact O-OG 3.32Å; D733-N737 PolarHBondContact O-N 2.75Å
734	A	49.1	Very low	52.9	Low	25 Å²	25	99.5 Å²	99.5	21%	0.207	51%	0.506	C	S	.	.	H	α-helix	trans	-69.7	-3.8	168.5	0	0	0	0	0	114.1	T732 I738	T732-A734 PolarHBondContact O-N 2.69Å; A734-I738 WeakPolarHBondContact O-CD1 3.22Å
735	R	47.4	Very low	51.3	Low	108 Å²	108	102.2 Å²	102.2	41%	0.408	53%	0.529	S	S	.	.	H	α-helix	trans	-121.1	-29.5	-177.6	-143.9	174.7	-177.1	-156.4	-2.6	112.6	T732 D733 D782 E927	T732-R735 CarbonylContact O-C 3.5Å; T732-R735 WeakPolarHBondContact O-CA 3.22Å; T732-R735 WeakPolarHBondContact O-CB 3.28Å; T732-R735 PolarHBondContact O-N 3.25Å; D733-R735 PolarHBondContact O-N 3.11Å; R735-D782 IonicContact CZ-OD1 2.96Å; R735-D782 IonicContact NH1-OD1 2.7Å; R735-D782 PolarHBondContact NH1-OD1 3.33Å; R735-D782 IonicContact NH2-OD1 3.52Å; R735-E927 IonicContact CZ-OE1 3Å; R735-E927 IonicContact NE-OE1 3.45Å; R735-E927 PolarHBondContact NE-OE1 2.88Å; R735-E927 IonicContact NH2-OE1 3.51Å; R735-E927 PolarHBondContact NH2-OE1 2.83Å
736	S	47	Very low	49.6	Very low	61 Å²	61	102.3 Å²	102.3	43%	0.427	54%	0.541	S	S	.	.	H	α-helix	trans	-67.1	-44.7	169.2	53.1	0	0	0	0	111.9	T732 D733 I738 K739	T732-S736 PolarHBondContact O-N 3.41Å; D733-S736 WeakPolarHBondContact CA-OG 3.17Å; D733-S736 PolarHBondContact O-OG 3.32Å; S736-I738 PolarHBondContact O-N 3.42Å; S736-K739 PolarHBondContact O-N 2.83Å
737	N	41.4	Very low	47.9	Very low	99 Å²	99	101 Å²	101	53%	0.529	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.2	12.8	177.8	-72.6	7.8	0	0	0	114.2	D733 N857 R906	D733-N737 PolarHBondContact O-N 2.75Å; N737-N857 PolarHBondContact O-ND2 3.3Å; N737-N857 PolarHBondContact O-OD1 3Å; N737-R906 PolarHBondContact O-NH2 3.01Å; N737-R906 VanDerWaalsContact O-NH2 3.14Å
738	I	49.3	Very low	46.2	Very low	93 Å²	93	103.9 Å²	103.9	48%	0.477	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.1	-14.3	173.1	-66.1	177.7	0	0	0	111.3	A734 S736	A734-I738 WeakPolarHBondContact O-CD1 3.22Å; S736-I738 PolarHBondContact O-N 3.42Å
739	K	41.1	Very low	44.7	Very low	189 Å²	189	107 Å²	107	82%	0.822	59%	0.588	S	S	*	*	S	Bend	trans	-116.3	18.4	-164.5	-148.2	-178.3	179.4	179.4	0	115.6	S736	S736-K739 PolarHBondContact O-N 2.83Å
740	V	39.9	Very low	43.2	Very low	124 Å²	124	108.4 Å²	108.4	75%	0.752	60%	0.6	S	S	*	*	S	Bend	trans	-129.3	-2.2	-171.8	-171	0	0	0	0	113.2
741	T	33.9	Very low	42	Very low	98 Å²	98	110 Å²	110	60%	0.601	61%	0.606	S	S	*	*			trans	-123.8	81.8	-174.7	57.3	0	0	0	0	112.1
742	S	36.2	Very low	40.9	Very low	107 Å²	107	112.6 Å²	112.6	75%	0.748	62%	0.616	S	S	*	*			trans	-164.6	95.3	165.3	58.9	0	0	0	0	111
743	N	36.5	Very low	40.1	Very low	163 Å²	163	115.2 Å²	115.2	87%	0.872	63%	0.627	S	S	*	*			trans	167.1	96.2	144.2	-88.3	5.6	0	0	0	109.4
744	D	34.8	Very low	39.6	Very low	154 Å²	154	116.3 Å²	116.3	82%	0.824	64%	0.641	S	S	*	*			trans	-69.3	167.4	148.5	-52.7	-67.8	0	0	0	108.3
745	S	37.3	Very low	38.9	Very low	94 Å²	94	120.9 Å²	120.9	66%	0.657	66%	0.662	S	S	*	*			cis	-155	169.3	22.5	-32	0	0	0	0	113.5
746	D	36.1	Very low	38.4	Very low	153 Å²	153	123.5 Å²	123.5	82%	0.818	68%	0.678	S	S	*	*			trans	55.8	108	145	-47.4	-27.2	0	0	0	120.5
747	A	37.6	Very low	37.9	Very low	94 Å²	94	126.7 Å²	126.7	78%	0.777	70%	0.696	S	S	*	*				158.1	125.4	99.8	0	0	0	0	0	115.7
748	E	36.2	Very low	37.5	Very low	170 Å²	170	132.2 Å²	132.2	79%	0.794	71%	0.711	S	S	*	*			trans	57.5	110.2	142.6	-59.2	-67.4	79.9	0	0	123.1
749	E	35.9	Very low	36.7	Very low	115 Å²	115	132.5 Å²	132.5	54%	0.537	72%	0.721	S	S	.	*				70.2	112.4	126.3	-71.5	-116.5	103.8	0	0	123.4	Y849	E749-Y849 WeakPolarHBondContact OE1-CE1 3.23Å; E749-Y849 PolarHBondContact OE1-OH 3.44Å
750	T	36.9	Very low	36.4	Very low	92 Å²	92	131 Å²	131	56%	0.564	72%	0.717	S	S	*	*			trans	76.1	148.6	133.2	68.8	0	0	0	0	119.9	Y849	T750-Y849 WeakPolarHBondContact CG2-OH 3.43Å
751	K	40.3	Very low	35.9	Very low	132 Å²	132	131.3 Å²	131.3	57%	0.574	71%	0.713	S	S	*	*			cis	-162.4	152.4	-4.7	-120.6	164.2	168.4	-79.2	0	109.6
752	E	36	Very low	35.9	Very low	134 Å²	134	134.3 Å²	134.3	63%	0.626	72%	0.722	S	S	*	*			trans	54	143.9	140.1	-71.6	158.1	-176.6	0	0	120.4
753	D	38.5	Very low	35.8	Very low	133 Å²	133	135.5 Å²	135.5	71%	0.711	72%	0.72	S	S	*	*			cis	-162.1	159.6	-3	-135.1	-24.5	0	0	0	113.4
754	S	39.3	Very low	35.7	Very low	104 Å²	104	134.6 Å²	134.6	73%	0.727	72%	0.715	S	S	*	*			trans	61.9	172.1	150.8	76.4	0	0	0	0	122.2
755	N	35.6	Very low	35.6	Very low	122 Å²	122	135.3 Å²	135.3	65%	0.652	71%	0.714	S	S	*	*				-168.5	139.4	-68.7	-128.8	24.7	0	0	0	110.4
756	E	36.6	Very low	35.5	Very low	162 Å²	162	136.7 Å²	136.7	76%	0.757	71%	0.713	S	S	*	*			trans	60.2	170.3	150.6	-63.3	166.3	-167.5	0	0	116.8
757	T	36.4	Very low	35.3	Very low	128 Å²	128	135.1 Å²	135.1	79%	0.785	71%	0.705	S	S	*	*			cis	-136.1	156	10.1	-48.3	0	0	0	0	112.8
758	Y	32.3	Very low	35.1	Very low	216 Å²	216	137.7 Å²	137.7	85%	0.847	70%	0.701	S	S	*	*			trans	-50.5	169.7	175.9	-141.8	-109.7	0	0	0	118.3
759	S	34.4	Very low	34.8	Very low	99 Å²	99	138.5 Å²	138.5	69%	0.692	70%	0.702	S	S	*	*			trans	108.5	145.2	157.1	-50	0	0	0	0	117.3
760	Q	34	Very low	34.7	Very low	157 Å²	157	138 Å²	138	73%	0.734	71%	0.709	S	S	*	*			cis	-167.3	126	-23	-177.7	170	11.5	0	0	110
761	I	29.7	Very low	34.3	Very low	131 Å²	131	139.8 Å²	139.8	67%	0.672	72%	0.715	S	S	*	*			trans	40	117.9	156.9	-50.2	165.1	0	0	0	119.1
762	M	34.3	Very low	33.9	Very low	161 Å²	161	139.4 Å²	139.4	79%	0.793	72%	0.719	S	S	*	*				172.6	155	124.7	-92.5	-53.3	169.9	0	0	113.7
763	N	33.1	Very low	33.7	Very low	132 Å²	132	142 Å²	142	71%	0.706	73%	0.729	S	S	*	*			trans	60.9	112.6	155.7	-62.4	8.6	0	0	0	122.7
764	D	34.7	Very low	33.5	Very low	144 Å²	144	142 Å²	142	77%	0.77	73%	0.734	S	S	*	*				53.8	123	120.2	-63.5	-23.6	0	0	0	124.5
765	E	33.5	Very low	33	Very low	169 Å²	169	144.5 Å²	144.5	79%	0.79	73%	0.731	S	S	*	*			trans	78.2	137.7	136.7	-72	-158.8	164.6	0	0	123.9
766	N	33.7	Very low	32.8	Very low	122 Å²	122	144.5 Å²	144.5	65%	0.652	74%	0.741	S	S	*	*			trans	80.7	106.4	152.3	-73.2	-53.4	0	0	0	122.2
767	N	32.5	Very low	32.6	Very low	121 Å²	121	143.7 Å²	143.7	65%	0.647	74%	0.737	S	S	*	*			trans	86.8	105.2	134.5	-68	-45.2	0	0	0	123.3
768	Q	33.6	Very low	32.3	Very low	148 Å²	148	143.3 Å²	143.3	69%	0.692	74%	0.735	S	S	*	*				90.7	104.4	117.6	-72.5	-179.3	14.8	0	0	122.8
769	F	30.1	Very low	32.2	Very low	186 Å²	186	136.7 Å²	136.7	82%	0.816	72%	0.72	S	S	*	*			trans	69.6	159.3	143.1	-61.4	-63.8	0	0	0	119.2
770	P	34.2	Very low	32.3	Very low	104 Å²	104	140.9 Å²	140.9	68%	0.675	73%	0.726	S	S	*	*				-139.4	-173.9	-62.2	39.9	-22.6	0	0	0	115.2
771	N	28.2	Very low	32.4	Very low	130 Å²	130	139.7 Å²	139.7	70%	0.695	72%	0.724	S	S	*	*			trans	101	133.8	147.7	-100.7	48.4	0	0	0	123.1
772	D	30.5	Very low	32.6	Very low	124 Å²	124	136.3 Å²	136.3	66%	0.663	71%	0.708	S	S	*	*			trans	79.4	156.7	148.9	-65.8	-44.2	0	0	0	123.9
773	F	33.3	Very low	32.8	Very low	190 Å²	190	133.9 Å²	133.9	83%	0.833	70%	0.695	S	S	*	*			trans	70.7	128	176.3	-62.1	-81.6	0	0	0	118
774	T	33.1	Very low	32.9	Very low	132 Å²	132	132.8 Å²	132.8	81%	0.81	69%	0.685	S	S	*	*			cis	-151.1	173.6	-18	-18.8	0	0	0	0	110.9
775	K	29.4	Very low	33	Very low	156 Å²	156	130.7 Å²	130.7	68%	0.678	67%	0.671	S	S	*	*			trans	-122.4	117.1	-160.3	-179.9	-162.6	-170.7	-164.6	0	112.9	Q777	K775-Q777 HydrophobicContact CD-CG 4.03Å; K775-Q777 HydrophobicContact CG-CG 4.12Å
776	S	31.5	Very low	33.3	Very low	122 Å²	122	125.7 Å²	125.7	85%	0.853	65%	0.649	S	S	*	*			trans	-89.8	115.1	168.2	-173.6	0	0	0	0	111
777	Q	32.4	Very low	33.5	Very low	145 Å²	145	122.7 Å²	122.7	68%	0.678	63%	0.631	S	S	*	*			trans	-98.7	111.8	176.2	-73	-170.9	-109.1	0	0	111.6	K775	K775-Q777 HydrophobicContact CD-CG 4.03Å; K775-Q777 HydrophobicContact CG-CG 4.12Å
778	V	30.5	Very low	33.7	Very low	121 Å²	121	121.6 Å²	121.6	73%	0.733	63%	0.629	S	S	*	*			trans	-78.7	136.1	158.8	-178.2	0	0	0	0	108.6
779	S	30	Very low	33.9	Very low	76 Å²	76	120.8 Å²	120.8	53%	0.531	63%	0.625	S	S	.	*			trans	-76.1	141.2	-174.2	-169.4	0	0	0	0	112.3	N781	S779-N781 PolarHBondContact O-N 3.23Å; S779-N781 VanDerWaalsContact O-N 3.17Å
780	F	35.6	Very low	34.2	Very low	188 Å²	188	115.9 Å²	115.9	83%	0.825	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	-15.5	-174.9	-90.3	-94.6	0	0	0	114.8
781	N	35.4	Very low	34.1	Very low	131 Å²	131	117 Å²	117	70%	0.701	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-36.9	-175.8	-75.4	-1.3	0	0	0	113.8	S779 Q783 E784	S779-N781 PolarHBondContact O-N 3.23Å; S779-N781 VanDerWaalsContact O-N 3.17Å; N781-Q783 PolarHBondContact O-N 2.82Å; N781-Q783 VanDerWaalsContact O-N 3.15Å; N781-E784 PolarHBondContact O-N 3.12Å
782	D	34	Very low	34.3	Very low	60 Å²	60	119 Å²	119	32%	0.321	61%	0.614	S	S	.	*	H	α-helix	trans	-62.2	-26.2	-175.7	-75	-70.6	0	0	0	113.2	R735 E784 L786	R735-D782 IonicContact CZ-OD1 2.96Å; R735-D782 IonicContact NH1-OD1 2.7Å; R735-D782 PolarHBondContact NH1-OD1 3.33Å; R735-D782 IonicContact NH2-OD1 3.52Å; D782-E784 VanDerWaalsContact C-N 3.35Å; D782-E784 PolarHBondContact O-N 2.71Å; D782-L786 WeakPolarHBondContact O-CD1 3.4Å
783	Q	39.2	Very low	34.3	Very low	111 Å²	111	118.5 Å²	118.5	52%	0.519	62%	0.616	S	S	.	*	H	α-helix	trans	-65.4	-36.1	179.3	-162	76.2	-7.1	0	0	112.3	N781	N781-Q783 PolarHBondContact O-N 2.82Å; N781-Q783 VanDerWaalsContact O-N 3.15Å
784	E	36.4	Very low	34.3	Very low	108 Å²	108	113.9 Å²	113.9	51%	0.505	60%	0.6	S	S	.	*	H	α-helix	trans	-82.7	-25.9	-171.9	-165.1	151	-131	0	0	112.8	K693 N781 D782 E787	K693-E784 IonicContact NZ-OE1 2.73Å; K693-E784 PolarHBondContact NZ-OE1 3.47Å; N781-E784 PolarHBondContact O-N 3.12Å; D782-E784 VanDerWaalsContact C-N 3.35Å; D782-E784 PolarHBondContact O-N 2.71Å; E784-E787 PolarHBondContact O-N 3.47Å
785	E	36.6	Very low	34.6	Very low	101 Å²	101	112.1 Å²	112.1	47%	0.472	59%	0.585	S	S	.	*	H	α-helix	trans	-67.8	-44.1	172.1	-82.7	-151.7	108.9	0	0	112.4	E787 T788	E785-E787 PolarHBondContact O-N 3.15Å; E785-T788 PolarHBondContact O-N 2.66Å; E785-T788 VanDerWaalsContact O-N 3.11Å; E785-T788 PolarHBondContact O-OG1 2.94Å
786	L	39.7	Very low	34.9	Very low	63 Å²	63	109.4 Å²	109.4	33%	0.33	57%	0.572	S	S	.	*	H	α-helix	trans	-63.7	-21	175.9	-84	86.5	0	0	0	112.7	R696 Q728 L731 D782 T788	R696-L786 PolarHBondContact NH1-O 2.78Å; R696-L786 PolarHBondContact NH2-O 2.63Å; Q728-L786 VanDerWaalsContact NE2-CD2 3.33Å; L731-L786 HydrophobicContact CD1-CD2 4.31Å; D782-L786 WeakPolarHBondContact O-CD1 3.4Å; L786-T788 PolarHBondContact O-N 2.86Å
787	E	36.6	Very low	34.9	Very low	60 Å²	60	108 Å²	108	28%	0.28	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.6	-6.5	175	-78.2	-171.6	-168.8	0	0	114.2	R696 E784 E785	R696-E787 PolarHBondContact NE-O 2.77Å; R696-E787 VanDerWaalsContact NE-O 3.08Å; R696-E787 PolarHBondContact NH2-O 2.83Å; E784-E787 PolarHBondContact O-N 3.47Å; E785-E787 PolarHBondContact O-N 3.15Å
788	T	37.3	Very low	35.1	Very low	97 Å²	97	104.9 Å²	104.9	60%	0.595	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	-33.2	-177.3	67.1	0	0	0	0	116.1	E785 L786 T790	E785-T788 PolarHBondContact O-N 2.66Å; E785-T788 VanDerWaalsContact O-N 3.11Å; E785-T788 PolarHBondContact O-OG1 2.94Å; L786-T788 PolarHBondContact O-N 2.86Å; T788-T790 PolarHBondContact O-N 2.96Å
789	Q	37.9	Very low	35.2	Very low	132 Å²	132	104.1 Å²	104.1	62%	0.617	54%	0.542	S	S	*	.	S	Bend	trans	-84.1	-9.4	-157.4	-58.5	-172.1	9	0	0	117.4
790	T	36.3	Very low	35.5	Very low	82 Å²	82	107.8 Å²	107.8	50%	0.503	55%	0.551	S	S	.	*			trans	-119.6	52.9	-161.4	42.3	0	0	0	0	114.8	R696 T788	R696-T790 PolarHBondContact NH1-OG1 3.28Å; R696-T790 PolarHBondContact NH2-OG1 3.22Å; T788-T790 PolarHBondContact O-N 2.96Å
791	I	32.8	Very low	35.4	Very low	129 Å²	129	107.5 Å²	107.5	66%	0.662	55%	0.552	S	S	*	*			trans	-119.5	29.5	175.3	-36.7	-175.1	0	0	0	111.8
792	E	32.2	Very low	35.2	Very low	170 Å²	170	110.5 Å²	110.5	79%	0.794	56%	0.562	S	S	*	*	S	Bend	trans	-122.1	95	176.4	-65.2	-160.2	167	0	0	112.8	D794	E792-D794 PolarHBondContact O-N 3.2Å
793	T	29.3	Very low	35	Very low	115 Å²	115	111 Å²	111	71%	0.706	58%	0.581	S	S	*	*			trans	56.4	52.3	144.9	-30.4	0	0	0	0	118.8	L795	T793-L795 PolarHBondContact O-N 3.23Å
794	D	34.1	Very low	34.7	Very low	92 Å²	92	112.8 Å²	112.8	49%	0.492	60%	0.599	S	S	.	*			trans	-64.5	87	156.9	-81.1	-65.7	0	0	0	110.7	R727 E792	R727-D794 IonicContact CZ-OD1 3.62Å; R727-D794 IonicContact NH1-OD1 2.74Å; R727-D794 PolarHBondContact NH1-OD1 2.68Å; R727-D794 IonicContact NH1-OD2 3.52Å; R727-D794 IonicContact NH2-OD1 3.41Å; E792-D794 PolarHBondContact O-N 3.2Å
795	L	38.5	Very low	34.3	Very low	95 Å²	95	116.7 Å²	116.7	50%	0.497	62%	0.617	S	S	.	*				32.7	116.8	118.6	-58.2	-178.1	0	0	0	116.5	Q393 T793	Q393-L795 HydrophobicContact CB-CD2 4.19Å; Q393-L795 HydrophobicContact CG-CD2 4.19Å; T793-L795 PolarHBondContact O-N 3.23Å
796	Y	36.4	Very low	34	Very low	100 Å²	100	115.8 Å²	115.8	39%	0.392	64%	0.635	S	S	.	*			trans	-115.7	124.4	167.1	-85.8	-99.7	0	0	0	108.7	R703 H712 F720	R703-Y796 PolarHBondContact NE-OH 2.92Å; R703-Y796 VanDerWaalsContact NH2-CZ 3.26Å; R703-Y796 PolarHBondContact NH2-OH 3.09Å; R703-Y796 VanDerWaalsContact NH2-OH 3.12Å; H712-Y796 AromaticContact CE1-CE1 3.95Å; H712-Y796 AromaticContact NE2-CE1 3.83Å; H712-Y796 AromaticContact NE2-CZ 3.64Å; H712-Y796 PolarHBondContact NE2-OH 2.89Å; F720-Y796 HydrophobicContact CZ-CE1 4.24Å
797	D	32.7	Very low	33.7	Very low	91 Å²	91	116.6 Å²	116.6	49%	0.487	65%	0.651	S	S	.	*			trans	-99.7	150	144.9	-146.3	-33.9	0	0	0	108.4	R390	R390-D797 IonicContact NH1-OD2 3.77Å; R390-D797 PolarHBondContact NH1-OD2 2.91Å
798	D	35.3	Very low	33.7	Very low	81 Å²	81	120.4 Å²	120.4	43%	0.433	67%	0.673	S	S	.	*			trans	-160.7	43.9	-175.3	-144.7	14.6	0	0	0	112.7	R716 H800	R716-D798 IonicContact CZ-OD1 3.45Å; R716-D798 IonicContact CZ-OD2 3.66Å; R716-D798 IonicContact NH1-OD1 3.98Å; R716-D798 PolarHBondContact NH1-OD1 3.5Å; R716-D798 IonicContact NH1-OD2 2.77Å; R716-D798 PolarHBondContact NH1-OD2 3.25Å; R716-D798 IonicContact NH2-OD1 3.74Å; R716-D798 PolarHBondContact NH2-OD1 3.41Å; R716-D798 IonicContact NH2-OD2 3Å; R716-D798 PolarHBondContact NH2-OD2 3.49Å; D798-H800 VanDerWaalsContact C-N 3.32Å; D798-H800 PolarHBondContact O-N 3.42Å; D798-H800 VanDerWaalsContact O-N 3.11Å; D798-H800 IonicContact OD1-CD2 3.74Å; D798-H800 PolarHBondContact OD1-CD2 2.96Å; D798-H800 VanDerWaalsContact OD1-CD2 3.28Å; D798-H800 IonicContact OD1-NE2 3.76Å
799	S	33.7	Very low	33.6	Very low	104 Å²	104	124.3 Å²	124.3	73%	0.727	68%	0.684	S	S	*	*			trans	-77.4	82.4	165.7	54.4	0	0	0	0	110.4	Q801	S799-Q801 PolarHBondContact O-N 3.21Å
800	H	35.5	Very low	33.5	Very low	154 Å²	154	125.9 Å²	125.9	71%	0.713	69%	0.692	S	S	*	*			trans	-73.3	112.9	165	-88.7	-80	0	0	0	109.8	D798	D798-H800 VanDerWaalsContact C-N 3.32Å; D798-H800 PolarHBondContact O-N 3.42Å; D798-H800 VanDerWaalsContact O-N 3.11Å; D798-H800 IonicContact OD1-CD2 3.74Å; D798-H800 PolarHBondContact OD1-CD2 2.96Å; D798-H800 VanDerWaalsContact OD1-CD2 3.28Å; D798-H800 IonicContact OD1-NE2 3.76Å
801	Q	33.3	Very low	33.5	Very low	182 Å²	182	125.5 Å²	125.5	85%	0.85	69%	0.692	S	S	*	*			trans	-133.7	130.8	158.1	-151	167.3	6.9	0	0	107.7	S799	S799-Q801 PolarHBondContact O-N 3.21Å
802	E	30.8	Very low	33.6	Very low	194 Å²	194	126.3 Å²	126.3	91%	0.907	70%	0.698	S	S	*	*			trans	-89.6	129.1	179.5	-64.1	166.6	125.4	0	0	108.7
803	G	30	Very low	33.8	Very low	69 Å²	69	124 Å²	124	71%	0.711	69%	0.691	S	S	*	*			trans	157.4	126.6	170.2	0	0	0	0	0	115.9
804	V	32.6	Very low	34.3	Very low	149 Å²	149	128.1 Å²	128.1	90%	0.903	69%	0.694	S	S	*	*			trans	73.1	141.9	162.8	-166.7	0	0	0	0	116.3
805	H	29.8	Very low	34.2	Very low	190 Å²	190	132.6 Å²	132.6	88%	0.88	71%	0.709	S	S	*	*			trans	-93.2	155.6	-178.8	-69	-105.8	0	0	0	112.4
806	G	28.6	Very low	34.1	Very low	83 Å²	83	134.3 Å²	134.3	86%	0.856	72%	0.718	S	S	*	*	S	Bend	trans	87	64.2	144.9	0	0	0	0	0	117.9
807	A	35.1	Very low	33.9	Very low	80 Å²	80	134.9 Å²	134.9	66%	0.661	73%	0.732	S	S	*	*	S	Bend	trans	-151.5	-43.3	165.7	0	0	0	0	0	114.5	E809	A807-E809 PolarHBondContact O-N 3.48Å
808	D	35.4	Very low	33.8	Very low	139 Å²	139	134.7 Å²	134.7	74%	0.743	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-71.8	-22.4	-162.4	-72	-26.5	0	0	0	116.2	E810 S811	D808-E810 PolarHBondContact O-N 2.9Å; D808-E810 VanDerWaalsContact O-N 3.16Å; D808-S811 PolarHBondContact O-N 3.12Å; D808-S811 PolarHBondContact O-OG 2.98Å
809	E	36.6	Very low	33.5	Very low	179 Å²	179	137.3 Å²	137.3	84%	0.836	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-66.7	-15.1	-177.7	-64.4	-167	132.5	0	0	114	A807 N813	A807-E809 PolarHBondContact O-N 3.48Å; E809-N813 PolarHBondContact O-ND2 3.06Å
810	E	34.9	Very low	33.4	Very low	165 Å²	165	138.6 Å²	138.6	77%	0.771	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-86.6	-11.4	-177.4	-154.3	166.7	-145	0	0	113.2	D808	D808-E810 PolarHBondContact O-N 2.9Å; D808-E810 VanDerWaalsContact O-N 3.16Å
811	S	35.1	Very low	33.1	Very low	74 Å²	74	137.5 Å²	137.5	52%	0.517	76%	0.76	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.4	-44.4	-173	65.3	0	0	0	0	114.4	D808 N813 R814	D808-S811 PolarHBondContact O-N 3.12Å; D808-S811 PolarHBondContact O-OG 2.98Å; S811-N813 VanDerWaalsContact C-N 3.31Å; S811-N813 PolarHBondContact O-N 3.5Å; S811-R814 PolarHBondContact O-N 3.19Å
812	D	36.4	Very low	32.9	Very low	147 Å²	147	135.9 Å²	135.9	79%	0.786	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-69.6	-26.6	-178.2	-101.9	-11.5	0	0	0	112.9	R814	D812-R814 VanDerWaalsContact C-N 3.32Å; D812-R814 PolarHBondContact O-N 3.24Å
813	N	35.6	Very low	32.8	Very low	121 Å²	121	133.8 Å²	133.8	65%	0.647	75%	0.751	S	S	*	*	G	3₁₀ helix	trans	-75.8	-16.6	-178.7	-72.5	-61.3	0	0	0	113.8	E809 S811 F815	E809-N813 PolarHBondContact O-ND2 3.06Å; S811-N813 VanDerWaalsContact C-N 3.31Å; S811-N813 PolarHBondContact O-N 3.5Å; N813-F815 PolarHBondContact O-N 2.71Å
814	R	39.9	Very low	32.7	Very low	201 Å²	201	135.5 Å²	135.5	76%	0.758	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-84.2	-6	-168.6	-141.6	174.2	-167.5	170.9	7.2	115.4	S811 D812	S811-R814 PolarHBondContact O-N 3.19Å; D812-R814 VanDerWaalsContact C-N 3.32Å; D812-R814 PolarHBondContact O-N 3.24Å
815	F	32.6	Very low	32.7	Very low	186 Å²	186	136.4 Å²	136.4	82%	0.816	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-97.3	-0	-176.4	-92.1	-82.5	0	0	0	115.4	N813	N813-F815 PolarHBondContact O-N 2.71Å
816	L	34.9	Very low	32.8	Very low	132 Å²	132	133.9 Å²	133.9	69%	0.691	74%	0.74	S	S	*	*	S	Bend	trans	-120.3	-5.1	-177.6	-66.2	176.7	0	0	0	114.8
817	T	33.6	Very low	33	Very low	111 Å²	111	140.1 Å²	140.1	68%	0.681	74%	0.739	S	S	*	*	S	Bend	trans	-97.5	-2.3	179.7	45.2	0	0	0	0	114.3	N819	T817-N819 PolarHBondContact O-N 3.06Å
818	A	30.5	Very low	32.7	Very low	87 Å²	87	145.9 Å²	145.9	72%	0.719	75%	0.749	S	S	*	*			trans	-91.8	66.1	-179.2	0	0	0	0	0	112.6
819	N	29.6	Very low	32.5	Very low	137 Å²	137	145.1 Å²	145.1	73%	0.733	75%	0.75	S	S	*	*			trans	-160.3	140.5	166.5	-115.4	8.1	0	0	0	108.2	T817	T817-N819 PolarHBondContact O-N 3.06Å
820	V	30.7	Very low	32.2	Very low	130 Å²	130	142.8 Å²	142.8	79%	0.788	75%	0.748	S	S	*	*			trans	66.6	110.4	-164	-168.4	0	0	0	0	109.8
821	N	28.3	Very low	32.1	Very low	131 Å²	131	140.3 Å²	140.3	70%	0.701	75%	0.746	S	S	*	*			cis	-156.3	158.1	41.2	-134.6	-3.2	0	0	0	113.9
822	L	30.5	Very low	31.9	Very low	148 Å²	148	142.4 Å²	142.4	78%	0.775	76%	0.756	S	S	*	*			trans	53.8	146.2	147.5	-69.1	165.3	0	0	0	123.1
823	N	27.8	Very low	31.7	Very low	151 Å²	151	144.1 Å²	144.1	81%	0.807	76%	0.756	S	S	*	*			trans	-69.7	168.6	172.2	-53.1	-45.1	0	0	0	113.1
824	S	28.4	Very low	31.6	Very low	105 Å²	105	143.6 Å²	143.6	73%	0.734	76%	0.758	S	S	*	*			trans	94.9	133.7	146.4	-118.7	0	0	0	0	120
825	E	32.3	Very low	31.3	Very low	168 Å²	168	141.5 Å²	141.5	79%	0.785	76%	0.756	S	S	*	*			trans	73.6	95.8	152.4	-42.3	-146.7	159	0	0	120.2
826	D	32.7	Very low	31.4	Very low	137 Å²	137	138.3 Å²	138.3	73%	0.733	75%	0.748	S	S	*	*				52.1	127.7	118.2	-73.5	-25.5	0	0	0	123.4
827	Y	32.8	Very low	31.2	Very low	214 Å²	214	139.1 Å²	139.1	84%	0.839	75%	0.753	S	S	*	*			trans	49.8	132.5	141.3	-75.7	-90.2	0	0	0	122.5	V829	Y827-V829 PolarHBondContact O-N 3.4Å
828	F	27.8	Very low	31	Very low	200 Å²	200	138.5 Å²	138.5	88%	0.877	75%	0.753	S	S	*	*			trans	-48.1	133.5	153	-84.3	-117.4	0	0	0	111.8
829	V	32.1	Very low	31	Very low	124 Å²	124	140.1 Å²	140.1	75%	0.752	75%	0.754	S	S	*	*				-174.6	126.7	112.5	143.3	0	0	0	0	113	Y827	Y827-V829 PolarHBondContact O-N 3.4Å
830	T	30.2	Very low	31	Very low	129 Å²	129	139.7 Å²	139.7	79%	0.791	76%	0.756	S	S	*	*			trans	62.2	140.4	165.1	46.2	0	0	0	0	122
831	P	31.2	Very low	31.1	Very low	113 Å²	113	140 Å²	140	73%	0.734	76%	0.758	S	S	*	*			trans	-109.2	171.4	173.5	41.5	-34.4	0	0	0	113.9
832	T	31	Very low	31.2	Very low	118 Å²	118	138.1 Å²	138.1	72%	0.724	76%	0.761	S	S	*	*				174	139	126.7	24.9	0	0	0	0	114.6
833	K	33.1	Very low	31.2	Very low	183 Å²	183	135.8 Å²	135.8	80%	0.796	76%	0.756	S	S	*	*			trans	66.1	154	147.1	-65.4	175.7	-179.9	-178.2	0	117.7
834	T	33.3	Very low	31.7	Very low	110 Å²	110	135.8 Å²	135.8	68%	0.675	76%	0.757	S	S	*	*			cis	-166	158.8	-8.4	17.2	0	0	0	0	111.9
835	H	34.3	Very low	31.9	Very low	158 Å²	158	137.2 Å²	137.2	73%	0.731	76%	0.761	S	S	*	*			trans	73.8	134.8	147.4	-86.4	-77.6	0	0	0	123.2
836	D	33.8	Very low	31.9	Very low	119 Å²	119	134.2 Å²	134.2	64%	0.636	76%	0.756	S	S	*	*			trans	71.8	94.5	138.3	-56.4	-17.3	0	0	0	124.5
837	N	31.9	Very low	31.7	Very low	149 Å²	149	134.5 Å²	134.5	80%	0.797	76%	0.757	S	S	*	*				50.8	112.5	103.4	-66.9	-16.7	0	0	0	121.8
838	S	29	Very low	31.7	Very low	97 Å²	97	130.4 Å²	130.4	68%	0.678	76%	0.755	S	S	*	*				86.9	139.5	118.3	-167.7	0	0	0	0	121.2
839	T	30.4	Very low	32.1	Very low	122 Å²	122	128 Å²	128	75%	0.748	74%	0.741	S	S	*	*			trans	64.9	141.1	150.9	37.6	0	0	0	0	119.3
840	V	29.7	Very low	32	Very low	127 Å²	127	126.6 Å²	126.6	77%	0.77	74%	0.737	S	S	*	*			cis	-166.4	-172.4	-17.9	87.4	0	0	0	0	109.4
841	V	33.1	Very low	32.1	Very low	138 Å²	138	127.9 Å²	127.9	84%	0.836	74%	0.739	S	S	*	*			trans	87.2	136.2	174.5	-164.8	0	0	0	0	115.5
842	A	30.3	Very low	32	Very low	91 Å²	91	129 Å²	129	75%	0.752	74%	0.735	S	S	*	*			trans	-96.3	165.3	-175.1	0	0	0	0	0	113.5
843	S	29.7	Very low	31.9	Very low	98 Å²	98	130.7 Å²	130.7	69%	0.685	74%	0.739	S	S	*	*			trans	-160.8	165.8	133	46.2	0	0	0	0	110.8
844	D	38.7	Very low	31.8	Very low	152 Å²	152	125.7 Å²	125.7	81%	0.813	73%	0.732	S	S	*	*			trans	68.8	81.5	153.4	-49.6	-26.9	0	0	0	120.9
845	T	32.6	Very low	31.9	Very low	134 Å²	134	130.9 Å²	130.9	82%	0.822	75%	0.745	S	S	*	*			trans	-60.8	170.1	133.3	29.1	0	0	0	0	111.2
846	P	33.1	Very low	32.3	Very low	106 Å²	106	130.5 Å²	130.5	69%	0.688	74%	0.744	S	S	*	*			cis	-145	174.8	26.5	42.5	-22	0	0	0	119.2
847	N	28.3	Very low	32.9	Very low	142 Å²	142	127.7 Å²	127.7	76%	0.759	73%	0.728	S	S	*	*			trans	37.7	126.2	144	-58	1.1	0	0	0	122.3
848	T	33.2	Very low	34	Very low	129 Å²	129	127 Å²	127	79%	0.791	72%	0.72	S	S	*	*			trans	-159.5	134	132.5	-73.9	0	0	0	0	110.6
849	Y	35.2	Very low	35.8	Very low	148 Å²	148	125.6 Å²	125.6	58%	0.58	70%	0.703	S	S	*	*			trans	-4.7	153.7	147.2	-60.1	-110	0	0	0	118.3	E749 T750	E749-Y849 WeakPolarHBondContact OE1-CE1 3.23Å; E749-Y849 PolarHBondContact OE1-OH 3.44Å; T750-Y849 WeakPolarHBondContact CG2-OH 3.43Å
850	S	29.7	Very low	38.1	Very low	95 Å²	95	122.6 Å²	122.6	66%	0.664	68%	0.682	S	S	*	*			cis	-168.5	-166.9	-5	-101.6	0	0	0	0	108.8
851	D	32.6	Very low	40.7	Very low	157 Å²	157	121.7 Å²	121.7	84%	0.84	67%	0.669	S	S	*	*			trans	66.8	150.4	173.1	-77.1	6.8	0	0	0	116.7
852	E	28.5	Very low	43.1	Very low	137 Å²	137	122 Å²	122	64%	0.64	66%	0.655	S	S	*	*			cis	170.4	169.9	-28	-113.1	-59.9	139.8	0	0	103.7	A854	E852-A854 VanDerWaalsContact C-N 3.32Å; E852-A854 PolarHBondContact O-N 2.95Å
853	N	29.1	Very low	45.8	Very low	153 Å²	153	127 Å²	127	82%	0.818	66%	0.655	S	S	*	*			trans	-49.3	56.2	-168.2	-79.7	-83	0	0	0	120
854	A	30.9	Very low	48.5	Very low	78 Å²	78	122.8 Å²	122.8	65%	0.645	62%	0.624	S	S	*	*			trans	-123.8	45.1	-164.1	0	0	0	0	0	117.4	E852	E852-A854 VanDerWaalsContact C-N 3.32Å; E852-A854 PolarHBondContact O-N 2.95Å
855	K	36.6	Very low	50.8	Low	218 Å²	218	123.3 Å²	123.3	95%	0.948	62%	0.622	S	S	*	*	S	Bend	trans	-104.7	97.9	156.6	-92.1	-179.1	177.9	171.8	0	110.6
856	Q	42.3	Very low	53.6	Low	151 Å²	151	117 Å²	117	71%	0.706	58%	0.583	S	S	*	*			trans	-73.1	157.2	-155.7	-63.6	-178.3	1.7	0	0	114.9	E858	Q856-E858 HydrophobicContact CB-CG 3.99Å; Q856-E858 PolarHBondContact O-N 3.45Å
857	N	45.7	Very low	56.3	Low	59 Å²	59	114.1 Å²	114.1	32%	0.316	56%	0.564	S	S	.	*			trans	-74.6	52.2	171.2	-97	-58.8	0	0	0	112.3	N737 E859 R906	N737-N857 PolarHBondContact O-ND2 3.3Å; N737-N857 PolarHBondContact O-OD1 3Å; N857-E859 PolarHBondContact O-N 3.23Å; N857-R906 PolarHBondContact ND2-NH2 2.83Å; N857-R906 PolarHBondContact OD1-NE 2.95Å; N857-R906 PolarHBondContact OD1-NH2 2.83Å
858	E	55.2	Low	59.4	Low	134 Å²	134	109.1 Å²	109.1	63%	0.626	54%	0.536	S	S	*	.			trans	-58.1	127.3	-169.1	-64.8	-168.6	131.5	0	0	113.8	Q856 I860	Q856-E858 HydrophobicContact CB-CG 3.99Å; Q856-E858 PolarHBondContact O-N 3.45Å; E858-I860 PolarHBondContact O-N 3.31Å
859	E	68	Low	62.2	Low	68 Å²	68	103.5 Å²	103.5	32%	0.318	50%	0.502	S	S	.	.			trans	-77	105.5	162.4	-74.9	-161.6	167.1	0	0	108.8	N857 H861 V904 S905 R920	N857-E859 PolarHBondContact O-N 3.23Å; E859-H861 PolarHBondContact O-CD2 3.44Å; E859-H861 PolarHBondContact O-N 3Å; E859-H861 VanDerWaalsContact O-N 3.11Å; E859-H861 IonicContact OE2-NE2 3.53Å; E859-V904 HydrophobicContact CB-CG1 4.01Å; E859-V904 HydrophobicContact CG-CG1 3.87Å; E859-V904 WeakPolarHBondContact OE2-CG1 3.49Å; E859-S905 CarbonylContact C-O 3.55Å; E859-R920 IonicContact OE1-CZ 3.39Å; E859-R920 IonicContact OE1-NH2 3.47Å; E859-R920 PolarHBondContact OE1-NH2 2.77Å; E859-R920 IonicContact OE2-NH2 3.94Å; E859-R920 PolarHBondContact OE2-NH2 3.03Å
860	I	78	Confident	64.8	Low	59 Å²	59	98.9 Å²	98.9	30%	0.303	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	103.4	174.7	-54.1	177.2	0	0	0	108.7	E858 R862 S905	E858-I860 PolarHBondContact O-N 3.31Å; I860-R862 HydrophobicContact CG2-CG 4.05Å; I860-S905 WeakPolarHBondContact CA-O 3.36Å; I860-S905 PolarHBondContact N-O 3.09Å; I860-S905 PolarHBondContact O-N 3.25Å; I860-S905 PolarHBondContact O-OG 2.92Å
861	H	84.8	Confident	67.7	Low	109 Å²	109	98 Å²	98	51%	0.505	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	112	175.8	-70.6	-90.8	0	0	0	111.7	E859 T902 V903	E859-H861 PolarHBondContact O-CD2 3.44Å; E859-H861 PolarHBondContact O-N 3Å; E859-H861 VanDerWaalsContact O-N 3.11Å; E859-H861 IonicContact OE2-NE2 3.53Å; H861-T902 HydrophobicContact CB-CG2 3.93Å; H861-V903 CarbonylContact C-O 3.57Å; H861-V903 WeakPolarHBondContact CA-O 3.44Å
862	R	83.3	Confident	70.5	Confident	143 Å²	143	90.6 Å²	90.6	54%	0.54	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	123	177.4	-61.9	-179.6	176.8	155.1	-1.2	110.9	I860 T902 V903	I860-R862 HydrophobicContact CG2-CG 4.05Å; R862-T902 CarbonylContact O-C 3.56Å; R862-T902 WeakPolarHBondContact O-CA 3.45Å; R862-V903 HydrophobicContact CB-CB 4.38Å; R862-V903 PolarHBondContact N-O 3.4Å; R862-V903 PolarHBondContact O-N 3.04Å
863	R	86.2	Confident	73.5	Confident	196 Å²	196	84 Å²	84	74%	0.74	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	133.5	173.6	-67.6	-177.3	179.7	166.8	1.8	110.3
864	I	86.7	Confident	76.5	Confident	10 Å²	10	81.4 Å²	81.4	5%	0.051	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	131.5	171.7	-71.8	168.6	0	0	0	108.8	L866 H900 L901 V903 I965 Y971	I864-L866 HydrophobicContact CG2-CD2 4.2Å; I864-H900 CarbonylContact O-C 3.56Å; I864-H900 WeakPolarHBondContact O-CA 3.35Å; I864-H900 VanDerWaalsContact O-CB 3.28Å; I864-H900 WeakPolarHBondContact O-CB 3.36Å; I864-L901 HydrophobicContact CB-CB 4.46Å; I864-L901 WeakPolarHBondContact CB-O 3.39Å; I864-L901 PolarHBondContact N-O 3.29Å; I864-L901 PolarHBondContact O-N 3.39Å; I864-V903 HydrophobicContact CD1-CG2 3.15Å; I864-V903 HydrophobicContact CG1-CG2 3.8Å; I864-I965 HydrophobicContact CG2-CD1 3.87Å; I864-Y971 HydrophobicContact CD1-CD1 3.39Å; I864-Y971 HydrophobicContact CD1-CD2 3.59Å; I864-Y971 HydrophobicContact CD1-CE1 3.52Å; I864-Y971 HydrophobicContact CD1-CE2 3.74Å; I864-Y971 HydrophobicContact CD1-CG 3.39Å; I864-Y971 HydrophobicContact CG1-CD1 4.29Å; I864-Y971 HydrophobicContact CG1-CD2 3.83Å; I864-Y971 HydrophobicContact CG1-CE2 4.3Å; I864-Y971 HydrophobicContact CG1-CG 3.8Å; I864-Y971 HydrophobicContact CG2-CG 4.48Å
865	E	87.6	Confident	79.3	Confident	163 Å²	163	80.1 Å²	80.1	76%	0.762	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.9	154	167.1	-60.9	-177.7	165.6	0	0	111.5	P867	E865-P867 WeakPolarHBondContact O-CD 3.21Å
866	L	90	Very high	81.7	Confident	1 Å²	1	70 Å²	70	1%	0.005	32%	0.324	C	S	.	.			trans	-116.9	67.7	-171.8	-63.4	179.4	0	0	0	112.8	I864 Y896 S897 H899 L901 R941 I944 I965	I864-L866 HydrophobicContact CG2-CD2 4.2Å; L866-Y896 HydrophobicContact CB-CD1 4.34Å; L866-Y896 HydrophobicContact CB-CE1 3.77Å; L866-Y896 HydrophobicContact CB-CE2 4.21Å; L866-Y896 HydrophobicContact CD1-CE2 3.9Å; L866-Y896 WeakPolarHBondContact O-CD1 3.47Å; L866-Y896 VanDerWaalsContact O-CE1 3.24Å; L866-Y896 WeakPolarHBondContact O-CE1 3.34Å; L866-S897 WeakPolarHBondContact O-CA 3.31Å; L866-H899 WeakPolarHBondContact CB-O 3.35Å; L866-H899 HydrophobicContact CD1-CB 4.41Å; L866-H899 WeakPolarHBondContact CD1-O 3.39Å; L866-H899 WeakPolarHBondContact CG-O 3.39Å; L866-L901 HydrophobicContact CD2-CB 4.24Å; L866-R941 HydrophobicContact CD2-CG 4.24Å; L866-I944 HydrophobicContact CD1-CD1 3.48Å; L866-I944 VanDerWaalsContact CD1-CD1 3.48Å; L866-I944 HydrophobicContact CD1-CG2 4.14Å; L866-I965 HydrophobicContact CD2-CD1 4.27Å
867	P	90.8	Very high	84	Confident	46 Å²	46	62.8 Å²	62.8	30%	0.299	29%	0.29	S	S	.	.			trans	-64.9	160.4	179.4	29.2	-36.3	0	0	0	112.7	E865 S963 I965 L973	E865-P867 WeakPolarHBondContact O-CD 3.21Å; P867-S963 WeakPolarHBondContact O-CB 3.27Å; P867-I965 HydrophobicContact CG-CG2 3.85Å; P867-L973 HydrophobicContact CB-CB 4.42Å; P867-L973 HydrophobicContact CB-CD1 4.38Å; P867-L973 HydrophobicContact CG-CB 4.05Å; P867-L973 HydrophobicContact CG-CD1 4.22Å
868	F	92.2	Very high	86	Confident	38 Å²	38	65.9 Å²	65.9	17%	0.167	30%	0.303	C	S	.	.			trans	-143.6	157.9	169.4	71.5	-82.2	0	0	0	109.6	D870 M893 Q894 A962	F868-D870 HydrophobicContact CE2-CB 4.13Å; F868-M893 HydrophobicContact CB-CE 3.38Å; F868-M893 HydrophobicContact CD1-CB 4.02Å; F868-M893 HydrophobicContact CD1-CE 4.09Å; F868-M893 HydrophobicContact CD2-CB 3.94Å; F868-M893 HydrophobicContact CD2-CE 3.94Å; F868-M893 HydrophobicContact CE1-CB 3.75Å; F868-M893 WeakPolarHBondContact CE1-O 3.33Å; F868-M893 HydrophobicContact CE2-CB 3.66Å; F868-M893 HydrophobicContact CG-CB 4.12Å; F868-M893 HydrophobicContact CG-CE 3.54Å; F868-M893 HydrophobicContact CZ-CB 3.56Å; F868-Q894 HydrophobicContact CZ-CG 4.36Å; F868-A962 WeakPolarHBondContact CA-O 3.42Å
