A0A3Q0KN20_SCHMA Loading...

DUF4139 domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KN20, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,018 aa.

						>A0A3Q0KN20_SCHMA|A0A3Q0KN20
MSTTVGVSDITADQSEINRESYISYPSYEIDNTPSQSSFGHLNHLNHDEYQTRLNGGEDEYLPGDIKENISGNNNSNEDIPTNDDRSEYTNMKTEESYHDSTCPSHSEQELDQDILKNEHGKNELIPEQNMECLNIQNVENQQKLSFNQIKEDLEKKNVIGSLQPLRPEQYIMHHQAGLIKQQEMLVLNPQTGDVLSDQYSSHHQTNTITTGGTHHFARNITSTNSVVVPSGGNVSGPPVGSGTVAGQQKGSTIYPKTGQNPIDGGTNGGVGANSSGSAGGGPSKSGTLVGGGLDRSRQVYNMFECQMSQLTVFLDRALICRRIRPRFNASDITEVVFEHLSPAIDKDSIRVEIRGAATILDVSFSAKSLSGEEDTWSQCVNELLVELRQCRRRADNLVNRIIRTEKQRCVLETFADSLSRREDEILLGGSHYGHTTLNNIPNHTGVVDQVNNISSQGATLSGGTTPANAQMAATTAEHKCINDVTNPYDPKNVETLHKFLEIYKDEAERFDTVLMDTTEELEQVRTRIETLEKEVRDIELKQDEHLARELSVLVEPRETGQVEMLVSYVVNRCGWKPAYDIRIFNNDGTMKIVYYGMVQQATGEDWETRYMTLSTAQPGIGGTVPHLGIQRVHFRRDHSPAIPISRNAISSTSVTTGYSSGGMTSTTTIPASTGHQISGASSTGKNTRSCTKLGAFKRSNRTPGTNINEIDRVGSMDNERDGITPSGTLQRGGSIESTYATGLRSSSTRPISRRTLGSSMLFNSVTSQSPLLTNRTSNLMNSQPALLPTPQQPTPSVGTVATIQLEVPRPPAIIRCDNEPNRVTVGLLDLQPRYEYVTVPKRSLYAYLKATAVNNTEFSILAGPTNIYADNTFIGKSEIRAVAPGEEFNCHLGAENGIKILYRPLFKYREGTGSSGKNATMTFKQLIEVRNTFDRRVRLMVVDQVPVSAEDKIKVNLLEPTIKHPEKYDKNRPIRMNKFNNVEWDLDLGPGEIRELTLKYSVEHPINEDLDVSVSEN
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.7	Very low	56.3	Low	186 Å²	186	74.5 Å²	74.5	92%	0.916	44%	0.442	S	S	*	.				0	136.4	0	-70.1	178	176.1	0	0	106.7
2	S	54.8	Low	54.7	Low	67 Å²	67	71.3 Å²	71.3	47%	0.469	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	131.9	173.9	-159.9	0	0	0	0	107.3	I354	S2-I354 WeakPolarHBondContact CA-O 3.24Å
3	T	65.4	Low	53.5	Low	42 Å²	42	75.2 Å²	75.2	26%	0.258	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	126.1	172.2	-47.5	0	0	0	0	107.3	V5 E353 I354	T3-V5 HydrophobicContact CG2-CG2 4.05Å; T3-E353 WeakPolarHBondContact O-CA 3.35Å; T3-I354 PolarHBondContact N-O 2.62Å; T3-I354 PolarHBondContact O-N 2.82Å
4	T	68.6	Low	52	Low	73 Å²	73	81.6 Å²	81.6	45%	0.448	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	128.2	177	-57.8	0	0	0	0	108.4	V352 E353	T4-V352 WeakPolarHBondContact CA-O 3.34Å; T4-E353 HydrophobicContact CG2-CG 3.89Å; T4-E353 WeakPolarHBondContact OG1-CG 3.46Å; T4-E353 PolarHBondContact OG1-OE1 2.74Å
5	V	70	Confident	51.2	Low	39 Å²	39	78.9 Å²	78.9	24%	0.236	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	138.6	-178.7	-169.9	0	0	0	0	109	T3 V352 I360 V363	T3-V5 HydrophobicContact CG2-CG2 4.05Å; V5-V352 PolarHBondContact N-O 3.09Å; V5-V352 PolarHBondContact O-N 3.24Å; V5-I360 HydrophobicContact CB-CB 4.43Å; V5-I360 HydrophobicContact CB-CD1 4.42Å; V5-I360 HydrophobicContact CB-CG2 3.99Å; V5-I360 HydrophobicContact CG1-CG2 4.42Å; V5-I360 HydrophobicContact CG2-CB 3.73Å; V5-I360 HydrophobicContact CG2-CD1 4.08Å; V5-I360 HydrophobicContact CG2-CG2 3.79Å; V5-V363 HydrophobicContact CB-CG2 4.11Å; V5-V363 HydrophobicContact CG1-CG2 4.09Å
6	G	64.4	Low	50.5	Low	25 Å²	25	76.9 Å²	76.9	26%	0.258	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	177.1	167.8	0	0	0	0	0	111.5	S8	G6-S8 PolarHBondContact O-N 3.42Å
7	V	67.3	Low	49.7	Very low	36 Å²	36	79.5 Å²	79.5	22%	0.218	45%	0.453	C	S	.	.			trans	-65.7	127.1	176.9	179.8	0	0	0	0	110.2	D9 I10 I350 V363 F365	V7-D9 WeakPolarHBondContact CG1-O 3.27Å; V7-I10 HydrophobicContact CG1-CG1 4.46Å; V7-I350 HydrophobicContact CG2-CB 3.83Å; V7-I350 HydrophobicContact CG2-CD1 4.33Å; V7-I350 HydrophobicContact CG2-CG2 4.05Å; V7-V363 WeakPolarHBondContact CA-O 3.26Å; V7-V363 HydrophobicContact CG2-CG1 3.98Å; V7-F365 HydrophobicContact CG1-CB 4.3Å; V7-F365 HydrophobicContact CG2-CB 4.42Å
8	S	49.9	Very low	48.8	Very low	71 Å²	71	82.7 Å²	82.7	50%	0.497	47%	0.468	S	S	.	.			trans	-89.8	-38.9	-179.2	-7.9	0	0	0	0	112.9	G6 D362 V363	G6-S8 PolarHBondContact O-N 3.42Å; S8-D362 PolarHBondContact OG-OD1 2.84Å; S8-V363 PolarHBondContact N-O 3.09Å
9	D	46.6	Very low	48.6	Very low	104 Å²	104	83 Å²	83	56%	0.556	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.6	132	-171.9	-74	-35.8	0	0	0	110.5	V7	V7-D9 WeakPolarHBondContact CG1-O 3.27Å
10	I	43.7	Very low	47.9	Very low	82 Å²	82	85.8 Å²	85.8	42%	0.421	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	108.4	173.9	-60.9	168	0	0	0	106.9	V7 A12 K347	V7-I10 HydrophobicContact CG1-CG1 4.46Å; I10-A12 HydrophobicContact CG2-CB 4.38Å; I10-A12 PolarHBondContact O-N 3.33Å; I10-K347 HydrophobicContact CD1-CD 4.34Å; I10-K347 HydrophobicContact CG2-CD 4.4Å
11	T	40.2	Very low	47	Very low	95 Å²	95	86.7 Å²	86.7	58%	0.583	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	87.7	171.4	38.4	0	0	0	0	109
12	A	36.7	Very low	46.2	Very low	35 Å²	35	84.5 Å²	84.5	29%	0.289	47%	0.466	S	S	.	.			trans	-94	139.4	169.3	0	0	0	0	0	110.1	I10 E16	I10-A12 HydrophobicContact CG2-CB 4.38Å; I10-A12 PolarHBondContact O-N 3.33Å; A12-E16 HydrophobicContact CB-CB 4.11Å; A12-E16 WeakPolarHBondContact CB-OE2 3.32Å
13	D	39.1	Very low	44.9	Very low	122 Å²	122	86.8 Å²	86.8	65%	0.652	47%	0.472	S	S	*	.			trans	-62.3	146.9	162.5	-159.2	-8.4	0	0	0	108.6	S15 E16	D13-S15 PolarHBondContact O-N 3.41Å; D13-E16 PolarHBondContact O-N 3.09Å; D13-E16 VanDerWaalsContact O-N 3.11Å
14	Q	32.8	Very low	43	Very low	166 Å²	166	90.2 Å²	90.2	78%	0.776	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-6.3	-169.7	-73.6	-173.8	6.3	0	0	114.2
15	S	39.5	Very low	41.1	Very low	41 Å²	41	93.2 Å²	93.2	29%	0.287	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-24.7	174.1	55.7	0	0	0	0	114.4	D13 I17 E374	D13-S15 PolarHBondContact O-N 3.41Å; S15-I17 PolarHBondContact O-N 3.1Å; S15-E374 VanDerWaalsContact CB-OE1 3.27Å; S15-E374 WeakPolarHBondContact CB-OE1 3.36Å; S15-E374 WeakPolarHBondContact CB-OE2 3.48Å; S15-E374 PolarHBondContact OG-OE1 3.08Å; S15-E374 PolarHBondContact OG-OE2 3.38Å
16	E	40.4	Very low	39	Very low	47 Å²	47	95.2 Å²	95.2	22%	0.22	52%	0.515	C	S	.	.	G	3₁₀ helix	trans	-75.2	-24.4	-178.5	-78.8	-171	160.9	0	0	114	A12 D13 N18 R19	A12-E16 HydrophobicContact CB-CB 4.11Å; A12-E16 WeakPolarHBondContact CB-OE2 3.32Å; D13-E16 PolarHBondContact O-N 3.09Å; D13-E16 VanDerWaalsContact O-N 3.11Å; E16-N18 PolarHBondContact O-N 2.76Å; E16-R19 PolarHBondContact O-N 3.16Å
17	I	37.2	Very low	37.1	Very low	121 Å²	121	99.6 Å²	99.6	62%	0.621	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-64.7	-18.4	-171.8	-60.7	173	0	0	0	112.4	S15	S15-I17 PolarHBondContact O-N 3.1Å
18	N	34.3	Very low	35.1	Very low	136 Å²	136	107.1 Å²	107.1	73%	0.727	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-90.6	-4.8	177.8	-73.4	-35.5	0	0	0	114.6	E16	E16-N18 PolarHBondContact O-N 2.76Å
19	R	43.6	Very low	34	Very low	89 Å²	89	112.7 Å²	112.7	34%	0.336	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.9	-17.7	-174.5	-63.8	-175.3	-172.8	-155	-1.5	114.7	E16 S21 E374	E16-R19 PolarHBondContact O-N 3.16Å; R19-S21 VanDerWaalsContact C-N 3.26Å; R19-S21 PolarHBondContact O-N 2.94Å; R19-E374 IonicContact CZ-OE1 3.71Å; R19-E374 IonicContact NE-OE1 2.69Å; R19-E374 VanDerWaalsContact NH2-CG 3.27Å; R19-E374 IonicContact NH2-OE1 3.72Å; R19-E374 PolarHBondContact NH2-OE1 3.02Å
20	E	35.8	Very low	33.1	Very low	138 Å²	138	113.4 Å²	113.4	65%	0.645	59%	0.588	S	S	*	*			trans	-79.2	1.5	-174.7	-72.9	179.9	177.7	0	0	114.8	Y22 K347	E20-Y22 PolarHBondContact O-N 2.91Å; E20-Y22 VanDerWaalsContact O-N 3.13Å; E20-K347 WeakPolarHBondContact OE1-CE 3.3Å; E20-K347 IonicContact OE1-NZ 3.39Å; E20-K347 PolarHBondContact OE1-NZ 2.78Å
21	S	27.9	Very low	32.2	Very low	105 Å²	105	115.9 Å²	115.9	73%	0.734	60%	0.602	S	S	*	*			trans	-86.2	55.5	171.3	62.4	0	0	0	0	112.2	R19 I23	R19-S21 VanDerWaalsContact C-N 3.26Å; R19-S21 PolarHBondContact O-N 2.94Å; S21-I23 PolarHBondContact O-N 3.12Å
22	Y	32.2	Very low	31.6	Very low	141 Å²	141	118.6 Å²	118.6	55%	0.553	61%	0.613	S	S	*	*			trans	-87.9	108.2	170.7	-108.2	-81.8	0	0	0	110.4	E20 S24 E540	E20-Y22 PolarHBondContact O-N 2.91Å; E20-Y22 VanDerWaalsContact O-N 3.13Å; Y22-S24 PolarHBondContact O-N 3.23Å; Y22-S24 VanDerWaalsContact O-N 3.17Å; Y22-E540 PolarHBondContact OH-OE1 3Å
23	I	28.2	Very low	31	Very low	115 Å²	115	121.6 Å²	121.6	59%	0.59	63%	0.628	S	S	*	*			trans	-58.5	113.7	165.1	-65.2	169.9	0	0	0	106.7	S21 Y25	S21-I23 PolarHBondContact O-N 3.12Å; I23-Y25 HydrophobicContact CB-CE2 4.45Å; I23-Y25 HydrophobicContact CG2-CE1 4.46Å; I23-Y25 VanDerWaalsContact O-CD2 3.28Å; I23-Y25 WeakPolarHBondContact O-CD2 3.38Å; I23-Y25 PolarHBondContact O-N 3.32Å
24	S	25.6	Very low	30.3	Very low	113 Å²	113	120.8 Å²	120.8	79%	0.79	63%	0.63	S	S	*	*			trans	-57.5	103.6	163.4	-178	0	0	0	0	107	Y22 P26	Y22-S24 PolarHBondContact O-N 3.23Å; Y22-S24 VanDerWaalsContact O-N 3.17Å; S24-P26 WeakPolarHBondContact O-CD 3.32Å
25	Y	27.7	Very low	30	Very low	137 Å²	137	116.9 Å²	116.9	54%	0.537	62%	0.62	S	S	.	*			trans	-73.4	121.3	169.8	-71.3	-82.5	0	0	0	106.4	I23 S27	I23-Y25 HydrophobicContact CB-CE2 4.45Å; I23-Y25 HydrophobicContact CG2-CE1 4.46Å; I23-Y25 VanDerWaalsContact O-CD2 3.28Å; I23-Y25 WeakPolarHBondContact O-CD2 3.38Å; I23-Y25 PolarHBondContact O-N 3.32Å; Y25-S27 PolarHBondContact O-N 3.11Å
26	P	25.8	Very low	29.3	Very low	81 Å²	81	122.5 Å²	122.5	53%	0.526	64%	0.642	S	S	.	*			trans	-58.6	126.6	168.6	24.5	-30	0	0	0	106.9	S24 Y28	S24-P26 WeakPolarHBondContact O-CD 3.32Å; P26-Y28 VanDerWaalsContact C-N 3.26Å; P26-Y28 HydrophobicContact CG-CD2 4.25Å; P26-Y28 HydrophobicContact CG-CE2 3.8Å; P26-Y28 PolarHBondContact O-N 3.22Å
27	S	25.6	Very low	28.6	Very low	117 Å²	117	124.2 Å²	124.2	82%	0.818	66%	0.659	S	S	*	*			trans	-55.4	101.5	158.4	-59.6	0	0	0	0	105.9	Y25 E29	Y25-S27 PolarHBondContact O-N 3.11Å; S27-E29 PolarHBondContact O-N 3.11Å
28	Y	25.6	Very low	28.1	Very low	193 Å²	193	122.7 Å²	122.7	76%	0.757	66%	0.66	S	S	*	*			trans	-70	91.5	163.5	-77.9	-85.5	0	0	0	105.3	P26 I30	P26-Y28 VanDerWaalsContact C-N 3.26Å; P26-Y28 HydrophobicContact CG-CD2 4.25Å; P26-Y28 HydrophobicContact CG-CE2 3.8Å; P26-Y28 PolarHBondContact O-N 3.22Å; Y28-I30 PolarHBondContact O-N 3.01Å
29	E	25.3	Very low	27.7	Very low	188 Å²	188	125.9 Å²	125.9	88%	0.879	67%	0.667	S	S	*	*			trans	-60.4	86.7	144.5	-82.1	178.1	166.1	0	0	105.2	S27 D31	S27-E29 PolarHBondContact O-N 3.11Å; E29-D31 PolarHBondContact O-N 3.21Å
30	I	27.3	Very low	26.9	Very low	119 Å²	119	125 Å²	125	61%	0.61	69%	0.685	S	S	*	*			trans	-67.8	115.5	154.8	-59.2	178.7	0	0	0	102.9	Y28 N32	Y28-I30 PolarHBondContact O-N 3.01Å; I30-N32 VanDerWaalsContact C-N 3.35Å; I30-N32 PolarHBondContact O-N 2.83Å
31	D	25.1	Very low	26.4	Very low	134 Å²	134	126.7 Å²	126.7	72%	0.717	69%	0.693	S	S	*	*			trans	-40	101.8	169.7	-97.2	-41.8	0	0	0	109	E29 T33	E29-D31 PolarHBondContact O-N 3.21Å; D31-T33 PolarHBondContact O-N 2.9Å
32	N	27.2	Very low	26.3	Very low	152 Å²	152	128.5 Å²	128.5	81%	0.813	69%	0.694	S	S	*	*			trans	-79.6	55.6	162.3	-82.1	-22.4	0	0	0	107	I30 P34	I30-N32 VanDerWaalsContact C-N 3.35Å; I30-N32 PolarHBondContact O-N 2.83Å; N32-P34 WeakPolarHBondContact O-CD 3.27Å
33	T	25.1	Very low	26.2	Very low	99 Å²	99	127.2 Å²	127.2	61%	0.607	70%	0.697	S	S	*	*			trans	-88.2	108.3	151.7	42.5	0	0	0	0	105.1	D31 S35	D31-T33 PolarHBondContact O-N 2.9Å; T33-S35 PolarHBondContact O-N 2.86Å
34	P	25.1	Very low	26.1	Very low	105 Å²	105	130.1 Å²	130.1	68%	0.682	71%	0.707	S	S	*	*			trans	-60.2	114.6	157.1	26.3	-25.9	0	0	0	103.7	N32 Q36	N32-P34 WeakPolarHBondContact O-CD 3.27Å; P34-Q36 VanDerWaalsContact C-N 3.26Å; P34-Q36 PolarHBondContact O-N 2.67Å
35	S	25	Very low	26.3	Very low	83 Å²	83	130.8 Å²	130.8	58%	0.58	70%	0.701	S	S	*	*			trans	-48.2	104.6	163.1	47.5	0	0	0	0	105.5	T33 S37	T33-S35 PolarHBondContact O-N 2.86Å; S35-S37 PolarHBondContact O-N 2.79Å
36	Q	25.7	Very low	26.2	Very low	159 Å²	159	130 Å²	130	74%	0.743	71%	0.706	S	S	*	*			trans	-73.7	59.5	172.6	-80	-162.3	-5.3	0	0	107.7	P34 S38 E1017	P34-Q36 VanDerWaalsContact C-N 3.26Å; P34-Q36 PolarHBondContact O-N 2.67Å; Q36-S38 PolarHBondContact O-N 2.82Å; Q36-E1017 VanDerWaalsContact C-OE1 3.27Å; Q36-E1017 VanDerWaalsContact O-OE1 3.09Å
37	S	25.9	Very low	26.4	Very low	83 Å²	83	134 Å²	134	58%	0.58	72%	0.718	S	S	*	*			trans	-71.9	87.4	155.1	60.8	0	0	0	0	106	S35 F39 E1017	S35-S37 PolarHBondContact O-N 2.79Å; S37-F39 PolarHBondContact O-N 2.83Å; S37-E1017 WeakPolarHBondContact CA-OE1 3.49Å; S37-E1017 PolarHBondContact N-OE1 3.05Å
38	S	26.3	Very low	26.5	Very low	90 Å²	90	136.3 Å²	136.3	63%	0.629	72%	0.721	S	S	*	*			trans	-11.5	93.7	151.4	163.2	0	0	0	0	113.6	Q36	Q36-S38 PolarHBondContact O-N 2.82Å
39	F	26.3	Very low	26.7	Very low	203 Å²	203	134.6 Å²	134.6	89%	0.89	72%	0.72	S	S	*	*				-146.4	138	129	-96.4	-77.2	0	0	0	107.5	S37	S37-F39 PolarHBondContact O-N 2.83Å
40	G	25.7	Very low	26.8	Very low	69 Å²	69	137.1 Å²	137.1	71%	0.711	72%	0.723	S	S	*	*			trans	-56.5	154.1	-156.2	0	0	0	0	0	115.6	L42	G40-L42 PolarHBondContact O-N 2.92Å
41	H	26.3	Very low	26.9	Very low	174 Å²	174	140 Å²	140	81%	0.806	73%	0.734	S	S	*	*			trans	-28.5	107.4	150.3	-87.2	-17.7	0	0	0	112.1
42	L	25.7	Very low	27.1	Very low	144 Å²	144	139 Å²	139	75%	0.754	73%	0.733	S	S	*	*			trans	-109.3	75.7	141.6	-119.4	96	0	0	0	107.6	G40 H44	G40-L42 PolarHBondContact O-N 2.92Å; L42-H44 PolarHBondContact O-N 3.02Å; L42-H44 VanDerWaalsContact O-N 3.1Å
43	N	29.1	Very low	27.2	Very low	114 Å²	114	142.6 Å²	142.6	61%	0.61	74%	0.735	S	S	*	*			trans	-69.5	91.1	149.6	-89.4	-20	0	0	0	106.4	L45	N43-L45 PolarHBondContact O-N 2.8Å; N43-L45 VanDerWaalsContact O-N 3.11Å
44	H	28	Very low	27.6	Very low	175 Å²	175	145.7 Å²	145.7	81%	0.81	75%	0.747	S	S	*	*			trans	-80.6	71.1	156.2	-104.7	-20.3	0	0	0	108.5	L42	L42-H44 PolarHBondContact O-N 3.02Å; L42-H44 VanDerWaalsContact O-N 3.1Å
45	L	28.8	Very low	27.8	Very low	127 Å²	127	148.3 Å²	148.3	67%	0.665	76%	0.755	S	S	*	*			trans	-95	106.7	156.2	-92.2	157.1	0	0	0	106.9	N43 H47	N43-L45 PolarHBondContact O-N 2.8Å; N43-L45 VanDerWaalsContact O-N 3.11Å; L45-H47 PolarHBondContact O-N 2.82Å
46	N	26.4	Very low	27.9	Very low	121 Å²	121	148.5 Å²	148.5	65%	0.647	77%	0.77	S	S	*	*			trans	3.1	109.6	153.7	-73.5	-40	0	0	0	116.1
47	H	28.5	Very low	28	Very low	164 Å²	164	144.4 Å²	144.4	76%	0.759	77%	0.77	S	S	*	*			trans	-148.1	80.6	151.4	-106.4	-66.4	0	0	0	109.9	L45 E49	L45-H47 PolarHBondContact O-N 2.82Å; H47-E49 VanDerWaalsContact C-N 3.26Å; H47-E49 PolarHBondContact O-N 3.45Å; H47-E49 VanDerWaalsContact O-N 3.17Å
48	D	27.8	Very low	28.2	Very low	167 Å²	167	148.8 Å²	148.8	89%	0.893	78%	0.782	S	S	*	*			trans	-59.9	96.9	138.2	-83	-38.3	0	0	0	106.7
49	E	29.6	Very low	28.5	Very low	157 Å²	157	151.1 Å²	151.1	73%	0.734	79%	0.787	S	S	*	*			trans	170	82.4	155.4	-101.2	179.5	167.4	0	0	109.3	H47	H47-E49 VanDerWaalsContact C-N 3.26Å; H47-E49 PolarHBondContact O-N 3.45Å; H47-E49 VanDerWaalsContact O-N 3.17Å
50	Y	28.5	Very low	28.8	Very low	241 Å²	241	149 Å²	149	95%	0.945	78%	0.78	S	S	*	*			trans	-153	75.8	145.1	-107.6	-76.7	0	0	0	107.7
51	Q	28.9	Very low	29.2	Very low	179 Å²	179	154.4 Å²	154.4	84%	0.836	78%	0.78	S	S	*	*			trans	-87.5	130.5	160.2	-123.1	-162.3	41.3	0	0	108.5
52	T	30	Very low	29.5	Very low	112 Å²	112	153.4 Å²	153.4	69%	0.687	78%	0.78	S	S	*	*			trans	84	128.2	147.2	-0.8	0	0	0	0	120.3
53	R	29.3	Very low	29.9	Very low	228 Å²	228	152.5 Å²	152.5	86%	0.86	78%	0.783	S	S	*	*			trans	90.3	94.2	159.6	-60.6	-177.8	175.4	-172.6	-1	116.4
54	L	32.5	Very low	30.1	Very low	165 Å²	165	150 Å²	150	86%	0.864	78%	0.784	S	S	*	*				-165.5	103.2	95.2	-91.3	165.7	0	0	0	111
55	N	28.8	Very low	30.5	Very low	160 Å²	160	148.9 Å²	148.9	86%	0.856	78%	0.784	S	S	*	*			trans	27	126.2	143.8	-66	-10.3	0	0	0	120.9
56	G	28.6	Very low	30.8	Very low	87 Å²	87	149.1 Å²	149.1	90%	0.897	78%	0.784	S	S	*	*			trans	160.1	88.8	136.2	0	0	0	0	0	115.5
57	G	26.9	Very low	31.2	Very low	72 Å²	72	150.9 Å²	150.9	74%	0.742	79%	0.786	S	S	*	*			trans	135.1	105.1	154.1	0	0	0	0	0	114.4
58	E	30.2	Very low	31.5	Very low	176 Å²	176	150 Å²	150	82%	0.822	78%	0.783	S	S	*	*			trans	-169.3	125.5	132.8	-101.9	168.3	-158.9	0	0	108.9
59	D	33.5	Very low	31.7	Very low	139 Å²	139	147.5 Å²	147.5	74%	0.743	77%	0.769	S	S	*	*			trans	68.2	132.9	142.7	-60.4	-14.9	0	0	0	118.5
60	E	31.8	Very low	32	Very low	158 Å²	158	146.7 Å²	146.7	74%	0.738	77%	0.768	S	S	*	*			cis	178.9	158.3	48.2	-133.8	-179.2	-168.5	0	0	111.3
61	Y	34.4	Very low	32.1	Very low	182 Å²	182	140.9 Å²	140.9	71%	0.714	76%	0.763	S	S	*	*			trans	73.2	103.9	155.9	-77.6	-91	0	0	0	124.7
62	L	33.1	Very low	32.3	Very low	154 Å²	154	135.5 Å²	135.5	81%	0.806	76%	0.755	S	S	*	*				112.9	137.5	122	-69.8	168.6	0	0	0	123
63	P	33.6	Very low	32.4	Very low	124 Å²	124	137 Å²	137	81%	0.805	76%	0.759	S	S	*	*			trans	-113.6	171.2	-171.3	43.1	-31.1	0	0	0	115.2
64	G	34	Very low	32.6	Very low	61 Å²	61	131.4 Å²	131.4	63%	0.629	75%	0.746	S	S	*	*			trans	154.6	105.4	162.1	0	0	0	0	0	112.4
65	D	35.3	Very low	32.6	Very low	152 Å²	152	130.2 Å²	130.2	81%	0.813	74%	0.741	S	S	*	*				73.5	121.4	109	-79.6	-15.7	0	0	0	113.4
66	I	34.3	Very low	32.7	Very low	133 Å²	133	126.8 Å²	126.8	68%	0.682	73%	0.729	S	S	*	*				175.2	141.6	57.5	-111.5	157.6	0	0	0	109.9
67	K	36.2	Very low	33	Very low	157 Å²	157	129 Å²	129	68%	0.683	72%	0.721	S	S	*	*			trans	69.7	116.6	144.9	-72.9	-175.8	-176.5	-175.1	0	122
68	E	34.8	Very low	33.2	Very low	147 Å²	147	133.7 Å²	133.7	69%	0.687	72%	0.723	S	S	*	*				78.3	139	98.5	-73.8	-178.6	-152.2	0	0	112.5
69	N	32.6	Very low	33.6	Very low	114 Å²	114	132 Å²	132	61%	0.61	72%	0.72	S	S	*	*			cis	-173	150.1	15.1	-119.3	-23.4	0	0	0	108.7
70	I	34.3	Very low	33.6	Very low	140 Å²	140	132.9 Å²	132.9	72%	0.718	72%	0.723	S	S	*	*			trans	77.5	117.4	132.9	-65.4	166	0	0	0	121.2
71	S	32	Very low	34	Very low	119 Å²	119	130.4 Å²	130.4	83%	0.832	72%	0.721	S	S	*	*			trans	64.8	136.7	135.6	175.4	0	0	0	0	119.3
72	G	32.4	Very low	34.1	Very low	65 Å²	65	128 Å²	128	67%	0.67	73%	0.725	S	S	*	*			cis	164.5	147.6	9.5	0	0	0	0	0	110.1
73	N	31.8	Very low	34.2	Very low	143 Å²	143	126.6 Å²	126.6	77%	0.765	72%	0.718	S	S	*	*			trans	51.5	127.2	148.6	-103.8	6.8	0	0	0	124.2
74	N	33.1	Very low	34.2	Very low	111 Å²	111	126.5 Å²	126.5	59%	0.594	71%	0.711	S	S	*	*				93.7	121.7	124.4	-73.2	-12.3	0	0	0	121.5
75	N	32.9	Very low	34.4	Very low	141 Å²	141	129 Å²	129	75%	0.754	71%	0.71	S	S	*	*			trans	65.2	146	132.5	-65.6	-6.6	0	0	0	117
76	S	31.8	Very low	34.3	Very low	87 Å²	87	131.6 Å²	131.6	61%	0.608	71%	0.708	S	S	*	*			cis	176.5	169.6	-0.8	44.3	0	0	0	0	104.9
77	N	33.9	Very low	34.2	Very low	135 Å²	135	129.6 Å²	129.6	72%	0.722	71%	0.706	S	S	*	*			trans	84.4	112.4	160.9	-56.5	-10.3	0	0	0	115.4
78	E	32.3	Very low	33.9	Very low	170 Å²	170	130.4 Å²	130.4	79%	0.794	71%	0.712	S	S	*	*				100.2	157.3	71.5	-87.4	-164.6	162.4	0	0	110.9
79	D	38.2	Very low	33.9	Very low	139 Å²	139	133 Å²	133	74%	0.743	72%	0.717	S	S	*	*			trans	92.2	93.6	176.7	-55.8	-29.7	0	0	0	116
80	I	32.4	Very low	33.8	Very low	158 Å²	158	133.1 Å²	133.1	81%	0.81	72%	0.722	S	S	*	*				79.1	138.5	70.1	-67.9	-179.3	0	0	0	113.9
81	P	41.3	Very low	33.6	Very low	107 Å²	107	133.7 Å²	133.7	70%	0.695	73%	0.727	S	S	*	*			trans	-112	-179.7	-150.5	41.6	-28.5	0	0	0	114
82	T	35.5	Very low	33.7	Very low	130 Å²	130	136.5 Å²	136.5	80%	0.798	73%	0.729	S	S	*	*			trans	160.3	154.5	159.3	43.4	0	0	0	0	107.7
83	N	34.7	Very low	33.5	Very low	126 Å²	126	142.6 Å²	142.6	67%	0.674	74%	0.737	S	S	*	*			cis	-168.9	162.4	-3.3	-118.8	0.3	0	0	0	105.5
84	D	34.9	Very low	33.5	Very low	121 Å²	121	141.4 Å²	141.4	65%	0.647	74%	0.735	S	S	*	*			trans	39.4	139.3	135.9	-56.4	-30.5	0	0	0	119.8
85	D	38.8	Very low	33.4	Very low	115 Å²	115	144.5 Å²	144.5	62%	0.615	75%	0.746	S	S	*	*				178.3	139.2	53.8	-130.5	-20.2	0	0	0	109.9
86	R	31.6	Very low	33.4	Very low	206 Å²	206	146.1 Å²	146.1	78%	0.777	75%	0.749	S	S	*	*				63.9	136.5	127.1	-97.4	178.9	174.1	134.9	-3.9	126.7
87	S	32.2	Very low	33.2	Very low	90 Å²	90	145.8 Å²	145.8	63%	0.629	75%	0.746	S	S	*	*			trans	75.9	115	132.7	56.3	0	0	0	0	119.5
88	E	29.9	Very low	33.2	Very low	174 Å²	174	148.5 Å²	148.5	81%	0.813	75%	0.748	S	S	*	*				85.8	158.6	76	-89.9	-172.6	164.3	0	0	114.7
89	Y	34.6	Very low	33.2	Very low	202 Å²	202	147.2 Å²	147.2	79%	0.792	74%	0.742	S	S	*	*			trans	101.3	99	176.8	-67.2	-81.9	0	0	0	115.7
90	T	31.8	Very low	32.7	Very low	117 Å²	117	146.9 Å²	146.9	72%	0.718	74%	0.74	S	S	*	*				98.4	122.5	60.6	53.6	0	0	0	0	114.5
91	N	30.3	Very low	32.4	Very low	152 Å²	152	143.1 Å²	143.1	81%	0.813	73%	0.728	S	S	*	*			trans	36.9	132.6	136.2	-89.6	-16.4	0	0	0	122.7
92	M	32.7	Very low	31.7	Very low	178 Å²	178	144.6 Å²	144.6	88%	0.877	74%	0.735	S	S	*	*				169.6	116.2	113.9	-90	-171	-80.5	0	0	110.2
93	K	29.3	Very low	31.5	Very low	193 Å²	193	144 Å²	144	84%	0.839	74%	0.735	S	S	*	*				37.6	133.3	104.5	-85.9	-173.2	173.9	-172.2	0	115.4
94	T	31.9	Very low	31.3	Very low	118 Å²	118	143.7 Å²	143.7	72%	0.724	74%	0.739	S	S	*	*				176.3	119	92.6	-52.9	0	0	0	0	107.2
95	E	29.7	Very low	30.9	Very low	175 Å²	175	142.6 Å²	142.6	82%	0.818	74%	0.742	S	S	*	*				65.1	157.1	102.9	-67	-173.3	168.7	0	0	119.1
96	E	33.8	Very low	30.6	Very low	175 Å²	175	145.4 Å²	145.4	82%	0.818	75%	0.75	S	S	*	*			trans	103.1	95.2	168.3	-60.9	-170.9	174.2	0	0	115.8
97	S	28.4	Very low	30.3	Very low	80 Å²	80	139.7 Å²	139.7	56%	0.559	74%	0.742	S	S	*	*				80.7	119.7	71.5	70.6	0	0	0	0	114.2
98	Y	32	Very low	30.1	Very low	193 Å²	193	142.4 Å²	142.4	76%	0.757	75%	0.745	S	S	*	*				166.2	130.3	107.5	-97.2	-62.5	0	0	0	115.2
99	H	32.2	Very low	29.9	Very low	142 Å²	142	141 Å²	141	66%	0.657	74%	0.739	S	S	*	*			trans	72.1	124.3	135.5	-85.6	-45	0	0	0	124.9
100	D	28.2	Very low	29.6	Very low	133 Å²	133	138.7 Å²	138.7	71%	0.711	74%	0.735	S	S	*	*				68	144.6	127.6	-85.2	33.7	0	0	0	120
101	S	26.3	Very low	29.4	Very low	79 Å²	79	138.9 Å²	138.9	55%	0.552	73%	0.731	S	S	*	*			cis	-177.4	153.8	-7.4	-101	0	0	0	0	106.9
102	T	26.5	Very low	29.5	Very low	137 Å²	137	137.2 Å²	137.2	84%	0.84	72%	0.722	S	S	*	*			trans	67.9	115.6	150.2	23.4	0	0	0	0	121.8
103	C	31.5	Very low	29.2	Very low	119 Å²	119	136.4 Å²	136.4	80%	0.804	72%	0.716	S	S	*	*			trans	-56.6	163.7	144.5	-64.9	0	0	0	0	111.8
104	P	30.6	Very low	29.4	Very low	118 Å²	118	133.5 Å²	133.5	77%	0.766	71%	0.709	S	S	*	*				-142.4	153.4	107.8	33.4	-17.1	0	0	0	115.8
105	S	27.3	Very low	29.4	Very low	99 Å²	99	133.9 Å²	133.9	69%	0.692	71%	0.706	S	S	*	*			trans	-53.2	147.7	159.9	48.7	0	0	0	0	114.8
106	H	32.1	Very low	29.2	Very low	173 Å²	173	132.8 Å²	132.8	80%	0.801	71%	0.705	S	S	*	*			trans	-162.9	111.6	144.1	-92.9	-67.5	0	0	0	106.2
107	S	25.7	Very low	29.1	Very low	86 Å²	86	132.9 Å²	132.9	60%	0.601	70%	0.702	S	S	*	*				54.7	133.7	87.4	71.5	0	0	0	0	111.2
108	E	26.4	Very low	29.2	Very low	148 Å²	148	135.4 Å²	135.4	69%	0.692	71%	0.71	S	S	*	*			cis	175.8	163.3	10.1	-123.2	-178.1	138	0	0	103.7
109	Q	26.5	Very low	29	Very low	145 Å²	145	133.9 Å²	133.9	68%	0.678	71%	0.71	S	S	*	*			trans	69.2	142.8	143.9	-74.8	167.2	15.3	0	0	117.3
110	E	27.7	Very low	28.8	Very low	153 Å²	153	135.8 Å²	135.8	72%	0.715	72%	0.718	S	S	*	*			cis	-179.9	175.1	-4.4	-134.8	-179.9	163.8	0	0	105
111	L	27.9	Very low	28.8	Very low	121 Å²	121	132.6 Å²	132.6	63%	0.634	72%	0.717	S	S	*	*			trans	87.3	113.4	146.2	-100	73.8	0	0	0	120.5
112	D	32.3	Very low	29	Very low	117 Å²	117	138.4 Å²	138.4	63%	0.626	73%	0.732	S	S	*	*				107.4	96.9	123.9	-71.8	-14.2	0	0	0	120.9
113	Q	27.7	Very low	29.1	Very low	160 Å²	160	140.1 Å²	140.1	75%	0.748	74%	0.736	S	S	*	*				32.1	123.4	107.6	-67.1	-177.9	32	0	0	116.6
114	D	32.4	Very low	29.1	Very low	132 Å²	132	143.2 Å²	143.2	71%	0.706	74%	0.739	S	S	*	*				-173.8	132.2	107.4	-101.3	-19.1	0	0	0	115
115	I	31.4	Very low	28.9	Very low	126 Å²	126	145.2 Å²	145.2	65%	0.646	74%	0.743	S	S	*	*			trans	78	94.1	131.8	-59.6	164.9	0	0	0	119.8
116	L	26.3	Very low	29	Very low	153 Å²	153	148.2 Å²	148.2	80%	0.801	75%	0.749	S	S	*	*				11.6	127.9	119.3	-72.6	156.1	0	0	0	118.1
117	K	31.1	Very low	28.8	Very low	176 Å²	176	144.7 Å²	144.7	77%	0.765	74%	0.742	S	S	*	*				174.6	134.8	118.3	-94.6	160.5	-172.9	179.9	0	114.3
118	N	31.4	Very low	28.8	Very low	133 Å²	133	148.5 Å²	148.5	71%	0.711	75%	0.75	S	S	*	*			trans	74.1	105.2	144.4	-58.1	-1.6	0	0	0	117.8
119	E	28.3	Very low	28.7	Very low	162 Å²	162	149.3 Å²	149.3	76%	0.757	75%	0.754	S	S	*	*				82.1	114.4	73.5	-81.7	-161.2	159.8	0	0	114.9
120	H	27.6	Very low	28.7	Very low	181 Å²	181	148 Å²	148	84%	0.838	75%	0.751	S	S	*	*			trans	62.5	111.8	135.6	-72.6	56.4	0	0	0	118.9
121	G	28.6	Very low	28.7	Very low	67 Å²	67	150 Å²	150	69%	0.691	76%	0.763	S	S	*	*			trans	173.6	86.6	158.4	0	0	0	0	0	116.6
122	K	29.6	Very low	28.6	Very low	200 Å²	200	151.5 Å²	151.5	87%	0.87	77%	0.767	S	S	*	*			trans	66.9	97.4	139.7	-54.9	176.3	-177.4	-178.3	0	117.8
123	N	29.5	Very low	28.2	Very low	173 Å²	173	151.8 Å²	151.8	93%	0.925	78%	0.777	S	S	*	*			trans	-92.6	110.2	146.3	-89.2	-12.5	0	0	0	108.3
124	E	30.8	Very low	28.1	Very low	184 Å²	184	152.1 Å²	152.1	86%	0.86	78%	0.783	S	S	*	*			trans	-68.3	137.9	168.3	-94.2	173.7	147.7	0	0	110.8
125	L	26.8	Very low	27.8	Very low	160 Å²	160	152.1 Å²	152.1	84%	0.838	78%	0.783	S	S	*	*			trans	-61.2	135.4	163.2	-80.3	82.8	0	0	0	110.1
126	I	29.5	Very low	27.6	Very low	163 Å²	163	154.2 Å²	154.2	84%	0.836	79%	0.794	S	S	*	*			trans	-120.5	121.3	151	-60.5	178.3	0	0	0	106.4
127	P	26.5	Very low	27.6	Very low	98 Å²	98	154.2 Å²	154.2	64%	0.636	79%	0.79	S	S	*	*			trans	-91.5	163.7	-171.1	37.1	-34.1	0	0	0	112.8
128	E	25.7	Very low	27.3	Very low	167 Å²	167	153.4 Å²	153.4	78%	0.78	79%	0.793	S	S	*	*			trans	49.1	119.8	151.1	-66.6	-177.6	164.6	0	0	119.1
129	Q	26.2	Very low	27.2	Very low	164 Å²	164	153.2 Å²	153.2	77%	0.766	80%	0.797	S	S	*	*				157	131.1	118.2	-84.1	169.8	12.2	0	0	110.5
130	N	26.3	Very low	27.1	Very low	117 Å²	117	153.7 Å²	153.7	63%	0.626	80%	0.799	S	S	*	*			trans	63.8	98.9	153.1	-55.5	-8.6	0	0	0	118.2
131	M	26.9	Very low	27	Very low	196 Å²	196	152.1 Å²	152.1	97%	0.966	80%	0.797	S	S	*	*				-116.7	85.9	128.3	-86.4	-143.7	-69.7	0	0	108.2
132	E	26.9	Very low	27.1	Very low	152 Å²	152	158.1 Å²	158.1	71%	0.71	81%	0.807	S	S	*	*			trans	-50.3	141.6	160.5	-77.9	168.9	131.7	0	0	110.5	L134	E132-L134 PolarHBondContact O-N 3.13Å; E132-L134 VanDerWaalsContact O-N 3.11Å
133	C	23.6	Very low	27.2	Very low	124 Å²	124	157.6 Å²	157.6	84%	0.838	81%	0.808	S	S	*	*			trans	-49.6	111.3	160.2	-53.5	0	0	0	0	109.4	N135	C133-N135 PolarHBondContact O-N 3Å
134	L	25.2	Very low	27.5	Very low	166 Å²	166	157.5 Å²	157.5	87%	0.869	80%	0.799	S	S	*	*			trans	-79.5	87.5	165.6	-84.7	167	0	0	0	108.9	E132 I136	E132-L134 PolarHBondContact O-N 3.13Å; E132-L134 VanDerWaalsContact O-N 3.11Å; L134-I136 PolarHBondContact O-N 3.46Å
135	N	25.4	Very low	28	Very low	133 Å²	133	154.6 Å²	154.6	71%	0.711	79%	0.789	S	S	*	*			trans	-46	113.3	161.3	-160	15.5	0	0	0	110.3	C133 Q137	C133-N135 PolarHBondContact O-N 3Å; N135-Q137 VanDerWaalsContact C-N 3.31Å; N135-Q137 PolarHBondContact O-N 3.11Å; N135-Q137 VanDerWaalsContact O-N 3.08Å
136	I	27.7	Very low	29.1	Very low	170 Å²	170	149.7 Å²	149.7	87%	0.872	77%	0.768	S	S	*	*			trans	-82.8	80.5	174.2	-57.2	175.2	0	0	0	107.6	L134	L134-I136 PolarHBondContact O-N 3.46Å
137	Q	25.7	Very low	29.7	Very low	153 Å²	153	149.7 Å²	149.7	72%	0.715	76%	0.762	S	S	*	*			trans	-141.4	123.7	160.3	-76.4	-166.1	-19.6	0	0	108.7	N135	N135-Q137 VanDerWaalsContact C-N 3.31Å; N135-Q137 PolarHBondContact O-N 3.11Å; N135-Q137 VanDerWaalsContact O-N 3.08Å
138	N	25.2	Very low	31.3	Very low	158 Å²	158	150.4 Å²	150.4	85%	0.845	76%	0.76	S	S	*	*			trans	70.9	119	-176.2	-53.9	-29.3	0	0	0	112.8
139	V	28.7	Very low	33.1	Very low	130 Å²	130	146.9 Å²	146.9	79%	0.788	74%	0.744	S	S	*	*				-160.5	129.7	74	161.4	0	0	0	0	109.7
140	E	26.4	Very low	34.5	Very low	171 Å²	171	143.3 Å²	143.3	80%	0.799	73%	0.729	S	S	*	*			trans	-50.6	148.7	164.8	-66.6	160.7	129.8	0	0	112.4
141	N	26.3	Very low	35.9	Very low	148 Å²	148	142 Å²	142	79%	0.791	72%	0.718	S	S	*	*			trans	67.9	97.4	169.2	-61.9	-36.7	0	0	0	117.1
142	Q	30.3	Very low	37.8	Very low	194 Å²	194	138.5 Å²	138.5	91%	0.907	70%	0.699	S	S	*	*			trans	-160	136.2	144.9	-109.8	157.5	68.2	0	0	113.5
143	Q	31	Very low	39.4	Very low	189 Å²	189	135 Å²	135	88%	0.883	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-58.1	136.6	-168.9	-73	163	-52	0	0	114.3	L145	Q143-L145 PolarHBondContact O-N 3.37Å
144	K	36.8	Very low	40.8	Very low	170 Å²	170	132.7 Å²	132.7	74%	0.739	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-54.9	121.4	162.4	-98	-178.7	173.8	-175.6	0	109.5	S146	K144-S146 PolarHBondContact O-N 3.01Å
145	L	41.8	Very low	42.3	Very low	123 Å²	123	129.6 Å²	129.6	64%	0.644	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-61.1	131.4	170.8	-74.1	155.5	0	0	0	109.7	Q143 Q149	Q143-L145 PolarHBondContact O-N 3.37Å; L145-Q149 HydrophobicContact CB-CB 4.43Å; L145-Q149 HydrophobicContact CD2-CB 3.83Å; L145-Q149 HydrophobicContact CD2-CG 4.25Å
146	S	48.7	Very low	44.2	Very low	57 Å²	57	131.5 Å²	131.5	40%	0.399	65%	0.647	S	S	.	*	P	Polyproline II helix	trans	-67.4	154.9	173.7	70.4	0	0	0	0	111.3	K144 N148 Q149 I150	K144-S146 PolarHBondContact O-N 3.01Å; S146-N148 PolarHBondContact O-N 2.89Å; S146-N148 VanDerWaalsContact O-N 3.07Å; S146-Q149 PolarHBondContact O-N 2.97Å; S146-Q149 PolarHBondContact OG-OE1 2.9Å; S146-I150 PolarHBondContact O-N 2.98Å
147	F	43.3	Very low	45.8	Very low	163 Å²	163	129.6 Å²	129.6	72%	0.715	63%	0.633	S	S	*	*	H	α-helix	trans	-48.4	-35.3	173.3	177.8	-98.1	0	0	0	113.3	I150 K151	F147-I150 PolarHBondContact O-N 3.27Å; F147-K151 PolarHBondContact O-N 3.33Å; F147-K151 VanDerWaalsContact O-N 3.08Å
148	N	59.6	Low	46.7	Very low	113 Å²	113	129.6 Å²	129.6	60%	0.604	64%	0.638	S	S	*	*	H	α-helix	trans	-69.6	-33.7	179	-70.8	-36.3	0	0	0	113.4	S146 K151 E152	S146-N148 PolarHBondContact O-N 2.89Å; S146-N148 VanDerWaalsContact O-N 3.07Å; N148-K151 PolarHBondContact O-N 3.28Å; N148-E152 PolarHBondContact O-N 3.36Å
149	Q	62.5	Low	47.5	Very low	93 Å²	93	127.1 Å²	127.1	44%	0.435	63%	0.628	S	S	.	*	H	α-helix	trans	-71.8	-33.9	176.2	-75.3	153.6	-36.9	0	0	111.6	L145 S146 D153	L145-Q149 HydrophobicContact CB-CB 4.43Å; L145-Q149 HydrophobicContact CD2-CB 3.83Å; L145-Q149 HydrophobicContact CD2-CG 4.25Å; S146-Q149 PolarHBondContact O-N 2.97Å; S146-Q149 PolarHBondContact OG-OE1 2.9Å; Q149-D153 WeakPolarHBondContact O-CB 3.22Å; Q149-D153 PolarHBondContact O-N 3.49Å; Q149-D153 VanDerWaalsContact O-N 3.15Å
150	I	56.1	Low	48	Very low	89 Å²	89	124.5 Å²	124.5	46%	0.456	61%	0.609	S	S	.	*	H	α-helix	trans	-67.2	-39.3	173.9	-61.9	172	0	0	0	110.4	S146 F147 D153 L154	S146-I150 PolarHBondContact O-N 2.98Å; F147-I150 PolarHBondContact O-N 3.27Å; I150-D153 PolarHBondContact O-N 3.29Å; I150-L154 HydrophobicContact CG2-CD1 4.01Å; I150-L154 WeakPolarHBondContact O-CD1 3.39Å; I150-L154 VanDerWaalsContact O-CG 3.3Å; I150-L154 WeakPolarHBondContact O-CG 3.35Å; I150-L154 PolarHBondContact O-N 3.45Å; I150-L154 VanDerWaalsContact O-N 3.1Å
151	K	56.9	Low	48.3	Very low	90 Å²	90	120 Å²	120	39%	0.391	61%	0.608	S	S	.	*	H	α-helix	trans	-65.2	-45.9	176.3	-175.2	174.8	178.6	-69.2	0	112.7	F147 N148 D153 L154 E155	F147-K151 PolarHBondContact O-N 3.33Å; F147-K151 VanDerWaalsContact O-N 3.08Å; N148-K151 PolarHBondContact O-N 3.28Å; K151-D153 VanDerWaalsContact C-N 3.3Å; K151-D153 PolarHBondContact O-N 3.29Å; K151-L154 PolarHBondContact O-N 3.47Å; K151-E155 IonicContact NZ-OE1 3.74Å; K151-E155 PolarHBondContact NZ-OE1 2.76Å; K151-E155 WeakPolarHBondContact O-CG 3.29Å; K151-E155 PolarHBondContact O-N 2.94Å
152	E	65.6	Low	48.8	Very low	123 Å²	123	118.5 Å²	118.5	58%	0.575	61%	0.609	S	S	*	*	H	α-helix	trans	-62.4	-35.9	175.8	-83.8	-172.5	155.5	0	0	112.8	N148 E155 K156	N148-E152 PolarHBondContact O-N 3.36Å; E152-E155 PolarHBondContact O-N 2.82Å; E152-K156 WeakPolarHBondContact O-CB 3.28Å; E152-K156 PolarHBondContact O-N 3.25Å
153	D	60.1	Low	48.9	Very low	79 Å²	79	113 Å²	113	42%	0.422	59%	0.586	S	S	.	*	H	α-helix	trans	-73	-32.1	179.6	-150.3	49.6	0	0	0	112	Q149 I150 K151 K157	Q149-D153 WeakPolarHBondContact O-CB 3.22Å; Q149-D153 PolarHBondContact O-N 3.49Å; Q149-D153 VanDerWaalsContact O-N 3.15Å; I150-D153 PolarHBondContact O-N 3.29Å; K151-D153 VanDerWaalsContact C-N 3.3Å; K151-D153 PolarHBondContact O-N 3.29Å; D153-K157 WeakPolarHBondContact O-CB 3.21Å; D153-K157 WeakPolarHBondContact O-CD 3.3Å; D153-K157 VanDerWaalsContact O-CG 3.26Å; D153-K157 WeakPolarHBondContact O-CG 3.15Å; D153-K157 PolarHBondContact O-N 3.45Å; D153-K157 VanDerWaalsContact OD2-CE 3.31Å; D153-K157 WeakPolarHBondContact OD2-CE 3.15Å; D153-K157 IonicContact OD2-NZ 2.84Å; D153-K157 PolarHBondContact OD2-NZ 3.01Å
154	L	54.3	Low	49.1	Very low	74 Å²	74	112.6 Å²	112.6	39%	0.387	58%	0.584	S	S	.	*	H	α-helix	trans	-73.6	-35.5	172.5	-72.9	166.9	0	0	0	112.7	I150 K151 I160	I150-L154 HydrophobicContact CG2-CD1 4.01Å; I150-L154 WeakPolarHBondContact O-CD1 3.39Å; I150-L154 VanDerWaalsContact O-CG 3.3Å; I150-L154 WeakPolarHBondContact O-CG 3.35Å; I150-L154 PolarHBondContact O-N 3.45Å; I150-L154 VanDerWaalsContact O-N 3.1Å; K151-L154 PolarHBondContact O-N 3.47Å; L154-I160 HydrophobicContact CB-CD1 3.99Å
155	E	55.4	Low	48.7	Very low	101 Å²	101	109.6 Å²	109.6	47%	0.472	58%	0.581	S	S	.	*	H	α-helix	trans	-68.3	-40.1	172.9	-75.4	174.7	-176.3	0	0	111.6	K151 E152 K157 N158	K151-E155 IonicContact NZ-OE1 3.74Å; K151-E155 PolarHBondContact NZ-OE1 2.76Å; K151-E155 WeakPolarHBondContact O-CG 3.29Å; K151-E155 PolarHBondContact O-N 2.94Å; E152-E155 PolarHBondContact O-N 2.82Å; E155-K157 VanDerWaalsContact C-N 3.33Å; E155-K157 PolarHBondContact O-N 2.76Å; E155-N158 PolarHBondContact O-N 2.9Å
156	K	65.1	Low	48.3	Very low	173 Å²	173	111.8 Å²	111.8	75%	0.752	59%	0.593	S	S	*	*	H	α-helix	trans	-65.5	-30.4	174.7	-89.4	178.7	178.1	167.8	0	114.1	E152 N158	E152-K156 WeakPolarHBondContact O-CB 3.28Å; E152-K156 PolarHBondContact O-N 3.25Å; K156-N158 PolarHBondContact O-N 3.17Å
157	K	61.3	Low	47.6	Very low	130 Å²	130	119.9 Å²	119.9	57%	0.565	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	3.1	-179.4	-72.6	172.5	-171.8	163.6	0	113.7	D153 E155 V159	D153-K157 WeakPolarHBondContact O-CB 3.21Å; D153-K157 WeakPolarHBondContact O-CD 3.3Å; D153-K157 VanDerWaalsContact O-CG 3.26Å; D153-K157 WeakPolarHBondContact O-CG 3.15Å; D153-K157 PolarHBondContact O-N 3.45Å; D153-K157 VanDerWaalsContact OD2-CE 3.31Å; D153-K157 WeakPolarHBondContact OD2-CE 3.15Å; D153-K157 IonicContact OD2-NZ 2.84Å; D153-K157 PolarHBondContact OD2-NZ 3.01Å; E155-K157 VanDerWaalsContact C-N 3.33Å; E155-K157 PolarHBondContact O-N 2.76Å; K157-V159 HydrophobicContact CB-CG2 3.68Å; K157-V159 VanDerWaalsContact O-CG2 3.24Å; K157-V159 WeakPolarHBondContact O-CG2 3.39Å; K157-V159 PolarHBondContact O-N 2.99Å; K157-V159 VanDerWaalsContact O-N 3.17Å