869	S	92.4	Very high	87.4	Confident	11 Å²	11	65.4 Å²	65.4	8%	0.077	30%	0.295	C	S	.	.			trans	-96.4	122.2	168	174.2	0	0	0	0	110.7	V872 L873 A962 D976	S869-V872 WeakPolarHBondContact OG-CG2 3.32Å; S869-V872 PolarHBondContact OG-N 3.3Å; S869-L873 PolarHBondContact O-N 3.27Å; S869-L873 VanDerWaalsContact O-N 3.1Å; S869-A962 PolarHBondContact N-O 2.83Å; S869-D976 WeakPolarHBondContact CB-OD1 3.44Å; S869-D976 PolarHBondContact OG-OD1 3.03Å; S869-D976 PolarHBondContact OG-OD2 3.01Å
870	D	90.7	Very high	88.1	Confident	51 Å²	51	65.1 Å²	65.1	27%	0.273	29%	0.294	S	S	.	.	H	α-helix	trans	-68.4	-43.6	175.6	176	48.7	0	0	0	112	F868 V872 L873 R874 Y886 V890	F868-D870 HydrophobicContact CE2-CB 4.13Å; D870-V872 VanDerWaalsContact C-N 3.32Å; D870-V872 PolarHBondContact O-N 2.95Å; D870-L873 WeakPolarHBondContact O-CB 3.37Å; D870-L873 PolarHBondContact O-N 3.18Å; D870-L873 VanDerWaalsContact O-N 3.07Å; D870-R874 PolarHBondContact O-N 2.89Å; D870-R874 IonicContact OD2-NH2 2.65Å; D870-R874 PolarHBondContact OD2-NH2 2.84Å; D870-Y886 WeakPolarHBondContact OD1-CE2 3.47Å; D870-Y886 PolarHBondContact OD1-OH 3.29Å; D870-Y886 PolarHBondContact OD2-OH 2.84Å; D870-V890 VanDerWaalsContact OD1-CG2 3.3Å; D870-V890 WeakPolarHBondContact OD1-CG2 3.28Å
871	N	90.8	Very high	88.3	Confident	77 Å²	77	65.3 Å²	65.3	41%	0.412	31%	0.31	S	S	.	.	H	α-helix	trans	-56.9	-45.3	175.8	177.9	42.7	0	0	0	111.7	R874 V875 D976	N871-R874 PolarHBondContact O-N 2.86Å; N871-V875 WeakPolarHBondContact O-CG2 3.26Å; N871-V875 PolarHBondContact O-N 2.97Å; N871-V875 VanDerWaalsContact O-N 3.12Å; N871-D976 WeakPolarHBondContact CB-OD2 3.43Å; N871-D976 PolarHBondContact ND2-OD2 3.17Å
872	V	90.7	Very high	88.1	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-64.1	-42.1	174.2	175.7	0	0	0	0	111.5	S869 D870 R874 V875 L876 A962 D976 L979 L980	S869-V872 WeakPolarHBondContact OG-CG2 3.32Å; S869-V872 PolarHBondContact OG-N 3.3Å; D870-V872 VanDerWaalsContact C-N 3.32Å; D870-V872 PolarHBondContact O-N 2.95Å; V872-R874 VanDerWaalsContact C-N 3.32Å; V872-R874 PolarHBondContact O-N 3.35Å; V872-V875 PolarHBondContact O-N 2.73Å; V872-L876 HydrophobicContact CG1-CD1 3.8Å; V872-L876 HydrophobicContact CG1-CG 4.21Å; V872-L876 WeakPolarHBondContact O-CB 3.49Å; V872-L876 WeakPolarHBondContact O-CG 3.17Å; V872-L876 PolarHBondContact O-N 3.07Å; V872-A962 HydrophobicContact CG1-CB 4.22Å; V872-D976 HydrophobicContact CG2-CB 3.85Å; V872-L979 HydrophobicContact CB-CB 4.46Å; V872-L979 HydrophobicContact CB-CD1 4.47Å; V872-L979 HydrophobicContact CG1-CB 3.92Å; V872-L979 HydrophobicContact CG2-CB 3.81Å; V872-L979 HydrophobicContact CG2-CD1 3.86Å; V872-L979 HydrophobicContact CG2-CG 4.47Å; V872-L980 HydrophobicContact CG1-CD2 4.11Å; V872-L980 HydrophobicContact CG1-CG 4.44Å; V872-L980 HydrophobicContact CG2-CG 4.19Å
873	L	91.8	Very high	88.3	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.7	-43	178.4	-170.2	71.2	0	0	0	111.5	S869 D870 L876 L877 L889 V890 M893 A962	S869-L873 PolarHBondContact O-N 3.27Å; S869-L873 VanDerWaalsContact O-N 3.1Å; D870-L873 WeakPolarHBondContact O-CB 3.37Å; D870-L873 PolarHBondContact O-N 3.18Å; D870-L873 VanDerWaalsContact O-N 3.07Å; L873-L876 PolarHBondContact O-N 3.13Å; L873-L877 HydrophobicContact CG-CD1 4.45Å; L873-L877 PolarHBondContact O-N 3.42Å; L873-L889 HydrophobicContact CD1-CD2 3.96Å; L873-L889 HydrophobicContact CD2-CD2 4.4Å; L873-L889 HydrophobicContact CD2-CG 4.41Å; L873-L889 HydrophobicContact CG-CD2 4.37Å; L873-V890 HydrophobicContact CD2-CG2 4.09Å; L873-M893 HydrophobicContact CD2-CB 4.36Å; L873-M893 HydrophobicContact CD2-CG 3.79Å; L873-A962 HydrophobicContact CB-CB 4.12Å; L873-A962 HydrophobicContact CD1-CB 3.94Å
874	R	91.2	Very high	88.2	Confident	98 Å²	98	57.8 Å²	57.8	37%	0.37	29%	0.294	S	S	.	.	H	α-helix	trans	-58.9	-55.1	177	-165.2	-178.3	-60.4	160	5.3	111.4	D870 N871 V872 L876 L877 E878 F883 Y886	D870-R874 PolarHBondContact O-N 2.89Å; D870-R874 IonicContact OD2-NH2 2.65Å; D870-R874 PolarHBondContact OD2-NH2 2.84Å; N871-R874 PolarHBondContact O-N 2.86Å; V872-R874 VanDerWaalsContact C-N 3.32Å; V872-R874 PolarHBondContact O-N 3.35Å; R874-L876 VanDerWaalsContact C-N 3.28Å; R874-L876 PolarHBondContact O-N 3.11Å; R874-L877 PolarHBondContact O-N 3.36Å; R874-E878 WeakPolarHBondContact O-CB 3.39Å; R874-E878 PolarHBondContact O-N 2.91Å; R874-F883 HydrophobicContact CG-CE2 3.74Å; R874-F883 HydrophobicContact CG-CZ 4.45Å; R874-Y886 HydrophobicContact CB-CD2 4.16Å; R874-Y886 HydrophobicContact CB-CE2 3.61Å; R874-Y886 HydrophobicContact CG-CD2 4.22Å; R874-Y886 HydrophobicContact CG-CE1 4.46Å; R874-Y886 HydrophobicContact CG-CE2 3.89Å; R874-Y886 VanDerWaalsContact NE-CZ 3.32Å; R874-Y886 PolarHBondContact NE-OH 3.38Å; R874-Y886 PolarHBondContact NH2-OH 3.48Å
875	V	89.4	Confident	88.1	Confident	51 Å²	51	61.2 Å²	61.2	31%	0.309	31%	0.31	S	S	.	.	H	α-helix	trans	-61.9	-33.8	179.3	174.2	0	0	0	0	112.1	N871 V872 R879 L980	N871-V875 WeakPolarHBondContact O-CG2 3.26Å; N871-V875 PolarHBondContact O-N 2.97Å; N871-V875 VanDerWaalsContact O-N 3.12Å; V872-V875 PolarHBondContact O-N 2.73Å; V875-R879 WeakPolarHBondContact O-CB 3.31Å; V875-R879 PolarHBondContact O-N 3.24Å; V875-R879 VanDerWaalsContact O-N 3.1Å; V875-L980 HydrophobicContact CB-CD2 3.98Å; V875-L980 HydrophobicContact CG1-CD2 3.66Å
876	L	88.8	Confident	88.2	Confident	5 Å²	5	54.5 Å²	54.5	3%	0.026	28%	0.277	C	S	.	.	H	α-helix	trans	-72.9	-33.1	176.5	-71	179.6	0	0	0	113.7	V872 L873 R874 E880 L958 Q961 A983	V872-L876 HydrophobicContact CG1-CD1 3.8Å; V872-L876 HydrophobicContact CG1-CG 4.21Å; V872-L876 WeakPolarHBondContact O-CB 3.49Å; V872-L876 WeakPolarHBondContact O-CG 3.17Å; V872-L876 PolarHBondContact O-N 3.07Å; L873-L876 PolarHBondContact O-N 3.13Å; R874-L876 VanDerWaalsContact C-N 3.28Å; R874-L876 PolarHBondContact O-N 3.11Å; L876-E880 PolarHBondContact O-N 3.48Å; L876-L958 HydrophobicContact CB-CD2 4.43Å; L876-Q961 HydrophobicContact CD1-CB 3.96Å; L876-A983 HydrophobicContact CD1-CB 4.08Å; L876-A983 HydrophobicContact CD2-CB 3.54Å; L876-A983 HydrophobicContact CG-CB 4.43Å
877	L	89.4	Confident	88.2	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-75.6	-41.7	174.6	-77.4	170.8	0	0	0	112.4	L873 R874 R879 E880 G881 M882 Y886 L889 L955 L958	L873-L877 HydrophobicContact CG-CD1 4.45Å; L873-L877 PolarHBondContact O-N 3.42Å; R874-L877 PolarHBondContact O-N 3.36Å; L877-R879 VanDerWaalsContact C-N 3.31Å; L877-R879 PolarHBondContact O-N 3.39Å; L877-E880 PolarHBondContact O-N 3.36Å; L877-G881 PolarHBondContact O-N 3.29Å; L877-G881 VanDerWaalsContact O-N 3.12Å; L877-M882 HydrophobicContact CD2-CB 3.93Å; L877-M882 PolarHBondContact O-N 3.08Å; L877-Y886 HydrophobicContact CD1-CD2 3.97Å; L877-L889 HydrophobicContact CD1-CB 4.48Å; L877-L889 HydrophobicContact CD1-CD2 3.77Å; L877-L889 HydrophobicContact CD2-CD2 4.03Å; L877-L889 HydrophobicContact CG-CD2 4.24Å; L877-L955 HydrophobicContact CD2-CD2 4.42Å; L877-L958 HydrophobicContact CD2-CD1 4.35Å
878	E	88	Confident	88.1	Confident	124 Å²	124	63 Å²	63	58%	0.579	32%	0.321	S	S	*	.	H	α-helix	trans	-55.8	-47.6	173.5	-172.6	-179.2	-175.7	0	0	110.8	R874 E880 G881 F883	R874-E878 WeakPolarHBondContact O-CB 3.39Å; R874-E878 PolarHBondContact O-N 2.91Å; E878-E880 VanDerWaalsContact C-N 3.35Å; E878-E880 PolarHBondContact O-N 3.36Å; E878-G881 PolarHBondContact O-N 3.46Å; E878-G881 VanDerWaalsContact O-N 3.08Å; E878-F883 HydrophobicContact CB-CD2 4.1Å
879	R	84.6	Confident	88.1	Confident	124 Å²	124	61.3 Å²	61.3	47%	0.468	31%	0.313	S	S	.	.	H	α-helix	trans	-57.3	-40.2	177.9	-176.7	-170.3	-161.4	123.3	19	114.5	V875 L877 G881 E984	V875-R879 WeakPolarHBondContact O-CB 3.31Å; V875-R879 PolarHBondContact O-N 3.24Å; V875-R879 VanDerWaalsContact O-N 3.1Å; L877-R879 VanDerWaalsContact C-N 3.31Å; L877-R879 PolarHBondContact O-N 3.39Å; R879-G881 VanDerWaalsContact C-N 3.32Å; R879-E984 IonicContact CZ-OE1 2.68Å; R879-E984 IonicContact NH1-OE1 3.03Å; R879-E984 PolarHBondContact NH1-OE1 3.08Å; R879-E984 IonicContact NH2-OE1 3.61Å; R879-E984 PolarHBondContact NH2-OE1 3.17Å; R879-E984 IonicContact NH2-OE2 3.55Å
880	E	82.2	Confident	88.1	Confident	62 Å²	62	61.6 Å²	61.6	29%	0.29	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	2.5	-179.2	-63.4	-68.8	139.5	0	0	112.3	L876 L877 E878 L958 F988	L876-E880 PolarHBondContact O-N 3.48Å; L877-E880 PolarHBondContact O-N 3.36Å; E878-E880 VanDerWaalsContact C-N 3.35Å; E878-E880 PolarHBondContact O-N 3.36Å; E880-L958 HydrophobicContact CG-CD1 4.38Å; E880-L958 HydrophobicContact CG-CD2 4.15Å; E880-F988 HydrophobicContact CG-CD1 4.42Å; E880-F988 WeakPolarHBondContact OE2-CD1 3.48Å
881	G	82.6	Confident	88.2	Confident	62 Å²	62	63.4 Å²	63.4	64%	0.639	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	31.4	179.1	0	0	0	0	0	113.8	L877 E878 R879	L877-G881 PolarHBondContact O-N 3.29Å; L877-G881 VanDerWaalsContact O-N 3.12Å; E878-G881 PolarHBondContact O-N 3.46Å; E878-G881 VanDerWaalsContact O-N 3.08Å; R879-G881 VanDerWaalsContact C-N 3.32Å
882	M	81.8	Confident	88.3	Confident	29 Å²	29	62.1 Å²	62.1	14%	0.143	32%	0.318	C	S	.	.			trans	-121	28.8	-176.7	-59.6	-160.3	72.2	0	0	112.7	L877 D884 Q885 L955 I993	L877-M882 HydrophobicContact CD2-CB 3.93Å; L877-M882 PolarHBondContact O-N 3.08Å; M882-D884 PolarHBondContact O-N 2.85Å; M882-Q885 PolarHBondContact O-N 3.38Å; M882-Q885 VanDerWaalsContact O-N 3.14Å; M882-L955 HydrophobicContact CE-CD2 4.4Å; M882-L955 HydrophobicContact SD-CD2 4.12Å; M882-I993 HydrophobicContact CE-CD1 4Å; M882-I993 HydrophobicContact SD-CD1 4.02Å
883	F	86.9	Confident	88.3	Confident	100 Å²	100	62.1 Å²	62.1	44%	0.439	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-59.4	-32.3	-178.2	-164.8	-89.5	0	0	0	113	R874 E878 Q885 Y886	R874-F883 HydrophobicContact CG-CE2 3.74Å; R874-F883 HydrophobicContact CG-CZ 4.45Å; E878-F883 HydrophobicContact CB-CD2 4.1Å; F883-Q885 PolarHBondContact O-N 2.82Å; F883-Y886 WeakPolarHBondContact O-CB 3.35Å; F883-Y886 PolarHBondContact O-N 2.97Å
884	D	84.2	Confident	88.4	Confident	161 Å²	161	66.5 Å²	66.5	86%	0.861	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-55.5	-16.9	175.5	-48.7	-19	0	0	0	114.3	M882	M882-D884 PolarHBondContact O-N 2.85Å
885	Q	83.8	Confident	88.3	Confident	83 Å²	83	64.6 Å²	64.6	39%	0.388	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-103.8	6.4	179.3	-57.8	-174.1	6.3	0	0	112.9	M882 F883 L889	M882-Q885 PolarHBondContact O-N 3.38Å; M882-Q885 VanDerWaalsContact O-N 3.14Å; F883-Q885 PolarHBondContact O-N 2.82Å; Q885-L889 WeakPolarHBondContact O-CB 3.43Å; Q885-L889 PolarHBondContact O-N 3.2Å
886	Y	90.3	Very high	88.5	Confident	21 Å²	21	62.1 Å²	62.1	8%	0.082	32%	0.323	C	S	.	.	H	α-helix	trans	-60.6	-58.9	-173.9	173.1	-112.8	0	0	0	113	D870 R874 L877 F883 D888 L889 V890	D870-Y886 WeakPolarHBondContact OD1-CE2 3.47Å; D870-Y886 PolarHBondContact OD1-OH 3.29Å; D870-Y886 PolarHBondContact OD2-OH 2.84Å; R874-Y886 HydrophobicContact CB-CD2 4.16Å; R874-Y886 HydrophobicContact CB-CE2 3.61Å; R874-Y886 HydrophobicContact CG-CD2 4.22Å; R874-Y886 HydrophobicContact CG-CE1 4.46Å; R874-Y886 HydrophobicContact CG-CE2 3.89Å; R874-Y886 VanDerWaalsContact NE-CZ 3.32Å; R874-Y886 PolarHBondContact NE-OH 3.38Å; R874-Y886 PolarHBondContact NH2-OH 3.48Å; L877-Y886 HydrophobicContact CD1-CD2 3.97Å; F883-Y886 WeakPolarHBondContact O-CB 3.35Å; F883-Y886 PolarHBondContact O-N 2.97Å; Y886-D888 VanDerWaalsContact C-N 3.29Å; Y886-D888 PolarHBondContact O-N 2.85Å; Y886-L889 CarbonylContact O-C 3.55Å; Y886-L889 WeakPolarHBondContact O-CA 3.08Å; Y886-L889 PolarHBondContact O-N 3.08Å; Y886-V890 HydrophobicContact CD2-CG2 3.79Å; Y886-V890 HydrophobicContact CE1-CG2 4.17Å; Y886-V890 HydrophobicContact CE2-CG2 3.31Å; Y886-V890 HydrophobicContact CG-CG2 4.36Å; Y886-V890 WeakPolarHBondContact O-CG2 3.37Å; Y886-V890 PolarHBondContact O-N 2.68Å
887	D	90.1	Very high	88.6	Confident	122 Å²	122	64.2 Å²	64.2	65%	0.652	34%	0.337	S	S	*	.	H	α-helix	trans	-59	-44.2	-177.7	-57.4	-38.5	0	0	0	111.5	L889 V890 V891	D887-L889 PolarHBondContact O-N 2.98Å; D887-V890 PolarHBondContact O-N 3.15Å; D887-V891 WeakPolarHBondContact O-CG2 3.32Å; D887-V891 PolarHBondContact O-N 3.07Å
888	D	89.1	Confident	88.6	Confident	104 Å²	104	72.4 Å²	72.4	56%	0.556	37%	0.373	S	S	*	.	H	α-helix	trans	-63.1	-24.6	178.4	-144.5	56.3	0	0	0	112.7	Y886 K892	Y886-D888 VanDerWaalsContact C-N 3.29Å; Y886-D888 PolarHBondContact O-N 2.85Å; D888-K892 VanDerWaalsContact O-CD 3.29Å; D888-K892 WeakPolarHBondContact O-CD 3.34Å; D888-K892 VanDerWaalsContact O-CE 3.31Å; D888-K892 WeakPolarHBondContact O-CE 3.11Å; D888-K892 VanDerWaalsContact O-CG 3.32Å; D888-K892 WeakPolarHBondContact O-CG 3.48Å; D888-K892 PolarHBondContact O-NZ 3.02Å; D888-K892 IonicContact OD2-NZ 3Å; D888-K892 PolarHBondContact OD2-NZ 3.47Å
889	L	91	Very high	88.7	Confident	2 Å²	2	68.2 Å²	68.2	1%	0.01	35%	0.353	C	S	.	.	H	α-helix	trans	-92.9	-34.9	175.9	-161.8	66.8	0	0	0	112.1	L873 L877 Q885 Y886 D887 K892 M893 I951 L955	L873-L889 HydrophobicContact CD1-CD2 3.96Å; L873-L889 HydrophobicContact CD2-CD2 4.4Å; L873-L889 HydrophobicContact CD2-CG 4.41Å; L873-L889 HydrophobicContact CG-CD2 4.37Å; L877-L889 HydrophobicContact CD1-CB 4.48Å; L877-L889 HydrophobicContact CD1-CD2 3.77Å; L877-L889 HydrophobicContact CD2-CD2 4.03Å; L877-L889 HydrophobicContact CG-CD2 4.24Å; Q885-L889 WeakPolarHBondContact O-CB 3.43Å; Q885-L889 PolarHBondContact O-N 3.2Å; Y886-L889 CarbonylContact O-C 3.55Å; Y886-L889 WeakPolarHBondContact O-CA 3.08Å; Y886-L889 PolarHBondContact O-N 3.08Å; D887-L889 PolarHBondContact O-N 2.98Å; L889-K892 CarbonylContact O-C 3.56Å; L889-K892 PolarHBondContact O-N 3.2Å; L889-M893 WeakPolarHBondContact O-CB 3.11Å; L889-M893 VanDerWaalsContact O-CG 3.29Å; L889-M893 WeakPolarHBondContact O-CG 3.3Å; L889-M893 PolarHBondContact O-N 2.87Å; L889-I951 HydrophobicContact CD1-CG1 4.11Å; L889-I951 HydrophobicContact CD1-CG2 3.95Å; L889-L955 HydrophobicContact CD1-CB 4.41Å; L889-L955 HydrophobicContact CD1-CD1 3.81Å; L889-L955 HydrophobicContact CD2-CD1 4.23Å
890	V	92.2	Very high	89	Confident	18 Å²	18	65.3 Å²	65.3	11%	0.109	35%	0.345	C	S	.	.	H	α-helix	trans	-60.3	-45.6	172.8	169.6	0	0	0	0	110.4	D870 L873 Y886 D887 K892 M893 Q894	D870-V890 VanDerWaalsContact OD1-CG2 3.3Å; D870-V890 WeakPolarHBondContact OD1-CG2 3.28Å; L873-V890 HydrophobicContact CD2-CG2 4.09Å; Y886-V890 HydrophobicContact CD2-CG2 3.79Å; Y886-V890 HydrophobicContact CE1-CG2 4.17Å; Y886-V890 HydrophobicContact CE2-CG2 3.31Å; Y886-V890 HydrophobicContact CG-CG2 4.36Å; Y886-V890 WeakPolarHBondContact O-CG2 3.37Å; Y886-V890 PolarHBondContact O-N 2.68Å; D887-V890 PolarHBondContact O-N 3.15Å; V890-K892 VanDerWaalsContact C-N 3.29Å; V890-K892 PolarHBondContact O-N 3.44Å; V890-M893 CarbonylContact O-C 3.51Å; V890-M893 PolarHBondContact O-N 2.93Å; V890-M893 VanDerWaalsContact O-N 3.09Å; V890-Q894 HydrophobicContact CG1-CG 4.43Å; V890-Q894 WeakPolarHBondContact O-CG 3.17Å; V890-Q894 PolarHBondContact O-N 2.82Å
891	V	92.5	Very high	89.3	Confident	88 Å²	88	62.4 Å²	62.4	53%	0.533	33%	0.331	S	S	.	.	H	α-helix	trans	-58.2	-41.8	174.6	172.6	0	0	0	0	111.2	D887 Q894 V895	D887-V891 WeakPolarHBondContact O-CG2 3.32Å; D887-V891 PolarHBondContact O-N 3.07Å; V891-Q894 PolarHBondContact O-N 2.94Å; V891-V895 PolarHBondContact O-N 3.25Å; V891-V895 VanDerWaalsContact O-N 3.07Å
892	K	92.7	Very high	89.7	Confident	50 Å²	50	60.5 Å²	60.5	22%	0.217	31%	0.307	C	S	.	.	H	α-helix	trans	-69.1	-34.3	176.2	-66.8	171.2	-166.1	120.7	0	112.2	D888 L889 V890 V895 Y896 A949 I951	D888-K892 VanDerWaalsContact O-CD 3.29Å; D888-K892 WeakPolarHBondContact O-CD 3.34Å; D888-K892 VanDerWaalsContact O-CE 3.31Å; D888-K892 WeakPolarHBondContact O-CE 3.11Å; D888-K892 VanDerWaalsContact O-CG 3.32Å; D888-K892 WeakPolarHBondContact O-CG 3.48Å; D888-K892 PolarHBondContact O-NZ 3.02Å; D888-K892 IonicContact OD2-NZ 3Å; D888-K892 PolarHBondContact OD2-NZ 3.47Å; L889-K892 CarbonylContact O-C 3.56Å; L889-K892 PolarHBondContact O-N 3.2Å; V890-K892 VanDerWaalsContact C-N 3.29Å; V890-K892 PolarHBondContact O-N 3.44Å; K892-V895 WeakPolarHBondContact O-CB 3.45Å; K892-V895 PolarHBondContact O-N 3.04Å; K892-Y896 PolarHBondContact O-N 3.18Å; K892-A949 WeakPolarHBondContact CB-O 3.31Å; K892-A949 WeakPolarHBondContact CG-O 3.45Å; K892-A949 VanDerWaalsContact O-CB 3.3Å; K892-A949 WeakPolarHBondContact O-CB 3.44Å; K892-I951 HydrophobicContact CB-CD1 4.23Å; K892-I951 HydrophobicContact CB-CG1 3.76Å; K892-I951 HydrophobicContact CD-CG1 4.28Å
893	M	92.7	Very high	90	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-73.1	-31.4	175.2	-70.3	-64.3	-67.1	0	0	112.5	F868 L873 L889 V890 V895 Y896 S897 L945 I951 C959	F868-M893 HydrophobicContact CB-CE 3.38Å; F868-M893 HydrophobicContact CD1-CB 4.02Å; F868-M893 HydrophobicContact CD1-CE 4.09Å; F868-M893 HydrophobicContact CD2-CB 3.94Å; F868-M893 HydrophobicContact CD2-CE 3.94Å; F868-M893 HydrophobicContact CE1-CB 3.75Å; F868-M893 WeakPolarHBondContact CE1-O 3.33Å; F868-M893 HydrophobicContact CE2-CB 3.66Å; F868-M893 HydrophobicContact CG-CB 4.12Å; F868-M893 HydrophobicContact CG-CE 3.54Å; F868-M893 HydrophobicContact CZ-CB 3.56Å; L873-M893 HydrophobicContact CD2-CB 4.36Å; L873-M893 HydrophobicContact CD2-CG 3.79Å; L889-M893 WeakPolarHBondContact O-CB 3.11Å; L889-M893 VanDerWaalsContact O-CG 3.29Å; L889-M893 WeakPolarHBondContact O-CG 3.3Å; L889-M893 PolarHBondContact O-N 2.87Å; V890-M893 CarbonylContact O-C 3.51Å; V890-M893 PolarHBondContact O-N 2.93Å; V890-M893 VanDerWaalsContact O-N 3.09Å; M893-V895 VanDerWaalsContact C-N 3.3Å; M893-Y896 HydrophobicContact CE-CD1 3.92Å; M893-Y896 HydrophobicContact CE-CE1 4.36Å; M893-Y896 WeakPolarHBondContact O-CA 3.21Å; M893-Y896 WeakPolarHBondContact O-CB 3.5Å; M893-Y896 PolarHBondContact O-N 3.22Å; M893-Y896 VanDerWaalsContact O-N 3.15Å; M893-Y896 HydrophobicContact SD-CD1 4.42Å; M893-S897 PolarHBondContact O-N 2.93Å; M893-S897 PolarHBondContact O-OG 3.44Å; M893-L945 HydrophobicContact CE-CD2 4.22Å; M893-L945 HydrophobicContact SD-CD2 3.54Å; M893-L945 VanDerWaalsContact SD-CD2 3.54Å; M893-I951 HydrophobicContact CG-CD1 4.34Å; M893-I951 HydrophobicContact SD-CD1 3.6Å; M893-C959 HydrophobicContact CE-CB 4.32Å; M893-C959 HydrophobicContact SD-CB 3.67Å
894	Q	92	Very high	90	Very high	93 Å²	93	54.5 Å²	54.5	44%	0.435	28%	0.281	S	S	.	.	H	α-helix	trans	-67.9	-27.1	167.4	-68.9	175.1	11.5	0	0	112.8	F868 V890 V891 S897 K898	F868-Q894 HydrophobicContact CZ-CG 4.36Å; V890-Q894 HydrophobicContact CG1-CG 4.43Å; V890-Q894 WeakPolarHBondContact O-CG 3.17Å; V890-Q894 PolarHBondContact O-N 2.82Å; V891-Q894 PolarHBondContact O-N 2.94Å; Q894-S897 PolarHBondContact O-OG 2.63Å; Q894-K898 WeakPolarHBondContact O-CD 3.43Å; Q894-K898 WeakPolarHBondContact O-CG 3.34Å
895	V	90.7	Very high	90	Very high	57 Å²	57	47.1 Å²	47.1	35%	0.345	24%	0.241	S	C	.	.	H	α-helix	trans	-72	-41.5	166.4	173.1	0	0	0	0	110.2	V891 K892 M893 S897 K898 H899 A949	V891-V895 PolarHBondContact O-N 3.25Å; V891-V895 VanDerWaalsContact O-N 3.07Å; K892-V895 WeakPolarHBondContact O-CB 3.45Å; K892-V895 PolarHBondContact O-N 3.04Å; M893-V895 VanDerWaalsContact C-N 3.3Å; V895-S897 PolarHBondContact O-N 2.86Å; V895-K898 PolarHBondContact O-N 3.05Å; V895-H899 PolarHBondContact O-CE1 3.07Å; V895-H899 PolarHBondContact O-ND1 3.47Å; V895-A949 HydrophobicContact CG1-CB 4.49Å
896	Y	92.9	Very high	89.5	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-59.2	-45	176.1	170.7	-101.8	0	0	0	113.1	L866 K892 M893 K898 H899 R941 I944 L945 S963	L866-Y896 HydrophobicContact CB-CD1 4.34Å; L866-Y896 HydrophobicContact CB-CE1 3.77Å; L866-Y896 HydrophobicContact CB-CE2 4.21Å; L866-Y896 HydrophobicContact CD1-CE2 3.9Å; L866-Y896 WeakPolarHBondContact O-CD1 3.47Å; L866-Y896 VanDerWaalsContact O-CE1 3.24Å; L866-Y896 WeakPolarHBondContact O-CE1 3.34Å; K892-Y896 PolarHBondContact O-N 3.18Å; M893-Y896 HydrophobicContact CE-CD1 3.92Å; M893-Y896 HydrophobicContact CE-CE1 4.36Å; M893-Y896 WeakPolarHBondContact O-CA 3.21Å; M893-Y896 WeakPolarHBondContact O-CB 3.5Å; M893-Y896 PolarHBondContact O-N 3.22Å; M893-Y896 VanDerWaalsContact O-N 3.15Å; M893-Y896 HydrophobicContact SD-CD1 4.42Å; Y896-K898 VanDerWaalsContact C-N 3.26Å; Y896-K898 PolarHBondContact O-N 3.37Å; Y896-H899 WeakPolarHBondContact O-CB 3.38Å; Y896-H899 PolarHBondContact O-N 3.34Å; Y896-R941 VanDerWaalsContact OH-CD 3.31Å; Y896-R941 WeakPolarHBondContact OH-CD 3.45Å; Y896-R941 WeakPolarHBondContact OH-CG 3.46Å; Y896-I944 HydrophobicContact CD2-CB 4.34Å; Y896-I944 HydrophobicContact CD2-CG2 3.76Å; Y896-I944 HydrophobicContact CE2-CB 4.2Å; Y896-I944 HydrophobicContact CE2-CG2 4.01Å; Y896-L945 HydrophobicContact CD1-CD2 4.03Å; Y896-L945 HydrophobicContact CD2-CD2 3.32Å; Y896-L945 HydrophobicContact CD2-CG 3.67Å; Y896-L945 HydrophobicContact CE1-CD2 4.31Å; Y896-L945 HydrophobicContact CE2-CD1 4.46Å; Y896-L945 HydrophobicContact CE2-CD2 3.65Å; Y896-L945 HydrophobicContact CE2-CG 3.62Å; Y896-L945 HydrophobicContact CG-CD2 3.53Å; Y896-L945 HydrophobicContact CG-CG 4.37Å; Y896-S963 VanDerWaalsContact CE1-CB 3.46Å; Y896-S963 PolarHBondContact OH-OG 3.16Å
897	S	91.8	Very high	88.7	Confident	48 Å²	48	47.2 Å²	47.2	34%	0.336	25%	0.253	S	S	.	.	H	α-helix	trans	-68.5	-21.3	-178.5	59.7	0	0	0	0	114.7	L866 M893 Q894 V895 H899	L866-S897 WeakPolarHBondContact O-CA 3.31Å; M893-S897 PolarHBondContact O-N 2.93Å; M893-S897 PolarHBondContact O-OG 3.44Å; Q894-S897 PolarHBondContact O-OG 2.63Å; V895-S897 PolarHBondContact O-N 2.86Å; S897-H899 PolarHBondContact O-N 3.14Å
898	K	89.1	Confident	87.9	Confident	172 Å²	172	47.2 Å²	47.2	75%	0.748	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-8.7	171.8	-68	171.4	-174.1	179.4	0	113.4	Q894 V895 Y896	Q894-K898 WeakPolarHBondContact O-CD 3.43Å; Q894-K898 WeakPolarHBondContact O-CG 3.34Å; V895-K898 PolarHBondContact O-N 3.05Å; Y896-K898 VanDerWaalsContact C-N 3.26Å; Y896-K898 PolarHBondContact O-N 3.37Å
899	H	90.3	Very high	87.2	Confident	37 Å²	37	45.6 Å²	45.6	17%	0.171	24%	0.239	C	C	.	.			trans	-94.6	145.2	175.3	-68.4	90.9	0	0	0	111.2	L866 V895 Y896 S897 I916 I944	L866-H899 WeakPolarHBondContact CB-O 3.35Å; L866-H899 HydrophobicContact CD1-CB 4.41Å; L866-H899 WeakPolarHBondContact CD1-O 3.39Å; L866-H899 WeakPolarHBondContact CG-O 3.39Å; V895-H899 PolarHBondContact O-CE1 3.07Å; V895-H899 PolarHBondContact O-ND1 3.47Å; Y896-H899 WeakPolarHBondContact O-CB 3.38Å; Y896-H899 PolarHBondContact O-N 3.34Å; S897-H899 PolarHBondContact O-N 3.14Å; H899-I916 WeakPolarHBondContact CD2-CD1 3.42Å; H899-I944 HydrophobicContact CB-CG2 3.86Å
900	H	89	Confident	86.7	Confident	63 Å²	63	46.6 Å²	46.6	29%	0.292	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	162.8	172.5	58.5	-92	0	0	0	111.5	I864 I916	I864-H900 CarbonylContact O-C 3.56Å; I864-H900 WeakPolarHBondContact O-CA 3.35Å; I864-H900 VanDerWaalsContact O-CB 3.28Å; I864-H900 WeakPolarHBondContact O-CB 3.36Å; H900-I916 WeakPolarHBondContact O-CG2 3.45Å
901	L	90.4	Very high	86.2	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	125.8	170.3	-174.2	75	0	0	0	108.6	I864 L866 Y913 L937 C940 I944	I864-L901 HydrophobicContact CB-CB 4.46Å; I864-L901 WeakPolarHBondContact CB-O 3.39Å; I864-L901 PolarHBondContact N-O 3.29Å; I864-L901 PolarHBondContact O-N 3.39Å; L866-L901 HydrophobicContact CD2-CB 4.24Å; L901-Y913 HydrophobicContact CD2-CD1 3.69Å; L901-Y913 HydrophobicContact CD2-CE1 4.46Å; L901-Y913 HydrophobicContact CD2-CG 3.97Å; L901-Y913 HydrophobicContact CG-CD1 4.32Å; L901-L937 HydrophobicContact CD2-CD1 3.36Å; L901-C940 HydrophobicContact CD1-CB 4.05Å; L901-C940 HydrophobicContact CD2-CB 4.13Å; L901-I944 HydrophobicContact CB-CD1 4.39Å; L901-I944 HydrophobicContact CD1-CD1 3.86Å
902	T	89.8	Confident	86	Confident	22 Å²	22	43.8 Å²	43.8	14%	0.135	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	115.2	178.6	-60.5	0	0	0	0	109.7	H861 R862 Y913 I914	H861-T902 HydrophobicContact CB-CG2 3.93Å; R862-T902 CarbonylContact O-C 3.56Å; R862-T902 WeakPolarHBondContact O-CA 3.45Å; T902-Y913 CarbonylContact O-C 3.59Å; T902-Y913 WeakPolarHBondContact O-CA 3.33Å; T902-I914 PolarHBondContact N-O 2.89Å; T902-I914 PolarHBondContact O-N 3.43Å
903	V	89	Confident	85.9	Confident	4 Å²	4	42 Å²	42	2%	0.024	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	129.3	168	-168.1	0	0	0	0	108.6	H861 R862 I864 I910 Y913	H861-V903 CarbonylContact C-O 3.57Å; H861-V903 WeakPolarHBondContact CA-O 3.44Å; R862-V903 HydrophobicContact CB-CB 4.38Å; R862-V903 PolarHBondContact N-O 3.4Å; R862-V903 PolarHBondContact O-N 3.04Å; I864-V903 HydrophobicContact CD1-CG2 3.15Å; I864-V903 HydrophobicContact CG1-CG2 3.8Å; V903-I910 HydrophobicContact CG1-CB 4.25Å; V903-I910 HydrophobicContact CG1-CD1 4.26Å; V903-I910 HydrophobicContact CG1-CG1 3.8Å; V903-I910 HydrophobicContact CG1-CG2 3.64Å; V903-Y913 HydrophobicContact CG1-CD1 4.45Å; V903-Y913 HydrophobicContact CG1-CE1 4.29Å; V903-Y913 HydrophobicContact CG2-CD1 4.09Å; V903-Y913 HydrophobicContact CG2-CE1 4.08Å
904	V	86.2	Confident	85.8	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	113.4	163	176.7	0	0	0	0	107.9	E859 I910 Y911 S912 I914	E859-V904 HydrophobicContact CB-CG1 4.01Å; E859-V904 HydrophobicContact CG-CG1 3.87Å; E859-V904 WeakPolarHBondContact OE2-CG1 3.49Å; V904-I910 WeakPolarHBondContact O-CA 3.42Å; V904-Y911 PolarHBondContact O-N 3.08Å; V904-S912 WeakPolarHBondContact CB-OG 3.35Å; V904-S912 VanDerWaalsContact CG2-OG 3.28Å; V904-S912 WeakPolarHBondContact CG2-OG 3.5Å; V904-S912 PolarHBondContact N-O 2.71Å; V904-I914 HydrophobicContact CG2-CD1 3.52Å; V904-I914 HydrophobicContact CG2-CG1 4Å
905	S	83.6	Confident	85.7	Confident	5 Å²	5	39.6 Å²	39.6	4%	0.035	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	140.6	174.3	29.3	0	0	0	0	112.2	E859 I860 R909	E859-S905 CarbonylContact C-O 3.55Å; I860-S905 WeakPolarHBondContact CA-O 3.36Å; I860-S905 PolarHBondContact N-O 3.09Å; I860-S905 PolarHBondContact O-N 3.25Å; I860-S905 PolarHBondContact O-OG 2.92Å; S905-R909 CarbonylContact C-O 3.43Å; S905-R909 WeakPolarHBondContact CA-O 3.42Å; S905-R909 WeakPolarHBondContact CB-O 3.47Å
906	R	75	Confident	85.5	Confident	58 Å²	58	40.3 Å²	40.3	22%	0.219	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	111	172.6	-171.8	-178.5	-179.1	136.4	-20.9	106.7	N737 N857 R909 Y911	N737-R906 PolarHBondContact O-NH2 3.01Å; N737-R906 VanDerWaalsContact O-NH2 3.14Å; N857-R906 PolarHBondContact ND2-NH2 2.83Å; N857-R906 PolarHBondContact OD1-NE 2.95Å; N857-R906 PolarHBondContact OD1-NH2 2.83Å; R906-R909 PolarHBondContact N-O 2.9Å; R906-R909 PolarHBondContact O-N 3.37Å; R906-Y911 HydrophobicContact CB-CD2 3.86Å; R906-Y911 HydrophobicContact CB-CE2 3.69Å
907	G	73.4	Confident	85.2	Confident	48 Å²	48	43.4 Å²	43.4	50%	0.495	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	-138.9	-160.4	0	0	0	0	0	111.9	R909	G907-R909 PolarHBondContact O-N 3.16Å
908	N	72.5	Confident	84.8	Confident	123 Å²	123	43.7 Å²	43.7	66%	0.658	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77	14.8	-175.4	-64.5	-5.1	0	0	0	114.4
909	R	73.4	Confident	84.7	Confident	70 Å²	70	42.7 Å²	42.7	26%	0.264	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	142	-170.4	-70.9	-178.2	165.3	-155.6	-5.5	113.2	Q730 L731 S905 R906 G907 Y911	Q730-R909 PolarHBondContact O-NE 2.72Å; Q730-R909 VanDerWaalsContact O-NE 3.16Å; Q730-R909 PolarHBondContact O-NH1 2.68Å; Q730-R909 PolarHBondContact O-NH2 3.44Å; L731-R909 VanDerWaalsContact CG-NH2 3.33Å; S905-R909 CarbonylContact C-O 3.43Å; S905-R909 WeakPolarHBondContact CA-O 3.42Å; S905-R909 WeakPolarHBondContact CB-O 3.47Å; R906-R909 PolarHBondContact N-O 2.9Å; R906-R909 PolarHBondContact O-N 3.37Å; G907-R909 PolarHBondContact O-N 3.16Å; R909-Y911 HydrophobicContact CB-CD2 4.39Å; R909-Y911 HydrophobicContact CB-CE2 4.03Å
910	I	82.4	Confident	84.5	Confident	22 Å²	22	47.1 Å²	47.1	11%	0.113	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	117.3	175.6	-56.7	165.9	0	0	0	107.9	V903 V904 Y913 V923 K967 Y971	V903-I910 HydrophobicContact CG1-CB 4.25Å; V903-I910 HydrophobicContact CG1-CD1 4.26Å; V903-I910 HydrophobicContact CG1-CG1 3.8Å; V903-I910 HydrophobicContact CG1-CG2 3.64Å; V904-I910 WeakPolarHBondContact O-CA 3.42Å; I910-Y913 HydrophobicContact CG2-CE1 4.1Å; I910-Y913 HydrophobicContact CG2-CE2 4.43Å; I910-V923 HydrophobicContact CG2-CB 4.49Å; I910-V923 HydrophobicContact CG2-CG2 4.07Å; I910-K967 HydrophobicContact CD1-CD 4.05Å; I910-Y971 WeakPolarHBondContact CD1-OH 3.2Å
911	Y	81.5	Confident	84.4	Confident	45 Å²	45	45.4 Å²	45.4	18%	0.176	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-41.3	177.2	-83.4	-108.1	0	0	0	111.2	V904 R906 R909 V923 V924	V904-Y911 PolarHBondContact O-N 3.08Å; R906-Y911 HydrophobicContact CB-CD2 3.86Å; R906-Y911 HydrophobicContact CB-CE2 3.69Å; R909-Y911 HydrophobicContact CB-CD2 4.39Å; R909-Y911 HydrophobicContact CB-CE2 4.03Å; Y911-V923 PolarHBondContact O-N 3.26Å; Y911-V924 HydrophobicContact CD1-CG2 4.46Å
912	S	88.2	Confident	84.1	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.014	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	163.7	177.4	66.6	0	0	0	0	113.3	V904 R920 F921	V904-S912 WeakPolarHBondContact CB-OG 3.35Å; V904-S912 VanDerWaalsContact CG2-OG 3.28Å; V904-S912 WeakPolarHBondContact CG2-OG 3.5Å; V904-S912 PolarHBondContact N-O 2.71Å; S912-R920 WeakPolarHBondContact OG-CG 3.44Å; S912-R920 PolarHBondContact OG-NE 3.43Å; S912-F921 CarbonylContact C-O 3.6Å; S912-F921 WeakPolarHBondContact CA-O 3.41Å; S912-F921 VanDerWaalsContact CB-O 3.3Å; S912-F921 WeakPolarHBondContact CB-O 3.22Å
913	Y	89.6	Confident	83.7	Confident	14 Å²	14	48.4 Å²	48.4	6%	0.055	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	134.3	159.5	-55.9	-78.6	0	0	0	109	L901 T902 V903 I910 R920 F921 V923 L937 C940	L901-Y913 HydrophobicContact CD2-CD1 3.69Å; L901-Y913 HydrophobicContact CD2-CE1 4.46Å; L901-Y913 HydrophobicContact CD2-CG 3.97Å; L901-Y913 HydrophobicContact CG-CD1 4.32Å; T902-Y913 CarbonylContact O-C 3.59Å; T902-Y913 WeakPolarHBondContact O-CA 3.33Å; V903-Y913 HydrophobicContact CG1-CD1 4.45Å; V903-Y913 HydrophobicContact CG1-CE1 4.29Å; V903-Y913 HydrophobicContact CG2-CD1 4.09Å; V903-Y913 HydrophobicContact CG2-CE1 4.08Å; I910-Y913 HydrophobicContact CG2-CE1 4.1Å; I910-Y913 HydrophobicContact CG2-CE2 4.43Å; Y913-R920 CarbonylContact O-C 3.45Å; Y913-F921 PolarHBondContact N-O 3.03Å; Y913-F921 WeakPolarHBondContact O-CB 3.44Å; Y913-F921 PolarHBondContact O-N 2.86Å; Y913-V923 HydrophobicContact CD2-CG2 3.41Å; Y913-V923 VanDerWaalsContact CD2-CG2 3.41Å; Y913-V923 HydrophobicContact CE2-CG2 3.3Å; Y913-V923 HydrophobicContact CG-CG2 4.44Å; Y913-L937 HydrophobicContact CD1-CD1 4.24Å; Y913-L937 HydrophobicContact CE1-CD1 3.94Å; Y913-L937 HydrophobicContact CE2-CB 4.16Å; Y913-C940 VanDerWaalsContact CD2-SG 3.54Å
914	I	90	Very high	83	Confident	39 Å²	39	51.1 Å²	51.1	20%	0.2	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	122.4	175.3	-65.3	171	0	0	0	108.3	T902 V904 R920	T902-I914 PolarHBondContact N-O 2.89Å; T902-I914 PolarHBondContact O-N 3.43Å; V904-I914 HydrophobicContact CG2-CD1 3.52Å; V904-I914 HydrophobicContact CG2-CG1 4Å; I914-R920 HydrophobicContact CG1-CB 4.25Å; I914-R920 HydrophobicContact CG1-CG 3.93Å
915	C	91.6	Very high	82	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.014	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	153.4	169	-175.7	0	0	0	0	110.4	C917 G918 R919 F921 H943 I944 H948	C915-C917 PolarHBondContact O-N 2.97Å; C915-C917 PolarHBondContact SG-SG 3Å; C915-G918 WeakPolarHBondContact O-CA 3.45Å; C915-G918 PolarHBondContact O-N 3.45Å; C915-R919 HydrophobicContact CB-CB 4.35Å; C915-R919 PolarHBondContact N-O 3.12Å; C915-F921 HydrophobicContact CB-CE2 4.08Å; C915-H943 VanDerWaalsContact SG-CD2 3.55Å; C915-I944 WeakPolarHBondContact SG-CG1 3.32Å; C915-H948 PolarHBondContact SG-NE2 3.12Å
916	I	86.6	Confident	80.6	Confident	73 Å²	73	63.2 Å²	63.2	37%	0.374	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-17.1	178.5	62.4	122.3	0	0	0	115	H899 H900 G918 H948	H899-I916 WeakPolarHBondContact CD2-CD1 3.42Å; H900-I916 WeakPolarHBondContact O-CG2 3.45Å; I916-G918 PolarHBondContact O-N 3.21Å; I916-H948 VanDerWaalsContact CD1-CE1 3.46Å; I916-H948 WeakPolarHBondContact CD1-CE1 3.49Å; I916-H948 WeakPolarHBondContact CD1-ND1 3.24Å
917	C	86.3	Confident	79.6	Confident	65 Å²	65	67 Å²	67	44%	0.439	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	8.2	168.8	61.7	0	0	0	0	114.5	C915 R919 H943 H948	C915-C917 PolarHBondContact O-N 2.97Å; C915-C917 PolarHBondContact SG-SG 3Å; C917-R919 PolarHBondContact O-N 2.92Å; C917-R919 WeakPolarHBondContact SG-CB 3.49Å; C917-H943 PolarHBondContact SG-NE2 2.77Å; C917-H948 WeakPolarHBondContact CB-NE2 3.31Å
918	G	82.8	Confident	78.7	Confident	54 Å²	54	70.5 Å²	70.5	56%	0.557	36%	0.358	S	S	*	.	S	Bend	trans	77.6	-3.9	-173.7	0	0	0	0	0	114.8	C915 I916 R920	C915-G918 WeakPolarHBondContact O-CA 3.45Å; C915-G918 PolarHBondContact O-N 3.45Å; I916-G918 PolarHBondContact O-N 3.21Å; G918-R920 PolarHBondContact O-N 2.77Å
919	R	86.4	Confident	77.7	Confident	150 Å²	150	73 Å²	73	57%	0.566	37%	0.366	S	S	*	.			trans	-69.5	108	-178.6	-166.7	173.1	-165.6	142	5.5	110.9	C915 C917 F921 H943	C915-R919 HydrophobicContact CB-CB 4.35Å; C915-R919 PolarHBondContact N-O 3.12Å; C917-R919 PolarHBondContact O-N 2.92Å; C917-R919 WeakPolarHBondContact SG-CB 3.49Å; R919-F921 HydrophobicContact CB-CE2 4.05Å; R919-F921 HydrophobicContact CG-CD2 4.45Å; R919-F921 HydrophobicContact CG-CE2 3.82Å; R919-F921 HydrophobicContact CG-CZ 4.09Å; R919-F921 VanDerWaalsContact O-CD2 3.26Å; R919-F921 WeakPolarHBondContact O-CD2 3.49Å; R919-F921 WeakPolarHBondContact O-CE2 3.35Å; R919-H943 WeakPolarHBondContact CD-NE2 3.46Å
920	R	87.2	Confident	76.9	Confident	130 Å²	130	71.7 Å²	71.7	49%	0.491	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	132	172.9	-159	175.9	-152	-148.3	9.8	110.1	E859 S912 Y913 I914 G918	E859-R920 IonicContact OE1-CZ 3.39Å; E859-R920 IonicContact OE1-NH2 3.47Å; E859-R920 PolarHBondContact OE1-NH2 2.77Å; E859-R920 IonicContact OE2-NH2 3.94Å; E859-R920 PolarHBondContact OE2-NH2 3.03Å; S912-R920 WeakPolarHBondContact OG-CG 3.44Å; S912-R920 PolarHBondContact OG-NE 3.43Å; Y913-R920 CarbonylContact O-C 3.45Å; I914-R920 HydrophobicContact CG1-CB 4.25Å; I914-R920 HydrophobicContact CG1-CG 3.93Å; G918-R920 PolarHBondContact O-N 2.77Å
921	F	86.6	Confident	75.8	Confident	28 Å²	28	78.8 Å²	78.8	12%	0.123	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	98.5	177.4	-72.7	-95.1	0	0	0	108.3	S912 Y913 C915 R919 V923 A935 C940 H943	S912-F921 CarbonylContact C-O 3.6Å; S912-F921 WeakPolarHBondContact CA-O 3.41Å; S912-F921 VanDerWaalsContact CB-O 3.3Å; S912-F921 WeakPolarHBondContact CB-O 3.22Å; Y913-F921 PolarHBondContact N-O 3.03Å; Y913-F921 WeakPolarHBondContact O-CB 3.44Å; Y913-F921 PolarHBondContact O-N 2.86Å; C915-F921 HydrophobicContact CB-CE2 4.08Å; R919-F921 HydrophobicContact CB-CE2 4.05Å; R919-F921 HydrophobicContact CG-CD2 4.45Å; R919-F921 HydrophobicContact CG-CE2 3.82Å; R919-F921 HydrophobicContact CG-CZ 4.09Å; R919-F921 VanDerWaalsContact O-CD2 3.26Å; R919-F921 WeakPolarHBondContact O-CD2 3.49Å; R919-F921 WeakPolarHBondContact O-CE2 3.35Å; F921-V923 PolarHBondContact O-N 2.93Å; F921-A935 HydrophobicContact CB-CB 3.78Å; F921-A935 HydrophobicContact CD1-CB 3.94Å; F921-A935 HydrophobicContact CG-CB 4.37Å; F921-C940 WeakPolarHBondContact CB-SG 3.49Å; F921-C940 HydrophobicContact CD2-CB 4.48Å; F921-C940 HydrophobicContact CG-CB 4.48Å; F921-C940 VanDerWaalsContact CG-SG 3.53Å; F921-H943 HydrophobicContact CE1-CB 4.36Å; F921-H943 HydrophobicContact CE2-CB 4.33Å; F921-H943 AromaticContact CE2-CD2 3.6Å; F921-H943 HydrophobicContact CZ-CB 3.59Å; F921-H943 AromaticContact CZ-CD2 3.49Å; F921-H943 VanDerWaalsContact CZ-CD2 3.49Å; F921-H943 WeakPolarHBondContact CZ-CD2 3.36Å; F921-H943 AromaticContact CZ-CG 3.59Å
922	A	83.4	Confident	74.8	Confident	38 Å²	38	83.1 Å²	83.1	31%	0.314	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	125.9	179.8	0	0	0	0	0	111.1	A935	A922-A935 WeakPolarHBondContact O-CB 3.49Å; A922-A935 PolarHBondContact O-N 2.85Å
923	V	82.6	Confident	74	Confident	46 Å²	46	91 Å²	91	28%	0.279	46%	0.46	S	S	.	.	S	Bend	trans	-96	-28.1	179.4	-179.1	0	0	0	0	110.8	I910 Y911 Y913 F921 P934	I910-V923 HydrophobicContact CG2-CB 4.49Å; I910-V923 HydrophobicContact CG2-CG2 4.07Å; Y911-V923 PolarHBondContact O-N 3.26Å; Y913-V923 HydrophobicContact CD2-CG2 3.41Å; Y913-V923 VanDerWaalsContact CD2-CG2 3.41Å; Y913-V923 HydrophobicContact CE2-CG2 3.3Å; Y913-V923 HydrophobicContact CG-CG2 4.44Å; F921-V923 PolarHBondContact O-N 2.93Å; V923-P934 WeakPolarHBondContact O-CB 3.34Å
924	V	72.8	Confident	73.5	Confident	62 Å²	62	92.6 Å²	92.6	38%	0.376	47%	0.472	S	S	.	.	S	Bend	trans	-88.6	157.8	167.5	-175.5	0	0	0	0	108.3	Y911	Y911-V924 HydrophobicContact CD1-CG2 4.46Å
925	R	65.7	Low	73.1	Confident	160 Å²	160	91.6 Å²	91.6	60%	0.604	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-86.7	120.3	163.1	-82.9	-175.4	173.4	143.7	-7.3	108.9	P934	R925-P934 HydrophobicContact CG-CG 4.34Å
926	D	55.3	Low	72.8	Confident	99 Å²	99	93.4 Å²	93.4	53%	0.529	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-72.8	155.7	163.8	-54.8	-41	0	0	0	109.3	S930	D926-S930 PolarHBondContact O-OG 3.23Å
927	E	52.9	Low	72.8	Confident	136 Å²	136	91 Å²	91	64%	0.636	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	145.1	-146.7	-53.6	-166.9	126.6	0	0	116.1	R735 E929	R735-E927 IonicContact CZ-OE1 3Å; R735-E927 IonicContact NE-OE1 3.45Å; R735-E927 PolarHBondContact NE-OE1 2.88Å; R735-E927 IonicContact NH2-OE1 3.51Å; R735-E927 PolarHBondContact NH2-OE1 2.83Å; E927-E929 VanDerWaalsContact C-N 3.29Å; E927-E929 PolarHBondContact O-N 2.73Å
928	V	53.9	Low	72.9	Confident	122 Å²	122	89.4 Å²	89.4	74%	0.739	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.6	-51.1	165.9	-172.6	0	0	0	0	119.6
929	E	51.9	Low	73.1	Confident	177 Å²	177	89.2 Å²	89.2	83%	0.827	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-3.6	-172.7	-88.7	109.1	-156.4	0	0	115	E927 D931	E927-E929 VanDerWaalsContact C-N 3.29Å; E927-E929 PolarHBondContact O-N 2.73Å; E929-D931 PolarHBondContact O-N 3.36Å
930	S	58	Low	73.2	Confident	42 Å²	42	82.1 Å²	82.1	29%	0.294	42%	0.421	S	S	.	.			trans	-78.9	93.2	-176.3	71	0	0	0	0	114.1	D926 I932	D926-S930 PolarHBondContact O-OG 3.23Å; S930-I932 PolarHBondContact O-N 2.84Å
931	D	58.2	Low	73.4	Confident	171 Å²	171	76.7 Å²	76.7	91%	0.914	40%	0.4	S	S	*	.			trans	-61.1	-9.7	171.9	-115.5	-11	0	0	0	113.7	E929	E929-D931 PolarHBondContact O-N 3.36Å
932	I	61.8	Low	73.6	Confident	136 Å²	136	80 Å²	80	70%	0.697	41%	0.412	S	S	*	.	S	Bend	trans	-75.5	125.8	-177.3	-57.5	178.3	0	0	0	109.9	S930	S930-I932 PolarHBondContact O-N 2.84Å
933	R	71.5	Confident	74	Confident	168 Å²	168	79.7 Å²	79.7	63%	0.634	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-61.1	132.2	169.4	156.6	177	155.6	173.5	-13.3	109.5	A935 D939	R933-A935 PolarHBondContact O-N 3.34Å; R933-D939 IonicContact NH2-OD2 3.21Å; R933-D939 PolarHBondContact NH2-OD2 3.47Å; R933-D939 VanDerWaalsContact NH2-OD2 3.14Å
934	P	77.9	Confident	74.4	Confident	47 Å²	47	77.5 Å²	77.5	31%	0.305	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-56.5	133.7	171.1	21.6	-31.7	0	0	0	111.6	V923 R925	V923-P934 WeakPolarHBondContact O-CB 3.34Å; R925-P934 HydrophobicContact CG-CG 4.34Å
935	A	82.1	Confident	75.4	Confident	17 Å²	17	74.5 Å²	74.5	14%	0.14	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-78.1	138	-172.1	0	0	0	0	0	111.7	F921 A922 R933	F921-A935 HydrophobicContact CB-CB 3.78Å; F921-A935 HydrophobicContact CD1-CB 3.94Å; F921-A935 HydrophobicContact CG-CB 4.37Å; A922-A935 WeakPolarHBondContact O-CB 3.49Å; A922-A935 PolarHBondContact O-N 2.85Å; R933-A935 PolarHBondContact O-N 3.34Å
936	S	85	Confident	76.6	Confident	40 Å²	40	68.1 Å²	68.1	28%	0.28	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-92.8	161.1	173.6	75	0	0	0	0	112	A938 D939 C940	S936-A938 PolarHBondContact O-N 2.84Å; S936-A938 VanDerWaalsContact O-N 3.09Å; S936-A938 PolarHBondContact OG-N 3.07Å; S936-D939 VanDerWaalsContact CB-OD2 3.29Å; S936-D939 WeakPolarHBondContact CB-OD2 3.31Å; S936-D939 PolarHBondContact N-OD2 3.36Å; S936-D939 WeakPolarHBondContact O-CB 3.49Å; S936-D939 PolarHBondContact O-N 3.35Å; S936-D939 VanDerWaalsContact OG-CG 3.25Å; S936-D939 PolarHBondContact OG-N 2.93Å; S936-D939 PolarHBondContact OG-OD2 2.79Å; S936-C940 PolarHBondContact O-N 3.01Å; S936-C940 VanDerWaalsContact O-N 3.15Å; S936-C940 PolarHBondContact O-SG 2.98Å
937	L	86.8	Confident	78.3	Confident	23 Å²	23	67.2 Å²	67.2	12%	0.12	35%	0.354	C	S	.	.	H	α-helix	trans	-57.9	-20.6	170.1	-177.1	58.1	0	0	0	112.9	L901 Y913 R941 I965 Y971	L901-L937 HydrophobicContact CD2-CD1 3.36Å; Y913-L937 HydrophobicContact CD1-CD1 4.24Å; Y913-L937 HydrophobicContact CE1-CD1 3.94Å; Y913-L937 HydrophobicContact CE2-CB 4.16Å; L937-R941 WeakPolarHBondContact O-CB 3.48Å; L937-R941 VanDerWaalsContact O-CG 3.31Å; L937-R941 WeakPolarHBondContact O-CG 3.24Å; L937-R941 PolarHBondContact O-N 2.69Å; L937-R941 PolarHBondContact O-NE 2.71Å; L937-R941 VanDerWaalsContact O-NE 3.1Å; L937-I965 HydrophobicContact CD1-CD1 4.46Å; L937-I965 HydrophobicContact CD2-CD1 4.09Å; L937-I965 HydrophobicContact CD2-CG1 4.09Å; L937-Y971 HydrophobicContact CD2-CD1 4.12Å; L937-Y971 HydrophobicContact CD2-CE1 4.06Å
938	A	87.5	Confident	80.2	Confident	31 Å²	31	62.8 Å²	62.8	26%	0.256	33%	0.333	S	S	.	.	H	α-helix	trans	-77.2	-35.8	172	0	0	0	0	0	112.6	S936 R942	S936-A938 PolarHBondContact O-N 2.84Å; S936-A938 VanDerWaalsContact O-N 3.09Å; S936-A938 PolarHBondContact OG-N 3.07Å; A938-R942 VanDerWaalsContact O-CB 3.31Å; A938-R942 WeakPolarHBondContact O-CB 3.43Å; A938-R942 WeakPolarHBondContact O-CD 3.13Å; A938-R942 WeakPolarHBondContact O-CG 3.32Å; A938-R942 PolarHBondContact O-N 2.87Å
939	D	88	Confident	82	Confident	51 Å²	51	57.1 Å²	57.1	27%	0.273	30%	0.3	S	S	.	.	H	α-helix	trans	-67.6	-40.2	177.4	-56.2	-54.2	0	0	0	110.3	R933 S936 R942 H943	R933-D939 IonicContact NH2-OD2 3.21Å; R933-D939 PolarHBondContact NH2-OD2 3.47Å; R933-D939 VanDerWaalsContact NH2-OD2 3.14Å; S936-D939 VanDerWaalsContact CB-OD2 3.29Å; S936-D939 WeakPolarHBondContact CB-OD2 3.31Å; S936-D939 PolarHBondContact N-OD2 3.36Å; S936-D939 WeakPolarHBondContact O-CB 3.49Å; S936-D939 PolarHBondContact O-N 3.35Å; S936-D939 VanDerWaalsContact OG-CG 3.25Å; S936-D939 PolarHBondContact OG-N 2.93Å; S936-D939 PolarHBondContact OG-OD2 2.79Å; D939-R942 PolarHBondContact O-N 2.63Å; D939-H943 PolarHBondContact O-N 2.85Å
940	C	88.2	Confident	83.8	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-63.2	-49.7	174.8	-52	0	0	0	0	112	L901 Y913 F921 S936 R942 H943 I944	L901-C940 HydrophobicContact CD1-CB 4.05Å; L901-C940 HydrophobicContact CD2-CB 4.13Å; Y913-C940 VanDerWaalsContact CD2-SG 3.54Å; F921-C940 WeakPolarHBondContact CB-SG 3.49Å; F921-C940 HydrophobicContact CD2-CB 4.48Å; F921-C940 HydrophobicContact CG-CB 4.48Å; F921-C940 VanDerWaalsContact CG-SG 3.53Å; S936-C940 PolarHBondContact O-N 3.01Å; S936-C940 VanDerWaalsContact O-N 3.15Å; S936-C940 PolarHBondContact O-SG 2.98Å; C940-R942 PolarHBondContact O-N 3.45Å; C940-H943 WeakPolarHBondContact O-CB 3.48Å; C940-H943 PolarHBondContact O-N 2.83Å; C940-I944 PolarHBondContact O-N 3.21Å; C940-I944 VanDerWaalsContact O-N 3.16Å
941	R	91.1	Very high	85.4	Confident	16 Å²	16	56.7 Å²	56.7	6%	0.06	28%	0.284	C	S	.	.	H	α-helix	trans	-63.1	-39	176.9	-73.6	-178.8	-64.8	124.2	3.4	112.1	L866 Y896 L937 H943 I944 L945 C960 S963	L866-R941 HydrophobicContact CD2-CG 4.24Å; Y896-R941 VanDerWaalsContact OH-CD 3.31Å; Y896-R941 WeakPolarHBondContact OH-CD 3.45Å; Y896-R941 WeakPolarHBondContact OH-CG 3.46Å; L937-R941 WeakPolarHBondContact O-CB 3.48Å; L937-R941 VanDerWaalsContact O-CG 3.31Å; L937-R941 WeakPolarHBondContact O-CG 3.24Å; L937-R941 PolarHBondContact O-N 2.69Å; L937-R941 PolarHBondContact O-NE 2.71Å; L937-R941 VanDerWaalsContact O-NE 3.1Å; R941-H943 VanDerWaalsContact C-N 3.3Å; R941-H943 PolarHBondContact O-N 3.23Å; R941-I944 PolarHBondContact O-N 3.36Å; R941-L945 WeakPolarHBondContact O-CB 3.14Å; R941-L945 VanDerWaalsContact O-CG 3.25Å; R941-L945 WeakPolarHBondContact O-CG 3.31Å; R941-L945 PolarHBondContact O-N 3.36Å; R941-C960 PolarHBondContact NH1-O 3.44Å; R941-S963 PolarHBondContact NH1-O 3.4Å
942	R	90.7	Very high	86.8	Confident	99 Å²	99	51.5 Å²	51.5	37%	0.374	26%	0.26	S	S	.	.	H	α-helix	trans	-61.7	-35.7	174.3	-78.9	169.7	166.1	-151.1	-11.9	112.9	A938 D939 C940 G946 T957 C960	A938-R942 VanDerWaalsContact O-CB 3.31Å; A938-R942 WeakPolarHBondContact O-CB 3.43Å; A938-R942 WeakPolarHBondContact O-CD 3.13Å; A938-R942 WeakPolarHBondContact O-CG 3.32Å; A938-R942 PolarHBondContact O-N 2.87Å; D939-R942 PolarHBondContact O-N 2.63Å; C940-R942 PolarHBondContact O-N 3.45Å; R942-G946 PolarHBondContact O-N 3.23Å; R942-T957 PolarHBondContact NH2-OG1 3.39Å; R942-C960 HydrophobicContact CG-CB 4.21Å
943	H	91.4	Very high	87.9	Confident	30 Å²	30	53.2 Å²	53.2	14%	0.139	27%	0.265	C	S	.	.	H	α-helix	trans	-65.4	-44.1	172.8	178.1	57.9	0	0	0	112.1	C915 C917 R919 F921 D939 C940 R941 G946 V947	C915-H943 VanDerWaalsContact SG-CD2 3.55Å; C917-H943 PolarHBondContact SG-NE2 2.77Å; R919-H943 WeakPolarHBondContact CD-NE2 3.46Å; F921-H943 HydrophobicContact CE1-CB 4.36Å; F921-H943 HydrophobicContact CE2-CB 4.33Å; F921-H943 AromaticContact CE2-CD2 3.6Å; F921-H943 HydrophobicContact CZ-CB 3.59Å; F921-H943 AromaticContact CZ-CD2 3.49Å; F921-H943 VanDerWaalsContact CZ-CD2 3.49Å; F921-H943 WeakPolarHBondContact CZ-CD2 3.36Å; F921-H943 AromaticContact CZ-CG 3.59Å; D939-H943 PolarHBondContact O-N 2.85Å; C940-H943 WeakPolarHBondContact O-CB 3.48Å; C940-H943 PolarHBondContact O-N 2.83Å; R941-H943 VanDerWaalsContact C-N 3.3Å; R941-H943 PolarHBondContact O-N 3.23Å; H943-G946 PolarHBondContact O-N 2.97Å; H943-V947 WeakPolarHBondContact ND1-CG2 3.09Å; H943-V947 WeakPolarHBondContact O-CB 3.32Å; H943-V947 PolarHBondContact O-N 3.12Å
944	I	91.9	Very high	88.5	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.254	C	S	.	.	I	π-helix	trans	-64.5	-46.2	176.8	-61.3	174.8	0	0	0	111.1	L866 Y896 H899 L901 C915 C940 R941 G946 H948 A949	L866-I944 HydrophobicContact CD1-CD1 3.48Å; L866-I944 VanDerWaalsContact CD1-CD1 3.48Å; L866-I944 HydrophobicContact CD1-CG2 4.14Å; Y896-I944 HydrophobicContact CD2-CB 4.34Å; Y896-I944 HydrophobicContact CD2-CG2 3.76Å; Y896-I944 HydrophobicContact CE2-CB 4.2Å; Y896-I944 HydrophobicContact CE2-CG2 4.01Å; H899-I944 HydrophobicContact CB-CG2 3.86Å; L901-I944 HydrophobicContact CB-CD1 4.39Å; L901-I944 HydrophobicContact CD1-CD1 3.86Å; C915-I944 WeakPolarHBondContact SG-CG1 3.32Å; C940-I944 PolarHBondContact O-N 3.21Å; C940-I944 VanDerWaalsContact O-N 3.16Å; R941-I944 PolarHBondContact O-N 3.36Å; I944-G946 VanDerWaalsContact C-N 3.34Å; I944-G946 PolarHBondContact O-N 3.07Å; I944-H948 HydrophobicContact CG2-CB 4.16Å; I944-H948 WeakPolarHBondContact O-CA 3.46Å; I944-H948 WeakPolarHBondContact O-CB 3.42Å; I944-H948 PolarHBondContact O-N 3.4Å; I944-A949 PolarHBondContact O-N 2.77Å
945	L	93.2	Very high	89	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.241	C	C	.	.	I	π-helix	trans	-56.4	-45.6	175.6	-70	165.8	0	0	0	111.7	M893 Y896 R941 A949 R950 I951 L956 C959 C960	M893-L945 HydrophobicContact CE-CD2 4.22Å; M893-L945 HydrophobicContact SD-CD2 3.54Å; M893-L945 VanDerWaalsContact SD-CD2 3.54Å; Y896-L945 HydrophobicContact CD1-CD2 4.03Å; Y896-L945 HydrophobicContact CD2-CD2 3.32Å; Y896-L945 HydrophobicContact CD2-CG 3.67Å; Y896-L945 HydrophobicContact CE1-CD2 4.31Å; Y896-L945 HydrophobicContact CE2-CD1 4.46Å; Y896-L945 HydrophobicContact CE2-CD2 3.65Å; Y896-L945 HydrophobicContact CE2-CG 3.62Å; Y896-L945 HydrophobicContact CG-CD2 3.53Å; Y896-L945 HydrophobicContact CG-CG 4.37Å; R941-L945 WeakPolarHBondContact O-CB 3.14Å; R941-L945 VanDerWaalsContact O-CG 3.25Å; R941-L945 WeakPolarHBondContact O-CG 3.31Å; R941-L945 PolarHBondContact O-N 3.36Å; L945-A949 CarbonylContact O-C 3.48Å; L945-A949 WeakPolarHBondContact O-CB 3.41Å; L945-R950 PolarHBondContact O-N 3.45Å; L945-I951 HydrophobicContact CB-CD1 4.2Å; L945-I951 HydrophobicContact CD2-CD1 3.53Å; L945-I951 HydrophobicContact CG-CD1 4.48Å; L945-I951 WeakPolarHBondContact O-CB 3.46Å; L945-I951 PolarHBondContact O-N 3.08Å; L945-L956 HydrophobicContact CB-CD2 3.5Å; L945-L956 VanDerWaalsContact CB-CD2 3.5Å; L945-C959 HydrophobicContact CD1-CB 4.07Å; L945-C959 HydrophobicContact CD2-CB 3.93Å; L945-C960 HydrophobicContact CD1-CB 3.84Å
946	G	91.4	Very high	89.4	Confident	26 Å²	26	47.7 Å²	47.7	27%	0.268	24%	0.24	S	C	.	.	I	π-helix	trans	-78.3	-37.9	-176.8	0	0	0	0	0	115.3	R942 H943 I944 R950	R942-G946 PolarHBondContact O-N 3.23Å; H943-G946 PolarHBondContact O-N 2.97Å; I944-G946 VanDerWaalsContact C-N 3.34Å; I944-G946 PolarHBondContact O-N 3.07Å; G946-R950 WeakPolarHBondContact O-CA 3.36Å
947	V	91.6	Very high	89.5	Confident	80 Å²	80	47.6 Å²	47.6	49%	0.485	24%	0.238	S	C	.	.	I	π-helix	trans	-97.6	-40.2	-172.4	177.2	0	0	0	0	112.5	H943	H943-V947 WeakPolarHBondContact ND1-CG2 3.09Å; H943-V947 WeakPolarHBondContact O-CB 3.32Å; H943-V947 PolarHBondContact O-N 3.12Å
948	H	91.8	Very high	89.6	Confident	42 Å²	42	46.6 Å²	46.6	19%	0.194	23%	0.233	C	C	.	.	I	π-helix	trans	-95.8	-43.6	-175.2	-66.3	-65.7	0	0	0	112.6	C915 I916 C917 I944 R950	C915-H948 PolarHBondContact SG-NE2 3.12Å; I916-H948 VanDerWaalsContact CD1-CE1 3.46Å; I916-H948 WeakPolarHBondContact CD1-CE1 3.49Å; I916-H948 WeakPolarHBondContact CD1-ND1 3.24Å; C917-H948 WeakPolarHBondContact CB-NE2 3.31Å; I944-H948 HydrophobicContact CG2-CB 4.16Å; I944-H948 WeakPolarHBondContact O-CA 3.46Å; I944-H948 WeakPolarHBondContact O-CB 3.42Å; I944-H948 PolarHBondContact O-N 3.4Å; H948-R950 VanDerWaalsContact C-N 3.34Å
949	A	91.1	Very high	89.7	Confident	4 Å²	4	45.1 Å²	45.1	3%	0.033	22%	0.221	C	C	.	.	S	Bend	trans	-84.8	-5.3	172.4	0	0	0	0	0	114.1	K892 V895 I944 L945 I951	K892-A949 WeakPolarHBondContact CB-O 3.31Å; K892-A949 WeakPolarHBondContact CG-O 3.45Å; K892-A949 VanDerWaalsContact O-CB 3.3Å; K892-A949 WeakPolarHBondContact O-CB 3.44Å; V895-A949 HydrophobicContact CG1-CB 4.49Å; I944-A949 PolarHBondContact O-N 2.77Å; L945-A949 CarbonylContact O-C 3.48Å; L945-A949 WeakPolarHBondContact O-CB 3.41Å; A949-I951 HydrophobicContact CB-CD1 3.81Å; A949-I951 HydrophobicContact CB-CG1 4.04Å; A949-I951 PolarHBondContact O-N 2.7Å
950	R	91.4	Very high	89.9	Confident	204 Å²	204	43.1 Å²	43.1	77%	0.77	21%	0.21	S	C	*	.			trans	52.7	35.7	178.6	-58.6	-176.8	177.8	-177.5	-0.1	113.9	L945 G946 H948	L945-R950 PolarHBondContact O-N 3.45Å; G946-R950 WeakPolarHBondContact O-CA 3.36Å; H948-R950 VanDerWaalsContact C-N 3.34Å
951	I	91.4	Very high	89.9	Confident	5 Å²	5	43.5 Å²	43.5	3%	0.026	21%	0.212	C	C	.	.			trans	-77.3	131.6	179.5	-68	165	0	0	0	109.7	L889 K892 M893 L945 A949 L955 L956 C959	L889-I951 HydrophobicContact CD1-CG1 4.11Å; L889-I951 HydrophobicContact CD1-CG2 3.95Å; K892-I951 HydrophobicContact CB-CD1 4.23Å; K892-I951 HydrophobicContact CB-CG1 3.76Å; K892-I951 HydrophobicContact CD-CG1 4.28Å; M893-I951 HydrophobicContact CG-CD1 4.34Å; M893-I951 HydrophobicContact SD-CD1 3.6Å; L945-I951 HydrophobicContact CB-CD1 4.2Å; L945-I951 HydrophobicContact CD2-CD1 3.53Å; L945-I951 HydrophobicContact CG-CD1 4.48Å; L945-I951 WeakPolarHBondContact O-CB 3.46Å; L945-I951 PolarHBondContact O-N 3.08Å; A949-I951 HydrophobicContact CB-CD1 3.81Å; A949-I951 HydrophobicContact CB-CG1 4.04Å; A949-I951 PolarHBondContact O-N 2.7Å; I951-L955 HydrophobicContact CG2-CB 3.86Å; I951-L956 HydrophobicContact CB-CD2 3.89Å; I951-L956 HydrophobicContact CG2-CD2 3.84Å; I951-L956 HydrophobicContact CG2-CG 4.5Å; I951-C959 HydrophobicContact CD1-CB 4.27Å
952	P	87.4	Confident	89.9	Confident	62 Å²	62	42.8 Å²	42.8	40%	0.403	21%	0.21	S	C	.	.			trans	-53.7	142.3	178.4	-28	34.8	0	0	0	113.3	E954 L955 L956	P952-E954 PolarHBondContact O-N 3.13Å; P952-L955 HydrophobicContact CB-CG 4.49Å; P952-L955 HydrophobicContact CG-CD1 4.26Å; P952-L955 PolarHBondContact O-N 2.88Å; P952-L956 PolarHBondContact O-N 2.74Å; P952-L956 VanDerWaalsContact O-N 3.14Å
953	Q	83.9	Confident	89.9	Confident	173 Å²	173	38 Å²	38	81%	0.808	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-31.9	-174.3	-171.4	177.1	9.8	0	0	113.6	L956	Q953-L956 HydrophobicContact CG-CD1 4.39Å
954	E	83.9	Confident	89.4	Confident	84 Å²	84	39.4 Å²	39.4	39%	0.393	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-48.6	178.5	-58.1	-179.5	140.1	0	0	110.8	P952 L956 F988 I993	P952-E954 PolarHBondContact O-N 3.13Å; E954-L956 VanDerWaalsContact C-N 3.31Å; E954-L956 PolarHBondContact O-N 3.4Å; E954-F988 WeakPolarHBondContact O-CE2 3.38Å; E954-F988 WeakPolarHBondContact O-CZ 3.5Å; E954-I993 WeakPolarHBondContact OE2-CD1 3.38Å; E954-I993 WeakPolarHBondContact OE2-CG1 3.36Å
955	L	89	Confident	89.1	Confident	7 Å²	7	39.9 Å²	39.9	4%	0.037	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-16.2	-179.5	-58.3	-178.8	0	0	0	114.1	L877 M882 L889 I951 P952 T957 L958 C959	L877-L955 HydrophobicContact CD2-CD2 4.42Å; M882-L955 HydrophobicContact CE-CD2 4.4Å; M882-L955 HydrophobicContact SD-CD2 4.12Å; L889-L955 HydrophobicContact CD1-CB 4.41Å; L889-L955 HydrophobicContact CD1-CD1 3.81Å; L889-L955 HydrophobicContact CD2-CD1 4.23Å; I951-L955 HydrophobicContact CG2-CB 3.86Å; P952-L955 HydrophobicContact CB-CG 4.49Å; P952-L955 HydrophobicContact CG-CD1 4.26Å; P952-L955 PolarHBondContact O-N 2.88Å; L955-T957 PolarHBondContact O-N 2.91Å; L955-L958 HydrophobicContact CD2-CD1 4.09Å; L955-L958 PolarHBondContact O-N 3.11Å; L955-L958 VanDerWaalsContact O-N 3.1Å; L955-C959 PolarHBondContact O-N 3.4Å; L955-C959 PolarHBondContact O-SG 2.73Å
956	L	89.7	Confident	88.3	Confident	24 Å²	24	40.4 Å²	40.4	13%	0.126	20%	0.202	C	C	.	.	H	α-helix	trans	-53.3	-27.7	177.8	-68.2	-178.7	0	0	0	113.8	L945 I951 P952 Q953 E954 C960	L945-L956 HydrophobicContact CB-CD2 3.5Å; L945-L956 VanDerWaalsContact CB-CD2 3.5Å; I951-L956 HydrophobicContact CB-CD2 3.89Å; I951-L956 HydrophobicContact CG2-CD2 3.84Å; I951-L956 HydrophobicContact CG2-CG 4.5Å; P952-L956 PolarHBondContact O-N 2.74Å; P952-L956 VanDerWaalsContact O-N 3.14Å; Q953-L956 HydrophobicContact CG-CD1 4.39Å; E954-L956 VanDerWaalsContact C-N 3.31Å; E954-L956 PolarHBondContact O-N 3.4Å; L956-C960 WeakPolarHBondContact O-CB 3.46Å; L956-C960 PolarHBondContact O-N 2.71Å; L956-C960 VanDerWaalsContact O-N 3.11Å
957	T	87.1	Confident	87.5	Confident	38 Å²	38	45.2 Å²	45.2	23%	0.233	22%	0.215	C	C	.	.	H	α-helix	trans	-76	-44.3	178.6	-62	0	0	0	0	112	R942 L955 C960 Q961 F988	R942-T957 PolarHBondContact NH2-OG1 3.39Å; L955-T957 PolarHBondContact O-N 2.91Å; T957-C960 PolarHBondContact O-N 2.86Å; T957-Q961 WeakPolarHBondContact O-CG 3.38Å; T957-Q961 PolarHBondContact O-N 2.83Å; T957-Q961 PolarHBondContact O-OE1 3.15Å; T957-F988 HydrophobicContact CG2-CD2 4.1Å; T957-F988 HydrophobicContact CG2-CE2 4.36Å
958	L	88.8	Confident	86.2	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-63.7	-46.2	176.7	-59.6	171.6	0	0	0	110.6	L876 L877 E880 L955 C960 Q961 A962 F988	L876-L958 HydrophobicContact CB-CD2 4.43Å; L877-L958 HydrophobicContact CD2-CD1 4.35Å; E880-L958 HydrophobicContact CG-CD1 4.38Å; E880-L958 HydrophobicContact CG-CD2 4.15Å; L955-L958 HydrophobicContact CD2-CD1 4.09Å; L955-L958 PolarHBondContact O-N 3.11Å; L955-L958 VanDerWaalsContact O-N 3.1Å; L958-C960 PolarHBondContact O-N 3.4Å; L958-Q961 WeakPolarHBondContact O-CA 3.46Å; L958-Q961 WeakPolarHBondContact O-CB 3.31Å; L958-Q961 PolarHBondContact O-N 3.05Å; L958-A962 PolarHBondContact O-N 3.07Å; L958-F988 HydrophobicContact CD2-CB 4.5Å; L958-F988 HydrophobicContact CD2-CG 4.46Å
959	C	91.6	Very high	85.2	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.9	-41.8	177.1	-59.6	0	0	0	0	112.1	M893 L945 I951 L955 Q961 A962 S963	M893-C959 HydrophobicContact CE-CB 4.32Å; M893-C959 HydrophobicContact SD-CB 3.67Å; L945-C959 HydrophobicContact CD1-CB 4.07Å; L945-C959 HydrophobicContact CD2-CB 3.93Å; I951-C959 HydrophobicContact CD1-CB 4.27Å; L955-C959 PolarHBondContact O-N 3.4Å; L955-C959 PolarHBondContact O-SG 2.73Å; C959-Q961 VanDerWaalsContact C-N 3.26Å; C959-Q961 PolarHBondContact O-N 3.48Å; C959-A962 PolarHBondContact O-N 3.17Å; C959-S963 PolarHBondContact O-N 2.81Å; C959-S963 PolarHBondContact O-OG 3.27Å; C959-S963 VanDerWaalsContact O-OG 3.07Å
960	C	91	Very high	84.3	Confident	9 Å²	9	52.8 Å²	52.8	6%	0.061	27%	0.266	C	S	.	.	H	α-helix	trans	-72	-15.8	176.5	-174.4	0	0	0	0	113.6	R941 R942 L945 L956 T957 L958 R964	R941-C960 PolarHBondContact NH1-O 3.44Å; R942-C960 HydrophobicContact CG-CB 4.21Å; L945-C960 HydrophobicContact CD1-CB 3.84Å; L956-C960 WeakPolarHBondContact O-CB 3.46Å; L956-C960 PolarHBondContact O-N 2.71Å; L956-C960 VanDerWaalsContact O-N 3.11Å; T957-C960 PolarHBondContact O-N 2.86Å; L958-C960 PolarHBondContact O-N 3.4Å; C960-R964 WeakPolarHBondContact O-CG 3.31Å
961	Q	88.1	Confident	83.8	Confident	9 Å²	9	45.3 Å²	45.3	4%	0.042	24%	0.238	C	C	.	.	H	α-helix	trans	-79.2	-46.4	167.4	-76.1	164	-47.3	0	0	110.6	L876 T957 L958 C959 S963 R964 A983	L876-Q961 HydrophobicContact CD1-CB 3.96Å; T957-Q961 WeakPolarHBondContact O-CG 3.38Å; T957-Q961 PolarHBondContact O-N 2.83Å; T957-Q961 PolarHBondContact O-OE1 3.15Å; L958-Q961 WeakPolarHBondContact O-CA 3.46Å; L958-Q961 WeakPolarHBondContact O-CB 3.31Å; L958-Q961 PolarHBondContact O-N 3.05Å; C959-Q961 VanDerWaalsContact C-N 3.26Å; C959-Q961 PolarHBondContact O-N 3.48Å; Q961-S963 VanDerWaalsContact C-N 3.26Å; Q961-S963 PolarHBondContact O-N 3.27Å; Q961-R964 WeakPolarHBondContact O-CG 3.12Å; Q961-R964 PolarHBondContact O-N 3.24Å; Q961-A983 HydrophobicContact CB-CB 4.27Å; Q961-A983 HydrophobicContact CG-CB 4.33Å
962	A	91.1	Very high	83.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-65.2	-22.5	176.3	0	0	0	0	0	114.3	F868 S869 V872 L873 L958 C959	F868-A962 WeakPolarHBondContact CA-O 3.42Å; S869-A962 PolarHBondContact N-O 2.83Å; V872-A962 HydrophobicContact CG1-CB 4.22Å; L873-A962 HydrophobicContact CB-CB 4.12Å; L873-A962 HydrophobicContact CD1-CB 3.94Å; L958-A962 PolarHBondContact O-N 3.07Å; C959-A962 PolarHBondContact O-N 3.17Å
963	S	90.3	Very high	83.4	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	32	177.3	68.3	0	0	0	0	115.1	P867 Y896 R941 C959 Q961 I965	P867-S963 WeakPolarHBondContact O-CB 3.27Å; Y896-S963 VanDerWaalsContact CE1-CB 3.46Å; Y896-S963 PolarHBondContact OH-OG 3.16Å; R941-S963 PolarHBondContact NH1-O 3.4Å; C959-S963 PolarHBondContact O-N 2.81Å; C959-S963 PolarHBondContact O-OG 3.27Å; C959-S963 VanDerWaalsContact O-OG 3.07Å; Q961-S963 VanDerWaalsContact C-N 3.26Å; Q961-S963 PolarHBondContact O-N 3.27Å; S963-I965 PolarHBondContact O-N 2.94Å; S963-I965 VanDerWaalsContact O-N 3.17Å
964	R	82.5	Confident	83.4	Confident	59 Å²	59	47.5 Å²	47.5	22%	0.223	24%	0.238	C	C	.	.			trans	-71.8	110.8	175.7	-71.8	-177.6	174.4	-149.4	3.1	111.1	C960 Q961 L973 Y974 L979 H986	C960-R964 WeakPolarHBondContact O-CG 3.31Å; Q961-R964 WeakPolarHBondContact O-CG 3.12Å; Q961-R964 PolarHBondContact O-N 3.24Å; R964-L973 WeakPolarHBondContact O-CD1 3.47Å; R964-Y974 HydrophobicContact CB-CD2 3.94Å; R964-Y974 HydrophobicContact CB-CE2 4.43Å; R964-Y974 WeakPolarHBondContact O-CD2 3.29Å; R964-Y974 PolarHBondContact O-N 3.36Å; R964-Y974 VanDerWaalsContact O-N 3.08Å; R964-L979 HydrophobicContact CB-CD2 3.64Å; R964-L979 HydrophobicContact CG-CD2 4.49Å; R964-H986 PolarHBondContact NH2-CD2 3.24Å
965	I	85.8	Confident	83.6	Confident	10 Å²	10	46.5 Å²	46.5	5%	0.051	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-97.1	150.7	165.4	55.8	173.4	0	0	0	110.9	I864 L866 P867 L937 S963 Y971 K972 L973	I864-I965 HydrophobicContact CG2-CD1 3.87Å; L866-I965 HydrophobicContact CD2-CD1 4.27Å; P867-I965 HydrophobicContact CG-CG2 3.85Å; L937-I965 HydrophobicContact CD1-CD1 4.46Å; L937-I965 HydrophobicContact CD2-CD1 4.09Å; L937-I965 HydrophobicContact CD2-CG1 4.09Å; S963-I965 PolarHBondContact O-N 2.94Å; S963-I965 VanDerWaalsContact O-N 3.17Å; I965-Y971 WeakPolarHBondContact CB-O 3.28Å; I965-Y971 HydrophobicContact CD1-CD1 4.4Å; I965-Y971 VanDerWaalsContact CG2-O 3.31Å; I965-Y971 WeakPolarHBondContact CG2-O 3.32Å; I965-K972 VanDerWaalsContact CA-O 3.31Å; I965-K972 WeakPolarHBondContact CA-O 3.4Å; I965-L973 HydrophobicContact CG2-CD1 4.32Å
966	S	76.2	Confident	83.5	Confident	10 Å²	10	48.6 Å²	48.6	7%	0.07	26%	0.256	C	S	.	.			trans	-110.3	135.3	176.8	-172.8	0	0	0	0	112.9	E968 S969 Y971 K972 Y974	S966-E968 PolarHBondContact O-N 3.35Å; S966-E968 PolarHBondContact OG-N 3.24Å; S966-S969 WeakPolarHBondContact CB-OG 3.21Å; S966-S969 PolarHBondContact O-N 3.38Å; S966-S969 PolarHBondContact O-OG 3.16Å; S966-Y971 WeakPolarHBondContact O-CA 3.34Å; S966-Y971 PolarHBondContact O-N 3.07Å; S966-K972 PolarHBondContact N-O 2.67Å; S966-Y974 PolarHBondContact OG-OH 3.44Å
967	K	73.2	Confident	83.3	Confident	127 Å²	127	52.7 Å²	52.7	55%	0.552	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-35.6	170.9	-177.9	-174.6	171.2	-170.1	0	111.5	I910 S969 G970 Y971	I910-K967 HydrophobicContact CD1-CD 4.05Å; K967-S969 VanDerWaalsContact C-N 3.34Å; K967-S969 PolarHBondContact O-N 2.84Å; K967-G970 PolarHBondContact O-N 3.2Å; K967-Y971 HydrophobicContact CB-CE1 4.1Å; K967-Y971 HydrophobicContact CG-CE1 4.18Å
968	E	65.8	Low	83.1	Confident	176 Å²	176	52.9 Å²	52.9	82%	0.822	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-28.2	-175.1	-64.9	165.7	178.9	0	0	112.5	S966	S966-E968 PolarHBondContact O-N 3.35Å; S966-E968 PolarHBondContact OG-N 3.24Å
969	S	69.5	Low	83	Confident	54 Å²	54	52.8 Å²	52.8	38%	0.378	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	20.3	177.2	64.1	0	0	0	0	113.8	S966 K967 K972	S966-S969 WeakPolarHBondContact CB-OG 3.21Å; S966-S969 PolarHBondContact O-N 3.38Å; S966-S969 PolarHBondContact O-OG 3.16Å; K967-S969 VanDerWaalsContact C-N 3.34Å; K967-S969 PolarHBondContact O-N 2.84Å; S969-K972 WeakPolarHBondContact O-CD 3.15Å; S969-K972 WeakPolarHBondContact O-CG 3.31Å; S969-K972 PolarHBondContact OG-O 3.47Å