158	N	45.6	Very low	47	Very low	154 Å²	154	117.8 Å²	117.8	82%	0.824	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	58	28.8	174.7	-132.6	8	0	0	0	113.6	E155 K156	E155-N158 PolarHBondContact O-N 2.9Å; K156-N158 PolarHBondContact O-N 3.17Å
159	V	42.1	Very low	45.7	Very low	105 Å²	105	121.3 Å²	121.3	64%	0.636	63%	0.63	S	S	*	*			trans	-90.7	-3.7	-175.7	-165.9	0	0	0	0	111.7	K157	K157-V159 HydrophobicContact CB-CG2 3.68Å; K157-V159 VanDerWaalsContact O-CG2 3.24Å; K157-V159 WeakPolarHBondContact O-CG2 3.39Å; K157-V159 PolarHBondContact O-N 2.99Å; K157-V159 VanDerWaalsContact O-N 3.17Å
160	I	38.1	Very low	44.2	Very low	76 Å²	76	125.4 Å²	125.4	39%	0.39	65%	0.649	S	S	.	*			trans	-137.4	105	-171.4	-50.3	179.2	0	0	0	110.5	L154 S162 L163	L154-I160 HydrophobicContact CB-CD1 3.99Å; I160-S162 PolarHBondContact O-N 2.77Å; I160-L163 HydrophobicContact CG2-CD1 3.83Å; I160-L163 HydrophobicContact CG2-CG 4Å
161	G	34.5	Very low	43	Very low	75 Å²	75	128.3 Å²	128.3	77%	0.773	66%	0.656	S	S	*	*			trans	-79.5	99.8	172.8	0	0	0	0	0	111.7
162	S	36.4	Very low	41.9	Very low	117 Å²	117	131.9 Å²	131.9	82%	0.818	68%	0.677	S	S	*	*			trans	58	110.1	166.5	64.6	0	0	0	0	118.3	I160	I160-S162 PolarHBondContact O-N 2.77Å
163	L	30.7	Very low	40.3	Very low	80 Å²	80	134.7 Å²	134.7	42%	0.419	69%	0.693	S	S	.	*			trans	-109	125.4	170.3	-73.1	160.3	0	0	0	109.8	I160 Y171	I160-L163 HydrophobicContact CG2-CD1 3.83Å; I160-L163 HydrophobicContact CG2-CG 4Å; L163-Y171 HydrophobicContact CD2-CD1 3.39Å; L163-Y171 HydrophobicContact CD2-CD2 4.44Å; L163-Y171 HydrophobicContact CD2-CE1 3.31Å; L163-Y171 HydrophobicContact CD2-CE2 4.36Å; L163-Y171 HydrophobicContact CD2-CG 4Å; L163-Y171 HydrophobicContact CG-CE1 4.48Å
164	Q	35.5	Very low	39.1	Very low	180 Å²	180	140 Å²	140	84%	0.841	72%	0.715	S	S	*	*			trans	-113.4	139.9	162.4	-93.5	-158.8	-17.8	0	0	111
165	P	29.3	Very low	38.1	Very low	106 Å²	106	144.8 Å²	144.8	69%	0.688	74%	0.735	S	S	*	*			trans	-92.1	138.4	-168.6	34.8	-31.5	0	0	0	112.7
166	L	32.2	Very low	37.1	Very low	169 Å²	169	148.2 Å²	148.2	89%	0.885	75%	0.75	S	S	*	*	S	Bend	trans	-117	-29.6	171.2	-83.1	161.9	0	0	0	114.2
167	R	34.4	Very low	35.7	Very low	228 Å²	228	145.1 Å²	145.1	86%	0.86	76%	0.757	S	S	*	*	S	Bend	trans	173	166.2	165.6	-105.5	177	-128.4	-161	3.4	110.2	E169	R167-E169 PolarHBondContact O-N 2.75Å
168	P	31.7	Very low	34.3	Very low	119 Å²	119	142 Å²	142	77%	0.773	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	121.7	-169.4	28.4	-30.8	0	0	0	111.4
169	E	32	Very low	33.5	Very low	186 Å²	186	142.5 Å²	142.5	87%	0.869	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	136.9	0.3	149.1	-69.7	-170.8	-178.7	0	0	119.6	R167	R167-E169 PolarHBondContact O-N 2.75Å
170	Q	31.5	Very low	33	Very low	180 Å²	180	143.7 Å²	143.7	84%	0.841	77%	0.765	S	S	*	*			trans	-148.9	141.9	175.4	-67.9	-176	-20.2	0	0	116.7
171	Y	31.1	Very low	32.5	Very low	150 Å²	150	149.1 Å²	149.1	59%	0.588	79%	0.786	S	S	*	*			trans	-142.1	142.3	175.3	-68.6	-79.5	0	0	0	112.1	L163	L163-Y171 HydrophobicContact CD2-CD1 3.39Å; L163-Y171 HydrophobicContact CD2-CD2 4.44Å; L163-Y171 HydrophobicContact CD2-CE1 3.31Å; L163-Y171 HydrophobicContact CD2-CE2 4.36Å; L163-Y171 HydrophobicContact CD2-CG 4Å; L163-Y171 HydrophobicContact CG-CE1 4.48Å
172	I	33.8	Very low	32.4	Very low	164 Å²	164	155.2 Å²	155.2	84%	0.841	79%	0.794	S	S	*	*			trans	-137	142.9	176.7	-60.3	178.8	0	0	0	112.2
173	M	31.9	Very low	32	Very low	183 Å²	183	157.8 Å²	157.8	90%	0.901	79%	0.793	S	S	*	*			trans	-111.3	158	-179.1	-76.3	-169.3	-71.7	0	0	114.1
174	H	33.4	Very low	31.9	Very low	190 Å²	190	163.5 Å²	163.5	88%	0.88	82%	0.818	S	S	*	*			trans	-142.1	143.2	169.8	-115.7	-81.5	0	0	0	113.4
175	H	34.1	Very low	31.5	Very low	175 Å²	175	162.2 Å²	162.2	81%	0.81	81%	0.814	S	S	*	*			trans	-150.4	167.4	159.9	-154.4	-94	0	0	0	113.9
176	Q	34.9	Very low	31.6	Very low	172 Å²	172	164 Å²	164	80%	0.804	82%	0.817	S	S	*	*			trans	-96.7	168.3	-139.8	-157.7	167.2	-0.3	0	0	118.8
177	A	34.1	Very low	31.6	Very low	108 Å²	108	160 Å²	160	89%	0.893	80%	0.799	S	S	*	*			trans	-110.1	175.7	-152.4	0	0	0	0	0	120.4
178	G	32.8	Very low	31.5	Very low	65 Å²	65	154.3 Å²	154.3	67%	0.67	79%	0.785	S	S	*	*			trans	-174.1	111.3	156.4	0	0	0	0	0	119.5
179	L	29.7	Very low	31.7	Very low	165 Å²	165	150.8 Å²	150.8	86%	0.864	76%	0.76	S	S	*	*			trans	51.4	136	153.9	-63.6	102.3	0	0	0	122.2
180	I	30.7	Very low	31.8	Very low	129 Å²	129	147.8 Å²	147.8	66%	0.662	76%	0.757	S	S	*	*			cis	-165.3	142.7	10.4	-102.4	168.1	0	0	0	111.5
181	K	28.7	Very low	31.8	Very low	191 Å²	191	148 Å²	148	83%	0.83	76%	0.757	S	S	*	*			trans	52.1	112	152.4	-65.9	173.5	-173.1	-177.4	0	120.8
182	Q	32.1	Very low	32.8	Very low	202 Å²	202	144.6 Å²	144.6	94%	0.944	75%	0.753	S	S	*	*				-166.1	147.5	71	-130	173.5	-7.4	0	0	108.4
183	Q	28	Very low	32.8	Very low	171 Å²	171	139.1 Å²	139.1	80%	0.799	74%	0.737	S	S	*	*			trans	-94.6	143	-145.7	-103.2	154.4	-50	0	0	116.3
184	E	28.8	Very low	33	Very low	201 Å²	201	134.6 Å²	134.6	94%	0.939	72%	0.716	S	S	*	*				-161.6	128.8	121.9	-108.4	171.7	-170.8	0	0	110.7
185	M	27.2	Very low	33.4	Very low	153 Å²	153	128.4 Å²	128.4	75%	0.754	69%	0.692	S	S	*	*			trans	-94.8	145.8	-172.3	-82.7	-175.8	-61.9	0	0	111.7
186	L	31.5	Very low	33.6	Very low	144 Å²	144	125.2 Å²	125.2	75%	0.754	68%	0.68	S	S	*	*			trans	-125.5	118.6	160.7	-86.4	162.6	0	0	0	108.7	V195	L186-V195 HydrophobicContact CB-CG1 3.83Å; L186-V195 HydrophobicContact CB-CG2 4.15Å; L186-V195 HydrophobicContact CD2-CB 4.07Å; L186-V195 HydrophobicContact CD2-CG1 3.14Å; L186-V195 HydrophobicContact CD2-CG2 4.28Å; L186-V195 HydrophobicContact CG-CG1 4.04Å
187	V	31.4	Very low	33.7	Very low	83 Å²	83	122.1 Å²	122.1	50%	0.503	68%	0.677	S	S	.	*			trans	-95.5	102.3	-171.8	176.1	0	0	0	0	109.5	V195 L196	V187-V195 WeakPolarHBondContact O-CA 3.47Å; V187-V195 WeakPolarHBondContact O-CG1 3.25Å; V187-L196 PolarHBondContact O-N 3.38Å
188	L	31.4	Very low	33.8	Very low	109 Å²	109	123.7 Å²	123.7	57%	0.571	67%	0.671	S	S	*	*	B	Isolated β-bridge	trans	-81.6	129.8	175.3	-70	162.8	0	0	0	110.7	P190 G193 D194 V195	L188-P190 VanDerWaalsContact O-CD 3.31Å; L188-P190 WeakPolarHBondContact O-CD 3.44Å; L188-G193 WeakPolarHBondContact CD2-O 3.37Å; L188-D194 CarbonylContact C-O 3.53Å; L188-D194 WeakPolarHBondContact CA-O 3.33Å; L188-V195 HydrophobicContact CD2-CB 4.25Å; L188-V195 HydrophobicContact CD2-CG2 3.18Å; L188-V195 HydrophobicContact CG-CG2 3.66Å
189	N	36.8	Very low	33.6	Very low	46 Å²	46	127.6 Å²	127.6	25%	0.246	67%	0.672	C	S	.	*			trans	-65.8	116	164.8	-179.7	-18.6	0	0	0	108	Q191 T192 G193 D194	N189-Q191 PolarHBondContact O-N 2.98Å; N189-Q191 VanDerWaalsContact O-N 3.17Å; N189-Q191 PolarHBondContact OD1-N 3.31Å; N189-T192 VanDerWaalsContact CB-OG1 3.27Å; N189-T192 WeakPolarHBondContact CB-OG1 3.43Å; N189-T192 PolarHBondContact ND2-OG1 3.16Å; N189-T192 VanDerWaalsContact ND2-OG1 3.09Å; N189-T192 PolarHBondContact O-N 3.03Å; N189-G193 WeakPolarHBondContact O-CA 3.18Å; N189-G193 PolarHBondContact O-N 3.4Å; N189-D194 HydrophobicContact CB-CB 4.19Å; N189-D194 WeakPolarHBondContact CB-O 3.29Å; N189-D194 PolarHBondContact N-O 3.05Å
190	P	33.1	Very low	33.6	Very low	123 Å²	123	130.4 Å²	130.4	80%	0.799	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-8.2	-174.3	28.2	-33.6	0	0	0	113.9	L188	L188-P190 VanDerWaalsContact O-CD 3.31Å; L188-P190 WeakPolarHBondContact O-CD 3.44Å
191	Q	33.2	Very low	33.4	Very low	183 Å²	183	129.1 Å²	129.1	86%	0.855	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	-20.5	176.1	-67.2	-170.5	-13.6	0	0	113.9	N189	N189-Q191 PolarHBondContact O-N 2.98Å; N189-Q191 VanDerWaalsContact O-N 3.17Å; N189-Q191 PolarHBondContact OD1-N 3.31Å
192	T	50.6	Low	33.4	Very low	79 Å²	79	124.7 Å²	124.7	49%	0.485	67%	0.668	S	S	.	*	T	Hydrogen-bonded Turn	trans	-122.4	-13.2	-178.3	61.7	0	0	0	0	113.9	N189 D194	N189-T192 VanDerWaalsContact CB-OG1 3.27Å; N189-T192 WeakPolarHBondContact CB-OG1 3.43Å; N189-T192 PolarHBondContact ND2-OG1 3.16Å; N189-T192 VanDerWaalsContact ND2-OG1 3.09Å; N189-T192 PolarHBondContact O-N 3.03Å; T192-D194 WeakPolarHBondContact CB-OD2 3.45Å; T192-D194 PolarHBondContact O-N 2.98Å; T192-D194 WeakPolarHBondContact OG1-CB 3.3Å; T192-D194 PolarHBondContact OG1-N 2.89Å; T192-D194 PolarHBondContact OG1-OD2 3.43Å
193	G	34.7	Very low	33.4	Very low	50 Å²	50	122.7 Å²	122.7	52%	0.515	66%	0.658	S	S	.	*			trans	73.8	6.1	-170.8	0	0	0	0	0	113.9	L188 N189 V195	L188-G193 WeakPolarHBondContact CD2-O 3.37Å; N189-G193 WeakPolarHBondContact O-CA 3.18Å; N189-G193 PolarHBondContact O-N 3.4Å; G193-V195 PolarHBondContact O-N 3.49Å
194	D	36.3	Very low	33.4	Very low	88 Å²	88	122 Å²	122	47%	0.471	66%	0.655	S	S	.	*			trans	-76.8	121.7	-175.9	-65.4	-42.9	0	0	0	111.5	L188 N189 T192 L196	L188-D194 CarbonylContact C-O 3.53Å; L188-D194 WeakPolarHBondContact CA-O 3.33Å; N189-D194 HydrophobicContact CB-CB 4.19Å; N189-D194 WeakPolarHBondContact CB-O 3.29Å; N189-D194 PolarHBondContact N-O 3.05Å; T192-D194 WeakPolarHBondContact CB-OD2 3.45Å; T192-D194 PolarHBondContact O-N 2.98Å; T192-D194 WeakPolarHBondContact OG1-CB 3.3Å; T192-D194 PolarHBondContact OG1-N 2.89Å; T192-D194 PolarHBondContact OG1-OD2 3.43Å; D194-L196 PolarHBondContact O-N 2.97Å
195	V	40.5	Very low	33.4	Very low	59 Å²	59	121.1 Å²	121.1	36%	0.358	65%	0.65	S	S	.	*	B	Isolated β-bridge	trans	-72.2	117.2	158.9	-174.8	0	0	0	0	109.6	L186 V187 L188 G193 S197	L186-V195 HydrophobicContact CB-CG1 3.83Å; L186-V195 HydrophobicContact CB-CG2 4.15Å; L186-V195 HydrophobicContact CD2-CB 4.07Å; L186-V195 HydrophobicContact CD2-CG1 3.14Å; L186-V195 HydrophobicContact CD2-CG2 4.28Å; L186-V195 HydrophobicContact CG-CG1 4.04Å; V187-V195 WeakPolarHBondContact O-CA 3.47Å; V187-V195 WeakPolarHBondContact O-CG1 3.25Å; L188-V195 HydrophobicContact CD2-CB 4.25Å; L188-V195 HydrophobicContact CD2-CG2 3.18Å; L188-V195 HydrophobicContact CG-CG2 3.66Å; G193-V195 PolarHBondContact O-N 3.49Å; V195-S197 PolarHBondContact O-N 3.13Å; V195-S197 VanDerWaalsContact O-N 3.11Å
196	L	39.8	Very low	33.4	Very low	108 Å²	108	118.9 Å²	118.9	57%	0.565	65%	0.646	S	S	*	*			trans	-77.6	86.6	175.1	-61.2	168.7	0	0	0	110.3	V187 D194	V187-L196 PolarHBondContact O-N 3.38Å; D194-L196 PolarHBondContact O-N 2.97Å
197	S	36.7	Very low	33.3	Very low	107 Å²	107	119.4 Å²	119.4	75%	0.748	65%	0.649	S	S	*	*			trans	29	152.6	151.8	63.6	0	0	0	0	121.9	V195	V195-S197 PolarHBondContact O-N 3.13Å; V195-S197 VanDerWaalsContact O-N 3.11Å
198	D	35.1	Very low	33.1	Very low	142 Å²	142	120.8 Å²	120.8	76%	0.759	66%	0.658	S	S	*	*			cis	176.9	167.3	-13.6	-162	15.5	0	0	0	108.3
199	Q	29.3	Very low	32.9	Very low	146 Å²	146	122.3 Å²	122.3	68%	0.682	67%	0.665	S	S	*	*			trans	87.3	122.3	158.4	-48.9	-164.4	-3.3	0	0	122.6
200	Y	29.4	Very low	32.6	Very low	224 Å²	224	126.3 Å²	126.3	88%	0.878	69%	0.691	S	S	*	*				-169.9	139.1	99.9	-110	-85.8	0	0	0	113.3
201	S	26	Very low	32.2	Very low	103 Å²	103	127 Å²	127	72%	0.72	69%	0.694	S	S	*	*			trans	-108.2	154.5	-179.6	175.7	0	0	0	0	111.2
202	S	29.7	Very low	32	Very low	97 Å²	97	122 Å²	122	68%	0.678	69%	0.691	S	S	*	*				172.5	131.1	125	49.6	0	0	0	0	116.9
203	H	31.9	Very low	31.1	Very low	160 Å²	160	121.8 Å²	121.8	74%	0.741	71%	0.705	S	S	*	*			trans	84.6	111.7	134.8	-70.9	-44.3	0	0	0	124.9
204	H	28.3	Very low	30.9	Very low	158 Å²	158	125.3 Å²	125.3	73%	0.731	72%	0.716	S	S	*	*				42.4	137.3	121.8	-70.7	-49.3	0	0	0	119.5
205	Q	29.6	Very low	30.6	Very low	181 Å²	181	128.8 Å²	128.8	85%	0.846	73%	0.73	S	S	*	*				-171.1	148	57.1	-153.6	163.3	35.3	0	0	112.8
206	T	25.9	Very low	30.3	Very low	107 Å²	107	133.6 Å²	133.6	66%	0.656	75%	0.748	S	S	*	*			trans	-74.8	157.6	176.7	41.4	0	0	0	0	115.1
207	N	30.5	Very low	29.9	Very low	154 Å²	154	137.7 Å²	137.7	82%	0.824	76%	0.761	S	S	*	*			trans	-174.1	92.3	131.2	-91.7	-15.8	0	0	0	114.5
208	T	26.7	Very low	29.4	Very low	113 Å²	113	136.7 Å²	136.7	69%	0.693	76%	0.76	S	S	*	*				27	141	117.1	-12.5	0	0	0	0	124.6
209	I	27.3	Very low	29.1	Very low	141 Å²	141	141 Å²	141	72%	0.723	77%	0.765	S	S	*	*			trans	77.8	118.1	147.2	-30	177.7	0	0	0	119.3
210	T	29.3	Very low	29.2	Very low	129 Å²	129	140.6 Å²	140.6	79%	0.791	77%	0.768	S	S	*	*				175.9	130.1	90.9	-49.8	0	0	0	0	113.3
211	T	25.9	Very low	29.1	Very low	138 Å²	138	137.2 Å²	137.2	85%	0.847	76%	0.763	S	S	*	*			trans	-70.3	153.2	176.1	38.4	0	0	0	0	116
212	G	29.6	Very low	29.3	Very low	78 Å²	78	137.9 Å²	137.9	80%	0.804	76%	0.763	S	S	*	*			trans	179.3	101.3	155.8	0	0	0	0	0	116.6
213	G	30.4	Very low	29.3	Very low	74 Å²	74	137.9 Å²	137.9	76%	0.763	76%	0.763	S	S	*	*			trans	64.3	155.8	143.9	0	0	0	0	0	120.2
214	T	31.2	Very low	29.3	Very low	124 Å²	124	136.1 Å²	136.1	76%	0.761	76%	0.764	S	S	*	*			cis	-173.6	132.2	-1.9	-45.8	0	0	0	0	106
215	H	29.5	Very low	29.4	Very low	162 Å²	162	137 Å²	137	75%	0.75	77%	0.774	S	S	*	*			trans	36.2	127.2	153.5	-67.9	-113.2	0	0	0	123.3
216	H	33.4	Very low	29.6	Very low	159 Å²	159	132.7 Å²	132.7	74%	0.736	76%	0.764	S	S	*	*				158	125.2	111	-93.8	-82.7	0	0	0	114.3
217	F	31.7	Very low	29.9	Very low	194 Å²	194	134 Å²	134	85%	0.851	77%	0.771	S	S	*	*			trans	60.1	134.6	138	-88.7	-102.7	0	0	0	124.1
218	A	27.6	Very low	30	Very low	87 Å²	87	132.6 Å²	132.6	72%	0.719	77%	0.768	S	S	*	*			trans	-66.6	142.4	173.4	0	0	0	0	0	115.4
219	R	27.9	Very low	30.3	Very low	232 Å²	232	132.5 Å²	132.5	88%	0.875	77%	0.767	S	S	*	*				165.7	144.7	117.6	-97.4	-179.6	175.1	149.8	-1.1	112.2
220	N	31.3	Very low	30.9	Very low	137 Å²	137	131.5 Å²	131.5	73%	0.733	77%	0.77	S	S	*	*			trans	74.1	107.2	156.5	-71.4	-8	0	0	0	120
221	I	28.2	Very low	30.9	Very low	153 Å²	153	131.2 Å²	131.2	79%	0.785	77%	0.773	S	S	*	*				26	109.6	117.6	-47.5	172.9	0	0	0	114.5
222	T	29.5	Very low	31.2	Very low	117 Å²	117	128.7 Å²	128.7	72%	0.718	78%	0.775	S	S	*	*				164	133.2	113.7	-49.9	0	0	0	0	108.8
223	S	29.8	Very low	31.4	Very low	98 Å²	98	128.9 Å²	128.9	69%	0.685	78%	0.776	S	S	*	*			trans	76.1	142.9	150.5	48.2	0	0	0	0	122
224	T	30.6	Very low	31.4	Very low	123 Å²	123	133.4 Å²	133.4	76%	0.755	78%	0.783	S	S	*	*			trans	87.3	92.4	157.5	75.3	0	0	0	0	119.3
225	N	32	Very low	31.6	Very low	175 Å²	175	134.5 Å²	134.5	94%	0.936	79%	0.79	S	S	*	*			trans	-93	90.8	146.1	-104.2	-4.1	0	0	0	108.7
226	S	32.9	Very low	31.7	Very low	92 Å²	92	132.4 Å²	132.4	64%	0.643	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-82.4	116.8	161.5	50.4	0	0	0	0	108.8	V228	S226-V228 PolarHBondContact O-N 3.19Å
227	V	32.5	Very low	31.7	Very low	133 Å²	133	128.2 Å²	128.2	81%	0.806	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-67	117.8	168.2	174.4	0	0	0	0	108.6	V229	V227-V229 HydrophobicContact CG1-CG2 4.33Å
228	V	32.4	Very low	32.1	Very low	126 Å²	126	125.3 Å²	125.3	76%	0.764	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-89.6	117.1	169.8	175.8	0	0	0	0	107.9	S226	S226-V228 PolarHBondContact O-N 3.19Å
229	V	33.4	Very low	32.6	Very low	111 Å²	111	126.6 Å²	126.6	67%	0.673	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-94.9	130.4	169.1	-179.7	0	0	0	0	107.8	V227	V227-V229 HydrophobicContact CG1-CG2 4.33Å
230	P	39.4	Very low	32.8	Very low	119 Å²	119	122.5 Å²	122.5	77%	0.773	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-83.8	121.5	167.9	30.5	-26.5	0	0	0	110.2
231	S	30.4	Very low	32.9	Very low	124 Å²	124	119.5 Å²	119.5	87%	0.867	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-76	139.2	174.1	-34	0	0	0	0	111.5
232	G	32.5	Very low	33	Very low	85 Å²	85	118.2 Å²	118.2	88%	0.876	80%	0.801	S	S	*	*			trans	150.1	111.6	151.7	0	0	0	0	0	115.7
233	G	32.2	Very low	33.2	Very low	81 Å²	81	116.3 Å²	116.3	84%	0.835	81%	0.805	S	S	*	*			trans	146	79.1	157.7	0	0	0	0	0	116
234	N	30.2	Very low	33	Very low	169 Å²	169	118.3 Å²	118.3	90%	0.904	81%	0.813	S	S	*	*			trans	-64.5	131.1	166.8	-87.1	-18.5	0	0	0	111.5
235	V	36.5	Very low	33.1	Very low	148 Å²	148	119.2 Å²	119.2	90%	0.897	82%	0.818	S	S	*	*			trans	-144	125.1	138.3	-175	0	0	0	0	109.2
236	S	31.6	Very low	32.9	Very low	118 Å²	118	115.6 Å²	115.6	83%	0.825	81%	0.812	S	S	*	*			trans	-82.1	143.7	-179.1	49.5	0	0	0	0	113.8
237	G	33.9	Very low	32.9	Very low	71 Å²	71	114.8 Å²	114.8	73%	0.732	82%	0.819	S	S	*	*			trans	-167.8	138.7	158.6	0	0	0	0	0	111.5
238	P	39.1	Very low	32.6	Very low	132 Å²	132	117.8 Å²	117.8	86%	0.857	82%	0.824	S	S	*	*			trans	-103.3	176.6	-146.6	36.5	-25.1	0	0	0	115.7
239	P	37.9	Very low	32.6	Very low	115 Å²	115	121.3 Å²	121.3	75%	0.747	83%	0.832	S	S	*	*			trans	-107	-175.4	-154.1	37.9	-27.6	0	0	0	115.8
240	V	32.9	Very low	32.4	Very low	145 Å²	145	126 Å²	126	88%	0.879	84%	0.844	S	S	*	*			trans	106	120.6	157.9	-166.3	0	0	0	0	116.3
241	G	33.3	Very low	32	Very low	75 Å²	75	124.2 Å²	124.2	77%	0.773	85%	0.847	S	S	*	*			trans	175.4	84.3	166.7	0	0	0	0	0	112.3
242	S	29.9	Very low	31.9	Very low	125 Å²	125	123 Å²	123	87%	0.874	84%	0.838	S	S	*	*			trans	-60.1	141.7	172.9	48.3	0	0	0	0	113.4
243	G	32.9	Very low	31.9	Very low	78 Å²	78	124.9 Å²	124.9	80%	0.804	83%	0.833	S	S	*	*			trans	-161.8	98.8	169.5	0	0	0	0	0	112.2
244	T	27	Very low	31.8	Very low	140 Å²	140	127.8 Å²	127.8	86%	0.859	83%	0.828	S	S	*	*			trans	-71.9	126.6	172.3	-44.7	0	0	0	0	110.4
245	V	32.9	Very low	32	Very low	142 Å²	142	127.9 Å²	127.9	86%	0.861	82%	0.816	S	S	*	*			trans	-146.5	126.3	153.7	-178.5	0	0	0	0	110
246	A	27.6	Very low	32.1	Very low	98 Å²	98	126.6 Å²	126.6	81%	0.81	81%	0.811	S	S	*	*			trans	-70.2	143.4	172.2	0	0	0	0	0	111.6
247	G	32	Very low	32.1	Very low	76 Å²	76	130.8 Å²	130.8	78%	0.784	82%	0.815	S	S	*	*			trans	-168.8	98.4	173.5	0	0	0	0	0	111.1
248	Q	27.3	Very low	32.2	Very low	195 Å²	195	134.7 Å²	134.7	91%	0.911	82%	0.824	S	S	*	*			trans	-49.4	139.9	165.3	-69.4	167.4	-36.3	0	0	111
249	Q	31.7	Very low	31.9	Very low	200 Å²	200	131.6 Å²	131.6	94%	0.935	82%	0.817	S	S	*	*			trans	-163.6	145.1	130.2	-109.8	172.4	16.7	0	0	113.4
250	K	28.6	Very low	31.7	Very low	211 Å²	211	135.4 Å²	135.4	92%	0.917	82%	0.824	S	S	*	*			trans	-71.2	147.8	-168.3	-69.2	162.9	165.8	177.1	0	113.2
251	G	30.8	Very low	31.8	Very low	81 Å²	81	136.1 Å²	136.1	84%	0.835	82%	0.823	S	S	*	*			trans	-151	98.5	152.2	0	0	0	0	0	108.3
252	S	28.9	Very low	32.1	Very low	99 Å²	99	138.4 Å²	138.4	69%	0.692	83%	0.825	S	S	*	*			trans	-89.8	127	177.7	63.9	0	0	0	0	110.1
253	T	32	Very low	32.3	Very low	123 Å²	123	140.3 Å²	140.3	76%	0.755	82%	0.823	S	S	*	*			trans	-108.2	117.3	156.9	-53.6	0	0	0	0	107
254	I	30.9	Very low	32.6	Very low	143 Å²	143	144.7 Å²	144.7	73%	0.733	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-89.9	118.4	-176.2	-64.4	171.8	0	0	0	107.7
255	Y	34.4	Very low	32.9	Very low	170 Å²	170	141.5 Å²	141.5	67%	0.667	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-99.9	132.6	155.7	-72.1	-83.1	0	0	0	108.1	K257	Y255-K257 PolarHBondContact O-N 3.34Å
256	P	37.9	Very low	33	Very low	121 Å²	121	138 Å²	138	79%	0.786	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-73.9	119.8	180	28.4	-30.2	0	0	0	110.5
257	K	32	Very low	33.5	Very low	207 Å²	207	139.4 Å²	139.4	90%	0.9	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-73.5	121.1	162.8	-79.2	-177.9	173.2	-179.3	0	109	Y255 G259	Y255-K257 PolarHBondContact O-N 3.34Å; K257-G259 PolarHBondContact O-N 3.39Å
258	T	36.4	Very low	33.7	Very low	152 Å²	152	143.4 Å²	143.4	93%	0.933	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-71.5	116.8	163.5	24.4	0	0	0	0	109.5
259	G	33.2	Very low	34.1	Very low	68 Å²	68	138.2 Å²	138.2	70%	0.701	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-91.1	147.4	-179.2	0	0	0	0	0	113.1	K257	K257-G259 PolarHBondContact O-N 3.39Å
260	Q	33.2	Very low	34.3	Very low	194 Å²	194	132 Å²	132	91%	0.907	81%	0.807	S	S	*	*			trans	-33.9	135.3	165.2	-73.9	143.8	-38.6	0	0	116.3
261	N	35.7	Very low	34.7	Very low	160 Å²	160	129.4 Å²	129.4	86%	0.856	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-63.2	134.1	161.9	-77.7	-34	0	0	0	111.5
262	P	39.7	Very low	35.1	Very low	124 Å²	124	129.3 Å²	129.3	81%	0.805	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-92.8	135.5	160	11.1	7.6	0	0	0	111.1
263	I	33.7	Very low	35.5	Very low	164 Å²	164	128.7 Å²	128.7	84%	0.841	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-82.6	132.6	169.7	-55.2	164.9	0	0	0	106.9
264	D	38.4	Very low	35.7	Very low	171 Å²	171	130 Å²	130	91%	0.914	81%	0.81	S	S	*	*			trans	-144.7	146.5	156.8	-128.7	-18	0	0	0	113.6
265	G	33.7	Very low	36.2	Very low	73 Å²	73	129.2 Å²	129.2	75%	0.753	82%	0.817	S	S	*	*			trans	-84.3	170.4	-153.5	0	0	0	0	0	117.8
266	G	35.8	Very low	36.2	Very low	68 Å²	68	127 Å²	127	70%	0.701	83%	0.827	S	S	*	*			trans	-171.2	60.5	-178.7	0	0	0	0	0	114.9
267	T	37.1	Very low	36.3	Very low	127 Å²	127	125.3 Å²	125.3	78%	0.779	83%	0.831	S	S	*	*			trans	43.8	134.1	143.4	51.5	0	0	0	0	123.8
268	N	37	Very low	36.6	Very low	161 Å²	161	121.3 Å²	121.3	86%	0.861	83%	0.829	S	S	*	*			trans	105.5	107.8	138.9	-69.7	-25.2	0	0	0	119.8
269	G	35.8	Very low	36.7	Very low	85 Å²	85	118.6 Å²	118.6	88%	0.876	82%	0.823	S	S	*	*				126.7	114.3	122.7	0	0	0	0	0	117.2
270	G	35.4	Very low	36.8	Very low	71 Å²	71	119.5 Å²	119.5	73%	0.732	83%	0.831	S	S	*	*			trans	120.5	76.5	138.6	0	0	0	0	0	119.9
271	V	37.2	Very low	36.9	Very low	156 Å²	156	114.3 Å²	114.3	95%	0.945	83%	0.83	S	S	*	*				42.1	125.3	125.3	-169.8	0	0	0	0	120.2
272	G	38.1	Very low	37	Very low	79 Å²	79	110.2 Å²	110.2	81%	0.814	83%	0.826	S	S	*	*			trans	167.3	113.2	152.2	0	0	0	0	0	114.9
273	A	39	Very low	36.8	Very low	85 Å²	85	110.4 Å²	110.4	70%	0.702	83%	0.827	S	S	*	*			trans	-98.2	165.5	-163.2	0	0	0	0	0	115.8
274	N	35.6	Very low	37.1	Very low	152 Å²	152	108.2 Å²	108.2	81%	0.813	83%	0.826	S	S	*	*			trans	69.4	120.3	146.8	-61.1	-17.2	0	0	0	120.1
275	S	39.9	Very low	37.1	Very low	126 Å²	126	109.4 Å²	109.4	88%	0.881	82%	0.823	S	S	*	*				171.2	144.8	93.6	48.3	0	0	0	0	113.1
276	S	36.2	Very low	37.1	Very low	123 Å²	123	111.3 Å²	111.3	86%	0.86	83%	0.825	S	S	*	*			trans	-75	151.3	-177.3	49.5	0	0	0	0	114.9
277	G	39.8	Very low	37	Very low	86 Å²	86	111.6 Å²	111.6	89%	0.887	83%	0.828	S	S	*	*			trans	-154.9	100	162.4	0	0	0	0	0	111.3
278	S	37.5	Very low	36.9	Very low	122 Å²	122	111.6 Å²	111.6	85%	0.853	83%	0.828	S	S	*	*			trans	-94.9	145.3	179.6	-175	0	0	0	0	110.9
279	A	39.1	Very low	36.8	Very low	96 Å²	96	112 Å²	112	79%	0.793	83%	0.829	S	S	*	*				148.7	123.5	124	0	0	0	0	0	114.2
280	G	35.5	Very low	36.6	Very low	86 Å²	86	114.3 Å²	114.3	89%	0.887	83%	0.826	S	S	*	*				106.7	114.1	122.9	0	0	0	0	0	119.1
281	G	35.1	Very low	36.5	Very low	85 Å²	85	114.4 Å²	114.4	88%	0.876	83%	0.827	S	S	*	*			trans	137.9	93.6	134.1	0	0	0	0	0	119
282	G	36.6	Very low	36.1	Very low	74 Å²	74	110.3 Å²	110.3	76%	0.763	82%	0.816	S	S	*	*			trans	96.5	119.5	134.2	0	0	0	0	0	119.1
283	P	35.6	Very low	35.9	Very low	128 Å²	128	109.9 Å²	109.9	83%	0.831	81%	0.812	S	S	*	*			trans	-90.2	137.8	170.1	34.6	-27.7	0	0	0	110.7
284	S	39.8	Very low	36.5	Very low	118 Å²	118	112.4 Å²	112.4	83%	0.825	81%	0.813	S	S	*	*			trans	-142	100	169.7	-75.6	0	0	0	0	111.6
285	K	39.9	Very low	37.3	Very low	197 Å²	197	112.7 Å²	112.7	86%	0.857	81%	0.814	S	S	*	*			trans	27.1	106.3	141	-64.7	-177.5	177.4	179.8	0	118.8
286	S	32.3	Very low	38.8	Very low	113 Å²	113	113.8 Å²	113.8	79%	0.79	80%	0.799	S	S	*	*				28.3	102.5	128.4	66.9	0	0	0	0	118.3
287	G	35.4	Very low	41.1	Very low	73 Å²	73	110.1 Å²	110.1	75%	0.753	77%	0.773	S	S	*	*			trans	-127.7	100.4	151	0	0	0	0	0	108.5	L289	G287-L289 PolarHBondContact O-N 3.02Å
288	T	33.3	Very low	43.6	Very low	128 Å²	128	112.3 Å²	112.3	79%	0.785	76%	0.755	S	S	*	*			trans	-66.1	107.9	175.7	-54.6	0	0	0	0	109.6	V290	T288-V290 HydrophobicContact CG2-CG2 4.08Å
289	L	35.7	Very low	46.3	Very low	170 Å²	170	108.3 Å²	108.3	89%	0.89	72%	0.723	S	S	*	*			trans	-85.1	105.8	161.3	-101.1	134.8	0	0	0	107.7	G287 G291	G287-L289 PolarHBondContact O-N 3.02Å; L289-G291 PolarHBondContact O-N 3.4Å
290	V	32.3	Very low	49	Very low	133 Å²	133	106.9 Å²	106.9	81%	0.806	70%	0.704	S	S	*	*			trans	-71.8	93.2	169.7	179.3	0	0	0	0	107.8	T288	T288-V290 HydrophobicContact CG2-CG2 4.08Å
291	G	31.8	Very low	51.9	Low	73 Å²	73	105.8 Å²	105.8	75%	0.753	67%	0.673	S	S	*	*			trans	-91.2	94	163.4	0	0	0	0	0	108.8	L289 G293	L289-G291 PolarHBondContact O-N 3.4Å; G291-G293 PolarHBondContact O-N 2.77Å
292	G	28.9	Very low	54.6	Low	69 Å²	69	103.6 Å²	103.6	71%	0.711	64%	0.642	S	S	*	*			trans	-71.8	90.4	173.2	0	0	0	0	0	110.5	L294	G292-L294 PolarHBondContact O-N 2.95Å
293	G	35.5	Very low	57.4	Low	71 Å²	71	100 Å²	100	73%	0.732	61%	0.605	S	S	*	*			trans	-71.9	114.9	159.9	0	0	0	0	0	107.9	G291 D295	G291-G293 PolarHBondContact O-N 2.77Å; G293-D295 PolarHBondContact O-N 3.24Å; G293-D295 VanDerWaalsContact O-N 3.16Å
294	L	50.2	Low	60	Low	138 Å²	138	97.2 Å²	97.2	72%	0.723	58%	0.58	S	S	*	*			trans	-59.6	117.5	164.5	-83.5	105.3	0	0	0	107	G292 R296	G292-L294 PolarHBondContact O-N 2.95Å; L294-R296 PolarHBondContact O-N 3.12Å
295	D	53.8	Low	62.5	Low	158 Å²	158	99.1 Å²	99.1	85%	0.845	58%	0.576	S	S	*	*			trans	-62.1	106.4	172.9	-162.8	10	0	0	0	107.6	G293	G293-D295 PolarHBondContact O-N 3.24Å; G293-D295 VanDerWaalsContact O-N 3.16Å
296	R	71.1	Confident	65	Low	148 Å²	148	90.2 Å²	90.2	56%	0.558	54%	0.539	S	S	*	.			trans	-89.1	122.1	-179.9	-66.5	179.6	-177.5	-174.6	-2	107.5	L294 R298	L294-R296 PolarHBondContact O-N 3.12Å; R296-R298 PolarHBondContact O-N 3.09Å
297	S	84.5	Confident	67.9	Low	46 Å²	46	89.6 Å²	89.6	32%	0.322	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	132.6	168.8	-174	0	0	0	0	108.7	I333 T334 E335	S297-I333 PolarHBondContact N-O 3.31Å; S297-T334 CarbonylContact O-C 3.56Å; S297-T334 WeakPolarHBondContact O-CA 3.45Å; S297-T334 WeakPolarHBondContact O-CG2 3.49Å; S297-E335 PolarHBondContact O-N 2.78Å
298	R	92.2	Very high	70.7	Confident	133 Å²	133	86.6 Å²	86.6	50%	0.502	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	127.8	176.7	-171.2	176.9	179.4	-133.8	-5.2	109.6	R296 V300 E335 V337 E339	R296-R298 PolarHBondContact O-N 3.09Å; R298-V300 HydrophobicContact CG-CG2 4.21Å; R298-E335 CarbonylContact C-O 3.58Å; R298-E335 WeakPolarHBondContact CA-O 3.44Å; R298-E335 IonicContact NE-OE2 3.97Å; R298-V337 HydrophobicContact CG-CG2 4.28Å; R298-E339 IonicContact NH2-OE1 3.95Å
299	Q	93.8	Very high	73.5	Confident	37 Å²	37	81.8 Å²	81.8	17%	0.173	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	125.3	173.5	-61.7	-174.8	20.5	0	0	108.2	Y301 R327 T334 E335 V336 V337	Q299-Y301 HydrophobicContact CB-CE2 3.93Å; Q299-Y301 PolarHBondContact OE1-OH 3.46Å; Q299-R327 PolarHBondContact NE2-O 3.4Å; Q299-T334 HydrophobicContact CG-CG2 3.9Å; Q299-E335 PolarHBondContact N-O 3.42Å; Q299-V336 CarbonylContact O-C 3.58Å; Q299-V336 WeakPolarHBondContact O-CA 3.36Å; Q299-V337 PolarHBondContact O-N 2.95Å
300	V	95.3	Very high	76.2	Confident	66 Å²	66	78.4 Å²	78.4	40%	0.4	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	133.9	-177.5	-175.6	0	0	0	0	109.3	R298 V337 E339	R298-V300 HydrophobicContact CG-CG2 4.21Å; V300-V337 CarbonylContact C-O 3.54Å; V300-V337 VanDerWaalsContact CA-O 3.32Å; V300-V337 WeakPolarHBondContact CA-O 3.42Å; V300-V337 HydrophobicContact CG2-CB 4.42Å; V300-E339 VanDerWaalsContact CG1-CD 3.44Å; V300-E339 HydrophobicContact CG1-CG 3.9Å; V300-E339 WeakPolarHBondContact CG1-OE1 3.21Å
301	Y	96.2	Very high	79.3	Confident	63 Å²	63	72 Å²	72	25%	0.247	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	140.2	178.5	-65.4	-75.6	0	0	0	110.5	Q299 I324 P326 V336 V337 F338 E339	Q299-Y301 HydrophobicContact CB-CE2 3.93Å; Q299-Y301 PolarHBondContact OE1-OH 3.46Å; Y301-I324 HydrophobicContact CD1-CD1 3.38Å; Y301-I324 HydrophobicContact CD2-CD1 3.54Å; Y301-I324 HydrophobicContact CE1-CD1 3.54Å; Y301-I324 HydrophobicContact CE1-CG1 4.47Å; Y301-I324 HydrophobicContact CE2-CD1 3.68Å; Y301-I324 HydrophobicContact CG-CD1 3.36Å; Y301-P326 HydrophobicContact CE2-CB 4.31Å; Y301-V336 HydrophobicContact CD2-CG1 3.74Å; Y301-V336 HydrophobicContact CE2-CG1 3.85Å; Y301-V337 PolarHBondContact N-O 3.38Å; Y301-F338 HydrophobicContact CD2-CE1 4.38Å; Y301-F338 CarbonylContact O-C 3.46Å; Y301-F338 VanDerWaalsContact O-CA 3.28Å; Y301-F338 WeakPolarHBondContact O-CA 3.34Å; Y301-E339 PolarHBondContact O-N 3.08Å
302	N	93.4	Very high	82.4	Confident	39 Å²	39	69 Å²	69	21%	0.209	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	122.1	166.6	-177.8	-13	0	0	0	108.5	F304 E305 C306	N302-F304 PolarHBondContact O-N 2.93Å; N302-F304 PolarHBondContact OD1-N 2.78Å; N302-E305 HydrophobicContact CB-CB 4.15Å; N302-E305 HydrophobicContact CB-CG 3.93Å; N302-E305 PolarHBondContact ND2-OE1 2.91Å; N302-E305 PolarHBondContact O-N 2.97Å; N302-C306 PolarHBondContact O-N 2.92Å; N302-C306 PolarHBondContact O-SG 2.97Å
303	M	94.6	Very high	85.6	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-58.6	-38.6	-178.5	-174.8	58.3	80.2	0	0	111.2	E305 C306 R322 F338 E339 L341 L551 V567 Y569	M303-E305 VanDerWaalsContact C-N 3.28Å; M303-E305 PolarHBondContact O-N 3.4Å; M303-C306 WeakPolarHBondContact O-CB 3.49Å; M303-C306 PolarHBondContact O-N 3.09Å; M303-C306 VanDerWaalsContact O-N 3.13Å; M303-R322 VanDerWaalsContact O-CD 3.29Å; M303-R322 WeakPolarHBondContact O-CD 3.42Å; M303-R322 PolarHBondContact O-NE 3.12Å; M303-R322 PolarHBondContact O-NH1 3.34Å; M303-R322 HydrophobicContact SD-CB 4.49Å; M303-R322 WeakPolarHBondContact SD-CD 3.29Å; M303-F338 HydrophobicContact CE-CB 3.52Å; M303-F338 HydrophobicContact CE-CD1 3.78Å; M303-F338 HydrophobicContact CE-CD2 4.25Å; M303-F338 HydrophobicContact CE-CG 3.59Å; M303-F338 HydrophobicContact SD-CD1 4.24Å; M303-E339 WeakPolarHBondContact CB-O 3.47Å; M303-E339 PolarHBondContact N-O 3.24Å; M303-L341 HydrophobicContact CB-CG 4.45Å; M303-L341 HydrophobicContact CE-CD2 4.19Å; M303-L341 HydrophobicContact CE-CG 4.28Å; M303-L341 HydrophobicContact CG-CG 4.44Å; M303-L551 HydrophobicContact CE-CD2 4.29Å; M303-V567 HydrophobicContact CE-CG1 4.04Å; M303-Y569 HydrophobicContact CE-CE1 4.25Å; M303-Y569 HydrophobicContact CG-CE1 4.44Å; M303-Y569 HydrophobicContact SD-CE1 4.02Å
304	F	90.6	Very high	88.5	Confident	69 Å²	69	63.3 Å²	63.3	30%	0.303	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-66.7	-27.7	-178.3	-58.6	-23.9	0	0	0	113.3	N302 R322 H340 E605	N302-F304 PolarHBondContact O-N 2.93Å; N302-F304 PolarHBondContact OD1-N 2.78Å; F304-R322 VanDerWaalsContact C-NH1 3.33Å; F304-R322 PolarHBondContact O-NH1 3.16Å; F304-H340 WeakPolarHBondContact CD1-O 3.49Å; F304-H340 HydrophobicContact CD2-CB 4.17Å; F304-H340 WeakPolarHBondContact CE1-O 3.37Å; F304-H340 HydrophobicContact CE2-CB 4.01Å; F304-H340 HydrophobicContact CZ-CB 4.43Å; F304-H340 WeakPolarHBondContact CZ-O 3.43Å; F304-E605 HydrophobicContact CD1-CB 3.74Å; F304-E605 HydrophobicContact CD1-CG 4.43Å; F304-E605 WeakPolarHBondContact CD1-OE2 3.32Å; F304-E605 HydrophobicContact CE1-CB 3.45Å; F304-E605 VanDerWaalsContact CE1-CB 3.45Å; F304-E605 HydrophobicContact CE1-CG 4.07Å; F304-E605 VanDerWaalsContact CE1-OE2 3.27Å; F304-E605 WeakPolarHBondContact CE1-OE2 3.31Å; F304-E605 HydrophobicContact CE2-CB 4.4Å; F304-E605 HydrophobicContact CG-CB 4.35Å; F304-E605 HydrophobicContact CZ-CB 3.81Å
305	E	91.1	Very high	90.5	Very high	157 Å²	157	60.1 Å²	60.1	73%	0.734	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-81.7	-13.8	176.8	-66.6	172.2	-156.6	0	0	113.1	N302 M303	N302-E305 HydrophobicContact CB-CB 4.15Å; N302-E305 HydrophobicContact CB-CG 3.93Å; N302-E305 PolarHBondContact ND2-OE1 2.91Å; N302-E305 PolarHBondContact O-N 2.97Å; M303-E305 VanDerWaalsContact C-N 3.28Å; M303-E305 PolarHBondContact O-N 3.4Å
306	C	93	Very high	92.3	Very high	11 Å²	11	56.2 Å²	56.2	7%	0.074	27%	0.267	C	S	.	.	S	Bend	trans	-74	128.5	179	-64	0	0	0	0	110.6	N302 M303 M308 R322	N302-C306 PolarHBondContact O-N 2.92Å; N302-C306 PolarHBondContact O-SG 2.97Å; M303-C306 WeakPolarHBondContact O-CB 3.49Å; M303-C306 PolarHBondContact O-N 3.09Å; M303-C306 VanDerWaalsContact O-N 3.13Å; C306-M308 PolarHBondContact O-N 3.43Å; C306-M308 VanDerWaalsContact O-N 3.13Å; C306-R322 HydrophobicContact CB-CB 4.16Å; C306-R322 PolarHBondContact O-NH1 2.94Å
307	Q	92.9	Very high	93.3	Very high	100 Å²	100	51.1 Å²	51.1	47%	0.467	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	119.6	-174.9	-177.1	-178.3	26.7	0	0	112.6	S309 R322 R323	Q307-S309 PolarHBondContact O-N 3.1Å; Q307-S309 VanDerWaalsContact O-N 3.16Å; Q307-R322 CarbonylContact O-C 3.54Å; Q307-R322 WeakPolarHBondContact O-CA 3.5Å; Q307-R323 PolarHBondContact O-N 3.05Å
308	M	93.9	Very high	93.9	Very high	10 Å²	10	49 Å²	49	5%	0.049	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	111.1	169.6	-176.7	154.4	66.6	0	0	109.6	C306 L311 I320 W607 T609	C306-M308 PolarHBondContact O-N 3.43Å; C306-M308 VanDerWaalsContact O-N 3.13Å; M308-L311 HydrophobicContact CE-CB 4.17Å; M308-L311 HydrophobicContact CE-CD2 4.1Å; M308-L311 HydrophobicContact CE-CG 4.5Å; M308-L311 HydrophobicContact SD-CB 3.98Å; M308-L311 HydrophobicContact SD-CD1 4.14Å; M308-L311 HydrophobicContact SD-CG 4.48Å; M308-I320 HydrophobicContact CG-CG2 4.43Å; M308-I320 HydrophobicContact SD-CG1 4.33Å; M308-I320 HydrophobicContact SD-CG2 3.87Å; M308-W607 HydrophobicContact CE-CB 3.61Å; M308-W607 HydrophobicContact CE-CG 4.03Å; M308-T609 VanDerWaalsContact CE-CB 3.43Å; M308-T609 HydrophobicContact CE-CG2 3.9Å
309	S	92.3	Very high	94.1	Very high	26 Å²	26	45.5 Å²	45.5	18%	0.182	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	-31.8	-177.6	56.9	0	0	0	0	112.6	Q307 C321	Q307-S309 PolarHBondContact O-N 3.1Å; Q307-S309 VanDerWaalsContact O-N 3.16Å; S309-C321 PolarHBondContact N-O 3.35Å; S309-C321 PolarHBondContact OG-O 2.75Å; S309-C321 PolarHBondContact OG-SG 3.17Å
310	Q	93.6	Very high	94.2	Very high	99 Å²	99	43.7 Å²	43.7	46%	0.463	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	135.5	179.3	-174.7	176.5	7.2	0	0	109.8	C321	Q310-C321 HydrophobicContact CB-CB 4.16Å; Q310-C321 PolarHBondContact N-O 3Å; Q310-C321 PolarHBondContact O-N 3.1Å