970	G	71.8	Confident	82.7	Confident	56 Å²	56	55 Å²	55	58%	0.577	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.5	36.5	-176.9	0	0	0	0	0	113.5	K967 K972	K967-G970 PolarHBondContact O-N 3.2Å; G970-K972 VanDerWaalsContact C-N 3.27Å; G970-K972 PolarHBondContact O-N 3.35Å
971	Y	82	Confident	82.2	Confident	47 Å²	47	55.3 Å²	55.3	18%	0.184	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.8	17.8	-178.2	-54.5	-76.9	0	0	0	115.9	I864 I910 L937 I965 S966 K967	I864-Y971 HydrophobicContact CD1-CD1 3.39Å; I864-Y971 HydrophobicContact CD1-CD2 3.59Å; I864-Y971 HydrophobicContact CD1-CE1 3.52Å; I864-Y971 HydrophobicContact CD1-CE2 3.74Å; I864-Y971 HydrophobicContact CD1-CG 3.39Å; I864-Y971 HydrophobicContact CG1-CD1 4.29Å; I864-Y971 HydrophobicContact CG1-CD2 3.83Å; I864-Y971 HydrophobicContact CG1-CE2 4.3Å; I864-Y971 HydrophobicContact CG1-CG 3.8Å; I864-Y971 HydrophobicContact CG2-CG 4.48Å; I910-Y971 WeakPolarHBondContact CD1-OH 3.2Å; L937-Y971 HydrophobicContact CD2-CD1 4.12Å; L937-Y971 HydrophobicContact CD2-CE1 4.06Å; I965-Y971 WeakPolarHBondContact CB-O 3.28Å; I965-Y971 HydrophobicContact CD1-CD1 4.4Å; I965-Y971 VanDerWaalsContact CG2-O 3.31Å; I965-Y971 WeakPolarHBondContact CG2-O 3.32Å; S966-Y971 WeakPolarHBondContact O-CA 3.34Å; S966-Y971 PolarHBondContact O-N 3.07Å; K967-Y971 HydrophobicContact CB-CE1 4.1Å; K967-Y971 HydrophobicContact CG-CE1 4.18Å
972	K	84.1	Confident	81.7	Confident	150 Å²	150	56 Å²	56	65%	0.652	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-70.8	153.4	170.4	-63.4	177	-176.7	-178.6	0	111.5	I965 S966 S969 G970	I965-K972 VanDerWaalsContact CA-O 3.31Å; I965-K972 WeakPolarHBondContact CA-O 3.4Å; S966-K972 PolarHBondContact N-O 2.67Å; S969-K972 WeakPolarHBondContact O-CD 3.15Å; S969-K972 WeakPolarHBondContact O-CG 3.31Å; S969-K972 PolarHBondContact OG-O 3.47Å; G970-K972 VanDerWaalsContact C-N 3.27Å; G970-K972 PolarHBondContact O-N 3.35Å
973	L	86.2	Confident	81.1	Confident	49 Å²	49	56.3 Å²	56.3	26%	0.257	31%	0.306	S	S	.	.	B	Isolated β-bridge	trans	-63	147.1	173.5	-162.3	75.5	0	0	0	110.5	P867 R964 I965 L979	P867-L973 HydrophobicContact CB-CB 4.42Å; P867-L973 HydrophobicContact CB-CD1 4.38Å; P867-L973 HydrophobicContact CG-CB 4.05Å; P867-L973 HydrophobicContact CG-CD1 4.22Å; R964-L973 WeakPolarHBondContact O-CD1 3.47Å; I965-L973 HydrophobicContact CG2-CD1 4.32Å; L973-L979 HydrophobicContact CD1-CD1 4.48Å; L973-L979 HydrophobicContact CD2-CD1 4.04Å; L973-L979 HydrophobicContact CG-CD1 4.11Å
974	Y	84.7	Confident	80.2	Confident	86 Å²	86	58.9 Å²	58.9	34%	0.337	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-70.2	151.3	163.8	-72.9	-88.6	0	0	0	110.3	R964 S966 L979 L982	R964-Y974 HydrophobicContact CB-CD2 3.94Å; R964-Y974 HydrophobicContact CB-CE2 4.43Å; R964-Y974 WeakPolarHBondContact O-CD2 3.29Å; R964-Y974 PolarHBondContact O-N 3.36Å; R964-Y974 VanDerWaalsContact O-N 3.08Å; S966-Y974 PolarHBondContact OG-OH 3.44Å; Y974-L979 VanDerWaalsContact O-CD1 3.31Å; Y974-L979 WeakPolarHBondContact O-CD1 3.49Å; Y974-L979 WeakPolarHBondContact O-CG 3.44Å; Y974-L982 HydrophobicContact CD1-CD1 4.44Å; Y974-L982 HydrophobicContact CD2-CD1 4.34Å; Y974-L982 HydrophobicContact CE2-CD1 4.43Å; Y974-L982 HydrophobicContact CG-CD1 4.35Å
975	A	86.3	Confident	79.2	Confident	64 Å²	64	58.2 Å²	58.2	53%	0.529	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-62.2	150.4	172	0	0	0	0	0	112.1	T977 S978 L979	A975-T977 VanDerWaalsContact C-N 3.3Å; A975-T977 PolarHBondContact O-N 2.69Å; A975-S978 CarbonylContact O-C 3.45Å; A975-S978 WeakPolarHBondContact O-CA 3.37Å; A975-S978 VanDerWaalsContact O-CB 3.31Å; A975-S978 WeakPolarHBondContact O-CB 3.5Å; A975-S978 PolarHBondContact O-N 2.85Å; A975-L979 PolarHBondContact O-N 3.39Å
976	D	87.9	Confident	77.9	Confident	50 Å²	50	62.9 Å²	62.9	27%	0.267	34%	0.339	S	S	.	.	H	α-helix	trans	-50.1	-44.2	-175.7	-80.5	13	0	0	0	114.3	S869 N871 V872 S978 L979 L980	S869-D976 WeakPolarHBondContact CB-OD1 3.44Å; S869-D976 PolarHBondContact OG-OD1 3.03Å; S869-D976 PolarHBondContact OG-OD2 3.01Å; N871-D976 WeakPolarHBondContact CB-OD2 3.43Å; N871-D976 PolarHBondContact ND2-OD2 3.17Å; V872-D976 HydrophobicContact CG2-CB 3.85Å; D976-S978 VanDerWaalsContact C-N 3.29Å; D976-S978 PolarHBondContact O-N 3.32Å; D976-L979 PolarHBondContact O-N 2.9Å; D976-L979 VanDerWaalsContact O-N 3.15Å; D976-L980 WeakPolarHBondContact O-CG 3.49Å; D976-L980 PolarHBondContact O-N 2.59Å
977	T	84.8	Confident	76.8	Confident	110 Å²	110	70.3 Å²	70.3	68%	0.675	37%	0.37	S	S	*	.	H	α-helix	trans	-58.5	-41.6	176.7	53.3	0	0	0	0	111.9	A975 A981	A975-T977 VanDerWaalsContact C-N 3.3Å; A975-T977 PolarHBondContact O-N 2.69Å; T977-A981 VanDerWaalsContact O-CB 3.31Å; T977-A981 WeakPolarHBondContact O-CB 3.25Å; T977-A981 PolarHBondContact O-N 2.87Å
978	S	83.8	Confident	75.7	Confident	43 Å²	43	66.3 Å²	66.3	30%	0.301	35%	0.352	S	S	.	.	H	α-helix	trans	-71.3	-39.1	174.9	-66.9	0	0	0	0	112	A975 D976 A981 L982	A975-S978 CarbonylContact O-C 3.45Å; A975-S978 WeakPolarHBondContact O-CA 3.37Å; A975-S978 VanDerWaalsContact O-CB 3.31Å; A975-S978 WeakPolarHBondContact O-CB 3.5Å; A975-S978 PolarHBondContact O-N 2.85Å; D976-S978 VanDerWaalsContact C-N 3.29Å; D976-S978 PolarHBondContact O-N 3.32Å; S978-A981 PolarHBondContact O-N 3.06Å; S978-L982 WeakPolarHBondContact O-CB 3.41Å; S978-L982 WeakPolarHBondContact O-CD1 3.47Å; S978-L982 WeakPolarHBondContact O-CG 3.22Å; S978-L982 PolarHBondContact O-N 2.88Å
979	L	86.3	Confident	74.5	Confident	0 Å²	0	68 Å²	68	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-62.3	-46.8	176.6	-68.2	175.2	0	0	0	111.7	V872 R964 L973 Y974 A975 D976 L982 A983	V872-L979 HydrophobicContact CB-CB 4.46Å; V872-L979 HydrophobicContact CB-CD1 4.47Å; V872-L979 HydrophobicContact CG1-CB 3.92Å; V872-L979 HydrophobicContact CG2-CB 3.81Å; V872-L979 HydrophobicContact CG2-CD1 3.86Å; V872-L979 HydrophobicContact CG2-CG 4.47Å; R964-L979 HydrophobicContact CB-CD2 3.64Å; R964-L979 HydrophobicContact CG-CD2 4.49Å; L973-L979 HydrophobicContact CD1-CD1 4.48Å; L973-L979 HydrophobicContact CD2-CD1 4.04Å; L973-L979 HydrophobicContact CG-CD1 4.11Å; Y974-L979 VanDerWaalsContact O-CD1 3.31Å; Y974-L979 WeakPolarHBondContact O-CD1 3.49Å; Y974-L979 WeakPolarHBondContact O-CG 3.44Å; A975-L979 PolarHBondContact O-N 3.39Å; D976-L979 PolarHBondContact O-N 2.9Å; D976-L979 VanDerWaalsContact O-N 3.15Å; L979-L982 PolarHBondContact O-N 2.9Å; L979-A983 WeakPolarHBondContact O-CB 3.31Å; L979-A983 PolarHBondContact O-N 2.81Å
980	L	85.5	Confident	73.4	Confident	45 Å²	45	67.9 Å²	67.9	24%	0.236	35%	0.35	C	S	.	.	H	α-helix	trans	-62.3	-47.5	175.8	-70.3	169.1	0	0	0	111.3	V872 V875 D976 L982 A983 E984	V872-L980 HydrophobicContact CG1-CD2 4.11Å; V872-L980 HydrophobicContact CG1-CG 4.44Å; V872-L980 HydrophobicContact CG2-CG 4.19Å; V875-L980 HydrophobicContact CB-CD2 3.98Å; V875-L980 HydrophobicContact CG1-CD2 3.66Å; D976-L980 WeakPolarHBondContact O-CG 3.49Å; D976-L980 PolarHBondContact O-N 2.59Å; L980-L982 VanDerWaalsContact C-N 3.28Å; L980-L982 PolarHBondContact O-N 2.76Å; L980-A983 WeakPolarHBondContact O-CB 3.22Å; L980-A983 PolarHBondContact O-N 2.97Å; L980-E984 WeakPolarHBondContact O-CG 3.43Å; L980-E984 PolarHBondContact O-N 3.41Å
981	A	80.6	Confident	71.9	Confident	17 Å²	17	70.9 Å²	70.9	14%	0.14	36%	0.358	C	S	.	.	H	α-helix	trans	-62.9	-33.4	177.1	0	0	0	0	0	113.1	P405 T977 S978 A983 Q985	P405-A981 HydrophobicContact CB-CB 4.31Å; P405-A981 HydrophobicContact CG-CB 4.06Å; T977-A981 VanDerWaalsContact O-CB 3.31Å; T977-A981 WeakPolarHBondContact O-CB 3.25Å; T977-A981 PolarHBondContact O-N 2.87Å; S978-A981 PolarHBondContact O-N 3.06Å; A981-A983 VanDerWaalsContact C-N 3.34Å; A981-Q985 WeakPolarHBondContact O-CG 3.39Å
982	L	77.5	Confident	69.9	Low	23 Å²	23	74.6 Å²	74.6	12%	0.12	37%	0.372	C	S	.	.	H	α-helix	trans	-76.4	-18.3	173.7	-73.2	171.8	0	0	0	113.4	A391 Y974 S978 L979 L980	A391-L982 HydrophobicContact CB-CD2 4.37Å; Y974-L982 HydrophobicContact CD1-CD1 4.44Å; Y974-L982 HydrophobicContact CD2-CD1 4.34Å; Y974-L982 HydrophobicContact CE2-CD1 4.43Å; Y974-L982 HydrophobicContact CG-CD1 4.35Å; S978-L982 WeakPolarHBondContact O-CB 3.41Å; S978-L982 WeakPolarHBondContact O-CD1 3.47Å; S978-L982 WeakPolarHBondContact O-CG 3.22Å; S978-L982 PolarHBondContact O-N 2.88Å; L979-L982 PolarHBondContact O-N 2.9Å; L980-L982 VanDerWaalsContact C-N 3.28Å; L980-L982 PolarHBondContact O-N 2.76Å
983	A	77.9	Confident	67.9	Low	6 Å²	6	70.8 Å²	70.8	5%	0.05	36%	0.358	C	S	.	.	H	α-helix	trans	-85.4	-44	173.2	0	0	0	0	0	112.1	L876 Q961 L979 L980 A981 Q985 H986	L876-A983 HydrophobicContact CD1-CB 4.08Å; L876-A983 HydrophobicContact CD2-CB 3.54Å; L876-A983 HydrophobicContact CG-CB 4.43Å; Q961-A983 HydrophobicContact CB-CB 4.27Å; Q961-A983 HydrophobicContact CG-CB 4.33Å; L979-A983 WeakPolarHBondContact O-CB 3.31Å; L979-A983 PolarHBondContact O-N 2.81Å; L980-A983 WeakPolarHBondContact O-CB 3.22Å; L980-A983 PolarHBondContact O-N 2.97Å; A981-A983 VanDerWaalsContact C-N 3.34Å; A983-Q985 PolarHBondContact O-N 3.2Å; A983-Q985 VanDerWaalsContact O-N 3.09Å; A983-H986 CarbonylContact O-C 3.54Å; A983-H986 PolarHBondContact O-N 2.98Å
984	E	72.6	Confident	65.6	Low	55 Å²	55	77.4 Å²	77.4	26%	0.257	39%	0.387	S	S	.	.	H	α-helix	trans	-42.9	-42.7	171	-77.3	-91.3	130.9	0	0	113	P405 R879 L980 H986	P405-E984 WeakPolarHBondContact CD-OE2 3.49Å; P405-E984 HydrophobicContact CG-CB 3.73Å; P405-E984 HydrophobicContact CG-CG 4.03Å; R879-E984 IonicContact CZ-OE1 2.68Å; R879-E984 IonicContact NH1-OE1 3.03Å; R879-E984 PolarHBondContact NH1-OE1 3.08Å; R879-E984 IonicContact NH2-OE1 3.61Å; R879-E984 PolarHBondContact NH2-OE1 3.17Å; R879-E984 IonicContact NH2-OE2 3.55Å; L980-E984 WeakPolarHBondContact O-CG 3.43Å; L980-E984 PolarHBondContact O-N 3.41Å; E984-H986 VanDerWaalsContact C-N 3.34Å; E984-H986 PolarHBondContact O-N 2.76Å
985	Q	60.6	Low	63.3	Low	45 Å²	45	78 Å²	78	21%	0.21	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-45.8	175.8	-74.6	-103.8	-93.9	0	0	113.6	N407 H408 A981 A983	N407-Q985 VanDerWaalsContact ND2-CD 3.33Å; N407-Q985 PolarHBondContact ND2-OE1 3.3Å; N407-Q985 VanDerWaalsContact ND2-OE1 3.13Å; H408-Q985 PolarHBondContact NE2-NE2 3.1Å; A981-Q985 WeakPolarHBondContact O-CG 3.39Å; A983-Q985 PolarHBondContact O-N 3.2Å; A983-Q985 VanDerWaalsContact O-N 3.09Å
986	H	58.1	Low	60.8	Low	108 Å²	108	85.8 Å²	85.8	50%	0.5	42%	0.421	S	S	.	.	S	Bend	trans	-105.8	73.1	-172.4	-68.6	-85.2	0	0	0	109.4	R964 A983 E984 F988	R964-H986 PolarHBondContact NH2-CD2 3.24Å; A983-H986 CarbonylContact O-C 3.54Å; A983-H986 PolarHBondContact O-N 2.98Å; E984-H986 VanDerWaalsContact C-N 3.34Å; E984-H986 PolarHBondContact O-N 2.76Å; H986-F988 PolarHBondContact O-N 3.09Å
987	K	53.9	Low	58.1	Low	166 Å²	166	88.6 Å²	88.6	72%	0.722	45%	0.445	S	S	*	.			trans	-45.8	111.5	171.2	-76.1	-161.7	168.1	-142.7	0	110.4
988	F	49.6	Very low	55.6	Low	42 Å²	42	95 Å²	95	18%	0.184	46%	0.456	C	S	.	.			trans	-61.6	148.4	170	-164.6	-115.8	0	0	0	108.3	E880 E954 T957 L958 H986	E880-F988 HydrophobicContact CG-CD1 4.42Å; E880-F988 WeakPolarHBondContact OE2-CD1 3.48Å; E954-F988 WeakPolarHBondContact O-CE2 3.38Å; E954-F988 WeakPolarHBondContact O-CZ 3.5Å; T957-F988 HydrophobicContact CG2-CD2 4.1Å; T957-F988 HydrophobicContact CG2-CE2 4.36Å; L958-F988 HydrophobicContact CD2-CB 4.5Å; L958-F988 HydrophobicContact CD2-CG 4.46Å; H986-F988 PolarHBondContact O-N 3.09Å
989	R	41.2	Very low	53.3	Low	211 Å²	211	102.1 Å²	102.1	80%	0.796	48%	0.482	S	S	*	.			trans	-131.3	77.5	179.3	-88.3	-169.6	169.5	-170.9	-3	107.5	T991	R989-T991 HydrophobicContact CB-CG2 4.24Å; R989-T991 PolarHBondContact O-N 3.29Å
990	S	45.2	Very low	50.9	Low	52 Å²	52	107.1 Å²	107.1	36%	0.364	52%	0.517	S	S	.	.			trans	-70.6	72.6	173.7	-159.9	0	0	0	0	110.8	R992 I993	S990-R992 VanDerWaalsContact C-N 3.31Å; S990-R992 PolarHBondContact O-N 3.15Å; S990-I993 VanDerWaalsContact OG-CD1 3.31Å; S990-I993 WeakPolarHBondContact OG-CD1 3.46Å; S990-I993 WeakPolarHBondContact OG-CG1 3.17Å
991	T	42	Very low	48.6	Very low	119 Å²	119	114.4 Å²	114.4	73%	0.73	55%	0.55	S	S	*	.			trans	-95	30.9	-177.9	62.3	0	0	0	0	112.4	R989	R989-T991 HydrophobicContact CB-CG2 4.24Å; R989-T991 PolarHBondContact O-N 3.29Å
992	R	38.9	Very low	46.3	Very low	126 Å²	126	117.6 Å²	117.6	48%	0.475	59%	0.585	S	S	.	*	S	Bend	trans	-144.1	-13	-177.3	-139.2	177.5	-173.2	-172.3	-0.6	116.9	S990 Q994 Q1055	S990-R992 VanDerWaalsContact C-N 3.31Å; S990-R992 PolarHBondContact O-N 3.15Å; R992-Q994 PolarHBondContact O-N 2.94Å; R992-Q1055 VanDerWaalsContact NH2-OE1 3.08Å
993	I	42.8	Very low	44.1	Very low	70 Å²	70	120 Å²	120	36%	0.359	62%	0.615	S	S	.	*			trans	-86.7	76.3	-176.8	-48	-179.1	0	0	0	111.1	M882 E954 S990	M882-I993 HydrophobicContact CE-CD1 4Å; M882-I993 HydrophobicContact SD-CD1 4.02Å; E954-I993 WeakPolarHBondContact OE2-CD1 3.38Å; E954-I993 WeakPolarHBondContact OE2-CG1 3.36Å; S990-I993 VanDerWaalsContact OG-CD1 3.31Å; S990-I993 WeakPolarHBondContact OG-CD1 3.46Å; S990-I993 WeakPolarHBondContact OG-CG1 3.17Å
994	Q	37.5	Very low	42.1	Very low	188 Å²	188	128 Å²	128	88%	0.879	66%	0.655	S	S	*	*			trans	-137.8	13.5	165.3	-74.1	-163.9	-13	0	0	113.2	R992	R992-Q994 PolarHBondContact O-N 2.94Å
995	S	35.3	Very low	40.1	Very low	98 Å²	98	130.4 Å²	130.4	69%	0.685	68%	0.678	S	S	*	*	S	Bend	trans	-104.3	-4.5	-172.6	-56.1	0	0	0	0	115.2
996	Y	33.8	Very low	38.8	Very low	227 Å²	227	134.3 Å²	134.3	89%	0.89	71%	0.707	S	S	*	*	S	Bend	trans	-125.9	35.6	-171.7	-72.8	-75.2	0	0	0	114.6
997	S	33	Very low	37.4	Very low	109 Å²	109	136.6 Å²	136.6	76%	0.762	72%	0.721	S	S	*	*			trans	-157.6	104.6	154.3	-169.9	0	0	0	0	111.6
998	R	31.1	Very low	36.3	Very low	245 Å²	245	138.1 Å²	138.1	93%	0.925	73%	0.728	S	S	*	*			trans	-151.6	91.3	163.1	-75.5	-159.7	-178	-165.8	0.7	110.7
999	K	36.1	Very low	35.4	Very low	193 Å²	193	147.2 Å²	147.2	84%	0.839	76%	0.761	S	S	*	*			trans	-131.3	154.2	152.5	-77.5	-171.8	174.2	-177.2	0	107.4
1000	S	36.2	Very low	35.1	Very low	105 Å²	105	143.2 Å²	143.2	73%	0.734	76%	0.762	S	S	*	*			trans	48.2	93.6	175.8	52.1	0	0	0	0	116.7
1001	E	36.6	Very low	34.5	Very low	197 Å²	197	148.5 Å²	148.5	92%	0.921	79%	0.786	S	S	*	*				46.7	149.1	112.8	-61.5	171.7	153.3	0	0	121.5
1002	G	33.5	Very low	34.3	Very low	85 Å²	85	151.7 Å²	151.7	88%	0.876	79%	0.792	S	S	*	*			trans	98.6	86.2	168.6	0	0	0	0	0	114.3
1003	G	30.9	Very low	34.1	Very low	73 Å²	73	150.2 Å²	150.2	75%	0.753	80%	0.799	S	S	*	*			trans	-105.2	142.5	174.1	0	0	0	0	0	112.9
1004	I	35.6	Very low	33.6	Very low	174 Å²	174	154 Å²	154	89%	0.892	82%	0.819	S	S	*	*			trans	-149.6	146.3	155	-92.3	140.5	0	0	0	106.9
1005	S	31	Very low	33.5	Very low	106 Å²	106	153 Å²	153	74%	0.741	82%	0.818	S	S	*	*			trans	-108.3	-177.7	-174.3	-46.9	0	0	0	0	111.9
1006	P	32.1	Very low	33.7	Very low	126 Å²	126	153 Å²	153	82%	0.818	82%	0.816	S	S	*	*				-113.7	144.6	-98.7	32.9	-17.5	0	0	0	113.4
1007	I	29.9	Very low	33.9	Very low	157 Å²	157	148.2 Å²	148.2	81%	0.805	81%	0.805	S	S	*	*			trans	-122.6	125.4	-176.3	-65.3	-179.9	0	0	0	112.3
1008	K	30.3	Very low	34.2	Very low	197 Å²	197	149 Å²	149	86%	0.857	80%	0.8	S	S	*	*			trans	21	145.8	149.7	-57.4	176.8	-177.7	176.5	0	121.1
1009	R	30	Very low	34.7	Very low	233 Å²	233	144.3 Å²	144.3	88%	0.879	79%	0.793	S	S	*	*			trans	-59.5	148.3	169.3	-49	173.3	-164.9	131	3	111.6
1010	P	34.6	Very low	34.6	Very low	127 Å²	127	143.4 Å²	143.4	83%	0.825	79%	0.791	S	S	*	*			trans	-63	163.8	163.6	-21	34.1	0	0	0	113.3
1011	L	33.6	Very low	34.7	Very low	164 Å²	164	141.3 Å²	141.3	86%	0.859	79%	0.786	S	S	*	*			trans	-110.1	167.1	172.5	-53.8	90.8	0	0	0	109.9
1012	E	36.9	Very low	34.7	Very low	185 Å²	185	139.2 Å²	139.2	86%	0.864	78%	0.78	S	S	*	*			trans	-156.6	169.7	141.7	-118.8	-168.5	173.7	0	0	110.7
1013	P	35.4	Very low	34.8	Very low	95 Å²	95	139.4 Å²	139.4	62%	0.617	77%	0.768	S	S	*	*				-129.9	156.8	-103.6	41.9	-27.2	0	0	0	118
1014	I	31.6	Very low	35.1	Very low	150 Å²	150	143.7 Å²	143.7	77%	0.769	77%	0.768	S	S	*	*			trans	31.2	120.3	132.4	-48.9	168.2	0	0	0	119.2
1015	I	36.8	Very low	35.1	Very low	167 Å²	167	141.8 Å²	141.8	86%	0.856	76%	0.759	S	S	*	*				-161.3	148.4	116.8	-98.5	158.3	0	0	0	109.2
1016	P	39.8	Very low	35.3	Very low	99 Å²	99	141.7 Å²	141.7	64%	0.643	76%	0.758	S	S	*	*			trans	-125	-149.7	-159.7	34.8	-12.1	0	0	0	114.2
1017	N	36.4	Very low	35.4	Very low	125 Å²	125	141.6 Å²	141.6	67%	0.668	76%	0.755	S	S	*	*			trans	88.1	138.9	175.5	-61.7	53.1	0	0	0	115.2
1018	D	39	Very low	35.7	Very low	125 Å²	125	139.9 Å²	139.9	67%	0.668	75%	0.754	S	S	*	*			cis	-161	166.1	-1.8	-113	-20.4	0	0	0	113.4
1019	I	41.7	Very low	35.8	Very low	148 Å²	148	136.5 Å²	136.5	76%	0.759	75%	0.75	S	S	*	*			trans	66.7	143.2	155.1	-70	158.8	0	0	0	118.7
1020	E	35.8	Very low	35.8	Very low	174 Å²	174	130.3 Å²	130.3	81%	0.813	74%	0.743	S	S	*	*			cis	-168.5	168.2	-36.8	-139	172.8	-161.4	0	0	109.4
1021	G	36.7	Very low	35.7	Very low	61 Å²	61	128.8 Å²	128.8	63%	0.629	74%	0.735	S	S	*	*			trans	113	97.7	173.6	0	0	0	0	0	115.4
1022	I	37.5	Very low	35.6	Very low	152 Å²	152	126.6 Å²	126.6	78%	0.779	73%	0.728	S	S	*	*				68.7	125.1	60.7	-53.8	164.3	0	0	0	111.1
1023	S	35	Very low	35.4	Very low	90 Å²	90	124.6 Å²	124.6	63%	0.629	72%	0.723	S	S	*	*			cis	-170.3	165.7	-8.3	-105.3	0	0	0	0	107.8
1024	E	37.3	Very low	35.2	Very low	162 Å²	162	125 Å²	125	76%	0.757	73%	0.728	S	S	*	*			cis	-152	-131.5	-7.1	-126.2	166.1	-82	0	0	109.2
1025	L	36.1	Very low	35.3	Very low	135 Å²	135	123.1 Å²	123.1	71%	0.707	72%	0.724	S	S	*	*			cis	-162.4	133.2	3.3	-172.4	71.4	0	0	0	111.7
1026	S	35	Very low	34.9	Very low	103 Å²	103	121.1 Å²	121.1	72%	0.72	72%	0.715	S	S	*	*			trans	60.5	157.8	157.5	69.7	0	0	0	0	121.6
1027	V	35.1	Very low	34.5	Very low	124 Å²	124	123.2 Å²	123.2	75%	0.752	72%	0.716	S	S	*	*			cis	-157.2	141.5	-27.3	136.9	0	0	0	0	107.2
1028	P	35.1	Very low	34.1	Very low	121 Å²	121	127.7 Å²	127.7	79%	0.786	72%	0.724	S	S	*	*			trans	-116.1	139.4	173.2	37.2	-27.4	0	0	0	114.6
1029	T	32.7	Very low	33.7	Very low	127 Å²	127	126.4 Å²	126.4	78%	0.779	73%	0.725	S	S	*	*			trans	-157.3	142.5	164.3	9.3	0	0	0	0	115.6
1030	S	29	Very low	33.2	Very low	103 Å²	103	126 Å²	126	72%	0.72	72%	0.724	S	S	*	*			trans	-12	159.1	153.9	63.8	0	0	0	0	120.4
1031	S	33.8	Very low	32.8	Very low	95 Å²	95	123.8 Å²	123.8	66%	0.664	72%	0.723	S	S	*	*				-176.1	150.8	53.1	57.8	0	0	0	0	117.9
1032	V	31.6	Very low	32.4	Very low	118 Å²	118	125.2 Å²	125.2	72%	0.715	72%	0.723	S	S	*	*			trans	55.1	150.1	145.5	-59.6	0	0	0	0	125.5
1033	N	32.1	Very low	31.9	Very low	142 Å²	142	128 Å²	128	76%	0.759	73%	0.725	S	S	*	*			trans	74.7	146	154.9	-67.1	-31.6	0	0	0	118.1
1034	S	32	Very low	31.6	Very low	103 Å²	103	128 Å²	128	72%	0.72	73%	0.725	S	S	*	*			cis	176.7	159.6	-14.9	-105	0	0	0	0	106.4
1035	V	32.5	Very low	31.1	Very low	112 Å²	112	125 Å²	125	68%	0.679	72%	0.722	S	S	*	*			cis	-161.3	150.2	-0.1	86.5	0	0	0	0	109.2
1036	N	29.3	Very low	30.8	Very low	125 Å²	125	127.6 Å²	127.6	67%	0.668	73%	0.733	S	S	*	*			trans	55.4	152.6	158.3	-66	-32.3	0	0	0	120.7
1037	Q	30	Very low	30.3	Very low	143 Å²	143	126 Å²	126	67%	0.668	73%	0.733	S	S	*	*			cis	-156.7	159.3	-5.9	-121.2	167.1	55	0	0	110.8
1038	R	28.8	Very low	30	Very low	219 Å²	219	129.7 Å²	129.7	83%	0.826	74%	0.739	S	S	*	*			trans	17.6	137.1	150.9	-61.6	173.7	178.2	-179.9	-1.4	118.9
1039	S	30.8	Very low	29.7	Very low	98 Å²	98	131.8 Å²	131.8	69%	0.685	74%	0.743	S	S	*	*			cis	-157	154.3	41.2	-47.4	0	0	0	0	113.5
1040	N	31.7	Very low	29.7	Very low	139 Å²	139	133.6 Å²	133.6	74%	0.743	74%	0.743	S	S	*	*			trans	46.1	105.8	148.1	-54.7	2.1	0	0	0	117.1
1041	T	27.2	Very low	29.5	Very low	128 Å²	128	134.2 Å²	134.2	79%	0.785	75%	0.747	S	S	*	*				44.9	131.1	66.4	84.8	0	0	0	0	112.4
1042	S	28.1	Very low	29.3	Very low	90 Å²	90	133.9 Å²	133.9	63%	0.629	75%	0.75	S	S	*	*			cis	-170.2	175.3	37.3	40.4	0	0	0	0	111
1043	Y	27.3	Very low	29.3	Very low	211 Å²	211	132.9 Å²	132.9	83%	0.827	75%	0.746	S	S	*	*			trans	44.1	144.8	150.2	93.3	-54.9	0	0	0	121.7
1044	S	28.4	Very low	29.1	Very low	90 Å²	90	130.9 Å²	130.9	63%	0.629	74%	0.743	S	S	*	*			cis	-159	152.7	8.7	-145.1	0	0	0	0	114.1
1045	S	26.3	Very low	29.1	Very low	99 Å²	99	132.6 Å²	132.6	69%	0.692	74%	0.74	S	S	*	*			trans	26	126.4	133.4	-52.5	0	0	0	0	120.3
1046	M	29.2	Very low	28.8	Very low	190 Å²	190	133 Å²	133	94%	0.936	74%	0.742	S	S	*	*				55.7	113.6	75.9	-72.2	-93	-77.4	0	0	114.5
1047	G	26.5	Very low	28.6	Very low	70 Å²	70	131.3 Å²	131.3	72%	0.722	75%	0.745	S	S	*	*			trans	-176.7	125.9	171.8	0	0	0	0	0	116.2
1048	F	27	Very low	28.5	Very low	201 Å²	201	131.3 Å²	131.3	88%	0.882	75%	0.75	S	S	*	*			trans	-84.8	114.7	162.3	-92.6	-108.7	0	0	0	109.2	H1050	F1048-H1050 PolarHBondContact O-N 2.89Å
1049	N	30.3	Very low	28.5	Very low	164 Å²	164	129.6 Å²	129.6	88%	0.877	75%	0.75	S	S	*	*			trans	-90.1	79.8	177.1	-74.1	-13.1	0	0	0	112.6
1050	H	32.1	Very low	28.3	Very low	165 Å²	165	132.5 Å²	132.5	76%	0.764	75%	0.753	S	S	*	*			trans	-106.1	156.5	152.2	-83.7	-47	0	0	0	109.2	F1048	F1048-H1050 PolarHBondContact O-N 2.89Å
1051	S	25.7	Very low	28.1	Very low	116 Å²	116	130.6 Å²	130.6	81%	0.811	75%	0.751	S	S	*	*			trans	77.7	157.3	-167.8	-29	0	0	0	0	112.1
1052	A	28.2	Very low	28.1	Very low	89 Å²	89	129.7 Å²	129.7	74%	0.736	75%	0.75	S	S	*	*			cis	-141	-148.8	7.5	0	0	0	0	0	110.7
1053	P	31	Very low	28.1	Very low	97 Å²	97	129.3 Å²	129.3	63%	0.63	75%	0.747	S	S	*	*				-123.8	-179.9	-84.1	35.8	-20.6	0	0	0	114.1
1054	S	28.9	Very low	28.3	Very low	100 Å²	100	125.4 Å²	125.4	70%	0.699	73%	0.731	S	S	*	*			trans	-79.5	129.5	163.4	54.3	0	0	0	0	112.3
1055	Q	31	Very low	28.3	Very low	139 Å²	139	123.8 Å²	123.8	65%	0.65	72%	0.72	S	S	*	*			trans	-125.5	138.3	158.5	-46.9	-139.4	44	0	0	105.6	R992	R992-Q1055 VanDerWaalsContact NH2-OE1 3.08Å
1056	V	27	Very low	28.6	Very low	120 Å²	120	124.3 Å²	124.3	73%	0.727	72%	0.724	S	S	*	*				61.8	121.3	53.2	-175.6	0	0	0	0	109
1057	A	26.1	Very low	28.5	Very low	89 Å²	89	120.4 Å²	120.4	74%	0.736	71%	0.707	S	S	*	*			cis	-138.3	-174.7	26.4	0	0	0	0	0	115.9
1058	L	26.1	Very low	28.7	Very low	144 Å²	144	126.2 Å²	126.2	75%	0.754	72%	0.715	S	S	*	*			trans	-47.5	152.7	162.6	-62.4	142.4	0	0	0	114
1059	H	30	Very low	28.8	Very low	182 Å²	182	122.3 Å²	122.3	84%	0.843	71%	0.709	S	S	*	*			trans	163.1	100.4	146	-89	-68.4	0	0	0	105.7
1060	H	26.7	Very low	28.9	Very low	159 Å²	159	122.5 Å²	122.5	74%	0.736	71%	0.71	S	S	*	*				56.8	118.2	78.4	-80.1	-88.9	0	0	0	115.7
1061	S	26.4	Very low	28.6	Very low	100 Å²	100	121.2 Å²	121.2	70%	0.699	71%	0.713	S	S	*	*			trans	79.1	122.3	154.9	-49.3	0	0	0	0	120.1
1062	S	27.3	Very low	28.7	Very low	109 Å²	109	121 Å²	121	76%	0.762	71%	0.71	S	S	*	*			trans	54.6	146.7	130.6	62.1	0	0	0	0	122.1
1063	S	28.6	Very low	28.8	Very low	81 Å²	81	125.2 Å²	125.2	57%	0.566	72%	0.716	S	S	*	*			cis	178.2	145	-14.1	48.7	0	0	0	0	109.3
1064	Y	31	Very low	28.6	Very low	129 Å²	129	129.1 Å²	129.1	51%	0.506	73%	0.731	S	S	.	*			trans	62.7	159.8	164.2	-42.8	-35.9	0	0	0	115.4	D1418 N1419	Y1064-D1418 HydrophobicContact CD1-CB 4.24Å; Y1064-D1418 HydrophobicContact CD2-CB 3.67Å; Y1064-D1418 HydrophobicContact CE1-CB 4.03Å; Y1064-D1418 HydrophobicContact CE2-CB 3.38Å; Y1064-D1418 HydrophobicContact CG-CB 4.09Å; Y1064-D1418 PolarHBondContact OH-O 2.79Å; Y1064-N1419 HydrophobicContact CD1-CB 3.53Å; Y1064-N1419 HydrophobicContact CE1-CB 3.96Å; Y1064-N1419 WeakPolarHBondContact CE1-O 3.45Å; Y1064-N1419 HydrophobicContact CG-CB 4.05Å
1065	S	29.9	Very low	29	Very low	56 Å²	56	135.6 Å²	135.6	39%	0.392	74%	0.74	S	S	.	*			cis	-137.8	-153.9	-22.1	-141.9	0	0	0	0	107.3	N1419	S1065-N1419 PolarHBondContact OG-ND2 2.94Å
1066	S	30.9	Very low	28.8	Very low	111 Å²	111	133.3 Å²	133.3	78%	0.776	75%	0.745	S	S	*	*			cis	-147.7	163.9	16.7	-56.9	0	0	0	0	112.1
1067	N	28.7	Very low	28.8	Very low	108 Å²	108	133 Å²	133	58%	0.578	75%	0.746	S	S	*	*			trans	-79.8	156.1	174.7	-57.9	-59.4	0	0	0	114.2
1068	H	29	Very low	28.8	Very low	191 Å²	191	135.4 Å²	135.4	88%	0.884	75%	0.751	S	S	*	*				-159.5	143.3	119.3	-104	-72.1	0	0	0	111.2
1069	P	30.2	Very low	28.9	Very low	119 Å²	119	134.6 Å²	134.6	77%	0.773	75%	0.752	S	S	*	*			trans	-103.2	-174.9	-167.2	40.5	-36.4	0	0	0	115.8
1070	L	31.3	Very low	28.7	Very low	168 Å²	168	133.5 Å²	133.5	88%	0.88	75%	0.745	S	S	*	*			trans	-73.3	162.2	-169.1	-59.6	165.3	0	0	0	116
1071	T	26.7	Very low	28.9	Very low	138 Å²	138	136.8 Å²	136.8	85%	0.847	75%	0.752	S	S	*	*			trans	-127.6	152.3	146.9	43.3	0	0	0	0	110.9
1072	P	28.5	Very low	28.9	Very low	113 Å²	113	138.6 Å²	138.6	73%	0.734	75%	0.75	S	S	*	*			trans	-110.4	160.3	-165.6	40.3	-33.7	0	0	0	115.9
1073	M	29.4	Very low	29.1	Very low	176 Å²	176	140.9 Å²	140.9	87%	0.867	75%	0.753	S	S	*	*			trans	58.8	137.1	156.8	-71.8	179.6	61.9	0	0	120.9
1074	L	27	Very low	29.2	Very low	179 Å²	179	141.9 Å²	141.9	94%	0.937	76%	0.759	S	S	*	*				-160.9	162.4	126.4	-108.5	167.9	0	0	0	110.2
1075	R	36.4	Very low	29.3	Very low	236 Å²	236	144.2 Å²	144.2	89%	0.891	78%	0.775	S	S	*	*			trans	-133.8	126.1	-168.6	-180	-170.4	-167.3	165.5	4.1	111.1
1076	A	26.9	Very low	29.5	Very low	91 Å²	91	147.5 Å²	147.5	75%	0.752	80%	0.795	S	S	*	*			trans	-164.4	164.3	171.4	0	0	0	0	0	110.5
1077	P	28.1	Very low	29.5	Very low	115 Å²	115	148.6 Å²	148.6	75%	0.747	79%	0.792	S	S	*	*			cis	-128.4	169.4	-46.6	37.2	-24.8	0	0	0	112
1078	T	26.7	Very low	29.8	Very low	139 Å²	139	152.8 Å²	152.8	85%	0.853	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-76.1	130.8	169.3	45.8	0	0	0	0	111.2
1079	V	27.1	Very low	30	Very low	127 Å²	127	148.6 Å²	148.6	77%	0.77	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-102.5	120.7	168.9	178.3	0	0	0	0	108.7
1080	K	26.3	Very low	30.7	Very low	158 Å²	158	148.7 Å²	148.7	69%	0.687	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-77.2	153.8	167.7	-70.8	-176	167.2	-161.7	0	110.2	E1082	K1080-E1082 IonicContact NZ-OE1 3.59Å
1081	Y	30.9	Very low	30.9	Very low	229 Å²	229	146 Å²	146	90%	0.898	79%	0.794	S	S	*	*			trans	-130.7	143.8	151.8	-118.2	-91	0	0	0	107.6
1082	E	26.8	Very low	31.1	Very low	138 Å²	138	146.5 Å²	146.5	65%	0.645	79%	0.79	S	S	*	*			trans	-148.8	172.3	-165.4	-157	160.7	-117.2	0	0	108.1	K1080	K1080-E1082 IonicContact NZ-OE1 3.59Å
1083	L	31.4	Very low	31.2	Very low	157 Å²	157	147.4 Å²	147.4	82%	0.822	79%	0.785	S	S	*	*			trans	70.3	137.4	-171.7	-91.3	66.9	0	0	0	115.3
1084	S	29.8	Very low	31.2	Very low	102 Å²	102	147.2 Å²	147.2	71%	0.713	78%	0.775	S	S	*	*			cis	-147.8	153.1	-1.6	-60.5	0	0	0	0	111.2
1085	E	33.6	Very low	31.4	Very low	178 Å²	178	145.4 Å²	145.4	83%	0.832	77%	0.767	S	S	*	*			trans	-94.6	173.8	160.8	-63.7	-161.8	154.4	0	0	111.5
1086	P	34.6	Very low	31.2	Very low	124 Å²	124	143.5 Å²	143.5	81%	0.805	77%	0.765	S	S	*	*				-141.5	128.4	99.2	36.2	-21.8	0	0	0	116.4
1087	D	30.1	Very low	31.6	Very low	134 Å²	134	144.4 Å²	144.4	72%	0.717	76%	0.763	S	S	*	*				48.4	105.1	113.1	-161.1	14.2	0	0	0	120.4
1088	E	34.6	Very low	31.7	Very low	196 Å²	196	146.9 Å²	146.9	92%	0.916	77%	0.77	S	S	*	*				-156.9	162.1	124.8	-134.9	-178	113.3	0	0	110.3
1089	S	33.9	Very low	32	Very low	103 Å²	103	144 Å²	144	72%	0.72	77%	0.768	S	S	*	*			trans	-129.8	156.3	-155.2	51.9	0	0	0	0	117.8
1090	P	44.4	Very low	32.1	Very low	121 Å²	121	147.3 Å²	147.3	79%	0.786	77%	0.772	S	S	*	*			trans	-108.6	165.1	-177	40.9	-35.2	0	0	0	115.1
1091	P	35.1	Very low	32.3	Very low	112 Å²	112	145.9 Å²	145.9	73%	0.727	78%	0.777	S	S	*	*			trans	-141.8	123.6	155	34	-16	0	0	0	117.6
1092	L	31.1	Very low	32.6	Very low	148 Å²	148	141.1 Å²	141.1	78%	0.775	78%	0.777	S	S	*	*				59.8	141.1	123	-66.4	164.7	0	0	0	125.2
1093	E	30.3	Very low	32.8	Very low	132 Å²	132	140 Å²	140	62%	0.617	78%	0.784	S	S	*	*			trans	70.8	154.5	142	-74.8	173.5	156.2	0	0	120.4
1094	Y	29.8	Very low	32.8	Very low	172 Å²	172	140.3 Å²	140.3	68%	0.675	79%	0.787	S	S	*	*			cis	-154.5	158.6	10.2	-121.7	-53	0	0	0	113.3
1095	N	31.5	Very low	32.9	Very low	142 Å²	142	143 Å²	143	76%	0.759	79%	0.79	S	S	*	*			trans	76.5	130.9	144.1	-72.8	-36.6	0	0	0	126.1
1096	K	32.9	Very low	32.9	Very low	195 Å²	195	142.4 Å²	142.4	85%	0.848	79%	0.792	S	S	*	*			trans	-87.1	178.9	154	-110.6	176.2	-178.8	175	0	109.1
1097	P	34.5	Very low	32.8	Very low	111 Å²	111	141.7 Å²	141.7	72%	0.721	79%	0.79	S	S	*	*			cis	-153.8	-178	36.5	44	-21.5	0	0	0	119.6
1098	N	30	Very low	32.6	Very low	166 Å²	166	141.7 Å²	141.7	89%	0.888	80%	0.795	S	S	*	*			trans	27.7	129.9	150	-70.4	-7.5	0	0	0	123.9
1099	G	33.1	Very low	32.5	Very low	78 Å²	78	142.2 Å²	142.2	80%	0.804	80%	0.795	S	S	*	*			trans	-149.1	157.2	153.7	0	0	0	0	0	110.6
1100	K	30.5	Very low	32.4	Very low	198 Å²	198	142.7 Å²	142.7	86%	0.861	80%	0.798	S	S	*	*			trans	-121.6	151	-166.9	-81.5	-173.7	176	179.1	0	115.7
1101	T	30.4	Very low	31.9	Very low	127 Å²	127	142.7 Å²	142.7	78%	0.779	80%	0.798	S	S	*	*			trans	54.4	117.5	146.9	50.7	0	0	0	0	121
1102	S	36.1	Very low	31.8	Very low	130 Å²	130	146.3 Å²	146.3	91%	0.909	81%	0.805	S	S	*	*				-164.6	165.2	112.1	32.9	0	0	0	0	110.6
1103	S	31.4	Very low	32	Very low	114 Å²	114	145.1 Å²	145.1	80%	0.797	81%	0.806	S	S	*	*			trans	-111.8	142.7	-165.9	53.2	0	0	0	0	113.5
1104	N	32.2	Very low	32.1	Very low	164 Å²	164	144 Å²	144	88%	0.877	81%	0.805	S	S	*	*			trans	-155.7	160.8	138.4	-137.9	-21.6	0	0	0	113.2
1105	M	30.1	Very low	32.3	Very low	159 Å²	159	141.5 Å²	141.5	78%	0.783	81%	0.809	S	S	*	*			trans	-89.5	146.4	-178.1	-68.2	-72.1	-178.6	0	0	112.4
1106	N	34.5	Very low	32.3	Very low	164 Å²	164	144 Å²	144	88%	0.877	81%	0.809	S	S	*	*				-179.3	162.8	127.8	-92.9	-24.5	0	0	0	113.1
1107	S	31.6	Very low	32.6	Very low	109 Å²	109	136.9 Å²	136.9	76%	0.762	79%	0.785	S	S	*	*			trans	-84.9	133.7	-158.4	-55.1	0	0	0	0	117.1
1108	T	27.4	Very low	32.7	Very low	134 Å²	134	138.9 Å²	138.9	82%	0.822	78%	0.782	S	S	*	*				43.4	94.6	129.1	-38.6	0	0	0	0	119.1
1109	K	30.9	Very low	33	Very low	208 Å²	208	137.3 Å²	137.3	90%	0.904	77%	0.769	S	S	*	*			trans	-133	123.8	144.9	-85.3	-172.2	174	-178.3	0	109.6
1110	S	32.5	Very low	33.3	Very low	112 Å²	112	141 Å²	141	78%	0.783	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-85.3	139	170.1	50.4	0	0	0	0	110.7
1111	P	33.9	Very low	34	Very low	121 Å²	121	140.3 Å²	140.3	79%	0.786	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-72.6	159.5	178.9	-15.4	30.6	0	0	0	113.6
1112	E	33.5	Very low	34.7	Very low	188 Å²	188	137.7 Å²	137.7	88%	0.879	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-67.9	143.2	168.9	-67.3	179.9	103.7	0	0	111.9	N1114	E1112-N1114 PolarHBondContact O-N 3.39Å
1113	P	35.1	Very low	34.6	Very low	123 Å²	123	137.1 Å²	137.1	80%	0.799	72%	0.723	S	S	*	*			trans	-77.6	113	173.8	30.7	-32.6	0	0	0	111.4
1114	N	32.3	Very low	34.8	Very low	110 Å²	110	135.2 Å²	135.2	59%	0.588	72%	0.722	S	S	*	*			trans	-56.6	128.8	177.7	-175.1	1.1	0	0	0	112.2	E1112 Y1116	E1112-N1114 PolarHBondContact O-N 3.39Å; N1114-Y1116 PolarHBondContact O-N 2.9Å; N1114-Y1116 WeakPolarHBondContact OD1-CD2 3.46Å
1115	P	34.3	Very low	35.1	Very low	118 Å²	118	131.2 Å²	131.2	77%	0.766	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	-10.3	-175.9	-28.9	36.6	0	0	0	117.5	S1117	P1115-S1117 PolarHBondContact O-N 3.37Å