311	L	96.6	Very high	94.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	122.2	171.5	176.4	65.6	0	0	0	108.6	M308 V313 A318 I320 W607 T609 Y611 M612 T613	M308-L311 HydrophobicContact CE-CB 4.17Å; M308-L311 HydrophobicContact CE-CD2 4.1Å; M308-L311 HydrophobicContact CE-CG 4.5Å; M308-L311 HydrophobicContact SD-CB 3.98Å; M308-L311 HydrophobicContact SD-CD1 4.14Å; M308-L311 HydrophobicContact SD-CG 4.48Å; L311-V313 HydrophobicContact CD1-CG2 4.17Å; L311-V313 HydrophobicContact CD2-CG2 3.97Å; L311-V313 HydrophobicContact CG-CG2 3.85Å; L311-A318 HydrophobicContact CD1-CB 4.03Å; L311-I320 HydrophobicContact CD1-CG1 3.85Å; L311-W607 HydrophobicContact CD1-CD2 4.24Å; L311-W607 HydrophobicContact CD1-CE3 4.21Å; L311-W607 HydrophobicContact CD1-CH2 4.39Å; L311-W607 HydrophobicContact CD1-CZ2 4.46Å; L311-W607 HydrophobicContact CD1-CZ3 4.29Å; L311-W607 HydrophobicContact CD2-CD2 4.08Å; L311-W607 HydrophobicContact CD2-CE3 3.59Å; L311-W607 HydrophobicContact CD2-CG 4.5Å; L311-W607 HydrophobicContact CD2-CZ3 4.09Å; L311-T609 HydrophobicContact CB-CG2 4Å; L311-T609 HydrophobicContact CD2-CG2 3.87Å; L311-Y611 PolarHBondContact N-O 3.11Å; L311-M612 HydrophobicContact CD2-CE 4.3Å; L311-M612 HydrophobicContact CD2-CG 4.25Å; L311-M612 HydrophobicContact CD2-SD 4.33Å; L311-M612 CarbonylContact O-C 3.58Å; L311-M612 WeakPolarHBondContact O-CA 3.46Å; L311-T613 PolarHBondContact O-N 2.78Å
312	T	96.5	Very high	94.2	Very high	10 Å²	10	38.6 Å²	38.6	6%	0.061	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	113	169.9	-55.7	0	0	0	0	109.2	F314 A318 L319 T613	T312-F314 HydrophobicContact CG2-CE1 4.14Å; T312-F314 HydrophobicContact CG2-CE2 4.14Å; T312-F314 HydrophobicContact CG2-CZ 3.84Å; T312-A318 CarbonylContact O-C 3.59Å; T312-A318 VanDerWaalsContact O-CA 3.23Å; T312-A318 WeakPolarHBondContact O-CA 3.41Å; T312-L319 PolarHBondContact N-O 3.09Å; T312-L319 PolarHBondContact O-N 3.12Å; T312-T613 CarbonylContact C-O 3.54Å; T312-T613 VanDerWaalsContact CA-O 3.28Å; T312-T613 WeakPolarHBondContact CA-O 3.31Å; T312-T613 HydrophobicContact CG2-CG2 4.48Å
313	V	96.9	Very high	94.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	123.4	179.1	-168.5	0	0	0	0	108.6	L311 A318 W576 V599 W607 M612 T613 L614 S615	L311-V313 HydrophobicContact CD1-CG2 4.17Å; L311-V313 HydrophobicContact CD2-CG2 3.97Å; L311-V313 HydrophobicContact CG-CG2 3.85Å; V313-A318 HydrophobicContact CG2-CB 4.3Å; V313-W576 HydrophobicContact CG1-CB 4.17Å; V313-W576 HydrophobicContact CG1-CG 4.46Å; V313-W576 PolarHBondContact O-NE1 3.3Å; V313-V599 HydrophobicContact CG1-CG1 4.4Å; V313-V599 HydrophobicContact CG2-CG1 4.41Å; V313-W607 HydrophobicContact CG2-CH2 4.41Å; V313-W607 HydrophobicContact CG2-CZ3 3.92Å; V313-M612 HydrophobicContact CG2-CE 3.67Å; V313-T613 PolarHBondContact N-O 3.48Å; V313-L614 HydrophobicContact CB-CD2 4Å; V313-L614 HydrophobicContact CG2-CD2 4.49Å; V313-L614 CarbonylContact O-C 3.55Å; V313-L614 WeakPolarHBondContact O-CA 3.47Å; V313-S615 PolarHBondContact O-N 3.05Å
314	F	95.2	Very high	94.3	Very high	19 Å²	19	41.4 Å²	41.4	8%	0.083	20%	0.199	C	C	.	.			trans	-94.9	179.8	172.9	-54	-88.3	0	0	0	110	T312 D316 R317 L319 G575 W576 S615 A617 P619	T312-F314 HydrophobicContact CG2-CE1 4.14Å; T312-F314 HydrophobicContact CG2-CE2 4.14Å; T312-F314 HydrophobicContact CG2-CZ 3.84Å; F314-D316 PolarHBondContact O-N 2.93Å; F314-R317 WeakPolarHBondContact CA-O 3.48Å; F314-R317 HydrophobicContact CB-CG 4Å; F314-R317 WeakPolarHBondContact CB-O 3.39Å; F314-R317 HydrophobicContact CD2-CG 3.63Å; F314-R317 HydrophobicContact CE2-CG 4.48Å; F314-R317 HydrophobicContact CG-CG 4.12Å; F314-R317 PolarHBondContact N-O 3.1Å; F314-L319 HydrophobicContact CE2-CB 3.78Å; F314-L319 HydrophobicContact CZ-CB 4.36Å; F314-G575 VanDerWaalsContact O-CA 3.28Å; F314-G575 WeakPolarHBondContact O-CA 3.36Å; F314-W576 VanDerWaalsContact C-CD1 3.47Å; F314-W576 PolarHBondContact O-N 2.93Å; F314-S615 WeakPolarHBondContact CA-O 3.38Å; F314-A617 HydrophobicContact CD1-CB 3.92Å; F314-A617 WeakPolarHBondContact CD1-O 3.35Å; F314-A617 HydrophobicContact CE1-CB 3.87Å; F314-P619 HydrophobicContact CD1-CG 4.31Å; F314-P619 HydrophobicContact CE1-CG 4.14Å; F314-P619 HydrophobicContact CZ-CG 4.3Å
315	L	93	Very high	94.5	Very high	71 Å²	71	44.7 Å²	44.7	37%	0.372	21%	0.21	S	C	.	.	S	Bend	trans	-63.7	-25.9	179.8	-60.2	177.6	0	0	0	113.2	W576	L315-W576 HydrophobicContact CD2-CD2 4.49Å; L315-W576 HydrophobicContact CD2-CZ2 4.27Å; L315-W576 WeakPolarHBondContact CD2-O 3.37Å
316	D	90.8	Very high	94.6	Very high	77 Å²	77	37.2 Å²	37.2	41%	0.412	18%	0.175	S	C	.	.	S	Bend	trans	-132.5	-3.5	-170.9	70.2	-22.1	0	0	0	115.5	F314 C574	F314-D316 PolarHBondContact O-N 2.93Å; D316-C574 CarbonylContact C-O 3.57Å; D316-C574 VanDerWaalsContact O-O 3.05Å
317	R	93.8	Very high	94.6	Very high	41 Å²	41	44.6 Å²	44.6	16%	0.155	20%	0.201	C	C	.	.			trans	-159.6	176.5	-175.4	72.1	-168.1	76.7	-156.4	-5.5	111.2	F314 V570 V571 C574	F314-R317 WeakPolarHBondContact CA-O 3.48Å; F314-R317 HydrophobicContact CB-CG 4Å; F314-R317 WeakPolarHBondContact CB-O 3.39Å; F314-R317 HydrophobicContact CD2-CG 3.63Å; F314-R317 HydrophobicContact CE2-CG 4.48Å; F314-R317 HydrophobicContact CG-CG 4.12Å; F314-R317 PolarHBondContact N-O 3.1Å; R317-V570 HydrophobicContact CB-CG1 4.09Å; R317-V570 HydrophobicContact CG-CG1 4.04Å; R317-V571 CarbonylContact C-O 3.59Å; R317-V571 WeakPolarHBondContact CA-O 3.22Å; R317-V571 VanDerWaalsContact CB-O 3.32Å; R317-V571 WeakPolarHBondContact CB-O 3.43Å; R317-C574 PolarHBondContact N-O 2.85Å
318	A	96.1	Very high	94.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	144.4	169.5	0	0	0	0	0	111.8	L311 T312 V313 V570 V571 C574 W607	L311-A318 HydrophobicContact CD1-CB 4.03Å; T312-A318 CarbonylContact O-C 3.59Å; T312-A318 VanDerWaalsContact O-CA 3.23Å; T312-A318 WeakPolarHBondContact O-CA 3.41Å; V313-A318 HydrophobicContact CG2-CB 4.3Å; A318-V570 CarbonylContact O-C 3.59Å; A318-V570 VanDerWaalsContact O-CA 3.26Å; A318-V570 WeakPolarHBondContact O-CA 3.4Å; A318-V571 HydrophobicContact CB-CG2 3.95Å; A318-V571 PolarHBondContact N-O 2.83Å; A318-V571 PolarHBondContact O-N 2.81Å; A318-C574 VanDerWaalsContact CB-SG 3.58Å; A318-C574 PolarHBondContact N-SG 2.86Å; A318-W607 HydrophobicContact CB-CH2 3.61Å; A318-W607 HydrophobicContact CB-CZ2 3.92Å
319	L	95.8	Very high	94.4	Very high	60 Å²	60	43.5 Å²	43.5	31%	0.314	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	119.4	166.2	173.4	68.7	0	0	0	108.4	T312 F314 V570	T312-L319 PolarHBondContact N-O 3.09Å; T312-L319 PolarHBondContact O-N 3.12Å; F314-L319 HydrophobicContact CE2-CB 3.78Å; F314-L319 HydrophobicContact CZ-CB 4.36Å; L319-V570 HydrophobicContact CD1-CG2 4.11Å
320	I	96.2	Very high	94	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.9	177.6	-65	176.4	0	0	0	108.2	M308 L311 R322 S568 Y569 V571 E605 W607	M308-I320 HydrophobicContact CG-CG2 4.43Å; M308-I320 HydrophobicContact SD-CG1 4.33Å; M308-I320 HydrophobicContact SD-CG2 3.87Å; L311-I320 HydrophobicContact CD1-CG1 3.85Å; I320-R322 HydrophobicContact CG2-CG 3.99Å; I320-S568 CarbonylContact O-C 3.58Å; I320-S568 VanDerWaalsContact O-CA 3.24Å; I320-S568 WeakPolarHBondContact O-CA 3.45Å; I320-Y569 HydrophobicContact CB-CD2 4.16Å; I320-Y569 HydrophobicContact CB-CE2 3.76Å; I320-Y569 HydrophobicContact CD1-CE2 3.96Å; I320-Y569 HydrophobicContact CG1-CE2 4.39Å; I320-Y569 HydrophobicContact CG2-CE1 4.32Å; I320-Y569 HydrophobicContact CG2-CE2 3.88Å; I320-Y569 PolarHBondContact N-O 2.78Å; I320-Y569 PolarHBondContact O-N 3Å; I320-V571 HydrophobicContact CD1-CB 4.46Å; I320-V571 HydrophobicContact CD1-CG1 3.96Å; I320-V571 HydrophobicContact CD1-CG2 3.59Å; I320-V571 HydrophobicContact CG1-CG2 4.15Å; I320-E605 WeakPolarHBondContact CD1-OE1 3.26Å; I320-W607 HydrophobicContact CD1-CZ2 4.37Å
321	C	95.8	Very high	93.2	Very high	12 Å²	12	44 Å²	44	8%	0.081	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	121.7	167.6	177.8	0	0	0	0	109.1	S309 Q310 V567 S568	S309-C321 PolarHBondContact N-O 3.35Å; S309-C321 PolarHBondContact OG-O 2.75Å; S309-C321 PolarHBondContact OG-SG 3.17Å; Q310-C321 HydrophobicContact CB-CB 4.16Å; Q310-C321 PolarHBondContact N-O 3Å; Q310-C321 PolarHBondContact O-N 3.1Å; C321-V567 WeakPolarHBondContact CA-O 3.34Å; C321-S568 PolarHBondContact SG-OG 3.28Å
322	R	95.9	Very high	92.5	Very high	10 Å²	10	47.5 Å²	47.5	4%	0.038	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	140.5	175.4	-70.7	-179.3	178.6	-100.1	3.8	110.4	M303 F304 C306 Q307 I320 L566 V567 Y569 E605	M303-R322 VanDerWaalsContact O-CD 3.29Å; M303-R322 WeakPolarHBondContact O-CD 3.42Å; M303-R322 PolarHBondContact O-NE 3.12Å; M303-R322 PolarHBondContact O-NH1 3.34Å; M303-R322 HydrophobicContact SD-CB 4.49Å; M303-R322 WeakPolarHBondContact SD-CD 3.29Å; F304-R322 VanDerWaalsContact C-NH1 3.33Å; F304-R322 PolarHBondContact O-NH1 3.16Å; C306-R322 HydrophobicContact CB-CB 4.16Å; C306-R322 PolarHBondContact O-NH1 2.94Å; Q307-R322 CarbonylContact O-C 3.54Å; Q307-R322 WeakPolarHBondContact O-CA 3.5Å; I320-R322 HydrophobicContact CG2-CG 3.99Å; R322-L566 WeakPolarHBondContact O-CA 3.18Å; R322-V567 PolarHBondContact N-O 2.75Å; R322-V567 PolarHBondContact O-N 3.24Å; R322-Y569 VanDerWaalsContact CD-OH 3.27Å; R322-Y569 WeakPolarHBondContact CD-OH 3.3Å; R322-Y569 PolarHBondContact NE-OH 2.95Å; R322-E605 IonicContact CZ-OE2 3.9Å; R322-E605 IonicContact NE-OE2 3.18Å; R322-E605 IonicContact NH2-OE2 3.93Å; R322-E605 PolarHBondContact NH2-OE2 2.98Å
323	R	94.5	Very high	92.3	Very high	77 Å²	77	49 Å²	49	29%	0.291	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134.2	179	178.2	176.1	62.5	-162.3	-2.7	110.2	Q307 E564 L566	Q307-R323 PolarHBondContact O-N 3.05Å; R323-E564 VanDerWaalsContact CD-OE1 3.3Å; R323-E564 WeakPolarHBondContact CD-OE1 3.49Å; R323-E564 HydrophobicContact CG-CG 4.18Å; R323-L566 HydrophobicContact CB-CD2 3.69Å; R323-L566 HydrophobicContact CG-CD2 3.79Å
324	I	95.1	Very high	92.1	Very high	20 Å²	20	49 Å²	49	10%	0.103	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	154.6	174.1	-168.6	173.1	0	0	0	110.8	Y301 P326 F338 M565	Y301-I324 HydrophobicContact CD1-CD1 3.38Å; Y301-I324 HydrophobicContact CD2-CD1 3.54Å; Y301-I324 HydrophobicContact CE1-CD1 3.54Å; Y301-I324 HydrophobicContact CE1-CG1 4.47Å; Y301-I324 HydrophobicContact CE2-CD1 3.68Å; Y301-I324 HydrophobicContact CG-CD1 3.36Å; I324-P326 VanDerWaalsContact C-CD 3.47Å; I324-F338 HydrophobicContact CD1-CE1 4.02Å; I324-F338 HydrophobicContact CG2-CE1 4.16Å; I324-F338 HydrophobicContact CG2-CZ 4.06Å; I324-M565 HydrophobicContact CG2-CB 3.82Å; I324-M565 HydrophobicContact CG2-CG 4.2Å; I324-M565 HydrophobicContact CG2-SD 4.24Å; I324-M565 PolarHBondContact N-O 3.25Å; I324-M565 PolarHBondContact O-N 3.03Å
325	R	95.4	Very high	92.1	Very high	139 Å²	139	50.6 Å²	50.6	53%	0.525	25%	0.249	S	C	.	.			trans	-125.2	68.2	178.5	-66.9	-177.6	177.2	172.1	-1.1	111.4	V563 E564	R325-V563 WeakPolarHBondContact CA-O 3.28Å; R325-E564 IonicContact CZ-OE1 3.68Å; R325-E564 IonicContact NE-OE1 2.69Å; R325-E564 IonicContact NH2-OE1 2.69Å; R325-E564 PolarHBondContact NH2-OE1 3.26Å
326	P	93.6	Very high	92.2	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.231	C	C	.	.			trans	-60	148.2	176.1	26.9	-36.4	0	0	0	110.6	Y301 I324 F328 Q562 V563 M565	Y301-P326 HydrophobicContact CE2-CB 4.31Å; I324-P326 VanDerWaalsContact C-CD 3.47Å; P326-F328 HydrophobicContact CB-CE1 4.26Å; P326-F328 HydrophobicContact CB-CE2 3.97Å; P326-F328 HydrophobicContact CB-CZ 3.74Å; P326-F328 HydrophobicContact CG-CE2 3.57Å; P326-F328 HydrophobicContact CG-CZ 3.55Å; P326-Q562 WeakPolarHBondContact O-CA 3.39Å; P326-V563 VanDerWaalsContact CD-O 3.28Å; P326-V563 WeakPolarHBondContact CD-O 3.46Å; P326-V563 PolarHBondContact O-N 3.01Å; P326-M565 HydrophobicContact CG-CB 4.48Å; P326-M565 HydrophobicContact CG-CE 4.47Å
327	R	93.8	Very high	92.5	Very high	165 Å²	165	43.7 Å²	43.7	62%	0.623	21%	0.212	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-105	124.9	175	-172.3	177.7	-178.1	176.1	0.8	108.7	Q299 G561 Q562	Q299-R327 PolarHBondContact NE2-O 3.4Å; R327-G561 WeakPolarHBondContact CA-O 3.34Å; R327-Q562 HydrophobicContact CB-CG 4.12Å; R327-Q562 HydrophobicContact CG-CG 4.31Å
328	F	92.2	Very high	92.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	154	-178.5	-62.6	-67	0	0	0	111.9	P326 T334 V336 I354 V555 P557 T560 G561 V563 M565	P326-F328 HydrophobicContact CB-CE1 4.26Å; P326-F328 HydrophobicContact CB-CE2 3.97Å; P326-F328 HydrophobicContact CB-CZ 3.74Å; P326-F328 HydrophobicContact CG-CE2 3.57Å; P326-F328 HydrophobicContact CG-CZ 3.55Å; F328-T334 HydrophobicContact CD1-CG2 3.9Å; F328-T334 HydrophobicContact CE1-CG2 3.77Å; F328-V336 HydrophobicContact CE1-CG2 3.73Å; F328-V336 HydrophobicContact CZ-CG2 3.83Å; F328-I354 HydrophobicContact CE2-CD1 4.32Å; F328-V555 HydrophobicContact CE1-CB 4.25Å; F328-V555 HydrophobicContact CE1-CG1 4.29Å; F328-V555 HydrophobicContact CE2-CG1 4.14Å; F328-V555 HydrophobicContact CZ-CB 4.14Å; F328-V555 HydrophobicContact CZ-CG1 3.92Å; F328-V555 HydrophobicContact CZ-CG2 4.23Å; F328-P557 HydrophobicContact CB-CB 3.51Å; F328-P557 HydrophobicContact CB-CG 3.39Å; F328-P557 HydrophobicContact CD1-CG 3.84Å; F328-P557 HydrophobicContact CD2-CG 4.39Å; F328-P557 HydrophobicContact CG-CB 4.06Å; F328-P557 HydrophobicContact CG-CG 3.64Å; F328-T560 VanDerWaalsContact O-CA 3.31Å; F328-T560 WeakPolarHBondContact O-CA 3.32Å; F328-T560 WeakPolarHBondContact O-CG2 3.24Å; F328-G561 PolarHBondContact N-O 3.08Å; F328-G561 PolarHBondContact O-N 2.94Å; F328-V563 HydrophobicContact CD2-CB 4.02Å; F328-V563 HydrophobicContact CD2-CG2 3.81Å; F328-V563 HydrophobicContact CE2-CB 3.97Å; F328-V563 HydrophobicContact CE2-CG2 4.25Å; F328-M565 HydrophobicContact CZ-CE 4.49Å
329	N	89.5	Confident	92.5	Very high	88 Å²	88	44.6 Å²	44.6	47%	0.471	22%	0.218	S	C	.	.			trans	-96.9	138.9	165.5	-65.4	-29.3	0	0	0	108.8
330	A	84	Confident	92.2	Very high	32 Å²	32	47 Å²	47	26%	0.264	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	139.8	177.4	0	0	0	0	0	111.2	D332 T560	A330-D332 PolarHBondContact O-N 3.25Å; A330-T560 WeakPolarHBondContact CB-OG1 3.45Å; A330-T560 PolarHBondContact N-OG1 2.87Å
331	S	75.6	Confident	92	Very high	103 Å²	103	47.3 Å²	47.3	72%	0.72	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	75	-9	174.5	-37.4	0	0	0	0	116.9	P557	S331-P557 PolarHBondContact N-O 2.92Å; S331-P557 VanDerWaalsContact N-O 3.17Å
332	D	83.8	Confident	91.8	Very high	73 Å²	73	46.7 Å²	46.7	39%	0.39	23%	0.225	S	C	.	.			trans	-92.4	111.1	175.6	-66.3	-21.4	0	0	0	110	A330 T334 P557	A330-D332 PolarHBondContact O-N 3.25Å; D332-T334 PolarHBondContact O-N 3.1Å; D332-T334 VanDerWaalsContact O-N 3.1Å; D332-T334 PolarHBondContact O-OG1 2.84Å; D332-T334 VanDerWaalsContact O-OG1 3.05Å; D332-P557 WeakPolarHBondContact O-CD 3.43Å
333	I	91.6	Very high	91.5	Very high	42 Å²	42	47.3 Å²	47.3	22%	0.215	23%	0.23	C	C	.	.			trans	-60.1	119.8	170.1	-62.3	175.5	0	0	0	107.6	S297 L361 L554 V555 E556	S297-I333 PolarHBondContact N-O 3.31Å; I333-L361 HydrophobicContact CD1-CD1 4Å; I333-L361 HydrophobicContact CG1-CD1 4.28Å; I333-L361 HydrophobicContact CG2-CD1 4.07Å; I333-L554 HydrophobicContact CG2-CD1 3.42Å; I333-L554 VanDerWaalsContact CG2-CD1 3.42Å; I333-L554 HydrophobicContact CG2-CD2 4.22Å; I333-L554 HydrophobicContact CG2-CG 3.7Å; I333-V555 WeakPolarHBondContact CA-O 3.38Å; I333-E556 HydrophobicContact CG1-CG 4.47Å
334	T	93.4	Very high	91.3	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.006	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	129	-175.1	-56	0	0	0	0	109.6	S297 Q299 F328 D332 V336 V555	S297-T334 CarbonylContact O-C 3.56Å; S297-T334 WeakPolarHBondContact O-CA 3.45Å; S297-T334 WeakPolarHBondContact O-CG2 3.49Å; Q299-T334 HydrophobicContact CG-CG2 3.9Å; F328-T334 HydrophobicContact CD1-CG2 3.9Å; F328-T334 HydrophobicContact CE1-CG2 3.77Å; D332-T334 PolarHBondContact O-N 3.1Å; D332-T334 VanDerWaalsContact O-N 3.1Å; D332-T334 PolarHBondContact O-OG1 2.84Å; D332-T334 VanDerWaalsContact O-OG1 3.05Å; T334-V336 HydrophobicContact CG2-CG2 4.43Å; T334-V555 PolarHBondContact N-O 3.4Å; T334-V555 PolarHBondContact O-N 3.34Å
335	E	94.7	Very high	91.1	Very high	52 Å²	52	43.9 Å²	43.9	24%	0.243	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	116.5	169.5	-171.2	-176.5	-152.1	0	0	109.2	S297 R298 Q299 V337 S552 L554	S297-E335 PolarHBondContact O-N 2.78Å; R298-E335 CarbonylContact C-O 3.58Å; R298-E335 WeakPolarHBondContact CA-O 3.44Å; R298-E335 IonicContact NE-OE2 3.97Å; Q299-E335 PolarHBondContact N-O 3.42Å; E335-V337 HydrophobicContact CG-CG2 3.79Å; E335-S552 VanDerWaalsContact CD-OG 3.3Å; E335-S552 WeakPolarHBondContact CG-OG 3.43Å; E335-S552 PolarHBondContact OE1-OG 3.11Å; E335-L554 HydrophobicContact CB-CD1 4.32Å
336	V	95.4	Very high	90.9	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	110.7	173.5	-177.2	0	0	0	0	108.1	Q299 Y301 F328 T334 F338 V553 V555 M565	Q299-V336 CarbonylContact O-C 3.58Å; Q299-V336 WeakPolarHBondContact O-CA 3.36Å; Y301-V336 HydrophobicContact CD2-CG1 3.74Å; Y301-V336 HydrophobicContact CE2-CG1 3.85Å; F328-V336 HydrophobicContact CE1-CG2 3.73Å; F328-V336 HydrophobicContact CZ-CG2 3.83Å; T334-V336 HydrophobicContact CG2-CG2 4.43Å; V336-F338 HydrophobicContact CG1-CD2 4.49Å; V336-F338 HydrophobicContact CG1-CE2 3.76Å; V336-F338 HydrophobicContact CG1-CZ 3.77Å; V336-V553 HydrophobicContact CB-CB 4.37Å; V336-V553 PolarHBondContact N-O 3.39Å; V336-V553 PolarHBondContact O-N 2.92Å; V336-V555 HydrophobicContact CG2-CG2 4.31Å; V336-M565 HydrophobicContact CG1-SD 4.5Å; V336-M565 HydrophobicContact CG2-CE 4.31Å
337	V	95.9	Very high	90.7	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.018	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	127.9	-179.7	-176.1	0	0	0	0	109.9	R298 Q299 V300 Y301 E335 E339 E550 L551	R298-V337 HydrophobicContact CG-CG2 4.28Å; Q299-V337 PolarHBondContact O-N 2.95Å; V300-V337 CarbonylContact C-O 3.54Å; V300-V337 VanDerWaalsContact CA-O 3.32Å; V300-V337 WeakPolarHBondContact CA-O 3.42Å; V300-V337 HydrophobicContact CG2-CB 4.42Å; Y301-V337 PolarHBondContact N-O 3.38Å; E335-V337 HydrophobicContact CG-CG2 3.79Å; V337-E339 HydrophobicContact CG1-CG 4.25Å; V337-E550 HydrophobicContact CG1-CB 4.48Å; V337-L551 CarbonylContact C-O 3.53Å; V337-L551 WeakPolarHBondContact CA-O 3.35Å
338	F	96.5	Very high	90.4	Very high	1 Å²	1	38.1 Å²	38.1	0%	0.004	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	124.1	169	-56.2	-90.3	0	0	0	109.5	Y301 M303 I324 V336 L341 E550 L551 V553 M565 V567	Y301-F338 HydrophobicContact CD2-CE1 4.38Å; Y301-F338 CarbonylContact O-C 3.46Å; Y301-F338 VanDerWaalsContact O-CA 3.28Å; Y301-F338 WeakPolarHBondContact O-CA 3.34Å; M303-F338 HydrophobicContact CE-CB 3.52Å; M303-F338 HydrophobicContact CE-CD1 3.78Å; M303-F338 HydrophobicContact CE-CD2 4.25Å; M303-F338 HydrophobicContact CE-CG 3.59Å; M303-F338 HydrophobicContact SD-CD1 4.24Å; I324-F338 HydrophobicContact CD1-CE1 4.02Å; I324-F338 HydrophobicContact CG2-CE1 4.16Å; I324-F338 HydrophobicContact CG2-CZ 4.06Å; V336-F338 HydrophobicContact CG1-CD2 4.49Å; V336-F338 HydrophobicContact CG1-CE2 3.76Å; V336-F338 HydrophobicContact CG1-CZ 3.77Å; F338-L341 HydrophobicContact CB-CD1 4.49Å; F338-L341 VanDerWaalsContact O-CD1 3.24Å; F338-L341 WeakPolarHBondContact O-CD1 3.47Å; F338-E550 WeakPolarHBondContact O-CA 3.36Å; F338-L551 HydrophobicContact CB-CB 4.26Å; F338-L551 HydrophobicContact CD2-CB 4.37Å; F338-L551 HydrophobicContact CD2-CD2 3.94Å; F338-L551 HydrophobicContact CD2-CG 4.18Å; F338-L551 PolarHBondContact N-O 3.34Å; F338-L551 PolarHBondContact O-N 3.31Å; F338-V553 HydrophobicContact CD2-CG2 4.49Å; F338-V553 HydrophobicContact CE2-CG2 4.06Å; F338-M565 HydrophobicContact CE2-SD 4.05Å; F338-M565 HydrophobicContact CZ-SD 3.79Å; F338-V567 HydrophobicContact CE2-CG2 4.03Å; F338-V567 HydrophobicContact CZ-CG2 3.9Å
339	E	93.5	Very high	90.3	Very high	58 Å²	58	39 Å²	39	27%	0.271	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	163.8	175.8	-65.1	177.4	177.8	0	0	109.9	R298 V300 Y301 M303 V337 E550	R298-E339 IonicContact NH2-OE1 3.95Å; V300-E339 VanDerWaalsContact CG1-CD 3.44Å; V300-E339 HydrophobicContact CG1-CG 3.9Å; V300-E339 WeakPolarHBondContact CG1-OE1 3.21Å; Y301-E339 PolarHBondContact O-N 3.08Å; M303-E339 WeakPolarHBondContact CB-O 3.47Å; M303-E339 PolarHBondContact N-O 3.24Å; V337-E339 HydrophobicContact CG1-CG 4.25Å; E339-E550 HydrophobicContact CG-CG 4.39Å
340	H	89.3	Confident	90.5	Very high	110 Å²	110	34.8 Å²	34.8	51%	0.509	19%	0.192	S	C	.	.			trans	59.5	50.6	179.5	-50.7	-69.2	0	0	0	113.4	F304	F304-H340 WeakPolarHBondContact CD1-O 3.49Å; F304-H340 HydrophobicContact CD2-CB 4.17Å; F304-H340 WeakPolarHBondContact CE1-O 3.37Å; F304-H340 HydrophobicContact CE2-CB 4.01Å; F304-H340 HydrophobicContact CZ-CB 4.43Å; F304-H340 WeakPolarHBondContact CZ-O 3.43Å
341	L	92.9	Very high	91	Very high	7 Å²	7	38.8 Å²	38.8	4%	0.037	20%	0.201	C	C	.	.			trans	-71	149.2	169.8	-68.8	92	0	0	0	110.7	M303 F338 I345 F365 R549 L551	M303-L341 HydrophobicContact CB-CG 4.45Å; M303-L341 HydrophobicContact CE-CD2 4.19Å; M303-L341 HydrophobicContact CE-CG 4.28Å; M303-L341 HydrophobicContact CG-CG 4.44Å; F338-L341 HydrophobicContact CB-CD1 4.49Å; F338-L341 VanDerWaalsContact O-CD1 3.24Å; F338-L341 WeakPolarHBondContact O-CD1 3.47Å; L341-I345 HydrophobicContact CB-CD1 4.31Å; L341-I345 HydrophobicContact CD2-CD1 3.54Å; L341-F365 HydrophobicContact CD2-CE2 4.38Å; L341-R549 HydrophobicContact CB-CB 4.02Å; L341-R549 HydrophobicContact CD1-CB 4.47Å; L341-R549 VanDerWaalsContact CD1-O 3.3Å; L341-R549 WeakPolarHBondContact CD1-O 3.21Å; L341-L551 HydrophobicContact CD1-CB 4.09Å; L341-L551 HydrophobicContact CD2-CB 3.95Å
342	S	91.4	Very high	91.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.166	C	C	.	.			trans	-50.2	135	177.6	165	0	0	0	0	111.4	A344 I345 T603	S342-A344 PolarHBondContact O-N 2.74Å; S342-A344 PolarHBondContact OG-N 2.92Å; S342-I345 VanDerWaalsContact O-CB 3.3Å; S342-I345 WeakPolarHBondContact O-CB 3.37Å; S342-I345 WeakPolarHBondContact O-CG2 3.42Å; S342-I345 PolarHBondContact O-N 3.48Å; S342-T603 PolarHBondContact OG-O 2.65Å
343	P	88.8	Confident	92.4	Very high	22 Å²	22	33.1 Å²	33.1	14%	0.143	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-20.7	172.7	24.7	-35.1	0	0	0	114.2	I345 D544 R549 T603	P343-I345 VanDerWaalsContact C-N 3.33Å; P343-D544 HydrophobicContact CB-CB 4.22Å; P343-R549 VanDerWaalsContact CA-CZ 3.42Å; P343-R549 PolarHBondContact O-NH2 3.27Å; P343-T603 VanDerWaalsContact CD-O 3.26Å; P343-T603 WeakPolarHBondContact CD-O 3.4Å
344	A	90.3	Very high	92.5	Very high	6 Å²	6	31.1 Å²	31.1	5%	0.05	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	7.9	178.2	0	0	0	0	0	113.5	S342 V571 N572 R573 T603	S342-A344 PolarHBondContact O-N 2.74Å; S342-A344 PolarHBondContact OG-N 2.92Å; A344-V571 HydrophobicContact CB-CB 4.39Å; A344-V571 CarbonylContact O-C 3.59Å; A344-V571 WeakPolarHBondContact O-CA 3.41Å; A344-N572 WeakPolarHBondContact CB-O 3.15Å; A344-N572 PolarHBondContact O-N 3.45Å; A344-R573 HydrophobicContact CB-CB 4.2Å; A344-R573 HydrophobicContact CB-CG 4.21Å; A344-T603 HydrophobicContact CB-CG2 4.48Å
345	I	92.3	Very high	92.3	Very high	19 Å²	19	37.3 Å²	37.3	10%	0.097	17%	0.173	C	C	.	.	B	Isolated β-bridge	trans	-67.1	134.7	-176.4	-164	169.9	0	0	0	112.6	L341 S342 P343 I350 F365 Y569	L341-I345 HydrophobicContact CB-CD1 4.31Å; L341-I345 HydrophobicContact CD2-CD1 3.54Å; S342-I345 VanDerWaalsContact O-CB 3.3Å; S342-I345 WeakPolarHBondContact O-CB 3.37Å; S342-I345 WeakPolarHBondContact O-CG2 3.42Å; S342-I345 PolarHBondContact O-N 3.48Å; P343-I345 VanDerWaalsContact C-N 3.33Å; I345-I350 HydrophobicContact CD1-CD1 4.01Å; I345-I350 HydrophobicContact CD1-CG1 4.07Å; I345-F365 HydrophobicContact CG2-CE2 4.26Å; I345-F365 HydrophobicContact CG2-CZ 4.39Å; I345-Y569 HydrophobicContact CD1-CD1 4.32Å; I345-Y569 HydrophobicContact CD1-CD2 3.77Å; I345-Y569 HydrophobicContact CD1-CE2 4.37Å; I345-Y569 HydrophobicContact CD1-CG 3.74Å; I345-Y569 HydrophobicContact CG1-CD2 3.92Å; I345-Y569 HydrophobicContact CG1-CG 4.17Å
346	D	90.4	Very high	91.8	Very high	51 Å²	51	36.5 Å²	36.5	27%	0.273	18%	0.179	S	C	.	.			trans	-85.4	108.8	165.9	176.4	-1.6	0	0	0	109.3	D348 S349 V570	D346-D348 PolarHBondContact O-N 3.02Å; D346-D348 PolarHBondContact OD1-N 3.33Å; D346-S349 WeakPolarHBondContact O-CB 3.36Å; D346-S349 PolarHBondContact O-N 2.72Å; D346-S349 VanDerWaalsContact O-N 3.12Å; D346-S349 PolarHBondContact O-OG 2.9Å; D346-V570 HydrophobicContact CB-CB 4.31Å; D346-V570 PolarHBondContact N-O 2.83Å
347	K	88.8	Confident	91.4	Very high	39 Å²	39	37.8 Å²	37.8	17%	0.17	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-57.6	-33.9	-177.7	68	-174.1	176.3	-167.4	0	113.1	I10 E20 S349 I350 F365	I10-K347 HydrophobicContact CD1-CD 4.34Å; I10-K347 HydrophobicContact CG2-CD 4.4Å; E20-K347 WeakPolarHBondContact OE1-CE 3.3Å; E20-K347 IonicContact OE1-NZ 3.39Å; E20-K347 PolarHBondContact OE1-NZ 2.78Å; K347-S349 PolarHBondContact O-N 2.98Å; K347-I350 WeakPolarHBondContact O-CG1 3.32Å; K347-I350 PolarHBondContact O-N 3.08Å; K347-F365 HydrophobicContact CB-CD1 3.94Å; K347-F365 HydrophobicContact CB-CE1 4Å; K347-F365 HydrophobicContact CB-CG 4.36Å; K347-F365 HydrophobicContact CB-CZ 4.45Å
348	D	87.6	Confident	91.1	Very high	93 Å²	93	37.9 Å²	37.9	50%	0.497	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-79.8	-12.1	-175.8	-65.4	-34.9	0	0	0	112.4	D346 R351	D346-D348 PolarHBondContact O-N 3.02Å; D346-D348 PolarHBondContact OD1-N 3.33Å; D348-R351 PolarHBondContact O-NH1 3.17Å; D348-R351 PolarHBondContact O-NH2 2.83Å
349	S	91.3	Very high	90.9	Very high	19 Å²	19	39 Å²	39	13%	0.133	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-85.9	-12.3	178.3	78.4	0	0	0	0	113.9	D346 K347 R351 V570	D346-S349 WeakPolarHBondContact O-CB 3.36Å; D346-S349 PolarHBondContact O-N 2.72Å; D346-S349 VanDerWaalsContact O-N 3.12Å; D346-S349 PolarHBondContact O-OG 2.9Å; K347-S349 PolarHBondContact O-N 2.98Å; S349-R351 PolarHBondContact O-N 2.72Å; S349-V570 PolarHBondContact OG-N 3.41Å
350	I	93.6	Very high	90.9	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.189	C	C	.	.			trans	-65.9	125.3	-173.5	-60.3	170.6	0	0	0	110.7	V7 I345 K347 F365 L551 S568	V7-I350 HydrophobicContact CG2-CB 3.83Å; V7-I350 HydrophobicContact CG2-CD1 4.33Å; V7-I350 HydrophobicContact CG2-CG2 4.05Å; I345-I350 HydrophobicContact CD1-CD1 4.01Å; I345-I350 HydrophobicContact CD1-CG1 4.07Å; K347-I350 WeakPolarHBondContact O-CG1 3.32Å; K347-I350 PolarHBondContact O-N 3.08Å; I350-F365 HydrophobicContact CD1-CB 4.3Å; I350-F365 HydrophobicContact CD1-CD2 3.67Å; I350-F365 HydrophobicContact CD1-CE2 4.34Å; I350-F365 HydrophobicContact CD1-CG 4.21Å; I350-L551 HydrophobicContact CD1-CD1 4.43Å; I350-L551 HydrophobicContact CG2-CD1 3.94Å; I350-L551 HydrophobicContact CG2-CD2 4.01Å; I350-S568 CarbonylContact C-O 3.55Å; I350-S568 WeakPolarHBondContact CA-O 3.49Å
351	R	93.8	Very high	91	Very high	115 Å²	115	35.7 Å²	35.7	43%	0.434	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	133.4	174.4	-58.8	-64.4	176.6	-87	-3.3	109.4	D348 S349 V567 S568	D348-R351 PolarHBondContact O-NH1 3.17Å; D348-R351 PolarHBondContact O-NH2 2.83Å; S349-R351 PolarHBondContact O-N 2.72Å; R351-V567 WeakPolarHBondContact O-CA 3.36Å; R351-S568 PolarHBondContact N-O 3.03Å; R351-S568 PolarHBondContact O-N 3.17Å
352	V	95.5	Very high	91	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	125.1	176.8	-174.4	0	0	0	0	109.3	T4 V5 I360 V363 L551 V553 M565 L566 V567	T4-V352 WeakPolarHBondContact CA-O 3.34Å; V5-V352 PolarHBondContact N-O 3.09Å; V5-V352 PolarHBondContact O-N 3.24Å; V352-I360 HydrophobicContact CB-CD1 4.2Å; V352-I360 HydrophobicContact CG1-CD1 3.86Å; V352-I360 WeakPolarHBondContact O-CD1 3.39Å; V352-V363 HydrophobicContact CB-CG2 4.25Å; V352-V363 HydrophobicContact CG2-CG1 3.93Å; V352-V363 HydrophobicContact CG2-CG2 4.13Å; V352-L551 HydrophobicContact CG2-CD2 4.47Å; V352-V553 HydrophobicContact CG1-CG1 4.13Å; V352-V553 HydrophobicContact CG1-CG2 4.28Å; V352-V553 HydrophobicContact CG2-CG2 3.98Å; V352-M565 HydrophobicContact CG1-CG 3.89Å; V352-M565 HydrophobicContact CG1-SD 4.11Å; V352-L566 CarbonylContact C-O 3.58Å; V352-L566 WeakPolarHBondContact CA-O 3.39Å; V352-V567 HydrophobicContact CG1-CG2 4.48Å; V352-V567 HydrophobicContact CG2-CG1 4.45Å; V352-V567 HydrophobicContact CG2-CG2 4.45Å
353	E	94.2	Very high	91.1	Very high	57 Å²	57	37.6 Å²	37.6	27%	0.266	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	138.3	172.2	-45.7	-157.9	139	0	0	110.2	T3 T4 M565 L566	T3-E353 WeakPolarHBondContact O-CA 3.35Å; T4-E353 HydrophobicContact CG2-CG 3.89Å; T4-E353 WeakPolarHBondContact OG1-CG 3.46Å; T4-E353 PolarHBondContact OG1-OE1 2.74Å; E353-M565 CarbonylContact O-C 3.57Å; E353-M565 VanDerWaalsContact O-CA 3.27Å; E353-M565 WeakPolarHBondContact O-CA 3.42Å; E353-L566 HydrophobicContact CB-CB 4.22Å; E353-L566 PolarHBondContact N-O 3.07Å; E353-L566 PolarHBondContact O-N 2.93Å
354	I	92.1	Very high	91.2	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	131.8	173.2	-159.5	165.3	0	0	0	110.7	S2 T3 F328 A358 I360 V555 V563 M565	S2-I354 WeakPolarHBondContact CA-O 3.24Å; T3-I354 PolarHBondContact N-O 2.62Å; T3-I354 PolarHBondContact O-N 2.82Å; F328-I354 HydrophobicContact CE2-CD1 4.32Å; I354-A358 HydrophobicContact CD1-CB 3.69Å; I354-A358 HydrophobicContact CG1-CB 4.43Å; I354-I360 HydrophobicContact CB-CD1 4.03Å; I354-I360 HydrophobicContact CB-CG1 4.09Å; I354-I360 HydrophobicContact CG2-CD1 3.89Å; I354-I360 HydrophobicContact CG2-CG1 3.7Å; I354-V555 HydrophobicContact CD1-CG1 3.72Å; I354-V555 HydrophobicContact CD1-CG2 4.33Å; I354-V563 HydrophobicContact CD1-CG1 3.67Å; I354-V563 HydrophobicContact CG1-CG1 3.27Å; I354-M565 HydrophobicContact CD1-CE 4.06Å
355	R	90	Very high	91.3	Very high	131 Å²	131	38.4 Å²	38.4	49%	0.494	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	107.4	178.3	-67	-175.3	176.2	-172.7	1.1	110	V563 E564	R355-V563 VanDerWaalsContact O-CG1 3.27Å; R355-V563 WeakPolarHBondContact O-CG1 3.32Å; R355-E564 HydrophobicContact CB-CB 4.31Å; R355-E564 PolarHBondContact N-O 2.78Å; R355-E564 PolarHBondContact O-N 3.13Å
356	G	84.8	Confident	91.2	Very high	35 Å²	35	38.5 Å²	38.5	36%	0.361	20%	0.202	S	C	.	.	S	Bend	trans	151	-164.2	177.3	0	0	0	0	0	111.7	A358	G356-A358 PolarHBondContact O-N 3.27Å
357	A	87.2	Confident	91	Very high	28 Å²	28	36.9 Å²	36.9	23%	0.231	20%	0.195	C	C	.	.	S	Bend	trans	-83	60.7	178.1	0	0	0	0	0	110.8	R558 E559	A357-R558 HydrophobicContact CB-CB 4.19Å; A357-R558 WeakPolarHBondContact O-CA 3.34Å; A357-R558 WeakPolarHBondContact O-CB 3.11Å; A357-R558 PolarHBondContact O-N 2.85Å; A357-E559 HydrophobicContact CB-CB 3.89Å; A357-E559 HydrophobicContact CB-CG 3.79Å
358	A	89.5	Confident	90.7	Very high	5 Å²	5	40.2 Å²	40.2	4%	0.041	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	153.4	177.3	0	0	0	0	0	111.4	I354 G356 V555 E556 V563	I354-A358 HydrophobicContact CD1-CB 3.69Å; I354-A358 HydrophobicContact CG1-CB 4.43Å; G356-A358 PolarHBondContact O-N 3.27Å; A358-V555 HydrophobicContact CB-CG1 3.82Å; A358-E556 CarbonylContact C-O 3.5Å; A358-E556 WeakPolarHBondContact CA-O 3.49Å; A358-V563 HydrophobicContact CB-CG1 4.25Å; A358-V563 HydrophobicContact CB-CG2 4.26Å
359	T	91.7	Very high	90.2	Very high	25 Å²	25	38.6 Å²	38.6	15%	0.153	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	134.2	177.9	32.2	0	0	0	0	110.8	V555 E556	T359-V555 WeakPolarHBondContact O-CA 3.38Å; T359-E556 PolarHBondContact N-O 3.44Å; T359-E556 PolarHBondContact O-N 3.4Å; T359-E556 PolarHBondContact OG1-O 2.85Å
360	I	93.3	Very high	89.3	Confident	16 Å²	16	43.4 Å²	43.4	8%	0.082	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	124.3	171.7	-58.5	165.8	0	0	0	107.3	V5 V352 I354 V363 V553	V5-I360 HydrophobicContact CB-CB 4.43Å; V5-I360 HydrophobicContact CB-CD1 4.42Å; V5-I360 HydrophobicContact CB-CG2 3.99Å; V5-I360 HydrophobicContact CG1-CG2 4.42Å; V5-I360 HydrophobicContact CG2-CB 3.73Å; V5-I360 HydrophobicContact CG2-CD1 4.08Å; V5-I360 HydrophobicContact CG2-CG2 3.79Å; V352-I360 HydrophobicContact CB-CD1 4.2Å; V352-I360 HydrophobicContact CG1-CD1 3.86Å; V352-I360 WeakPolarHBondContact O-CD1 3.39Å; I354-I360 HydrophobicContact CB-CD1 4.03Å; I354-I360 HydrophobicContact CB-CG1 4.09Å; I354-I360 HydrophobicContact CG2-CD1 3.89Å; I354-I360 HydrophobicContact CG2-CG1 3.7Å; I360-V363 HydrophobicContact CG2-CG2 3.69Å; I360-V553 HydrophobicContact CG1-CG1 4.49Å; I360-V553 HydrophobicContact CG2-CG1 4.05Å
361	L	92.1	Very high	88.1	Confident	82 Å²	82	44.8 Å²	44.8	43%	0.429	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	-38.6	177.4	-63.6	-176.7	0	0	0	111.8	I333 L554 E556	I333-L361 HydrophobicContact CD1-CD1 4Å; I333-L361 HydrophobicContact CG1-CD1 4.28Å; I333-L361 HydrophobicContact CG2-CD1 4.07Å; L361-L554 HydrophobicContact CB-CB 4.18Å; L361-L554 HydrophobicContact CB-CD2 3.98Å; L361-L554 HydrophobicContact CB-CG 4.11Å; L361-L554 HydrophobicContact CD1-CD2 4.03Å; L361-L554 HydrophobicContact CD1-CG 4.17Å; L361-L554 PolarHBondContact N-O 2.87Å; L361-E556 HydrophobicContact CD1-CB 4Å; L361-E556 HydrophobicContact CD2-CB 4.19Å; L361-E556 HydrophobicContact CG-CB 4.03Å
362	D	92.3	Very high	86.9	Confident	46 Å²	46	43.4 Å²	43.4	25%	0.246	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	153.2	-177.8	-172.3	30.2	0	0	0	111.1	S8 V553 L554	S8-D362 PolarHBondContact OG-OD1 2.84Å; D362-V553 WeakPolarHBondContact O-CA 3.27Å; D362-L554 HydrophobicContact CB-CB 4.02Å; D362-L554 PolarHBondContact O-N 2.96Å
363	V	93.1	Very high	85.5	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	117.8	172.1	-176.4	0	0	0	0	107.1	V5 V7 S8 V352 I360 L551 S552 V553	V5-V363 HydrophobicContact CB-CG2 4.11Å; V5-V363 HydrophobicContact CG1-CG2 4.09Å; V7-V363 WeakPolarHBondContact CA-O 3.26Å; V7-V363 HydrophobicContact CG2-CG1 3.98Å; S8-V363 PolarHBondContact N-O 3.09Å; V352-V363 HydrophobicContact CB-CG2 4.25Å; V352-V363 HydrophobicContact CG2-CG1 3.93Å; V352-V363 HydrophobicContact CG2-CG2 4.13Å; I360-V363 HydrophobicContact CG2-CG2 3.69Å; V363-L551 HydrophobicContact CG1-CD1 3.6Å; V363-S552 CarbonylContact C-O 3.58Å; V363-S552 WeakPolarHBondContact CA-O 3.49Å; V363-V553 HydrophobicContact CG1-CG2 4.44Å; V363-V553 HydrophobicContact CG2-CG1 4.35Å
364	S	92.3	Very high	84.3	Confident	31 Å²	31	47.5 Å²	47.5	22%	0.217	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	139.1	-179.6	57	0	0	0	0	111	L551 S552	S364-L551 CarbonylContact O-C 3.59Å; S364-L551 WeakPolarHBondContact O-CA 3.41Å; S364-S552 PolarHBondContact N-O 3.5Å; S364-S552 PolarHBondContact O-N 2.81Å