1116	Y	32	Very low	35.5	Very low	194 Å²	194	129.5 Å²	129.5	76%	0.761	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-9.3	-173.4	-80.3	-93.6	0	0	0	115.7	N1114 F1118	N1114-Y1116 PolarHBondContact O-N 2.9Å; N1114-Y1116 WeakPolarHBondContact OD1-CD2 3.46Å; Y1116-F1118 PolarHBondContact O-N 3.18Å
1117	S	37.9	Very low	35.8	Very low	47 Å²	47	128.4 Å²	128.4	33%	0.329	69%	0.687	S	S	.	*	H	α-helix	trans	-71.2	7.1	-172.3	76	0	0	0	0	117	P1115 R1121	P1115-S1117 PolarHBondContact O-N 3.37Å; S1117-R1121 WeakPolarHBondContact O-CG 3.47Å
1118	F	37.3	Very low	36.3	Very low	152 Å²	152	131.8 Å²	131.8	67%	0.667	69%	0.691	S	S	*	*	H	α-helix	trans	-78.6	-42.9	-179.4	-176.4	-100.5	0	0	0	112.8	Y1116	Y1116-F1118 PolarHBondContact O-N 3.18Å
1119	E	36.5	Very low	37.3	Very low	134 Å²	134	126.5 Å²	126.5	63%	0.626	66%	0.661	S	S	*	*	H	α-helix	trans	-69.1	-37.8	178.6	-67.4	-160.6	137.5	0	0	111.3	R1121 H1122 N1123	E1119-R1121 VanDerWaalsContact C-N 3.28Å; E1119-R1121 PolarHBondContact O-N 2.59Å; E1119-H1122 PolarHBondContact O-N 3.14Å; E1119-N1123 VanDerWaalsContact O-CB 3.28Å; E1119-N1123 WeakPolarHBondContact O-CB 3.43Å; E1119-N1123 PolarHBondContact O-N 2.9Å
1120	E	38.6	Very low	38	Very low	156 Å²	156	117.8 Å²	117.8	73%	0.729	63%	0.626	S	S	*	*	H	α-helix	trans	-63.4	-24.9	-176.5	-154.6	170.3	-143.7	0	0	114.3	H1122	E1120-H1122 VanDerWaalsContact C-N 3.27Å; E1120-H1122 PolarHBondContact O-N 3.15Å
1121	R	44.6	Very low	39.1	Very low	182 Å²	182	119.5 Å²	119.5	69%	0.687	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-16.3	177.5	-69.4	179.2	-163.7	-162.1	3.6	114	S1117 E1119	S1117-R1121 WeakPolarHBondContact O-CG 3.47Å; E1119-R1121 VanDerWaalsContact C-N 3.28Å; E1119-R1121 PolarHBondContact O-N 2.59Å
1122	H	45.9	Very low	40.6	Very low	72 Å²	72	119.9 Å²	119.9	33%	0.333	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-133.9	-25.3	-174.2	-66	-28.8	0	0	0	114	E1119 E1120 G1124 L1125	E1119-H1122 PolarHBondContact O-N 3.14Å; E1120-H1122 VanDerWaalsContact C-N 3.27Å; E1120-H1122 PolarHBondContact O-N 3.15Å; H1122-G1124 PolarHBondContact O-N 3.02Å; H1122-L1125 PolarHBondContact O-N 3.06Å
1123	N	33.9	Very low	42.2	Very low	118 Å²	118	115.3 Å²	115.3	63%	0.631	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	92.1	166.9	-68.8	-8.2	0	0	0	108.8	E1119	E1119-N1123 VanDerWaalsContact O-CB 3.28Å; E1119-N1123 WeakPolarHBondContact O-CB 3.43Å; E1119-N1123 PolarHBondContact O-N 2.9Å
1124	G	36	Very low	44.1	Very low	74 Å²	74	110 Å²	110	76%	0.763	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	140.6	-3.9	-169.2	0	0	0	0	0	113.9	H1122 D1126	H1122-G1124 PolarHBondContact O-N 3.02Å; G1124-D1126 PolarHBondContact O-N 3.06Å
1125	L	39.4	Very low	46.2	Very low	80 Å²	80	107 Å²	107	42%	0.419	53%	0.532	S	S	.	.			trans	-73.7	75.1	164.3	-79.7	167.9	0	0	0	110.4	H1122 W1142	H1122-L1125 PolarHBondContact O-N 3.06Å; L1125-W1142 HydrophobicContact CD2-CH2 4.29Å; L1125-W1142 HydrophobicContact CD2-CZ3 3.72Å
1126	D	37.4	Very low	48.1	Very low	124 Å²	124	106.2 Å²	106.2	66%	0.663	53%	0.527	S	S	*	.			trans	-63.4	168.1	179.5	-157.4	1.7	0	0	0	112.7	G1124 E1128	G1124-D1126 PolarHBondContact O-N 3.06Å; D1126-E1128 PolarHBondContact O-N 2.87Å
1127	L	41.2	Very low	50.1	Low	140 Å²	140	103.5 Å²	103.5	73%	0.733	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-14.1	-155	-69.3	163.9	0	0	0	115.8
1128	E	41.9	Very low	52.1	Low	180 Å²	180	103.3 Å²	103.3	84%	0.841	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-5.4	-168.9	-60.7	-145.5	122.2	0	0	116.8	D1126 P1130	D1126-E1128 PolarHBondContact O-N 2.87Å; E1128-P1130 WeakPolarHBondContact O-CD 3.43Å; E1128-P1130 VanDerWaalsContact O-N 3.08Å
1129	A	49.1	Very low	54.2	Low	24 Å²	24	96.9 Å²	96.9	20%	0.198	49%	0.489	C	S	.	.			trans	-45.1	115.3	-173.6	0	0	0	0	0	113.4	R1131 W1142	A1129-R1131 PolarHBondContact O-N 3.34Å; A1129-W1142 HydrophobicContact CB-CH2 4.18Å; A1129-W1142 HydrophobicContact CB-CZ2 4.38Å
1130	P	45.8	Very low	56.2	Low	24 Å²	24	94 Å²	94	16%	0.156	48%	0.48	C	S	.	.			trans	-64.7	120.7	-164.2	-24.6	32.8	0	0	0	113.7	E1128 R1132 L1134	E1128-P1130 WeakPolarHBondContact O-CD 3.43Å; E1128-P1130 VanDerWaalsContact O-N 3.08Å; P1130-R1132 HydrophobicContact CB-CG 4Å; P1130-R1132 PolarHBondContact O-N 3.46Å; P1130-L1134 HydrophobicContact CB-CD2 3.86Å; P1130-L1134 HydrophobicContact CG-CD2 4.01Å
1131	R	54.1	Low	58.2	Low	148 Å²	148	89.8 Å²	89.8	56%	0.558	47%	0.465	S	S	*	.	S	Bend	trans	-76.3	-10.4	174.6	-53.5	-175.9	-165.8	-175.6	6	113.4	A1129	A1129-R1131 PolarHBondContact O-N 3.34Å
1132	R	65.9	Low	60	Low	129 Å²	129	83.2 Å²	83.2	49%	0.487	44%	0.44	S	S	.	.	S	Bend	trans	-79.1	-177.9	176.8	57.7	166.5	172.2	73.4	0.4	111.5	P1130 E1138	P1130-R1132 HydrophobicContact CB-CG 4Å; P1130-R1132 PolarHBondContact O-N 3.46Å; R1132-E1138 IonicContact CZ-OE1 2.71Å; R1132-E1138 IonicContact CZ-OE2 3.56Å; R1132-E1138 IonicContact NH1-OE1 3.66Å; R1132-E1138 PolarHBondContact NH1-OE1 3.13Å; R1132-E1138 IonicContact NH1-OE2 3.63Å; R1132-E1138 PolarHBondContact NH1-OE2 2.9Å; R1132-E1138 IonicContact NH2-OE1 3.71Å; R1132-E1138 PolarHBondContact NH2-OE1 3.43Å; R1132-E1138 IonicContact NH2-OE2 3.54Å
1133	I	66.4	Low	61.8	Low	93 Å²	93	80.3 Å²	80.3	48%	0.477	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-64.6	132.4	162.4	-58.8	169.8	0	0	0	107.4	E1155 R1156	I1133-E1155 HydrophobicContact CG2-CG 4.41Å; I1133-R1156 VanDerWaalsContact CG1-CZ 3.48Å
1134	L	75.7	Confident	64	Low	12 Å²	12	82.3 Å²	82.3	6%	0.063	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-72.6	143.4	173	-60.7	179.4	0	0	0	109.8	P1130 E1138 W1142 L1154 E1155	P1130-L1134 HydrophobicContact CB-CD2 3.86Å; P1130-L1134 HydrophobicContact CG-CD2 4.01Å; L1134-E1138 WeakPolarHBondContact CA-OE2 3.49Å; L1134-E1138 HydrophobicContact CB-CB 3.98Å; L1134-E1138 HydrophobicContact CD2-CB 4.28Å; L1134-W1142 HydrophobicContact CD1-CB 4.2Å; L1134-W1142 HydrophobicContact CD1-CG 4.3Å; L1134-L1154 HydrophobicContact CD1-CD2 3.68Å; L1134-L1154 HydrophobicContact CD1-CG 3.78Å; L1134-E1155 PolarHBondContact N-O 3.12Å; L1134-E1155 VanDerWaalsContact N-O 3.09Å
1135	T	76	Confident	66	Low	47 Å²	47	86.1 Å²	86.1	29%	0.288	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-64.6	163.8	166.4	76.7	0	0	0	0	109.9	E1137 E1138 S1139	T1135-E1137 VanDerWaalsContact C-N 3.29Å; T1135-E1137 PolarHBondContact O-N 2.72Å; T1135-E1137 PolarHBondContact OG1-N 3.29Å; T1135-E1137 PolarHBondContact OG1-OE2 2.92Å; T1135-E1138 HydrophobicContact CG2-CG 4.49Å; T1135-E1138 PolarHBondContact N-OE2 3.46Å; T1135-E1138 PolarHBondContact O-N 2.89Å; T1135-E1138 WeakPolarHBondContact OG1-CG 3.46Å; T1135-E1138 PolarHBondContact OG1-N 3.41Å; T1135-E1138 VanDerWaalsContact OG1-N 3.14Å; T1135-S1139 WeakPolarHBondContact O-CB 3.39Å; T1135-S1139 PolarHBondContact O-N 3.05Å
1136	P	74.4	Confident	67.9	Low	100 Å²	100	83.7 Å²	83.7	65%	0.649	42%	0.417	S	S	*	.	H	α-helix	trans	-54.6	-42.9	172.7	-27.3	37	0	0	0	112.8	S1139 V1140	P1136-S1139 PolarHBondContact O-N 3.4Å; P1136-S1139 PolarHBondContact O-OG 3.02Å; P1136-V1140 PolarHBondContact O-N 2.64Å
1137	E	75.1	Confident	69.9	Low	137 Å²	137	80.6 Å²	80.6	64%	0.64	41%	0.414	S	S	*	.	H	α-helix	trans	-65.6	-44	177.9	-50	97.9	-166.4	0	0	112.1	T1135 S1139 V1140 T1141	T1135-E1137 VanDerWaalsContact C-N 3.29Å; T1135-E1137 PolarHBondContact O-N 2.72Å; T1135-E1137 PolarHBondContact OG1-N 3.29Å; T1135-E1137 PolarHBondContact OG1-OE2 2.92Å; E1137-S1139 VanDerWaalsContact C-N 3.31Å; E1137-S1139 PolarHBondContact O-N 3.2Å; E1137-V1140 PolarHBondContact O-N 3.39Å; E1137-T1141 WeakPolarHBondContact O-CB 3.36Å; E1137-T1141 PolarHBondContact O-N 3.43Å; E1137-T1141 PolarHBondContact O-OG1 2.9Å
1138	E	79.2	Confident	71.9	Confident	44 Å²	44	74.7 Å²	74.7	21%	0.206	38%	0.383	C	S	.	.	H	α-helix	trans	-62.4	-39	174.9	-72.5	174.1	159.7	0	0	111.5	R1132 L1134 T1135 V1140 T1141 W1142	R1132-E1138 IonicContact CZ-OE1 2.71Å; R1132-E1138 IonicContact CZ-OE2 3.56Å; R1132-E1138 IonicContact NH1-OE1 3.66Å; R1132-E1138 PolarHBondContact NH1-OE1 3.13Å; R1132-E1138 IonicContact NH1-OE2 3.63Å; R1132-E1138 PolarHBondContact NH1-OE2 2.9Å; R1132-E1138 IonicContact NH2-OE1 3.71Å; R1132-E1138 PolarHBondContact NH2-OE1 3.43Å; R1132-E1138 IonicContact NH2-OE2 3.54Å; L1134-E1138 WeakPolarHBondContact CA-OE2 3.49Å; L1134-E1138 HydrophobicContact CB-CB 3.98Å; L1134-E1138 HydrophobicContact CD2-CB 4.28Å; T1135-E1138 HydrophobicContact CG2-CG 4.49Å; T1135-E1138 PolarHBondContact N-OE2 3.46Å; T1135-E1138 PolarHBondContact O-N 2.89Å; T1135-E1138 WeakPolarHBondContact OG1-CG 3.46Å; T1135-E1138 PolarHBondContact OG1-N 3.41Å; T1135-E1138 VanDerWaalsContact OG1-N 3.14Å; E1138-V1140 VanDerWaalsContact C-N 3.3Å; E1138-V1140 PolarHBondContact O-N 3Å; E1138-T1141 PolarHBondContact O-N 2.77Å; E1138-W1142 WeakPolarHBondContact O-CB 3.48Å; E1138-W1142 VanDerWaalsContact O-CD1 3.25Å; E1138-W1142 PolarHBondContact O-N 2.77Å
1139	S	80.1	Confident	73.7	Confident	16 Å²	16	68.6 Å²	68.6	11%	0.112	36%	0.359	C	S	.	.	H	α-helix	trans	-61.6	-39.8	179.2	79.1	0	0	0	0	111.5	T1135 P1136 E1137 S1143 L1154	T1135-S1139 WeakPolarHBondContact O-CB 3.39Å; T1135-S1139 PolarHBondContact O-N 3.05Å; P1136-S1139 PolarHBondContact O-N 3.4Å; P1136-S1139 PolarHBondContact O-OG 3.02Å; E1137-S1139 VanDerWaalsContact C-N 3.31Å; E1137-S1139 PolarHBondContact O-N 3.2Å; S1139-S1143 WeakPolarHBondContact O-CB 3.41Å; S1139-S1143 PolarHBondContact O-N 3.46Å; S1139-S1143 PolarHBondContact O-OG 3.13Å; S1139-L1154 WeakPolarHBondContact CB-O 3.42Å
1140	V	79.8	Confident	75.1	Confident	75 Å²	75	71.5 Å²	71.5	46%	0.455	38%	0.383	S	S	.	.	H	α-helix	trans	-69.9	-48.5	175.2	174.2	0	0	0	0	110.1	P1136 E1137 E1138 W1142 S1143 Q1144	P1136-V1140 PolarHBondContact O-N 2.64Å; E1137-V1140 PolarHBondContact O-N 3.39Å; E1138-V1140 VanDerWaalsContact C-N 3.3Å; E1138-V1140 PolarHBondContact O-N 3Å; V1140-W1142 PolarHBondContact O-N 3.35Å; V1140-S1143 PolarHBondContact O-N 3.07Å; V1140-Q1144 WeakPolarHBondContact O-CB 3.44Å; V1140-Q1144 PolarHBondContact O-N 3.48Å
1141	T	81.2	Confident	76.6	Confident	66 Å²	66	72.2 Å²	72.2	41%	0.405	39%	0.388	S	S	.	.	H	α-helix	trans	-58.5	-46.5	-179.4	-55	0	0	0	0	112.1	E1137 E1138 K1145	E1137-T1141 WeakPolarHBondContact O-CB 3.36Å; E1137-T1141 PolarHBondContact O-N 3.43Å; E1137-T1141 PolarHBondContact O-OG1 2.9Å; E1138-T1141 PolarHBondContact O-N 2.77Å; T1141-K1145 WeakPolarHBondContact O-CB 3.47Å; T1141-K1145 WeakPolarHBondContact O-CG 3.25Å; T1141-K1145 PolarHBondContact O-N 2.91Å
1142	W	81.1	Confident	78	Confident	44 Å²	44	66.8 Å²	66.8	17%	0.167	37%	0.368	C	S	.	.	H	α-helix	trans	-71.4	-37.8	175.9	-78.5	108	0	0	0	112.2	L1125 A1129 L1134 E1138 V1140 Q1144 K1145 L1146 L1154 I1157	L1125-W1142 HydrophobicContact CD2-CH2 4.29Å; L1125-W1142 HydrophobicContact CD2-CZ3 3.72Å; A1129-W1142 HydrophobicContact CB-CH2 4.18Å; A1129-W1142 HydrophobicContact CB-CZ2 4.38Å; L1134-W1142 HydrophobicContact CD1-CB 4.2Å; L1134-W1142 HydrophobicContact CD1-CG 4.3Å; E1138-W1142 WeakPolarHBondContact O-CB 3.48Å; E1138-W1142 VanDerWaalsContact O-CD1 3.25Å; E1138-W1142 PolarHBondContact O-N 2.77Å; V1140-W1142 PolarHBondContact O-N 3.35Å; W1142-Q1144 VanDerWaalsContact C-N 3.29Å; W1142-Q1144 PolarHBondContact O-N 3.23Å; W1142-K1145 PolarHBondContact O-N 3.26Å; W1142-L1146 HydrophobicContact CE3-CD1 4.4Å; W1142-L1146 HydrophobicContact CE3-CG 4.43Å; W1142-L1146 WeakPolarHBondContact O-CB 3.49Å; W1142-L1146 WeakPolarHBondContact O-CG 3.28Å; W1142-L1146 PolarHBondContact O-N 3.27Å; W1142-L1154 HydrophobicContact CB-CD2 3.67Å; W1142-I1157 HydrophobicContact CD2-CD1 4.08Å; W1142-I1157 HydrophobicContact CE3-CD1 4.05Å; W1142-I1157 HydrophobicContact CG-CD1 4.33Å
1143	S	83	Confident	78.8	Confident	12 Å²	12	62.2 Å²	62.2	8%	0.084	36%	0.358	C	S	.	.	H	α-helix	trans	-61.7	-39.3	175.4	-62.5	0	0	0	0	111.9	S1139 V1140 L1146 G1147 L1148 L1154	S1139-S1143 WeakPolarHBondContact O-CB 3.41Å; S1139-S1143 PolarHBondContact O-N 3.46Å; S1139-S1143 PolarHBondContact O-OG 3.13Å; V1140-S1143 PolarHBondContact O-N 3.07Å; S1143-L1146 PolarHBondContact O-N 3.36Å; S1143-G1147 PolarHBondContact O-N 3.4Å; S1143-G1147 VanDerWaalsContact O-N 3.07Å; S1143-L1148 PolarHBondContact O-N 3.39Å; S1143-L1154 WeakPolarHBondContact OG-CB 3.45Å
1144	Q	80.2	Confident	79.7	Confident	159 Å²	159	58 Å²	58	74%	0.743	34%	0.336	S	S	*	.	H	α-helix	trans	-67.8	-47.9	175.5	-170	176.6	8.4	0	0	111.6	V1140 W1142 L1146 G1147	V1140-Q1144 WeakPolarHBondContact O-CB 3.44Å; V1140-Q1144 PolarHBondContact O-N 3.48Å; W1142-Q1144 VanDerWaalsContact C-N 3.29Å; W1142-Q1144 PolarHBondContact O-N 3.23Å; Q1144-L1146 PolarHBondContact O-N 3.14Å; Q1144-G1147 PolarHBondContact O-N 2.98Å
1145	K	79.5	Confident	80.1	Confident	154 Å²	154	58.5 Å²	58.5	67%	0.67	34%	0.338	S	S	*	.	H	α-helix	trans	-60.4	-29.9	175.4	-75.6	-177.7	177.6	-173.3	0	113.5	T1141 W1142	T1141-K1145 WeakPolarHBondContact O-CB 3.47Å; T1141-K1145 WeakPolarHBondContact O-CG 3.25Å; T1141-K1145 PolarHBondContact O-N 2.91Å; W1142-K1145 PolarHBondContact O-N 3.26Å
1146	L	78.8	Confident	80.6	Confident	30 Å²	30	58.3 Å²	58.3	16%	0.157	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	0.2	-178.1	-63.7	174.1	0	0	0	113.9	W1142 S1143 Q1144 L1148 L1154 I1157 Y1198	W1142-L1146 HydrophobicContact CE3-CD1 4.4Å; W1142-L1146 HydrophobicContact CE3-CG 4.43Å; W1142-L1146 WeakPolarHBondContact O-CB 3.49Å; W1142-L1146 WeakPolarHBondContact O-CG 3.28Å; W1142-L1146 PolarHBondContact O-N 3.27Å; S1143-L1146 PolarHBondContact O-N 3.36Å; Q1144-L1146 PolarHBondContact O-N 3.14Å; L1146-L1148 VanDerWaalsContact C-N 3.33Å; L1146-L1148 HydrophobicContact CB-CG 4.11Å; L1146-L1148 PolarHBondContact O-N 3.25Å; L1146-L1154 HydrophobicContact CD1-CD2 4.15Å; L1146-I1157 HydrophobicContact CD1-CD1 3.96Å; L1146-Y1198 HydrophobicContact CD1-CD1 4.3Å; L1146-Y1198 HydrophobicContact CD1-CE1 3.76Å; L1146-Y1198 HydrophobicContact CD1-CE2 4.32Å; L1146-Y1198 WeakPolarHBondContact CD2-OH 3.41Å
1147	G	80.3	Confident	81.1	Confident	58 Å²	58	54.3 Å²	54.3	60%	0.598	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	33	179.9	0	0	0	0	0	114.4	S1143 Q1144	S1143-G1147 PolarHBondContact O-N 3.4Å; S1143-G1147 VanDerWaalsContact O-N 3.07Å; Q1144-G1147 PolarHBondContact O-N 2.98Å
1148	L	82.2	Confident	81.7	Confident	17 Å²	17	48.2 Å²	48.2	9%	0.089	28%	0.278	C	S	.	.			trans	-77.9	145.9	179.5	-61.2	-179	0	0	0	111.7	S1143 L1146 W1152 L1154 Y1198 T1200 L1219	S1143-L1148 PolarHBondContact O-N 3.39Å; L1146-L1148 VanDerWaalsContact C-N 3.33Å; L1146-L1148 HydrophobicContact CB-CG 4.11Å; L1146-L1148 PolarHBondContact O-N 3.25Å; L1148-W1152 HydrophobicContact CD2-CE3 4.41Å; L1148-W1152 HydrophobicContact CD2-CZ3 4.43Å; L1148-L1154 HydrophobicContact CD1-CB 4.31Å; L1148-L1154 HydrophobicContact CD1-CD1 4.06Å; L1148-L1154 HydrophobicContact CD1-CD2 4.17Å; L1148-L1154 HydrophobicContact CD1-CG 4.41Å; L1148-Y1198 HydrophobicContact CD2-CD2 4.12Å; L1148-Y1198 HydrophobicContact CD2-CE2 4.37Å; L1148-T1200 HydrophobicContact CD1-CG2 4.34Å; L1148-L1219 HydrophobicContact CD2-CD2 3.75Å
1149	P	80.7	Confident	81.9	Confident	51 Å²	51	51.1 Å²	51.1	33%	0.331	29%	0.287	S	S	.	.			trans	-54	138.2	175	-27	34.4	0	0	0	113.4	S1151 W1152	P1149-S1151 PolarHBondContact O-N 3.45Å; P1149-S1151 VanDerWaalsContact O-N 3.16Å; P1149-W1152 HydrophobicContact CB-CD2 4.31Å; P1149-W1152 HydrophobicContact CB-CG 4.35Å; P1149-W1152 HydrophobicContact CG-CD2 4.09Å; P1149-W1152 HydrophobicContact CG-CE3 4.14Å; P1149-W1152 HydrophobicContact CG-CH2 4.35Å; P1149-W1152 HydrophobicContact CG-CZ2 4.31Å; P1149-W1152 HydrophobicContact CG-CZ3 4.26Å; P1149-W1152 WeakPolarHBondContact O-CB 3.4Å; P1149-W1152 PolarHBondContact O-N 2.79Å
1150	A	76.7	Confident	82.4	Confident	86 Å²	86	50.4 Å²	50.4	71%	0.711	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-24	-178.2	0	0	0	0	0	114.2	W1152 R1203	A1150-W1152 PolarHBondContact O-N 3.29Å; A1150-R1203 WeakPolarHBondContact O-CD 3.11Å; A1150-R1203 PolarHBondContact O-NE 2.97Å
1151	S	78.1	Confident	82.8	Confident	38 Å²	38	50.1 Å²	50.1	27%	0.266	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-6.9	173.3	57	0	0	0	0	113.7	P1149 R1203	P1149-S1151 PolarHBondContact O-N 3.45Å; P1149-S1151 VanDerWaalsContact O-N 3.16Å; S1151-R1203 WeakPolarHBondContact O-CG 3.46Å; S1151-R1203 PolarHBondContact O-N 2.78Å
1152	W	83.5	Confident	83.3	Confident	34 Å²	34	48.6 Å²	48.6	13%	0.129	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	144.5	174.4	-63.4	-1.8	0	0	0	111.4	L1148 P1149 A1150 T1200 R1201 V1214 T1221	L1148-W1152 HydrophobicContact CD2-CE3 4.41Å; L1148-W1152 HydrophobicContact CD2-CZ3 4.43Å; P1149-W1152 HydrophobicContact CB-CD2 4.31Å; P1149-W1152 HydrophobicContact CB-CG 4.35Å; P1149-W1152 HydrophobicContact CG-CD2 4.09Å; P1149-W1152 HydrophobicContact CG-CE3 4.14Å; P1149-W1152 HydrophobicContact CG-CH2 4.35Å; P1149-W1152 HydrophobicContact CG-CZ2 4.31Å; P1149-W1152 HydrophobicContact CG-CZ3 4.26Å; P1149-W1152 WeakPolarHBondContact O-CB 3.4Å; P1149-W1152 PolarHBondContact O-N 2.79Å; A1150-W1152 PolarHBondContact O-N 3.29Å; W1152-T1200 HydrophobicContact CE3-CG2 4.33Å; W1152-R1201 CarbonylContact C-O 3.52Å; W1152-R1201 WeakPolarHBondContact CA-O 3.49Å; W1152-V1214 HydrophobicContact CE3-CG2 4.38Å; W1152-V1214 HydrophobicContact CH2-CG2 4.45Å; W1152-V1214 HydrophobicContact CZ3-CG1 4.02Å; W1152-V1214 HydrophobicContact CZ3-CG2 3.96Å; W1152-T1221 HydrophobicContact CH2-CG2 3.58Å; W1152-T1221 HydrophobicContact CZ2-CG2 3.85Å
1153	A	82.6	Confident	83.7	Confident	33 Å²	33	46.8 Å²	46.8	27%	0.273	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	123.6	168.7	0	0	0	0	0	109.1	T1200 R1201	A1153-T1200 CarbonylContact O-C 3.58Å; A1153-T1200 WeakPolarHBondContact O-CA 3.28Å; A1153-R1201 PolarHBondContact N-O 3.16Å; A1153-R1201 PolarHBondContact O-N 3.06Å
1154	L	86.4	Confident	84	Confident	4 Å²	4	49.3 Å²	49.3	2%	0.021	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	111.9	-176.3	-179.8	64.9	0	0	0	111.4	L1134 S1139 W1142 S1143 L1146 L1148 I1157 Y1198 T1200	L1134-L1154 HydrophobicContact CD1-CD2 3.68Å; L1134-L1154 HydrophobicContact CD1-CG 3.78Å; S1139-L1154 WeakPolarHBondContact CB-O 3.42Å; W1142-L1154 HydrophobicContact CB-CD2 3.67Å; S1143-L1154 WeakPolarHBondContact OG-CB 3.45Å; L1146-L1154 HydrophobicContact CD1-CD2 4.15Å; L1148-L1154 HydrophobicContact CD1-CB 4.31Å; L1148-L1154 HydrophobicContact CD1-CD1 4.06Å; L1148-L1154 HydrophobicContact CD1-CD2 4.17Å; L1148-L1154 HydrophobicContact CD1-CG 4.41Å; L1154-I1157 HydrophobicContact CD2-CD1 4.36Å; L1154-I1157 HydrophobicContact CD2-CG1 4.25Å; L1154-Y1198 HydrophobicContact CD1-CG 4.35Å; L1154-T1200 HydrophobicContact CD1-CG2 3.89Å
1155	E	84	Confident	84.3	Confident	24 Å²	24	44.6 Å²	44.6	11%	0.112	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	-44	179.6	-159.4	-165.5	117.6	0	0	112.2	I1133 L1134 I1199 R1201 R1211	I1133-E1155 HydrophobicContact CG2-CG 4.41Å; L1134-E1155 PolarHBondContact N-O 3.12Å; L1134-E1155 VanDerWaalsContact N-O 3.09Å; E1155-I1199 WeakPolarHBondContact CA-O 3.25Å; E1155-I1199 HydrophobicContact CB-CG2 4.35Å; E1155-I1199 WeakPolarHBondContact CB-O 3.31Å; E1155-I1199 PolarHBondContact N-O 3.43Å; E1155-R1201 IonicContact OE2-CZ 3.55Å; E1155-R1201 IonicContact OE2-NE 3.86Å; E1155-R1201 PolarHBondContact OE2-NE 2.8Å; E1155-R1201 VanDerWaalsContact OE2-NE 3.08Å; E1155-R1201 IonicContact OE2-NH2 3.78Å; E1155-R1201 PolarHBondContact OE2-NH2 2.57Å; E1155-R1211 VanDerWaalsContact CD-NH2 3.34Å; E1155-R1211 IonicContact OE1-CZ 2.97Å; E1155-R1211 IonicContact OE1-NE 2.69Å; E1155-R1211 PolarHBondContact OE1-NE 3.21Å; E1155-R1211 IonicContact OE1-NH2 2.72Å; E1155-R1211 PolarHBondContact OE1-NH2 3.25Å; E1155-R1211 IonicContact OE2-CZ 3.2Å; E1155-R1211 IonicContact OE2-NE 2.95Å; E1155-R1211 PolarHBondContact OE2-NE 2.96Å; E1155-R1211 IonicContact OE2-NH2 3.2Å; E1155-R1211 PolarHBondContact OE2-NH2 3.5Å; E1155-R1211 VanDerWaalsContact OE2-NH2 3.12Å
1156	R	85.2	Confident	84.7	Confident	42 Å²	42	37.3 Å²	37.3	16%	0.158	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	156.7	-173.2	-50.7	-177.6	-155.8	-139.7	-7.2	112.8	I1133 I1199	I1133-R1156 VanDerWaalsContact CG1-CZ 3.48Å; R1156-I1199 HydrophobicContact CB-CB 4.28Å; R1156-I1199 HydrophobicContact CB-CD1 4.35Å; R1156-I1199 HydrophobicContact CB-CG1 4.49Å; R1156-I1199 PolarHBondContact N-O 2.52Å; R1156-I1199 PolarHBondContact O-N 3.09Å
1157	I	86.2	Confident	85.3	Confident	16 Å²	16	35.9 Å²	35.9	8%	0.082	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	122.4	167.1	-56.4	174.2	0	0	0	108.6	W1142 L1146 L1154 Y1198	W1142-I1157 HydrophobicContact CD2-CD1 4.08Å; W1142-I1157 HydrophobicContact CE3-CD1 4.05Å; W1142-I1157 HydrophobicContact CG-CD1 4.33Å; L1146-I1157 HydrophobicContact CD1-CD1 3.96Å; L1154-I1157 HydrophobicContact CD2-CD1 4.36Å; L1154-I1157 HydrophobicContact CD2-CG1 4.25Å; I1157-Y1198 HydrophobicContact CB-CD1 4.39Å; I1157-Y1198 HydrophobicContact CG1-CD1 3.99Å; I1157-Y1198 HydrophobicContact CG1-CE1 4.33Å; I1157-Y1198 HydrophobicContact CG2-CD1 4.01Å; I1157-Y1198 HydrophobicContact CG2-CE1 4Å
1158	V	85.9	Confident	85.6	Confident	10 Å²	10	34.8 Å²	34.8	6%	0.061	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	116.5	-175.9	-177.5	0	0	0	0	111.4	S1196 V1197 I1199 F1226 L1254 Y1259	V1158-S1196 CarbonylContact O-C 3.58Å; V1158-S1196 WeakPolarHBondContact O-CA 3.19Å; V1158-S1196 WeakPolarHBondContact O-CB 3.45Å; V1158-V1197 PolarHBondContact N-O 2.9Å; V1158-V1197 PolarHBondContact O-N 3.43Å; V1158-I1199 HydrophobicContact CG2-CD1 3.88Å; V1158-I1199 HydrophobicContact CG2-CG1 4.34Å; V1158-F1226 HydrophobicContact CB-CE2 3.93Å; V1158-F1226 HydrophobicContact CB-CZ 4.23Å; V1158-F1226 HydrophobicContact CG1-CE2 3.83Å; V1158-F1226 HydrophobicContact CG1-CZ 3.63Å; V1158-F1226 HydrophobicContact CG2-CE2 4.31Å; V1158-L1254 HydrophobicContact CG1-CD1 3.96Å; V1158-Y1259 HydrophobicContact CG1-CD1 3.76Å; V1158-Y1259 HydrophobicContact CG1-CG 4.03Å; V1158-Y1259 HydrophobicContact CG2-CD1 4Å; V1158-Y1259 HydrophobicContact CG2-CE1 4.36Å; V1158-Y1259 HydrophobicContact CG2-CG 4.11Å
1159	R	85.4	Confident	85.8	Confident	105 Å²	105	38.9 Å²	38.9	40%	0.396	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	143.9	176.6	-64.3	178.1	69.7	158.7	0.9	111.7	L1161	R1159-L1161 PolarHBondContact O-N 3.36Å
1160	L	89.2	Confident	85.9	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.211	C	C	.	.			trans	-99.6	73.3	-171.5	-64.1	-176.7	0	0	0	114.2	Y1192 A1193 H1195 V1197 F1226 R1230 I1233 L1254	L1160-Y1192 HydrophobicContact CB-CD1 4.29Å; L1160-Y1192 HydrophobicContact CB-CE1 3.79Å; L1160-Y1192 HydrophobicContact CB-CE2 4.28Å; L1160-Y1192 HydrophobicContact CD1-CD2 4.3Å; L1160-Y1192 HydrophobicContact CD1-CE2 3.75Å; L1160-Y1192 WeakPolarHBondContact O-CE1 3.48Å; L1160-A1193 WeakPolarHBondContact O-CA 3.42Å; L1160-H1195 WeakPolarHBondContact CB-O 3.31Å; L1160-H1195 HydrophobicContact CD1-CB 4.32Å; L1160-H1195 PolarHBondContact N-O 2.92Å; L1160-V1197 HydrophobicContact CD1-CG2 4.07Å; L1160-V1197 HydrophobicContact CD2-CG2 4.04Å; L1160-V1197 HydrophobicContact CG-CG2 4.34Å; L1160-F1226 HydrophobicContact CD2-CE1 4.32Å; L1160-F1226 HydrophobicContact CD2-CZ 3.81Å; L1160-R1230 HydrophobicContact CD1-CG 4.27Å; L1160-R1230 HydrophobicContact CD2-CG 3.78Å; L1160-I1233 HydrophobicContact CD1-CB 4.46Å; L1160-I1233 HydrophobicContact CD1-CD1 3.5Å; L1160-I1233 HydrophobicContact CD1-CG2 4.24Å; L1160-L1254 HydrophobicContact CD2-CD1 4.41Å
1161	L	87.8	Confident	86.4	Confident	70 Å²	70	33.4 Å²	33.4	37%	0.366	18%	0.178	S	C	.	.			trans	-67.7	155.8	177.4	-58.4	178.2	0	0	0	113.2	R1159 S1252 L1261	R1159-L1161 PolarHBondContact O-N 3.36Å; L1161-S1252 WeakPolarHBondContact O-CB 3.46Å; L1161-L1261 HydrophobicContact CB-CB 4.25Å; L1161-L1261 HydrophobicContact CB-CD2 4.49Å
1162	Y	91.8	Very high	86.7	Confident	34 Å²	34	37.9 Å²	37.9	13%	0.133	19%	0.188	C	C	.	.			trans	-143	157.2	170.5	80.5	-80	0	0	0	111	P1164 M1189 A1193 S1251	Y1162-P1164 HydrophobicContact CE2-CB 4.29Å; Y1162-P1164 HydrophobicContact CE2-CG 4.01Å; Y1162-M1189 HydrophobicContact CD1-CB 4.19Å; Y1162-M1189 HydrophobicContact CD1-CE 4.06Å; Y1162-M1189 HydrophobicContact CD2-CB 4.14Å; Y1162-M1189 HydrophobicContact CD2-CE 3.77Å; Y1162-M1189 HydrophobicContact CD2-CG 4.49Å; Y1162-M1189 HydrophobicContact CE1-CB 3.74Å; Y1162-M1189 WeakPolarHBondContact CE1-O 3.49Å; Y1162-M1189 HydrophobicContact CE2-CB 3.68Å; Y1162-M1189 HydrophobicContact CE2-CE 4.45Å; Y1162-M1189 HydrophobicContact CE2-CG 4.3Å; Y1162-M1189 HydrophobicContact CG-CB 4.38Å; Y1162-M1189 HydrophobicContact CG-CE 3.54Å; Y1162-M1189 VanDerWaalsContact CZ-CB 3.46Å; Y1162-A1193 HydrophobicContact CD1-CB 4.05Å; Y1162-A1193 HydrophobicContact CE1-CB 4.07Å; Y1162-S1251 CarbonylContact C-O 3.6Å; Y1162-S1251 WeakPolarHBondContact CA-O 3.41Å
1163	S	91	Very high	86.5	Confident	5 Å²	5	40.8 Å²	40.8	4%	0.035	21%	0.214	C	C	.	.			trans	-93.6	121.2	170.3	170.4	0	0	0	0	111	V1166 F1167 S1251 D1264	S1163-V1166 VanDerWaalsContact OG-CG2 3.32Å; S1163-V1166 WeakPolarHBondContact OG-CG2 3.48Å; S1163-V1166 PolarHBondContact OG-N 2.71Å; S1163-F1167 WeakPolarHBondContact O-CB 3.38Å; S1163-F1167 PolarHBondContact O-N 2.81Å; S1163-S1251 PolarHBondContact N-O 3.44Å; S1163-D1264 WeakPolarHBondContact CB-OD1 3.45Å; S1163-D1264 VanDerWaalsContact OG-CG 3.25Å; S1163-D1264 PolarHBondContact OG-OD1 3.01Å; S1163-D1264 PolarHBondContact OG-OD2 2.61Å
1164	P	89.3	Confident	86.2	Confident	65 Å²	65	43.3 Å²	43.3	42%	0.422	23%	0.226	S	C	.	.	H	α-helix	trans	-62.5	-48.4	174.2	-24	35.2	0	0	0	112.9	Y1162 V1166 F1167 D1168	Y1162-P1164 HydrophobicContact CE2-CB 4.29Å; Y1162-P1164 HydrophobicContact CE2-CG 4.01Å; P1164-V1166 VanDerWaalsContact C-N 3.34Å; P1164-V1166 PolarHBondContact O-N 3.04Å; P1164-F1167 WeakPolarHBondContact O-CB 3.34Å; P1164-F1167 PolarHBondContact O-N 2.99Å; P1164-F1167 VanDerWaalsContact O-N 3.07Å; P1164-D1168 PolarHBondContact O-N 3.42Å
1165	A	86.5	Confident	85.9	Confident	60 Å²	60	45.9 Å²	45.9	50%	0.496	24%	0.239	S	C	.	.	H	α-helix	trans	-62.1	-40.6	-175	0	0	0	0	0	112.6	H1169	A1165-H1169 PolarHBondContact O-N 2.89Å
1166	V	87.6	Confident	85.2	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-69.3	-36.3	176.1	178	0	0	0	0	111.5	S1163 P1164 Q1170 D1264 L1267 L1268	S1163-V1166 VanDerWaalsContact OG-CG2 3.32Å; S1163-V1166 WeakPolarHBondContact OG-CG2 3.48Å; S1163-V1166 PolarHBondContact OG-N 2.71Å; P1164-V1166 VanDerWaalsContact C-N 3.34Å; P1164-V1166 PolarHBondContact O-N 3.04Å; V1166-Q1170 WeakPolarHBondContact O-CG 3.47Å; V1166-Q1170 PolarHBondContact O-N 3.33Å; V1166-Q1170 VanDerWaalsContact O-N 3.16Å; V1166-D1264 HydrophobicContact CG2-CB 3.84Å; V1166-L1267 HydrophobicContact CB-CB 4.45Å; V1166-L1267 HydrophobicContact CB-CD1 4.5Å; V1166-L1267 HydrophobicContact CG1-CB 3.88Å; V1166-L1267 HydrophobicContact CG2-CB 3.93Å; V1166-L1267 HydrophobicContact CG2-CD1 4.07Å; V1166-L1268 HydrophobicContact CG2-CG 4.2Å
1167	F	90.4	Very high	84.3	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-65.3	-46.3	176.1	-174.4	-115.8	0	0	0	111.1	S1163 P1164 H1169 Q1170 V1171 L1185 H1186 M1189 A1247 A1248 S1251	S1163-F1167 WeakPolarHBondContact O-CB 3.38Å; S1163-F1167 PolarHBondContact O-N 2.81Å; P1164-F1167 WeakPolarHBondContact O-CB 3.34Å; P1164-F1167 PolarHBondContact O-N 2.99Å; P1164-F1167 VanDerWaalsContact O-N 3.07Å; F1167-H1169 PolarHBondContact O-N 3.1Å; F1167-Q1170 PolarHBondContact O-N 3.43Å; F1167-V1171 HydrophobicContact CD1-CG2 4.25Å; F1167-V1171 HydrophobicContact CD2-CG2 4.09Å; F1167-V1171 HydrophobicContact CE1-CG2 3.99Å; F1167-V1171 HydrophobicContact CE2-CG2 3.81Å; F1167-V1171 HydrophobicContact CG-CG2 4.31Å; F1167-V1171 HydrophobicContact CZ-CG2 3.77Å; F1167-V1171 WeakPolarHBondContact O-CB 3.26Å; F1167-V1171 VanDerWaalsContact O-CG2 3.32Å; F1167-V1171 WeakPolarHBondContact O-CG2 3.44Å; F1167-V1171 PolarHBondContact O-N 3.46Å; F1167-L1185 HydrophobicContact CE1-CB 3.76Å; F1167-L1185 HydrophobicContact CZ-CB 3.92Å; F1167-L1185 HydrophobicContact CZ-CD1 4.27Å; F1167-H1186 AromaticContact CD1-CE1 3.96Å; F1167-M1189 HydrophobicContact CD1-CG 4.19Å; F1167-M1189 HydrophobicContact CE1-CG 3.73Å; F1167-M1189 HydrophobicContact CE2-CG 4.15Å; F1167-M1189 HydrophobicContact CE2-SD 4.28Å; F1167-M1189 HydrophobicContact CZ-CG 3.7Å; F1167-M1189 HydrophobicContact CZ-SD 4.31Å; F1167-A1247 HydrophobicContact CD2-CB 4.5Å; F1167-A1247 HydrophobicContact CE2-CB 4.4Å; F1167-A1248 HydrophobicContact CE2-CB 4.05Å; F1167-S1251 WeakPolarHBondContact CD2-OG 3.41Å
1168	D	87.5	Confident	83.6	Confident	36 Å²	36	54.6 Å²	54.6	19%	0.193	30%	0.298	C	S	.	.	H	α-helix	trans	-60.2	-44.5	176.1	-75.8	-43.8	0	0	0	112.4	P1164 Q1170 V1171 R1172 I1182 H1186	P1164-D1168 PolarHBondContact O-N 3.42Å; D1168-Q1170 VanDerWaalsContact C-N 3.31Å; D1168-Q1170 PolarHBondContact O-N 2.91Å; D1168-V1171 PolarHBondContact O-N 3.4Å; D1168-R1172 VanDerWaalsContact O-CB 3.24Å; D1168-R1172 WeakPolarHBondContact O-CB 3.43Å; D1168-R1172 WeakPolarHBondContact O-CG 3.33Å; D1168-R1172 PolarHBondContact O-N 3.1Å; D1168-I1182 WeakPolarHBondContact OD1-CG2 3.49Å; D1168-H1186 IonicContact OD1-CD2 3.05Å; D1168-H1186 IonicContact OD1-CE1 3.53Å; D1168-H1186 IonicContact OD1-NE2 3.08Å; D1168-H1186 PolarHBondContact OD1-NE2 3.32Å; D1168-H1186 IonicContact OD2-CE1 2.68Å; D1168-H1186 PolarHBondContact OD2-CE1 3.07Å; D1168-H1186 IonicContact OD2-NE2 2.77Å; D1168-H1186 PolarHBondContact OD2-NE2 3.02Å
1169	H	85.2	Confident	83.1	Confident	102 Å²	102	58.5 Å²	58.5	47%	0.472	32%	0.319	S	S	.	.	H	α-helix	trans	-57.2	-45	176.2	-173.2	83.7	0	0	0	111.7	A1165 F1167 S1173 L1268	A1165-H1169 PolarHBondContact O-N 2.89Å; F1167-H1169 PolarHBondContact O-N 3.1Å; H1169-S1173 PolarHBondContact O-N 2.88Å; H1169-L1268 HydrophobicContact CB-CD2 4.15Å; H1169-L1268 VanDerWaalsContact CD2-CD2 3.45Å; H1169-L1268 WeakPolarHBondContact CD2-CD2 3.46Å
1170	Q	84.4	Confident	82.8	Confident	23 Å²	23	58.6 Å²	58.6	11%	0.107	34%	0.335	C	S	.	.	H	α-helix	trans	-73	-38.7	179.5	-69.4	178.9	45.7	0	0	112.9	V1166 F1167 D1168 S1173 A1247 C1250 A1271	V1166-Q1170 WeakPolarHBondContact O-CG 3.47Å; V1166-Q1170 PolarHBondContact O-N 3.33Å; V1166-Q1170 VanDerWaalsContact O-N 3.16Å; F1167-Q1170 PolarHBondContact O-N 3.43Å; D1168-Q1170 VanDerWaalsContact C-N 3.31Å; D1168-Q1170 PolarHBondContact O-N 2.91Å; Q1170-S1173 PolarHBondContact O-N 3.13Å; Q1170-S1173 PolarHBondContact O-OG 2.91Å; Q1170-A1247 HydrophobicContact CB-CB 3.96Å; Q1170-C1250 VanDerWaalsContact OE1-CB 3.24Å; Q1170-A1271 HydrophobicContact CG-CB 4.32Å
1171	V	86	Confident	82.6	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-69.5	-42.6	178.3	174.3	0	0	0	0	111	F1167 D1168 S1173 V1174 L1175 I1182 L1185 F1244	F1167-V1171 HydrophobicContact CD1-CG2 4.25Å; F1167-V1171 HydrophobicContact CD2-CG2 4.09Å; F1167-V1171 HydrophobicContact CE1-CG2 3.99Å; F1167-V1171 HydrophobicContact CE2-CG2 3.81Å; F1167-V1171 HydrophobicContact CG-CG2 4.31Å; F1167-V1171 HydrophobicContact CZ-CG2 3.77Å; F1167-V1171 WeakPolarHBondContact O-CB 3.26Å; F1167-V1171 VanDerWaalsContact O-CG2 3.32Å; F1167-V1171 WeakPolarHBondContact O-CG2 3.44Å; F1167-V1171 PolarHBondContact O-N 3.46Å; D1168-V1171 PolarHBondContact O-N 3.4Å; V1171-S1173 PolarHBondContact O-N 2.85Å; V1171-V1174 CarbonylContact O-C 3.54Å; V1171-V1174 WeakPolarHBondContact O-CA 3.24Å; V1171-V1174 PolarHBondContact O-N 3.46Å; V1171-L1175 PolarHBondContact O-N 3.24Å; V1171-I1182 HydrophobicContact CG1-CD1 4.44Å; V1171-I1182 HydrophobicContact CG1-CG1 3.86Å; V1171-L1185 HydrophobicContact CG1-CD1 3.79Å; V1171-L1185 HydrophobicContact CG2-CD1 4.05Å; V1171-F1244 HydrophobicContact CG1-CD1 4.46Å; V1171-F1244 HydrophobicContact CG1-CE1 4.22Å; V1171-F1244 HydrophobicContact CG2-CD1 4.2Å
1172	R	84.1	Confident	82.5	Confident	131 Å²	131	58 Å²	58	49%	0.494	33%	0.33	S	S	.	.	H	α-helix	trans	-63.2	-28.8	176.2	-73.4	176.6	165	167.4	-4	112.9	D1168 V1174 L1175 D1179 I1182	D1168-R1172 VanDerWaalsContact O-CB 3.24Å; D1168-R1172 WeakPolarHBondContact O-CB 3.43Å; D1168-R1172 WeakPolarHBondContact O-CG 3.33Å; D1168-R1172 PolarHBondContact O-N 3.1Å; R1172-V1174 PolarHBondContact O-N 3.25Å; R1172-L1175 WeakPolarHBondContact CA-O 3.47Å; R1172-L1175 CarbonylContact O-C 3.58Å; R1172-D1179 IonicContact CZ-OD1 3.14Å; R1172-D1179 IonicContact NE-OD1 2.77Å; R1172-D1179 IonicContact NH2-OD1 2.64Å; R1172-D1179 PolarHBondContact NH2-OD1 3.5Å; R1172-I1182 HydrophobicContact CG-CD1 3.78Å
1173	S	79.2	Confident	82.2	Confident	96 Å²	96	60 Å²	60	67%	0.671	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-17.9	171	82.9	0	0	0	0	114.3	H1169 Q1170 V1171	H1169-S1173 PolarHBondContact O-N 2.88Å; Q1170-S1173 PolarHBondContact O-N 3.13Å; Q1170-S1173 PolarHBondContact O-OG 2.91Å; V1171-S1173 PolarHBondContact O-N 2.85Å
1174	V	76.9	Confident	82	Confident	86 Å²	86	62.1 Å²	62.1	52%	0.521	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-30.1	179.9	-178.8	0	0	0	0	112.1	V1171 R1172 F1244	V1171-V1174 CarbonylContact O-C 3.54Å; V1171-V1174 WeakPolarHBondContact O-CA 3.24Å; V1171-V1174 PolarHBondContact O-N 3.46Å; R1172-V1174 PolarHBondContact O-N 3.25Å; V1174-F1244 HydrophobicContact CB-CE1 4.49Å; V1174-F1244 HydrophobicContact CG1-CE1 4.21Å
1175	L	80	Confident	82.1	Confident	57 Å²	57	59 Å²	59	30%	0.298	34%	0.344	S	S	.	.			trans	-135.5	98.2	177.6	-71	-179.4	0	0	0	110.3	V1171 R1172 F1181 F1244	V1171-L1175 PolarHBondContact O-N 3.24Å; R1172-L1175 WeakPolarHBondContact CA-O 3.47Å; R1172-L1175 CarbonylContact O-C 3.58Å; L1175-F1181 HydrophobicContact CD1-CD1 3.63Å; L1175-F1181 HydrophobicContact CD1-CE1 3.92Å; L1175-F1244 HydrophobicContact CD1-CE1 4.25Å; L1175-F1244 HydrophobicContact CD1-CZ 3.68Å; L1175-F1244 HydrophobicContact CG-CZ 4.33Å
1176	P	70	Confident	82.3	Confident	93 Å²	93	57.7 Å²	57.7	60%	0.604	33%	0.327	S	S	*	.	S	Bend	trans	-67.2	-41.7	175.4	-21.4	34.1	0	0	0	112.9
1177	D	65.5	Low	82.4	Confident	160 Å²	160	62 Å²	62	86%	0.856	35%	0.347	S	S	*	.	S	Bend	trans	-109.8	64.5	-164.2	-41.6	-68.1	0	0	0	111.6
1178	G	71	Confident	82.5	Confident	13 Å²	13	64.7 Å²	64.7	13%	0.134	36%	0.357	C	S	.	.			trans	-154.7	26.1	-161.6	0	0	0	0	0	119.3	S1180 F1181 I1182	G1178-S1180 PolarHBondContact O-N 3.11Å; G1178-F1181 WeakPolarHBondContact O-CA 3.33Å; G1178-F1181 WeakPolarHBondContact O-CB 3.31Å; G1178-F1181 PolarHBondContact O-N 3.46Å; G1178-I1182 WeakPolarHBondContact O-CG1 3.44Å; G1178-I1182 PolarHBondContact O-N 2.68Å
1179	D	76.8	Confident	82.7	Confident	92 Å²	92	63 Å²	63	49%	0.492	35%	0.348	S	S	.	.	H	α-helix	trans	-55.7	-39.4	-169.8	-65	-62.3	0	0	0	115.2	R1172 F1181 I1182 S1183	R1172-D1179 IonicContact CZ-OD1 3.14Å; R1172-D1179 IonicContact NE-OD1 2.77Å; R1172-D1179 IonicContact NH2-OD1 2.64Å; R1172-D1179 PolarHBondContact NH2-OD1 3.5Å; D1179-F1181 VanDerWaalsContact C-N 3.26Å; D1179-F1181 PolarHBondContact O-N 2.93Å; D1179-I1182 WeakPolarHBondContact O-CB 3.31Å; D1179-I1182 PolarHBondContact O-N 3.14Å; D1179-I1182 VanDerWaalsContact O-N 3.12Å; D1179-S1183 PolarHBondContact O-N 2.83Å; D1179-S1183 PolarHBondContact O-OG 3.11Å
1180	S	78.6	Confident	83	Confident	106 Å²	106	62.7 Å²	62.7	74%	0.741	35%	0.346	S	S	*	.	H	α-helix	trans	-62.2	-33.4	176	59.4	0	0	0	0	113.2	G1178 S1184	G1178-S1180 PolarHBondContact O-N 3.11Å; S1180-S1184 PolarHBondContact O-N 3.31Å
1181	F	84.3	Confident	83.2	Confident	54 Å²	54	63.9 Å²	63.9	24%	0.237	35%	0.354	C	S	.	.	H	α-helix	trans	-78.5	-32.3	175	-177	-92.6	0	0	0	111.8	L1175 G1178 D1179 S1184 L1185 P1241 F1244	L1175-F1181 HydrophobicContact CD1-CD1 3.63Å; L1175-F1181 HydrophobicContact CD1-CE1 3.92Å; G1178-F1181 WeakPolarHBondContact O-CA 3.33Å; G1178-F1181 WeakPolarHBondContact O-CB 3.31Å; G1178-F1181 PolarHBondContact O-N 3.46Å; D1179-F1181 VanDerWaalsContact C-N 3.26Å; D1179-F1181 PolarHBondContact O-N 2.93Å; F1181-S1184 PolarHBondContact O-N 2.84Å; F1181-L1185 HydrophobicContact CD1-CD1 4.15Å; F1181-L1185 HydrophobicContact CD1-CG 4.3Å; F1181-L1185 HydrophobicContact CE1-CD1 3.62Å; F1181-L1185 HydrophobicContact CE1-CD2 4.15Å; F1181-L1185 HydrophobicContact CE1-CG 3.75Å; F1181-L1185 HydrophobicContact CZ-CD1 4.42Å; F1181-L1185 HydrophobicContact CZ-CD2 4.13Å; F1181-L1185 HydrophobicContact CZ-CG 4.16Å; F1181-L1185 PolarHBondContact O-N 3.49Å; F1181-P1241 HydrophobicContact CZ-CG 4.48Å; F1181-F1244 HydrophobicContact CE1-CD2 4.25Å; F1181-F1244 AromaticContact CE1-CE2 3.33Å; F1181-F1244 HydrophobicContact CE1-CE2 3.33Å; F1181-F1244 AromaticContact CE1-CZ 3.62Å; F1181-F1244 HydrophobicContact CE1-CZ 3.62Å; F1181-F1244 HydrophobicContact CZ-CD2 4.45Å; F1181-F1244 AromaticContact CZ-CE2 3.65Å; F1181-F1244 HydrophobicContact CZ-CE2 3.65Å; F1181-F1244 HydrophobicContact CZ-CZ 4.35Å
1182	I	86.1	Confident	83.5	Confident	5 Å²	5	63.9 Å²	63.9	3%	0.026	35%	0.354	C	S	.	.	H	α-helix	trans	-62.3	-44	170.5	-65.5	171.5	0	0	0	110.3	D1168 V1171 R1172 G1178 D1179 S1184 L1185 H1186	D1168-I1182 WeakPolarHBondContact OD1-CG2 3.49Å; V1171-I1182 HydrophobicContact CG1-CD1 4.44Å; V1171-I1182 HydrophobicContact CG1-CG1 3.86Å; R1172-I1182 HydrophobicContact CG-CD1 3.78Å; G1178-I1182 WeakPolarHBondContact O-CG1 3.44Å; G1178-I1182 PolarHBondContact O-N 2.68Å; D1179-I1182 WeakPolarHBondContact O-CB 3.31Å; D1179-I1182 PolarHBondContact O-N 3.14Å; D1179-I1182 VanDerWaalsContact O-N 3.12Å; I1182-S1184 VanDerWaalsContact C-N 3.33Å; I1182-S1184 PolarHBondContact O-N 3.42Å; I1182-L1185 WeakPolarHBondContact O-CA 3.41Å; I1182-L1185 WeakPolarHBondContact O-CB 3.1Å; I1182-L1185 PolarHBondContact O-N 2.93Å; I1182-H1186 PolarHBondContact O-N 3.46Å
1183	S	86	Confident	83.8	Confident	76 Å²	76	59 Å²	59	53%	0.531	34%	0.342	S	S	.	.	H	α-helix	trans	-58	-42.5	173.3	-59.1	0	0	0	0	112.5	D1179 L1185 H1186 E1187	D1179-S1183 PolarHBondContact O-N 2.83Å; D1179-S1183 PolarHBondContact O-OG 3.11Å; S1183-L1185 VanDerWaalsContact C-N 3.29Å; S1183-L1185 PolarHBondContact O-N 2.84Å; S1183-H1186 PolarHBondContact O-N 3.02Å; S1183-E1187 PolarHBondContact O-N 3.35Å; S1183-E1187 VanDerWaalsContact O-N 3.09Å
1184	S	87.6	Confident	84.1	Confident	49 Å²	49	64.1 Å²	64.1	34%	0.343	35%	0.347	S	S	.	.	H	α-helix	trans	-64.9	-30.7	174.7	-170.7	0	0	0	0	113.1	S1180 F1181 I1182 R1188	S1180-S1184 PolarHBondContact O-N 3.31Å; F1181-S1184 PolarHBondContact O-N 2.84Å; I1182-S1184 VanDerWaalsContact C-N 3.33Å; I1182-S1184 PolarHBondContact O-N 3.42Å; S1184-R1188 WeakPolarHBondContact O-CG 3.47Å; S1184-R1188 PolarHBondContact O-N 3.2Å
1185	L	89.7	Confident	84.6	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-73.5	-37.9	172.8	-72.3	178.7	0	0	0	112.5	F1167 V1171 F1181 I1182 S1183 R1188 M1189 P1241 F1244	F1167-L1185 HydrophobicContact CE1-CB 3.76Å; F1167-L1185 HydrophobicContact CZ-CB 3.92Å; F1167-L1185 HydrophobicContact CZ-CD1 4.27Å; V1171-L1185 HydrophobicContact CG1-CD1 3.79Å; V1171-L1185 HydrophobicContact CG2-CD1 4.05Å; F1181-L1185 HydrophobicContact CD1-CD1 4.15Å; F1181-L1185 HydrophobicContact CD1-CG 4.3Å; F1181-L1185 HydrophobicContact CE1-CD1 3.62Å; F1181-L1185 HydrophobicContact CE1-CD2 4.15Å; F1181-L1185 HydrophobicContact CE1-CG 3.75Å; F1181-L1185 HydrophobicContact CZ-CD1 4.42Å; F1181-L1185 HydrophobicContact CZ-CD2 4.13Å; F1181-L1185 HydrophobicContact CZ-CG 4.16Å; F1181-L1185 PolarHBondContact O-N 3.49Å; I1182-L1185 WeakPolarHBondContact O-CA 3.41Å; I1182-L1185 WeakPolarHBondContact O-CB 3.1Å; I1182-L1185 PolarHBondContact O-N 2.93Å; S1183-L1185 VanDerWaalsContact C-N 3.29Å; S1183-L1185 PolarHBondContact O-N 2.84Å; L1185-R1188 WeakPolarHBondContact O-CB 3.31Å; L1185-R1188 PolarHBondContact O-N 3.45Å; L1185-M1189 WeakPolarHBondContact O-CG 3.34Å; L1185-M1189 PolarHBondContact O-N 3.36Å; L1185-P1241 HydrophobicContact CD2-CG 4.25Å; L1185-F1244 HydrophobicContact CD1-CD1 4.15Å; L1185-F1244 HydrophobicContact CD1-CD2 3.8Å; L1185-F1244 HydrophobicContact CD1-CE1 4.31Å; L1185-F1244 HydrophobicContact CD1-CE2 3.97Å; L1185-F1244 HydrophobicContact CD1-CG 3.9Å; L1185-F1244 HydrophobicContact CD1-CZ 4.22Å; L1185-F1244 HydrophobicContact CD2-CD2 3.78Å; L1185-F1244 HydrophobicContact CD2-CE2 4.32Å; L1185-F1244 HydrophobicContact CD2-CG 4.34Å; L1185-F1244 HydrophobicContact CG-CD2 4.43Å
1186	H	91.6	Very high	85	Confident	31 Å²	31	59.4 Å²	59.4	14%	0.144	32%	0.319	C	S	.	.	H	α-helix	trans	-62	-41.5	173.8	-86.4	-69.3	0	0	0	112	F1167 D1168 I1182 S1183 R1188 M1189 K1190	F1167-H1186 AromaticContact CD1-CE1 3.96Å; D1168-H1186 IonicContact OD1-CD2 3.05Å; D1168-H1186 IonicContact OD1-CE1 3.53Å; D1168-H1186 IonicContact OD1-NE2 3.08Å; D1168-H1186 PolarHBondContact OD1-NE2 3.32Å; D1168-H1186 IonicContact OD2-CE1 2.68Å; D1168-H1186 PolarHBondContact OD2-CE1 3.07Å; D1168-H1186 IonicContact OD2-NE2 2.77Å; D1168-H1186 PolarHBondContact OD2-NE2 3.02Å; I1182-H1186 PolarHBondContact O-N 3.46Å; S1183-H1186 PolarHBondContact O-N 3.02Å; H1186-R1188 VanDerWaalsContact C-N 3.3Å; H1186-R1188 PolarHBondContact O-N 3.17Å; H1186-M1189 CarbonylContact O-C 3.54Å; H1186-M1189 WeakPolarHBondContact O-CA 3.4Å; H1186-M1189 WeakPolarHBondContact O-CB 3.47Å; H1186-M1189 PolarHBondContact O-N 2.78Å; H1186-K1190 WeakPolarHBondContact O-CG 3.5Å; H1186-K1190 PolarHBondContact O-N 3.28Å
1187	E	90	Very high	85.9	Confident	92 Å²	92	55 Å²	55	43%	0.43	29%	0.291	S	S	.	.	H	α-helix	trans	-61.5	-40.3	177.3	-158	57.3	-133.3	0	0	111.7	S1183 M1189 K1190 V1191	S1183-E1187 PolarHBondContact O-N 3.35Å; S1183-E1187 VanDerWaalsContact O-N 3.09Å; E1187-M1189 VanDerWaalsContact C-N 3.33Å; E1187-M1189 PolarHBondContact O-N 2.64Å; E1187-K1190 WeakPolarHBondContact O-CB 3.38Å; E1187-K1190 PolarHBondContact O-N 3.05Å; E1187-K1190 WeakPolarHBondContact OE1-CD 3.49Å; E1187-K1190 IonicContact OE1-NZ 3.1Å; E1187-K1190 WeakPolarHBondContact OE2-CD 3.37Å; E1187-K1190 WeakPolarHBondContact OE2-CE 3.2Å; E1187-K1190 IonicContact OE2-NZ 3.57Å; E1187-K1190 PolarHBondContact OE2-NZ 3.16Å; E1187-V1191 PolarHBondContact O-N 3.44Å; E1187-V1191 VanDerWaalsContact O-N 3.09Å
1188	R	91.6	Very high	87.1	Confident	56 Å²	56	47.8 Å²	47.8	21%	0.211	25%	0.251	C	S	.	.	H	α-helix	trans	-62.1	-37.8	171.1	-67.7	178.6	-152.9	-137.7	-1.8	112.3	S1184 L1185 H1186 V1191 Y1192 A1238 H1239 V1240 T1442	S1184-R1188 WeakPolarHBondContact O-CG 3.47Å; S1184-R1188 PolarHBondContact O-N 3.2Å; L1185-R1188 WeakPolarHBondContact O-CB 3.31Å; L1185-R1188 PolarHBondContact O-N 3.45Å; H1186-R1188 VanDerWaalsContact C-N 3.3Å; H1186-R1188 PolarHBondContact O-N 3.17Å; R1188-V1191 PolarHBondContact O-N 3.07Å; R1188-Y1192 PolarHBondContact O-N 3.32Å; R1188-A1238 VanDerWaalsContact CB-O 3.23Å; R1188-A1238 WeakPolarHBondContact CB-O 3.34Å; R1188-A1238 VanDerWaalsContact CG-O 3.29Å; R1188-A1238 WeakPolarHBondContact CG-O 3.36Å; R1188-A1238 WeakPolarHBondContact O-CB 3.16Å; R1188-H1239 WeakPolarHBondContact CD-O 3.46Å; R1188-H1239 PolarHBondContact NH1-O 3.1Å; R1188-V1240 HydrophobicContact CB-CG2 3.97Å; R1188-T1442 PolarHBondContact NH1-O 2.89Å
1189	M	93.2	Very high	87.9	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-71.1	-30.5	174.9	-69.5	-59.5	-61.6	0	0	113.4	Y1162 F1167 L1185 H1186 E1187 Y1192 A1193 L1234 V1240 A1248	Y1162-M1189 HydrophobicContact CD1-CB 4.19Å; Y1162-M1189 HydrophobicContact CD1-CE 4.06Å; Y1162-M1189 HydrophobicContact CD2-CB 4.14Å; Y1162-M1189 HydrophobicContact CD2-CE 3.77Å; Y1162-M1189 HydrophobicContact CD2-CG 4.49Å; Y1162-M1189 HydrophobicContact CE1-CB 3.74Å; Y1162-M1189 WeakPolarHBondContact CE1-O 3.49Å; Y1162-M1189 HydrophobicContact CE2-CB 3.68Å; Y1162-M1189 HydrophobicContact CE2-CE 4.45Å; Y1162-M1189 HydrophobicContact CE2-CG 4.3Å; Y1162-M1189 HydrophobicContact CG-CB 4.38Å; Y1162-M1189 HydrophobicContact CG-CE 3.54Å; Y1162-M1189 VanDerWaalsContact CZ-CB 3.46Å; F1167-M1189 HydrophobicContact CD1-CG 4.19Å; F1167-M1189 HydrophobicContact CE1-CG 3.73Å; F1167-M1189 HydrophobicContact CE2-CG 4.15Å; F1167-M1189 HydrophobicContact CE2-SD 4.28Å; F1167-M1189 HydrophobicContact CZ-CG 3.7Å; F1167-M1189 HydrophobicContact CZ-SD 4.31Å; L1185-M1189 WeakPolarHBondContact O-CG 3.34Å; L1185-M1189 PolarHBondContact O-N 3.36Å; H1186-M1189 CarbonylContact O-C 3.54Å; H1186-M1189 WeakPolarHBondContact O-CA 3.4Å; H1186-M1189 WeakPolarHBondContact O-CB 3.47Å; H1186-M1189 PolarHBondContact O-N 2.78Å; E1187-M1189 VanDerWaalsContact C-N 3.33Å; E1187-M1189 PolarHBondContact O-N 2.64Å; M1189-Y1192 HydrophobicContact CE-CD1 3.88Å; M1189-Y1192 HydrophobicContact CE-CE1 4.32Å; M1189-Y1192 HydrophobicContact CE-CG 4.47Å; M1189-Y1192 WeakPolarHBondContact O-CB 3.16Å; M1189-Y1192 PolarHBondContact O-N 3.25Å; M1189-A1193 WeakPolarHBondContact O-CB 3.41Å; M1189-A1193 PolarHBondContact O-N 2.94Å; M1189-L1234 HydrophobicContact SD-CD2 4.05Å; M1189-V1240 HydrophobicContact SD-CG2 4.26Å; M1189-A1248 HydrophobicContact CE-CB 4.08Å; M1189-A1248 HydrophobicContact SD-CB 3.58Å; M1189-A1248 VanDerWaalsContact SD-CB 3.58Å
1190	K	91	Very high	88.4	Confident	97 Å²	97	42.8 Å²	42.8	42%	0.422	22%	0.222	S	C	.	.	H	α-helix	trans	-63.7	-41.4	168.8	-65.1	176.8	-163.9	165.5	0	111.4	H1186 E1187 Y1192 A1193 R1194	H1186-K1190 WeakPolarHBondContact O-CG 3.5Å; H1186-K1190 PolarHBondContact O-N 3.28Å; E1187-K1190 WeakPolarHBondContact O-CB 3.38Å; E1187-K1190 PolarHBondContact O-N 3.05Å; E1187-K1190 WeakPolarHBondContact OE1-CD 3.49Å; E1187-K1190 IonicContact OE1-NZ 3.1Å; E1187-K1190 WeakPolarHBondContact OE2-CD 3.37Å; E1187-K1190 WeakPolarHBondContact OE2-CE 3.2Å; E1187-K1190 IonicContact OE2-NZ 3.57Å; E1187-K1190 PolarHBondContact OE2-NZ 3.16Å; K1190-Y1192 VanDerWaalsContact C-N 3.34Å; K1190-Y1192 PolarHBondContact O-N 3.06Å; K1190-A1193 PolarHBondContact O-N 2.88Å; K1190-A1193 VanDerWaalsContact O-N 3.16Å; K1190-R1194 PolarHBondContact O-N 2.97Å; K1190-R1194 VanDerWaalsContact O-N 3.14Å
1191	V	89	Confident	88.6	Confident	47 Å²	47	41.3 Å²	41.3	29%	0.285	20%	0.2	S	C	.	.	H	α-helix	trans	-60.2	-45	173.1	175.9	0	0	0	0	110.6	E1187 R1188 A1193 R1194 H1195 A1238	E1187-V1191 PolarHBondContact O-N 3.44Å; E1187-V1191 VanDerWaalsContact O-N 3.09Å; R1188-V1191 PolarHBondContact O-N 3.07Å; V1191-A1193 VanDerWaalsContact C-N 3.33Å; V1191-A1193 PolarHBondContact O-N 2.74Å; V1191-R1194 PolarHBondContact O-N 3.01Å; V1191-H1195 PolarHBondContact O-ND1 3.02Å; V1191-A1238 HydrophobicContact CG1-CB 4.4Å
1192	Y	91.9	Very high	88.2	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-57.3	-42.7	172.5	172.9	-95.3	0	0	0	112.4	L1160 R1188 M1189 K1190 R1194 H1195 R1230 I1233 L1234 S1252	L1160-Y1192 HydrophobicContact CB-CD1 4.29Å; L1160-Y1192 HydrophobicContact CB-CE1 3.79Å; L1160-Y1192 HydrophobicContact CB-CE2 4.28Å; L1160-Y1192 HydrophobicContact CD1-CD2 4.3Å; L1160-Y1192 HydrophobicContact CD1-CE2 3.75Å; L1160-Y1192 WeakPolarHBondContact O-CE1 3.48Å; R1188-Y1192 PolarHBondContact O-N 3.32Å; M1189-Y1192 HydrophobicContact CE-CD1 3.88Å; M1189-Y1192 HydrophobicContact CE-CE1 4.32Å; M1189-Y1192 HydrophobicContact CE-CG 4.47Å; M1189-Y1192 WeakPolarHBondContact O-CB 3.16Å; M1189-Y1192 PolarHBondContact O-N 3.25Å; K1190-Y1192 VanDerWaalsContact C-N 3.34Å; K1190-Y1192 PolarHBondContact O-N 3.06Å; Y1192-R1194 VanDerWaalsContact C-N 3.27Å; Y1192-R1194 PolarHBondContact O-N 3.44Å; Y1192-H1195 WeakPolarHBondContact O-CB 3.49Å; Y1192-H1195 PolarHBondContact O-N 3.32Å; Y1192-R1230 WeakPolarHBondContact OH-CD 3.46Å; Y1192-I1233 HydrophobicContact CD2-CB 4.45Å; Y1192-I1233 HydrophobicContact CD2-CG2 3.8Å; Y1192-I1233 HydrophobicContact CE2-CG2 4.37Å; Y1192-L1234 HydrophobicContact CD2-CD2 3.4Å; Y1192-L1234 VanDerWaalsContact CD2-CD2 3.4Å; Y1192-L1234 HydrophobicContact CD2-CG 3.65Å; Y1192-L1234 HydrophobicContact CE2-CD1 4.29Å; Y1192-L1234 HydrophobicContact CE2-CD2 3.76Å; Y1192-L1234 HydrophobicContact CE2-CG 3.63Å; Y1192-L1234 HydrophobicContact CG-CD2 3.85Å; Y1192-S1252 WeakPolarHBondContact OH-CB 3.39Å; Y1192-S1252 PolarHBondContact OH-OG 3.27Å; Y1192-S1252 VanDerWaalsContact OH-OG 3.06Å
1193	A	89.2	Confident	87.4	Confident	28 Å²	28	48.4 Å²	48.4	23%	0.231	23%	0.228	C	C	.	.	H	α-helix	trans	-67.6	-20.4	-179.6	0	0	0	0	0	115	L1160 Y1162 M1189 K1190 V1191 H1195	L1160-A1193 WeakPolarHBondContact O-CA 3.42Å; Y1162-A1193 HydrophobicContact CD1-CB 4.05Å; Y1162-A1193 HydrophobicContact CE1-CB 4.07Å; M1189-A1193 WeakPolarHBondContact O-CB 3.41Å; M1189-A1193 PolarHBondContact O-N 2.94Å; K1190-A1193 PolarHBondContact O-N 2.88Å; K1190-A1193 VanDerWaalsContact O-N 3.16Å; V1191-A1193 VanDerWaalsContact C-N 3.33Å; V1191-A1193 PolarHBondContact O-N 2.74Å; A1193-H1195 VanDerWaalsContact C-N 3.3Å
1194	R	86.5	Confident	86.3	Confident	205 Å²	205	52 Å²	52	77%	0.774	24%	0.237	S	C	*	.	H	α-helix	trans	-75.9	-16.7	171.1	-69.3	178.1	179.8	175.1	-0.1	113	K1190 V1191 Y1192	K1190-R1194 PolarHBondContact O-N 2.97Å; K1190-R1194 VanDerWaalsContact O-N 3.14Å; V1191-R1194 PolarHBondContact O-N 3.01Å; Y1192-R1194 VanDerWaalsContact C-N 3.27Å; Y1192-R1194 PolarHBondContact O-N 3.44Å
1195	H	87.9	Confident	84.8	Confident	25 Å²	25	51.4 Å²	51.4	12%	0.116	23%	0.231	C	C	.	.			trans	-88.6	155.8	-177.1	-71.9	70	0	0	0	113.1	L1160 V1191 Y1192 A1193 A1217 I1233 H1237	L1160-H1195 WeakPolarHBondContact CB-O 3.31Å; L1160-H1195 HydrophobicContact CD1-CB 4.32Å; L1160-H1195 PolarHBondContact N-O 2.92Å; V1191-H1195 PolarHBondContact O-ND1 3.02Å; Y1192-H1195 WeakPolarHBondContact O-CB 3.49Å; Y1192-H1195 PolarHBondContact O-N 3.32Å; A1193-H1195 VanDerWaalsContact C-N 3.3Å; H1195-A1217 WeakPolarHBondContact NE2-CB 3.26Å; H1195-I1233 HydrophobicContact CB-CD1 4.29Å; H1195-I1233 HydrophobicContact CB-CG2 3.71Å; H1195-H1237 WeakPolarHBondContact NE2-CB 3.49Å; H1195-H1237 AromaticContact NE2-CG 3.5Å; H1195-H1237 AromaticContact NE2-ND1 3.65Å
1196	S	87.9	Confident	82.9	Confident	19 Å²	19	57.5 Å²	57.5	13%	0.133	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	162.8	173.7	-62.9	0	0	0	0	111.4	V1158 C1216	V1158-S1196 CarbonylContact O-C 3.58Å; V1158-S1196 WeakPolarHBondContact O-CA 3.19Å; V1158-S1196 WeakPolarHBondContact O-CB 3.45Å; S1196-C1216 PolarHBondContact N-SG 2.91Å; S1196-C1216 VanDerWaalsContact O-CB 3.29Å; S1196-C1216 WeakPolarHBondContact O-CB 3.13Å; S1196-C1216 PolarHBondContact O-N 3.03Å; S1196-C1216 PolarHBondContact O-SG 3.32Å
1197	V	89.6	Confident	81.1	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	125.2	171.4	176.7	0	0	0	0	108.1	V1158 L1160 Y1213 V1214 F1226 V1229 I1233	V1158-V1197 PolarHBondContact N-O 2.9Å; V1158-V1197 PolarHBondContact O-N 3.43Å; L1160-V1197 HydrophobicContact CD1-CG2 4.07Å; L1160-V1197 HydrophobicContact CD2-CG2 4.04Å; L1160-V1197 HydrophobicContact CG-CG2 4.34Å; V1197-Y1213 HydrophobicContact CG1-CD1 4.43Å; V1197-V1214 CarbonylContact C-O 3.58Å; V1197-V1214 WeakPolarHBondContact CA-O 3.35Å; V1197-F1226 HydrophobicContact CB-CD2 4.21Å; V1197-F1226 HydrophobicContact CB-CE2 3.66Å; V1197-F1226 HydrophobicContact CB-CZ 4.41Å; V1197-F1226 HydrophobicContact CG1-CD2 3.8Å; V1197-F1226 HydrophobicContact CG1-CE2 3.77Å; V1197-F1226 HydrophobicContact CG2-CE2 4.04Å; V1197-F1226 HydrophobicContact CG2-CZ 4.41Å; V1197-V1229 HydrophobicContact CG1-CB 4.39Å; V1197-V1229 HydrophobicContact CG1-CG1 4.15Å; V1197-V1229 HydrophobicContact CG2-CB 4.31Å; V1197-V1229 HydrophobicContact CG2-CG1 3.81Å; V1197-I1233 HydrophobicContact CG2-CD1 3.91Å
1198	Y	89.5	Confident	79.6	Confident	8 Å²	8	62.5 Å²	62.5	3%	0.031	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	139.3	170.8	-47.2	-43.7	0	0	0	109.2	L1146 L1148 L1154 I1157 V1214 C1216 L1219	L1146-Y1198 HydrophobicContact CD1-CD1 4.3Å; L1146-Y1198 HydrophobicContact CD1-CE1 3.76Å; L1146-Y1198 HydrophobicContact CD1-CE2 4.32Å; L1146-Y1198 WeakPolarHBondContact CD2-OH 3.41Å; L1148-Y1198 HydrophobicContact CD2-CD2 4.12Å; L1148-Y1198 HydrophobicContact CD2-CE2 4.37Å; L1154-Y1198 HydrophobicContact CD1-CG 4.35Å; I1157-Y1198 HydrophobicContact CB-CD1 4.39Å; I1157-Y1198 HydrophobicContact CG1-CD1 3.99Å; I1157-Y1198 HydrophobicContact CG1-CE1 4.33Å; I1157-Y1198 HydrophobicContact CG2-CD1 4.01Å; I1157-Y1198 HydrophobicContact CG2-CE1 4Å; Y1198-V1214 HydrophobicContact CD2-CB 4.49Å; Y1198-V1214 HydrophobicContact CD2-CG1 4.45Å; Y1198-V1214 PolarHBondContact N-O 2.99Å; Y1198-V1214 PolarHBondContact O-N 2.96Å; Y1198-C1216 HydrophobicContact CE1-CB 4.04Å; Y1198-C1216 HydrophobicContact CE2-CB 3.88Å; Y1198-C1216 WeakPolarHBondContact OH-CB 3.13Å; Y1198-L1219 HydrophobicContact CE2-CD2 4.43Å
1199	I	88.7	Confident	78.2	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	112.6	173	-57.6	-176.7	0	0	0	106.6	E1155 R1156 V1158 R1211 Y1213 Y1259	E1155-I1199 WeakPolarHBondContact CA-O 3.25Å; E1155-I1199 HydrophobicContact CB-CG2 4.35Å; E1155-I1199 WeakPolarHBondContact CB-O 3.31Å; E1155-I1199 PolarHBondContact N-O 3.43Å; R1156-I1199 HydrophobicContact CB-CB 4.28Å; R1156-I1199 HydrophobicContact CB-CD1 4.35Å; R1156-I1199 HydrophobicContact CB-CG1 4.49Å; R1156-I1199 PolarHBondContact N-O 2.52Å; R1156-I1199 PolarHBondContact O-N 3.09Å; V1158-I1199 HydrophobicContact CG2-CD1 3.88Å; V1158-I1199 HydrophobicContact CG2-CG1 4.34Å; I1199-R1211 HydrophobicContact CG2-CB 4.26Å; I1199-R1211 HydrophobicContact CG2-CG 4.04Å; I1199-Y1213 HydrophobicContact CD1-CD1 4.37Å; I1199-Y1213 HydrophobicContact CD1-CE1 3.96Å; I1199-Y1213 HydrophobicContact CG1-CD1 3.94Å; I1199-Y1213 HydrophobicContact CG1-CE1 3.99Å; I1199-Y1213 HydrophobicContact CG2-CE1 4.34Å; I1199-Y1259 HydrophobicContact CD1-CE1 4.19Å
1200	T	86.8	Confident	77.1	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	169.7	-176.6	61.3	0	0	0	0	111.8	L1148 W1152 A1153 L1154 R1211 I1212 V1214	L1148-T1200 HydrophobicContact CD1-CG2 4.34Å; W1152-T1200 HydrophobicContact CE3-CG2 4.33Å; A1153-T1200 CarbonylContact O-C 3.58Å; A1153-T1200 WeakPolarHBondContact O-CA 3.28Å; L1154-T1200 HydrophobicContact CD1-CG2 3.89Å; T1200-R1211 WeakPolarHBondContact O-CA 3.13Å; T1200-I1212 PolarHBondContact N-O 3.43Å; T1200-I1212 PolarHBondContact O-N 2.81Å; T1200-V1214 HydrophobicContact CG2-CG2 4.15Å
1201	R	82.2	Confident	76.7	Confident	75 Å²	75	68.4 Å²	68.4	28%	0.283	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	149.6	169.3	-62.6	179.7	-175.8	-122.7	3.5	109.4	W1152 A1153 E1155 L1208 R1211	W1152-R1201 CarbonylContact C-O 3.52Å; W1152-R1201 WeakPolarHBondContact CA-O 3.49Å; A1153-R1201 PolarHBondContact N-O 3.16Å; A1153-R1201 PolarHBondContact O-N 3.06Å; E1155-R1201 IonicContact OE2-CZ 3.55Å; E1155-R1201 IonicContact OE2-NE 3.86Å; E1155-R1201 PolarHBondContact OE2-NE 2.8Å; E1155-R1201 VanDerWaalsContact OE2-NE 3.08Å; E1155-R1201 IonicContact OE2-NH2 3.78Å; E1155-R1201 PolarHBondContact OE2-NH2 2.57Å; R1201-L1208 PolarHBondContact NH1-O 3.03Å; R1201-R1211 HydrophobicContact CG-CG 4.47Å
1202	M	76.4	Confident	76.5	Confident	62 Å²	62	66.4 Å²	66.4	31%	0.305	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	138.7	169	-66	-86.3	-74.3	0	0	109.3	T1205 I1212	M1202-T1205 HydrophobicContact CB-CG2 3.62Å; M1202-T1205 HydrophobicContact CE-CG2 3.91Å; M1202-T1205 HydrophobicContact CG-CG2 3.9Å; M1202-I1212 HydrophobicContact CG-CD1 3.58Å; M1202-I1212 HydrophobicContact SD-CD1 4.08Å
1203	R	69	Low	76.4	Confident	146 Å²	146	68.1 Å²	68.1	55%	0.551	33%	0.331	S	S	*	.	S	Bend	trans	-75.8	-24.3	175	-65.9	-177.8	-173.7	-149.9	3	113.4	A1150 S1151	A1150-R1203 WeakPolarHBondContact O-CD 3.11Å; A1150-R1203 PolarHBondContact O-NE 2.97Å; S1151-R1203 WeakPolarHBondContact O-CG 3.46Å; S1151-R1203 PolarHBondContact O-N 2.78Å
1204	E	62.8	Low	76.4	Confident	153 Å²	153	66.8 Å²	66.8	72%	0.715	32%	0.32	S	S	*	.	S	Bend	trans	-112.4	-0.1	-163.8	-69.4	152.8	-150.1	0	0	114.6
1205	T	55.6	Low	76.7	Confident	36 Å²	36	57 Å²	57	22%	0.221	28%	0.283	C	S	.	.			trans	-86.7	139.4	-179.1	51.8	0	0	0	0	112.2	M1202 N1207	M1202-T1205 HydrophobicContact CB-CG2 3.62Å; M1202-T1205 HydrophobicContact CE-CG2 3.91Å; M1202-T1205 HydrophobicContact CG-CG2 3.9Å; T1205-N1207 PolarHBondContact O-N 3.17Å
1206	P	50.9	Low	76.7	Confident	127 Å²	127	56.8 Å²	56.8	83%	0.825	28%	0.284	S	S	*	.	S	Bend	trans	-62.8	-14	180	25.4	-35.1	0	0	0	114.5
1207	N	54.6	Low	76.5	Confident	100 Å²	100	57.3 Å²	57.3	54%	0.535	29%	0.29	S	S	.	.			trans	-104.2	77.9	173.5	-73.6	-56.6	0	0	0	111.4	T1205 T1209 Q1210	T1205-N1207 PolarHBondContact O-N 3.17Å; N1207-T1209 PolarHBondContact O-N 2.95Å; N1207-Q1210 PolarHBondContact O-N 3.34Å
1208	L	57.3	Low	76.3	Confident	129 Å²	129	58.9 Å²	58.9	68%	0.675	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-16.6	177	-87.1	74	0	0	0	114.4	R1201	R1201-L1208 PolarHBondContact NH1-O 3.03Å
1209	T	62.5	Low	76.1	Confident	114 Å²	114	61.2 Å²	61.2	70%	0.699	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-18.5	178	54.5	0	0	0	0	113.8	N1207 R1211	N1207-T1209 PolarHBondContact O-N 2.95Å; T1209-R1211 PolarHBondContact O-N 3Å
1210	Q	70.2	Confident	75.9	Confident	85 Å²	85	62.1 Å²	62.1	40%	0.397	32%	0.318	S	S	.	.			trans	-79.1	113.1	-172.6	-165.4	174.8	12.3	0	0	112.4	N1207 H1223	N1207-Q1210 PolarHBondContact O-N 3.34Å; Q1210-H1223 PolarHBondContact NE2-ND1 3.1Å
1211	R	82.1	Confident	75.9	Confident	78 Å²	78	64.1 Å²	64.1	29%	0.294	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	138.9	169.1	-72.6	175.7	173.3	135	-2.3	111.2	E1155 I1199 T1200 R1201 T1209 Y1213	E1155-R1211 VanDerWaalsContact CD-NH2 3.34Å; E1155-R1211 IonicContact OE1-CZ 2.97Å; E1155-R1211 IonicContact OE1-NE 2.69Å; E1155-R1211 PolarHBondContact OE1-NE 3.21Å; E1155-R1211 IonicContact OE1-NH2 2.72Å; E1155-R1211 PolarHBondContact OE1-NH2 3.25Å; E1155-R1211 IonicContact OE2-CZ 3.2Å; E1155-R1211 IonicContact OE2-NE 2.95Å; E1155-R1211 PolarHBondContact OE2-NE 2.96Å; E1155-R1211 IonicContact OE2-NH2 3.2Å; E1155-R1211 PolarHBondContact OE2-NH2 3.5Å; E1155-R1211 VanDerWaalsContact OE2-NH2 3.12Å; I1199-R1211 HydrophobicContact CG2-CB 4.26Å; I1199-R1211 HydrophobicContact CG2-CG 4.04Å; T1200-R1211 WeakPolarHBondContact O-CA 3.13Å; R1201-R1211 HydrophobicContact CG-CG 4.47Å; T1209-R1211 PolarHBondContact O-N 3Å; R1211-Y1213 HydrophobicContact CB-CE2 4.31Å
1212	I	85.1	Confident	76.1	Confident	5 Å²	5	61.1 Å²	61.1	3%	0.026	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	137.4	166	-58	-177.4	0	0	0	107.9	T1200 M1202 V1214 T1221	T1200-I1212 PolarHBondContact N-O 3.43Å; T1200-I1212 PolarHBondContact O-N 2.81Å; M1202-I1212 HydrophobicContact CG-CD1 3.58Å; M1202-I1212 HydrophobicContact SD-CD1 4.08Å; I1212-V1214 HydrophobicContact CG2-CG2 3.99Å; I1212-T1221 HydrophobicContact CG2-CG2 3.91Å
1213	Y	89.9	Confident	76.1	Confident	36 Å²	36	62.9 Å²	62.9	14%	0.141	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	128.6	173.9	-60.6	-87	0	0	0	108.9	V1197 I1199 R1211 T1221 S1222 F1226 V1229	V1197-Y1213 HydrophobicContact CG1-CD1 4.43Å; I1199-Y1213 HydrophobicContact CD1-CD1 4.37Å; I1199-Y1213 HydrophobicContact CD1-CE1 3.96Å; I1199-Y1213 HydrophobicContact CG1-CD1 3.94Å; I1199-Y1213 HydrophobicContact CG1-CE1 3.99Å; I1199-Y1213 HydrophobicContact CG2-CE1 4.34Å; R1211-Y1213 HydrophobicContact CB-CE2 4.31Å; Y1213-T1221 CarbonylContact O-C 3.59Å; Y1213-T1221 WeakPolarHBondContact O-CA 3.47Å; Y1213-S1222 PolarHBondContact N-O 3.35Å; Y1213-S1222 VanDerWaalsContact N-O 3.14Å; Y1213-S1222 PolarHBondContact O-N 2.77Å; Y1213-F1226 HydrophobicContact CD1-CB 3.77Å; Y1213-F1226 AromaticContact CD1-CD2 3.79Å; Y1213-F1226 HydrophobicContact CD1-CD2 3.79Å; Y1213-F1226 HydrophobicContact CD1-CG 4.29Å; Y1213-F1226 HydrophobicContact CE1-CB 3.74Å; Y1213-F1226 HydrophobicContact CE1-CD2 4.06Å; Y1213-F1226 HydrophobicContact CE1-CG 4.4Å; Y1213-F1226 HydrophobicContact CG-CB 4.33Å; Y1213-V1229 WeakPolarHBondContact O-CG2 3.34Å
1214	V	89.1	Confident	76.3	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	134.8	-169.7	-170.7	0	0	0	0	110.8	W1152 V1197 Y1198 T1200 I1212 L1219 T1220 T1221	W1152-V1214 HydrophobicContact CE3-CG2 4.38Å; W1152-V1214 HydrophobicContact CH2-CG2 4.45Å; W1152-V1214 HydrophobicContact CZ3-CG1 4.02Å; W1152-V1214 HydrophobicContact CZ3-CG2 3.96Å; V1197-V1214 CarbonylContact C-O 3.58Å; V1197-V1214 WeakPolarHBondContact CA-O 3.35Å; Y1198-V1214 HydrophobicContact CD2-CB 4.49Å; Y1198-V1214 HydrophobicContact CD2-CG1 4.45Å; Y1198-V1214 PolarHBondContact N-O 2.99Å; Y1198-V1214 PolarHBondContact O-N 2.96Å; T1200-V1214 HydrophobicContact CG2-CG2 4.15Å; I1212-V1214 HydrophobicContact CG2-CG2 3.99Å; V1214-L1219 HydrophobicContact CG1-CB 4.22Å; V1214-L1219 HydrophobicContact CG1-CD2 3.96Å; V1214-T1220 WeakPolarHBondContact CA-O 3.5Å; V1214-T1221 HydrophobicContact CG2-CG2 4.32Å
1215	C	91.7	Very high	77.1	Confident	0 Å²	0	57 Å²	57	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	128.5	174	-178.9	0	0	0	0	111.7	A1217 L1219 T1220 V1229 I1233	C1215-A1217 VanDerWaalsContact C-N 3.34Å; C1215-A1217 PolarHBondContact O-N 3.01Å; C1215-L1219 VanDerWaalsContact O-CA 3.31Å; C1215-L1219 WeakPolarHBondContact O-CA 2.99Å; C1215-L1219 PolarHBondContact O-N 2.82Å; C1215-T1220 PolarHBondContact N-O 3.42Å; C1215-V1229 HydrophobicContact CB-CG1 3.91Å; C1215-I1233 HydrophobicContact CB-CG1 4.47Å; C1215-I1233 WeakPolarHBondContact SG-CG1 3.28Å
1216	C	88.4	Confident	78.5	Confident	19 Å²	19	56.2 Å²	56.2	13%	0.128	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-39.1	-177.4	67.1	0	0	0	0	114.6	S1196 Y1198	S1196-C1216 PolarHBondContact N-SG 2.91Å; S1196-C1216 VanDerWaalsContact O-CB 3.29Å; S1196-C1216 WeakPolarHBondContact O-CB 3.13Å; S1196-C1216 PolarHBondContact O-N 3.03Å; S1196-C1216 PolarHBondContact O-SG 3.32Å; Y1198-C1216 HydrophobicContact CE1-CB 4.04Å; Y1198-C1216 HydrophobicContact CE2-CB 3.88Å; Y1198-C1216 WeakPolarHBondContact OH-CB 3.13Å
1217	A	83.2	Confident	80.3	Confident	31 Å²	31	51.4 Å²	51.4	26%	0.256	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	1.3	-168.5	0	0	0	0	0	115	H1195 C1215	H1195-A1217 WeakPolarHBondContact NE2-CB 3.26Å; C1215-A1217 VanDerWaalsContact C-N 3.34Å; C1215-A1217 PolarHBondContact O-N 3.01Å
1218	C	86.2	Confident	81.8	Confident	33 Å²	33	48.8 Å²	48.8	22%	0.223	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-161.4	6.3	-179	64.8	0	0	0	0	115.1	I541 T1220 H1232 H1237	I541-C1218 HydrophobicContact CD1-CB 3.68Å; C1218-T1220 PolarHBondContact O-N 3.32Å; C1218-T1220 PolarHBondContact SG-OG1 2.87Å; C1218-H1232 PolarHBondContact SG-NE2 2.75Å; C1218-H1237 PolarHBondContact SG-NE2 2.88Å