365	F	91.9	Very high	83.4	Confident	14 Å²	14	54 Å²	54	6%	0.061	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	135.9	174.4	172.8	-90.3	0	0	0	108.6	V7 L341 I345 K347 I350 A367 R549 E550	V7-F365 HydrophobicContact CG1-CB 4.3Å; V7-F365 HydrophobicContact CG2-CB 4.42Å; L341-F365 HydrophobicContact CD2-CE2 4.38Å; I345-F365 HydrophobicContact CG2-CE2 4.26Å; I345-F365 HydrophobicContact CG2-CZ 4.39Å; K347-F365 HydrophobicContact CB-CD1 3.94Å; K347-F365 HydrophobicContact CB-CE1 4Å; K347-F365 HydrophobicContact CB-CG 4.36Å; K347-F365 HydrophobicContact CB-CZ 4.45Å; I350-F365 HydrophobicContact CD1-CB 4.3Å; I350-F365 HydrophobicContact CD1-CD2 3.67Å; I350-F365 HydrophobicContact CD1-CE2 4.34Å; I350-F365 HydrophobicContact CD1-CG 4.21Å; F365-A367 HydrophobicContact CE1-CB 4.14Å; F365-A367 HydrophobicContact CZ-CB 4.44Å; F365-R549 HydrophobicContact CE2-CB 4.03Å; F365-R549 HydrophobicContact CE2-CG 4.37Å; F365-R549 HydrophobicContact CZ-CB 4.07Å; F365-R549 HydrophobicContact CZ-CG 3.92Å; F365-E550 WeakPolarHBondContact CA-O 3.18Å
366	S	89.6	Confident	83	Confident	22 Å²	22	51.2 Å²	51.2	15%	0.154	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	139.8	173.9	72.6	0	0	0	0	110.9	R549 E550	S366-R549 CarbonylContact O-C 3.5Å; S366-R549 WeakPolarHBondContact O-CA 3.36Å; S366-E550 PolarHBondContact N-O 3.03Å; S366-E550 PolarHBondContact O-N 2.83Å
367	A	85.9	Confident	82.7	Confident	16 Å²	16	51.9 Å²	51.9	13%	0.132	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	127.8	170.2	0	0	0	0	0	108.3	F365 A548 R549	F365-A367 HydrophobicContact CE1-CB 4.14Å; F365-A367 HydrophobicContact CZ-CB 4.44Å; A367-A548 CarbonylContact C-O 3.57Å; A367-A548 WeakPolarHBondContact CA-O 3.23Å; A367-R549 HydrophobicContact CB-CG 4.24Å
368	K	83	Confident	82.4	Confident	110 Å²	110	52.4 Å²	52.4	48%	0.478	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	127.2	179.8	-64.1	170.1	-170.1	144.4	0	108.9	L370 A548 E550	K368-L370 PolarHBondContact O-N 3.29Å; K368-A548 PolarHBondContact N-O 2.8Å; K368-A548 PolarHBondContact O-N 2.79Å; K368-E550 IonicContact NZ-OE2 3.98Å; K368-E550 PolarHBondContact NZ-OE2 2.65Å
369	S	76.5	Confident	82.2	Confident	58 Å²	58	58.7 Å²	58.7	41%	0.406	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	131.1	172.2	-171.9	0	0	0	0	110.8	S371	S369-S371 VanDerWaalsContact C-N 3.34Å; S369-S371 PolarHBondContact OG-N 2.67Å; S369-S371 PolarHBondContact OG-O 3.29Å
370	L	73.4	Confident	82	Confident	120 Å²	120	60 Å²	60	63%	0.628	34%	0.344	S	S	*	.	S	Bend	trans	-82.2	-14.1	174.4	-65.6	173.3	0	0	0	112.2	K368 H546 A548	K368-L370 PolarHBondContact O-N 3.29Å; L370-H546 WeakPolarHBondContact CB-O 3.3Å; L370-H546 VanDerWaalsContact CG-O 3.31Å; L370-H546 WeakPolarHBondContact CG-O 3.44Å; L370-H546 PolarHBondContact N-O 3.09Å; L370-A548 HydrophobicContact CD1-CB 4.38Å; L370-A548 HydrophobicContact CD2-CB 3.87Å; L370-A548 HydrophobicContact CG-CB 4.08Å
371	S	68.2	Low	81.8	Confident	29 Å²	29	60 Å²	60	20%	0.203	35%	0.345	C	S	.	.			trans	-132.3	147.5	-178.4	64.9	0	0	0	0	112.5	S369 E373	S369-S371 VanDerWaalsContact C-N 3.34Å; S369-S371 PolarHBondContact OG-N 2.67Å; S369-S371 PolarHBondContact OG-O 3.29Å; S371-E373 PolarHBondContact O-N 3.4Å
372	G	67.5	Low	81.6	Confident	87 Å²	87	60.9 Å²	60.9	90%	0.897	35%	0.35	S	S	*	.	S	Bend	trans	-81.5	18.1	172.8	0	0	0	0	0	113.7	E374	G372-E374 VanDerWaalsContact C-N 3.32Å
373	E	67.4	Low	81.6	Confident	94 Å²	94	65.1 Å²	65.1	44%	0.439	37%	0.368	S	S	.	.			trans	-91.7	12.5	-175.5	-67.5	-179.3	171.3	0	0	112.5	S371 D375 T376 W377	S371-E373 PolarHBondContact O-N 3.4Å; E373-D375 PolarHBondContact O-N 3.12Å; E373-D375 VanDerWaalsContact O-N 3.17Å; E373-T376 PolarHBondContact O-N 3.43Å; E373-T376 PolarHBondContact O-OG1 2.95Å; E373-W377 PolarHBondContact O-N 2.8Å; E373-W377 VanDerWaalsContact O-N 3.14Å; E373-W377 PolarHBondContact OE2-NE1 3.49Å
374	E	68.6	Low	81.6	Confident	48 Å²	48	66 Å²	66	22%	0.224	37%	0.373	C	S	.	.	H	α-helix	trans	-57	-38.2	-173.9	-162.2	-177.7	171.8	0	0	112.8	S15 R19 G372 S378	S15-E374 VanDerWaalsContact CB-OE1 3.27Å; S15-E374 WeakPolarHBondContact CB-OE1 3.36Å; S15-E374 WeakPolarHBondContact CB-OE2 3.48Å; S15-E374 PolarHBondContact OG-OE1 3.08Å; S15-E374 PolarHBondContact OG-OE2 3.38Å; R19-E374 IonicContact CZ-OE1 3.71Å; R19-E374 IonicContact NE-OE1 2.69Å; R19-E374 VanDerWaalsContact NH2-CG 3.27Å; R19-E374 IonicContact NH2-OE1 3.72Å; R19-E374 PolarHBondContact NH2-OE1 3.02Å; G372-E374 VanDerWaalsContact C-N 3.32Å; E374-S378 WeakPolarHBondContact O-CB 3.48Å; E374-S378 PolarHBondContact O-N 3.21Å; E374-S378 PolarHBondContact O-OG 3.44Å
375	D	72.8	Confident	81.5	Confident	136 Å²	136	67.1 Å²	67.1	73%	0.727	38%	0.376	S	S	*	.	H	α-helix	trans	-67	-39.1	178.3	-70.9	-24.2	0	0	0	112.3	E373 Q379	E373-D375 PolarHBondContact O-N 3.12Å; E373-D375 VanDerWaalsContact O-N 3.17Å; D375-Q379 WeakPolarHBondContact O-CB 3.5Å; D375-Q379 PolarHBondContact O-N 2.97Å
376	T	81	Confident	81.7	Confident	73 Å²	73	70 Å²	70	45%	0.448	40%	0.395	S	S	.	.	H	α-helix	trans	-69.4	-43.2	-178.9	57.8	0	0	0	0	110.3	E373 Q379 C380	E373-T376 PolarHBondContact O-N 3.43Å; E373-T376 PolarHBondContact O-OG1 2.95Å; T376-Q379 PolarHBondContact O-N 2.96Å; T376-C380 PolarHBondContact O-N 2.87Å; T376-C380 PolarHBondContact O-SG 3.46Å
377	W	79.4	Confident	81.9	Confident	50 Å²	50	71.9 Å²	71.9	19%	0.189	40%	0.401	C	S	.	.	H	α-helix	trans	-65.5	-41.6	177.3	-59.9	119.2	0	0	0	112.4	E373 Q379 C380 V381 I539 K542 Q543	E373-W377 PolarHBondContact O-N 2.8Å; E373-W377 VanDerWaalsContact O-N 3.14Å; E373-W377 PolarHBondContact OE2-NE1 3.49Å; W377-Q379 VanDerWaalsContact C-N 3.32Å; W377-Q379 PolarHBondContact O-N 2.87Å; W377-C380 PolarHBondContact O-N 3.46Å; W377-V381 WeakPolarHBondContact O-CG2 3.37Å; W377-V381 PolarHBondContact O-N 2.93Å; W377-I539 HydrophobicContact CB-CG2 4.4Å; W377-I539 HydrophobicContact CD2-CG2 4.44Å; W377-I539 HydrophobicContact CE3-CG2 3.63Å; W377-I539 HydrophobicContact CZ3-CG2 4.3Å; W377-K542 HydrophobicContact CH2-CD 4.22Å; W377-K542 HydrophobicContact CZ3-CD 4.41Å; W377-Q543 VanDerWaalsContact CB-CD 3.46Å; W377-Q543 HydrophobicContact CB-CG 3.46Å; W377-Q543 VanDerWaalsContact CB-CG 3.46Å; W377-Q543 HydrophobicContact CD2-CG 4.27Å; W377-Q543 HydrophobicContact CG-CG 3.64Å
378	S	81.2	Confident	82.2	Confident	39 Å²	39	71.8 Å²	71.8	27%	0.273	40%	0.398	S	S	.	.	H	α-helix	trans	-62.7	-39	176.1	-61.1	0	0	0	0	111.9	E374 N382	E374-S378 WeakPolarHBondContact O-CB 3.48Å; E374-S378 PolarHBondContact O-N 3.21Å; E374-S378 PolarHBondContact O-OG 3.44Å; S378-N382 WeakPolarHBondContact O-CB 3.4Å; S378-N382 VanDerWaalsContact O-CG 3.31Å; S378-N382 PolarHBondContact O-N 3.02Å; S378-N382 PolarHBondContact O-ND2 2.85Å
379	Q	85.6	Confident	82.7	Confident	136 Å²	136	73.5 Å²	73.5	64%	0.636	40%	0.402	S	S	*	.	H	α-helix	trans	-64.7	-47.2	175.7	-173.4	172.6	10.4	0	0	111.6	D375 T376 W377 V381 N382 E383	D375-Q379 WeakPolarHBondContact O-CB 3.5Å; D375-Q379 PolarHBondContact O-N 2.97Å; T376-Q379 PolarHBondContact O-N 2.96Å; W377-Q379 VanDerWaalsContact C-N 3.32Å; W377-Q379 PolarHBondContact O-N 2.87Å; Q379-V381 PolarHBondContact O-N 3.37Å; Q379-N382 PolarHBondContact O-N 3.15Å; Q379-E383 PolarHBondContact O-N 2.92Å
380	C	87.9	Confident	83.6	Confident	53 Å²	53	76.5 Å²	76.5	36%	0.358	41%	0.409	S	S	.	.	H	α-helix	trans	-60.1	-46	177.4	-68.5	0	0	0	0	112.2	T376 W377 N382 E383 L384 I539	T376-C380 PolarHBondContact O-N 2.87Å; T376-C380 PolarHBondContact O-SG 3.46Å; W377-C380 PolarHBondContact O-N 3.46Å; C380-N382 VanDerWaalsContact C-N 3.34Å; C380-N382 PolarHBondContact O-N 3.08Å; C380-E383 PolarHBondContact O-N 3.11Å; C380-L384 WeakPolarHBondContact O-CG 3.29Å; C380-L384 PolarHBondContact O-N 3.4Å; C380-I539 HydrophobicContact CB-CD1 3.98Å
381	V	87.7	Confident	84.7	Confident	15 Å²	15	71.7 Å²	71.7	9%	0.091	39%	0.385	C	S	.	.	H	α-helix	trans	-61	-43.9	177.4	171.4	0	0	0	0	110.9	W377 Q379 E383 L384 L385 V536 I539	W377-V381 WeakPolarHBondContact O-CG2 3.37Å; W377-V381 PolarHBondContact O-N 2.93Å; Q379-V381 PolarHBondContact O-N 3.37Å; V381-E383 VanDerWaalsContact C-N 3.34Å; V381-E383 PolarHBondContact O-N 3.06Å; V381-L384 PolarHBondContact O-N 3.35Å; V381-L385 HydrophobicContact CG1-CD1 3.79Å; V381-L385 HydrophobicContact CG1-CG 4.16Å; V381-L385 WeakPolarHBondContact O-CB 3.48Å; V381-L385 VanDerWaalsContact O-CG 3.24Å; V381-L385 WeakPolarHBondContact O-CG 3.3Å; V381-L385 PolarHBondContact O-N 3.33Å; V381-V536 HydrophobicContact CG1-CG1 4.4Å; V381-I539 HydrophobicContact CG2-CB 4.19Å; V381-I539 HydrophobicContact CG2-CG2 3.55Å
382	N	88.9	Confident	86	Confident	102 Å²	102	74.2 Å²	74.2	55%	0.545	39%	0.391	S	S	.	.	H	α-helix	trans	-61.7	-40.8	177.7	-79.4	-48.5	0	0	0	112.6	S378 Q379 C380 L385 V386	S378-N382 WeakPolarHBondContact O-CB 3.4Å; S378-N382 VanDerWaalsContact O-CG 3.31Å; S378-N382 PolarHBondContact O-N 3.02Å; S378-N382 PolarHBondContact O-ND2 2.85Å; Q379-N382 PolarHBondContact O-N 3.15Å; C380-N382 VanDerWaalsContact C-N 3.34Å; C380-N382 PolarHBondContact O-N 3.08Å; N382-L385 PolarHBondContact O-N 2.86Å; N382-V386 VanDerWaalsContact O-CG2 3.31Å; N382-V386 WeakPolarHBondContact O-CG2 3.31Å; N382-V386 PolarHBondContact O-N 3.32Å
383	E	92.2	Very high	87.3	Confident	134 Å²	134	77.5 Å²	77.5	63%	0.626	38%	0.376	S	S	*	.	H	α-helix	trans	-63.1	-48.3	176.9	-173.7	168	-168.6	0	0	111.6	Q379 C380 V381 L385 V386 E387	Q379-E383 PolarHBondContact O-N 2.92Å; C380-E383 PolarHBondContact O-N 3.11Å; V381-E383 VanDerWaalsContact C-N 3.34Å; V381-E383 PolarHBondContact O-N 3.06Å; E383-L385 VanDerWaalsContact C-N 3.35Å; E383-L385 PolarHBondContact O-N 2.73Å; E383-V386 WeakPolarHBondContact O-CB 3.45Å; E383-V386 PolarHBondContact O-N 3.23Å; E383-V386 VanDerWaalsContact O-N 3.16Å; E383-E387 PolarHBondContact O-N 3.08Å
384	L	92.7	Very high	88.6	Confident	20 Å²	20	79.1 Å²	79.1	11%	0.105	38%	0.378	C	S	.	.	H	α-helix	trans	-62.3	-39.5	176.4	-67.8	176.2	0	0	0	112.5	C380 V381 V386 E387 L388 L532 E535 V536 I539	C380-L384 WeakPolarHBondContact O-CG 3.29Å; C380-L384 PolarHBondContact O-N 3.4Å; V381-L384 PolarHBondContact O-N 3.35Å; L384-V386 VanDerWaalsContact C-N 3.31Å; L384-V386 PolarHBondContact O-N 2.87Å; L384-E387 PolarHBondContact O-N 2.98Å; L384-L388 VanDerWaalsContact O-CB 3.3Å; L384-L388 WeakPolarHBondContact O-CB 3.36Å; L384-L388 PolarHBondContact O-N 2.98Å; L384-L532 HydrophobicContact CD2-CD2 3.62Å; L384-E535 HydrophobicContact CD1-CB 3.86Å; L384-E535 HydrophobicContact CD2-CB 4.46Å; L384-E535 WeakPolarHBondContact CD2-OE2 3.48Å; L384-V536 HydrophobicContact CB-CG2 3.55Å; L384-V536 HydrophobicContact CD1-CG2 3.93Å; L384-V536 HydrophobicContact CG-CG2 4.41Å; L384-I539 HydrophobicContact CD1-CD1 3.59Å
385	L	91	Very high	89.9	Confident	53 Å²	53	77.3 Å²	77.3	28%	0.277	37%	0.372	S	S	.	.	H	α-helix	trans	-66.5	-32.8	176.5	-73.7	176.7	0	0	0	112.4	V381 N382 E383 L388 R389 V536	V381-L385 HydrophobicContact CG1-CD1 3.79Å; V381-L385 HydrophobicContact CG1-CG 4.16Å; V381-L385 WeakPolarHBondContact O-CB 3.48Å; V381-L385 VanDerWaalsContact O-CG 3.24Å; V381-L385 WeakPolarHBondContact O-CG 3.3Å; V381-L385 PolarHBondContact O-N 3.33Å; N382-L385 PolarHBondContact O-N 2.86Å; E383-L385 VanDerWaalsContact C-N 3.35Å; E383-L385 PolarHBondContact O-N 2.73Å; L385-L388 HydrophobicContact CD2-CD2 4.27Å; L385-R389 WeakPolarHBondContact O-CB 3.22Å; L385-R389 PolarHBondContact O-N 2.9Å; L385-R389 VanDerWaalsContact O-N 3.08Å; L385-V536 HydrophobicContact CD2-CG1 4.49Å; L385-V536 HydrophobicContact CD2-CG2 4.4Å
386	V	94.4	Very high	90.9	Very high	74 Å²	74	75.6 Å²	75.6	45%	0.448	36%	0.362	S	S	.	.	H	α-helix	trans	-67.2	-44.9	172.4	169.1	0	0	0	0	110.3	N382 E383 L384 R389 Q390	N382-V386 VanDerWaalsContact O-CG2 3.31Å; N382-V386 WeakPolarHBondContact O-CG2 3.31Å; N382-V386 PolarHBondContact O-N 3.32Å; E383-V386 WeakPolarHBondContact O-CB 3.45Å; E383-V386 PolarHBondContact O-N 3.23Å; E383-V386 VanDerWaalsContact O-N 3.16Å; L384-V386 VanDerWaalsContact C-N 3.31Å; L384-V386 PolarHBondContact O-N 2.87Å; V386-R389 PolarHBondContact O-N 2.83Å; V386-Q390 WeakPolarHBondContact O-CG 3.4Å; V386-Q390 PolarHBondContact O-N 3.3Å; V386-Q390 VanDerWaalsContact O-N 3.09Å
387	E	94.3	Very high	91.6	Very high	62 Å²	62	77.4 Å²	77.4	29%	0.29	37%	0.369	S	S	.	.	H	α-helix	trans	-62.8	-46.3	176.4	-163	-175.1	153.1	0	0	111.4	E383 L384 R389 Q390 C391 R528 L532	E383-E387 PolarHBondContact O-N 3.08Å; L384-E387 PolarHBondContact O-N 2.98Å; E387-R389 VanDerWaalsContact C-N 3.26Å; E387-R389 PolarHBondContact O-N 3.28Å; E387-Q390 WeakPolarHBondContact O-CA 3.29Å; E387-Q390 WeakPolarHBondContact O-CB 3.33Å; E387-Q390 PolarHBondContact O-N 2.8Å; E387-C391 PolarHBondContact O-N 2.76Å; E387-R528 VanDerWaalsContact CD-NH2 3.29Å; E387-R528 IonicContact OE1-CZ 3.33Å; E387-R528 IonicContact OE1-NE 2.76Å; E387-R528 PolarHBondContact OE1-NE 2.9Å; E387-R528 IonicContact OE1-NH2 2.86Å; E387-R528 PolarHBondContact OE1-NH2 3.19Å; E387-R528 IonicContact OE2-NH2 3.24Å; E387-R528 PolarHBondContact OE2-NH2 2.9Å; E387-R528 VanDerWaalsContact OE2-NH2 3.09Å; E387-L532 HydrophobicContact CB-CD1 4.04Å; E387-L532 HydrophobicContact CB-CD2 4.22Å; E387-L532 HydrophobicContact CG-CD1 3.77Å; E387-L532 HydrophobicContact CG-CD2 4.29Å
388	L	93	Very high	92.4	Very high	14 Å²	14	75.3 Å²	75.3	7%	0.073	36%	0.362	C	S	.	.	H	α-helix	trans	-55.6	-42.8	176.7	-180	63.3	0	0	0	111.3	L384 L385 Q390 C391 R392 I529 L532 E533	L384-L388 VanDerWaalsContact O-CB 3.3Å; L384-L388 WeakPolarHBondContact O-CB 3.36Å; L384-L388 PolarHBondContact O-N 2.98Å; L385-L388 HydrophobicContact CD2-CD2 4.27Å; L388-Q390 VanDerWaalsContact C-N 3.34Å; L388-Q390 PolarHBondContact O-N 2.85Å; L388-C391 PolarHBondContact O-N 2.78Å; L388-R392 WeakPolarHBondContact O-CB 3.37Å; L388-R392 VanDerWaalsContact O-CG 3.32Å; L388-R392 WeakPolarHBondContact O-CG 3.4Å; L388-R392 PolarHBondContact O-N 3.25Å; L388-I529 HydrophobicContact CD1-CB 4.32Å; L388-I529 HydrophobicContact CD1-CG1 4.39Å; L388-I529 HydrophobicContact CD1-CG2 3.85Å; L388-L532 HydrophobicContact CB-CB 4.48Å; L388-L532 HydrophobicContact CB-CD1 4.39Å; L388-L532 HydrophobicContact CD1-CB 4.18Å; L388-E533 HydrophobicContact CD1-CG 3.77Å; L388-E533 HydrophobicContact CD2-CG 3.98Å
389	R	93.9	Very high	93	Very high	147 Å²	147	76 Å²	76	56%	0.555	36%	0.364	S	S	*	.	H	α-helix	trans	-64.6	-37.1	176.1	-171.3	-176.2	-61.7	167.8	2	112.3	L385 V386 E387 R393	L385-R389 WeakPolarHBondContact O-CB 3.22Å; L385-R389 PolarHBondContact O-N 2.9Å; L385-R389 VanDerWaalsContact O-N 3.08Å; V386-R389 PolarHBondContact O-N 2.83Å; E387-R389 VanDerWaalsContact C-N 3.26Å; E387-R389 PolarHBondContact O-N 3.28Å; R389-R393 WeakPolarHBondContact O-CG 3.43Å; R389-R393 PolarHBondContact O-N 2.76Å
390	Q	95.3	Very high	93.4	Very high	120 Å²	120	73.9 Å²	73.9	56%	0.561	36%	0.357	S	S	*	.	H	α-helix	trans	-69.1	-45.5	176.4	-68.7	177.4	19	0	0	111.4	V386 E387 L388 R393 R394	V386-Q390 WeakPolarHBondContact O-CG 3.4Å; V386-Q390 PolarHBondContact O-N 3.3Å; V386-Q390 VanDerWaalsContact O-N 3.09Å; E387-Q390 WeakPolarHBondContact O-CA 3.29Å; E387-Q390 WeakPolarHBondContact O-CB 3.33Å; E387-Q390 PolarHBondContact O-N 2.8Å; L388-Q390 VanDerWaalsContact C-N 3.34Å; L388-Q390 PolarHBondContact O-N 2.85Å; Q390-R393 PolarHBondContact O-N 2.87Å; Q390-R394 PolarHBondContact O-N 3.34Å
391	C	95	Very high	93.7	Very high	19 Å²	19	75.6 Å²	75.6	13%	0.128	36%	0.356	C	S	.	.	H	α-helix	trans	-60.7	-45.5	176.5	-69.4	0	0	0	0	111.7	E387 L388 R393 R394 A395 V525 I529	E387-C391 PolarHBondContact O-N 2.76Å; L388-C391 PolarHBondContact O-N 2.78Å; C391-R393 PolarHBondContact O-N 3.11Å; C391-R394 WeakPolarHBondContact O-CB 3.49Å; C391-R394 PolarHBondContact O-N 2.86Å; C391-A395 PolarHBondContact O-N 3.19Å; C391-V525 HydrophobicContact CB-CG1 4.18Å; C391-V525 WeakPolarHBondContact O-CG1 3.47Å; C391-I529 HydrophobicContact CB-CD1 4.34Å; C391-I529 HydrophobicContact CB-CG1 3.67Å
392	R	95.1	Very high	94	Very high	83 Å²	83	75.8 Å²	75.8	31%	0.313	36%	0.356	S	S	.	.	H	α-helix	trans	-57.6	-46	174.8	-74.8	177.3	177	-171.8	0.3	112.3	L388 R394 A395 D396 I529 E533	L388-R392 WeakPolarHBondContact O-CB 3.37Å; L388-R392 VanDerWaalsContact O-CG 3.32Å; L388-R392 WeakPolarHBondContact O-CG 3.4Å; L388-R392 PolarHBondContact O-N 3.25Å; R392-R394 VanDerWaalsContact C-N 3.3Å; R392-R394 PolarHBondContact O-N 2.69Å; R392-A395 WeakPolarHBondContact O-CB 3.46Å; R392-A395 PolarHBondContact O-N 2.83Å; R392-D396 PolarHBondContact O-N 3.43Å; R392-I529 HydrophobicContact CG-CD1 3.95Å; R392-I529 HydrophobicContact CG-CG1 4.3Å; R392-E533 IonicContact CZ-OE1 2.67Å; R392-E533 IonicContact NE-OE1 3.29Å; R392-E533 IonicContact NH2-OE1 3.38Å; R392-E533 PolarHBondContact NH2-OE1 2.84Å
393	R	95.5	Very high	94.1	Very high	155 Å²	155	74.1 Å²	74.1	59%	0.585	35%	0.347	S	S	*	.	H	α-helix	trans	-61.3	-36.7	174.5	-74.6	176.6	-178.9	174.8	0.5	112.7	R389 Q390 C391 N397	R389-R393 WeakPolarHBondContact O-CG 3.43Å; R389-R393 PolarHBondContact O-N 2.76Å; Q390-R393 PolarHBondContact O-N 2.87Å; C391-R393 PolarHBondContact O-N 3.11Å; R393-N397 PolarHBondContact O-N 3.15Å; R393-N397 VanDerWaalsContact O-N 3.12Å; R393-N397 PolarHBondContact O-ND2 3.46Å
394	R	95.7	Very high	94.1	Very high	128 Å²	128	75.2 Å²	75.2	48%	0.483	35%	0.345	S	S	.	.	H	α-helix	trans	-66.1	-44.8	176.2	-172.3	175.4	179.7	172.5	-1	110.9	Q390 C391 R392 D396 N397 L398 E521 V525	Q390-R394 PolarHBondContact O-N 3.34Å; C391-R394 WeakPolarHBondContact O-CB 3.49Å; C391-R394 PolarHBondContact O-N 2.86Å; R392-R394 VanDerWaalsContact C-N 3.3Å; R392-R394 PolarHBondContact O-N 2.69Å; R394-D396 VanDerWaalsContact C-N 3.35Å; R394-D396 PolarHBondContact O-N 3.25Å; R394-N397 PolarHBondContact O-N 3Å; R394-N397 VanDerWaalsContact O-N 3.16Å; R394-L398 HydrophobicContact CG-CD1 4.12Å; R394-L398 WeakPolarHBondContact O-CG 3.42Å; R394-L398 PolarHBondContact O-N 2.95Å; R394-E521 IonicContact CZ-OE1 2.78Å; R394-E521 VanDerWaalsContact CZ-OE1 3.29Å; R394-E521 IonicContact NE-OE1 3.09Å; R394-E521 PolarHBondContact NE-OE1 2.84Å; R394-E521 IonicContact NH2-OE1 2.65Å; R394-E521 PolarHBondContact NH2-OE1 3.04Å; R394-V525 HydrophobicContact CB-CG1 4.31Å; R394-V525 HydrophobicContact CG-CG2 4.02Å
395	A	94.9	Very high	94.1	Very high	11 Å²	11	74.6 Å²	74.6	9%	0.091	34%	0.342	C	S	.	.	H	α-helix	trans	-56.8	-47	174.6	0	0	0	0	0	111.6	C391 R392 N397 L398 V399 L522 V525 I529	C391-A395 PolarHBondContact O-N 3.19Å; R392-A395 WeakPolarHBondContact O-CB 3.46Å; R392-A395 PolarHBondContact O-N 2.83Å; A395-N397 VanDerWaalsContact C-N 3.3Å; A395-N397 PolarHBondContact O-N 2.98Å; A395-L398 PolarHBondContact O-N 3.33Å; A395-L398 VanDerWaalsContact O-N 3.14Å; A395-V399 WeakPolarHBondContact O-CG2 3.21Å; A395-V399 PolarHBondContact O-N 3.47Å; A395-L522 HydrophobicContact CB-CD1 3.85Å; A395-V525 HydrophobicContact CB-CG1 3.97Å; A395-I529 HydrophobicContact CB-CD1 4.15Å
396	D	94.1	Very high	94.1	Very high	99 Å²	99	76.8 Å²	76.8	53%	0.529	35%	0.351	S	S	.	.	H	α-helix	trans	-58	-41.9	176.3	-68.5	-26.3	0	0	0	112.2	R392 R394 N400	R392-D396 PolarHBondContact O-N 3.43Å; R394-D396 VanDerWaalsContact C-N 3.35Å; R394-D396 PolarHBondContact O-N 3.25Å; D396-N400 WeakPolarHBondContact O-CB 3.39Å; D396-N400 PolarHBondContact O-N 2.92Å; D396-N400 PolarHBondContact O-ND2 3.42Å
397	N	95.4	Very high	93.9	Very high	111 Å²	111	80 Å²	80	59%	0.594	36%	0.359	S	S	*	.	H	α-helix	trans	-66.5	-38.5	177.8	-73	-40.5	0	0	0	112.4	R393 R394 A395 N400 R401	R393-N397 PolarHBondContact O-N 3.15Å; R393-N397 VanDerWaalsContact O-N 3.12Å; R393-N397 PolarHBondContact O-ND2 3.46Å; R394-N397 PolarHBondContact O-N 3Å; R394-N397 VanDerWaalsContact O-N 3.16Å; A395-N397 VanDerWaalsContact C-N 3.3Å; A395-N397 PolarHBondContact O-N 2.98Å; N397-N400 PolarHBondContact O-N 3.33Å; N397-R401 PolarHBondContact O-N 2.95Å
398	L	95.8	Very high	93.7	Very high	6 Å²	6	81.4 Å²	81.4	3%	0.031	37%	0.365	C	S	.	.	H	α-helix	trans	-68.8	-44.6	178.3	-68.2	168.6	0	0	0	111.6	R394 A395 N400 R401 I402 T518 E521 L522 V525	R394-L398 HydrophobicContact CG-CD1 4.12Å; R394-L398 WeakPolarHBondContact O-CG 3.42Å; R394-L398 PolarHBondContact O-N 2.95Å; A395-L398 PolarHBondContact O-N 3.33Å; A395-L398 VanDerWaalsContact O-N 3.14Å; L398-N400 VanDerWaalsContact C-N 3.3Å; L398-N400 PolarHBondContact O-N 3.13Å; L398-R401 CarbonylContact O-C 3.52Å; L398-R401 WeakPolarHBondContact O-CA 3.32Å; L398-R401 WeakPolarHBondContact O-CB 3.1Å; L398-R401 PolarHBondContact O-N 3.39Å; L398-I402 WeakPolarHBondContact O-CG1 3.47Å; L398-I402 PolarHBondContact O-N 3.04Å; L398-T518 HydrophobicContact CB-CG2 4.2Å; L398-T518 HydrophobicContact CD2-CG2 3.86Å; L398-E521 HydrophobicContact CD1-CB 4.08Å; L398-E521 HydrophobicContact CD1-CG 3.75Å; L398-E521 HydrophobicContact CD2-CB 4.23Å; L398-E521 HydrophobicContact CD2-CG 4.05Å; L398-E521 VanDerWaalsContact CD2-OE2 3.24Å; L398-E521 WeakPolarHBondContact CD2-OE2 3.28Å; L398-L522 HydrophobicContact CB-CB 4.22Å; L398-L522 HydrophobicContact CB-CD1 4.22Å; L398-L522 HydrophobicContact CD1-CB 4.3Å; L398-V525 HydrophobicContact CD1-CG2 4.09Å
399	V	94.7	Very high	93.6	Very high	53 Å²	53	84.4 Å²	84.4	32%	0.321	38%	0.376	S	S	.	.	H	α-helix	trans	-56.6	-46.2	173.1	171.2	0	0	0	0	110.7	A395 R401 I402 I403 L522	A395-V399 WeakPolarHBondContact O-CG2 3.21Å; A395-V399 PolarHBondContact O-N 3.47Å; V399-R401 PolarHBondContact O-N 3.11Å; V399-I402 PolarHBondContact O-N 2.91Å; V399-I403 HydrophobicContact CG1-CD1 3.84Å; V399-I403 WeakPolarHBondContact O-CG1 3.39Å; V399-I403 PolarHBondContact O-N 2.68Å; V399-L522 HydrophobicContact CG2-CD1 3.92Å; V399-L522 HydrophobicContact CG2-CD2 3.76Å
400	N	93.9	Very high	93.1	Very high	92 Å²	92	80.5 Å²	80.5	49%	0.492	37%	0.37	S	S	.	.	H	α-helix	trans	-63.6	-28	175.6	-76.5	-55	0	0	0	113.4	D396 N397 L398 R404	D396-N400 WeakPolarHBondContact O-CB 3.39Å; D396-N400 PolarHBondContact O-N 2.92Å; D396-N400 PolarHBondContact O-ND2 3.42Å; N397-N400 PolarHBondContact O-N 3.33Å; L398-N400 VanDerWaalsContact C-N 3.3Å; L398-N400 PolarHBondContact O-N 3.13Å; N400-R404 WeakPolarHBondContact O-CB 3.37Å; N400-R404 PolarHBondContact O-N 2.99Å
401	R	94.7	Very high	92.7	Very high	90 Å²	90	79.6 Å²	79.6	34%	0.34	37%	0.373	S	S	.	.	H	α-helix	trans	-72.3	-47.3	173.9	-171.6	170.9	86.2	-163.7	-0.6	110.6	N397 L398 V399 I403 R404 T405 T518 E521	N397-R401 PolarHBondContact O-N 2.95Å; L398-R401 CarbonylContact O-C 3.52Å; L398-R401 WeakPolarHBondContact O-CA 3.32Å; L398-R401 WeakPolarHBondContact O-CB 3.1Å; L398-R401 PolarHBondContact O-N 3.39Å; V399-R401 PolarHBondContact O-N 3.11Å; R401-I403 PolarHBondContact O-N 3.24Å; R401-R404 PolarHBondContact O-N 2.8Å; R401-R404 VanDerWaalsContact O-N 3.11Å; R401-T405 PolarHBondContact O-N 2.81Å; R401-T405 PolarHBondContact O-OG1 3.15Å; R401-T405 VanDerWaalsContact O-OG1 3.04Å; R401-T518 HydrophobicContact CB-CG2 4.07Å; R401-T518 HydrophobicContact CG-CG2 4.22Å; R401-T518 VanDerWaalsContact NE-CG2 3.26Å; R401-T518 PolarHBondContact NE-OG1 3.33Å; R401-T518 VanDerWaalsContact NH2-CA 3.32Å; R401-T518 VanDerWaalsContact NH2-CB 3.34Å; R401-T518 PolarHBondContact NH2-OG1 3.34Å; R401-E521 IonicContact CZ-OE2 2.81Å; R401-E521 IonicContact NH1-OE2 3.23Å; R401-E521 IonicContact NH2-OE2 3.7Å; R401-E521 PolarHBondContact NH2-OE2 2.83Å
402	I	93.8	Very high	92.3	Very high	19 Å²	19	80.1 Å²	80.1	10%	0.097	37%	0.374	C	S	.	.	H	α-helix	trans	-53.6	-54.8	174.9	-66.1	171.3	0	0	0	109.9	L398 V399 R404 T405 E406 L515 T518 L522	L398-I402 WeakPolarHBondContact O-CG1 3.47Å; L398-I402 PolarHBondContact O-N 3.04Å; V399-I402 PolarHBondContact O-N 2.91Å; I402-R404 PolarHBondContact O-N 2.92Å; I402-R404 VanDerWaalsContact O-N 3.15Å; I402-T405 PolarHBondContact O-N 3.3Å; I402-E406 HydrophobicContact CG2-CG 4.09Å; I402-E406 WeakPolarHBondContact CG2-OE1 3.28Å; I402-E406 WeakPolarHBondContact O-CG 3.39Å; I402-E406 PolarHBondContact O-N 3.26Å; I402-L515 HydrophobicContact CG2-CD2 4.13Å; I402-T518 HydrophobicContact CD1-CG2 4.11Å; I402-T518 HydrophobicContact CG1-CG2 3.48Å; I402-T518 VanDerWaalsContact CG1-CG2 3.48Å; I402-L522 HydrophobicContact CD1-CD2 3.79Å
403	I	91.2	Very high	91.7	Very high	67 Å²	67	79.5 Å²	79.5	34%	0.344	38%	0.375	S	S	.	.	H	α-helix	trans	-56.9	-37	179.7	-66.5	167.2	0	0	0	111.9	V399 R401 K407	V399-I403 HydrophobicContact CG1-CD1 3.84Å; V399-I403 WeakPolarHBondContact O-CG1 3.39Å; V399-I403 PolarHBondContact O-N 2.68Å; R401-I403 PolarHBondContact O-N 3.24Å; I403-K407 HydrophobicContact CG2-CD 4.4Å; I403-K407 WeakPolarHBondContact O-CD 3.43Å; I403-K407 VanDerWaalsContact O-CG 3.25Å; I403-K407 WeakPolarHBondContact O-CG 3.3Å; I403-K407 PolarHBondContact O-N 2.93Å
404	R	91.9	Very high	91	Very high	157 Å²	157	75.8 Å²	75.8	59%	0.592	37%	0.37	S	S	*	.	H	α-helix	trans	-70.2	-45.3	177.5	-177.4	-177.6	-76.9	105	-4.7	111	N400 R401 I402 K407 Q408	N400-R404 WeakPolarHBondContact O-CB 3.37Å; N400-R404 PolarHBondContact O-N 2.99Å; R401-R404 PolarHBondContact O-N 2.8Å; R401-R404 VanDerWaalsContact O-N 3.11Å; I402-R404 PolarHBondContact O-N 2.92Å; I402-R404 VanDerWaalsContact O-N 3.15Å; R404-K407 PolarHBondContact O-N 2.77Å; R404-Q408 WeakPolarHBondContact O-CG 3.48Å; R404-Q408 PolarHBondContact O-N 2.84Å; R404-Q408 VanDerWaalsContact O-N 3.15Å
405	T	91.7	Very high	90.3	Very high	7 Å²	7	74.3 Å²	74.3	4%	0.043	37%	0.367	C	S	.	.	H	α-helix	trans	-67.7	-42.8	-178.6	-54.3	0	0	0	0	111.5	R401 I402 K407 Q408 R409 F511 V514 L515	R401-T405 PolarHBondContact O-N 2.81Å; R401-T405 PolarHBondContact O-OG1 3.15Å; R401-T405 VanDerWaalsContact O-OG1 3.04Å; I402-T405 PolarHBondContact O-N 3.3Å; T405-K407 VanDerWaalsContact C-N 3.28Å; T405-K407 PolarHBondContact O-N 2.88Å; T405-Q408 WeakPolarHBondContact O-CB 3.28Å; T405-Q408 PolarHBondContact O-N 2.92Å; T405-R409 PolarHBondContact O-N 3.1Å; T405-F511 HydrophobicContact CG2-CB 4.19Å; T405-F511 HydrophobicContact CG2-CD1 3.76Å; T405-F511 HydrophobicContact CG2-CG 4.35Å; T405-V514 HydrophobicContact CG2-CB 4.29Å; T405-V514 HydrophobicContact CG2-CG1 4Å; T405-L515 HydrophobicContact CG2-CD1 4.44Å; T405-L515 HydrophobicContact CG2-CD2 3.83Å; T405-L515 HydrophobicContact CG2-CG 3.72Å
406	E	91.7	Very high	89.5	Confident	99 Å²	99	74.4 Å²	74.4	46%	0.463	37%	0.367	S	S	.	.	H	α-helix	trans	-57.3	-41.9	174.4	-72.5	174.6	160.4	0	0	111.5	I402 Q408 R409 C410 L515	I402-E406 HydrophobicContact CG2-CG 4.09Å; I402-E406 WeakPolarHBondContact CG2-OE1 3.28Å; I402-E406 WeakPolarHBondContact O-CG 3.39Å; I402-E406 PolarHBondContact O-N 3.26Å; E406-Q408 VanDerWaalsContact C-N 3.34Å; E406-Q408 PolarHBondContact O-N 2.88Å; E406-R409 PolarHBondContact O-N 2.98Å; E406-C410 VanDerWaalsContact O-CB 3.28Å; E406-C410 WeakPolarHBondContact O-CB 3.5Å; E406-C410 PolarHBondContact O-N 2.81Å; E406-L515 HydrophobicContact CG-CD1 4.31Å; E406-L515 HydrophobicContact CG-CD2 3.65Å
407	K	90	Very high	88.6	Confident	140 Å²	140	74.1 Å²	74.1	61%	0.609	37%	0.366	S	S	*	.	H	α-helix	trans	-63	-39	174.5	-75	173.8	-177.6	179.1	0	112.4	I403 R404 T405 V411	I403-K407 HydrophobicContact CG2-CD 4.4Å; I403-K407 WeakPolarHBondContact O-CD 3.43Å; I403-K407 VanDerWaalsContact O-CG 3.25Å; I403-K407 WeakPolarHBondContact O-CG 3.3Å; I403-K407 PolarHBondContact O-N 2.93Å; R404-K407 PolarHBondContact O-N 2.77Å; T405-K407 VanDerWaalsContact C-N 3.28Å; T405-K407 PolarHBondContact O-N 2.88Å; K407-V411 VanDerWaalsContact O-CG2 3.26Å; K407-V411 WeakPolarHBondContact O-CG2 3.46Å; K407-V411 PolarHBondContact O-N 2.78Å; K407-V411 VanDerWaalsContact O-N 3.08Å
408	Q	91.1	Very high	87.6	Confident	92 Å²	92	71.2 Å²	71.2	43%	0.43	36%	0.355	S	S	.	.	H	α-helix	trans	-68.6	-41.8	177.2	-67.1	177.1	-70.5	0	0	111.6	R404 T405 E406 V411 L412 F511	R404-Q408 WeakPolarHBondContact O-CG 3.48Å; R404-Q408 PolarHBondContact O-N 2.84Å; R404-Q408 VanDerWaalsContact O-N 3.15Å; T405-Q408 WeakPolarHBondContact O-CB 3.28Å; T405-Q408 PolarHBondContact O-N 2.92Å; E406-Q408 VanDerWaalsContact C-N 3.34Å; E406-Q408 PolarHBondContact O-N 2.88Å; Q408-V411 PolarHBondContact O-N 3.16Å; Q408-L412 PolarHBondContact O-N 2.93Å; Q408-F511 HydrophobicContact CB-CD1 4.38Å; Q408-F511 HydrophobicContact CB-CE1 3.71Å; Q408-F511 HydrophobicContact CB-CE2 4.05Å; Q408-F511 HydrophobicContact CB-CZ 3.55Å; Q408-F511 HydrophobicContact CG-CE1 4.48Å; Q408-F511 HydrophobicContact CG-CZ 4.45Å
409	R	89.3	Confident	86.4	Confident	78 Å²	78	72.3 Å²	72.3	29%	0.294	36%	0.36	S	S	.	.	H	α-helix	trans	-60.1	-47.6	173.5	177.5	-110.3	178.8	73.3	17.4	111.8	T405 E406 V411 L412 E413 F511 D512	T405-R409 PolarHBondContact O-N 3.1Å; E406-R409 PolarHBondContact O-N 2.98Å; R409-V411 VanDerWaalsContact C-N 3.34Å; R409-V411 PolarHBondContact O-N 2.94Å; R409-L412 WeakPolarHBondContact O-CB 3.1Å; R409-L412 PolarHBondContact O-N 2.85Å; R409-L412 VanDerWaalsContact O-N 3.11Å; R409-E413 IonicContact CZ-OE1 2.69Å; R409-E413 VanDerWaalsContact CZ-OE1 3.23Å; R409-E413 IonicContact NE-OE1 3.8Å; R409-E413 PolarHBondContact NE-OE1 2.81Å; R409-E413 IonicContact NE-OE2 3.29Å; R409-E413 PolarHBondContact NE-OE2 3.45Å; R409-E413 IonicContact NH2-OE1 3.65Å; R409-E413 PolarHBondContact NH2-OE1 3.25Å; R409-E413 PolarHBondContact O-N 2.97Å; R409-F511 HydrophobicContact CB-CB 4.19Å; R409-F511 HydrophobicContact CB-CD2 4.36Å; R409-F511 HydrophobicContact CB-CG 4.44Å; R409-D512 IonicContact CZ-OD1 2.79Å; R409-D512 IonicContact NH1-OD1 2.72Å; R409-D512 PolarHBondContact NH1-OD1 3.03Å; R409-D512 IonicContact NH2-OD1 3.98Å
410	C	84.8	Confident	85.1	Confident	65 Å²	65	72.9 Å²	72.9	44%	0.439	37%	0.367	S	S	.	.	H	α-helix	trans	-60.3	-41	176.8	176.6	0	0	0	0	112.5	E406 L412 E413 T414	E406-C410 VanDerWaalsContact O-CB 3.28Å; E406-C410 WeakPolarHBondContact O-CB 3.5Å; E406-C410 PolarHBondContact O-N 2.81Å; C410-L412 VanDerWaalsContact C-N 3.32Å; C410-L412 PolarHBondContact O-N 2.82Å; C410-E413 PolarHBondContact O-N 2.85Å; C410-T414 WeakPolarHBondContact O-CB 2.98Å; C410-T414 PolarHBondContact O-N 3.14Å; C410-T414 PolarHBondContact O-OG1 3.43Å
411	V	86.5	Confident	83.5	Confident	101 Å²	101	73.8 Å²	73.8	61%	0.612	36%	0.363	S	S	*	.	H	α-helix	trans	-63.3	-39.7	175	169.3	0	0	0	0	111.3	K407 Q408 R409 F415	K407-V411 VanDerWaalsContact O-CG2 3.26Å; K407-V411 WeakPolarHBondContact O-CG2 3.46Å; K407-V411 PolarHBondContact O-N 2.78Å; K407-V411 VanDerWaalsContact O-N 3.08Å; Q408-V411 PolarHBondContact O-N 3.16Å; R409-V411 VanDerWaalsContact C-N 3.34Å; R409-V411 PolarHBondContact O-N 2.94Å; V411-F415 WeakPolarHBondContact O-CB 3.31Å; V411-F415 PolarHBondContact O-N 3.48Å; V411-F415 VanDerWaalsContact O-N 3.08Å
412	L	85.8	Confident	81.8	Confident	30 Å²	30	74.7 Å²	74.7	16%	0.157	37%	0.367	C	S	.	.	H	α-helix	trans	-66.2	-45.1	177.9	-171.7	64.8	0	0	0	111.5	Q408 R409 C410 F415 A416 Y504 E507 A508 F511	Q408-L412 PolarHBondContact O-N 2.93Å; R409-L412 WeakPolarHBondContact O-CB 3.1Å; R409-L412 PolarHBondContact O-N 2.85Å; R409-L412 VanDerWaalsContact O-N 3.11Å; C410-L412 VanDerWaalsContact C-N 3.32Å; C410-L412 PolarHBondContact O-N 2.82Å; L412-F415 PolarHBondContact O-N 2.92Å; L412-A416 PolarHBondContact O-N 2.77Å; L412-Y504 HydrophobicContact CD1-CD2 3.77Å; L412-Y504 HydrophobicContact CD1-CE2 4.28Å; L412-Y504 HydrophobicContact CD2-CD2 4.08Å; L412-Y504 HydrophobicContact CD2-CE2 4.19Å; L412-Y504 HydrophobicContact CG-CD2 3.6Å; L412-Y504 HydrophobicContact CG-CE2 3.64Å; L412-E507 HydrophobicContact CD2-CB 4Å; L412-E507 HydrophobicContact CD2-CG 4.13Å; L412-A508 HydrophobicContact CD2-CB 4.03Å; L412-F511 HydrophobicContact CD2-CD2 4.07Å; L412-F511 HydrophobicContact CD2-CE2 4.09Å
413	E	82.3	Confident	79.8	Confident	69 Å²	69	78.6 Å²	78.6	32%	0.322	38%	0.384	S	S	.	.	H	α-helix	trans	-59.9	-47.6	174.3	-75.5	176.4	160.1	0	0	111.7	R409 C410 F415 A416 D417	R409-E413 IonicContact CZ-OE1 2.69Å; R409-E413 VanDerWaalsContact CZ-OE1 3.23Å; R409-E413 IonicContact NE-OE1 3.8Å; R409-E413 PolarHBondContact NE-OE1 2.81Å; R409-E413 IonicContact NE-OE2 3.29Å; R409-E413 PolarHBondContact NE-OE2 3.45Å; R409-E413 IonicContact NH2-OE1 3.65Å; R409-E413 PolarHBondContact NH2-OE1 3.25Å; R409-E413 PolarHBondContact O-N 2.97Å; C410-E413 PolarHBondContact O-N 2.85Å; E413-F415 PolarHBondContact O-N 3.08Å; E413-A416 PolarHBondContact O-N 2.98Å; E413-A416 VanDerWaalsContact O-N 3.08Å; E413-D417 PolarHBondContact O-N 3.5Å
414	T	82.6	Confident	77.8	Confident	78 Å²	78	80.3 Å²	80.3	48%	0.479	39%	0.394	S	S	.	.	H	α-helix	trans	-58.9	-37.4	177.9	-53.9	0	0	0	0	111.7	C410 S418	C410-T414 WeakPolarHBondContact O-CB 2.98Å; C410-T414 PolarHBondContact O-N 3.14Å; C410-T414 PolarHBondContact O-OG1 3.43Å; T414-S418 WeakPolarHBondContact O-CB 3.49Å; T414-S418 PolarHBondContact O-N 3.49Å; T414-S418 VanDerWaalsContact O-N 3.12Å; T414-S418 PolarHBondContact O-OG 3.01Å
415	F	80.6	Confident	75.7	Confident	96 Å²	96	79.2 Å²	79.2	42%	0.421	40%	0.396	S	S	.	.	H	α-helix	trans	-70	-39.4	177	-174.5	-96.2	0	0	0	112.2	V411 L412 E413 S418 L419 F500	V411-F415 WeakPolarHBondContact O-CB 3.31Å; V411-F415 PolarHBondContact O-N 3.48Å; V411-F415 VanDerWaalsContact O-N 3.08Å; L412-F415 PolarHBondContact O-N 2.92Å; E413-F415 PolarHBondContact O-N 3.08Å; F415-S418 WeakPolarHBondContact O-CB 3.3Å; F415-S418 PolarHBondContact O-N 2.8Å; F415-L419 HydrophobicContact CD1-CD1 3.88Å; F415-L419 HydrophobicContact CE1-CD1 3.43Å; F415-L419 VanDerWaalsContact CE1-CD1 3.43Å; F415-L419 HydrophobicContact CE1-CG 4.15Å; F415-L419 HydrophobicContact CZ-CD1 4.16Å; F415-L419 PolarHBondContact O-N 2.84Å; F415-F500 HydrophobicContact CD1-CE1 4.49Å; F415-F500 AromaticContact CD1-CE2 3.8Å; F415-F500 HydrophobicContact CD1-CE2 3.8Å; F415-F500 AromaticContact CD1-CZ 3.49Å; F415-F500 HydrophobicContact CD1-CZ 3.49Å; F415-F500 VanDerWaalsContact CD1-CZ 3.49Å; F415-F500 HydrophobicContact CE1-CD2 4.22Å; F415-F500 HydrophobicContact CE1-CE1 4.28Å; F415-F500 AromaticContact CE1-CE2 3.31Å; F415-F500 HydrophobicContact CE1-CE2 3.31Å; F415-F500 AromaticContact CE1-CZ 3.36Å; F415-F500 HydrophobicContact CE1-CZ 3.36Å; F415-F500 HydrophobicContact CZ-CE2 4.43Å