1219	L	85.2	Confident	83.3	Confident	57 Å²	57	42.7 Å²	42.7	30%	0.298	23%	0.232	S	C	.	.			trans	54.5	16.9	-179.9	-53.3	-178.9	0	0	0	116.4	L1148 Y1198 V1214 C1215 T1221	L1148-L1219 HydrophobicContact CD2-CD2 3.75Å; Y1198-L1219 HydrophobicContact CE2-CD2 4.43Å; V1214-L1219 HydrophobicContact CG1-CB 4.22Å; V1214-L1219 HydrophobicContact CG1-CD2 3.96Å; C1215-L1219 VanDerWaalsContact O-CA 3.31Å; C1215-L1219 WeakPolarHBondContact O-CA 2.99Å; C1215-L1219 PolarHBondContact O-N 2.82Å; L1219-T1221 PolarHBondContact O-N 3.19Å
1220	T	85.4	Confident	84.7	Confident	18 Å²	18	38.8 Å²	38.8	11%	0.11	21%	0.205	C	C	.	.			trans	-56.1	122	171.9	-61.5	0	0	0	0	110.2	I541 V1214 C1215 C1218 H1232	I541-T1220 WeakPolarHBondContact CD1-OG1 3.31Å; I541-T1220 HydrophobicContact CG2-CG2 4.04Å; I541-T1220 WeakPolarHBondContact CG2-OG1 3.31Å; V1214-T1220 WeakPolarHBondContact CA-O 3.5Å; C1215-T1220 PolarHBondContact N-O 3.42Å; C1218-T1220 PolarHBondContact O-N 3.32Å; C1218-T1220 PolarHBondContact SG-OG1 2.87Å; T1220-H1232 PolarHBondContact OG1-CE1 3.4Å; T1220-H1232 PolarHBondContact OG1-NE2 3.18Å
1221	T	86.8	Confident	85.6	Confident	42 Å²	42	39.4 Å²	39.4	26%	0.258	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	154.9	-179.4	59.5	0	0	0	0	112.1	W1152 I1212 Y1213 V1214 L1219	W1152-T1221 HydrophobicContact CH2-CG2 3.58Å; W1152-T1221 HydrophobicContact CZ2-CG2 3.85Å; I1212-T1221 HydrophobicContact CG2-CG2 3.91Å; Y1213-T1221 CarbonylContact O-C 3.59Å; Y1213-T1221 WeakPolarHBondContact O-CA 3.47Å; V1214-T1221 HydrophobicContact CG2-CG2 4.32Å; L1219-T1221 PolarHBondContact O-N 3.19Å
1222	S	84.6	Confident	86	Confident	13 Å²	13	37.6 Å²	37.6	9%	0.091	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	123	167.8	179.5	0	0	0	0	111.5	Y1213 H1224	Y1213-S1222 PolarHBondContact N-O 3.35Å; Y1213-S1222 VanDerWaalsContact N-O 3.14Å; Y1213-S1222 PolarHBondContact O-N 2.77Å; S1222-H1224 PolarHBondContact OG-N 3.24Å
1223	H	77.8	Confident	86.3	Confident	98 Å²	98	37.3 Å²	37.3	45%	0.454	20%	0.2	S	C	.	.	S	Bend	trans	-83.5	-15.1	169.3	-59.2	-98.6	0	0	0	112.2	Q1210 G1225	Q1210-H1223 PolarHBondContact NE2-ND1 3.1Å; H1223-G1225 VanDerWaalsContact C-N 3.34Å
1224	H	71.8	Confident	86.4	Confident	160 Å²	160	35.6 Å²	35.6	74%	0.741	19%	0.193	S	C	*	.	S	Bend	trans	-85.4	-5.2	-177.8	-55.1	-56.1	0	0	0	113.7	S1222	S1222-H1224 PolarHBondContact OG-N 3.24Å
1225	G	80.6	Confident	86.5	Confident	16 Å²	16	36.5 Å²	36.5	17%	0.165	20%	0.202	C	C	.	.			trans	118.3	162.9	168.2	0	0	0	0	0	116	H1223 G1227 D1228	H1223-G1225 VanDerWaalsContact C-N 3.34Å; G1225-G1227 PolarHBondContact O-N 2.97Å; G1225-D1228 PolarHBondContact O-N 2.99Å
1226	F	85.7	Confident	86.3	Confident	20 Å²	20	38.6 Å²	38.6	9%	0.088	21%	0.214	C	C	.	.	H	α-helix	trans	-47.3	-28.6	178.8	-169.1	-96.7	0	0	0	115	V1158 L1160 V1197 Y1213 D1228 R1230 L1254 Y1259	V1158-F1226 HydrophobicContact CB-CE2 3.93Å; V1158-F1226 HydrophobicContact CB-CZ 4.23Å; V1158-F1226 HydrophobicContact CG1-CE2 3.83Å; V1158-F1226 HydrophobicContact CG1-CZ 3.63Å; V1158-F1226 HydrophobicContact CG2-CE2 4.31Å; L1160-F1226 HydrophobicContact CD2-CE1 4.32Å; L1160-F1226 HydrophobicContact CD2-CZ 3.81Å; V1197-F1226 HydrophobicContact CB-CD2 4.21Å; V1197-F1226 HydrophobicContact CB-CE2 3.66Å; V1197-F1226 HydrophobicContact CB-CZ 4.41Å; V1197-F1226 HydrophobicContact CG1-CD2 3.8Å; V1197-F1226 HydrophobicContact CG1-CE2 3.77Å; V1197-F1226 HydrophobicContact CG2-CE2 4.04Å; V1197-F1226 HydrophobicContact CG2-CZ 4.41Å; Y1213-F1226 HydrophobicContact CD1-CB 3.77Å; Y1213-F1226 AromaticContact CD1-CD2 3.79Å; Y1213-F1226 HydrophobicContact CD1-CD2 3.79Å; Y1213-F1226 HydrophobicContact CD1-CG 4.29Å; Y1213-F1226 HydrophobicContact CE1-CB 3.74Å; Y1213-F1226 HydrophobicContact CE1-CD2 4.06Å; Y1213-F1226 HydrophobicContact CE1-CG 4.4Å; Y1213-F1226 HydrophobicContact CG-CB 4.33Å; F1226-D1228 VanDerWaalsContact C-N 3.34Å; F1226-D1228 PolarHBondContact O-N 3.46Å; F1226-R1230 HydrophobicContact CD1-CG 4.37Å; F1226-R1230 VanDerWaalsContact CD1-NE 3.31Å; F1226-R1230 HydrophobicContact CE1-CG 4.03Å; F1226-R1230 PolarHBondContact O-N 2.9Å; F1226-L1254 HydrophobicContact CE1-CD1 3.88Å; F1226-L1254 HydrophobicContact CZ-CD1 3.85Å; F1226-Y1259 HydrophobicContact CD2-CE1 4.23Å; F1226-Y1259 HydrophobicContact CE2-CD1 4.27Å; F1226-Y1259 HydrophobicContact CE2-CE1 4.17Å; F1226-Y1259 HydrophobicContact CZ-CD1 4.19Å; F1226-Y1259 HydrophobicContact CZ-CE1 4.44Å
1227	G	87	Confident	86.4	Confident	25 Å²	25	39.7 Å²	39.7	26%	0.258	22%	0.218	S	C	.	.	H	α-helix	trans	-67.9	-27.2	177.2	0	0	0	0	0	114.6	G1225 K1231	G1225-G1227 PolarHBondContact O-N 2.97Å; G1227-K1231 WeakPolarHBondContact O-CE 3.06Å; G1227-K1231 VanDerWaalsContact O-CG 3.31Å; G1227-K1231 WeakPolarHBondContact O-CG 3.37Å; G1227-K1231 PolarHBondContact O-N 3.37Å
1228	D	87.6	Confident	86.7	Confident	45 Å²	45	38.4 Å²	38.4	24%	0.241	21%	0.207	C	C	.	.	H	α-helix	trans	-85.8	-33.7	178.8	-85.4	13.2	0	0	0	111.6	G1225 F1226 R1230 K1231 H1232 K1437	G1225-D1228 PolarHBondContact O-N 2.99Å; F1226-D1228 VanDerWaalsContact C-N 3.34Å; F1226-D1228 PolarHBondContact O-N 3.46Å; D1228-R1230 PolarHBondContact O-N 3.33Å; D1228-K1231 PolarHBondContact O-N 3.47Å; D1228-K1231 IonicContact OD1-NZ 2.9Å; D1228-K1231 PolarHBondContact OD1-NZ 3.3Å; D1228-H1232 PolarHBondContact O-N 3.03Å; D1228-K1437 IonicContact OD2-NZ 3.1Å
1229	V	89.2	Confident	86.8	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.012	21%	0.209	C	C	.	.	H	α-helix	trans	-65	-39	171.9	-170.9	0	0	0	0	111.4	V1197 Y1213 C1215 K1231 H1232 I1233	V1197-V1229 HydrophobicContact CG1-CB 4.39Å; V1197-V1229 HydrophobicContact CG1-CG1 4.15Å; V1197-V1229 HydrophobicContact CG2-CB 4.31Å; V1197-V1229 HydrophobicContact CG2-CG1 3.81Å; Y1213-V1229 WeakPolarHBondContact O-CG2 3.34Å; C1215-V1229 HydrophobicContact CB-CG1 3.91Å; V1229-K1231 PolarHBondContact O-N 3.37Å; V1229-H1232 WeakPolarHBondContact O-CB 3.34Å; V1229-H1232 PolarHBondContact O-N 3.5Å; V1229-I1233 HydrophobicContact CG1-CD1 4.06Å; V1229-I1233 WeakPolarHBondContact O-CG1 3.35Å; V1229-I1233 PolarHBondContact O-N 2.9Å
1230	R	91.6	Very high	87	Confident	31 Å²	31	37 Å²	37	12%	0.117	20%	0.196	C	C	.	.	H	α-helix	trans	-61.6	-40.7	171.8	-78.6	-171.4	-71.7	166.1	-4	113.1	L1160 Y1192 F1226 D1228 H1232 I1233 L1234 M1249 S1252	L1160-R1230 HydrophobicContact CD1-CG 4.27Å; L1160-R1230 HydrophobicContact CD2-CG 3.78Å; Y1192-R1230 WeakPolarHBondContact OH-CD 3.46Å; F1226-R1230 HydrophobicContact CD1-CG 4.37Å; F1226-R1230 VanDerWaalsContact CD1-NE 3.31Å; F1226-R1230 HydrophobicContact CE1-CG 4.03Å; F1226-R1230 PolarHBondContact O-N 2.9Å; D1228-R1230 PolarHBondContact O-N 3.33Å; R1230-H1232 VanDerWaalsContact C-N 3.34Å; R1230-I1233 PolarHBondContact O-N 3.2Å; R1230-L1234 WeakPolarHBondContact O-CB 3.43Å; R1230-L1234 VanDerWaalsContact O-CG 3.31Å; R1230-L1234 WeakPolarHBondContact O-CG 3.5Å; R1230-L1234 PolarHBondContact O-N 2.89Å; R1230-M1249 HydrophobicContact CB-CE 4.3Å; R1230-M1249 HydrophobicContact CB-SD 3.8Å; R1230-S1252 PolarHBondContact NH1-O 3.15Å
1231	K	89.4	Confident	87.1	Confident	99 Å²	99	36.2 Å²	36.2	43%	0.43	19%	0.191	S	C	.	.	H	α-helix	trans	-65.3	-37.1	174.6	-68.9	167	-157.3	159.9	0	112.3	G1227 D1228 V1229 G1235 M1249	G1227-K1231 WeakPolarHBondContact O-CE 3.06Å; G1227-K1231 VanDerWaalsContact O-CG 3.31Å; G1227-K1231 WeakPolarHBondContact O-CG 3.37Å; G1227-K1231 PolarHBondContact O-N 3.37Å; D1228-K1231 PolarHBondContact O-N 3.47Å; D1228-K1231 IonicContact OD1-NZ 2.9Å; D1228-K1231 PolarHBondContact OD1-NZ 3.3Å; V1229-K1231 PolarHBondContact O-N 3.37Å; K1231-G1235 PolarHBondContact O-N 2.94Å; K1231-M1249 HydrophobicContact CG-SD 4.24Å
1232	H	89.8	Confident	86.9	Confident	39 Å²	39	36.6 Å²	36.6	18%	0.181	19%	0.19	C	C	.	.	H	α-helix	trans	-60.1	-53	172.3	172.2	89.1	0	0	0	110.5	C1218 T1220 D1228 V1229 R1230 L1234 G1235 V1236 H1237	C1218-H1232 PolarHBondContact SG-NE2 2.75Å; T1220-H1232 PolarHBondContact OG1-CE1 3.4Å; T1220-H1232 PolarHBondContact OG1-NE2 3.18Å; D1228-H1232 PolarHBondContact O-N 3.03Å; V1229-H1232 WeakPolarHBondContact O-CB 3.34Å; V1229-H1232 PolarHBondContact O-N 3.5Å; R1230-H1232 VanDerWaalsContact C-N 3.34Å; H1232-L1234 PolarHBondContact O-N 3.03Å; H1232-G1235 PolarHBondContact O-N 3.4Å; H1232-V1236 WeakPolarHBondContact O-CB 3.46Å; H1232-V1236 PolarHBondContact O-N 2.87Å; H1232-H1237 AromaticContact NE2-CD2 3.35Å; H1232-H1237 PolarHBondContact NE2-CD2 3.47Å; H1232-H1237 VanDerWaalsContact NE2-CD2 3.35Å; H1232-H1237 AromaticContact NE2-CE1 3.93Å; H1232-H1237 AromaticContact NE2-NE2 2.74Å; H1232-H1237 PolarHBondContact NE2-NE2 3.47Å
1233	I	91.5	Very high	86.9	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.209	C	C	.	.	I	π-helix	trans	-60.3	-45.1	179	-65.2	165.6	0	0	0	111.3	L1160 Y1192 H1195 V1197 C1215 V1229 R1230 G1235 H1237 A1238	L1160-I1233 HydrophobicContact CD1-CB 4.46Å; L1160-I1233 HydrophobicContact CD1-CD1 3.5Å; L1160-I1233 HydrophobicContact CD1-CG2 4.24Å; Y1192-I1233 HydrophobicContact CD2-CB 4.45Å; Y1192-I1233 HydrophobicContact CD2-CG2 3.8Å; Y1192-I1233 HydrophobicContact CE2-CG2 4.37Å; H1195-I1233 HydrophobicContact CB-CD1 4.29Å; H1195-I1233 HydrophobicContact CB-CG2 3.71Å; V1197-I1233 HydrophobicContact CG2-CD1 3.91Å; C1215-I1233 HydrophobicContact CB-CG1 4.47Å; C1215-I1233 WeakPolarHBondContact SG-CG1 3.28Å; V1229-I1233 HydrophobicContact CG1-CD1 4.06Å; V1229-I1233 WeakPolarHBondContact O-CG1 3.35Å; V1229-I1233 PolarHBondContact O-N 2.9Å; R1230-I1233 PolarHBondContact O-N 3.2Å; I1233-G1235 VanDerWaalsContact C-N 3.25Å; I1233-G1235 PolarHBondContact O-N 3.21Å; I1233-H1237 HydrophobicContact CG2-CB 4.4Å; I1233-H1237 PolarHBondContact O-N 3.38Å; I1233-A1238 PolarHBondContact O-N 3.38Å
1234	L	92.7	Very high	87.5	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.188	C	C	.	.	I	π-helix	trans	-59.8	-31.7	174.2	-74.4	170.6	0	0	0	113.4	M1189 Y1192 R1230 H1232 H1239 V1240 K1245 A1248 M1249	M1189-L1234 HydrophobicContact SD-CD2 4.05Å; Y1192-L1234 HydrophobicContact CD2-CD2 3.4Å; Y1192-L1234 VanDerWaalsContact CD2-CD2 3.4Å; Y1192-L1234 HydrophobicContact CD2-CG 3.65Å; Y1192-L1234 HydrophobicContact CE2-CD1 4.29Å; Y1192-L1234 HydrophobicContact CE2-CD2 3.76Å; Y1192-L1234 HydrophobicContact CE2-CG 3.63Å; Y1192-L1234 HydrophobicContact CG-CD2 3.85Å; R1230-L1234 WeakPolarHBondContact O-CB 3.43Å; R1230-L1234 VanDerWaalsContact O-CG 3.31Å; R1230-L1234 WeakPolarHBondContact O-CG 3.5Å; R1230-L1234 PolarHBondContact O-N 2.89Å; H1232-L1234 PolarHBondContact O-N 3.03Å; L1234-H1239 PolarHBondContact O-N 3.07Å; L1234-V1240 HydrophobicContact CD2-CB 4.39Å; L1234-V1240 HydrophobicContact CD2-CG2 3.86Å; L1234-V1240 WeakPolarHBondContact O-CB 3.49Å; L1234-V1240 PolarHBondContact O-N 3.28Å; L1234-K1245 HydrophobicContact CB-CD 4.4Å; L1234-K1245 HydrophobicContact CB-CG 4.43Å; L1234-A1248 HydrophobicContact CD1-CB 4.09Å; L1234-A1248 HydrophobicContact CD2-CB 3.79Å; L1234-M1249 HydrophobicContact CD1-CG 3.65Å; L1234-M1249 HydrophobicContact CD1-SD 3.61Å
1235	G	89.4	Confident	88.3	Confident	18 Å²	18	30.9 Å²	30.9	19%	0.186	16%	0.156	C	C	.	.	I	π-helix	trans	-91.2	-39.1	-177.2	0	0	0	0	0	115.4	K1231 H1232 I1233	K1231-G1235 PolarHBondContact O-N 2.94Å; H1232-G1235 PolarHBondContact O-N 3.4Å; I1233-G1235 VanDerWaalsContact C-N 3.25Å; I1233-G1235 PolarHBondContact O-N 3.21Å
1236	V	88.7	Confident	88.5	Confident	44 Å²	44	34.5 Å²	34.5	27%	0.267	18%	0.179	S	C	.	.	I	π-helix	trans	-104.2	-33.6	-166.2	179.5	0	0	0	0	112.7	R539 H1232 H1239	R539-V1236 PolarHBondContact NH1-O 3.31Å; H1232-V1236 WeakPolarHBondContact O-CB 3.46Å; H1232-V1236 PolarHBondContact O-N 2.87Å; V1236-H1239 PolarHBondContact O-NE2 3.11Å
1237	H	90	Very high	88.6	Confident	43 Å²	43	34.1 Å²	34.1	20%	0.199	18%	0.179	C	C	.	.	I	π-helix	trans	-105.7	-48.9	-177.6	-65.2	-80.7	0	0	0	111.9	H1195 C1218 H1232 I1233	H1195-H1237 WeakPolarHBondContact NE2-CB 3.49Å; H1195-H1237 AromaticContact NE2-CG 3.5Å; H1195-H1237 AromaticContact NE2-ND1 3.65Å; C1218-H1237 PolarHBondContact SG-NE2 2.88Å; H1232-H1237 AromaticContact NE2-CD2 3.35Å; H1232-H1237 PolarHBondContact NE2-CD2 3.47Å; H1232-H1237 VanDerWaalsContact NE2-CD2 3.35Å; H1232-H1237 AromaticContact NE2-CE1 3.93Å; H1232-H1237 AromaticContact NE2-NE2 2.74Å; H1232-H1237 PolarHBondContact NE2-NE2 3.47Å; I1233-H1237 HydrophobicContact CG2-CB 4.4Å; I1233-H1237 PolarHBondContact O-N 3.38Å
1238	A	89.2	Confident	88.8	Confident	3 Å²	3	33 Å²	33	3%	0.025	17%	0.167	C	C	.	.	S	Bend	trans	-84.1	-10	177.9	0	0	0	0	0	114	R1188 V1191 I1233 V1240	R1188-A1238 VanDerWaalsContact CB-O 3.23Å; R1188-A1238 WeakPolarHBondContact CB-O 3.34Å; R1188-A1238 VanDerWaalsContact CG-O 3.29Å; R1188-A1238 WeakPolarHBondContact CG-O 3.36Å; R1188-A1238 WeakPolarHBondContact O-CB 3.16Å; V1191-A1238 HydrophobicContact CG1-CB 4.4Å; I1233-A1238 PolarHBondContact O-N 3.38Å; A1238-V1240 HydrophobicContact CB-CG2 4.04Å; A1238-V1240 PolarHBondContact O-N 3.38Å
1239	H	89.8	Confident	88.9	Confident	59 Å²	59	32.5 Å²	32.5	27%	0.273	16%	0.164	S	C	.	.			trans	50.7	30.4	177.5	-80.2	-85.7	0	0	0	114.8	R539 R1188 L1234 V1236 T1442	R539-H1239 PolarHBondContact NH1-NE2 3.39Å; R1188-H1239 WeakPolarHBondContact CD-O 3.46Å; R1188-H1239 PolarHBondContact NH1-O 3.1Å; L1234-H1239 PolarHBondContact O-N 3.07Å; V1236-H1239 PolarHBondContact O-NE2 3.11Å; H1239-T1442 PolarHBondContact ND1-OG1 3.4Å
1240	V	88.4	Confident	88.8	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.012	17%	0.173	C	C	.	.			trans	-66.6	127.4	-179.5	177	0	0	0	0	109.4	R1188 M1189 L1234 A1238 E1242 F1244 K1245 A1248	R1188-V1240 HydrophobicContact CB-CG2 3.97Å; M1189-V1240 HydrophobicContact SD-CG2 4.26Å; L1234-V1240 HydrophobicContact CD2-CB 4.39Å; L1234-V1240 HydrophobicContact CD2-CG2 3.86Å; L1234-V1240 WeakPolarHBondContact O-CB 3.49Å; L1234-V1240 PolarHBondContact O-N 3.28Å; A1238-V1240 HydrophobicContact CB-CG2 4.04Å; A1238-V1240 PolarHBondContact O-N 3.38Å; V1240-E1242 PolarHBondContact O-N 2.98Å; V1240-F1244 HydrophobicContact CG1-CB 4.24Å; V1240-K1245 HydrophobicContact CB-CG 4.29Å; V1240-K1245 HydrophobicContact CG1-CG 4.05Å; V1240-K1245 WeakPolarHBondContact O-CE 3.46Å; V1240-A1248 HydrophobicContact CG1-CB 4.38Å
1241	P	86.6	Confident	88.6	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.006	17%	0.167	C	C	.	.			trans	-61.4	136.6	179.9	-24.2	34.2	0	0	0	112.3	F1181 L1185 R1243 F1244 K1245 P1441	F1181-P1241 HydrophobicContact CZ-CG 4.48Å; L1185-P1241 HydrophobicContact CD2-CG 4.25Å; P1241-R1243 HydrophobicContact CB-CG 4.49Å; P1241-R1243 PolarHBondContact O-N 3.42Å; P1241-F1244 HydrophobicContact CB-CD2 4.01Å; P1241-F1244 HydrophobicContact CB-CE2 4.44Å; P1241-F1244 HydrophobicContact CG-CD2 4.27Å; P1241-F1244 PolarHBondContact O-N 3.12Å; P1241-K1245 PolarHBondContact O-N 3.4Å; P1241-P1441 HydrophobicContact CB-CB 3.7Å
1242	E	83.1	Confident	88.7	Confident	51 Å²	51	27.6 Å²	27.6	24%	0.238	15%	0.147	C	C	.	.	H	α-helix	trans	-45.4	-40	-176.9	-172.7	67.3	176	0	0	114.2	V1240 F1244 K1245 P1439	V1240-E1242 PolarHBondContact O-N 2.98Å; E1242-F1244 PolarHBondContact O-N 3.48Å; E1242-F1244 VanDerWaalsContact O-N 3.14Å; E1242-K1245 PolarHBondContact O-N 3.07Å; E1242-K1245 VanDerWaalsContact O-N 3.16Å; E1242-K1245 VanDerWaalsContact OE2-CD 3.28Å; E1242-K1245 WeakPolarHBondContact OE2-CD 3.25Å; E1242-K1245 VanDerWaalsContact OE2-CE 3.3Å; E1242-K1245 WeakPolarHBondContact OE2-CE 3.43Å; E1242-K1245 IonicContact OE2-NZ 3.86Å; E1242-K1245 PolarHBondContact OE2-NZ 3.01Å; E1242-P1439 VanDerWaalsContact OE2-O 3.11Å
1243	R	85.5	Confident	88.4	Confident	134 Å²	134	30 Å²	30	51%	0.506	15%	0.154	S	C	.	.	H	α-helix	trans	-61.9	-19.1	178.6	71.7	-172.2	-173.6	-103	1.6	114.4	P1241	P1241-R1243 HydrophobicContact CB-CG 4.49Å; P1241-R1243 PolarHBondContact O-N 3.42Å
1244	F	89	Confident	88.1	Confident	1 Å²	1	30.7 Å²	30.7	0%	0.004	16%	0.158	C	C	.	.	H	α-helix	trans	-111.5	-6.2	175.6	-52.5	-68.7	0	0	0	114	V1171 V1174 L1175 F1181 L1185 V1240 P1241 E1242 S1246 A1247 A1248	V1171-F1244 HydrophobicContact CG1-CD1 4.46Å; V1171-F1244 HydrophobicContact CG1-CE1 4.22Å; V1171-F1244 HydrophobicContact CG2-CD1 4.2Å; V1174-F1244 HydrophobicContact CB-CE1 4.49Å; V1174-F1244 HydrophobicContact CG1-CE1 4.21Å; L1175-F1244 HydrophobicContact CD1-CE1 4.25Å; L1175-F1244 HydrophobicContact CD1-CZ 3.68Å; L1175-F1244 HydrophobicContact CG-CZ 4.33Å; F1181-F1244 HydrophobicContact CE1-CD2 4.25Å; F1181-F1244 AromaticContact CE1-CE2 3.33Å; F1181-F1244 HydrophobicContact CE1-CE2 3.33Å; F1181-F1244 AromaticContact CE1-CZ 3.62Å; F1181-F1244 HydrophobicContact CE1-CZ 3.62Å; F1181-F1244 HydrophobicContact CZ-CD2 4.45Å; F1181-F1244 AromaticContact CZ-CE2 3.65Å; F1181-F1244 HydrophobicContact CZ-CE2 3.65Å; F1181-F1244 HydrophobicContact CZ-CZ 4.35Å; L1185-F1244 HydrophobicContact CD1-CD1 4.15Å; L1185-F1244 HydrophobicContact CD1-CD2 3.8Å; L1185-F1244 HydrophobicContact CD1-CE1 4.31Å; L1185-F1244 HydrophobicContact CD1-CE2 3.97Å; L1185-F1244 HydrophobicContact CD1-CG 3.9Å; L1185-F1244 HydrophobicContact CD1-CZ 4.22Å; L1185-F1244 HydrophobicContact CD2-CD2 3.78Å; L1185-F1244 HydrophobicContact CD2-CE2 4.32Å; L1185-F1244 HydrophobicContact CD2-CG 4.34Å; L1185-F1244 HydrophobicContact CG-CD2 4.43Å; V1240-F1244 HydrophobicContact CG1-CB 4.24Å; P1241-F1244 HydrophobicContact CB-CD2 4.01Å; P1241-F1244 HydrophobicContact CB-CE2 4.44Å; P1241-F1244 HydrophobicContact CG-CD2 4.27Å; P1241-F1244 PolarHBondContact O-N 3.12Å; E1242-F1244 PolarHBondContact O-N 3.48Å; E1242-F1244 VanDerWaalsContact O-N 3.14Å; F1244-S1246 PolarHBondContact O-N 3.1Å; F1244-A1247 WeakPolarHBondContact O-CA 3.46Å; F1244-A1247 WeakPolarHBondContact O-CB 3.39Å; F1244-A1247 PolarHBondContact O-N 3.46Å; F1244-A1248 PolarHBondContact O-N 2.98Å
1245	K	89.1	Confident	87.5	Confident	15 Å²	15	32.4 Å²	32.4	7%	0.065	17%	0.167	C	C	.	.	H	α-helix	trans	-61.3	-30.4	178.3	-69.1	-172.8	-155.8	151.6	0	112.4	L1234 V1240 P1241 E1242 M1249 P1439	L1234-K1245 HydrophobicContact CB-CD 4.4Å; L1234-K1245 HydrophobicContact CB-CG 4.43Å; V1240-K1245 HydrophobicContact CB-CG 4.29Å; V1240-K1245 HydrophobicContact CG1-CG 4.05Å; V1240-K1245 WeakPolarHBondContact O-CE 3.46Å; P1241-K1245 PolarHBondContact O-N 3.4Å; E1242-K1245 PolarHBondContact O-N 3.07Å; E1242-K1245 VanDerWaalsContact O-N 3.16Å; E1242-K1245 VanDerWaalsContact OE2-CD 3.28Å; E1242-K1245 WeakPolarHBondContact OE2-CD 3.25Å; E1242-K1245 VanDerWaalsContact OE2-CE 3.3Å; E1242-K1245 WeakPolarHBondContact OE2-CE 3.43Å; E1242-K1245 IonicContact OE2-NZ 3.86Å; E1242-K1245 PolarHBondContact OE2-NZ 3.01Å; K1245-M1249 VanDerWaalsContact O-CB 3.22Å; K1245-M1249 WeakPolarHBondContact O-CB 3.38Å; K1245-M1249 WeakPolarHBondContact O-CG 3.01Å; K1245-M1249 PolarHBondContact O-N 3.01Å; K1245-P1439 PolarHBondContact NZ-O 3.12Å
1246	S	86	Confident	86.6	Confident	93 Å²	93	40.8 Å²	40.8	65%	0.65	19%	0.193	S	C	*	.	H	α-helix	trans	-61.8	-43.6	169.8	-58.6	0	0	0	0	112.3	F1244 C1250	F1244-S1246 PolarHBondContact O-N 3.1Å; S1246-C1250 WeakPolarHBondContact O-CB 3.42Å; S1246-C1250 PolarHBondContact O-N 2.68Å; S1246-C1250 PolarHBondContact O-SG 2.94Å; S1246-C1250 VanDerWaalsContact O-SG 3.4Å
1247	A	87.8	Confident	85.6	Confident	12 Å²	12	43.1 Å²	43.1	10%	0.099	20%	0.204	C	C	.	.	H	α-helix	trans	-68.1	-45.8	177.8	0	0	0	0	0	111.4	F1167 Q1170 F1244 M1249 C1250 S1251	F1167-A1247 HydrophobicContact CD2-CB 4.5Å; F1167-A1247 HydrophobicContact CE2-CB 4.4Å; Q1170-A1247 HydrophobicContact CB-CB 3.96Å; F1244-A1247 WeakPolarHBondContact O-CA 3.46Å; F1244-A1247 WeakPolarHBondContact O-CB 3.39Å; F1244-A1247 PolarHBondContact O-N 3.46Å; A1247-M1249 PolarHBondContact O-N 3Å; A1247-C1250 CarbonylContact O-C 3.55Å; A1247-C1250 WeakPolarHBondContact O-CA 3.22Å; A1247-C1250 WeakPolarHBondContact O-CB 3.42Å; A1247-C1250 PolarHBondContact O-N 2.68Å; A1247-S1251 PolarHBondContact O-N 3.33Å; A1247-S1251 PolarHBondContact O-OG 3.07Å
1248	A	90.9	Very high	84.7	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.5	-41.1	175.3	0	0	0	0	0	112.7	F1167 M1189 L1234 V1240 F1244 C1250 S1251 S1252	F1167-A1248 HydrophobicContact CE2-CB 4.05Å; M1189-A1248 HydrophobicContact CE-CB 4.08Å; M1189-A1248 HydrophobicContact SD-CB 3.58Å; M1189-A1248 VanDerWaalsContact SD-CB 3.58Å; L1234-A1248 HydrophobicContact CD1-CB 4.09Å; L1234-A1248 HydrophobicContact CD2-CB 3.79Å; V1240-A1248 HydrophobicContact CG1-CB 4.38Å; F1244-A1248 PolarHBondContact O-N 2.98Å; A1248-C1250 VanDerWaalsContact C-N 3.27Å; A1248-C1250 PolarHBondContact O-N 3.03Å; A1248-S1251 PolarHBondContact O-OG 3.22Å; A1248-S1252 WeakPolarHBondContact O-CB 3.38Å; A1248-S1252 PolarHBondContact O-N 3.39Å; A1248-S1252 PolarHBondContact O-OG 3.03Å
1249	M	89.3	Confident	84.1	Confident	36 Å²	36	47.8 Å²	47.8	18%	0.177	23%	0.227	C	C	.	.	H	α-helix	trans	-68.5	-24.2	173.9	-75.8	-68.6	-60.9	0	0	113	R1230 K1231 L1234 K1245 A1247 R1253	R1230-M1249 HydrophobicContact CB-CE 4.3Å; R1230-M1249 HydrophobicContact CB-SD 3.8Å; K1231-M1249 HydrophobicContact CG-SD 4.24Å; L1234-M1249 HydrophobicContact CD1-CG 3.65Å; L1234-M1249 HydrophobicContact CD1-SD 3.61Å; K1245-M1249 VanDerWaalsContact O-CB 3.22Å; K1245-M1249 WeakPolarHBondContact O-CB 3.38Å; K1245-M1249 WeakPolarHBondContact O-CG 3.01Å; K1245-M1249 PolarHBondContact O-N 3.01Å; A1247-M1249 PolarHBondContact O-N 3Å; M1249-R1253 WeakPolarHBondContact O-CG 3.36Å
1250	C	86.7	Confident	83.7	Confident	28 Å²	28	50.5 Å²	50.5	19%	0.189	24%	0.238	C	C	.	.	H	α-helix	trans	-82.1	-43	173.7	-78.7	0	0	0	0	112.2	Q1170 S1246 A1247 A1248 S1252 R1253 L1267	Q1170-C1250 VanDerWaalsContact OE1-CB 3.24Å; S1246-C1250 WeakPolarHBondContact O-CB 3.42Å; S1246-C1250 PolarHBondContact O-N 2.68Å; S1246-C1250 PolarHBondContact O-SG 2.94Å; S1246-C1250 VanDerWaalsContact O-SG 3.4Å; A1247-C1250 CarbonylContact O-C 3.55Å; A1247-C1250 WeakPolarHBondContact O-CA 3.22Å; A1247-C1250 WeakPolarHBondContact O-CB 3.42Å; A1247-C1250 PolarHBondContact O-N 2.68Å; A1248-C1250 VanDerWaalsContact C-N 3.27Å; A1248-C1250 PolarHBondContact O-N 3.03Å; C1250-S1252 PolarHBondContact O-N 2.86Å; C1250-R1253 PolarHBondContact O-N 2.8Å; C1250-L1267 WeakPolarHBondContact O-CD2 3.35Å
1251	S	88.5	Confident	83.5	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-74	-10.1	176.2	64.8	0	0	0	0	114.3	Y1162 S1163 F1167 A1247 A1248	Y1162-S1251 CarbonylContact C-O 3.6Å; Y1162-S1251 WeakPolarHBondContact CA-O 3.41Å; S1163-S1251 PolarHBondContact N-O 3.44Å; F1167-S1251 WeakPolarHBondContact CD2-OG 3.41Å; A1247-S1251 PolarHBondContact O-N 3.33Å; A1247-S1251 PolarHBondContact O-OG 3.07Å; A1248-S1251 PolarHBondContact O-OG 3.22Å
1252	S	89.7	Confident	83.4	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	32	173.6	66.4	0	0	0	0	113.5	L1161 Y1192 R1230 A1248 C1250 L1254	L1161-S1252 WeakPolarHBondContact O-CB 3.46Å; Y1192-S1252 WeakPolarHBondContact OH-CB 3.39Å; Y1192-S1252 PolarHBondContact OH-OG 3.27Å; Y1192-S1252 VanDerWaalsContact OH-OG 3.06Å; R1230-S1252 PolarHBondContact NH1-O 3.15Å; A1248-S1252 WeakPolarHBondContact O-CB 3.38Å; A1248-S1252 PolarHBondContact O-N 3.39Å; A1248-S1252 PolarHBondContact O-OG 3.03Å; C1250-S1252 PolarHBondContact O-N 2.86Å; S1252-L1254 PolarHBondContact O-N 3.09Å
1253	R	85	Confident	83.5	Confident	89 Å²	89	55.5 Å²	55.5	34%	0.336	27%	0.267	S	S	.	.			trans	-70.7	114.9	170.6	-72.7	-177	174.2	-142.9	7.5	110.3	M1249 C1250 Y1262 L1267	M1249-R1253 WeakPolarHBondContact O-CG 3.36Å; C1250-R1253 PolarHBondContact O-N 2.8Å; R1253-Y1262 HydrophobicContact CB-CD2 3.82Å; R1253-Y1262 HydrophobicContact CB-CE2 4.29Å; R1253-Y1262 WeakPolarHBondContact O-CD2 3.48Å; R1253-Y1262 PolarHBondContact O-N 3.35Å; R1253-L1267 HydrophobicContact CB-CD2 3.7Å
1254	L	84.8	Confident	83.4	Confident	16 Å²	16	52.5 Å²	52.5	8%	0.084	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-89.2	150	170.6	-50	-177.7	0	0	0	110.3	V1158 L1160 F1226 S1252 F1260 L1261 Y1262	V1158-L1254 HydrophobicContact CG1-CD1 3.96Å; L1160-L1254 HydrophobicContact CD2-CD1 4.41Å; F1226-L1254 HydrophobicContact CE1-CD1 3.88Å; F1226-L1254 HydrophobicContact CZ-CD1 3.85Å; S1252-L1254 PolarHBondContact O-N 3.09Å; L1254-F1260 CarbonylContact C-O 3.59Å; L1254-F1260 VanDerWaalsContact CA-O 3.23Å; L1254-F1260 WeakPolarHBondContact CA-O 3.3Å; L1254-L1261 HydrophobicContact CD2-CB 4.32Å; L1254-L1261 HydrophobicContact CD2-CD1 4.15Å; L1254-Y1262 WeakPolarHBondContact O-CE2 3.29Å
1255	N	79.7	Confident	83	Confident	35 Å²	35	56.5 Å²	56.5	19%	0.187	29%	0.289	C	S	.	.			trans	-62.2	146.2	170.6	-166.8	27.2	0	0	0	110.3	D1257 D1258 Y1259 F1260 Y1262	N1255-D1257 VanDerWaalsContact C-N 3.3Å; N1255-D1257 PolarHBondContact O-N 2.8Å; N1255-D1258 PolarHBondContact ND2-OD2 3.19Å; N1255-Y1259 VanDerWaalsContact O-CA 3.28Å; N1255-Y1259 WeakPolarHBondContact O-CA 3.46Å; N1255-Y1259 PolarHBondContact O-N 3.2Å; N1255-Y1259 VanDerWaalsContact O-N 3.15Å; N1255-F1260 PolarHBondContact N-O 3.24Å; N1255-Y1262 HydrophobicContact CB-CE1 3.98Å; N1255-Y1262 WeakPolarHBondContact OD1-CE1 3.3Å; N1255-Y1262 PolarHBondContact OD1-OH 2.98Å
1256	R	71.2	Confident	82.7	Confident	195 Å²	195	60.1 Å²	60.1	74%	0.736	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-29.6	-173.7	-161.1	-170.2	69.9	158.7	3.1	112.6
1257	D	68.1	Low	82.7	Confident	92 Å²	92	55.8 Å²	55.8	49%	0.492	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-45.7	-167.4	-45.3	-59.1	0	0	0	110.5	N1255	N1255-D1257 VanDerWaalsContact C-N 3.3Å; N1255-D1257 PolarHBondContact O-N 2.8Å
1258	D	70	Confident	82.4	Confident	100 Å²	100	57.6 Å²	57.6	54%	0.535	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-9.3	-179.2	-33.5	-74.8	0	0	0	115.2	N1255 F1260	N1255-D1258 PolarHBondContact ND2-OD2 3.19Å; D1258-F1260 HydrophobicContact CB-CD2 3.83Å; D1258-F1260 WeakPolarHBondContact O-CD2 3.48Å; D1258-F1260 PolarHBondContact O-N 2.95Å
1259	Y	76.7	Confident	81.7	Confident	44 Å²	44	63.2 Å²	63.2	17%	0.173	31%	0.311	C	S	.	.			trans	57.7	11	-174.3	-61.3	-96.6	0	0	0	116.6	V1158 I1199 F1226 N1255	V1158-Y1259 HydrophobicContact CG1-CD1 3.76Å; V1158-Y1259 HydrophobicContact CG1-CG 4.03Å; V1158-Y1259 HydrophobicContact CG2-CD1 4Å; V1158-Y1259 HydrophobicContact CG2-CE1 4.36Å; V1158-Y1259 HydrophobicContact CG2-CG 4.11Å; I1199-Y1259 HydrophobicContact CD1-CE1 4.19Å; F1226-Y1259 HydrophobicContact CD2-CE1 4.23Å; F1226-Y1259 HydrophobicContact CE2-CD1 4.27Å; F1226-Y1259 HydrophobicContact CE2-CE1 4.17Å; F1226-Y1259 HydrophobicContact CZ-CD1 4.19Å; F1226-Y1259 HydrophobicContact CZ-CE1 4.44Å; N1255-Y1259 VanDerWaalsContact O-CA 3.28Å; N1255-Y1259 WeakPolarHBondContact O-CA 3.46Å; N1255-Y1259 PolarHBondContact O-N 3.2Å; N1255-Y1259 VanDerWaalsContact O-N 3.15Å
1260	F	80.6	Confident	81	Confident	116 Å²	116	63.8 Å²	63.8	51%	0.509	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-68.8	152.5	168	-81.5	-100.3	0	0	0	111.9	L1254 N1255 D1258	L1254-F1260 CarbonylContact C-O 3.59Å; L1254-F1260 VanDerWaalsContact CA-O 3.23Å; L1254-F1260 WeakPolarHBondContact CA-O 3.3Å; N1255-F1260 PolarHBondContact N-O 3.24Å; D1258-F1260 HydrophobicContact CB-CD2 3.83Å; D1258-F1260 WeakPolarHBondContact O-CD2 3.48Å; D1258-F1260 PolarHBondContact O-N 2.95Å
1261	L	84.1	Confident	80	Confident	45 Å²	45	64 Å²	64	24%	0.236	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-63.5	134.8	171.4	-170.8	70.6	0	0	0	110.2	L1161 L1254 L1267	L1161-L1261 HydrophobicContact CB-CB 4.25Å; L1161-L1261 HydrophobicContact CB-CD2 4.49Å; L1254-L1261 HydrophobicContact CD2-CB 4.32Å; L1254-L1261 HydrophobicContact CD2-CD1 4.15Å; L1261-L1267 HydrophobicContact CD1-CD1 4.3Å; L1261-L1267 HydrophobicContact CG-CD1 4.26Å
1262	Y	85.4	Confident	78.9	Confident	34 Å²	34	69.1 Å²	69.1	13%	0.133	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-63.5	155.6	170	-71.5	-69.3	0	0	0	110.9	R1253 L1254 N1255 L1267 L1270	R1253-Y1262 HydrophobicContact CB-CD2 3.82Å; R1253-Y1262 HydrophobicContact CB-CE2 4.29Å; R1253-Y1262 WeakPolarHBondContact O-CD2 3.48Å; R1253-Y1262 PolarHBondContact O-N 3.35Å; L1254-Y1262 WeakPolarHBondContact O-CE2 3.29Å; N1255-Y1262 HydrophobicContact CB-CE1 3.98Å; N1255-Y1262 WeakPolarHBondContact OD1-CE1 3.3Å; N1255-Y1262 PolarHBondContact OD1-OH 2.98Å; Y1262-L1267 HydrophobicContact CD2-CD2 4.4Å; Y1262-L1267 WeakPolarHBondContact O-CD1 3.21Å; Y1262-L1270 HydrophobicContact CD2-CD1 4.39Å
1263	T	84.8	Confident	77.1	Confident	81 Å²	81	72.6 Å²	72.6	50%	0.497	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-67.6	153.3	179.5	69.1	0	0	0	0	111.7	S1265 Q1266 L1267	T1263-S1265 PolarHBondContact O-N 2.83Å; T1263-S1265 VanDerWaalsContact O-N 3.13Å; T1263-Q1266 VanDerWaalsContact N-OE1 3.09Å; T1263-Q1266 WeakPolarHBondContact O-CA 3.37Å; T1263-Q1266 WeakPolarHBondContact O-CB 3.46Å; T1263-Q1266 PolarHBondContact O-N 3.25Å; T1263-Q1266 WeakPolarHBondContact OG1-CG 3.42Å; T1263-Q1266 PolarHBondContact OG1-OE1 3.17Å; T1263-L1267 WeakPolarHBondContact O-CG 3.45Å; T1263-L1267 PolarHBondContact O-N 3.31Å
1264	D	83.8	Confident	74.7	Confident	70 Å²	70	74.6 Å²	74.6	37%	0.374	40%	0.395	S	S	.	.	H	α-helix	trans	-53	-39.7	-177.2	-76.6	0.8	0	0	0	113.3	S1163 V1166 L1267 L1268	S1163-D1264 WeakPolarHBondContact CB-OD1 3.45Å; S1163-D1264 VanDerWaalsContact OG-CG 3.25Å; S1163-D1264 PolarHBondContact OG-OD1 3.01Å; S1163-D1264 PolarHBondContact OG-OD2 2.61Å; V1166-D1264 HydrophobicContact CG2-CB 3.84Å; D1264-L1267 PolarHBondContact O-N 3.03Å; D1264-L1268 WeakPolarHBondContact O-CB 3.5Å; D1264-L1268 WeakPolarHBondContact O-CD1 3.46Å; D1264-L1268 VanDerWaalsContact O-CG 3.28Å; D1264-L1268 WeakPolarHBondContact O-CG 3.22Å; D1264-L1268 PolarHBondContact O-N 3.38Å
1265	S	81.1	Confident	72.2	Confident	85 Å²	85	77.2 Å²	77.2	59%	0.594	43%	0.425	S	S	*	.	H	α-helix	trans	-59.6	-47.3	173.6	178.8	0	0	0	0	112.4	T1263 L1268 M1269	T1263-S1265 PolarHBondContact O-N 2.83Å; T1263-S1265 VanDerWaalsContact O-N 3.13Å; S1265-L1268 PolarHBondContact O-N 3.36Å; S1265-M1269 WeakPolarHBondContact O-CB 3.43Å; S1265-M1269 VanDerWaalsContact O-CG 3.31Å; S1265-M1269 WeakPolarHBondContact O-CG 3.31Å; S1265-M1269 PolarHBondContact O-N 3.14Å
1266	Q	83.5	Confident	70	Confident	92 Å²	92	84.9 Å²	84.9	43%	0.43	45%	0.452	S	S	.	.	H	α-helix	trans	-64.6	-41.3	176.6	-67.9	166.4	-13.8	0	0	111.4	T1263 M1269 L1270	T1263-Q1266 VanDerWaalsContact N-OE1 3.09Å; T1263-Q1266 WeakPolarHBondContact O-CA 3.37Å; T1263-Q1266 WeakPolarHBondContact O-CB 3.46Å; T1263-Q1266 PolarHBondContact O-N 3.25Å; T1263-Q1266 WeakPolarHBondContact OG1-CG 3.42Å; T1263-Q1266 PolarHBondContact OG1-OE1 3.17Å; Q1266-M1269 PolarHBondContact O-N 2.95Å; Q1266-L1270 WeakPolarHBondContact O-CB 3.29Å; Q1266-L1270 WeakPolarHBondContact O-CD1 3.11Å; Q1266-L1270 WeakPolarHBondContact O-CG 3.32Å; Q1266-L1270 PolarHBondContact O-N 2.96Å