416	A	77.7	Confident	73.6	Confident	13 Å²	13	84.2 Å²	84.2	11%	0.107	42%	0.421	C	S	.	.	H	α-helix	trans	-64.3	-46	174.3	0	0	0	0	0	111.8	L412 E413 S418 L419 S420 Y504	L412-A416 PolarHBondContact O-N 2.77Å; E413-A416 PolarHBondContact O-N 2.98Å; E413-A416 VanDerWaalsContact O-N 3.08Å; A416-S418 PolarHBondContact O-N 3.46Å; A416-L419 WeakPolarHBondContact O-CB 3.18Å; A416-L419 PolarHBondContact O-N 2.88Å; A416-S420 PolarHBondContact O-N 2.96Å; A416-S420 PolarHBondContact O-OG 3.27Å; A416-Y504 HydrophobicContact CB-CD2 3.89Å; A416-Y504 HydrophobicContact CB-CE1 4.47Å; A416-Y504 HydrophobicContact CB-CE2 3.35Å
417	D	75.3	Confident	71.3	Confident	94 Å²	94	86.5 Å²	86.5	50%	0.503	44%	0.436	S	S	.	.	H	α-helix	trans	-57.1	-38.3	174.9	-74.4	-18.2	0	0	0	111.9	E413 L419 S420 R421	E413-D417 PolarHBondContact O-N 3.5Å; D417-L419 VanDerWaalsContact C-N 3.28Å; D417-L419 PolarHBondContact O-N 3.26Å; D417-S420 PolarHBondContact O-N 2.76Å; D417-R421 WeakPolarHBondContact O-CG 3.23Å; D417-R421 PolarHBondContact O-N 2.93Å; D417-R421 VanDerWaalsContact O-N 3.09Å
418	S	73.5	Confident	69.1	Low	50 Å²	50	87 Å²	87	35%	0.35	44%	0.444	S	S	.	.	H	α-helix	trans	-68.8	-23.1	177	-60	0	0	0	0	113.8	T414 F415 A416 R422	T414-S418 WeakPolarHBondContact O-CB 3.49Å; T414-S418 PolarHBondContact O-N 3.49Å; T414-S418 VanDerWaalsContact O-N 3.12Å; T414-S418 PolarHBondContact O-OG 3.01Å; F415-S418 WeakPolarHBondContact O-CB 3.3Å; F415-S418 PolarHBondContact O-N 2.8Å; A416-S418 PolarHBondContact O-N 3.46Å; S418-R422 PolarHBondContact O-NE 2.83Å; S418-R422 PolarHBondContact O-NH2 3.37Å
419	L	70.6	Confident	66.5	Low	29 Å²	29	85.8 Å²	85.8	15%	0.152	46%	0.456	C	S	.	.	H	α-helix	trans	-84.1	-43	174.2	-76.7	168.6	0	0	0	111.2	F415 A416 D417 R421 R422 E423 F500	F415-L419 HydrophobicContact CD1-CD1 3.88Å; F415-L419 HydrophobicContact CE1-CD1 3.43Å; F415-L419 VanDerWaalsContact CE1-CD1 3.43Å; F415-L419 HydrophobicContact CE1-CG 4.15Å; F415-L419 HydrophobicContact CZ-CD1 4.16Å; F415-L419 PolarHBondContact O-N 2.84Å; A416-L419 WeakPolarHBondContact O-CB 3.18Å; A416-L419 PolarHBondContact O-N 2.88Å; D417-L419 VanDerWaalsContact C-N 3.28Å; D417-L419 PolarHBondContact O-N 3.26Å; L419-R421 VanDerWaalsContact C-N 3.3Å; L419-R421 PolarHBondContact O-N 3.47Å; L419-R422 WeakPolarHBondContact O-CB 3.45Å; L419-R422 PolarHBondContact O-N 3.04Å; L419-E423 PolarHBondContact O-N 3.49Å; L419-F500 HydrophobicContact CD1-CD1 3.58Å; L419-F500 HydrophobicContact CD1-CE1 3.08Å; L419-F500 HydrophobicContact CD1-CE2 4.21Å; L419-F500 HydrophobicContact CD1-CG 4.34Å; L419-F500 HydrophobicContact CD1-CZ 3.46Å; L419-F500 VanDerWaalsContact CD1-CZ 3.46Å
420	S	68.1	Low	63.8	Low	65 Å²	65	85.6 Å²	85.6	46%	0.455	48%	0.478	S	S	.	.	H	α-helix	trans	-57.6	-43.4	176.8	-48.6	0	0	0	0	111.6	A416 D417 R422 E423 D424	A416-S420 PolarHBondContact O-N 2.96Å; A416-S420 PolarHBondContact O-OG 3.27Å; D417-S420 PolarHBondContact O-N 2.76Å; S420-R422 VanDerWaalsContact C-N 3.26Å; S420-R422 PolarHBondContact O-N 3.38Å; S420-E423 PolarHBondContact O-N 2.9Å; S420-D424 PolarHBondContact O-N 2.8Å
421	R	61.2	Low	61.2	Low	111 Å²	111	87.8 Å²	87.8	42%	0.419	49%	0.494	S	S	.	.	H	α-helix	trans	-62.1	-30.5	175.8	-70.9	-178.7	-168.2	-158.4	5.6	113.4	D417 L419 E425 D1010	D417-R421 WeakPolarHBondContact O-CG 3.23Å; D417-R421 PolarHBondContact O-N 2.93Å; D417-R421 VanDerWaalsContact O-N 3.09Å; L419-R421 VanDerWaalsContact C-N 3.3Å; L419-R421 PolarHBondContact O-N 3.47Å; R421-E425 PolarHBondContact O-N 3.29Å; R421-D1010 IonicContact NH1-OD2 3.19Å
422	R	58.2	Low	58.7	Low	109 Å²	109	90.5 Å²	90.5	41%	0.411	50%	0.5	S	S	.	.	H	α-helix	trans	-74.9	-28.9	179.5	-88.8	-175.4	-100.3	132.8	-2.1	113.1	S418 L419 S420 I426	S418-R422 PolarHBondContact O-NE 2.83Å; S418-R422 PolarHBondContact O-NH2 3.37Å; L419-R422 WeakPolarHBondContact O-CB 3.45Å; L419-R422 PolarHBondContact O-N 3.04Å; S420-R422 VanDerWaalsContact C-N 3.26Å; S420-R422 PolarHBondContact O-N 3.38Å; R422-I426 VanDerWaalsContact O-CG1 3.3Å; R422-I426 WeakPolarHBondContact O-CG1 3.25Å; R422-I426 PolarHBondContact O-N 3.27Å
423	E	51.7	Low	56.2	Low	101 Å²	101	99.1 Å²	99.1	47%	0.472	53%	0.532	S	S	.	.	H	α-helix	trans	-69.1	-38.2	172.9	-77.2	-171.9	150.9	0	0	111.7	L419 S420 E425 I426 L427 L497	L419-E423 PolarHBondContact O-N 3.49Å; S420-E423 PolarHBondContact O-N 2.9Å; E423-E425 VanDerWaalsContact C-N 3.34Å; E423-E425 PolarHBondContact O-N 3.07Å; E423-I426 PolarHBondContact O-N 2.99Å; E423-L427 WeakPolarHBondContact O-CG 3.33Å; E423-L427 PolarHBondContact O-N 3Å; E423-L497 VanDerWaalsContact OE1-CD2 3.24Å; E423-L497 WeakPolarHBondContact OE1-CD2 3.36Å
424	D	48.4	Very low	53.8	Low	102 Å²	102	99.9 Å²	99.9	55%	0.545	56%	0.558	S	S	.	*	H	α-helix	trans	-63.4	-38.1	175	-76.6	-26.4	0	0	0	112.1	S420 L427 L428	S420-D424 PolarHBondContact O-N 2.8Å; D424-L427 PolarHBondContact O-N 3Å; D424-L428 WeakPolarHBondContact O-CB 3.37Å; D424-L428 WeakPolarHBondContact O-CD1 3.47Å; D424-L428 PolarHBondContact O-N 3.32Å; D424-L428 VanDerWaalsContact O-N 3.11Å
425	E	48.7	Very low	51.4	Low	134 Å²	134	104.5 Å²	104.5	63%	0.626	57%	0.574	S	S	*	*	H	α-helix	trans	-66.4	-35.1	174.5	-81	-164.9	139.6	0	0	113.2	R421 E423 G429	R421-E425 PolarHBondContact O-N 3.29Å; E423-E425 VanDerWaalsContact C-N 3.34Å; E423-E425 PolarHBondContact O-N 3.07Å; E425-G429 PolarHBondContact O-N 2.78Å
426	I	47	Very low	49.2	Very low	113 Å²	113	105.6 Å²	105.6	58%	0.579	59%	0.589	S	S	*	*	H	α-helix	trans	-74.3	-33.2	179.1	-65.4	167.1	0	0	0	110.9	R422 E423	R422-I426 VanDerWaalsContact O-CG1 3.3Å; R422-I426 WeakPolarHBondContact O-CG1 3.25Å; R422-I426 PolarHBondContact O-N 3.27Å; E423-I426 PolarHBondContact O-N 2.99Å
427	L	43.8	Very low	46.9	Very low	146 Å²	146	110.9 Å²	110.9	76%	0.764	62%	0.62	S	S	*	*	H	α-helix	trans	-79.2	-20.9	178.2	-72.6	168.3	0	0	0	113.5	E423 D424	E423-L427 WeakPolarHBondContact O-CG 3.33Å; E423-L427 PolarHBondContact O-N 3Å; D424-L427 PolarHBondContact O-N 3Å
428	L	43.6	Very low	44.8	Very low	152 Å²	152	114.6 Å²	114.6	80%	0.796	64%	0.639	S	S	*	*	H	α-helix	trans	-103	-5	-179.8	-77.4	155.2	0	0	0	114.7	D424	D424-L428 WeakPolarHBondContact O-CB 3.37Å; D424-L428 WeakPolarHBondContact O-CD1 3.47Å; D424-L428 PolarHBondContact O-N 3.32Å; D424-L428 VanDerWaalsContact O-N 3.11Å
429	G	37.1	Very low	42.9	Very low	66 Å²	66	119 Å²	119	68%	0.68	66%	0.659	S	S	*	*			trans	-100.7	0.5	-171.1	0	0	0	0	0	118.2	E425	E425-G429 PolarHBondContact O-N 2.78Å
430	G	31.9	Very low	41.1	Very low	73 Å²	73	124.9 Å²	124.9	75%	0.753	69%	0.69	S	S	*	*			trans	-107.4	66.7	-166.5	0	0	0	0	0	117.1
431	S	30.1	Very low	39.5	Very low	111 Å²	111	129.4 Å²	129.4	78%	0.776	71%	0.708	S	S	*	*			trans	-171.8	100	152.6	-165.2	0	0	0	0	113.4
432	H	34	Very low	38.2	Very low	159 Å²	159	129.3 Å²	129.3	74%	0.736	72%	0.722	S	S	*	*			trans	-166.4	129.6	137.8	-114.4	-11.8	0	0	0	114.7
433	Y	33.9	Very low	36.8	Very low	211 Å²	211	131.4 Å²	131.4	83%	0.827	74%	0.741	S	S	*	*			trans	83.8	102.1	167.6	-56.7	-73.7	0	0	0	119.6
434	G	32.4	Very low	36	Very low	85 Å²	85	134.7 Å²	134.7	88%	0.876	76%	0.756	S	S	*	*			trans	169	87.3	163.5	0	0	0	0	0	114.9
435	H	32.3	Very low	35.3	Very low	174 Å²	174	136.5 Å²	136.5	81%	0.806	77%	0.771	S	S	*	*			trans	-63.5	123.7	-178	-177.5	-82.5	0	0	0	115
436	T	33.4	Very low	34.5	Very low	120 Å²	120	133 Å²	133	74%	0.736	77%	0.77	S	S	*	*				173.1	138.9	124.3	23.2	0	0	0	0	113.6
437	T	30.3	Very low	33.9	Very low	124 Å²	124	133 Å²	133	76%	0.761	78%	0.775	S	S	*	*			trans	-30.3	129	172.3	51.9	0	0	0	0	119.1
438	L	31.7	Very low	33.5	Very low	171 Å²	171	132.4 Å²	132.4	90%	0.895	78%	0.778	S	S	*	*				-168.9	144.5	129.8	-105.4	149.4	0	0	0	112.2
439	N	32.8	Very low	33.2	Very low	143 Å²	143	133.2 Å²	133.2	77%	0.765	78%	0.783	S	S	*	*			trans	-72.1	156.7	-164.2	-69.9	-35.5	0	0	0	115.6
440	N	33.6	Very low	33.1	Very low	152 Å²	152	137.8 Å²	137.8	81%	0.813	79%	0.787	S	S	*	*			trans	62.8	112.1	155	-76.1	-9.8	0	0	0	117.7
441	I	32.8	Very low	33.3	Very low	160 Å²	160	139.8 Å²	139.8	82%	0.821	78%	0.784	S	S	*	*				-174.7	133.8	121.4	-85.7	145.2	0	0	0	108
442	P	34.4	Very low	33.6	Very low	110 Å²	110	142.5 Å²	142.5	71%	0.714	79%	0.79	S	S	*	*			trans	-78.9	154.3	-175.1	30.9	-33.8	0	0	0	114
443	N	29.6	Very low	33.6	Very low	152 Å²	152	142 Å²	142	81%	0.813	79%	0.792	S	S	*	*			trans	-35.6	124.8	175.5	-67	-21.2	0	0	0	115.6
444	H	34.4	Very low	33.6	Very low	171 Å²	171	139 Å²	139	79%	0.792	79%	0.789	S	S	*	*			trans	-120.7	83	157	-85.8	-81.4	0	0	0	109.2
445	T	32.7	Very low	33.6	Very low	139 Å²	139	140.5 Å²	140.5	85%	0.853	79%	0.786	S	S	*	*			trans	-116.6	84.7	161.9	52.6	0	0	0	0	106.5
446	G	31.9	Very low	33.7	Very low	60 Å²	60	137.9 Å²	137.9	62%	0.619	79%	0.788	S	S	*	*			trans	-160	29.4	-174.5	0	0	0	0	0	113.5
447	V	35.2	Very low	33.7	Very low	113 Å²	113	141.7 Å²	141.7	69%	0.685	80%	0.797	S	S	*	*	S	Bend	trans	-121.1	1.1	-170.8	-171	0	0	0	0	113.6
448	V	36.1	Very low	33.7	Very low	134 Å²	134	139.7 Å²	139.7	81%	0.812	80%	0.801	S	S	*	*	S	Bend	trans	-104.1	-11.8	-177.9	-168.8	0	0	0	0	113.8
449	D	36.6	Very low	33.6	Very low	169 Å²	169	136 Å²	136	90%	0.904	80%	0.796	S	S	*	*	S	Bend	trans	-97.6	13.8	179.5	-70.5	-37	0	0	0	115
450	Q	34.1	Very low	33.6	Very low	163 Å²	163	135.4 Å²	135.4	76%	0.762	80%	0.797	S	S	*	*	S	Bend	trans	-117.5	9.4	-177.1	-93.6	-176.9	16.7	0	0	116
451	V	37.2	Very low	33.6	Very low	114 Å²	114	135.6 Å²	135.6	69%	0.691	80%	0.797	S	S	*	*	S	Bend	trans	-105.3	-11	-175.6	-176.4	0	0	0	0	114.4
452	N	35.6	Very low	33.5	Very low	169 Å²	169	133 Å²	133	90%	0.904	79%	0.793	S	S	*	*	S	Bend	trans	-101.8	18.8	-179.3	-77	-15.4	0	0	0	115.1
453	N	34.2	Very low	33.2	Very low	147 Å²	147	131.7 Å²	131.7	79%	0.786	80%	0.8	S	S	*	*	S	Bend	trans	-141.8	47.5	-175.5	-143	4	0	0	0	113.1
454	I	35.4	Very low	33.3	Very low	148 Å²	148	127.7 Å²	127.7	76%	0.759	80%	0.795	S	S	*	*	S	Bend	trans	-153.2	112.6	161	-78.3	120	0	0	0	107.1
455	S	31.7	Very low	33.2	Very low	118 Å²	118	125.9 Å²	125.9	83%	0.825	80%	0.796	S	S	*	*			trans	141.6	60.7	150.3	-61	0	0	0	0	113.4
456	S	33.7	Very low	33.1	Very low	119 Å²	119	125.4 Å²	125.4	83%	0.832	79%	0.793	S	S	*	*			trans	-124	57.4	156.6	64.4	0	0	0	0	109.6
457	Q	33.3	Very low	33.4	Very low	199 Å²	199	128.1 Å²	128.1	93%	0.93	80%	0.8	S	S	*	*			trans	-149.6	110.9	163.7	-72.3	-166.4	3	0	0	108.6
458	G	31.6	Very low	33.2	Very low	83 Å²	83	127.8 Å²	127.8	86%	0.856	81%	0.809	S	S	*	*			trans	157.7	45.7	174.6	0	0	0	0	0	116.3
459	A	28.6	Very low	33	Very low	94 Å²	94	129.1 Å²	129.1	78%	0.777	81%	0.811	S	S	*	*			trans	-94.2	106.3	160.4	0	0	0	0	0	108.2
460	T	33.3	Very low	32.7	Very low	130 Å²	130	125.2 Å²	125.2	80%	0.798	80%	0.803	S	S	*	*			trans	-175.9	135.6	148.9	18.5	0	0	0	0	110.5
461	L	32.5	Very low	32.5	Very low	156 Å²	156	125.9 Å²	125.9	82%	0.817	81%	0.806	S	S	*	*			trans	88.1	86	157.3	-60.5	152.9	0	0	0	118.1
462	S	30.7	Very low	32.2	Very low	104 Å²	104	128.1 Å²	128.1	73%	0.727	81%	0.811	S	S	*	*				44.8	115.9	113	65.6	0	0	0	0	119.4
463	G	29.6	Very low	31.8	Very low	84 Å²	84	124.4 Å²	124.4	87%	0.866	80%	0.804	S	S	*	*				102.1	118.5	123.7	0	0	0	0	0	117
464	G	30.4	Very low	31.5	Very low	68 Å²	68	121.9 Å²	121.9	70%	0.701	80%	0.803	S	S	*	*			trans	120.3	97.1	141.8	0	0	0	0	0	117.3
465	T	33.5	Very low	31.3	Very low	133 Å²	133	120.8 Å²	120.8	82%	0.816	80%	0.803	S	S	*	*			trans	67.2	99.9	130.4	-5.8	0	0	0	0	119.9
466	T	31	Very low	31.4	Very low	129 Å²	129	120.9 Å²	120.9	79%	0.791	80%	0.799	S	S	*	*				32	162.2	124.3	-3.5	0	0	0	0	122.3
467	P	36.7	Very low	31.3	Very low	117 Å²	117	118.9 Å²	118.9	76%	0.76	79%	0.79	S	S	*	*				-118.7	166.8	-106.6	39	-20.4	0	0	0	113.1
468	A	32.3	Very low	31.3	Very low	105 Å²	105	117.1 Å²	117.1	87%	0.868	78%	0.781	S	S	*	*			trans	-148.4	109.1	169	0	0	0	0	0	113.3
469	N	31	Very low	31.6	Very low	162 Å²	162	120.6 Å²	120.6	87%	0.866	78%	0.775	S	S	*	*			trans	-59.4	148.6	160.1	-91.3	-28.5	0	0	0	112.1
470	A	29.9	Very low	31.9	Very low	88 Å²	88	125.1 Å²	125.1	73%	0.727	78%	0.777	S	S	*	*			trans	59.4	107	145	0	0	0	0	0	118.7
471	Q	30	Very low	31.7	Very low	176 Å²	176	124.2 Å²	124.2	82%	0.822	78%	0.775	S	S	*	*			trans	-158.4	120.6	146.1	-110.3	155.2	44.9	0	0	113.1
472	M	30.5	Very low	31.6	Very low	161 Å²	161	123.5 Å²	123.5	79%	0.793	77%	0.77	S	S	*	*			trans	65.3	112	142.8	-62.5	-163.4	-65.1	0	0	119
473	A	28.7	Very low	31.6	Very low	92 Å²	92	125.4 Å²	125.4	76%	0.76	77%	0.773	S	S	*	*				68.7	117.8	55.5	0	0	0	0	0	114.4
474	A	28.2	Very low	32	Very low	93 Å²	93	128.6 Å²	128.6	77%	0.769	77%	0.77	S	S	*	*			trans	66.7	125.8	162.7	0	0	0	0	0	115
475	T	31.3	Very low	32.5	Very low	125 Å²	125	132.5 Å²	132.5	77%	0.767	78%	0.779	S	S	*	*				-179.1	134.1	62.8	45.1	0	0	0	0	105.4
476	T	33.8	Very low	33.1	Very low	121 Å²	121	131.1 Å²	131.1	74%	0.742	77%	0.771	S	S	*	*				166.4	119.9	77.9	-62.2	0	0	0	0	104.1
477	A	31.1	Very low	33.8	Very low	76 Å²	76	129 Å²	129	63%	0.628	76%	0.755	S	S	*	*				46	124.4	116.6	0	0	0	0	0	114.3
478	E	31.9	Very low	34.4	Very low	162 Å²	162	127.8 Å²	127.8	76%	0.757	75%	0.747	S	S	*	*				177.8	147.4	52.8	-125.5	167.3	-148.7	0	0	110.9
479	H	38.4	Very low	35.2	Very low	157 Å²	157	131.7 Å²	131.7	73%	0.727	74%	0.741	S	S	*	*			trans	86	119.6	151.9	-69.1	-66.9	0	0	0	123.8
480	K	36.2	Very low	36.6	Very low	189 Å²	189	126.4 Å²	126.4	82%	0.822	71%	0.712	S	S	*	*			trans	82.4	95.6	147.2	-80.6	178.6	170.1	178.2	0	117.5
481	C	28.2	Very low	37.8	Very low	110 Å²	110	125.9 Å²	125.9	74%	0.743	70%	0.702	S	S	*	*				84.6	110.3	76.4	-80.2	0	0	0	0	114.7
482	I	30.5	Very low	39.3	Very low	141 Å²	141	125 Å²	125	72%	0.723	70%	0.695	S	S	*	*			trans	96.3	109.3	133.2	-60.2	164.8	0	0	0	117.2
483	N	31.3	Very low	41.3	Very low	145 Å²	145	119.4 Å²	119.4	78%	0.775	67%	0.668	S	S	*	*			trans	81.4	89.5	156.5	-58.9	-10.4	0	0	0	119.7
484	D	37.2	Very low	43.6	Very low	151 Å²	151	120.5 Å²	120.5	81%	0.807	67%	0.665	S	S	*	*				-167.4	122.3	117.3	-103.8	-24.3	0	0	0	110.6	T486	D484-T486 VanDerWaalsContact C-N 3.33Å; D484-T486 PolarHBondContact O-N 2.85Å; D484-T486 VanDerWaalsContact O-N 3.12Å
485	V	40.1	Very low	45.8	Very low	149 Å²	149	123.1 Å²	123.1	90%	0.903	66%	0.662	S	S	*	*			trans	-80.5	85.9	172.2	177	0	0	0	0	106.3	N487	V485-N487 PolarHBondContact O-N 3.44Å
486	T	47	Very low	47.8	Very low	105 Å²	105	118.9 Å²	118.9	64%	0.644	64%	0.636	S	S	*	*			trans	-70.1	118.2	173.6	30.2	0	0	0	0	109.4	D484 P488	D484-T486 VanDerWaalsContact C-N 3.33Å; D484-T486 PolarHBondContact O-N 2.85Å; D484-T486 VanDerWaalsContact O-N 3.12Å; T486-P488 WeakPolarHBondContact O-CD 3.42Å
487	N	46.3	Very low	49.7	Very low	83 Å²	83	115.2 Å²	115.2	44%	0.444	61%	0.611	S	S	.	*			trans	-62.4	121.9	175.3	174.9	12.8	0	0	0	108.6	V485 Y489 D490	V485-N487 PolarHBondContact O-N 3.44Å; N487-Y489 PolarHBondContact O-N 2.83Å; N487-Y489 WeakPolarHBondContact OD1-CB 3.47Å; N487-Y489 WeakPolarHBondContact OD1-CD2 3.43Å; N487-Y489 PolarHBondContact OD1-N 2.95Å; N487-D490 HydrophobicContact CB-CB 4.2Å; N487-D490 VanDerWaalsContact O-CB 3.3Å; N487-D490 WeakPolarHBondContact O-CB 3.33Å; N487-D490 PolarHBondContact O-N 3.37Å
488	P	49.3	Very low	51.9	Low	92 Å²	92	117.5 Å²	117.5	60%	0.597	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-2.1	176.8	26.6	-33.6	0	0	0	113.4	T486 T496	T486-P488 WeakPolarHBondContact O-CD 3.42Å; P488-T496 PolarHBondContact O-OG1 2.76Å
489	Y	48.5	Very low	54.2	Low	188 Å²	188	116.3 Å²	116.3	74%	0.737	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.8	17	172	-54.7	-79.1	0	0	0	112.5	N487 P491	N487-Y489 PolarHBondContact O-N 2.83Å; N487-Y489 WeakPolarHBondContact OD1-CB 3.47Å; N487-Y489 WeakPolarHBondContact OD1-CD2 3.43Å; N487-Y489 PolarHBondContact OD1-N 2.95Å; Y489-P491 WeakPolarHBondContact O-CD 3.38Å
490	D	59.9	Low	56.1	Low	50 Å²	50	111.2 Å²	111.2	27%	0.267	58%	0.577	S	S	.	*			trans	-73.4	113.3	175.7	-166.4	-9.2	0	0	0	109.5	N487 K492 N493	N487-D490 HydrophobicContact CB-CB 4.2Å; N487-D490 VanDerWaalsContact O-CB 3.3Å; N487-D490 WeakPolarHBondContact O-CB 3.33Å; N487-D490 PolarHBondContact O-N 3.37Å; D490-K492 PolarHBondContact O-N 2.9Å; D490-K492 VanDerWaalsContact OD1-CB 3.29Å; D490-K492 WeakPolarHBondContact OD1-CB 3.17Å; D490-K492 WeakPolarHBondContact OD1-CG 3.47Å; D490-K492 PolarHBondContact OD1-N 2.93Å; D490-N493 HydrophobicContact CB-CB 4.42Å; D490-N493 WeakPolarHBondContact O-CB 3.38Å; D490-N493 PolarHBondContact O-N 3.34Å
491	P	56.2	Low	58.3	Low	78 Å²	78	106.7 Å²	106.7	51%	0.506	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.9	-12.9	174.9	27.1	-35.3	0	0	0	112.8	Y489 N493	Y489-P491 WeakPolarHBondContact O-CD 3.38Å; P491-N493 VanDerWaalsContact C-N 3.32Å
492	K	61.5	Low	60.8	Low	158 Å²	158	106.6 Å²	106.6	69%	0.687	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-12.8	172.3	-57.8	178.7	179.2	-175.3	0	113.3	D490 V494	D490-K492 PolarHBondContact O-N 2.9Å; D490-K492 VanDerWaalsContact OD1-CB 3.29Å; D490-K492 WeakPolarHBondContact OD1-CB 3.17Å; D490-K492 WeakPolarHBondContact OD1-CG 3.47Å; D490-K492 PolarHBondContact OD1-N 2.93Å; K492-V494 PolarHBondContact O-N 3.31Å
493	N	72.7	Confident	63.4	Low	43 Å²	43	104.6 Å²	104.6	23%	0.23	54%	0.54	C	S	.	.	S	Bend	trans	-77.3	114	172.4	-178.7	-0.7	0	0	0	108.9	D490 P491 E495 T496 L497	D490-N493 HydrophobicContact CB-CB 4.42Å; D490-N493 WeakPolarHBondContact O-CB 3.38Å; D490-N493 PolarHBondContact O-N 3.34Å; P491-N493 VanDerWaalsContact C-N 3.32Å; N493-E495 PolarHBondContact O-N 2.84Å; N493-E495 VanDerWaalsContact O-N 3.13Å; N493-E495 WeakPolarHBondContact OD1-CB 3.3Å; N493-E495 PolarHBondContact OD1-N 2.82Å; N493-T496 PolarHBondContact ND2-OG1 2.91Å; N493-T496 WeakPolarHBondContact O-CA 3.47Å; N493-T496 WeakPolarHBondContact O-CB 3.43Å; N493-T496 PolarHBondContact O-N 2.9Å; N493-L497 PolarHBondContact O-N 3.28Å
494	V	75.5	Confident	66.1	Low	115 Å²	115	100.6 Å²	100.6	70%	0.697	51%	0.514	S	S	*	.	H	α-helix	trans	-51.4	-35.7	177	179.6	0	0	0	0	111.7	K492 L497 H498	K492-V494 PolarHBondContact O-N 3.31Å; V494-L497 PolarHBondContact O-N 3.34Å; V494-H498 WeakPolarHBondContact O-CB 3.33Å; V494-H498 PolarHBondContact O-N 3.36Å
495	E	75.5	Confident	68.5	Low	148 Å²	148	99.9 Å²	99.9	69%	0.692	50%	0.504	S	S	*	.	H	α-helix	trans	-68.7	-36.8	177.5	-61.7	168.2	167.8	0	0	112.2	N493 K499	N493-E495 PolarHBondContact O-N 2.84Å; N493-E495 VanDerWaalsContact O-N 3.13Å; N493-E495 WeakPolarHBondContact OD1-CB 3.3Å; N493-E495 PolarHBondContact OD1-N 2.82Å; E495-K499 WeakPolarHBondContact O-CB 3.03Å; E495-K499 PolarHBondContact O-N 2.73Å
496	T	73.1	Confident	70.9	Confident	36 Å²	36	97.2 Å²	97.2	22%	0.221	48%	0.484	C	S	.	.	H	α-helix	trans	-72.4	-39.1	178.3	-56.5	0	0	0	0	110.6	P488 N493 F500	P488-T496 PolarHBondContact O-OG1 2.76Å; N493-T496 PolarHBondContact ND2-OG1 2.91Å; N493-T496 WeakPolarHBondContact O-CA 3.47Å; N493-T496 WeakPolarHBondContact O-CB 3.43Å; N493-T496 PolarHBondContact O-N 2.9Å; T496-F500 WeakPolarHBondContact O-CB 3.5Å; T496-F500 PolarHBondContact O-N 3.32Å
497	L	74.3	Confident	73	Confident	43 Å²	43	94.9 Å²	94.9	23%	0.225	47%	0.466	C	S	.	.	H	α-helix	trans	-65.2	-46.5	173.5	-178.7	64.8	0	0	0	111.8	E423 N493 V494 K499 F500 L501	E423-L497 VanDerWaalsContact OE1-CD2 3.24Å; E423-L497 WeakPolarHBondContact OE1-CD2 3.36Å; N493-L497 PolarHBondContact O-N 3.28Å; V494-L497 PolarHBondContact O-N 3.34Å; L497-K499 VanDerWaalsContact C-N 3.31Å; L497-K499 PolarHBondContact O-N 3.23Å; L497-F500 WeakPolarHBondContact O-CB 3.37Å; L497-F500 PolarHBondContact O-N 3.43Å; L497-F500 VanDerWaalsContact O-N 3.1Å; L497-L501 HydrophobicContact CD1-CD1 4.37Å; L497-L501 HydrophobicContact CD1-CG 4.27Å; L497-L501 HydrophobicContact CG-CD1 4.11Å; L497-L501 HydrophobicContact CG-CG 4.41Å; L497-L501 WeakPolarHBondContact O-CG 3.21Å; L497-L501 PolarHBondContact O-N 2.83Å
498	H	75.9	Confident	75	Confident	124 Å²	124	91.9 Å²	91.9	57%	0.574	45%	0.453	S	S	*	.	H	α-helix	trans	-57.9	-46.5	176.8	-173.5	-76.8	0	0	0	111.1	V494 F500 L501 E502	V494-H498 WeakPolarHBondContact O-CB 3.33Å; V494-H498 PolarHBondContact O-N 3.36Å; H498-F500 VanDerWaalsContact C-N 3.3Å; H498-F500 PolarHBondContact O-N 3.2Å; H498-L501 PolarHBondContact O-N 3.05Å; H498-E502 IonicContact ND1-OE2 3.06Å; H498-E502 WeakPolarHBondContact O-CB 3.21Å; H498-E502 PolarHBondContact O-N 2.81Å
499	K	80.2	Confident	77	Confident	137 Å²	137	93 Å²	93	60%	0.596	45%	0.45	S	S	*	.	H	α-helix	trans	-62.4	-37.4	176.1	-171.7	171.4	-173.9	173.4	0	112.4	E495 L497 I503	E495-K499 WeakPolarHBondContact O-CB 3.03Å; E495-K499 PolarHBondContact O-N 2.73Å; L497-K499 VanDerWaalsContact C-N 3.31Å; L497-K499 PolarHBondContact O-N 3.23Å; K499-I503 HydrophobicContact CG-CD1 4.19Å; K499-I503 WeakPolarHBondContact O-CD1 3.28Å; K499-I503 VanDerWaalsContact O-CG1 3.22Å; K499-I503 WeakPolarHBondContact O-CG1 3.25Å; K499-I503 PolarHBondContact O-N 2.8Å; K499-I503 VanDerWaalsContact O-N 3.12Å
500	F	79.2	Confident	79.2	Confident	50 Å²	50	91 Å²	91	22%	0.219	44%	0.441	C	S	.	.	H	α-helix	trans	-66.9	-46.2	175.6	172.8	-93.3	0	0	0	112	F415 L419 T496 L497 H498 E502 I503 Y504	F415-F500 HydrophobicContact CD1-CE1 4.49Å; F415-F500 AromaticContact CD1-CE2 3.8Å; F415-F500 HydrophobicContact CD1-CE2 3.8Å; F415-F500 AromaticContact CD1-CZ 3.49Å; F415-F500 HydrophobicContact CD1-CZ 3.49Å; F415-F500 VanDerWaalsContact CD1-CZ 3.49Å; F415-F500 HydrophobicContact CE1-CD2 4.22Å; F415-F500 HydrophobicContact CE1-CE1 4.28Å; F415-F500 AromaticContact CE1-CE2 3.31Å; F415-F500 HydrophobicContact CE1-CE2 3.31Å; F415-F500 AromaticContact CE1-CZ 3.36Å; F415-F500 HydrophobicContact CE1-CZ 3.36Å; F415-F500 HydrophobicContact CZ-CE2 4.43Å; L419-F500 HydrophobicContact CD1-CD1 3.58Å; L419-F500 HydrophobicContact CD1-CE1 3.08Å; L419-F500 HydrophobicContact CD1-CE2 4.21Å; L419-F500 HydrophobicContact CD1-CG 4.34Å; L419-F500 HydrophobicContact CD1-CZ 3.46Å; L419-F500 VanDerWaalsContact CD1-CZ 3.46Å; T496-F500 WeakPolarHBondContact O-CB 3.5Å; T496-F500 PolarHBondContact O-N 3.32Å; L497-F500 WeakPolarHBondContact O-CB 3.37Å; L497-F500 PolarHBondContact O-N 3.43Å; L497-F500 VanDerWaalsContact O-N 3.1Å; H498-F500 VanDerWaalsContact C-N 3.3Å; H498-F500 PolarHBondContact O-N 3.2Å; F500-E502 VanDerWaalsContact C-N 3.3Å; F500-E502 PolarHBondContact O-N 3.02Å; F500-I503 PolarHBondContact O-N 2.98Å; F500-Y504 WeakPolarHBondContact O-CB 3.28Å; F500-Y504 PolarHBondContact O-N 3.33Å
501	L	81	Confident	80.8	Confident	94 Å²	94	89.6 Å²	89.6	49%	0.492	43%	0.433	S	S	.	.	H	α-helix	trans	-63.9	-36.4	179.4	-71.5	174.4	0	0	0	111.9	L497 H498 Y504 K505	L497-L501 HydrophobicContact CD1-CD1 4.37Å; L497-L501 HydrophobicContact CD1-CG 4.27Å; L497-L501 HydrophobicContact CG-CD1 4.11Å; L497-L501 HydrophobicContact CG-CG 4.41Å; L497-L501 WeakPolarHBondContact O-CG 3.21Å; L497-L501 PolarHBondContact O-N 2.83Å; H498-L501 PolarHBondContact O-N 3.05Å; L501-Y504 PolarHBondContact O-N 3.44Å; L501-K505 WeakPolarHBondContact O-CB 3.38Å; L501-K505 PolarHBondContact O-N 2.81Å
502	E	82.7	Confident	82.5	Confident	108 Å²	108	89.1 Å²	89.1	51%	0.505	43%	0.426	S	S	.	.	H	α-helix	trans	-62.5	-48.8	172.3	-166.3	174.2	-170.9	0	0	110.9	H498 F500 Y504 K505 D506	H498-E502 IonicContact ND1-OE2 3.06Å; H498-E502 WeakPolarHBondContact O-CB 3.21Å; H498-E502 PolarHBondContact O-N 2.81Å; F500-E502 VanDerWaalsContact C-N 3.3Å; F500-E502 PolarHBondContact O-N 3.02Å; E502-Y504 PolarHBondContact O-N 2.94Å; E502-K505 PolarHBondContact O-N 3.12Å; E502-D506 WeakPolarHBondContact O-CB 3.33Å; E502-D506 VanDerWaalsContact O-CG 3.28Å; E502-D506 PolarHBondContact O-N 2.57Å
503	I	85.1	Confident	84	Confident	100 Å²	100	84.6 Å²	84.6	51%	0.513	41%	0.412	S	S	.	.	H	α-helix	trans	-62.1	-40.9	175.7	-67.5	164.9	0	0	0	112	K499 F500 D506 E507	K499-I503 HydrophobicContact CG-CD1 4.19Å; K499-I503 WeakPolarHBondContact O-CD1 3.28Å; K499-I503 VanDerWaalsContact O-CG1 3.22Å; K499-I503 WeakPolarHBondContact O-CG1 3.25Å; K499-I503 PolarHBondContact O-N 2.8Å; K499-I503 VanDerWaalsContact O-N 3.12Å; F500-I503 PolarHBondContact O-N 2.98Å; I503-D506 PolarHBondContact O-N 3.14Å; I503-E507 WeakPolarHBondContact O-CB 3.34Å; I503-E507 PolarHBondContact O-N 3.16Å
504	Y	86.3	Confident	85.1	Confident	60 Å²	60	85 Å²	85	24%	0.235	42%	0.415	C	S	.	.	H	α-helix	trans	-61.6	-48.1	177.9	170.2	-93	0	0	0	110.9	L412 A416 F500 L501 E502 E507 A508	L412-Y504 HydrophobicContact CD1-CD2 3.77Å; L412-Y504 HydrophobicContact CD1-CE2 4.28Å; L412-Y504 HydrophobicContact CD2-CD2 4.08Å; L412-Y504 HydrophobicContact CD2-CE2 4.19Å; L412-Y504 HydrophobicContact CG-CD2 3.6Å; L412-Y504 HydrophobicContact CG-CE2 3.64Å; A416-Y504 HydrophobicContact CB-CD2 3.89Å; A416-Y504 HydrophobicContact CB-CE1 4.47Å; A416-Y504 HydrophobicContact CB-CE2 3.35Å; F500-Y504 WeakPolarHBondContact O-CB 3.28Å; F500-Y504 PolarHBondContact O-N 3.33Å; L501-Y504 PolarHBondContact O-N 3.44Å; E502-Y504 PolarHBondContact O-N 2.94Å; Y504-E507 PolarHBondContact O-N 3.47Å; Y504-A508 WeakPolarHBondContact O-CB 3.4Å; Y504-A508 PolarHBondContact O-N 3.16Å
505	K	87.7	Confident	86	Confident	136 Å²	136	80.4 Å²	80.4	59%	0.591	39%	0.387	S	S	*	.	H	α-helix	trans	-59.1	-49.7	178.1	-177.2	-173.1	172.3	-170.3	0	110.6	L501 E502 E507 A508 E509	L501-K505 WeakPolarHBondContact O-CB 3.38Å; L501-K505 PolarHBondContact O-N 2.81Å; E502-K505 PolarHBondContact O-N 3.12Å; K505-E507 PolarHBondContact O-N 2.97Å; K505-A508 PolarHBondContact O-N 2.91Å; K505-E509 WeakPolarHBondContact O-CB 3.45Å; K505-E509 PolarHBondContact O-N 2.92Å
506	D	90.5	Very high	86.9	Confident	93 Å²	93	79.2 Å²	79.2	50%	0.497	38%	0.383	S	S	.	.	H	α-helix	trans	-62.1	-43.1	-178.9	-71.2	-5.4	0	0	0	111.9	E502 I503 R510	E502-D506 WeakPolarHBondContact O-CB 3.33Å; E502-D506 VanDerWaalsContact O-CG 3.28Å; E502-D506 PolarHBondContact O-N 2.57Å; I503-D506 PolarHBondContact O-N 3.14Å; D506-R510 VanDerWaalsContact O-CB 3.23Å; D506-R510 WeakPolarHBondContact O-CB 3.4Å; D506-R510 PolarHBondContact O-N 2.95Å
507	E	90.9	Very high	88	Confident	56 Å²	56	81.2 Å²	81.2	26%	0.262	39%	0.392	S	S	.	.	H	α-helix	trans	-75.6	-33.3	-178.7	-166.4	68.2	-173.3	0	0	112.2	L412 I503 Y504 K505 R510 F511	L412-E507 HydrophobicContact CD2-CB 4Å; L412-E507 HydrophobicContact CD2-CG 4.13Å; I503-E507 WeakPolarHBondContact O-CB 3.34Å; I503-E507 PolarHBondContact O-N 3.16Å; Y504-E507 PolarHBondContact O-N 3.47Å; K505-E507 PolarHBondContact O-N 2.97Å; E507-R510 PolarHBondContact O-N 3.34Å; E507-R510 IonicContact OE1-NH1 3.67Å; E507-R510 PolarHBondContact OE1-NH1 2.94Å; E507-R510 IonicContact OE2-NH1 2.85Å; E507-R510 PolarHBondContact OE2-NH1 3.19Å; E507-F511 HydrophobicContact CG-CD2 4.14Å; E507-F511 HydrophobicContact CG-CE2 3.56Å; E507-F511 HydrophobicContact CG-CZ 3.97Å; E507-F511 WeakPolarHBondContact O-CD2 3.45Å; E507-F511 WeakPolarHBondContact O-CG 3.46Å; E507-F511 PolarHBondContact O-N 2.68Å; E507-F511 VanDerWaalsContact OE1-CZ 3.3Å; E507-F511 WeakPolarHBondContact OE1-CZ 3.44Å
508	A	89.2	Confident	88.9	Confident	20 Å²	20	79.2 Å²	79.2	17%	0.165	38%	0.382	C	S	.	.	H	α-helix	trans	-65.5	-48.5	172.8	0	0	0	0	0	111.3	L412 Y504 K505 R510 F511 D512	L412-A508 HydrophobicContact CD2-CB 4.03Å; Y504-A508 WeakPolarHBondContact O-CB 3.4Å; Y504-A508 PolarHBondContact O-N 3.16Å; K505-A508 PolarHBondContact O-N 2.91Å; A508-R510 VanDerWaalsContact C-N 3.25Å; A508-R510 PolarHBondContact O-N 2.93Å; A508-F511 PolarHBondContact O-N 3.26Å; A508-F511 VanDerWaalsContact O-N 3.13Å; A508-D512 PolarHBondContact O-N 3.01Å
509	E	92.2	Very high	89.9	Confident	115 Å²	115	76.7 Å²	76.7	54%	0.537	38%	0.375	S	S	.	.	H	α-helix	trans	-59.1	-39	175.8	-175.3	173.9	175.9	0	0	111.3	K505 D512 T513	K505-E509 WeakPolarHBondContact O-CB 3.45Å; K505-E509 PolarHBondContact O-N 2.92Å; E509-D512 PolarHBondContact O-N 3.1Å; E509-T513 WeakPolarHBondContact O-CB 3.31Å; E509-T513 PolarHBondContact O-N 3.11Å; E509-T513 PolarHBondContact O-OG1 2.86Å
510	R	94	Very high	90.6	Very high	148 Å²	148	75.4 Å²	75.4	56%	0.558	37%	0.371	S	S	*	.	H	α-helix	trans	-64.3	-44	174.4	-176.5	-177	177.2	-148.9	-1.2	112.7	D506 E507 A508 T513 V514	D506-R510 VanDerWaalsContact O-CB 3.23Å; D506-R510 WeakPolarHBondContact O-CB 3.4Å; D506-R510 PolarHBondContact O-N 2.95Å; E507-R510 PolarHBondContact O-N 3.34Å; E507-R510 IonicContact OE1-NH1 3.67Å; E507-R510 PolarHBondContact OE1-NH1 2.94Å; E507-R510 IonicContact OE2-NH1 2.85Å; E507-R510 PolarHBondContact OE2-NH1 3.19Å; A508-R510 VanDerWaalsContact C-N 3.25Å; A508-R510 PolarHBondContact O-N 2.93Å; R510-T513 PolarHBondContact O-N 2.9Å; R510-V514 VanDerWaalsContact O-CG2 3.28Å; R510-V514 WeakPolarHBondContact O-CG2 3.38Å; R510-V514 PolarHBondContact O-N 2.83Å
511	F	92.7	Very high	91.5	Very high	20 Å²	20	75.1 Å²	75.1	9%	0.088	37%	0.371	C	S	.	.	H	α-helix	trans	-66	-41.9	176.8	-73.1	-45.7	0	0	0	112.1	T405 Q408 R409 L412 E507 A508 T513 V514 L515	T405-F511 HydrophobicContact CG2-CB 4.19Å; T405-F511 HydrophobicContact CG2-CD1 3.76Å; T405-F511 HydrophobicContact CG2-CG 4.35Å; Q408-F511 HydrophobicContact CB-CD1 4.38Å; Q408-F511 HydrophobicContact CB-CE1 3.71Å; Q408-F511 HydrophobicContact CB-CE2 4.05Å; Q408-F511 HydrophobicContact CB-CZ 3.55Å; Q408-F511 HydrophobicContact CG-CE1 4.48Å; Q408-F511 HydrophobicContact CG-CZ 4.45Å; R409-F511 HydrophobicContact CB-CB 4.19Å; R409-F511 HydrophobicContact CB-CD2 4.36Å; R409-F511 HydrophobicContact CB-CG 4.44Å; L412-F511 HydrophobicContact CD2-CD2 4.07Å; L412-F511 HydrophobicContact CD2-CE2 4.09Å; E507-F511 HydrophobicContact CG-CD2 4.14Å; E507-F511 HydrophobicContact CG-CE2 3.56Å; E507-F511 HydrophobicContact CG-CZ 3.97Å; E507-F511 WeakPolarHBondContact O-CD2 3.45Å; E507-F511 WeakPolarHBondContact O-CG 3.46Å; E507-F511 PolarHBondContact O-N 2.68Å; E507-F511 VanDerWaalsContact OE1-CZ 3.3Å; E507-F511 WeakPolarHBondContact OE1-CZ 3.44Å; A508-F511 PolarHBondContact O-N 3.26Å; A508-F511 VanDerWaalsContact O-N 3.13Å; F511-T513 VanDerWaalsContact C-N 3.34Å; F511-T513 PolarHBondContact O-N 2.8Å; F511-V514 PolarHBondContact O-N 2.97Å; F511-L515 WeakPolarHBondContact O-CB 3.43Å; F511-L515 VanDerWaalsContact O-CG 3.31Å; F511-L515 WeakPolarHBondContact O-CG 3.25Å; F511-L515 PolarHBondContact O-N 3.41Å
512	D	91.5	Very high	92.2	Very high	67 Å²	67	71.1 Å²	71.1	36%	0.358	35%	0.35	S	S	.	.	H	α-helix	trans	-61.9	-42.7	176.7	-74.9	-22.9	0	0	0	111.3	R409 A508 E509 L515 M516	R409-D512 IonicContact CZ-OD1 2.79Å; R409-D512 IonicContact NH1-OD1 2.72Å; R409-D512 PolarHBondContact NH1-OD1 3.03Å; R409-D512 IonicContact NH2-OD1 3.98Å; A508-D512 PolarHBondContact O-N 3.01Å; E509-D512 PolarHBondContact O-N 3.1Å; D512-L515 PolarHBondContact O-N 2.97Å; D512-M516 WeakPolarHBondContact O-CB 3.4Å; D512-M516 PolarHBondContact O-N 3.29Å
513	T	94.9	Very high	92.9	Very high	64 Å²	64	70.5 Å²	70.5	39%	0.393	35%	0.347	S	S	.	.	H	α-helix	trans	-60.9	-47.8	174.1	-55.6	0	0	0	0	111.3	E509 R510 F511 L515 M516 D517	E509-T513 WeakPolarHBondContact O-CB 3.31Å; E509-T513 PolarHBondContact O-N 3.11Å; E509-T513 PolarHBondContact O-OG1 2.86Å; R510-T513 PolarHBondContact O-N 2.9Å; F511-T513 VanDerWaalsContact C-N 3.34Å; F511-T513 PolarHBondContact O-N 2.8Å; T513-L515 VanDerWaalsContact C-N 3.31Å; T513-L515 PolarHBondContact O-N 2.96Å; T513-M516 PolarHBondContact O-N 2.93Å; T513-D517 WeakPolarHBondContact O-CB 3.48Å; T513-D517 VanDerWaalsContact O-CG 3.27Å; T513-D517 PolarHBondContact O-N 2.97Å
514	V	94.8	Very high	93.4	Very high	50 Å²	50	71.3 Å²	71.3	30%	0.303	35%	0.348	S	S	.	.	H	α-helix	trans	-62.2	-38.2	177.4	171	0	0	0	0	111.5	T405 R510 F511 T518	T405-V514 HydrophobicContact CG2-CB 4.29Å; T405-V514 HydrophobicContact CG2-CG1 4Å; R510-V514 VanDerWaalsContact O-CG2 3.28Å; R510-V514 WeakPolarHBondContact O-CG2 3.38Å; R510-V514 PolarHBondContact O-N 2.83Å; F511-V514 PolarHBondContact O-N 2.97Å; V514-T518 VanDerWaalsContact O-CB 3.22Å; V514-T518 WeakPolarHBondContact O-CB 3.27Å; V514-T518 PolarHBondContact O-N 3.47Å; V514-T518 PolarHBondContact O-OG1 2.88Å
515	L	93.9	Very high	93.9	Very high	20 Å²	20	68.9 Å²	68.9	11%	0.105	34%	0.34	C	S	.	.	H	α-helix	trans	-64.7	-46.2	176.2	-75.5	171.8	0	0	0	111.2	I402 T405 E406 F511 D512 T513 T518 T519	I402-L515 HydrophobicContact CG2-CD2 4.13Å; T405-L515 HydrophobicContact CG2-CD1 4.44Å; T405-L515 HydrophobicContact CG2-CD2 3.83Å; T405-L515 HydrophobicContact CG2-CG 3.72Å; E406-L515 HydrophobicContact CG-CD1 4.31Å; E406-L515 HydrophobicContact CG-CD2 3.65Å; F511-L515 WeakPolarHBondContact O-CB 3.43Å; F511-L515 VanDerWaalsContact O-CG 3.31Å; F511-L515 WeakPolarHBondContact O-CG 3.25Å; F511-L515 PolarHBondContact O-N 3.41Å; D512-L515 PolarHBondContact O-N 2.97Å; T513-L515 VanDerWaalsContact C-N 3.31Å; T513-L515 PolarHBondContact O-N 2.96Å; L515-T518 PolarHBondContact O-N 2.81Å; L515-T519 VanDerWaalsContact O-CB 3.27Å; L515-T519 WeakPolarHBondContact O-CB 3.33Å; L515-T519 PolarHBondContact O-N 2.73Å; L515-T519 PolarHBondContact O-OG1 3.17Å
516	M	94	Very high	94.3	Very high	122 Å²	122	67.1 Å²	67.1	60%	0.601	33%	0.33	S	S	*	.	H	α-helix	trans	-58.5	-54.7	176.5	-171.8	-175.6	75	0	0	111	D512 T513 T518 T519 E520	D512-M516 WeakPolarHBondContact O-CB 3.4Å; D512-M516 PolarHBondContact O-N 3.29Å; T513-M516 PolarHBondContact O-N 2.93Å; M516-T518 VanDerWaalsContact C-N 3.33Å; M516-T518 PolarHBondContact O-N 3.29Å; M516-T519 PolarHBondContact O-N 3.33Å; M516-T519 VanDerWaalsContact O-N 3.16Å; M516-E520 PolarHBondContact O-N 3.48Å
517	D	96.2	Very high	94.5	Very high	79 Å²	79	66 Å²	66	42%	0.422	33%	0.326	S	S	.	.	H	α-helix	trans	-60.8	-40.6	-178.8	-66.7	-9.9	0	0	0	112.1	T513 E521	T513-D517 WeakPolarHBondContact O-CB 3.48Å; T513-D517 VanDerWaalsContact O-CG 3.27Å; T513-D517 PolarHBondContact O-N 2.97Å; D517-E521 WeakPolarHBondContact O-CB 3.44Å; D517-E521 PolarHBondContact O-N 2.84Å
518	T	94.7	Very high	94.8	Very high	0 Å²	0	67 Å²	67	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-69.2	-36.7	178.6	-51.3	0	0	0	0	112.2	L398 R401 I402 V514 L515 M516 L522	L398-T518 HydrophobicContact CB-CG2 4.2Å; L398-T518 HydrophobicContact CD2-CG2 3.86Å; R401-T518 HydrophobicContact CB-CG2 4.07Å; R401-T518 HydrophobicContact CG-CG2 4.22Å; R401-T518 VanDerWaalsContact NE-CG2 3.26Å; R401-T518 PolarHBondContact NE-OG1 3.33Å; R401-T518 VanDerWaalsContact NH2-CA 3.32Å; R401-T518 VanDerWaalsContact NH2-CB 3.34Å; R401-T518 PolarHBondContact NH2-OG1 3.34Å; I402-T518 HydrophobicContact CD1-CG2 4.11Å; I402-T518 HydrophobicContact CG1-CG2 3.48Å; I402-T518 VanDerWaalsContact CG1-CG2 3.48Å; V514-T518 VanDerWaalsContact O-CB 3.22Å; V514-T518 WeakPolarHBondContact O-CB 3.27Å; V514-T518 PolarHBondContact O-N 3.47Å; V514-T518 PolarHBondContact O-OG1 2.88Å; L515-T518 PolarHBondContact O-N 2.81Å; M516-T518 VanDerWaalsContact C-N 3.33Å; M516-T518 PolarHBondContact O-N 3.29Å; T518-L522 WeakPolarHBondContact O-CB 3.48Å; T518-L522 PolarHBondContact O-N 2.99Å