1267	L	84.7	Confident	68.2	Low	1 Å²	1	83.5 Å²	83.5	1%	0.005	46%	0.459	C	S	.	.	H	α-helix	trans	-64.7	-40.8	177.8	-64.5	175.6	0	0	0	112.3	V1166 C1250 R1253 L1261 Y1262 T1263 D1264 L1270 A1271	V1166-L1267 HydrophobicContact CB-CB 4.45Å; V1166-L1267 HydrophobicContact CB-CD1 4.5Å; V1166-L1267 HydrophobicContact CG1-CB 3.88Å; V1166-L1267 HydrophobicContact CG2-CB 3.93Å; V1166-L1267 HydrophobicContact CG2-CD1 4.07Å; C1250-L1267 WeakPolarHBondContact O-CD2 3.35Å; R1253-L1267 HydrophobicContact CB-CD2 3.7Å; L1261-L1267 HydrophobicContact CD1-CD1 4.3Å; L1261-L1267 HydrophobicContact CG-CD1 4.26Å; Y1262-L1267 HydrophobicContact CD2-CD2 4.4Å; Y1262-L1267 WeakPolarHBondContact O-CD1 3.21Å; T1263-L1267 WeakPolarHBondContact O-CG 3.45Å; T1263-L1267 PolarHBondContact O-N 3.31Å; D1264-L1267 PolarHBondContact O-N 3.03Å; L1267-L1270 PolarHBondContact O-N 2.99Å; L1267-A1271 WeakPolarHBondContact O-CB 3.48Å; L1267-A1271 PolarHBondContact O-N 3.45Å
1268	L	81.6	Confident	66.4	Low	50 Å²	50	82.1 Å²	82.1	26%	0.262	46%	0.46	S	S	.	.	H	α-helix	trans	-65	-45.2	174.7	-74.1	163.5	0	0	0	111.7	V1166 H1169 D1264 S1265 L1270 A1271 N1272	V1166-L1268 HydrophobicContact CG2-CG 4.2Å; H1169-L1268 HydrophobicContact CB-CD2 4.15Å; H1169-L1268 VanDerWaalsContact CD2-CD2 3.45Å; H1169-L1268 WeakPolarHBondContact CD2-CD2 3.46Å; D1264-L1268 WeakPolarHBondContact O-CB 3.5Å; D1264-L1268 WeakPolarHBondContact O-CD1 3.46Å; D1264-L1268 VanDerWaalsContact O-CG 3.28Å; D1264-L1268 WeakPolarHBondContact O-CG 3.22Å; D1264-L1268 PolarHBondContact O-N 3.38Å; S1265-L1268 PolarHBondContact O-N 3.36Å; L1268-L1270 VanDerWaalsContact C-N 3.28Å; L1268-L1270 PolarHBondContact O-N 3.1Å; L1268-A1271 WeakPolarHBondContact O-CB 3.22Å; L1268-A1271 PolarHBondContact O-N 3.43Å; L1268-A1271 VanDerWaalsContact O-N 3.1Å; L1268-N1272 WeakPolarHBondContact O-CB 3.46Å; L1268-N1272 PolarHBondContact O-N 3.3Å
1269	M	77.4	Confident	64.7	Low	119 Å²	119	83.4 Å²	83.4	59%	0.586	47%	0.467	S	S	*	.	H	α-helix	trans	-58.8	-39.2	174.7	-75.5	-65.6	-76.6	0	0	112.5	S1265 Q1266 S1273	S1265-M1269 WeakPolarHBondContact O-CB 3.43Å; S1265-M1269 VanDerWaalsContact O-CG 3.31Å; S1265-M1269 WeakPolarHBondContact O-CG 3.31Å; S1265-M1269 PolarHBondContact O-N 3.14Å; Q1266-M1269 PolarHBondContact O-N 2.95Å; M1269-S1273 PolarHBondContact O-OG 2.82Å
1270	L	73.1	Confident	63	Low	48 Å²	48	85.4 Å²	85.4	25%	0.251	48%	0.48	S	S	.	.	H	α-helix	trans	-74.3	-22.8	176.6	-69.7	169.5	0	0	0	113.5	Y1262 Q1266 L1267 L1268	Y1262-L1270 HydrophobicContact CD2-CD1 4.39Å; Q1266-L1270 WeakPolarHBondContact O-CB 3.29Å; Q1266-L1270 WeakPolarHBondContact O-CD1 3.11Å; Q1266-L1270 WeakPolarHBondContact O-CG 3.32Å; Q1266-L1270 PolarHBondContact O-N 2.96Å; L1267-L1270 PolarHBondContact O-N 2.99Å; L1268-L1270 VanDerWaalsContact C-N 3.28Å; L1268-L1270 PolarHBondContact O-N 3.1Å
1271	A	66.5	Low	60.7	Low	33 Å²	33	85.5 Å²	85.5	27%	0.273	50%	0.495	S	S	.	.	H	α-helix	trans	-79.6	-41.1	174	0	0	0	0	0	112.1	Q1170 L1267 L1268 S1273	Q1170-A1271 HydrophobicContact CG-CB 4.32Å; L1267-A1271 WeakPolarHBondContact O-CB 3.48Å; L1267-A1271 PolarHBondContact O-N 3.45Å; L1268-A1271 WeakPolarHBondContact O-CB 3.22Å; L1268-A1271 PolarHBondContact O-N 3.43Å; L1268-A1271 VanDerWaalsContact O-N 3.1Å; A1271-S1273 PolarHBondContact O-N 3.34Å
1272	N	64.1	Low	58.4	Low	106 Å²	106	87 Å²	87	57%	0.567	51%	0.513	S	S	*	.	S	Bend	trans	-79.2	7.1	-174.3	-67.4	-16.7	0	0	0	114.5	L1268 P1274	L1268-N1272 WeakPolarHBondContact O-CB 3.46Å; L1268-N1272 PolarHBondContact O-N 3.3Å; N1272-P1274 WeakPolarHBondContact O-CD 3.31Å
1273	S	52.1	Low	56	Low	74 Å²	74	90.5 Å²	90.5	52%	0.517	53%	0.534	S	S	.	.			trans	-107.8	87.5	-173.8	-68.9	0	0	0	0	112.8	M1269 A1271 G1275	M1269-S1273 PolarHBondContact O-OG 2.82Å; A1271-S1273 PolarHBondContact O-N 3.34Å; S1273-G1275 PolarHBondContact O-N 3.17Å
1274	P	34.9	Very low	53.4	Low	131 Å²	131	89.9 Å²	89.9	85%	0.851	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	97.2	-176.4	29.6	-36.2	0	0	0	112.7	N1272	N1272-P1274 WeakPolarHBondContact O-CD 3.31Å
1275	G	32.1	Very low	50.8	Low	70 Å²	70	90.6 Å²	90.6	72%	0.722	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	87.7	56.6	159.3	0	0	0	0	0	116.4	S1273	S1273-G1275 PolarHBondContact O-N 3.17Å
1276	R	33.7	Very low	48.4	Very low	197 Å²	197	90.6 Å²	90.6	74%	0.743	56%	0.564	S	S	*	*			trans	-149.9	135.2	154.9	-124.1	172.1	-74.7	-167.2	2.7	110.9	A1278	R1276-A1278 PolarHBondContact O-N 2.99Å
1277	N	33.3	Very low	45.9	Very low	166 Å²	166	91.8 Å²	91.8	89%	0.888	58%	0.583	S	S	*	*			trans	-72.9	87.7	159	-72.2	-2.7	0	0	0	106.5
1278	A	30.8	Very low	43.1	Very low	63 Å²	63	96.1 Å²	96.1	52%	0.521	61%	0.613	S	S	.	*			trans	-77.3	125.6	169.9	0	0	0	0	0	108.4	R1276 I1280	R1276-A1278 PolarHBondContact O-N 2.99Å; A1278-I1280 PolarHBondContact O-N 3.23Å
1279	N	33.6	Very low	40.7	Very low	126 Å²	126	103.7 Å²	103.7	67%	0.674	64%	0.644	S	S	*	*			trans	-65.8	118	176	-69.1	-13.8	0	0	0	108.7	S1281 A1282	N1279-S1281 PolarHBondContact O-N 3.32Å; N1279-S1281 VanDerWaalsContact O-N 3.1Å; N1279-A1282 PolarHBondContact O-N 3.23Å
1280	I	41.5	Very low	38.4	Very low	87 Å²	87	103.4 Å²	103.4	45%	0.446	65%	0.649	S	S	.	*	G	3₁₀ helix	trans	-61	-24.8	-173.9	-64.2	177.7	0	0	0	111.6	A1278 A1282 L1283	A1278-I1280 PolarHBondContact O-N 3.23Å; I1280-A1282 PolarHBondContact O-N 2.87Å; I1280-L1283 PolarHBondContact O-N 2.8Å
1281	S	33.5	Very low	36.4	Very low	117 Å²	117	109.4 Å²	109.4	82%	0.818	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-51.8	-20.3	170.7	-43.3	0	0	0	0	115.2	N1279	N1279-S1281 PolarHBondContact O-N 3.32Å; N1279-S1281 VanDerWaalsContact O-N 3.1Å
1282	A	34.5	Very low	34.5	Very low	76 Å²	76	112.2 Å²	112.2	63%	0.628	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-94.3	-11	179.1	0	0	0	0	0	114.6	N1279 I1280	N1279-A1282 PolarHBondContact O-N 3.23Å; I1280-A1282 PolarHBondContact O-N 2.87Å
1283	L	35.5	Very low	32.8	Very low	109 Å²	109	114.8 Å²	114.8	57%	0.571	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	-13.6	-176.4	-85.8	149.7	0	0	0	113.7	I1280 A1285	I1280-L1283 PolarHBondContact O-N 2.8Å; L1283-A1285 PolarHBondContact O-N 2.65Å
1284	G	30.3	Very low	31.6	Very low	68 Å²	68	117.7 Å²	117.7	70%	0.701	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-13.6	170.5	0	0	0	0	0	114.5
1285	A	30	Very low	31.3	Very low	85 Å²	85	117.5 Å²	117.5	70%	0.702	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	4.5	-175.5	0	0	0	0	0	114.6	L1283	L1283-A1285 PolarHBondContact O-N 2.65Å
1286	A	30.3	Very low	31.2	Very low	84 Å²	84	121.5 Å²	121.5	69%	0.694	70%	0.702	S	S	*	*	S	Bend	trans	-132.9	31.7	-168.7	0	0	0	0	0	114.1
1287	S	29.4	Very low	30.8	Very low	117 Å²	117	118.8 Å²	118.8	82%	0.818	70%	0.703	S	S	*	*	S	Bend	trans	-150	42	174.6	-164.5	0	0	0	0	113.2
1288	S	27	Very low	30.5	Very low	92 Å²	92	116.2 Å²	116.2	64%	0.643	70%	0.698	S	S	*	*			trans	-146.5	46.5	-174.5	43	0	0	0	0	112.9
1289	K	31.1	Very low	30.4	Very low	210 Å²	210	117.9 Å²	117.9	91%	0.913	71%	0.711	S	S	*	*			trans	-126.5	95.5	156.7	-82.1	-165.5	173.9	-175.6	0	110.7
1290	T	29.8	Very low	30.4	Very low	112 Å²	112	117.2 Å²	117.2	69%	0.687	71%	0.714	S	S	*	*			trans	-43.9	151.1	163.7	36	0	0	0	0	115.6
1291	Q	29.6	Very low	29.8	Very low	175 Å²	175	121.1 Å²	121.1	82%	0.818	73%	0.73	S	S	*	*			trans	63.1	144.3	140.1	-72.4	163.9	-45.2	0	0	119.2
1292	S	26.9	Very low	29.5	Very low	92 Å²	92	124.6 Å²	124.6	64%	0.643	73%	0.73	S	S	*	*			cis	-171.3	168.6	-3.6	46.5	0	0	0	0	112.8
1293	H	28.5	Very low	29.3	Very low	160 Å²	160	128.1 Å²	128.1	74%	0.741	73%	0.733	S	S	*	*			trans	74.1	118.6	152.6	-75.2	-67.2	0	0	0	122
1294	L	28.2	Very low	29	Very low	135 Å²	135	132.4 Å²	132.4	71%	0.707	74%	0.742	S	S	*	*				72.6	120.5	127.4	-66.3	167.4	0	0	0	122.9
1295	N	26.9	Very low	29	Very low	126 Å²	126	137.8 Å²	137.8	67%	0.674	75%	0.749	S	S	*	*			trans	80.2	144.7	130.6	-74	6.8	0	0	0	123.2
1296	H	30.2	Very low	29.1	Very low	155 Å²	155	137.9 Å²	137.9	72%	0.718	74%	0.738	S	S	*	*			trans	60.6	108.9	160.8	-62.9	-53.9	0	0	0	120.4
1297	N	25.6	Very low	29.4	Very low	140 Å²	140	140 Å²	140	75%	0.749	74%	0.737	S	S	*	*				43.8	151.8	114.4	-68.1	-1.1	0	0	0	122
1298	S	27.5	Very low	29.7	Very low	112 Å²	112	138.5 Å²	138.5	78%	0.783	73%	0.726	S	S	*	*			trans	70.8	105.2	157.8	36.9	0	0	0	0	119.3
1299	A	27.9	Very low	30.2	Very low	98 Å²	98	141.1 Å²	141.1	81%	0.81	73%	0.734	S	S	*	*				74.7	160.4	129.8	0	0	0	0	0	118.7
1300	P	34.5	Very low	30.3	Very low	111 Å²	111	137.5 Å²	137.5	72%	0.721	72%	0.724	S	S	*	*			trans	-112	-178	-156	42.3	-35.5	0	0	0	115.5
1301	H	28.7	Very low	30.7	Very low	169 Å²	169	137.2 Å²	137.2	78%	0.782	73%	0.727	S	S	*	*			trans	91.4	137.8	153.1	-95.1	-61.5	0	0	0	120.5
1302	K	28	Very low	30.7	Very low	191 Å²	191	134 Å²	134	83%	0.83	72%	0.724	S	S	*	*			trans	75.1	157.9	155.4	-70.3	173.6	-179.2	-178.9	0	117.2
1303	H	30.2	Very low	31.1	Very low	149 Å²	149	134.8 Å²	134.8	69%	0.69	73%	0.727	S	S	*	*			cis	176.8	133.1	-27.5	170.1	27.5	0	0	0	107
1304	R	29	Very low	31	Very low	199 Å²	199	134.6 Å²	134.6	75%	0.751	73%	0.726	S	S	*	*			trans	-169.6	120	141.5	-116.3	167.6	170	170.7	-5.5	114.2	N1306	R1304-N1306 PolarHBondContact NE-OD1 2.99Å
1305	Q	30.1	Very low	31	Very low	182 Å²	182	134.9 Å²	134.9	85%	0.85	73%	0.728	S	S	*	*				-128	124.2	117.2	-100	178.8	-27.1	0	0	106.6
1306	N	30.8	Very low	31.2	Very low	87 Å²	87	135 Å²	135	47%	0.465	73%	0.733	S	S	.	*			trans	-80	160.9	160.7	-95.8	60.9	0	0	0	106.5	R1304	R1304-N1306 PolarHBondContact NE-OD1 2.99Å
1307	D	36.7	Very low	31.3	Very low	127 Å²	127	132.2 Å²	132.2	68%	0.679	73%	0.729	S	S	*	*			cis	-156.6	172.6	4.4	-96.9	-45.1	0	0	0	105.7
1308	S	35.7	Very low	31.2	Very low	86 Å²	86	131.3 Å²	131.3	60%	0.601	72%	0.724	S	S	*	*			cis	-171.4	148.9	-34.2	-96.2	0	0	0	0	106.5
1309	D	38.6	Very low	31.2	Very low	148 Å²	148	136 Å²	136	79%	0.791	73%	0.725	S	S	*	*				171	155.8	120.3	-99.3	-20.3	0	0	0	116.2
1310	N	33.8	Very low	31.1	Very low	133 Å²	133	140.2 Å²	140.2	71%	0.711	73%	0.725	S	S	*	*			trans	59.3	91.8	157.2	-73.5	-44.3	0	0	0	121.3
1311	S	36.3	Very low	30.7	Very low	107 Å²	107	144.8 Å²	144.8	75%	0.748	73%	0.728	S	S	*	*				83.8	147	118.8	83	0	0	0	0	117.6
1312	S	31.1	Very low	30.6	Very low	108 Å²	108	146.2 Å²	146.2	76%	0.755	73%	0.726	S	S	*	*			cis	-150.9	165.2	-12.9	-115.6	0	0	0	0	108.8
1313	P	33.9	Very low	30.6	Very low	108 Å²	108	145.4 Å²	145.4	70%	0.701	72%	0.723	S	S	*	*				-120	-134	-128.9	31.8	-11.9	0	0	0	111.5
1314	Q	28.2	Very low	30.5	Very low	156 Å²	156	143.3 Å²	143.3	73%	0.729	73%	0.725	S	S	*	*			trans	86.3	125.2	158.9	-69.5	-180	8.8	0	0	119.5
1315	N	26.9	Very low	30.7	Very low	141 Å²	141	136.7 Å²	136.7	75%	0.754	72%	0.719	S	S	*	*			trans	85.8	130.4	135	-61.5	-9.7	0	0	0	120.8
1316	T	32.5	Very low	30.7	Very low	127 Å²	127	133.5 Å²	133.5	78%	0.779	71%	0.712	S	S	*	*			trans	-66.4	-172.4	148.7	63.1	0	0	0	0	109.1
1317	P	30.7	Very low	30.8	Very low	97 Å²	97	137.4 Å²	137.4	63%	0.63	73%	0.727	S	S	*	*			cis	-139.2	-155.5	1.4	32.2	-6.3	0	0	0	112.6
1318	N	24.3	Very low	30.5	Very low	121 Å²	121	135.8 Å²	135.8	65%	0.647	73%	0.726	S	S	*	*			trans	55.7	106	139.6	-88.1	-62.6	0	0	0	121.3
1319	R	26.6	Very low	30.5	Very low	211 Å²	211	138.5 Å²	138.5	80%	0.796	73%	0.734	S	S	*	*				57.6	96.5	101	-176.3	-164.5	-176.5	-169.2	5.4	118
1320	K	26.4	Very low	30.3	Very low	187 Å²	187	136.6 Å²	136.6	81%	0.813	73%	0.732	S	S	*	*			trans	172.1	144.5	142.8	-97.3	149.9	-169.2	170.8	0	109
1321	R	26.5	Very low	30.6	Very low	206 Å²	206	137.8 Å²	137.8	78%	0.777	74%	0.737	S	S	*	*			cis	-146.7	142	9.8	-94.2	150.3	-174.3	-164.1	2.2	110.4
1322	R	27.2	Very low	30.4	Very low	200 Å²	200	139.6 Å²	139.6	76%	0.755	74%	0.738	S	S	*	*			trans	52.1	148.2	133.5	-53.4	177.7	-179.9	-179.8	-3.4	119.5
1323	F	27.6	Very low	30.5	Very low	173 Å²	173	140.8 Å²	140.8	76%	0.759	74%	0.735	S	S	*	*			cis	-135	166.4	15.3	-106.1	-73.8	0	0	0	113.2
1324	S	28.2	Very low	30.4	Very low	106 Å²	106	139 Å²	139	74%	0.741	74%	0.737	S	S	*	*			trans	-33.2	157.2	169.5	46.3	0	0	0	0	118.6
1325	G	32.4	Very low	30.4	Very low	59 Å²	59	137.8 Å²	137.8	61%	0.608	73%	0.734	S	S	*	*			cis	-169.1	174.6	6.9	0	0	0	0	0	113.1
1326	T	29.9	Very low	30.4	Very low	115 Å²	115	139.3 Å²	139.3	71%	0.706	73%	0.734	S	S	*	*				59.7	130.3	91.9	63.9	0	0	0	0	113.3
1327	E	33.3	Very low	30.2	Very low	169 Å²	169	139.1 Å²	139.1	79%	0.79	73%	0.733	S	S	*	*			cis	-169	159.5	2.5	-106.7	135.6	-157.2	0	0	105.6
1328	S	31.4	Very low	30	Very low	93 Å²	93	142.6 Å²	142.6	65%	0.65	74%	0.741	S	S	*	*			cis	-165.9	-168	-7.3	-114.9	0	0	0	0	110.4
1329	D	34.8	Very low	30.1	Very low	144 Å²	144	141.3 Å²	141.3	77%	0.77	74%	0.741	S	S	*	*			trans	72.9	121.3	160.6	-52.6	-35.6	0	0	0	119
1330	S	34.4	Very low	30.2	Very low	107 Å²	107	136.4 Å²	136.4	75%	0.748	74%	0.739	S	S	*	*			cis	91.7	165.2	23.3	-51.9	0	0	0	0	115.6
1331	I	39.2	Very low	30.3	Very low	158 Å²	158	131.4 Å²	131.4	81%	0.81	73%	0.728	S	S	*	*			trans	84.7	88.9	-166.4	-51	164.1	0	0	0	111
1332	D	32.8	Very low	30.4	Very low	145 Å²	145	129.9 Å²	129.9	78%	0.775	73%	0.729	S	S	*	*			cis	79.8	156.3	31.7	-156.5	16.2	0	0	0	114.9
1333	L	33.8	Very low	30.6	Very low	133 Å²	133	128 Å²	128	70%	0.696	73%	0.734	S	S	*	*			trans	72.4	116.9	-176.2	-50.1	165.5	0	0	0	114.8	I1335	L1333-I1335 HydrophobicContact CD2-CD1 3.85Å
1334	G	30.4	Very low	31.2	Very low	72 Å²	72	125.8 Å²	125.8	74%	0.742	73%	0.734	S	S	*	*			cis	117.4	-178.9	-7.8	0	0	0	0	0	115
1335	I	28.6	Very low	31.6	Very low	130 Å²	130	125.1 Å²	125.1	67%	0.667	73%	0.727	S	S	*	*			trans	83.7	107.1	157.7	-54.1	-179.4	0	0	0	119	L1333	L1333-I1335 HydrophobicContact CD2-CD1 3.85Å
1336	K	27.1	Very low	31.5	Very low	172 Å²	172	128 Å²	128	75%	0.748	73%	0.728	S	S	*	*			trans	74.8	134.4	150.5	-65.5	169.8	-172.1	179.6	0	119
1337	T	28.6	Very low	31.6	Very low	123 Å²	123	130.5 Å²	130.5	76%	0.755	73%	0.732	S	S	*	*			cis	90.7	146.3	32.6	-51.4	0	0	0	0	112.7
1338	E	25.7	Very low	31.5	Very low	171 Å²	171	127.8 Å²	127.8	80%	0.799	72%	0.722	S	S	*	*			trans	77.5	149.6	178.8	-51.4	-179.7	-162.2	0	0	115.4
1339	S	27.1	Very low	31.6	Very low	93 Å²	93	129.5 Å²	129.5	65%	0.65	72%	0.723	S	S	*	*			cis	-163.2	167.1	-33.8	68.5	0	0	0	0	108.4
1340	S	28.4	Very low	31.7	Very low	109 Å²	109	129.8 Å²	129.8	76%	0.762	72%	0.719	S	S	*	*			trans	67.7	157.8	160.2	-52.1	0	0	0	0	115.4
1341	S	28.2	Very low	31.4	Very low	82 Å²	82	130.8 Å²	130.8	57%	0.573	72%	0.721	S	S	*	*			cis	-170.3	162.6	-20.1	46.9	0	0	0	0	108.1
1342	Q	30.1	Very low	31	Very low	173 Å²	173	126.8 Å²	126.8	81%	0.808	71%	0.712	S	S	*	*			trans	68.3	141.5	162	-67.6	155.9	6	0	0	115.2
1343	L	31.1	Very low	30.8	Very low	162 Å²	162	127.6 Å²	127.6	85%	0.848	71%	0.71	S	S	*	*			cis	-141.1	146.6	1.4	-108.4	148.6	0	0	0	110.8
1344	V	39.5	Very low	30.7	Very low	126 Å²	126	127.1 Å²	127.1	76%	0.764	71%	0.708	S	S	*	*			trans	-93.1	-178.5	159.4	-145.1	0	0	0	0	105
1345	P	36.2	Very low	30.6	Very low	92 Å²	92	130.5 Å²	130.5	60%	0.597	71%	0.709	S	S	*	*			cis	-151.4	-166.3	17.1	44.3	-20.3	0	0	0	117.7
1346	D	30.6	Very low	30.6	Very low	118 Å²	118	128 Å²	128	63%	0.631	72%	0.715	S	S	*	*			trans	64	152.5	139.3	-66.5	-16.2	0	0	0	121.6	I1348	D1346-I1348 WeakPolarHBondContact OD1-CD1 3.37Å
1347	E	32.1	Very low	30.7	Very low	168 Å²	168	128.1 Å²	128.1	79%	0.785	72%	0.718	S	S	*	*			cis	-124.5	159.3	-2.3	-78.4	-156.7	105.9	0	0	110.8
1348	I	31.8	Very low	30.6	Very low	113 Å²	113	127.3 Å²	127.3	58%	0.579	72%	0.717	S	S	*	*			cis	78	136.2	31.5	-59.4	179.5	0	0	0	111.1	D1346	D1346-I1348 WeakPolarHBondContact OD1-CD1 3.37Å
1349	L	33.2	Very low	30.6	Very low	128 Å²	128	123 Å²	123	67%	0.67	71%	0.711	S	S	*	*			cis	-151	-172	-22.9	-142.3	67.5	0	0	0	111.2
1350	H	37.3	Very low	30.5	Very low	151 Å²	151	127.9 Å²	127.9	70%	0.699	72%	0.721	S	S	*	*			trans	-32.5	165.4	159	-45.2	-25.9	0	0	0	117
1351	T	28.3	Very low	31.3	Very low	127 Å²	127	128.2 Å²	128.2	78%	0.779	72%	0.721	S	S	*	*				-174.7	168.4	87.9	33.8	0	0	0	0	109.3
1352	A	30.2	Very low	31.7	Very low	75 Å²	75	129.4 Å²	129.4	62%	0.62	73%	0.726	S	S	*	*			cis	-153.6	150.7	6.3	0	0	0	0	0	111.8
1353	H	28.6	Very low	31.6	Very low	161 Å²	161	127 Å²	127	75%	0.745	72%	0.719	S	S	*	*				43.6	155.4	122.7	-55.1	-33.9	0	0	0	123.9
1354	L	30.7	Very low	31.6	Very low	124 Å²	124	126.5 Å²	126.5	65%	0.649	72%	0.716	S	S	*	*			cis	-169.7	157.5	-19.4	-105	171	0	0	0	109.5
1355	N	29.1	Very low	31.2	Very low	143 Å²	143	125 Å²	125	77%	0.765	71%	0.711	S	S	*	*			trans	56.5	149.3	150.1	-63.2	-19.2	0	0	0	121.8
1356	G	27.7	Very low	30.9	Very low	77 Å²	77	126.3 Å²	126.3	79%	0.794	72%	0.718	S	S	*	*			trans	168.5	96.6	167	0	0	0	0	0	115.5
1357	H	29.1	Very low	30.9	Very low	174 Å²	174	129.5 Å²	129.5	81%	0.806	73%	0.726	S	S	*	*			trans	-68.8	144.6	-170.2	-71.6	-106.5	0	0	0	117.9
1358	S	26.5	Very low	31.1	Very low	106 Å²	106	126.4 Å²	126.4	74%	0.741	72%	0.72	S	S	*	*			trans	60.8	122.8	131.8	69.7	0	0	0	0	124.5
1359	A	26.1	Very low	31	Very low	81 Å²	81	130 Å²	130	67%	0.669	73%	0.728	S	S	*	*				90.2	155.8	124.3	0	0	0	0	0	122.9
1360	F	26.7	Very low	30.9	Very low	196 Å²	196	129 Å²	129	86%	0.86	72%	0.719	S	S	*	*			trans	83.3	118.2	166.5	-60.6	-74.5	0	0	0	121.3
1361	P	43.4	Very low	30.7	Very low	115 Å²	115	128.1 Å²	128.1	75%	0.747	72%	0.716	S	S	*	*			trans	-88.8	-177.7	153.5	42.4	-35.9	0	0	0	110.1
1362	P	37.9	Very low	31.2	Very low	107 Å²	107	128.9 Å²	128.9	70%	0.695	71%	0.71	S	S	*	*			cis	-117	-146.4	27.9	23.6	4.1	0	0	0	112.5
1363	D	27.4	Very low	31.4	Very low	123 Å²	123	130.7 Å²	130.7	66%	0.658	71%	0.709	S	S	*	*			cis	-145.6	164.1	17	-93.2	-55.2	0	0	0	110
1364	I	30.4	Very low	31.9	Very low	151 Å²	151	129.8 Å²	129.8	77%	0.774	71%	0.705	S	S	*	*				63.6	122.3	57.1	-52.1	-177.9	0	0	0	112.5
1365	S	30.9	Very low	32.5	Very low	96 Å²	96	131.9 Å²	131.9	67%	0.671	71%	0.711	S	S	*	*			cis	-128.5	-149.8	-0.5	-149	0	0	0	0	109.1
1366	T	30.3	Very low	32.5	Very low	119 Å²	119	135.8 Å²	135.8	73%	0.73	72%	0.716	S	S	*	*			cis	-156.9	143	1.1	1.7	0	0	0	0	104.7
1367	K	31.2	Very low	33.4	Very low	185 Å²	185	137.1 Å²	137.1	80%	0.804	71%	0.71	S	S	*	*				63.3	141.7	59.3	-80.7	-162.8	175.2	-171.9	0	116.2
1368	P	36.1	Very low	33.4	Very low	102 Å²	102	134 Å²	134	66%	0.662	71%	0.705	S	S	*	*			cis	-142.6	-149.1	-34.1	41.6	-22	0	0	0	111.7
1369	Y	29.9	Very low	33.8	Very low	190 Å²	190	136.1 Å²	136.1	75%	0.745	71%	0.707	S	S	*	*			trans	74.9	134.5	158.7	-94.7	-137	0	0	0	118.1
1370	E	31.1	Very low	33.8	Very low	106 Å²	106	138.9 Å²	138.9	50%	0.495	71%	0.709	S	S	.	*			cis	-157.4	178.5	-18.7	-139.4	178.3	-161.3	0	0	111.5
1371	E	34	Very low	33.8	Very low	133 Å²	133	135.8 Å²	135.8	62%	0.621	70%	0.701	S	S	*	*			trans	3.3	155.6	139.3	-76.9	172.5	-170.1	0	0	119.8
1372	H	37.5	Very low	33.1	Very low	142 Å²	142	136 Å²	136	66%	0.657	70%	0.7	S	S	*	*			cis	-168.1	171.8	10.5	-112.5	-46	0	0	0	105.7
1373	D	35.4	Very low	32.6	Very low	113 Å²	113	138.8 Å²	138.8	60%	0.604	71%	0.707	S	S	*	*			cis	-161.9	-175	-25	-152	-22.9	0	0	0	107.8
1374	E	38.9	Very low	32.6	Very low	142 Å²	142	138.3 Å²	138.3	66%	0.664	71%	0.711	S	S	*	*			trans	69.7	153.2	141.5	-81.7	-178.6	148.7	0	0	120.2
1375	H	42.5	Very low	32.7	Very low	168 Å²	168	142.6 Å²	142.6	78%	0.778	72%	0.718	S	S	*	*			cis	-112	154.2	3.4	-75.9	-69.2	0	0	0	114.4
1376	R	30.4	Very low	32.8	Very low	226 Å²	226	144.3 Å²	144.3	85%	0.853	73%	0.726	S	S	*	*			trans	-101.4	150.1	178.3	-173.7	-173.4	173.7	175.6	-2.2	110.2
1377	P	45.9	Very low	32.7	Very low	104 Å²	104	148.1 Å²	148.1	68%	0.675	73%	0.733	S	S	*	*			trans	-69.4	-179.5	167.7	32.6	-39.2	0	0	0	111.7
1378	P	29.2	Very low	32.5	Very low	108 Å²	108	143.3 Å²	143.3	70%	0.701	73%	0.727	S	S	*	*				-136.2	147.6	126.7	37.9	-28.4	0	0	0	115.5	I1380	P1378-I1380 HydrophobicContact CB-CD1 4.2Å; P1378-I1380 HydrophobicContact CB-CG1 4.22Å; P1378-I1380 HydrophobicContact CG-CD1 4.45Å
1379	I	34.8	Very low	32.3	Very low	151 Å²	151	148.7 Å²	148.7	77%	0.774	74%	0.74	S	S	*	*			trans	-96.9	129.6	154.6	-64.6	169.6	0	0	0	106.9
1380	I	25.3	Very low	32.5	Very low	140 Å²	140	148 Å²	148	72%	0.718	74%	0.744	S	S	*	*			trans	-141.8	106.5	175.8	-70.4	179.4	0	0	0	104	P1378	P1378-I1380 HydrophobicContact CB-CD1 4.2Å; P1378-I1380 HydrophobicContact CB-CG1 4.22Å; P1378-I1380 HydrophobicContact CG-CD1 4.45Å
1381	L	27.7	Very low	32.7	Very low	131 Å²	131	148.3 Å²	148.3	69%	0.686	76%	0.755	S	S	*	*				55.7	124	60.9	-55.7	175.2	0	0	0	110.3
1382	T	29.7	Very low	32.5	Very low	120 Å²	120	146.1 Å²	146.1	74%	0.736	75%	0.754	S	S	*	*			cis	176.9	173.4	22.2	12.4	0	0	0	0	105.6
1383	I	26.2	Very low	32.2	Very low	164 Å²	164	146.5 Å²	146.5	84%	0.841	76%	0.761	S	S	*	*			trans	177.8	156.2	137.3	-96.6	155	0	0	0	112.1
1384	P	27.7	Very low	32.3	Very low	114 Å²	114	148.1 Å²	148.1	74%	0.74	77%	0.765	S	S	*	*			trans	-98.8	-179.8	-175.5	0.9	22.5	0	0	0	115.2
1385	R	32.3	Very low	32.2	Very low	241 Å²	241	147.2 Å²	147.2	91%	0.909	77%	0.772	S	S	*	*			trans	-40.4	149.5	166	-72.3	179.7	174.1	-176.8	-2	112.9
1386	P	33.9	Very low	31.6	Very low	131 Å²	131	144.9 Å²	144.9	85%	0.851	77%	0.765	S	S	*	*			cis	-148.8	-137.6	47.8	44	-22	0	0	0	116.3
1387	K	26.2	Very low	31.7	Very low	200 Å²	200	140.7 Å²	140.7	87%	0.87	76%	0.759	S	S	*	*			trans	-69.1	138.9	-163.4	-57.5	171.7	177.3	178.5	0	116.1
1388	A	27.3	Very low	31.1	Very low	83 Å²	83	142.5 Å²	142.5	69%	0.686	76%	0.763	S	S	*	*			trans	69.8	151.2	140.6	0	0	0	0	0	121.5
1389	F	33	Very low	31.4	Very low	215 Å²	215	143.5 Å²	143.5	94%	0.943	77%	0.769	S	S	*	*			trans	79.9	137.7	173.2	-66.1	-82.2	0	0	0	119.6
1390	H	33.6	Very low	31.2	Very low	176 Å²	176	142.2 Å²	142.2	82%	0.815	77%	0.768	S	S	*	*			trans	-96.9	-178.7	170.9	-118.9	-113.4	0	0	0	108.6
1391	P	34.5	Very low	31.3	Very low	112 Å²	112	146 Å²	146	73%	0.727	77%	0.773	S	S	*	*			cis	-133.9	-168.1	4.9	40.9	-21.4	0	0	0	115.9
1392	S	30.8	Very low	31.5	Very low	88 Å²	88	146.6 Å²	146.6	62%	0.615	78%	0.776	S	S	*	*			trans	-27.5	168	173.8	-41.8	0	0	0	0	124.8
1393	D	30.4	Very low	31.7	Very low	150 Å²	150	145.3 Å²	145.3	80%	0.802	77%	0.772	S	S	*	*			trans	105.8	123	139.9	-62.7	-36.5	0	0	0	122.6
1394	Q	38.6	Very low	32.1	Very low	147 Å²	147	142.3 Å²	142.3	69%	0.687	77%	0.766	S	S	*	*			trans	65.2	173.6	148.8	-101.6	-173.3	-27.9	0	0	118.9	D1396	Q1394-D1396 PolarHBondContact NE2-OD1 3.01Å; Q1394-D1396 PolarHBondContact NE2-OD2 2.89Å
1395	P	35.1	Very low	32.5	Very low	123 Å²	123	143.5 Å²	143.5	80%	0.799	77%	0.765	S	S	*	*			cis	-123.6	-172.1	20.9	43.7	-27.8	0	0	0	117.2
1396	D	30.6	Very low	32.7	Very low	119 Å²	119	138.4 Å²	138.4	64%	0.636	76%	0.756	S	S	*	*			trans	-95.2	-165.5	-165.1	-47	-62.3	0	0	0	115.9	Q1394	Q1394-D1396 PolarHBondContact NE2-OD1 3.01Å; Q1394-D1396 PolarHBondContact NE2-OD2 2.89Å
1397	D	32.5	Very low	32.7	Very low	137 Å²	137	137.4 Å²	137.4	73%	0.733	75%	0.752	S	S	*	*			trans	87.1	99.3	158.2	-75.7	-28.2	0	0	0	122.2
1398	L	32.9	Very low	33.1	Very low	142 Å²	142	131.9 Å²	131.9	74%	0.743	74%	0.744	S	S	*	*				50.7	136.4	120.2	-62.5	174.6	0	0	0	121.5
1399	P	37.1	Very low	33.4	Very low	129 Å²	129	137.5 Å²	137.5	84%	0.838	75%	0.753	S	S	*	*			trans	-123.7	99.5	144.3	35.3	-24.7	0	0	0	113.1	R1401	P1399-R1401 PolarHBondContact O-N 3.28Å
1400	V	28.9	Very low	33.6	Very low	125 Å²	125	132 Å²	132	76%	0.758	74%	0.739	S	S	*	*			trans	-81.6	102	154.5	175.6	0	0	0	0	108.5
1401	R	29	Very low	33.6	Very low	218 Å²	218	130.1 Å²	130.1	82%	0.823	73%	0.733	S	S	*	*	S	Bend	trans	64.7	156.8	164.2	-69.7	-173.9	169.3	-163.1	-1.8	119	P1399	P1399-R1401 PolarHBondContact O-N 3.28Å
1402	L	31.8	Very low	33.8	Very low	144 Å²	144	131 Å²	131	75%	0.754	73%	0.731	S	S	*	*			trans	68.4	79.7	151.2	-70.8	157.9	0	0	0	119.6
1403	S	32.5	Very low	34	Very low	93 Å²	93	133.1 Å²	133.1	65%	0.65	73%	0.732	S	S	*	*				59.9	125.3	113.3	66.4	0	0	0	0	122.4
1404	S	34.5	Very low	34.3	Very low	102 Å²	102	134.8 Å²	134.8	71%	0.713	73%	0.728	S	S	*	*				100.8	124.3	126.8	-71.9	0	0	0	0	122.7
1405	I	37.5	Very low	34.1	Very low	138 Å²	138	134.2 Å²	134.2	71%	0.708	73%	0.728	S	S	*	*				87.1	100	127.8	-68	171.7	0	0	0	119.9
1406	N	35	Very low	34	Very low	134 Å²	134	135.3 Å²	135.3	72%	0.717	73%	0.727	S	S	*	*				72.2	125.5	122.6	-60.2	7.9	0	0	0	124.4
1407	S	34.9	Very low	34.2	Very low	110 Å²	110	133.9 Å²	133.9	77%	0.769	73%	0.727	S	S	*	*				96.2	120.5	121.9	-75.9	0	0	0	0	124
1408	A	34	Very low	34.3	Very low	85 Å²	85	132 Å²	132	70%	0.702	72%	0.717	S	S	*	*				77.5	108.9	126.2	0	0	0	0	0	122.3
1409	K	33.3	Very low	34.2	Very low	201 Å²	201	128.1 Å²	128.1	87%	0.874	70%	0.697	S	S	*	*				54.5	166.6	107.3	-91.8	-179.2	179.4	176.9	0	120.6
1410	P	38	Very low	33.9	Very low	100 Å²	100	125 Å²	125	65%	0.649	68%	0.682	S	S	*	*			cis	-137.4	-157	-13.3	31.1	-6.6	0	0	0	113.8
1411	I	34.3	Very low	33.9	Very low	136 Å²	136	129.1 Å²	129.1	70%	0.697	69%	0.685	S	S	*	*			trans	104.2	129.5	136	-100.7	171.2	0	0	0	120.5
1412	D	37.9	Very low	33.9	Very low	129 Å²	129	123.9 Å²	123.9	69%	0.69	68%	0.682	S	S	*	*			trans	62.2	147.4	150.2	-63.3	-0.6	0	0	0	123
1413	E	34.3	Very low	33.6	Very low	134 Å²	134	122.2 Å²	122.2	63%	0.626	68%	0.682	S	S	*	*			cis	-165	174.1	-20.4	-157.3	175.2	-174.7	0	0	111.4
1414	Y	37.4	Very low	33.4	Very low	184 Å²	184	123.2 Å²	123.2	72%	0.722	69%	0.689	S	S	*	*			trans	91.6	126.7	146	-85.6	-51.1	0	0	0	126
1415	I	34.4	Very low	33	Very low	135 Å²	135	121.7 Å²	121.7	69%	0.692	69%	0.689	S	S	*	*			trans	84.1	99.3	146.7	-59.4	166.1	0	0	0	120.8
1416	N	32.1	Very low	32.4	Very low	146 Å²	146	119.8 Å²	119.8	78%	0.781	69%	0.689	S	S	*	*				40.9	153.1	124.3	-52.2	-22.3	0	0	0	122.5
1417	S	36	Very low	32	Very low	90 Å²	90	123 Å²	123	63%	0.629	69%	0.69	S	S	*	*			cis	-146	144.3	15	-40.4	0	0	0	0	113.7
1418	D	34.5	Very low	31.7	Very low	98 Å²	98	122.4 Å²	122.4	52%	0.524	69%	0.686	S	S	.	*			trans	60.5	157.3	145	-68.2	-47.3	0	0	0	121.2	Y1064	Y1064-D1418 HydrophobicContact CD1-CB 4.24Å; Y1064-D1418 HydrophobicContact CD2-CB 3.67Å; Y1064-D1418 HydrophobicContact CE1-CB 4.03Å; Y1064-D1418 HydrophobicContact CE2-CB 3.38Å; Y1064-D1418 HydrophobicContact CG-CB 4.09Å; Y1064-D1418 PolarHBondContact OH-O 2.79Å
1419	N	30.5	Very low	31.5	Very low	60 Å²	60	129.1 Å²	129.1	32%	0.321	69%	0.694	S	S	.	*			cis	-161.3	163.8	-40.8	-132.7	-47.7	0	0	0	110.7	Y1064 S1065	Y1064-N1419 HydrophobicContact CD1-CB 3.53Å; Y1064-N1419 HydrophobicContact CE1-CB 3.96Å; Y1064-N1419 WeakPolarHBondContact CE1-O 3.45Å; Y1064-N1419 HydrophobicContact CG-CB 4.05Å; S1065-N1419 PolarHBondContact OG-ND2 2.94Å
1420	A	30.2	Very low	31.3	Very low	62 Å²	62	130.1 Å²	130.1	51%	0.512	69%	0.692	S	S	.	*			trans	-55	154.8	-167.2	0	0	0	0	0	119
1421	Y	30.4	Very low	30.8	Very low	213 Å²	213	130.2 Å²	130.2	84%	0.835	70%	0.695	S	S	*	*				-149.1	126.9	124.2	-110.1	-70.4	0	0	0	112.7
1422	S	29.2	Very low	30.5	Very low	107 Å²	107	131.5 Å²	131.5	75%	0.748	70%	0.7	S	S	*	*			trans	-110.8	-174.9	170.6	-71.5	0	0	0	0	110.6
1423	S	25.3	Very low	30.1	Very low	109 Å²	109	132.2 Å²	132.2	76%	0.762	70%	0.702	S	S	*	*			trans	88.1	122.1	-175.2	-157.2	0	0	0	0	112.5
1424	S	27.7	Very low	30.2	Very low	115 Å²	115	132.4 Å²	132.4	80%	0.804	71%	0.707	S	S	*	*			cis	73.8	124.2	44.5	-167.3	0	0	0	0	113.3
1425	G	25.5	Very low	29.8	Very low	69 Å²	69	132.4 Å²	132.4	71%	0.711	71%	0.711	S	S	*	*			trans	80.3	166.6	-173	0	0	0	0	0	114.2
1426	S	25.7	Very low	29.6	Very low	99 Å²	99	130.6 Å²	130.6	69%	0.692	71%	0.71	S	S	*	*			cis	-164.8	133.5	-9.6	-157.4	0	0	0	0	112.1
1427	R	26.9	Very low	29.8	Very low	200 Å²	200	130.9 Å²	130.9	76%	0.755	70%	0.704	S	S	*	*			trans	70.2	159.2	169.3	-50.2	138.1	141.8	-167.9	-9.2	112.9
1428	S	28.6	Very low	30	Very low	98 Å²	98	134 Å²	134	69%	0.685	70%	0.702	S	S	*	*			cis	-162.5	159.7	24.8	-151.5	0	0	0	0	114.4
1429	R	29.9	Very low	30	Very low	226 Å²	226	132.4 Å²	132.4	85%	0.853	70%	0.697	S	S	*	*			trans	67.8	102.7	152	-76.2	166.7	176.7	-172	-0.9	120.5
1430	R	28.7	Very low	30.1	Very low	222 Å²	222	130.8 Å²	130.8	84%	0.838	69%	0.691	S	S	*	*				94	46.7	107.1	-152.3	-177.3	-153.1	-103.6	5.8	118.7
1431	S	27.3	Very low	30.2	Very low	102 Å²	102	129.7 Å²	129.7	71%	0.713	68%	0.678	S	S	*	*			trans	-68.9	143.4	147.6	53.8	0	0	0	0	110.6	I1433	S1431-I1433 PolarHBondContact O-N 3.14Å
1432	M	28.2	Very low	30.2	Very low	164 Å²	164	122.6 Å²	122.6	81%	0.808	66%	0.657	S	S	*	*			trans	-89.7	76.3	-177.8	-68.3	-163.8	-60	0	0	112	L1434	M1432-L1434 PolarHBondContact O-N 3.27Å
1433	I	30.3	Very low	30.2	Very low	144 Å²	144	120.6 Å²	120.6	74%	0.738	64%	0.643	S	S	*	*			trans	-67.9	102	168	-56.9	178.7	0	0	0	108.6	S1431 K1435	S1431-I1433 PolarHBondContact O-N 3.14Å; I1433-K1435 PolarHBondContact O-N 3.01Å
1434	L	34.6	Very low	30.5	Very low	137 Å²	137	125.6 Å²	125.6	72%	0.717	67%	0.669	S	S	*	*			trans	-58.9	117.7	171.5	-77.2	167.7	0	0	0	109.2	M1432 S1436	M1432-L1434 PolarHBondContact O-N 3.27Å; L1434-S1436 PolarHBondContact O-N 3.08Å
1435	K	29.7	Very low	30.7	Very low	184 Å²	184	126.2 Å²	126.2	80%	0.8	66%	0.663	S	S	*	*			trans	-76.3	63.4	-177.7	-70.1	-173.8	174.8	-177.6	0	112.5	I1433 K1437	I1433-K1435 PolarHBondContact O-N 3.01Å; K1435-K1437 PolarHBondContact O-N 2.9Å; K1435-K1437 VanDerWaalsContact O-N 3.15Å
1436	S	31.3	Very low	30.9	Very low	98 Å²	98	129.2 Å²	129.2	69%	0.685	66%	0.66	S	S	*	*			trans	-84.4	47.8	173.3	61.1	0	0	0	0	112.8	L1434	L1434-S1436 PolarHBondContact O-N 3.08Å
1437	K	35.6	Very low	31.2	Very low	151 Å²	151	130.8 Å²	130.8	66%	0.657	66%	0.658	S	S	*	*			trans	-130.8	85.2	162.7	-81.5	-169.9	172.5	-174.7	0	107.2	D1228 K1435	D1228-K1437 IonicContact OD2-NZ 3.1Å; K1435-K1437 PolarHBondContact O-N 2.9Å; K1435-K1437 VanDerWaalsContact O-N 3.15Å
1438	R	39.7	Very low	31.5	Very low	156 Å²	156	126.8 Å²	126.8	59%	0.589	65%	0.653	S	S	*	*			trans	-135.7	95.6	175.3	-70.6	-168.4	-172.1	-151.7	5	109.8	C1440	R1438-C1440 PolarHBondContact O-N 3.44Å
1439	P	34.8	Very low	31.6	Very low	64 Å²	64	128.6 Å²	128.6	42%	0.416	65%	0.651	S	S	.	*	P	Polyproline II helix	trans	-68.1	117	170.5	-5.9	19.5	0	0	0	109	E1242 K1245	E1242-P1439 VanDerWaalsContact OE2-O 3.11Å; K1245-P1439 PolarHBondContact NZ-O 3.12Å
1440	C	33.2	Very low	31.8	Very low	27 Å²	27	122.1 Å²	122.1	18%	0.182	64%	0.637	C	S	.	*	P	Polyproline II helix	trans	-66.6	147.5	-173	-143.3	0	0	0	0	112	C668 Y670 H682 R1438	C668-C1440 HydrophobicContact CB-CB 3.88Å; C668-C1440 PolarHBondContact O-SG 3.05Å; C668-C1440 WeakPolarHBondContact SG-CB 3.24Å; C668-C1440 VanDerWaalsContact SG-SG 3.6Å; Y670-C1440 VanDerWaalsContact CA-SG 3.54Å; Y670-C1440 WeakPolarHBondContact CB-SG 3.47Å; H682-C1440 WeakPolarHBondContact CE1-CB 3.42Å; R1438-C1440 PolarHBondContact O-N 3.44Å
1441	P	31.6	Very low	32	Very low	38 Å²	38	114.9 Å²	114.9	25%	0.247	62%	0.623	C	S	.	*	P	Polyproline II helix	trans	-78.9	128.5	-175.7	29.6	-32.7	0	0	0	112.8	P1241	P1241-P1441 HydrophobicContact CB-CB 3.7Å
1442	T	30.2	Very low	32.3	Very low	64 Å²	64	115.9 Å²	115.9	39%	0.393	62%	0.616	S	S	.	*			trans	-78.8	116	164.5	47.4	0	0	0	0	110.8	R1188 H1239	R1188-T1442 PolarHBondContact NH1-O 2.89Å; H1239-T1442 PolarHBondContact ND1-OG1 3.4Å
1443	S	30	Very low	32.7	Very low	66 Å²	66	111.9 Å²	111.9	46%	0.462	60%	0.6	S	S	.	*			trans	-143.3	128.4	165.4	56.8	0	0	0	0	108.2
1444	T	31.3	Very low	32.9	Very low	214 Å²	214	109 Å²	109	100%	1.313	59%	0.587	S	S	*	*			trans	49.3	0	-159	65.9	0	0	0	0	110.8

Retrieved 1,444 of 1,444 residues in 242 ms (Link to these results)

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