519	T	95.5	Very high	95.1	Very high	71 Å²	71	67 Å²	67	44%	0.436	33%	0.325	S	S	.	.	H	α-helix	trans	-70.7	-40.7	178.9	-56.7	0	0	0	0	110.5	L515 M516 L522 E523	L515-T519 VanDerWaalsContact O-CB 3.27Å; L515-T519 WeakPolarHBondContact O-CB 3.33Å; L515-T519 PolarHBondContact O-N 2.73Å; L515-T519 PolarHBondContact O-OG1 3.17Å; M516-T519 PolarHBondContact O-N 3.33Å; M516-T519 VanDerWaalsContact O-N 3.16Å; T519-L522 WeakPolarHBondContact O-CB 3.23Å; T519-L522 PolarHBondContact O-N 2.67Å; T519-E523 PolarHBondContact O-N 3.38Å
520	E	96.6	Very high	95.1	Very high	111 Å²	111	67.3 Å²	67.3	52%	0.519	33%	0.326	S	S	.	.	H	α-helix	trans	-62.1	-45.6	172.8	-169.1	-175.7	168.3	0	0	111.5	M516 L522 E523 Q524	M516-E520 PolarHBondContact O-N 3.48Å; E520-L522 VanDerWaalsContact C-N 3.28Å; E520-L522 PolarHBondContact O-N 2.92Å; E520-E523 PolarHBondContact O-N 2.95Å; E520-Q524 WeakPolarHBondContact O-CG 3.28Å; E520-Q524 PolarHBondContact O-N 2.95Å; E520-Q524 PolarHBondContact OE1-NE2 2.95Å
521	E	96.8	Very high	95.1	Very high	44 Å²	44	62.9 Å²	62.9	21%	0.206	32%	0.315	C	S	.	.	H	α-helix	trans	-60.2	-39	175.7	-165.2	-172.4	164.3	0	0	111.7	R394 L398 R401 D517 V525	R394-E521 IonicContact CZ-OE1 2.78Å; R394-E521 VanDerWaalsContact CZ-OE1 3.29Å; R394-E521 IonicContact NE-OE1 3.09Å; R394-E521 PolarHBondContact NE-OE1 2.84Å; R394-E521 IonicContact NH2-OE1 2.65Å; R394-E521 PolarHBondContact NH2-OE1 3.04Å; L398-E521 HydrophobicContact CD1-CB 4.08Å; L398-E521 HydrophobicContact CD1-CG 3.75Å; L398-E521 HydrophobicContact CD2-CB 4.23Å; L398-E521 HydrophobicContact CD2-CG 4.05Å; L398-E521 VanDerWaalsContact CD2-OE2 3.24Å; L398-E521 WeakPolarHBondContact CD2-OE2 3.28Å; R401-E521 IonicContact CZ-OE2 2.81Å; R401-E521 IonicContact NH1-OE2 3.23Å; R401-E521 IonicContact NH2-OE2 3.7Å; R401-E521 PolarHBondContact NH2-OE2 2.83Å; D517-E521 WeakPolarHBondContact O-CB 3.44Å; D517-E521 PolarHBondContact O-N 2.84Å; E521-V525 VanDerWaalsContact O-CG2 3.27Å; E521-V525 WeakPolarHBondContact O-CG2 3.2Å; E521-V525 PolarHBondContact O-N 3.13Å; E521-V525 VanDerWaalsContact O-N 3.09Å
522	L	96.6	Very high	95.2	Very high	9 Å²	9	61.9 Å²	61.9	5%	0.047	31%	0.311	C	S	.	.	H	α-helix	trans	-64	-43.1	176.6	176.1	62.4	0	0	0	111.1	A395 L398 V399 I402 T518 T519 E520 V525 R526	A395-L522 HydrophobicContact CB-CD1 3.85Å; L398-L522 HydrophobicContact CB-CB 4.22Å; L398-L522 HydrophobicContact CB-CD1 4.22Å; L398-L522 HydrophobicContact CD1-CB 4.3Å; V399-L522 HydrophobicContact CG2-CD1 3.92Å; V399-L522 HydrophobicContact CG2-CD2 3.76Å; I402-L522 HydrophobicContact CD1-CD2 3.79Å; T518-L522 WeakPolarHBondContact O-CB 3.48Å; T518-L522 PolarHBondContact O-N 2.99Å; T519-L522 WeakPolarHBondContact O-CB 3.23Å; T519-L522 PolarHBondContact O-N 2.67Å; E520-L522 VanDerWaalsContact C-N 3.28Å; E520-L522 PolarHBondContact O-N 2.92Å; L522-V525 PolarHBondContact O-N 3.32Å; L522-R526 HydrophobicContact CD1-CG 4.43Å; L522-R526 WeakPolarHBondContact O-CG 3.48Å; L522-R526 PolarHBondContact O-N 3.06Å
523	E	95.9	Very high	95.1	Very high	96 Å²	96	61.4 Å²	61.4	45%	0.449	31%	0.307	S	S	.	.	H	α-helix	trans	-65.8	-43.3	179.5	-165.9	56.6	-154.1	0	0	111.6	T519 E520 V525 R526 T527	T519-E523 PolarHBondContact O-N 3.38Å; E520-E523 PolarHBondContact O-N 2.95Å; E523-V525 VanDerWaalsContact C-N 3.31Å; E523-V525 PolarHBondContact O-N 3.37Å; E523-R526 WeakPolarHBondContact O-CB 3.42Å; E523-R526 PolarHBondContact O-N 2.98Å; E523-R526 VanDerWaalsContact O-N 3.13Å; E523-R526 IonicContact OE2-NH1 3.52Å; E523-T527 PolarHBondContact O-N 3.48Å; E523-T527 PolarHBondContact O-OG1 3.41Å; E523-T527 VanDerWaalsContact O-OG1 3.11Å
524	Q	97	Very high	94.8	Very high	116 Å²	116	64.1 Å²	64.1	54%	0.542	31%	0.313	S	S	.	.	H	α-helix	trans	-58.1	-42.4	173.6	-68.6	175.2	16.4	0	0	112.2	E520 T527 R528	E520-Q524 WeakPolarHBondContact O-CG 3.28Å; E520-Q524 PolarHBondContact O-N 2.95Å; E520-Q524 PolarHBondContact OE1-NE2 2.95Å; Q524-T527 PolarHBondContact O-N 2.69Å; Q524-R528 PolarHBondContact O-N 3.25Å
525	V	96	Very high	94.6	Very high	10 Å²	10	65 Å²	65	6%	0.061	31%	0.314	C	S	.	.	H	α-helix	trans	-67.7	-37.8	177.1	173.8	0	0	0	0	111.4	C391 R394 A395 L398 E521 L522 E523 R528 I529	C391-V525 HydrophobicContact CB-CG1 4.18Å; C391-V525 WeakPolarHBondContact O-CG1 3.47Å; R394-V525 HydrophobicContact CB-CG1 4.31Å; R394-V525 HydrophobicContact CG-CG2 4.02Å; A395-V525 HydrophobicContact CB-CG1 3.97Å; L398-V525 HydrophobicContact CD1-CG2 4.09Å; E521-V525 VanDerWaalsContact O-CG2 3.27Å; E521-V525 WeakPolarHBondContact O-CG2 3.2Å; E521-V525 PolarHBondContact O-N 3.13Å; E521-V525 VanDerWaalsContact O-N 3.09Å; L522-V525 PolarHBondContact O-N 3.32Å; E523-V525 VanDerWaalsContact C-N 3.31Å; E523-V525 PolarHBondContact O-N 3.37Å; V525-R528 PolarHBondContact O-N 3.07Å; V525-I529 HydrophobicContact CG1-CD1 4.15Å; V525-I529 WeakPolarHBondContact O-CG1 3.39Å; V525-I529 PolarHBondContact O-N 3.28Å
526	R	95.8	Very high	94.2	Very high	99 Å²	99	64.4 Å²	64.4	37%	0.374	31%	0.311	S	S	.	.	H	α-helix	trans	-62.9	-46.5	174.9	-77	172.5	170.4	179.8	-4.3	111.7	L522 E523 R528 I529 E530	L522-R526 HydrophobicContact CD1-CG 4.43Å; L522-R526 WeakPolarHBondContact O-CG 3.48Å; L522-R526 PolarHBondContact O-N 3.06Å; E523-R526 WeakPolarHBondContact O-CB 3.42Å; E523-R526 PolarHBondContact O-N 2.98Å; E523-R526 VanDerWaalsContact O-N 3.13Å; E523-R526 IonicContact OE2-NH1 3.52Å; R526-R528 VanDerWaalsContact C-N 3.26Å; R526-R528 PolarHBondContact O-N 2.93Å; R526-I529 WeakPolarHBondContact O-CB 3.37Å; R526-I529 PolarHBondContact O-N 2.98Å; R526-E530 PolarHBondContact O-N 3.09Å
527	T	96.2	Very high	93.6	Very high	68 Å²	68	65 Å²	65	42%	0.417	31%	0.307	S	S	.	.	H	α-helix	trans	-58.7	-38.7	173.3	-50.5	0	0	0	0	111.4	E523 Q524 E530 T531	E523-T527 PolarHBondContact O-N 3.48Å; E523-T527 PolarHBondContact O-OG1 3.41Å; E523-T527 VanDerWaalsContact O-OG1 3.11Å; Q524-T527 PolarHBondContact O-N 2.69Å; T527-E530 PolarHBondContact O-N 2.97Å; T527-T531 WeakPolarHBondContact O-CG2 3.45Å; T527-T531 PolarHBondContact O-N 3.18Å; T527-T531 PolarHBondContact O-OG1 3.41Å; T527-T531 VanDerWaalsContact O-OG1 3.08Å
528	R	96.8	Very high	93	Very high	77 Å²	77	64.4 Å²	64.4	29%	0.291	30%	0.303	S	S	.	.	H	α-helix	trans	-66.1	-38	174.5	-173.5	56.7	-177.5	150.2	-3.5	112.6	E387 Q524 V525 R526 T531 L532 E535	E387-R528 VanDerWaalsContact CD-NH2 3.29Å; E387-R528 IonicContact OE1-CZ 3.33Å; E387-R528 IonicContact OE1-NE 2.76Å; E387-R528 PolarHBondContact OE1-NE 2.9Å; E387-R528 IonicContact OE1-NH2 2.86Å; E387-R528 PolarHBondContact OE1-NH2 3.19Å; E387-R528 IonicContact OE2-NH2 3.24Å; E387-R528 PolarHBondContact OE2-NH2 2.9Å; E387-R528 VanDerWaalsContact OE2-NH2 3.09Å; Q524-R528 PolarHBondContact O-N 3.25Å; V525-R528 PolarHBondContact O-N 3.07Å; R526-R528 VanDerWaalsContact C-N 3.26Å; R526-R528 PolarHBondContact O-N 2.93Å; R528-T531 WeakPolarHBondContact CA-OG1 3.41Å; R528-T531 PolarHBondContact NH1-OG1 2.91Å; R528-T531 PolarHBondContact O-N 2.69Å; R528-T531 PolarHBondContact O-OG1 2.93Å; R528-L532 HydrophobicContact CG-CD1 3.98Å; R528-L532 HydrophobicContact CG-CG 4.35Å; R528-L532 VanDerWaalsContact CZ-CD2 3.48Å; R528-L532 VanDerWaalsContact NH2-CD2 3.3Å; R528-L532 WeakPolarHBondContact O-CB 3.22Å; R528-L532 VanDerWaalsContact O-CG 3.28Å; R528-L532 WeakPolarHBondContact O-CG 3.27Å; R528-L532 PolarHBondContact O-N 3.47Å; R528-E535 IonicContact NH1-OE1 3.23Å; R528-E535 PolarHBondContact NH1-OE1 3.13Å; R528-E535 IonicContact NH1-OE2 2.73Å
529	I	94.9	Very high	92.5	Very high	22 Å²	22	65.5 Å²	65.5	11%	0.113	31%	0.309	C	S	.	.	H	α-helix	trans	-59.9	-48.9	173.8	-72	166.4	0	0	0	110.3	L388 C391 R392 A395 V525 R526 T531 L532 E533	L388-I529 HydrophobicContact CD1-CB 4.32Å; L388-I529 HydrophobicContact CD1-CG1 4.39Å; L388-I529 HydrophobicContact CD1-CG2 3.85Å; C391-I529 HydrophobicContact CB-CD1 4.34Å; C391-I529 HydrophobicContact CB-CG1 3.67Å; R392-I529 HydrophobicContact CG-CD1 3.95Å; R392-I529 HydrophobicContact CG-CG1 4.3Å; A395-I529 HydrophobicContact CB-CD1 4.15Å; V525-I529 HydrophobicContact CG1-CD1 4.15Å; V525-I529 WeakPolarHBondContact O-CG1 3.39Å; V525-I529 PolarHBondContact O-N 3.28Å; R526-I529 WeakPolarHBondContact O-CB 3.37Å; R526-I529 PolarHBondContact O-N 2.98Å; I529-T531 PolarHBondContact O-N 3.32Å; I529-L532 PolarHBondContact O-N 3.36Å; I529-E533 HydrophobicContact CG2-CG 4.47Å; I529-E533 WeakPolarHBondContact O-CB 3.5Å; I529-E533 VanDerWaalsContact O-CG 3.31Å; I529-E533 WeakPolarHBondContact O-CG 3.35Å; I529-E533 PolarHBondContact O-N 3.28Å
530	E	92.4	Very high	91.6	Very high	120 Å²	120	64.4 Å²	64.4	56%	0.561	30%	0.299	S	S	*	.	H	α-helix	trans	-61.7	-42	180	-69.6	176.7	177.3	0	0	112.6	R526 T527 E533 K534	R526-E530 PolarHBondContact O-N 3.09Å; T527-E530 PolarHBondContact O-N 2.97Å; E530-E533 PolarHBondContact O-N 3.13Å; E530-K534 WeakPolarHBondContact O-CB 3.38Å; E530-K534 PolarHBondContact O-N 2.97Å
531	T	94.7	Very high	90.6	Very high	55 Å²	55	61.4 Å²	61.4	34%	0.337	29%	0.286	S	S	.	.	H	α-helix	trans	-66.4	-44.4	176.8	51.4	0	0	0	0	112	T527 R528 I529 E533 K534 E535	T527-T531 WeakPolarHBondContact O-CG2 3.45Å; T527-T531 PolarHBondContact O-N 3.18Å; T527-T531 PolarHBondContact O-OG1 3.41Å; T527-T531 VanDerWaalsContact O-OG1 3.08Å; R528-T531 WeakPolarHBondContact CA-OG1 3.41Å; R528-T531 PolarHBondContact NH1-OG1 2.91Å; R528-T531 PolarHBondContact O-N 2.69Å; R528-T531 PolarHBondContact O-OG1 2.93Å; I529-T531 PolarHBondContact O-N 3.32Å; T531-E533 PolarHBondContact O-N 2.94Å; T531-K534 WeakPolarHBondContact O-CB 3.24Å; T531-K534 PolarHBondContact O-N 3.44Å; T531-K534 VanDerWaalsContact O-N 3.16Å; T531-E535 WeakPolarHBondContact O-CG 3.39Å; T531-E535 PolarHBondContact O-N 3.17Å
532	L	93.3	Very high	89.7	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-61.1	-43	175	-76.9	170.4	0	0	0	112.3	L384 E387 L388 R528 I529 K534 E535 V536	L384-L532 HydrophobicContact CD2-CD2 3.62Å; E387-L532 HydrophobicContact CB-CD1 4.04Å; E387-L532 HydrophobicContact CB-CD2 4.22Å; E387-L532 HydrophobicContact CG-CD1 3.77Å; E387-L532 HydrophobicContact CG-CD2 4.29Å; L388-L532 HydrophobicContact CB-CB 4.48Å; L388-L532 HydrophobicContact CB-CD1 4.39Å; L388-L532 HydrophobicContact CD1-CB 4.18Å; R528-L532 HydrophobicContact CG-CD1 3.98Å; R528-L532 HydrophobicContact CG-CG 4.35Å; R528-L532 VanDerWaalsContact CZ-CD2 3.48Å; R528-L532 VanDerWaalsContact NH2-CD2 3.3Å; R528-L532 WeakPolarHBondContact O-CB 3.22Å; R528-L532 VanDerWaalsContact O-CG 3.28Å; R528-L532 WeakPolarHBondContact O-CG 3.27Å; R528-L532 PolarHBondContact O-N 3.47Å; I529-L532 PolarHBondContact O-N 3.36Å; L532-K534 VanDerWaalsContact C-N 3.28Å; L532-K534 PolarHBondContact O-N 3.17Å; L532-E535 PolarHBondContact O-N 3.19Å; L532-V536 WeakPolarHBondContact O-CG2 3.44Å; L532-V536 PolarHBondContact O-N 3.15Å
533	E	89.5	Confident	88.6	Confident	57 Å²	57	64.7 Å²	64.7	27%	0.266	30%	0.3	S	S	.	.	H	α-helix	trans	-64	-34.8	175.6	-73.3	177.4	174.2	0	0	111.9	L388 R392 I529 E530 T531 R537	L388-E533 HydrophobicContact CD1-CG 3.77Å; L388-E533 HydrophobicContact CD2-CG 3.98Å; R392-E533 IonicContact CZ-OE1 2.67Å; R392-E533 IonicContact NE-OE1 3.29Å; R392-E533 IonicContact NH2-OE1 3.38Å; R392-E533 PolarHBondContact NH2-OE1 2.84Å; I529-E533 HydrophobicContact CG2-CG 4.47Å; I529-E533 WeakPolarHBondContact O-CB 3.5Å; I529-E533 VanDerWaalsContact O-CG 3.31Å; I529-E533 WeakPolarHBondContact O-CG 3.35Å; I529-E533 PolarHBondContact O-N 3.28Å; E530-E533 PolarHBondContact O-N 3.13Å; T531-E533 PolarHBondContact O-N 2.94Å; E533-R537 WeakPolarHBondContact O-CB 3.25Å; E533-R537 VanDerWaalsContact O-CG 3.26Å; E533-R537 WeakPolarHBondContact O-CG 3.29Å; E533-R537 PolarHBondContact O-N 2.91Å; E533-R537 PolarHBondContact O-NE 2.8Å; E533-R537 VanDerWaalsContact O-NE 3.14Å
534	K	88.7	Confident	87.5	Confident	120 Å²	120	61.8 Å²	61.8	52%	0.522	29%	0.287	S	S	.	.	H	α-helix	trans	-66.2	-48.1	170.9	-173.8	-175.6	174.5	-175.1	0	111.7	E530 T531 L532 V536 R537 D538	E530-K534 WeakPolarHBondContact O-CB 3.38Å; E530-K534 PolarHBondContact O-N 2.97Å; T531-K534 WeakPolarHBondContact O-CB 3.24Å; T531-K534 PolarHBondContact O-N 3.44Å; T531-K534 VanDerWaalsContact O-N 3.16Å; L532-K534 VanDerWaalsContact C-N 3.28Å; L532-K534 PolarHBondContact O-N 3.17Å; K534-V536 PolarHBondContact O-N 2.79Å; K534-R537 PolarHBondContact O-N 3.36Å; K534-D538 WeakPolarHBondContact O-CB 3.36Å; K534-D538 VanDerWaalsContact O-CG 3.24Å; K534-D538 PolarHBondContact O-N 3.05Å
535	E	90.4	Very high	86.3	Confident	69 Å²	69	62.3 Å²	62.3	32%	0.322	29%	0.29	S	S	.	.	H	α-helix	trans	-59.4	-43.6	179.2	-71.7	170.6	-151.2	0	0	112.1	L384 R528 T531 L532 D538 I539	L384-E535 HydrophobicContact CD1-CB 3.86Å; L384-E535 HydrophobicContact CD2-CB 4.46Å; L384-E535 WeakPolarHBondContact CD2-OE2 3.48Å; R528-E535 IonicContact NH1-OE1 3.23Å; R528-E535 PolarHBondContact NH1-OE1 3.13Å; R528-E535 IonicContact NH1-OE2 2.73Å; T531-E535 WeakPolarHBondContact O-CG 3.39Å; T531-E535 PolarHBondContact O-N 3.17Å; L532-E535 PolarHBondContact O-N 3.19Å; E535-D538 PolarHBondContact O-N 3.05Å; E535-I539 WeakPolarHBondContact O-CG1 3.16Å; E535-I539 PolarHBondContact O-N 2.86Å
536	V	87	Confident	85.3	Confident	8 Å²	8	65.3 Å²	65.3	5%	0.048	30%	0.303	C	S	.	.	H	α-helix	trans	-59.5	-49.3	174.5	171.2	0	0	0	0	110.4	V381 L384 L385 L532 K534 D538 I539 E540	V381-V536 HydrophobicContact CG1-CG1 4.4Å; L384-V536 HydrophobicContact CB-CG2 3.55Å; L384-V536 HydrophobicContact CD1-CG2 3.93Å; L384-V536 HydrophobicContact CG-CG2 4.41Å; L385-V536 HydrophobicContact CD2-CG1 4.49Å; L385-V536 HydrophobicContact CD2-CG2 4.4Å; L532-V536 WeakPolarHBondContact O-CG2 3.44Å; L532-V536 PolarHBondContact O-N 3.15Å; K534-V536 PolarHBondContact O-N 2.79Å; V536-D538 VanDerWaalsContact C-N 3.34Å; V536-D538 PolarHBondContact O-N 2.84Å; V536-I539 PolarHBondContact O-N 2.81Å; V536-E540 HydrophobicContact CG1-CG 4.34Å; V536-E540 WeakPolarHBondContact O-CG 3.34Å; V536-E540 PolarHBondContact O-N 2.84Å
537	R	80.3	Confident	84.6	Confident	135 Å²	135	62.1 Å²	62.1	51%	0.509	29%	0.293	S	S	.	.	H	α-helix	trans	-59.7	-42.7	178	-76.8	-178.2	-65	-154.6	-0.4	112.3	E533 K534 I539 E540 L541	E533-R537 WeakPolarHBondContact O-CB 3.25Å; E533-R537 VanDerWaalsContact O-CG 3.26Å; E533-R537 WeakPolarHBondContact O-CG 3.29Å; E533-R537 PolarHBondContact O-N 2.91Å; E533-R537 PolarHBondContact O-NE 2.8Å; E533-R537 VanDerWaalsContact O-NE 3.14Å; K534-R537 PolarHBondContact O-N 3.36Å; R537-I539 VanDerWaalsContact C-N 3.33Å; R537-I539 PolarHBondContact O-N 2.81Å; R537-E540 PolarHBondContact O-N 3.16Å; R537-L541 WeakPolarHBondContact O-CB 3.17Å; R537-L541 WeakPolarHBondContact O-CD1 3.07Å; R537-L541 VanDerWaalsContact O-CG 3.28Å; R537-L541 WeakPolarHBondContact O-CG 3.33Å; R537-L541 PolarHBondContact O-N 2.97Å
538	D	84.3	Confident	84	Confident	65 Å²	65	60.4 Å²	60.4	35%	0.348	29%	0.286	S	S	.	.	H	α-helix	trans	-65.4	-36.7	-179.6	-69.9	-12.4	0	0	0	111.4	K534 E535 V536 K542	K534-D538 WeakPolarHBondContact O-CB 3.36Å; K534-D538 VanDerWaalsContact O-CG 3.24Å; K534-D538 PolarHBondContact O-N 3.05Å; E535-D538 PolarHBondContact O-N 3.05Å; V536-D538 VanDerWaalsContact C-N 3.34Å; V536-D538 PolarHBondContact O-N 2.84Å; D538-K542 VanDerWaalsContact O-CG 3.28Å; D538-K542 WeakPolarHBondContact O-CG 3.31Å; D538-K542 PolarHBondContact O-N 2.82Å; D538-K542 VanDerWaalsContact O-N 3.07Å
539	I	84.2	Confident	83.6	Confident	23 Å²	23	57.9 Å²	57.9	12%	0.118	28%	0.276	C	S	.	.	H	α-helix	trans	-71.2	-44.2	174.4	-67.5	173.3	0	0	0	111.2	W377 C380 V381 L384 E535 V536 R537 L541 K542 Q543	W377-I539 HydrophobicContact CB-CG2 4.4Å; W377-I539 HydrophobicContact CD2-CG2 4.44Å; W377-I539 HydrophobicContact CE3-CG2 3.63Å; W377-I539 HydrophobicContact CZ3-CG2 4.3Å; C380-I539 HydrophobicContact CB-CD1 3.98Å; V381-I539 HydrophobicContact CG2-CB 4.19Å; V381-I539 HydrophobicContact CG2-CG2 3.55Å; L384-I539 HydrophobicContact CD1-CD1 3.59Å; E535-I539 WeakPolarHBondContact O-CG1 3.16Å; E535-I539 PolarHBondContact O-N 2.86Å; V536-I539 PolarHBondContact O-N 2.81Å; R537-I539 VanDerWaalsContact C-N 3.33Å; R537-I539 PolarHBondContact O-N 2.81Å; I539-L541 VanDerWaalsContact C-N 3.29Å; I539-L541 PolarHBondContact O-N 2.77Å; I539-K542 PolarHBondContact O-N 2.88Å; I539-Q543 HydrophobicContact CG2-CG 4.44Å; I539-Q543 WeakPolarHBondContact O-CG 3.4Å; I539-Q543 PolarHBondContact O-N 2.86Å
540	E	77.3	Confident	83.5	Confident	48 Å²	48	59 Å²	59	22%	0.224	28%	0.281	C	S	.	.	H	α-helix	trans	-60.2	-40.6	175.9	-72.6	178.7	157.7	0	0	111.3	Y22 V536 R537 Q543 D544	Y22-E540 PolarHBondContact OH-OE1 3Å; V536-E540 HydrophobicContact CG1-CG 4.34Å; V536-E540 WeakPolarHBondContact O-CG 3.34Å; V536-E540 PolarHBondContact O-N 2.84Å; R537-E540 PolarHBondContact O-N 3.16Å; E540-Q543 PolarHBondContact O-N 2.78Å; E540-D544 WeakPolarHBondContact O-CB 3.4Å; E540-D544 PolarHBondContact O-N 2.89Å
541	L	73.9	Confident	83.6	Confident	49 Å²	49	53.2 Å²	53.2	26%	0.257	25%	0.254	S	S	.	.	H	α-helix	trans	-58.7	-49.2	172.5	-81.9	161.2	0	0	0	111.7	R537 I539 Q543 D544 E545	R537-L541 WeakPolarHBondContact O-CB 3.17Å; R537-L541 WeakPolarHBondContact O-CD1 3.07Å; R537-L541 VanDerWaalsContact O-CG 3.28Å; R537-L541 WeakPolarHBondContact O-CG 3.33Å; R537-L541 PolarHBondContact O-N 2.97Å; I539-L541 VanDerWaalsContact C-N 3.29Å; I539-L541 PolarHBondContact O-N 2.77Å; L541-Q543 VanDerWaalsContact C-N 3.35Å; L541-Q543 PolarHBondContact O-N 2.89Å; L541-D544 PolarHBondContact O-N 3.34Å; L541-E545 WeakPolarHBondContact O-CB 3.49Å; L541-E545 VanDerWaalsContact O-CG 3.3Å; L541-E545 WeakPolarHBondContact O-CG 3.36Å; L541-E545 PolarHBondContact O-N 3.03Å
542	K	77.8	Confident	83.7	Confident	101 Å²	101	51.4 Å²	51.4	44%	0.439	24%	0.244	S	C	.	.	H	α-helix	trans	-60	-44.5	176.8	-74.1	170.1	-175.8	175.6	0	111.8	W377 D538 I539 D544 E545 H546	W377-K542 HydrophobicContact CH2-CD 4.22Å; W377-K542 HydrophobicContact CZ3-CD 4.41Å; D538-K542 VanDerWaalsContact O-CG 3.28Å; D538-K542 WeakPolarHBondContact O-CG 3.31Å; D538-K542 PolarHBondContact O-N 2.82Å; D538-K542 VanDerWaalsContact O-N 3.07Å; I539-K542 PolarHBondContact O-N 2.88Å; K542-D544 VanDerWaalsContact C-N 3.33Å; K542-D544 PolarHBondContact O-N 3.08Å; K542-E545 PolarHBondContact O-N 3.44Å; K542-H546 PolarHBondContact O-CD2 3.48Å; K542-H546 PolarHBondContact O-N 2.84Å
543	Q	74.7	Confident	83.8	Confident	20 Å²	20	51.4 Å²	51.4	9%	0.093	24%	0.244	C	C	.	.	H	α-helix	trans	-58.7	-47.4	175.6	-72.1	-176.8	34.8	0	0	111.1	W377 I539 E540 L541 E545 H546 L547	W377-Q543 VanDerWaalsContact CB-CD 3.46Å; W377-Q543 HydrophobicContact CB-CG 3.46Å; W377-Q543 VanDerWaalsContact CB-CG 3.46Å; W377-Q543 HydrophobicContact CD2-CG 4.27Å; W377-Q543 HydrophobicContact CG-CG 3.64Å; I539-Q543 HydrophobicContact CG2-CG 4.44Å; I539-Q543 WeakPolarHBondContact O-CG 3.4Å; I539-Q543 PolarHBondContact O-N 2.86Å; E540-Q543 PolarHBondContact O-N 2.78Å; L541-Q543 VanDerWaalsContact C-N 3.35Å; L541-Q543 PolarHBondContact O-N 2.89Å; Q543-E545 VanDerWaalsContact C-N 3.34Å; Q543-E545 PolarHBondContact O-N 2.87Å; Q543-H546 PolarHBondContact O-N 2.73Å; Q543-H546 VanDerWaalsContact O-N 3.17Å; Q543-L547 PolarHBondContact O-N 3.37Å
544	D	71.8	Confident	84	Confident	35 Å²	35	49.9 Å²	49.9	19%	0.187	24%	0.237	C	C	.	.	H	α-helix	trans	-63.9	-36.6	179.2	-81.9	-26.7	0	0	0	112.9	P343 E540 L541 K542 H546 L547 R549 R573	P343-D544 HydrophobicContact CB-CB 4.22Å; E540-D544 WeakPolarHBondContact O-CB 3.4Å; E540-D544 PolarHBondContact O-N 2.89Å; L541-D544 PolarHBondContact O-N 3.34Å; K542-D544 VanDerWaalsContact C-N 3.33Å; K542-D544 PolarHBondContact O-N 3.08Å; D544-H546 VanDerWaalsContact C-N 3.28Å; D544-L547 PolarHBondContact O-N 3.26Å; D544-R549 PolarHBondContact O-NH1 3.26Å; D544-R549 PolarHBondContact O-NH2 3.01Å; D544-R549 VanDerWaalsContact O-NH2 3.07Å; D544-R549 IonicContact OD1-NH2 3.56Å; D544-R549 PolarHBondContact OD1-NH2 3.09Å; D544-R573 IonicContact OD2-CZ 3.38Å; D544-R573 IonicContact OD2-NH1 2.7Å; D544-R573 PolarHBondContact OD2-NH1 3.45Å; D544-R573 IonicContact OD2-NH2 2.58Å; D544-R573 PolarHBondContact OD2-NH2 3.16Å
545	E	72.1	Confident	84.3	Confident	128 Å²	128	44.1 Å²	44.1	60%	0.598	21%	0.212	S	C	*	.	H	α-helix	trans	-67.9	-28.8	175.4	-75.7	175.2	-178.9	0	0	112.2	L541 K542 Q543 L547	L541-E545 WeakPolarHBondContact O-CB 3.49Å; L541-E545 VanDerWaalsContact O-CG 3.3Å; L541-E545 WeakPolarHBondContact O-CG 3.36Å; L541-E545 PolarHBondContact O-N 3.03Å; K542-E545 PolarHBondContact O-N 3.44Å; Q543-E545 VanDerWaalsContact C-N 3.34Å; Q543-E545 PolarHBondContact O-N 2.87Å; E545-L547 PolarHBondContact O-N 2.96Å
546	H	75.8	Confident	84.4	Confident	73 Å²	73	45 Å²	45	34%	0.338	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	1.6	173.7	-82.8	-74.8	0	0	0	113.8	L370 K542 Q543 D544	L370-H546 WeakPolarHBondContact CB-O 3.3Å; L370-H546 VanDerWaalsContact CG-O 3.31Å; L370-H546 WeakPolarHBondContact CG-O 3.44Å; L370-H546 PolarHBondContact N-O 3.09Å; K542-H546 PolarHBondContact O-CD2 3.48Å; K542-H546 PolarHBondContact O-N 2.84Å; Q543-H546 PolarHBondContact O-N 2.73Å; Q543-H546 VanDerWaalsContact O-N 3.17Å; D544-H546 VanDerWaalsContact C-N 3.28Å
547	L	79.9	Confident	84.6	Confident	31 Å²	31	44.8 Å²	44.8	16%	0.162	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	118.9	171.2	-63	178.2	0	0	0	111	Q543 D544 E545 R549	Q543-L547 PolarHBondContact O-N 3.37Å; D544-L547 PolarHBondContact O-N 3.26Å; E545-L547 PolarHBondContact O-N 2.96Å; L547-R549 PolarHBondContact O-N 2.9Å; L547-R549 PolarHBondContact O-NH1 3.23Å
548	A	83.4	Confident	85	Confident	33 Å²	33	45.6 Å²	45.6	27%	0.273	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	112.7	166.5	0	0	0	0	0	109.7	A367 K368 L370	A367-A548 CarbonylContact C-O 3.57Å; A367-A548 WeakPolarHBondContact CA-O 3.23Å; K368-A548 PolarHBondContact N-O 2.8Å; K368-A548 PolarHBondContact O-N 2.79Å; L370-A548 HydrophobicContact CD1-CB 4.38Å; L370-A548 HydrophobicContact CD2-CB 3.87Å; L370-A548 HydrophobicContact CG-CB 4.08Å
549	R	88.9	Confident	85.4	Confident	23 Å²	23	48.8 Å²	48.8	9%	0.087	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	130.5	179.2	-62.6	175.6	-174.2	77.9	-2.4	110.3	L341 P343 F365 S366 A367 D544 L547	L341-R549 HydrophobicContact CB-CB 4.02Å; L341-R549 HydrophobicContact CD1-CB 4.47Å; L341-R549 VanDerWaalsContact CD1-O 3.3Å; L341-R549 WeakPolarHBondContact CD1-O 3.21Å; P343-R549 VanDerWaalsContact CA-CZ 3.42Å; P343-R549 PolarHBondContact O-NH2 3.27Å; F365-R549 HydrophobicContact CE2-CB 4.03Å; F365-R549 HydrophobicContact CE2-CG 4.37Å; F365-R549 HydrophobicContact CZ-CB 4.07Å; F365-R549 HydrophobicContact CZ-CG 3.92Å; S366-R549 CarbonylContact O-C 3.5Å; S366-R549 WeakPolarHBondContact O-CA 3.36Å; A367-R549 HydrophobicContact CB-CG 4.24Å; D544-R549 PolarHBondContact O-NH1 3.26Å; D544-R549 PolarHBondContact O-NH2 3.01Å; D544-R549 VanDerWaalsContact O-NH2 3.07Å; D544-R549 IonicContact OD1-NH2 3.56Å; D544-R549 PolarHBondContact OD1-NH2 3.09Å; L547-R549 PolarHBondContact O-N 2.9Å; L547-R549 PolarHBondContact O-NH1 3.23Å
550	E	92.9	Very high	85.8	Confident	45 Å²	45	51.7 Å²	51.7	21%	0.21	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	139.2	179.7	-63.2	176.1	153.4	0	0	110.2	V337 F338 E339 F365 S366 K368	V337-E550 HydrophobicContact CG1-CB 4.48Å; F338-E550 WeakPolarHBondContact O-CA 3.36Å; E339-E550 HydrophobicContact CG-CG 4.39Å; F365-E550 WeakPolarHBondContact CA-O 3.18Å; S366-E550 PolarHBondContact N-O 3.03Å; S366-E550 PolarHBondContact O-N 2.83Å; K368-E550 IonicContact NZ-OE2 3.98Å; K368-E550 PolarHBondContact NZ-OE2 2.65Å
551	L	95.6	Very high	86.5	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	118.3	170.3	172.7	69.1	0	0	0	108.8	M303 V337 F338 L341 I350 V352 V363 S364 V553 V567	M303-L551 HydrophobicContact CE-CD2 4.29Å; V337-L551 CarbonylContact C-O 3.53Å; V337-L551 WeakPolarHBondContact CA-O 3.35Å; F338-L551 HydrophobicContact CB-CB 4.26Å; F338-L551 HydrophobicContact CD2-CB 4.37Å; F338-L551 HydrophobicContact CD2-CD2 3.94Å; F338-L551 HydrophobicContact CD2-CG 4.18Å; F338-L551 PolarHBondContact N-O 3.34Å; F338-L551 PolarHBondContact O-N 3.31Å; L341-L551 HydrophobicContact CD1-CB 4.09Å; L341-L551 HydrophobicContact CD2-CB 3.95Å; I350-L551 HydrophobicContact CD1-CD1 4.43Å; I350-L551 HydrophobicContact CG2-CD1 3.94Å; I350-L551 HydrophobicContact CG2-CD2 4.01Å; V352-L551 HydrophobicContact CG2-CD2 4.47Å; V363-L551 HydrophobicContact CG1-CD1 3.6Å; S364-L551 CarbonylContact O-C 3.59Å; S364-L551 WeakPolarHBondContact O-CA 3.41Å; L551-V553 HydrophobicContact CD2-CG2 4.5Å; L551-V553 HydrophobicContact CG-CG2 4.26Å; L551-V567 HydrophobicContact CD2-CG1 3.71Å
552	S	95.4	Very high	87.4	Confident	16 Å²	16	54.8 Å²	54.8	11%	0.112	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	126.5	175.6	179.2	0	0	0	0	110.8	E335 V363 S364	E335-S552 VanDerWaalsContact CD-OG 3.3Å; E335-S552 WeakPolarHBondContact CG-OG 3.43Å; E335-S552 PolarHBondContact OE1-OG 3.11Å; V363-S552 CarbonylContact C-O 3.58Å; V363-S552 WeakPolarHBondContact CA-O 3.49Å; S364-S552 PolarHBondContact N-O 3.5Å; S364-S552 PolarHBondContact O-N 2.81Å
553	V	95.2	Very high	88.1	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	113	177.6	-175.3	0	0	0	0	108.4	V336 F338 V352 I360 D362 V363 L551 V555 M565	V336-V553 HydrophobicContact CB-CB 4.37Å; V336-V553 PolarHBondContact N-O 3.39Å; V336-V553 PolarHBondContact O-N 2.92Å; F338-V553 HydrophobicContact CD2-CG2 4.49Å; F338-V553 HydrophobicContact CE2-CG2 4.06Å; V352-V553 HydrophobicContact CG1-CG1 4.13Å; V352-V553 HydrophobicContact CG1-CG2 4.28Å; V352-V553 HydrophobicContact CG2-CG2 3.98Å; I360-V553 HydrophobicContact CG1-CG1 4.49Å; I360-V553 HydrophobicContact CG2-CG1 4.05Å; D362-V553 WeakPolarHBondContact O-CA 3.27Å; V363-V553 HydrophobicContact CG1-CG2 4.44Å; V363-V553 HydrophobicContact CG2-CG1 4.35Å; L551-V553 HydrophobicContact CD2-CG2 4.5Å; L551-V553 HydrophobicContact CG-CG2 4.26Å; V553-V555 HydrophobicContact CG1-CG2 3.78Å; V553-M565 HydrophobicContact CG1-CE 4.12Å
554	L	94.8	Very high	89	Confident	25 Å²	25	51.4 Å²	51.4	13%	0.131	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	118.8	176.7	-166.2	67.3	0	0	0	109.4	I333 E335 L361 D362	I333-L554 HydrophobicContact CG2-CD1 3.42Å; I333-L554 VanDerWaalsContact CG2-CD1 3.42Å; I333-L554 HydrophobicContact CG2-CD2 4.22Å; I333-L554 HydrophobicContact CG2-CG 3.7Å; E335-L554 HydrophobicContact CB-CD1 4.32Å; L361-L554 HydrophobicContact CB-CB 4.18Å; L361-L554 HydrophobicContact CB-CD2 3.98Å; L361-L554 HydrophobicContact CB-CG 4.11Å; L361-L554 HydrophobicContact CD1-CD2 4.03Å; L361-L554 HydrophobicContact CD1-CG 4.17Å; L361-L554 PolarHBondContact N-O 2.87Å; D362-L554 HydrophobicContact CB-CB 4.02Å; D362-L554 PolarHBondContact O-N 2.96Å
555	V	94	Very high	90.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	134.8	-174.4	-176.5	0	0	0	0	110.5	F328 I333 T334 V336 I354 A358 T359 V553 P557 M565	F328-V555 HydrophobicContact CE1-CB 4.25Å; F328-V555 HydrophobicContact CE1-CG1 4.29Å; F328-V555 HydrophobicContact CE2-CG1 4.14Å; F328-V555 HydrophobicContact CZ-CB 4.14Å; F328-V555 HydrophobicContact CZ-CG1 3.92Å; F328-V555 HydrophobicContact CZ-CG2 4.23Å; I333-V555 WeakPolarHBondContact CA-O 3.38Å; T334-V555 PolarHBondContact N-O 3.4Å; T334-V555 PolarHBondContact O-N 3.34Å; V336-V555 HydrophobicContact CG2-CG2 4.31Å; I354-V555 HydrophobicContact CD1-CG1 3.72Å; I354-V555 HydrophobicContact CD1-CG2 4.33Å; A358-V555 HydrophobicContact CB-CG1 3.82Å; T359-V555 WeakPolarHBondContact O-CA 3.38Å; V553-V555 HydrophobicContact CG1-CG2 3.78Å; V555-P557 WeakPolarHBondContact O-CD 3.2Å; V555-M565 HydrophobicContact CG2-CE 3.81Å
556	E	93	Very high	91.2	Very high	88 Å²	88	44.8 Å²	44.8	41%	0.411	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	103.3	169.5	-175.3	-178.6	-157.1	0	0	109.9	I333 A358 T359 L361	I333-E556 HydrophobicContact CG1-CG 4.47Å; A358-E556 CarbonylContact C-O 3.5Å; A358-E556 WeakPolarHBondContact CA-O 3.49Å; T359-E556 PolarHBondContact N-O 3.44Å; T359-E556 PolarHBondContact O-N 3.4Å; T359-E556 PolarHBondContact OG1-O 2.85Å; L361-E556 HydrophobicContact CD1-CB 4Å; L361-E556 HydrophobicContact CD2-CB 4.19Å; L361-E556 HydrophobicContact CG-CB 4.03Å
557	P	91.3	Very high	92.2	Very high	3 Å²	3	41.4 Å²	41.4	2%	0.019	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	130.3	177.6	-8.2	26.4	0	0	0	111.3	F328 S331 D332 V555	F328-P557 HydrophobicContact CB-CB 3.51Å; F328-P557 HydrophobicContact CB-CG 3.39Å; F328-P557 HydrophobicContact CD1-CG 3.84Å; F328-P557 HydrophobicContact CD2-CG 4.39Å; F328-P557 HydrophobicContact CG-CB 4.06Å; F328-P557 HydrophobicContact CG-CG 3.64Å; S331-P557 PolarHBondContact N-O 2.92Å; S331-P557 VanDerWaalsContact N-O 3.17Å; D332-P557 WeakPolarHBondContact O-CD 3.43Å; V555-P557 WeakPolarHBondContact O-CD 3.2Å
558	R	89.6	Confident	93	Very high	151 Å²	151	41.3 Å²	41.3	57%	0.57	21%	0.21	S	C	*	.	S	Bend	trans	-86.5	-25.8	175.8	-58.8	-179.7	-179.1	179.9	-0.2	112.7	A357	A357-R558 HydrophobicContact CB-CB 4.19Å; A357-R558 WeakPolarHBondContact O-CA 3.34Å; A357-R558 WeakPolarHBondContact O-CB 3.11Å; A357-R558 PolarHBondContact O-N 2.85Å
559	E	91.7	Very high	93.6	Very high	132 Å²	132	39.8 Å²	39.8	62%	0.617	20%	0.198	S	C	*	.	S	Bend	trans	-137	152.2	179.6	-63.3	174.8	-167	0	0	110.2	A357 G561	A357-E559 HydrophobicContact CB-CB 3.89Å; A357-E559 HydrophobicContact CB-CG 3.79Å; E559-G561 PolarHBondContact O-N 3.06Å
560	T	92.4	Very high	93.9	Very high	84 Å²	84	39.8 Å²	39.8	52%	0.515	20%	0.2	S	C	.	.	S	Bend	trans	-76.5	121.7	173.2	-61.9	0	0	0	0	109	F328 A330	F328-T560 VanDerWaalsContact O-CA 3.31Å; F328-T560 WeakPolarHBondContact O-CA 3.32Å; F328-T560 WeakPolarHBondContact O-CG2 3.24Å; A330-T560 WeakPolarHBondContact CB-OG1 3.45Å; A330-T560 PolarHBondContact N-OG1 2.87Å
561	G	91.9	Very high	93.9	Very high	24 Å²	24	37.6 Å²	37.6	25%	0.247	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.5	178.6	-177.4	0	0	0	0	0	113.9	R327 F328 E559	R327-G561 WeakPolarHBondContact CA-O 3.34Å; F328-G561 PolarHBondContact N-O 3.08Å; F328-G561 PolarHBondContact O-N 2.94Å; E559-G561 PolarHBondContact O-N 3.06Å
562	Q	92.8	Very high	93.7	Very high	139 Å²	139	40.7 Å²	40.7	65%	0.65	21%	0.207	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-83	138.1	168.5	-74.5	-179.7	-13.5	0	0	109.7	P326 R327	P326-Q562 WeakPolarHBondContact O-CA 3.39Å; R327-Q562 HydrophobicContact CB-CG 4.12Å; R327-Q562 HydrophobicContact CG-CG 4.31Å
563	V	92	Very high	93.5	Very high	7 Å²	7	44 Å²	44	4%	0.042	22%	0.216	C	C	.	.			trans	-125.7	137.2	178.1	-179.7	0	0	0	0	107.8	R325 P326 F328 I354 R355 A358	R325-V563 WeakPolarHBondContact CA-O 3.28Å; P326-V563 VanDerWaalsContact CD-O 3.28Å; P326-V563 WeakPolarHBondContact CD-O 3.46Å; P326-V563 PolarHBondContact O-N 3.01Å; F328-V563 HydrophobicContact CD2-CB 4.02Å; F328-V563 HydrophobicContact CD2-CG2 3.81Å; F328-V563 HydrophobicContact CE2-CB 3.97Å; F328-V563 HydrophobicContact CE2-CG2 4.25Å; I354-V563 HydrophobicContact CD1-CG1 3.67Å; I354-V563 HydrophobicContact CG1-CG1 3.27Å; R355-V563 VanDerWaalsContact O-CG1 3.27Å; R355-V563 WeakPolarHBondContact O-CG1 3.32Å; A358-V563 HydrophobicContact CB-CG1 4.25Å; A358-V563 HydrophobicContact CB-CG2 4.26Å
564	E	94.5	Very high	93.4	Very high	43 Å²	43	44.5 Å²	44.5	20%	0.201	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	124.1	176.9	-177.6	172.2	-103.7	0	0	109.3	R323 R325 R355	R323-E564 VanDerWaalsContact CD-OE1 3.3Å; R323-E564 WeakPolarHBondContact CD-OE1 3.49Å; R323-E564 HydrophobicContact CG-CG 4.18Å; R325-E564 IonicContact CZ-OE1 3.68Å; R325-E564 IonicContact NE-OE1 2.69Å; R325-E564 IonicContact NH2-OE1 2.69Å; R325-E564 PolarHBondContact NH2-OE1 3.26Å; R355-E564 HydrophobicContact CB-CB 4.31Å; R355-E564 PolarHBondContact N-O 2.78Å; R355-E564 PolarHBondContact O-N 3.13Å
565	M	95.4	Very high	93.4	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	132.9	175.6	179	-173.4	-69.9	0	0	109.1	I324 P326 F328 V336 F338 V352 E353 I354 V553 V555 V567	I324-M565 HydrophobicContact CG2-CB 3.82Å; I324-M565 HydrophobicContact CG2-CG 4.2Å; I324-M565 HydrophobicContact CG2-SD 4.24Å; I324-M565 PolarHBondContact N-O 3.25Å; I324-M565 PolarHBondContact O-N 3.03Å; P326-M565 HydrophobicContact CG-CB 4.48Å; P326-M565 HydrophobicContact CG-CE 4.47Å; F328-M565 HydrophobicContact CZ-CE 4.49Å; V336-M565 HydrophobicContact CG1-SD 4.5Å; V336-M565 HydrophobicContact CG2-CE 4.31Å; F338-M565 HydrophobicContact CE2-SD 4.05Å; F338-M565 HydrophobicContact CZ-SD 3.79Å; V352-M565 HydrophobicContact CG1-CG 3.89Å; V352-M565 HydrophobicContact CG1-SD 4.11Å; E353-M565 CarbonylContact O-C 3.57Å; E353-M565 VanDerWaalsContact O-CA 3.27Å; E353-M565 WeakPolarHBondContact O-CA 3.42Å; I354-M565 HydrophobicContact CD1-CE 4.06Å; V553-M565 HydrophobicContact CG1-CE 4.12Å; V555-M565 HydrophobicContact CG2-CE 3.81Å; M565-V567 HydrophobicContact CG-CG2 4.38Å; M565-V567 HydrophobicContact SD-CG2 4.44Å
566	L	95.7	Very high	93.6	Very high	24 Å²	24	44 Å²	44	13%	0.126	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	129.4	175.2	-57.8	177	0	0	0	108.7	R322 R323 V352 E353	R322-L566 WeakPolarHBondContact O-CA 3.18Å; R323-L566 HydrophobicContact CB-CD2 3.69Å; R323-L566 HydrophobicContact CG-CD2 3.79Å; V352-L566 CarbonylContact C-O 3.58Å; V352-L566 WeakPolarHBondContact CA-O 3.39Å; E353-L566 HydrophobicContact CB-CB 4.22Å; E353-L566 PolarHBondContact N-O 3.07Å; E353-L566 PolarHBondContact O-N 2.93Å
567	V	96.5	Very high	93.7	Very high	2 Å²	2	47 Å²	47	1%	0.012	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	116	174.8	-174.2	0	0	0	0	107.2	M303 C321 R322 F338 R351 V352 L551 M565 Y569	M303-V567 HydrophobicContact CE-CG1 4.04Å; C321-V567 WeakPolarHBondContact CA-O 3.34Å; R322-V567 PolarHBondContact N-O 2.75Å; R322-V567 PolarHBondContact O-N 3.24Å; F338-V567 HydrophobicContact CE2-CG2 4.03Å; F338-V567 HydrophobicContact CZ-CG2 3.9Å; R351-V567 WeakPolarHBondContact O-CA 3.36Å; V352-V567 HydrophobicContact CG1-CG2 4.48Å; V352-V567 HydrophobicContact CG2-CG1 4.45Å; V352-V567 HydrophobicContact CG2-CG2 4.45Å; L551-V567 HydrophobicContact CD2-CG1 3.71Å; M565-V567 HydrophobicContact CG-CG2 4.38Å; M565-V567 HydrophobicContact SD-CG2 4.44Å; V567-Y569 HydrophobicContact CG1-CD1 4.08Å; V567-Y569 HydrophobicContact CG1-CE1 4.35Å
568	S	95.7	Very high	94	Very high	28 Å²	28	47.7 Å²	47.7	20%	0.196	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	136.3	179.1	-60.2	0	0	0	0	110.7	I320 C321 I350 R351	I320-S568 CarbonylContact O-C 3.58Å; I320-S568 VanDerWaalsContact O-CA 3.24Å; I320-S568 WeakPolarHBondContact O-CA 3.45Å; C321-S568 PolarHBondContact SG-OG 3.28Å; I350-S568 CarbonylContact C-O 3.55Å; I350-S568 WeakPolarHBondContact CA-O 3.49Å; R351-S568 PolarHBondContact N-O 3.03Å; R351-S568 PolarHBondContact O-N 3.17Å
569	Y	95.4	Very high	94.3	Very high	1 Å²	1	41.2 Å²	41.2	0%	0.004	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	155.5	178.1	51	-92.9	0	0	0	111	M303 I320 R322 I345 V567 V571	M303-Y569 HydrophobicContact CE-CE1 4.25Å; M303-Y569 HydrophobicContact CG-CE1 4.44Å; M303-Y569 HydrophobicContact SD-CE1 4.02Å; I320-Y569 HydrophobicContact CB-CD2 4.16Å; I320-Y569 HydrophobicContact CB-CE2 3.76Å; I320-Y569 HydrophobicContact CD1-CE2 3.96Å; I320-Y569 HydrophobicContact CG1-CE2 4.39Å; I320-Y569 HydrophobicContact CG2-CE1 4.32Å; I320-Y569 HydrophobicContact CG2-CE2 3.88Å; I320-Y569 PolarHBondContact N-O 2.78Å; I320-Y569 PolarHBondContact O-N 3Å; R322-Y569 VanDerWaalsContact CD-OH 3.27Å; R322-Y569 WeakPolarHBondContact CD-OH 3.3Å; R322-Y569 PolarHBondContact NE-OH 2.95Å; I345-Y569 HydrophobicContact CD1-CD1 4.32Å; I345-Y569 HydrophobicContact CD1-CD2 3.77Å; I345-Y569 HydrophobicContact CD1-CE2 4.37Å; I345-Y569 HydrophobicContact CD1-CG 3.74Å; I345-Y569 HydrophobicContact CG1-CD2 3.92Å; I345-Y569 HydrophobicContact CG1-CG 4.17Å; V567-Y569 HydrophobicContact CG1-CD1 4.08Å; V567-Y569 HydrophobicContact CG1-CE1 4.35Å; Y569-V571 HydrophobicContact CD2-CG1 3.83Å; Y569-V571 HydrophobicContact CE2-CG1 3.86Å
570	V	95.3	Very high	94.6	Very high	23 Å²	23	35 Å²	35	14%	0.139	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	137.1	173.9	174.6	0	0	0	0	108.8	R317 A318 L319 D346 S349	R317-V570 HydrophobicContact CB-CG1 4.09Å; R317-V570 HydrophobicContact CG-CG1 4.04Å; A318-V570 CarbonylContact O-C 3.59Å; A318-V570 VanDerWaalsContact O-CA 3.26Å; A318-V570 WeakPolarHBondContact O-CA 3.4Å; L319-V570 HydrophobicContact CD1-CG2 4.11Å; D346-V570 HydrophobicContact CB-CB 4.31Å; D346-V570 PolarHBondContact N-O 2.83Å; S349-V570 PolarHBondContact OG-N 3.41Å
571	V	94.3	Very high	94.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	139.4	169.6	-65.9	0	0	0	0	109.7	R317 A318 I320 A344 Y569 C574 T603 W607	R317-V571 CarbonylContact C-O 3.59Å; R317-V571 WeakPolarHBondContact CA-O 3.22Å; R317-V571 VanDerWaalsContact CB-O 3.32Å; R317-V571 WeakPolarHBondContact CB-O 3.43Å; A318-V571 HydrophobicContact CB-CG2 3.95Å; A318-V571 PolarHBondContact N-O 2.83Å; A318-V571 PolarHBondContact O-N 2.81Å; I320-V571 HydrophobicContact CD1-CB 4.46Å; I320-V571 HydrophobicContact CD1-CG1 3.96Å; I320-V571 HydrophobicContact CD1-CG2 3.59Å; I320-V571 HydrophobicContact CG1-CG2 4.15Å; A344-V571 HydrophobicContact CB-CB 4.39Å; A344-V571 CarbonylContact O-C 3.59Å; A344-V571 WeakPolarHBondContact O-CA 3.41Å; Y569-V571 HydrophobicContact CD2-CG1 3.83Å; Y569-V571 HydrophobicContact CE2-CG1 3.86Å; V571-C574 PolarHBondContact O-SG 3.46Å; V571-T603 HydrophobicContact CB-CG2 4.17Å; V571-T603 HydrophobicContact CG2-CG2 3.85Å; V571-W607 HydrophobicContact CG2-CZ2 3.96Å
572	N	90.5	Very high	94.9	Very high	65 Å²	65	30.2 Å²	30.2	35%	0.348	15%	0.151	S	C	.	.			trans	-89	-165.6	173.4	-61.7	-30.9	0	0	0	109.8	A344 C574 T603	A344-N572 WeakPolarHBondContact CB-O 3.15Å; A344-N572 PolarHBondContact O-N 3.45Å; N572-C574 PolarHBondContact O-N 2.84Å; N572-C574 PolarHBondContact O-SG 3.18Å; N572-C574 VanDerWaalsContact O-SG 3.42Å; N572-T603 VanDerWaalsContact O-CG2 3.29Å; N572-T603 WeakPolarHBondContact O-CG2 3.46Å
573	R	90.4	Very high	95	Very high	84 Å²	84	26.6 Å²	26.6	32%	0.317	13%	0.131	S	C	.	.	S	Bend	trans	56.9	33.2	176.7	-57	-175.1	175.7	152.1	5.7	113.7	A344 D544 A602	A344-R573 HydrophobicContact CB-CB 4.2Å; A344-R573 HydrophobicContact CB-CG 4.21Å; D544-R573 IonicContact OD2-CZ 3.38Å; D544-R573 IonicContact OD2-NH1 2.7Å; D544-R573 PolarHBondContact OD2-NH1 3.45Å; D544-R573 IonicContact OD2-NH2 2.58Å; D544-R573 PolarHBondContact OD2-NH2 3.16Å; R573-A602 HydrophobicContact CB-CB 4.43Å; R573-A602 PolarHBondContact O-N 3.48Å
574	C	94.4	Very high	94.9	Very high	12 Å²	12	26.3 Å²	26.3	8%	0.081	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	162.9	175.6	57.1	0	0	0	0	109.7	D316 R317 A318 V571 N572 Q600 Q601 T603 W607	D316-C574 CarbonylContact C-O 3.57Å; D316-C574 VanDerWaalsContact O-O 3.05Å; R317-C574 PolarHBondContact N-O 2.85Å; A318-C574 VanDerWaalsContact CB-SG 3.58Å; A318-C574 PolarHBondContact N-SG 2.86Å; V571-C574 PolarHBondContact O-SG 3.46Å; N572-C574 PolarHBondContact O-N 2.84Å; N572-C574 PolarHBondContact O-SG 3.18Å; N572-C574 VanDerWaalsContact O-SG 3.42Å; C574-Q600 CarbonylContact C-O 3.47Å; C574-Q600 WeakPolarHBondContact CA-O 3.43Å; C574-Q600 WeakPolarHBondContact CB-O 3.28Å; C574-Q601 HydrophobicContact CB-CB 3.56Å; C574-T603 HydrophobicContact CB-CG2 3.76Å; C574-W607 HydrophobicContact CB-CH2 3.48Å; C574-W607 VanDerWaalsContact CB-CH2 3.48Å; C574-W607 HydrophobicContact CB-CZ2 4Å; C574-W607 HydrophobicContact CB-CZ3 4.44Å
575	G	95.3	Very high	94.7	Very high	10 Å²	10	26.6 Å²	26.6	10%	0.103	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.2	-178.3	176.4	0	0	0	0	0	111.4	F314 Q600	F314-G575 VanDerWaalsContact O-CA 3.28Å; F314-G575 WeakPolarHBondContact O-CA 3.36Å; G575-Q600 PolarHBondContact N-O 2.94Å; G575-Q600 PolarHBondContact O-N 2.9Å
576	W	96.3	Very high	93.9	Very high	4 Å²	4	31 Å²	31	2%	0.015	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	155.8	171.5	75.8	-81.1	0	0	0	111.9	V313 F314 L315 P578 M598 V599 L614 S615 T616 L806 L862	V313-W576 HydrophobicContact CG1-CB 4.17Å; V313-W576 HydrophobicContact CG1-CG 4.46Å; V313-W576 PolarHBondContact O-NE1 3.3Å; F314-W576 VanDerWaalsContact C-CD1 3.47Å; F314-W576 PolarHBondContact O-N 2.93Å; L315-W576 HydrophobicContact CD2-CD2 4.49Å; L315-W576 HydrophobicContact CD2-CZ2 4.27Å; L315-W576 WeakPolarHBondContact CD2-O 3.37Å; W576-P578 HydrophobicContact CZ3-CB 4.17Å; W576-M598 CarbonylContact C-O 3.37Å; W576-M598 WeakPolarHBondContact CA-O 3.46Å; W576-V599 HydrophobicContact CB-CG2 4.07Å; W576-L614 HydrophobicContact CB-CD2 4.05Å; W576-L614 HydrophobicContact CD2-CB 3.87Å; W576-L614 HydrophobicContact CD2-CD1 3.98Å; W576-L614 HydrophobicContact CD2-CD2 4.17Å; W576-L614 HydrophobicContact CD2-CG 4.23Å; W576-L614 HydrophobicContact CE3-CB 4.31Å; W576-L614 HydrophobicContact CE3-CD1 3.76Å; W576-L614 HydrophobicContact CE3-CG 4.5Å; W576-L614 HydrophobicContact CG-CB 4.27Å; W576-L614 HydrophobicContact CG-CD1 4.41Å; W576-L614 HydrophobicContact CG-CD2 3.81Å; W576-L614 HydrophobicContact CG-CG 4.4Å; W576-L614 HydrophobicContact CH2-CB 4.24Å; W576-L614 HydrophobicContact CZ2-CB 3.84Å; W576-L614 HydrophobicContact CZ3-CB 4.47Å; W576-L614 HydrophobicContact CZ3-CD1 4.11Å; W576-S615 PolarHBondContact NE1-O 3.24Å; W576-T616 HydrophobicContact CH2-CG2 4.3Å; W576-T616 HydrophobicContact CZ2-CG2 3.84Å; W576-L806 HydrophobicContact CH2-CD1 3.71Å; W576-L806 HydrophobicContact CZ2-CD1 4.4Å; W576-L806 HydrophobicContact CZ3-CD1 4.38Å; W576-L862 HydrophobicContact CH2-CD1 3.48Å; W576-L862 VanDerWaalsContact CH2-CD1 3.48Å; W576-L862 HydrophobicContact CZ2-CD1 4.21Å; W576-L862 HydrophobicContact CZ3-CD1 4.25Å
577	K	96.4	Very high	93.2	Very high	152 Å²	152	37.8 Å²	37.8	66%	0.661	19%	0.19	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-130.7	145.7	173	-63.2	-177.8	-178.4	-179.8	0	110.7	M598	K577-M598 PolarHBondContact N-O 3.26Å; K577-M598 PolarHBondContact O-N 2.92Å
578	P	96.7	Very high	92.5	Very high	17 Å²	17	42.7 Å²	42.7	11%	0.11	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	145.3	174.1	31.1	-36.3	0	0	0	111.2	W576 Y580 Y595 L862 A863	W576-P578 HydrophobicContact CZ3-CB 4.17Å; P578-Y580 HydrophobicContact CB-CE2 4.05Å; P578-Y595 HydrophobicContact CB-CE2 3.8Å; P578-L862 HydrophobicContact CB-CB 3.94Å; P578-L862 HydrophobicContact CB-CD1 4.39Å; P578-L862 HydrophobicContact CG-CB 3.83Å; P578-L862 HydrophobicContact CG-CD1 4.39Å; P578-A863 WeakPolarHBondContact CG-O 3.38Å
579	A	97.2	Very high	91.9	Very high	15 Å²	15	42.6 Å²	42.6	12%	0.124	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	154.8	170.5	0	0	0	0	0	110.3	Y596 M598	A579-Y596 PolarHBondContact N-O 2.8Å; A579-Y596 WeakPolarHBondContact O-CA 3.44Å; A579-Y596 WeakPolarHBondContact O-CB 3.35Å; A579-Y596 PolarHBondContact O-N 3.39Å; A579-M598 HydrophobicContact CB-CG 3.62Å; A579-M598 HydrophobicContact CB-SD 4.14Å
580	Y	96.8	Very high	91.6	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.008	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	143.3	-171.7	-56.7	-85.4	0	0	0	112.8	P578 I593 V594 Y595 I861 L862 P865 T866 N867 I880	P578-Y580 HydrophobicContact CB-CE2 4.05Å; Y580-I593 HydrophobicContact CD1-CG2 3.72Å; Y580-I593 HydrophobicContact CG-CG2 4.4Å; Y580-V594 WeakPolarHBondContact CA-O 3.31Å; Y580-Y595 AromaticContact CD1-CD2 3.92Å; Y580-Y595 HydrophobicContact CD1-CD2 3.92Å; Y580-Y595 HydrophobicContact CD1-CG 4.21Å; Y580-Y595 HydrophobicContact CE1-CD1 4.17Å; Y580-Y595 AromaticContact CE1-CD2 3.23Å; Y580-Y595 HydrophobicContact CE1-CD2 3.23Å; Y580-Y595 HydrophobicContact CE1-CE1 4.49Å; Y580-Y595 AromaticContact CE1-CE2 3.69Å; Y580-Y595 HydrophobicContact CE1-CE2 3.69Å; Y580-Y595 AromaticContact CE1-CG 3.54Å; Y580-Y595 HydrophobicContact CE1-CG 3.54Å; Y580-Y595 AromaticContact CZ-CD2 3.66Å; Y580-Y595 AromaticContact CZ-CE2 3.6Å; Y580-Y595 WeakPolarHBondContact OH-CE2 3.47Å; Y580-Y595 VanDerWaalsContact OH-CZ 3.31Å; Y580-I861 HydrophobicContact CE1-CG2 3.87Å; Y580-I861 HydrophobicContact CE2-CG2 4.41Å; Y580-L862 WeakPolarHBondContact CE2-O 3.47Å; Y580-L862 PolarHBondContact OH-N 3.42Å; Y580-L862 PolarHBondContact OH-O 2.79Å; Y580-P865 PolarHBondContact N-O 3.03Å; Y580-T866 CarbonylContact O-C 3.56Å; Y580-T866 VanDerWaalsContact O-CA 3.3Å; Y580-T866 WeakPolarHBondContact O-CA 3.35Å; Y580-N867 PolarHBondContact O-N 3.33Å; Y580-I880 HydrophobicContact CD2-CG2 3.33Å; Y580-I880 HydrophobicContact CE2-CG2 3.37Å; Y580-I880 HydrophobicContact CG-CG2 4.01Å
581	D	96.4	Very high	91.5	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.021	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	118.5	158.8	-72.8	-7.3	0	0	0	108.3	I593 V594 Y596 N867 Y869	D581-I593 WeakPolarHBondContact O-CA 3.47Å; D581-V594 HydrophobicContact CB-CB 4.26Å; D581-V594 HydrophobicContact CB-CG2 4.48Å; D581-V594 PolarHBondContact N-O 2.79Å; D581-V594 PolarHBondContact O-N 2.85Å; D581-Y596 HydrophobicContact CB-CE2 3.95Å; D581-Y596 PolarHBondContact OD2-OH 3.49Å; D581-N867 CarbonylContact C-O 3.58Å; D581-N867 WeakPolarHBondContact CA-O 3.34Å; D581-N867 WeakPolarHBondContact OD1-CB 3.21Å; D581-N867 PolarHBondContact OD1-ND2 3Å; D581-Y869 HydrophobicContact CB-CD2 4.35Å; D581-Y869 HydrophobicContact CB-CE2 3.95Å
582	I	94.9	Very high	91.5	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.01	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	123.2	171.3	-65.6	-178.7	0	0	0	108.4	I584 M591 K592 I593 T866 N867 I868 Y869 C891 L893	I582-I584 HydrophobicContact CG2-CG1 4.37Å; I582-M591 HydrophobicContact CG2-CG 3.67Å; I582-M591 HydrophobicContact CG2-SD 3.72Å; I582-K592 CarbonylContact C-O 3.6Å; I582-K592 WeakPolarHBondContact CA-O 3.49Å; I582-I593 HydrophobicContact CD1-CD1 4.41Å; I582-I593 HydrophobicContact CG1-CD1 4.35Å; I582-I593 HydrophobicContact CG1-CG1 4.07Å; I582-I593 HydrophobicContact CG1-CG2 4.24Å; I582-T866 HydrophobicContact CB-CG2 4.1Å; I582-T866 HydrophobicContact CD1-CG2 3.51Å; I582-T866 HydrophobicContact CG1-CG2 3.44Å; I582-T866 VanDerWaalsContact CG1-CG2 3.44Å; I582-N867 PolarHBondContact N-O 3.03Å; I582-I868 HydrophobicContact CB-CG1 4.5Å; I582-I868 CarbonylContact O-C 3.47Å; I582-I868 WeakPolarHBondContact O-CA 3.38Å; I582-Y869 PolarHBondContact O-N 3.17Å; I582-C891 HydrophobicContact CD1-CB 4.14Å; I582-L893 HydrophobicContact CG2-CD2 4.44Å
583	R	93.9	Very high	91.7	Very high	63 Å²	63	43.6 Å²	43.6	24%	0.238	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	120.9	175.6	-61.4	-177.4	176.4	-87.7	-13.4	109.6	F585 M591 K592 Y869 N872	R583-F585 HydrophobicContact CB-CE2 3.86Å; R583-F585 HydrophobicContact CB-CZ 4.07Å; R583-M591 CarbonylContact O-C 3.52Å; R583-M591 VanDerWaalsContact O-CA 3.31Å; R583-M591 WeakPolarHBondContact O-CA 3.43Å; R583-K592 HydrophobicContact CB-CB 4.44Å; R583-K592 PolarHBondContact N-O 2.82Å; R583-K592 PolarHBondContact O-N 3.09Å; R583-Y869 CarbonylContact C-O 3.51Å; R583-Y869 WeakPolarHBondContact CA-O 3.27Å; R583-Y869 HydrophobicContact CG-CD2 4.27Å; R583-Y869 HydrophobicContact CG-CG 4.47Å; R583-N872 PolarHBondContact NH1-OD1 2.84Å
584	I	91.6	Very high	92	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	133.3	175.9	-61.6	145.3	0	0	0	107.9	I582 Y835 I868 Y869 D871 I875 L893	I582-I584 HydrophobicContact CG2-CG1 4.37Å; I584-Y835 HydrophobicContact CG1-CE1 4.42Å; I584-Y835 HydrophobicContact CG2-CE1 4.08Å; I584-Y835 WeakPolarHBondContact CG2-OH 3.39Å; I584-I868 HydrophobicContact CD1-CG2 3.86Å; I584-Y869 PolarHBondContact N-O 2.68Å; I584-D871 PolarHBondContact O-N 2.92Å; I584-I875 HydrophobicContact CD1-CD1 4.48Å; I584-L893 HydrophobicContact CD1-CB 4.09Å; I584-L893 HydrophobicContact CD1-CD1 3.35Å; I584-L893 HydrophobicContact CD1-CD2 3.87Å; I584-L893 HydrophobicContact CD1-CG 3.93Å; I584-L893 HydrophobicContact CG1-CD1 4.01Å
585	F	88.7	Confident	92.1	Very high	49 Å²	49	39.7 Å²	39.7	22%	0.215	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	107.8	174.8	-62.2	-83	0	0	0	108	R583 N587 D588 G589 T590 K592	R583-F585 HydrophobicContact CB-CE2 3.86Å; R583-F585 HydrophobicContact CB-CZ 4.07Å; F585-N587 VanDerWaalsContact C-N 3.29Å; F585-N587 PolarHBondContact O-N 3.44Å; F585-D588 WeakPolarHBondContact CB-OD1 3.42Å; F585-G589 WeakPolarHBondContact O-CA 3.14Å; F585-G589 PolarHBondContact O-N 3.45Å; F585-T590 PolarHBondContact N-O 3.27Å; F585-T590 PolarHBondContact O-N 2.89Å; F585-K592 HydrophobicContact CD2-CG 4.33Å; F585-K592 HydrophobicContact CE2-CB 4.22Å; F585-K592 HydrophobicContact CE2-CD 3.68Å; F585-K592 HydrophobicContact CE2-CG 3.72Å; F585-K592 HydrophobicContact CZ-CD 4.26Å
586	N	80.2	Confident	92.2	Very high	93 Å²	93	40.3 Å²	40.3	50%	0.497	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-30.1	-173.2	-73.9	-31.4	0	0	0	112.2	D588 D871	N586-D588 PolarHBondContact O-N 3.42Å; N586-D871 WeakPolarHBondContact CB-OD2 3.5Å; N586-D871 PolarHBondContact N-OD1 3.28Å; N586-D871 PolarHBondContact ND2-OD2 3.06Å
587	N	79.8	Confident	92.2	Very high	166 Å²	166	40.1 Å²	40.1	89%	0.888	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-37.3	-176.3	-71.8	-8.9	0	0	0	113.4	F585	F585-N587 VanDerWaalsContact C-N 3.29Å; F585-N587 PolarHBondContact O-N 3.44Å
588	D	81.4	Confident	92.3	Very high	105 Å²	105	35.4 Å²	35.4	56%	0.561	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112.3	-3.2	-179.1	65.5	7.4	0	0	0	113.2	F585 N586 T590	F585-D588 WeakPolarHBondContact CB-OD1 3.42Å; N586-D588 PolarHBondContact O-N 3.42Å; D588-T590 HydrophobicContact CB-CG2 4.15Å; D588-T590 VanDerWaalsContact CG-CG2 3.41Å; D588-T590 PolarHBondContact O-N 3.01Å; D588-T590 VanDerWaalsContact OD1-CB 3.3Å; D588-T590 WeakPolarHBondContact OD1-CB 3.39Å; D588-T590 WeakPolarHBondContact OD1-CG2 3.44Å; D588-T590 PolarHBondContact OD1-N 3.38Å; D588-T590 PolarHBondContact OD1-OG1 3.43Å; D588-T590 WeakPolarHBondContact OD2-CG2 3.46Å; D588-T590 PolarHBondContact OD2-OG1 2.99Å; D588-T590 VanDerWaalsContact OD2-OG1 3.13Å
589	G	83.3	Confident	92.3	Very high	27 Å²	27	34.6 Å²	34.6	28%	0.278	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.8	17.4	-178.6	0	0	0	0	0	113.4	F585 Y835	F585-G589 WeakPolarHBondContact O-CA 3.14Å; F585-G589 PolarHBondContact O-N 3.45Å; G589-Y835 WeakPolarHBondContact O-CE2 3.48Å
590	T	90.1	Very high	92.3	Very high	27 Å²	27	37.2 Å²	37.2	17%	0.166	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	157.9	-178.8	67.7	0	0	0	0	111.8	F585 D588 Y835	F585-T590 PolarHBondContact N-O 3.27Å; F585-T590 PolarHBondContact O-N 2.89Å; D588-T590 HydrophobicContact CB-CG2 4.15Å; D588-T590 VanDerWaalsContact CG-CG2 3.41Å; D588-T590 PolarHBondContact O-N 3.01Å; D588-T590 VanDerWaalsContact OD1-CB 3.3Å; D588-T590 WeakPolarHBondContact OD1-CB 3.39Å; D588-T590 WeakPolarHBondContact OD1-CG2 3.44Å; D588-T590 PolarHBondContact OD1-N 3.38Å; D588-T590 PolarHBondContact OD1-OG1 3.43Å; D588-T590 WeakPolarHBondContact OD2-CG2 3.46Å; D588-T590 PolarHBondContact OD2-OG1 2.99Å; D588-T590 VanDerWaalsContact OD2-OG1 3.13Å; T590-Y835 PolarHBondContact O-OH 2.98Å
591	M	92.8	Very high	92.2	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	128.4	172.5	179.9	-179.8	69.7	0	0	109	I582 R583 I593 L831 P833 A851 A853 F889	I582-M591 HydrophobicContact CG2-CG 3.67Å; I582-M591 HydrophobicContact CG2-SD 3.72Å; R583-M591 CarbonylContact O-C 3.52Å; R583-M591 VanDerWaalsContact O-CA 3.31Å; R583-M591 WeakPolarHBondContact O-CA 3.43Å; M591-I593 HydrophobicContact CE-CD1 4.12Å; M591-I593 HydrophobicContact CE-CG1 4.31Å; M591-L831 HydrophobicContact CE-CB 4.01Å; M591-L831 HydrophobicContact CE-CD1 3.79Å; M591-L831 PolarHBondContact N-O 3.02Å; M591-L831 PolarHBondContact O-N 3.35Å; M591-L831 VanDerWaalsContact O-O 3.04Å; M591-P833 HydrophobicContact CB-CG 3.62Å; M591-P833 HydrophobicContact CE-CB 4.22Å; M591-P833 HydrophobicContact CE-CG 4.34Å; M591-P833 HydrophobicContact SD-CG 4.29Å; M591-A851 HydrophobicContact SD-CB 4.27Å; M591-A853 HydrophobicContact CE-CB 3.78Å; M591-F889 HydrophobicContact CE-CZ 4.42Å
592	K	94.3	Very high	92	Very high	81 Å²	81	38.4 Å²	38.4	35%	0.352	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	126.7	173	-59.6	-171.7	177.7	-97.9	0	109	I582 R583 F585 L829 D830	I582-K592 CarbonylContact C-O 3.6Å; I582-K592 WeakPolarHBondContact CA-O 3.49Å; R583-K592 HydrophobicContact CB-CB 4.44Å; R583-K592 PolarHBondContact N-O 2.82Å; R583-K592 PolarHBondContact O-N 3.09Å; F585-K592 HydrophobicContact CD2-CG 4.33Å; F585-K592 HydrophobicContact CE2-CB 4.22Å; F585-K592 HydrophobicContact CE2-CD 3.68Å; F585-K592 HydrophobicContact CE2-CG 3.72Å; F585-K592 HydrophobicContact CZ-CD 4.26Å; K592-L829 WeakPolarHBondContact CA-O 3.24Å; K592-D830 WeakPolarHBondContact CD-OD1 3.46Å; K592-D830 WeakPolarHBondContact CE-OD1 3.47Å; K592-D830 VanDerWaalsContact CG-OD1 3.24Å; K592-D830 WeakPolarHBondContact CG-OD1 3.26Å; K592-D830 IonicContact NZ-OD1 3.82Å; K592-D830 PolarHBondContact NZ-OD1 3.42Å; K592-D830 IonicContact NZ-OD2 3.94Å
593	I	95.5	Very high	91.8	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	117	169.9	-48.3	-171.4	0	0	0	107.7	Y580 D581 I582 M591 L829 L831 I861 I880 F889	Y580-I593 HydrophobicContact CD1-CG2 3.72Å; Y580-I593 HydrophobicContact CG-CG2 4.4Å; D581-I593 WeakPolarHBondContact O-CA 3.47Å; I582-I593 HydrophobicContact CD1-CD1 4.41Å; I582-I593 HydrophobicContact CG1-CD1 4.35Å; I582-I593 HydrophobicContact CG1-CG1 4.07Å; I582-I593 HydrophobicContact CG1-CG2 4.24Å; M591-I593 HydrophobicContact CE-CD1 4.12Å; M591-I593 HydrophobicContact CE-CG1 4.31Å; I593-L829 HydrophobicContact CB-CB 4.16Å; I593-L829 PolarHBondContact N-O 2.95Å; I593-L829 PolarHBondContact O-N 3.47Å; I593-L831 HydrophobicContact CD1-CD1 3.76Å; I593-L831 HydrophobicContact CG1-CD1 4.16Å; I593-I861 HydrophobicContact CD1-CD1 4.49Å; I593-I880 HydrophobicContact CD1-CD1 4.19Å; I593-F889 HydrophobicContact CD1-CE2 4.03Å; I593-F889 HydrophobicContact CD1-CZ 3.82Å
594	V	96.5	Very high	91.5	Very high	13 Å²	13	37 Å²	37	8%	0.079	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	116.3	169	-169.7	0	0	0	0	107.9	Y580 D581 Y596 T825 L828	Y580-V594 WeakPolarHBondContact CA-O 3.31Å; D581-V594 HydrophobicContact CB-CB 4.26Å; D581-V594 HydrophobicContact CB-CG2 4.48Å; D581-V594 PolarHBondContact N-O 2.79Å; D581-V594 PolarHBondContact O-N 2.85Å; V594-Y596 HydrophobicContact CB-CE2 3.87Å; V594-Y596 HydrophobicContact CG1-CD1 4.16Å; V594-Y596 HydrophobicContact CG1-CD2 4.33Å; V594-Y596 HydrophobicContact CG1-CE1 3.47Å; V594-Y596 VanDerWaalsContact CG1-CE1 3.47Å; V594-Y596 HydrophobicContact CG1-CE2 3.66Å; V594-Y596 VanDerWaalsContact CG1-OH 3.28Å; V594-Y596 WeakPolarHBondContact CG1-OH 3.4Å; V594-T825 HydrophobicContact CG1-CG2 4.21Å; V594-L828 HydrophobicContact CB-CD2 4.09Å; V594-L828 HydrophobicContact CG1-CD2 3.65Å; V594-L828 HydrophobicContact CG2-CD2 3.76Å
595	Y	96.9	Very high	91.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	118.5	178.7	-173.7	-176.4	0	0	0	109.6	P578 Y580 L806 V826 G827 L862	P578-Y595 HydrophobicContact CB-CE2 3.8Å; Y580-Y595 AromaticContact CD1-CD2 3.92Å; Y580-Y595 HydrophobicContact CD1-CD2 3.92Å; Y580-Y595 HydrophobicContact CD1-CG 4.21Å; Y580-Y595 HydrophobicContact CE1-CD1 4.17Å; Y580-Y595 AromaticContact CE1-CD2 3.23Å; Y580-Y595 HydrophobicContact CE1-CD2 3.23Å; Y580-Y595 HydrophobicContact CE1-CE1 4.49Å; Y580-Y595 AromaticContact CE1-CE2 3.69Å; Y580-Y595 HydrophobicContact CE1-CE2 3.69Å; Y580-Y595 AromaticContact CE1-CG 3.54Å; Y580-Y595 HydrophobicContact CE1-CG 3.54Å; Y580-Y595 AromaticContact CZ-CD2 3.66Å; Y580-Y595 AromaticContact CZ-CE2 3.6Å; Y580-Y595 WeakPolarHBondContact OH-CE2 3.47Å; Y580-Y595 VanDerWaalsContact OH-CZ 3.31Å; Y595-L806 HydrophobicContact CE1-CD1 3.91Å; Y595-L806 HydrophobicContact CE1-CD2 4.42Å; Y595-L806 WeakPolarHBondContact OH-CD1 3.28Å; Y595-V826 HydrophobicContact CD1-CB 4.2Å; Y595-V826 HydrophobicContact CD1-CG1 3.92Å; Y595-V826 HydrophobicContact CD2-CB 4.48Å; Y595-V826 HydrophobicContact CE1-CG1 4.18Å; Y595-V826 HydrophobicContact CG-CB 4.09Å; Y595-V826 HydrophobicContact CG-CG1 4.33Å; Y595-V826 WeakPolarHBondContact O-CB 3.38Å; Y595-V826 PolarHBondContact O-N 2.8Å; Y595-G827 PolarHBondContact N-O 2.97Å; Y595-G827 PolarHBondContact O-N 3.03Å; Y595-L862 VanDerWaalsContact OH-CD1 3.29Å; Y595-L862 WeakPolarHBondContact OH-CD1 3.35Å; Y595-L862 WeakPolarHBondContact OH-CG 3.33Å
596	Y	97.2	Very high	91.8	Very high	24 Å²	24	37 Å²	37	9%	0.094	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	150.7	174.4	-55.2	-72.1	0	0	0	112.9	A579 D581 V594 R823 V824	A579-Y596 PolarHBondContact N-O 2.8Å; A579-Y596 WeakPolarHBondContact O-CA 3.44Å; A579-Y596 WeakPolarHBondContact O-CB 3.35Å; A579-Y596 PolarHBondContact O-N 3.39Å; D581-Y596 HydrophobicContact CB-CE2 3.95Å; D581-Y596 PolarHBondContact OD2-OH 3.49Å; V594-Y596 HydrophobicContact CB-CE2 3.87Å; V594-Y596 HydrophobicContact CG1-CD1 4.16Å; V594-Y596 HydrophobicContact CG1-CD2 4.33Å; V594-Y596 HydrophobicContact CG1-CE1 3.47Å; V594-Y596 VanDerWaalsContact CG1-CE1 3.47Å; V594-Y596 HydrophobicContact CG1-CE2 3.66Å; V594-Y596 VanDerWaalsContact CG1-OH 3.28Å; V594-Y596 WeakPolarHBondContact CG1-OH 3.4Å; Y596-R823 HydrophobicContact CD1-CG 3.43Å; Y596-R823 VanDerWaalsContact CD1-CG 3.43Å; Y596-R823 HydrophobicContact CD2-CG 4.39Å; Y596-R823 HydrophobicContact CE1-CG 4Å; Y596-R823 HydrophobicContact CG-CG 3.65Å; Y596-V824 CarbonylContact C-O 3.56Å; Y596-V824 WeakPolarHBondContact CA-O 3.38Å
597	G	96.9	Very high	92.5	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	128	155.4	0	0	0	0	0	109.8	V824	G597-V824 PolarHBondContact N-O 3.26Å; G597-V824 WeakPolarHBondContact O-CG2 3.41Å; G597-V824 PolarHBondContact O-N 3.47Å
598	M	97.2	Very high	93.1	Very high	52 Å²	52	31.2 Å²	31.2	26%	0.256	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	99.1	172.1	-59.3	-55	-60.3	0	0	107.9	W576 K577 A579 P821 R823	W576-M598 CarbonylContact C-O 3.37Å; W576-M598 WeakPolarHBondContact CA-O 3.46Å; K577-M598 PolarHBondContact N-O 3.26Å; K577-M598 PolarHBondContact O-N 2.92Å; A579-M598 HydrophobicContact CB-CG 3.62Å; A579-M598 HydrophobicContact CB-SD 4.14Å; M598-P821 HydrophobicContact CE-CB 3.72Å; M598-R823 HydrophobicContact CE-CB 4.04Å; M598-R823 HydrophobicContact SD-CB 3.78Å; M598-R823 HydrophobicContact SD-CG 3.83Å
599	V	97.4	Very high	93.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	127.8	-175.6	179.5	0	0	0	0	108.8	V313 W576 W607 M612 L614 I815 N822 V824	V313-V599 HydrophobicContact CG1-CG1 4.4Å; V313-V599 HydrophobicContact CG2-CG1 4.41Å; W576-V599 HydrophobicContact CB-CG2 4.07Å; V599-W607 HydrophobicContact CG1-CZ3 4.17Å; V599-M612 HydrophobicContact CB-CE 4.12Å; V599-M612 HydrophobicContact CG1-CE 3.85Å; V599-M612 HydrophobicContact CG2-CE 3.34Å; V599-L614 HydrophobicContact CG2-CD2 3.84Å; V599-I815 HydrophobicContact CG1-CD1 4.19Å; V599-I815 HydrophobicContact CG1-CG2 4.45Å; V599-N822 PolarHBondContact N-O 3.43Å; V599-N822 PolarHBondContact O-N 2.96Å; V599-V824 HydrophobicContact CG2-CG1 4.25Å; V599-V824 HydrophobicContact CG2-CG2 3.91Å
600	Q	96.2	Very high	93.6	Very high	71 Å²	71	35.1 Å²	35.1	33%	0.332	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	139.5	-179	-172.9	-177	17.4	0	0	108.8	C574 G575 N819	C574-Q600 CarbonylContact C-O 3.47Å; C574-Q600 WeakPolarHBondContact CA-O 3.43Å; C574-Q600 WeakPolarHBondContact CB-O 3.28Å; G575-Q600 PolarHBondContact N-O 2.94Å; G575-Q600 PolarHBondContact O-N 2.9Å; Q600-N819 WeakPolarHBondContact CG-O 3.28Å; Q600-N819 VanDerWaalsContact CG-OD1 3.3Å; Q600-N819 WeakPolarHBondContact CG-OD1 3.36Å; Q600-N819 PolarHBondContact NE2-O 2.85Å; Q600-N819 PolarHBondContact NE2-OD1 2.95Å
601	Q	95.1	Very high	93.7	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	142.8	-177	75.4	93.2	-5.9	0	0	112.8	C574 T603 E605 W607 I815 R816 C817 N819	C574-Q601 HydrophobicContact CB-CB 3.56Å; Q601-T603 HydrophobicContact CB-CG2 4.3Å; Q601-T603 PolarHBondContact OE1-OG1 3.14Å; Q601-E605 PolarHBondContact NE2-O 3.16Å; Q601-E605 PolarHBondContact OE1-O 3.49Å; Q601-W607 HydrophobicContact CB-CE3 4.28Å; Q601-W607 HydrophobicContact CB-CH2 3.74Å; Q601-W607 HydrophobicContact CB-CZ2 4.07Å; Q601-W607 HydrophobicContact CB-CZ3 3.83Å; Q601-W607 HydrophobicContact CG-CD2 4.23Å; Q601-W607 HydrophobicContact CG-CE3 4.05Å; Q601-W607 HydrophobicContact CG-CH2 4.35Å; Q601-W607 HydrophobicContact CG-CZ2 4.48Å; Q601-W607 HydrophobicContact CG-CZ3 4.11Å; Q601-I815 HydrophobicContact CG-CG2 4.07Å; Q601-I815 PolarHBondContact NE2-O 3.48Å; Q601-R816 WeakPolarHBondContact CG-O 3.38Å; Q601-R816 PolarHBondContact NE2-O 3.04Å; Q601-C817 VanDerWaalsContact CD-CA 3.5Å; Q601-C817 VanDerWaalsContact NE2-CB 3.33Å; Q601-N819 VanDerWaalsContact O-CA 3.3Å; Q601-N819 WeakPolarHBondContact O-CA 3.3Å; Q601-N819 PolarHBondContact O-N 3.32Å
602	A	92.4	Very high	93.9	Very high	30 Å²	30	41.1 Å²	41.1	25%	0.248	19%	0.194	C	C	.	.			trans	-136.9	46.9	174.8	0	0	0	0	0	109.2	R573 G604 N819	R573-A602 HydrophobicContact CB-CB 4.43Å; R573-A602 PolarHBondContact O-N 3.48Å; A602-G604 VanDerWaalsContact C-N 3.27Å; A602-G604 PolarHBondContact O-N 3.04Å; A602-N819 HydrophobicContact CB-CB 4.09Å
603	T	91.4	Very high	94	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.186	C	C	.	.	S	Bend	trans	-83.7	-1.2	-172.4	64.2	0	0	0	0	113.6	S342 P343 A344 V571 N572 C574 Q601 E605 W607	S342-T603 PolarHBondContact OG-O 2.65Å; P343-T603 VanDerWaalsContact CD-O 3.26Å; P343-T603 WeakPolarHBondContact CD-O 3.4Å; A344-T603 HydrophobicContact CB-CG2 4.48Å; V571-T603 HydrophobicContact CB-CG2 4.17Å; V571-T603 HydrophobicContact CG2-CG2 3.85Å; N572-T603 VanDerWaalsContact O-CG2 3.29Å; N572-T603 WeakPolarHBondContact O-CG2 3.46Å; C574-T603 HydrophobicContact CB-CG2 3.76Å; Q601-T603 HydrophobicContact CB-CG2 4.3Å; Q601-T603 PolarHBondContact OE1-OG1 3.14Å; T603-E605 VanDerWaalsContact C-N 3.26Å; T603-E605 WeakPolarHBondContact OG1-CG 3.32Å; T603-E605 PolarHBondContact OG1-O 3.17Å; T603-W607 HydrophobicContact CG2-CH2 4.38Å; T603-W607 HydrophobicContact CG2-CZ2 3.57Å; T603-W607 PolarHBondContact OG1-NE1 3.18Å
604	G	87.8	Confident	94.1	Very high	36 Å²	36	38.6 Å²	38.6	37%	0.371	19%	0.186	S	C	.	.	S	Bend	trans	77.7	8.1	-175.4	0	0	0	0	0	114.1	A602	A602-G604 VanDerWaalsContact C-N 3.27Å; A602-G604 PolarHBondContact O-N 3.04Å
605	E	90.8	Very high	94	Very high	2 Å²	2	38 Å²	38	1%	0.009	18%	0.182	C	C	.	.	S	Bend	trans	-141.1	144.7	173.9	62.5	178.6	153.2	0	0	111.4	F304 I320 R322 Q601 T603 C817	F304-E605 HydrophobicContact CD1-CB 3.74Å; F304-E605 HydrophobicContact CD1-CG 4.43Å; F304-E605 WeakPolarHBondContact CD1-OE2 3.32Å; F304-E605 HydrophobicContact CE1-CB 3.45Å; F304-E605 VanDerWaalsContact CE1-CB 3.45Å; F304-E605 HydrophobicContact CE1-CG 4.07Å; F304-E605 VanDerWaalsContact CE1-OE2 3.27Å; F304-E605 WeakPolarHBondContact CE1-OE2 3.31Å; F304-E605 HydrophobicContact CE2-CB 4.4Å; F304-E605 HydrophobicContact CG-CB 4.35Å; F304-E605 HydrophobicContact CZ-CB 3.81Å; I320-E605 WeakPolarHBondContact CD1-OE1 3.26Å; R322-E605 IonicContact CZ-OE2 3.9Å; R322-E605 IonicContact NE-OE2 3.18Å; R322-E605 IonicContact NH2-OE2 3.93Å; R322-E605 PolarHBondContact NH2-OE2 2.98Å; Q601-E605 PolarHBondContact NE2-O 3.16Å; Q601-E605 PolarHBondContact OE1-O 3.49Å; T603-E605 VanDerWaalsContact C-N 3.26Å; T603-E605 WeakPolarHBondContact OG1-CG 3.32Å; T603-E605 PolarHBondContact OG1-O 3.17Å; E605-C817 WeakPolarHBondContact O-CB 3.46Å
606	D	94	Very high	93.8	Very high	48 Å²	48	39 Å²	39	26%	0.257	19%	0.188	S	C	.	.			trans	-76.4	139.8	169.4	-72.5	-11.8	0	0	0	110.1	I814 R816 C817	D606-I814 HydrophobicContact CB-CD1 3.96Å; D606-I814 HydrophobicContact CB-CG1 4.09Å; D606-R816 VanDerWaalsContact OD1-CA 3.27Å; D606-R816 WeakPolarHBondContact OD1-CA 3.34Å; D606-C817 PolarHBondContact OD1-N 3.35Å; D606-C817 PolarHBondContact OD1-SG 3.01Å
607	W	95	Very high	93.2	Very high	1 Å²	1	38.6 Å²	38.6	0%	0.004	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-99.2	112.5	-178.6	-71	-9.4	0	0	0	111.5	M308 L311 V313 A318 I320 V571 C574 V599 Q601 T603 I814 I815	M308-W607 HydrophobicContact CE-CB 3.61Å; M308-W607 HydrophobicContact CE-CG 4.03Å; L311-W607 HydrophobicContact CD1-CD2 4.24Å; L311-W607 HydrophobicContact CD1-CE3 4.21Å; L311-W607 HydrophobicContact CD1-CH2 4.39Å; L311-W607 HydrophobicContact CD1-CZ2 4.46Å; L311-W607 HydrophobicContact CD1-CZ3 4.29Å; L311-W607 HydrophobicContact CD2-CD2 4.08Å; L311-W607 HydrophobicContact CD2-CE3 3.59Å; L311-W607 HydrophobicContact CD2-CG 4.5Å; L311-W607 HydrophobicContact CD2-CZ3 4.09Å; V313-W607 HydrophobicContact CG2-CH2 4.41Å; V313-W607 HydrophobicContact CG2-CZ3 3.92Å; A318-W607 HydrophobicContact CB-CH2 3.61Å; A318-W607 HydrophobicContact CB-CZ2 3.92Å; I320-W607 HydrophobicContact CD1-CZ2 4.37Å; V571-W607 HydrophobicContact CG2-CZ2 3.96Å; C574-W607 HydrophobicContact CB-CH2 3.48Å; C574-W607 VanDerWaalsContact CB-CH2 3.48Å; C574-W607 HydrophobicContact CB-CZ2 4Å; C574-W607 HydrophobicContact CB-CZ3 4.44Å; V599-W607 HydrophobicContact CG1-CZ3 4.17Å; Q601-W607 HydrophobicContact CB-CE3 4.28Å; Q601-W607 HydrophobicContact CB-CH2 3.74Å; Q601-W607 HydrophobicContact CB-CZ2 4.07Å; Q601-W607 HydrophobicContact CB-CZ3 3.83Å; Q601-W607 HydrophobicContact CG-CD2 4.23Å; Q601-W607 HydrophobicContact CG-CE3 4.05Å; Q601-W607 HydrophobicContact CG-CH2 4.35Å; Q601-W607 HydrophobicContact CG-CZ2 4.48Å; Q601-W607 HydrophobicContact CG-CZ3 4.11Å; T603-W607 HydrophobicContact CG2-CH2 4.38Å; T603-W607 HydrophobicContact CG2-CZ2 3.57Å; T603-W607 PolarHBondContact OG1-NE1 3.18Å; W607-I814 CarbonylContact O-C 3.55Å; W607-I814 WeakPolarHBondContact O-CA 3.45Å; W607-I815 HydrophobicContact CB-CB 4.21Å; W607-I815 HydrophobicContact CE3-CD1 4.49Å; W607-I815 HydrophobicContact CE3-CG2 4.44Å; W607-I815 PolarHBondContact N-O 2.72Å; W607-I815 PolarHBondContact O-N 3.11Å
608	E	93.1	Very high	92.4	Very high	136 Å²	136	43.9 Å²	43.9	64%	0.636	22%	0.215	S	C	*	.			trans	-108.9	97.3	173	-64	-176.7	-165.9	0	0	110.2	I814	E608-I814 HydrophobicContact CG-CB 4.48Å; E608-I814 HydrophobicContact CG-CD1 4.39Å; E608-I814 HydrophobicContact CG-CG1 4.18Å
609	T	87.3	Confident	91	Very high	9 Å²	9	45.3 Å²	45.3	6%	0.055	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-127.6	149.5	179.8	-175.5	0	0	0	0	113.2	M308 L311 Y611 M612	M308-T609 VanDerWaalsContact CE-CB 3.43Å; M308-T609 HydrophobicContact CE-CG2 3.9Å; L311-T609 HydrophobicContact CB-CG2 4Å; L311-T609 HydrophobicContact CD2-CG2 3.87Å; T609-Y611 PolarHBondContact OG1-N 3.22Å; T609-Y611 PolarHBondContact OG1-O 2.69Å; T609-M612 HydrophobicContact CG2-CB 4.16Å
610	R	88.2	Confident	89.3	Confident	204 Å²	204	47.2 Å²	47.2	77%	0.77	25%	0.248	S	C	*	.	S	Bend	trans	-96.2	-15.7	168.2	-62.7	-172.5	-177.8	-130.7	0.1	113.3
611	Y	92.8	Very high	87.9	Confident	153 Å²	153	49.5 Å²	49.5	60%	0.6	26%	0.261	S	S	*	.			trans	-132.9	120	-177.1	-64.9	-76.3	0	0	0	110	L311 T609	L311-Y611 PolarHBondContact N-O 3.11Å; T609-Y611 PolarHBondContact OG1-N 3.22Å; T609-Y611 PolarHBondContact OG1-O 2.69Å
612	M	95.9	Very high	86.2	Confident	2 Å²	2	52 Å²	52	1%	0.01	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	133.3	-175.7	-177.9	175.1	-176.2	0	0	110.2	L311 V313 V599 T609 L614 V808 P811 I815 V824	L311-M612 HydrophobicContact CD2-CE 4.3Å; L311-M612 HydrophobicContact CD2-CG 4.25Å; L311-M612 HydrophobicContact CD2-SD 4.33Å; L311-M612 CarbonylContact O-C 3.58Å; L311-M612 WeakPolarHBondContact O-CA 3.46Å; V313-M612 HydrophobicContact CG2-CE 3.67Å; V599-M612 HydrophobicContact CB-CE 4.12Å; V599-M612 HydrophobicContact CG1-CE 3.85Å; V599-M612 HydrophobicContact CG2-CE 3.34Å; T609-M612 HydrophobicContact CG2-CB 4.16Å; M612-L614 HydrophobicContact CE-CD2 3.71Å; M612-V808 HydrophobicContact CB-CB 4.15Å; M612-V808 HydrophobicContact CB-CG2 4.34Å; M612-V808 HydrophobicContact CG-CB 4.39Å; M612-V808 HydrophobicContact CG-CG2 4.05Å; M612-V808 PolarHBondContact O-N 2.89Å; M612-V808 HydrophobicContact SD-CG2 4.35Å; M612-P811 HydrophobicContact CB-CB 3.9Å; M612-P811 HydrophobicContact CB-CG 3.73Å; M612-P811 HydrophobicContact SD-CB 4.38Å; M612-I815 HydrophobicContact CE-CD1 3.91Å; M612-I815 HydrophobicContact SD-CD1 3.9Å; M612-V824 HydrophobicContact SD-CG1 4.43Å
613	T	96.6	Very high	85.2	Confident	28 Å²	28	54.8 Å²	54.8	17%	0.172	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	133.8	175.9	-53.7	0	0	0	0	109	L311 T312 V313 Q805 L806	L311-T613 PolarHBondContact O-N 2.78Å; T312-T613 CarbonylContact C-O 3.54Å; T312-T613 VanDerWaalsContact CA-O 3.28Å; T312-T613 WeakPolarHBondContact CA-O 3.31Å; T312-T613 HydrophobicContact CG2-CG2 4.48Å; V313-T613 PolarHBondContact N-O 3.48Å; T613-Q805 HydrophobicContact CG2-CB 4.2Å; T613-L806 CarbonylContact C-O 3.52Å; T613-L806 WeakPolarHBondContact CA-O 3.39Å
614	L	96.8	Very high	84.3	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	135.8	169.7	-56.6	-178.2	0	0	0	108.9	V313 W576 V599 M612 Q805 L806 V808 V824 V826	V313-L614 HydrophobicContact CB-CD2 4Å; V313-L614 HydrophobicContact CG2-CD2 4.49Å; V313-L614 CarbonylContact O-C 3.55Å; V313-L614 WeakPolarHBondContact O-CA 3.47Å; W576-L614 HydrophobicContact CB-CD2 4.05Å; W576-L614 HydrophobicContact CD2-CB 3.87Å; W576-L614 HydrophobicContact CD2-CD1 3.98Å; W576-L614 HydrophobicContact CD2-CD2 4.17Å; W576-L614 HydrophobicContact CD2-CG 4.23Å; W576-L614 HydrophobicContact CE3-CB 4.31Å; W576-L614 HydrophobicContact CE3-CD1 3.76Å; W576-L614 HydrophobicContact CE3-CG 4.5Å; W576-L614 HydrophobicContact CG-CB 4.27Å; W576-L614 HydrophobicContact CG-CD1 4.41Å; W576-L614 HydrophobicContact CG-CD2 3.81Å; W576-L614 HydrophobicContact CG-CG 4.4Å; W576-L614 HydrophobicContact CH2-CB 4.24Å; W576-L614 HydrophobicContact CZ2-CB 3.84Å; W576-L614 HydrophobicContact CZ3-CB 4.47Å; W576-L614 HydrophobicContact CZ3-CD1 4.11Å; V599-L614 HydrophobicContact CG2-CD2 3.84Å; M612-L614 HydrophobicContact CE-CD2 3.71Å; L614-Q805 CarbonylContact O-C 3.52Å; L614-Q805 WeakPolarHBondContact O-CA 3.37Å; L614-L806 HydrophobicContact CB-CB 4.25Å; L614-L806 PolarHBondContact N-O 3.37Å; L614-L806 PolarHBondContact O-N 3.12Å; L614-V808 HydrophobicContact CD1-CG2 4.19Å; L614-V808 HydrophobicContact CG-CG2 3.88Å; L614-V824 HydrophobicContact CD1-CG2 3.94Å; L614-V826 HydrophobicContact CD1-CG2 3.75Å
615	S	94.8	Very high	83.9	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	136.7	-174.6	-178.7	0	0	0	0	111.6	V313 F314 W576 A617 I804	V313-S615 PolarHBondContact O-N 3.05Å; F314-S615 WeakPolarHBondContact CA-O 3.38Å; W576-S615 PolarHBondContact NE1-O 3.24Å; S615-A617 VanDerWaalsContact C-N 3.31Å; S615-A617 VanDerWaalsContact OG-CB 3.28Å; S615-A617 WeakPolarHBondContact OG-CB 3.32Å; S615-A617 PolarHBondContact OG-N 2.58Å; S615-A617 VanDerWaalsContact OG-N 3.13Å; S615-I804 WeakPolarHBondContact CA-O 3.22Å
616	T	92.3	Very high	83.3	Confident	21 Å²	21	70.1 Å²	70.1	13%	0.129	41%	0.407	C	S	.	.			trans	-91	6.5	168.8	63.1	0	0	0	0	112.8	W576 I804 L862	W576-T616 HydrophobicContact CH2-CG2 4.3Å; W576-T616 HydrophobicContact CZ2-CG2 3.84Å; T616-I804 HydrophobicContact CG2-CB 4.32Å; T616-I804 PolarHBondContact N-O 3.37Å; T616-I804 PolarHBondContact OG1-N 3.43Å; T616-L862 HydrophobicContact CG2-CD1 3.44Å; T616-L862 VanDerWaalsContact CG2-CD1 3.44Å; T616-L862 HydrophobicContact CG2-CD2 4.17Å; T616-L862 HydrophobicContact CG2-CG 4.47Å
617	A	86.1	Confident	82.5	Confident	17 Å²	17	76.7 Å²	76.7	14%	0.14	44%	0.436	C	S	.	.			trans	-62.3	142.6	175.8	0	0	0	0	0	110.4	F314 S615 P619 T803	F314-A617 HydrophobicContact CD1-CB 3.92Å; F314-A617 WeakPolarHBondContact CD1-O 3.35Å; F314-A617 HydrophobicContact CE1-CB 3.87Å; S615-A617 VanDerWaalsContact C-N 3.31Å; S615-A617 VanDerWaalsContact OG-CB 3.28Å; S615-A617 WeakPolarHBondContact OG-CB 3.32Å; S615-A617 PolarHBondContact OG-N 2.58Å; S615-A617 VanDerWaalsContact OG-N 3.13Å; A617-P619 WeakPolarHBondContact O-CD 3.28Å; A617-T803 HydrophobicContact CB-CG2 3.42Å; A617-T803 VanDerWaalsContact CB-CG2 3.42Å
618	Q	79.2	Confident	81.8	Confident	111 Å²	111	85 Å²	85	52%	0.519	48%	0.479	S	S	.	.			trans	-114.9	71.6	172.8	-69.8	176.4	-29.7	0	0	109.6	G620 I621	Q618-G620 PolarHBondContact O-N 2.84Å; Q618-G620 VanDerWaalsContact O-N 3.15Å; Q618-I621 HydrophobicContact CB-CD1 3.71Å; Q618-I621 HydrophobicContact CB-CG1 3.95Å; Q618-I621 HydrophobicContact CG-CD1 4.33Å; Q618-I621 PolarHBondContact O-N 2.89Å
619	P	67.6	Low	81.1	Confident	82 Å²	82	81.9 Å²	81.9	53%	0.532	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-19	-176.3	28	-35.3	0	0	0	113.1	F314 A617	F314-P619 HydrophobicContact CD1-CG 4.31Å; F314-P619 HydrophobicContact CE1-CG 4.14Å; F314-P619 HydrophobicContact CZ-CG 4.3Å; A617-P619 WeakPolarHBondContact O-CD 3.28Å
620	G	62.8	Low	80.9	Confident	40 Å²	40	88.3 Å²	88.3	41%	0.412	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-9.7	177.7	0	0	0	0	0	115.3	Q618 G622	Q618-G620 PolarHBondContact O-N 2.84Å; Q618-G620 VanDerWaalsContact O-N 3.15Å; G620-G622 PolarHBondContact O-N 2.86Å
621	I	65.8	Low	80.4	Confident	119 Å²	119	87.4 Å²	87.4	61%	0.61	52%	0.521	S	S	*	.	S	Bend	trans	-69.3	107.1	170.6	-66.9	178.6	0	0	0	106.8	Q618	Q618-I621 HydrophobicContact CB-CD1 3.71Å; Q618-I621 HydrophobicContact CB-CG1 3.95Å; Q618-I621 HydrophobicContact CG-CD1 4.33Å; Q618-I621 PolarHBondContact O-N 2.89Å
622	G	60.6	Low	79.5	Confident	52 Å²	52	88.9 Å²	88.9	54%	0.536	53%	0.525	S	S	.	.			trans	-51.1	140.3	-173.1	0	0	0	0	0	112.6	G620 T624	G620-G622 PolarHBondContact O-N 2.86Å; G622-T624 PolarHBondContact O-N 3.42Å
623	G	69.8	Low	78.5	Confident	90 Å²	90	95.2 Å²	95.2	93%	0.928	56%	0.564	S	S	*	*	S	Bend	trans	-75.2	-0.9	175.1	0	0	0	0	0	114.1
624	T	72.6	Confident	77.4	Confident	124 Å²	124	100.8 Å²	100.8	76%	0.761	59%	0.587	S	S	*	*	S	Bend	trans	-82.5	124.1	177.4	40.6	0	0	0	0	110.3	G622	G622-T624 PolarHBondContact O-N 3.42Å
625	V	79.8	Confident	76	Confident	120 Å²	120	110.3 Å²	110.3	73%	0.727	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-62.3	125.4	174.9	-178.4	0	0	0	0	108.6
626	P	77.2	Confident	74.1	Confident	116 Å²	116	121.4 Å²	121.4	75%	0.753	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-64.8	137.4	176.7	26.3	-33.2	0	0	0	110.1
627	H	78	Confident	72.1	Confident	185 Å²	185	129.5 Å²	129.5	86%	0.856	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-85.4	131.2	176.7	-68.9	-67.1	0	0	0	111
628	L	81	Confident	70.3	Confident	176 Å²	176	135.6 Å²	135.6	92%	0.921	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-76	129.1	170.9	-67.5	171.8	0	0	0	110.1
629	G	78.9	Confident	68.7	Low	70 Å²	70	137.1 Å²	137.1	72%	0.722	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-70.6	163	167.3	0	0	0	0	0	112.1	Q631	G629-Q631 PolarHBondContact O-N 3.48Å
630	I	81.1	Confident	67.8	Low	144 Å²	144	138.4 Å²	138.4	74%	0.738	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-72.8	117	173.5	-60.7	173.1	0	0	0	109.1	R632	I630-R632 HydrophobicContact CG2-CG 4.03Å
631	Q	77.6	Confident	67.2	Low	186 Å²	186	142 Å²	142	87%	0.869	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-80.2	119.2	169.5	-159.3	175.7	26.3	0	0	109.6	G629	G629-Q631 PolarHBondContact O-N 3.48Å
632	R	74.8	Confident	66.3	Low	183 Å²	183	140.9 Å²	140.9	69%	0.691	77%	0.772	S	S	*	*			trans	-106.7	127.3	177.5	-66.3	-178.9	179	-103	-0.1	109.9	I630	I630-R632 HydrophobicContact CG2-CG 4.03Å
633	V	75.3	Confident	65.9	Low	136 Å²	136	145.1 Å²	145.1	82%	0.824	78%	0.781	S	S	*	*			trans	-99.5	132.7	173	-178	0	0	0	0	108.8
634	H	73	Confident	64.7	Low	144 Å²	144	146.7 Å²	146.7	67%	0.667	78%	0.775	S	S	*	*			trans	-129.3	143.2	173.2	-61.7	-56.9	0	0	0	109.2	R636	H634-R636 PolarHBondContact O-N 3.18Å
635	F	67.9	Low	63.6	Low	200 Å²	200	148.4 Å²	148.4	88%	0.877	78%	0.778	S	S	*	*			trans	-57.5	133.8	168.5	-71.1	-71.4	0	0	0	109.2	R637	F635-R637 PolarHBondContact O-N 3.3Å
636	R	55.3	Low	62	Low	233 Å²	233	148 Å²	148	88%	0.879	78%	0.781	S	S	*	*			trans	-53.8	110.1	168.3	-128.2	-173	-166.6	-176.5	4.8	106.6	H634 D638	H634-R636 PolarHBondContact O-N 3.18Å; R636-D638 PolarHBondContact O-N 2.88Å
637	R	49.5	Very low	60.1	Low	192 Å²	192	153.9 Å²	153.9	73%	0.725	79%	0.787	S	S	*	*			trans	-83	112.2	169.5	-64.4	-175.8	-168.3	139.3	0.4	105.7	F635 H639	F635-R637 PolarHBondContact O-N 3.3Å; R637-H639 WeakPolarHBondContact CB-CE1 3.16Å; R637-H639 WeakPolarHBondContact CB-NE2 3.42Å; R637-H639 WeakPolarHBondContact CD-CE1 3.45Å; R637-H639 PolarHBondContact O-N 2.91Å
638	D	49.4	Very low	58.5	Low	144 Å²	144	152.1 Å²	152.1	77%	0.77	78%	0.784	S	S	*	*			trans	-66	85.1	170.7	-66.9	-34.7	0	0	0	108.4	R636 S640	R636-D638 PolarHBondContact O-N 2.88Å; D638-S640 PolarHBondContact O-N 2.81Å
639	H	45	Very low	56.5	Low	143 Å²	143	148.3 Å²	148.3	66%	0.662	78%	0.779	S	S	*	*			trans	-86	68.6	166.6	-51.5	-41.3	0	0	0	107.7	R637 P641	R637-H639 WeakPolarHBondContact CB-CE1 3.16Å; R637-H639 WeakPolarHBondContact CB-NE2 3.42Å; R637-H639 WeakPolarHBondContact CD-CE1 3.45Å; R637-H639 PolarHBondContact O-N 2.91Å; H639-P641 VanDerWaalsContact O-CD 3.29Å; H639-P641 WeakPolarHBondContact O-CD 3.41Å
640	S	47.6	Very low	54.9	Low	110 Å²	110	151.7 Å²	151.7	77%	0.769	78%	0.778	S	S	*	*			trans	-67.8	119	158	-78.3	0	0	0	0	107	D638 A642	D638-S640 PolarHBondContact O-N 2.81Å; S640-A642 PolarHBondContact O-N 2.93Å
641	P	51	Low	52.8	Low	114 Å²	114	149.5 Å²	149.5	74%	0.74	78%	0.776	S	S	*	*			trans	-68.8	100.6	173.3	27.8	-29.5	0	0	0	107.4	H639 I643	H639-P641 VanDerWaalsContact O-CD 3.29Å; H639-P641 WeakPolarHBondContact O-CD 3.41Å; P641-I643 VanDerWaalsContact C-N 3.35Å; P641-I643 PolarHBondContact O-N 2.77Å
642	A	47.3	Very low	50.9	Low	97 Å²	97	145.6 Å²	145.6	80%	0.802	77%	0.77	S	S	*	*			trans	-66.1	98.9	167	0	0	0	0	0	107.7	S640 P644	S640-A642 PolarHBondContact O-N 2.93Å; A642-P644 VanDerWaalsContact O-CD 3.31Å; A642-P644 WeakPolarHBondContact O-CD 3.28Å
643	I	51.3	Low	49.2	Very low	141 Å²	141	143.9 Å²	143.9	72%	0.723	78%	0.779	S	S	*	*			trans	-65.7	118.1	165.2	-59.4	174.5	0	0	0	106.4	P641 I645	P641-I643 VanDerWaalsContact C-N 3.35Å; P641-I643 PolarHBondContact O-N 2.77Å; I643-I645 PolarHBondContact O-N 3.34Å; I643-I645 VanDerWaalsContact O-N 3.16Å
644	P	45.2	Very low	47.4	Very low	123 Å²	123	142 Å²	142	80%	0.799	77%	0.773	S	S	*	*			trans	-74.8	106.1	177.8	28.7	-29.9	0	0	0	109.4	A642 S646	A642-P644 VanDerWaalsContact O-CD 3.31Å; A642-P644 WeakPolarHBondContact O-CD 3.28Å; P644-S646 PolarHBondContact O-N 2.79Å
645	I	49.9	Very low	45.7	Very low	160 Å²	160	141.3 Å²	141.3	82%	0.821	78%	0.778	S	S	*	*			trans	-74.6	118.9	169.3	-59.7	173	0	0	0	108	I643 R647	I643-I645 PolarHBondContact O-N 3.34Å; I643-I645 VanDerWaalsContact O-N 3.16Å; I645-R647 PolarHBondContact O-N 2.83Å
646	S	46.7	Very low	44.1	Very low	112 Å²	112	137.5 Å²	137.5	78%	0.783	77%	0.771	S	S	*	*			trans	-61	123.5	178.4	65	0	0	0	0	111.2	P644	P644-S646 PolarHBondContact O-N 2.79Å
647	R	36.6	Very low	43.1	Very low	238 Å²	238	132.5 Å²	132.5	90%	0.898	77%	0.767	S	S	*	*			trans	-93.4	94.8	174.2	-150.9	-173.2	-70.3	168.7	-4.3	107.9	I645	I645-R647 PolarHBondContact O-N 2.83Å
648	N	43.2	Very low	42.3	Very low	148 Å²	148	126.8 Å²	126.8	79%	0.791	77%	0.768	S	S	*	*			trans	-170.8	94.7	162	-98.9	-7	0	0	0	112
649	A	40.7	Very low	41.8	Very low	97 Å²	97	130.5 Å²	130.5	80%	0.802	77%	0.773	S	S	*	*			trans	175	71.2	152.4	0	0	0	0	0	106
650	I	43.9	Very low	41.3	Very low	140 Å²	140	129.5 Å²	129.5	72%	0.718	78%	0.782	S	S	*	*				56.5	99.8	88	-56.6	-178.5	0	0	0	112.6
651	S	38.6	Very low	40.7	Very low	99 Å²	99	130.3 Å²	130.3	69%	0.692	79%	0.787	S	S	*	*			trans	77.2	103.8	138	-53.2	0	0	0	0	121.2
652	S	37.6	Very low	40	Very low	104 Å²	104	128.4 Å²	128.4	73%	0.727	79%	0.789	S	S	*	*				23	117.3	123.4	61	0	0	0	0	118.3
653	T	38	Very low	39.3	Very low	146 Å²	146	127.3 Å²	127.3	90%	0.896	79%	0.787	S	S	*	*				-173.9	155.1	115.3	13.7	0	0	0	0	111.4
654	S	36.7	Very low	38.7	Very low	98 Å²	98	129 Å²	129	69%	0.685	79%	0.793	S	S	*	*			trans	-78.2	170.6	-167.2	48.2	0	0	0	0	115.6
655	V	38.4	Very low	38.1	Very low	129 Å²	129	129 Å²	129	78%	0.782	79%	0.791	S	S	*	*			trans	76.6	123.4	152.6	-107.2	0	0	0	0	121.8
656	T	34.2	Very low	37.5	Very low	119 Å²	119	127.2 Å²	127.2	73%	0.73	79%	0.793	S	S	*	*			trans	96.4	103.1	136	-48.7	0	0	0	0	119.5
657	T	33.5	Very low	36.8	Very low	128 Å²	128	127.4 Å²	127.4	79%	0.785	79%	0.79	S	S	*	*			trans	20.6	124.7	131.4	-31.7	0	0	0	0	119.5
658	G	33.9	Very low	36.8	Very low	73 Å²	73	122.8 Å²	122.8	75%	0.753	79%	0.789	S	S	*	*			trans	178.1	106.8	162.8	0	0	0	0	0	112.6
659	Y	37.8	Very low	36.4	Very low	221 Å²	221	120.7 Å²	120.7	87%	0.867	78%	0.781	S	S	*	*			trans	-49.4	145.3	168	-69.6	-98.9	0	0	0	112.3
660	S	35.2	Very low	36.1	Very low	123 Å²	123	123 Å²	123	86%	0.86	78%	0.778	S	S	*	*				169.4	145.1	129.1	-72.3	0	0	0	0	112.6
661	S	35.3	Very low	35.8	Very low	126 Å²	126	122 Å²	122	88%	0.881	78%	0.781	S	S	*	*			trans	-55.9	158.7	-177.3	61.7	0	0	0	0	117.4
662	G	35.7	Very low	35.5	Very low	75 Å²	75	121.6 Å²	121.6	77%	0.773	78%	0.784	S	S	*	*			trans	144.7	95	138.5	0	0	0	0	0	116.3
663	G	33.5	Very low	35.6	Very low	73 Å²	73	122.3 Å²	122.3	75%	0.753	79%	0.789	S	S	*	*				76.1	139.1	121.7	0	0	0	0	0	121.5
664	M	38.9	Very low	35.5	Very low	176 Å²	176	122.1 Å²	122.1	87%	0.867	79%	0.788	S	S	*	*			trans	100.3	85.7	147.1	-48.4	-164.8	91.3	0	0	118.3
665	T	32	Very low	35.2	Very low	123 Å²	123	120.2 Å²	120.2	76%	0.755	78%	0.784	S	S	*	*				23.7	132.4	121.1	60.3	0	0	0	0	120.3
666	S	36.5	Very low	35	Very low	123 Å²	123	123.2 Å²	123.2	86%	0.86	79%	0.789	S	S	*	*			trans	-143	100.3	144.7	57.7	0	0	0	0	111.1
667	T	31.7	Very low	34.9	Very low	116 Å²	116	126.1 Å²	126.1	71%	0.712	79%	0.794	S	S	*	*			trans	-75.8	145.3	158.1	-46.3	0	0	0	0	108.4
668	T	37	Very low	35	Very low	142 Å²	142	127.8 Å²	127.8	87%	0.871	80%	0.797	S	S	*	*			trans	-140.7	127	151.5	-62.8	0	0	0	0	110.6
669	T	34.3	Very low	34.9	Very low	103 Å²	103	129.7 Å²	129.7	63%	0.632	80%	0.798	S	S	*	*			trans	-91.8	156.2	-169	-50.5	0	0	0	0	111
670	I	36.2	Very low	34.6	Very low	145 Å²	145	122.5 Å²	122.5	74%	0.744	79%	0.791	S	S	*	*			trans	-25.4	157.2	153.7	-24.1	177.2	0	0	0	114.2
671	P	37.8	Very low	34.4	Very low	119 Å²	119	121.1 Å²	121.1	77%	0.773	79%	0.787	S	S	*	*				-149.5	154	92.7	36	-17.2	0	0	0	116.3
672	A	31.5	Very low	34.1	Very low	91 Å²	91	120.1 Å²	120.1	75%	0.752	78%	0.78	S	S	*	*			trans	-76	146.9	153.6	0	0	0	0	0	110.3
673	S	39.6	Very low	33.9	Very low	120 Å²	120	121.3 Å²	121.3	84%	0.839	78%	0.777	S	S	*	*			trans	-165.6	135.7	149.9	65.7	0	0	0	0	113.7
674	T	34.9	Very low	33.8	Very low	141 Å²	141	124.6 Å²	124.6	87%	0.865	78%	0.782	S	S	*	*			trans	-68.5	147.3	179.1	-39	0	0	0	0	115
675	G	31.3	Very low	33.4	Very low	59 Å²	59	119.7 Å²	119.7	61%	0.608	78%	0.777	S	S	*	*			trans	72.4	119	137.7	0	0	0	0	0	120.4
676	H	34.8	Very low	33.6	Very low	192 Å²	192	122.7 Å²	122.7	89%	0.889	78%	0.78	S	S	*	*				-173.6	135.3	119.7	-104.2	68.7	0	0	0	111.8
677	Q	32	Very low	33.4	Very low	179 Å²	179	123.4 Å²	123.4	84%	0.836	77%	0.774	S	S	*	*			trans	-68	154.4	166.5	-60.6	178.5	6	0	0	110.3
678	I	34.4	Very low	33.5	Very low	164 Å²	164	123.3 Å²	123.3	84%	0.841	77%	0.773	S	S	*	*				-173.7	146.4	128.4	-87.8	149.4	0	0	0	109.2
679	S	32.1	Very low	33.4	Very low	112 Å²	112	127.3 Å²	127.3	78%	0.783	77%	0.772	S	S	*	*			trans	-69.8	169.2	-164.9	47.2	0	0	0	0	118.1
680	G	31.8	Very low	33.2	Very low	70 Å²	70	127.9 Å²	127.9	72%	0.722	78%	0.78	S	S	*	*				122.6	87.6	127.3	0	0	0	0	0	118.8
681	A	31	Very low	33.2	Very low	94 Å²	94	126.4 Å²	126.4	78%	0.777	78%	0.782	S	S	*	*			trans	58.6	123.9	131.9	0	0	0	0	0	122.8
682	S	29.5	Very low	32.9	Very low	105 Å²	105	126.6 Å²	126.6	73%	0.734	78%	0.781	S	S	*	*				88.8	112.6	126.1	72	0	0	0	0	121.6
683	S	31.3	Very low	32.9	Very low	100 Å²	100	131.6 Å²	131.6	70%	0.699	79%	0.786	S	S	*	*				85.5	125.4	121.6	77.7	0	0	0	0	120.9
684	T	30.5	Very low	32.4	Very low	142 Å²	142	134.2 Å²	134.2	87%	0.871	79%	0.789	S	S	*	*			trans	58.9	120.3	139.8	32.6	0	0	0	0	120.1
685	G	31.5	Very low	32.3	Very low	73 Å²	73	130.7 Å²	130.7	75%	0.753	78%	0.782	S	S	*	*			trans	163.8	74.7	154.1	0	0	0	0	0	118.2
686	K	35.8	Very low	32.3	Very low	187 Å²	187	132.2 Å²	132.2	81%	0.813	79%	0.788	S	S	*	*				46.2	129.5	129.2	-73.4	177.6	-178.8	170.5	0	121.2
687	N	32.7	Very low	32.3	Very low	137 Å²	137	132.7 Å²	132.7	73%	0.733	79%	0.788	S	S	*	*			trans	75	124.2	138.8	-57.4	-16.2	0	0	0	115.7
688	T	34.5	Very low	32.4	Very low	115 Å²	115	132.7 Å²	132.7	71%	0.706	79%	0.785	S	S	*	*				-180	136.7	64.8	26.6	0	0	0	0	111.8
689	R	35	Very low	32.5	Very low	226 Å²	226	136.2 Å²	136.2	85%	0.853	79%	0.788	S	S	*	*			trans	57.6	112	133.4	-58.5	177	176.2	179.1	-2	118.8
690	S	30.2	Very low	32.5	Very low	114 Å²	114	134.9 Å²	134.9	80%	0.797	78%	0.779	S	S	*	*				63.8	117.1	76.5	-174.3	0	0	0	0	114.3
691	C	35.2	Very low	32.5	Very low	115 Å²	115	137.9 Å²	137.9	78%	0.777	78%	0.778	S	S	*	*				-176.3	141.4	97.6	79.6	0	0	0	0	114.4
692	T	31	Very low	32.7	Very low	123 Å²	123	144.1 Å²	144.1	76%	0.755	78%	0.781	S	S	*	*			trans	-47.6	144.9	156.7	41.5	0	0	0	0	116.9
693	K	32.7	Very low	33	Very low	195 Å²	195	145.1 Å²	145.1	85%	0.848	78%	0.783	S	S	*	*				177.8	123.3	129.6	-113.5	162.3	171.2	170.7	0	110.7
694	L	28.3	Very low	33.5	Very low	175 Å²	175	146.3 Å²	146.3	92%	0.916	79%	0.789	S	S	*	*				65.1	118.5	75.6	-106.9	159.4	0	0	0	114.8
695	G	32.3	Very low	33.7	Very low	68 Å²	68	142.4 Å²	142.4	70%	0.701	78%	0.777	S	S	*	*			trans	145	86	166.6	0	0	0	0	0	112.1
696	A	32.7	Very low	34	Very low	90 Å²	90	145 Å²	145	74%	0.744	78%	0.778	S	S	*	*				60.5	112.4	83.6	0	0	0	0	0	114.1
697	F	34.5	Very low	33.7	Very low	202 Å²	202	143.3 Å²	143.3	89%	0.886	78%	0.778	S	S	*	*			trans	-172.5	101.5	134.5	-93.6	-74.4	0	0	0	107.1
698	K	34.6	Very low	33.9	Very low	180 Å²	180	143.4 Å²	143.4	78%	0.783	78%	0.777	S	S	*	*				71.5	128.8	82.7	-99.5	-175.9	-179.6	176.4	0	114.8
699	R	35	Very low	33.9	Very low	238 Å²	238	143.6 Å²	143.6	90%	0.898	77%	0.774	S	S	*	*			trans	94	139.7	157.7	-64.9	176.5	-174.7	-128.6	2.3	115.4
700	S	31.8	Very low	33.9	Very low	84 Å²	84	141.6 Å²	141.6	59%	0.587	77%	0.774	S	S	*	*			cis	165.3	135.1	-8.2	163.6	0	0	0	0	104.7
701	N	33.4	Very low	34.2	Very low	132 Å²	132	142.3 Å²	142.3	71%	0.706	77%	0.768	S	S	*	*			trans	65.4	139	153.4	-71	-8.9	0	0	0	116.2
702	R	34.8	Very low	34.4	Very low	225 Å²	225	142.4 Å²	142.4	85%	0.849	76%	0.761	S	S	*	*			cis	-167.3	132.3	25.1	-118.7	161.5	-162	-164.1	4.5	107.2
703	T	35.2	Very low	34.7	Very low	126 Å²	126	146 Å²	146	77%	0.773	76%	0.76	S	S	*	*			trans	-53.5	-172.3	147.4	-3	0	0	0	0	111.4
704	P	41.6	Very low	34.8	Very low	125 Å²	125	143.6 Å²	143.6	81%	0.812	76%	0.762	S	S	*	*			cis	-130	-173.8	-47.4	27.8	-7.3	0	0	0	110.2
705	G	34	Very low	35.1	Very low	61 Å²	61	138.7 Å²	138.7	63%	0.629	75%	0.753	S	S	*	*			trans	-174.4	98.8	155.7	0	0	0	0	0	115.5
706	T	38.4	Very low	35.4	Very low	127 Å²	127	140.3 Å²	140.3	78%	0.779	75%	0.754	S	S	*	*			trans	57.1	106.1	136.1	61	0	0	0	0	117.1
707	N	29.5	Very low	35.4	Very low	152 Å²	152	143.7 Å²	143.7	81%	0.813	76%	0.757	S	S	*	*			cis	54	122	49.5	-144.5	-6.1	0	0	0	112.1
708	I	37	Very low	35.7	Very low	139 Å²	139	141.9 Å²	141.9	71%	0.713	76%	0.756	S	S	*	*			trans	175.6	114.3	145.9	-82.3	143.3	0	0	0	109.1
709	N	34.7	Very low	35.7	Very low	119 Å²	119	139.7 Å²	139.7	64%	0.636	75%	0.753	S	S	*	*			trans	54.8	145.6	133.2	-49.8	-12.9	0	0	0	119.9
710	E	35.2	Very low	35.7	Very low	183 Å²	183	138 Å²	138	86%	0.855	76%	0.755	S	S	*	*			cis	-144.7	138.2	33.6	-77.3	167.3	124.3	0	0	108.5
711	I	36.6	Very low	35.8	Very low	129 Å²	129	144 Å²	144	66%	0.662	77%	0.765	S	S	*	*				59.2	96.7	53.7	-50.6	179.1	0	0	0	114.2
712	D	38.2	Very low	36	Very low	118 Å²	118	145.7 Å²	145.7	63%	0.631	77%	0.774	S	S	*	*				180	143.7	128	-97.5	-7.6	0	0	0	108.2
713	R	37.3	Very low	35.9	Very low	197 Å²	197	138.2 Å²	138.2	74%	0.743	77%	0.767	S	S	*	*			cis	-175.3	137.9	-15.5	-117.3	176.2	-178.5	128.6	-6.4	105.1
714	V	35.8	Very low	36.1	Very low	145 Å²	145	140.4 Å²	140.4	88%	0.879	77%	0.772	S	S	*	*			trans	55.1	131.8	132.9	-173.7	0	0	0	0	118.2
715	G	35.6	Very low	35.8	Very low	72 Å²	72	140.4 Å²	140.4	74%	0.742	77%	0.77	S	S	*	*			cis	-167.2	-169.9	8.8	0	0	0	0	0	105.9
716	S	36.6	Very low	36	Very low	102 Å²	102	143 Å²	143	71%	0.713	78%	0.776	S	S	*	*			cis	-168.7	140.4	11.2	-177.1	0	0	0	0	106.1
717	M	33.8	Very low	35.8	Very low	162 Å²	162	142.6 Å²	142.6	80%	0.798	78%	0.779	S	S	*	*			trans	37.5	125.3	143.8	-55.2	175	76.3	0	0	118.5
718	D	40.1	Very low	36.2	Very low	163 Å²	163	138.8 Å²	138.8	87%	0.872	78%	0.775	S	S	*	*				-146.7	142.8	76.9	-73.3	-38.6	0	0	0	114.9
719	N	34.9	Very low	36.3	Very low	135 Å²	135	138.2 Å²	138.2	72%	0.722	78%	0.778	S	S	*	*			trans	-95.5	139.1	173.1	-99.4	-38.4	0	0	0	109.4
720	E	35.3	Very low	36.5	Very low	202 Å²	202	139.4 Å²	139.4	94%	0.944	78%	0.784	S	S	*	*			trans	-131	124.7	136.7	-84.3	-164.8	137.4	0	0	109.4
721	R	33.1	Very low	36.6	Very low	210 Å²	210	138 Å²	138	79%	0.792	78%	0.777	S	S	*	*			trans	-107.6	146.2	174	-79.8	178.1	174.4	171.8	-2.1	107.5
722	D	38.9	Very low	36.5	Very low	167 Å²	167	143.3 Å²	143.3	89%	0.893	79%	0.789	S	S	*	*			trans	-174.6	117.5	132.9	-86	-26.1	0	0	0	105.7
723	G	33.1	Very low	36.3	Very low	69 Å²	69	141.5 Å²	141.5	71%	0.711	80%	0.798	S	S	*	*				79.9	121.2	67.6	0	0	0	0	0	108.9
724	I	38.3	Very low	36	Very low	171 Å²	171	135.9 Å²	135.9	88%	0.877	80%	0.801	S	S	*	*			cis	-173.5	139.9	41.3	-80	154.1	0	0	0	107.7
725	T	35.5	Very low	35.8	Very low	125 Å²	125	134 Å²	134	77%	0.767	80%	0.795	S	S	*	*			trans	-86.9	162	163.3	-14.5	0	0	0	0	109.6
726	P	38.7	Very low	35.8	Very low	115 Å²	115	137.3 Å²	137.3	75%	0.747	79%	0.794	S	S	*	*				-162.4	161.9	73.6	39.2	-15	0	0	0	119.9
727	S	34.6	Very low	35.6	Very low	120 Å²	120	140.4 Å²	140.4	84%	0.839	80%	0.797	S	S	*	*			trans	14.1	143.7	144.2	-50.3	0	0	0	0	125.8
728	G	37.5	Very low	35.4	Very low	71 Å²	71	137.5 Å²	137.5	73%	0.732	79%	0.793	S	S	*	*			trans	169	80.1	155.9	0	0	0	0	0	113.2
729	T	39.7	Very low	35	Very low	128 Å²	128	134.7 Å²	134.7	79%	0.785	78%	0.782	S	S	*	*				65.2	137.2	94.7	-30.6	0	0	0	0	117.7
730	L	37	Very low	34.7	Very low	144 Å²	144	138.7 Å²	138.7	75%	0.754	79%	0.788	S	S	*	*			trans	102.1	134.7	164.6	-60.1	164.7	0	0	0	115
731	Q	37.8	Very low	34.7	Very low	153 Å²	153	133 Å²	133	72%	0.715	78%	0.775	S	S	*	*			cis	-173.3	149.4	-7.3	-132	172.8	-3.6	0	0	107.6
732	R	35.2	Very low	34.5	Very low	241 Å²	241	130 Å²	130	91%	0.909	78%	0.781	S	S	*	*			trans	25.7	140.3	151.2	-68.6	176.6	-175.1	-134.1	-0.4	119.9
733	G	33.2	Very low	34.3	Very low	80 Å²	80	125.2 Å²	125.2	83%	0.825	77%	0.771	S	S	*	*			cis	141.3	143.1	15.1	0	0	0	0	0	110
734	G	31.8	Very low	34.3	Very low	78 Å²	78	129.8 Å²	129.8	80%	0.804	78%	0.778	S	S	*	*			trans	88.6	111.5	145.3	0	0	0	0	0	121.9
735	S	31.5	Very low	34.1	Very low	107 Å²	107	132.1 Å²	132.1	75%	0.748	78%	0.776	S	S	*	*				79.4	128.3	123.6	-105	0	0	0	0	124.5
736	I	36	Very low	34	Very low	140 Å²	140	130.8 Å²	130.8	72%	0.718	77%	0.771	S	S	*	*			trans	93.6	116.4	130.6	-68	160.5	0	0	0	120.5
737	E	31	Very low	33.8	Very low	167 Å²	167	130.6 Å²	130.6	78%	0.78	77%	0.773	S	S	*	*			trans	39.4	122.4	139.1	-63.4	177.1	143.3	0	0	123.7
738	S	31.2	Very low	33.8	Very low	102 Å²	102	129.8 Å²	129.8	71%	0.713	77%	0.767	S	S	*	*				75.3	144.3	123.3	79.6	0	0	0	0	121
739	T	31.3	Very low	33.7	Very low	104 Å²	104	131.6 Å²	131.6	64%	0.638	76%	0.764	S	S	*	*			trans	107.9	100.2	138.8	-53.4	0	0	0	0	117.9
740	Y	28.7	Very low	33.6	Very low	219 Å²	219	136.6 Å²	136.6	86%	0.859	77%	0.769	S	S	*	*			trans	62.8	138.3	142.3	-58.1	-57.7	0	0	0	124.3
741	A	34.4	Very low	33.7	Very low	82 Å²	82	134.8 Å²	134.8	68%	0.678	77%	0.766	S	S	*	*			trans	93.3	101.8	134.2	0	0	0	0	0	120.2
742	T	29.8	Very low	33.7	Very low	147 Å²	147	135.5 Å²	135.5	90%	0.902	77%	0.773	S	S	*	*				49.1	124.7	125.8	54.1	0	0	0	0	121
743	G	34.3	Very low	33.6	Very low	67 Å²	67	128.4 Å²	128.4	69%	0.691	76%	0.76	S	S	*	*			trans	160.9	85.5	157.4	0	0	0	0	0	111.3
744	L	33.3	Very low	33.7	Very low	164 Å²	164	134.3 Å²	134.3	86%	0.859	76%	0.758	S	S	*	*				62.1	125.8	103	-76.4	172.3	0	0	0	116.3
745	R	32.7	Very low	33.7	Very low	221 Å²	221	140.7 Å²	140.7	83%	0.834	76%	0.757	S	S	*	*			trans	98.8	107.8	142.6	-77.5	174.5	172.6	-117.9	-0.6	120.1
746	S	34.1	Very low	34.1	Very low	96 Å²	96	142.8 Å²	142.8	67%	0.671	77%	0.766	S	S	*	*				91.3	107.6	108.9	75.4	0	0	0	0	119.6
747	S	34.3	Very low	33.9	Very low	112 Å²	112	144.8 Å²	144.8	78%	0.783	78%	0.777	S	S	*	*				51.5	124.4	121.8	68.9	0	0	0	0	120
748	S	35.7	Very low	34.1	Very low	102 Å²	102	140.8 Å²	140.8	71%	0.713	78%	0.78	S	S	*	*				-178.9	106.1	117.2	169.3	0	0	0	0	112
749	T	35.6	Very low	34.2	Very low	109 Å²	109	141.8 Å²	141.8	67%	0.669	79%	0.787	S	S	*	*				30	121.4	121.1	32.6	0	0	0	0	120.7
750	R	37.3	Very low	34.5	Very low	233 Å²	233	141.9 Å²	141.9	88%	0.879	79%	0.792	S	S	*	*				134.3	152.4	103.2	-94.4	170.9	-172.5	-117.4	2.3	116.1
751	P	39	Very low	34.8	Very low	106 Å²	106	138.5 Å²	138.5	69%	0.688	79%	0.786	S	S	*	*			trans	-104.9	-179.1	-156.2	42.4	-35.3	0	0	0	113.2
752	I	36.4	Very low	35	Very low	169 Å²	169	140 Å²	140	87%	0.867	78%	0.782	S	S	*	*			trans	-179.2	133.3	140.2	-92.1	150.1	0	0	0	114
753	S	33.4	Very low	35.3	Very low	92 Å²	92	140.7 Å²	140.7	64%	0.643	77%	0.773	S	S	*	*			trans	-11.1	147.1	157	-87.8	0	0	0	0	125.3
754	R	35.1	Very low	35.2	Very low	204 Å²	204	143.8 Å²	143.8	77%	0.77	77%	0.774	S	S	*	*				84.1	126	129.6	-79.7	-177	-142.4	-158.3	3.7	123
755	R	33.7	Very low	35	Very low	212 Å²	212	140.5 Å²	140.5	80%	0.8	76%	0.764	S	S	*	*			trans	60.4	128	137.4	-68.4	-175.4	-178.2	-169.7	-0.4	118.3
756	T	38	Very low	35.1	Very low	151 Å²	151	136.5 Å²	136.5	93%	0.926	76%	0.764	S	S	*	*				-174.2	148.9	116.6	23.6	0	0	0	0	111.9
757	L	33.3	Very low	34.9	Very low	182 Å²	182	137.9 Å²	137.9	95%	0.953	77%	0.769	S	S	*	*			trans	-76.2	157.5	178.9	-69.2	156.2	0	0	0	111.8
758	G	34.1	Very low	34.8	Very low	82 Å²	82	136.5 Å²	136.5	85%	0.845	76%	0.759	S	S	*	*			trans	-162.6	96.6	164.5	0	0	0	0	0	112.2
759	S	34.4	Very low	34.8	Very low	123 Å²	123	140.1 Å²	140.1	86%	0.86	77%	0.765	S	S	*	*			trans	-75.3	151.2	165.7	-79.2	0	0	0	0	111.9
760	S	36.7	Very low	34.7	Very low	107 Å²	107	140.3 Å²	140.3	75%	0.748	77%	0.77	S	S	*	*			trans	-160.6	112.6	141.1	-170.9	0	0	0	0	108.1
761	M	36.2	Very low	34.8	Very low	147 Å²	147	135 Å²	135	72%	0.724	77%	0.766	S	S	*	*				65.5	124.6	70.8	-68.5	-83.5	-100.3	0	0	110.5
762	L	37.7	Very low	34.4	Very low	113 Å²	113	137.4 Å²	137.4	59%	0.592	77%	0.772	S	S	*	*			cis	-172	167.7	19.9	-81.6	137.6	0	0	0	112.8
763	F	35.5	Very low	34.3	Very low	162 Å²	162	137.7 Å²	137.7	71%	0.711	77%	0.774	S	S	*	*			trans	113	105.5	135.5	-70.1	-58.3	0	0	0	122.4
764	N	32.6	Very low	34.3	Very low	133 Å²	133	138.5 Å²	138.5	71%	0.711	78%	0.776	S	S	*	*				51.7	114.1	123.4	-75	10.1	0	0	0	120.1
765	S	30.2	Very low	34.4	Very low	95 Å²	95	136.1 Å²	136.1	66%	0.664	78%	0.778	S	S	*	*				73.3	124.2	74.2	81	0	0	0	0	114.2
766	V	33.4	Very low	34.4	Very low	137 Å²	137	136.6 Å²	136.6	83%	0.83	78%	0.78	S	S	*	*				175.5	138.4	116.9	160.4	0	0	0	0	110.2
767	T	29.9	Very low	34.3	Very low	125 Å²	125	135.4 Å²	135.4	77%	0.767	77%	0.773	S	S	*	*			trans	-59	156.8	180	-34.3	0	0	0	0	115.7
768	S	33	Very low	34.4	Very low	82 Å²	82	131.1 Å²	131.1	57%	0.573	76%	0.758	S	S	*	*				114.6	127.4	125.7	111.2	0	0	0	0	119.6
769	Q	35.2	Very low	34.7	Very low	179 Å²	179	133.9 Å²	133.9	84%	0.836	75%	0.753	S	S	*	*			trans	83	113.6	136.6	-67.3	174.4	74.2	0	0	120.4
770	S	34.1	Very low	34.8	Very low	112 Å²	112	134.4 Å²	134.4	78%	0.783	75%	0.746	S	S	*	*			trans	-56.4	157.6	150.9	-33.5	0	0	0	0	111
771	P	39	Very low	34.7	Very low	121 Å²	121	137.6 Å²	137.6	79%	0.786	75%	0.751	S	S	*	*				-152.8	169.2	83.6	36.1	-15	0	0	0	117.1
772	L	30.2	Very low	34.7	Very low	157 Å²	157	137.8 Å²	137.8	82%	0.822	76%	0.755	S	S	*	*			trans	-23.8	146.9	161.2	-64.2	148.3	0	0	0	118
773	L	35.6	Very low	34.7	Very low	175 Å²	175	137.2 Å²	137.2	92%	0.916	76%	0.761	S	S	*	*			trans	-162.5	142.8	134.3	-102.6	144.4	0	0	0	113.4
774	T	31.6	Very low	34.9	Very low	110 Å²	110	138.4 Å²	138.4	68%	0.675	77%	0.768	S	S	*	*			trans	-90.8	154.7	-169.4	43.4	0	0	0	0	114.6
775	N	37.7	Very low	35.2	Very low	154 Å²	154	138.2 Å²	138.2	82%	0.824	77%	0.774	S	S	*	*			trans	-170.7	119	135.9	-96.4	-18.8	0	0	0	108.2
776	R	33.7	Very low	35.5	Very low	222 Å²	222	138.3 Å²	138.3	84%	0.838	78%	0.781	S	S	*	*			cis	98.3	135.2	42.2	-152	-178.1	-158.4	-161.8	5.4	111.9
777	T	36.1	Very low	35.8	Very low	126 Å²	126	140 Å²	140	77%	0.773	79%	0.785	S	S	*	*			trans	89	139.3	168.8	73.2	0	0	0	0	116.8
778	S	36.4	Very low	36.1	Very low	92 Å²	92	141.8 Å²	141.8	64%	0.643	79%	0.788	S	S	*	*			cis	175.4	131.5	-31.2	44.3	0	0	0	0	105.9
779	N	38.8	Very low	36.5	Very low	139 Å²	139	143.6 Å²	143.6	74%	0.743	80%	0.798	S	S	*	*				147.1	126.3	129.5	-81.7	-14.6	0	0	0	117
780	L	36.8	Very low	36.6	Very low	135 Å²	135	141 Å²	141	71%	0.707	80%	0.795	S	S	*	*			trans	74.8	110	141.9	-82.5	86.6	0	0	0	122.1
781	M	36.1	Very low	36.7	Very low	174 Å²	174	141.5 Å²	141.5	86%	0.857	80%	0.795	S	S	*	*				48.1	124.3	124.8	-60.7	178.1	162.7	0	0	117.2
782	N	36	Very low	36.4	Very low	151 Å²	151	144.8 Å²	144.8	81%	0.807	80%	0.8	S	S	*	*			cis	-174.9	161.7	45	-157	8.7	0	0	0	109.5
783	S	37.6	Very low	36.5	Very low	101 Å²	101	145.9 Å²	145.9	71%	0.706	80%	0.801	S	S	*	*			trans	73.6	124.5	158.2	58.1	0	0	0	0	123.5
784	Q	38.2	Very low	36.4	Very low	187 Å²	187	143.3 Å²	143.3	87%	0.874	80%	0.795	S	S	*	*			trans	84.6	121.2	149.6	-99.7	174.9	-9.6	0	0	120.9	A786	Q784-A786 PolarHBondContact O-N 2.92Å
785	P	39.2	Very low	36.5	Very low	128 Å²	128	144 Å²	144	83%	0.831	80%	0.799	S	S	*	*			trans	-82.8	112	176.1	31.6	-28.4	0	0	0	110.9
786	A	37.2	Very low	36.2	Very low	97 Å²	97	142.7 Å²	142.7	80%	0.802	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-81.7	125.8	164.2	0	0	0	0	0	109.5	Q784	Q784-A786 PolarHBondContact O-N 2.92Å
787	L	40.5	Very low	36.1	Very low	174 Å²	174	136.9 Å²	136.9	91%	0.911	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-61.3	131	172.2	-75.3	155.7	0	0	0	109.9
788	L	35.1	Very low	36	Very low	161 Å²	161	138.6 Å²	138.6	84%	0.843	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-61.2	141.3	174.5	-77.8	115.8	0	0	0	111	T790	L788-T790 PolarHBondContact O-N 2.78Å
789	P	41.9	Very low	35.7	Very low	121 Å²	121	136.8 Å²	136.8	79%	0.786	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-69.2	124	168.3	-1.4	17.1	0	0	0	108.9
790	T	36.9	Very low	35.6	Very low	125 Å²	125	137 Å²	137	77%	0.767	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-57.1	138.6	163.3	2.2	0	0	0	0	109	L788 Q792	L788-T790 PolarHBondContact O-N 2.78Å; T790-Q792 PolarHBondContact O-N 2.74Å
791	P	35.9	Very low	36.2	Very low	121 Å²	121	136.2 Å²	136.2	79%	0.786	81%	0.805	S	S	*	*			trans	-60.3	115.2	176.5	23.2	-30.7	0	0	0	109.2	Q793	P791-Q793 PolarHBondContact O-N 2.84Å
792	Q	33.9	Very low	37.6	Very low	190 Å²	190	131.4 Å²	131.4	89%	0.888	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-59.3	117.5	168	-78.1	-179.2	-27.2	0	0	107.6	T790	T790-Q792 PolarHBondContact O-N 2.74Å
793	Q	30.6	Very low	39.8	Very low	181 Å²	181	128.3 Å²	128.3	85%	0.846	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-53.1	132.2	164.7	-85.9	176.3	-51.7	0	0	107.8	P791 T795	P791-Q793 PolarHBondContact O-N 2.84Å; Q793-T795 PolarHBondContact O-N 2.92Å; Q793-T795 VanDerWaalsContact O-N 3.12Å
794	P	33.9	Very low	42.2	Very low	120 Å²	120	124.7 Å²	124.7	78%	0.779	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-57.6	123.7	174.4	23.3	-30	0	0	0	108
795	T	33.3	Very low	44.8	Very low	124 Å²	124	122.4 Å²	122.4	76%	0.761	74%	0.741	S	S	*	*			trans	-45.6	131.2	164.5	43.7	0	0	0	0	108.1	Q793 S797	Q793-T795 PolarHBondContact O-N 2.92Å; Q793-T795 VanDerWaalsContact O-N 3.12Å; T795-S797 PolarHBondContact O-N 3.49Å
796	P	31.6	Very low	47.3	Very low	128 Å²	128	116.7 Å²	116.7	83%	0.831	70%	0.704	S	S	*	*			trans	-56.9	111	176.9	22.8	-30.7	0	0	0	107.7	V798	P796-V798 PolarHBondContact O-N 2.89Å
797	S	32.1	Very low	50	Low	100 Å²	100	118.6 Å²	118.6	70%	0.699	70%	0.696	S	S	*	*			trans	-53.2	127	167.5	48.1	0	0	0	0	107.1	T795 G799	T795-S797 PolarHBondContact O-N 3.49Å; S797-G799 VanDerWaalsContact C-N 3.32Å; S797-G799 PolarHBondContact O-N 2.81Å
798	V	34	Very low	52.7	Low	162 Å²	162	110.5 Å²	110.5	98%	0.982	65%	0.654	S	S	*	*	S	Bend	trans	-47.7	97.6	166.1	-178.8	0	0	0	0	107.4	P796	P796-V798 PolarHBondContact O-N 2.89Å
799	G	29.7	Very low	55.5	Low	53 Å²	53	107 Å²	107	55%	0.546	64%	0.641	S	S	.	*			trans	-179.7	109.1	-162.7	0	0	0	0	0	114.6	S797	S797-G799 VanDerWaalsContact C-N 3.32Å; S797-G799 PolarHBondContact O-N 2.81Å
800	T	36.4	Very low	57.9	Low	143 Å²	143	111.1 Å²	111.1	88%	0.877	64%	0.641	S	S	*	*			trans	75.1	87	177.4	-22.5	0	0	0	0	114.5	A802	T800-A802 PolarHBondContact O-N 3.17Å; T800-A802 VanDerWaalsContact O-N 3.1Å
801	V	49.8	Very low	60.6	Low	119 Å²	119	106.5 Å²	106.5	72%	0.721	61%	0.612	S	S	*	*			trans	-62.4	112	161.2	-177.7	0	0	0	0	106.5	T803	V801-T803 PolarHBondContact O-N 2.9Å
802	A	65.7	Low	63.3	Low	73 Å²	73	102.2 Å²	102.2	60%	0.603	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-55.1	133.8	169.8	0	0	0	0	0	108.1	T800 I804	T800-A802 PolarHBondContact O-N 3.17Å; T800-A802 VanDerWaalsContact O-N 3.1Å; A802-I804 PolarHBondContact O-N 3.43Å
803	T	81.5	Confident	66	Low	87 Å²	87	97.4 Å²	97.4	53%	0.534	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-58.3	122.4	172.9	-65.5	0	0	0	0	109.1	A617 V801	A617-T803 HydrophobicContact CB-CG2 3.42Å; A617-T803 VanDerWaalsContact CB-CG2 3.42Å; V801-T803 PolarHBondContact O-N 2.9Å
804	I	88.7	Confident	69	Low	24 Å²	24	91.5 Å²	91.5	12%	0.123	55%	0.551	C	S	.	*	P	Polyproline II helix	trans	-101.3	129.5	179.6	-69.1	154.7	0	0	0	107.7	S615 T616 A802 L806 S860 L862	S615-I804 WeakPolarHBondContact CA-O 3.22Å; T616-I804 HydrophobicContact CG2-CB 4.32Å; T616-I804 PolarHBondContact N-O 3.37Å; T616-I804 PolarHBondContact OG1-N 3.43Å; A802-I804 PolarHBondContact O-N 3.43Å; I804-L806 HydrophobicContact CG2-CD1 4.19Å; I804-L806 HydrophobicContact CG2-CD2 3.67Å; I804-L806 HydrophobicContact CG2-CG 3.73Å; I804-S860 VanDerWaalsContact CD1-CB 3.49Å; I804-L862 HydrophobicContact CD1-CD2 3.48Å; I804-L862 VanDerWaalsContact CD1-CD2 3.48Å
805	Q	91.9	Very high	71.9	Confident	140 Å²	140	86 Å²	86	65%	0.654	52%	0.515	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.1	127.5	171.1	-68.4	-172	-20.2	0	0	108.7	T613 L614	T613-Q805 HydrophobicContact CG2-CB 4.2Å; L614-Q805 CarbonylContact O-C 3.52Å; L614-Q805 WeakPolarHBondContact O-CA 3.37Å
806	L	93.5	Very high	74.8	Confident	8 Å²	8	87.2 Å²	87.2	4%	0.042	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	115.8	-175.5	-57.3	166.2	0	0	0	108.4	W576 Y595 T613 L614 I804 V826 F859	W576-L806 HydrophobicContact CH2-CD1 3.71Å; W576-L806 HydrophobicContact CZ2-CD1 4.4Å; W576-L806 HydrophobicContact CZ3-CD1 4.38Å; Y595-L806 HydrophobicContact CE1-CD1 3.91Å; Y595-L806 HydrophobicContact CE1-CD2 4.42Å; Y595-L806 WeakPolarHBondContact OH-CD1 3.28Å; T613-L806 CarbonylContact C-O 3.52Å; T613-L806 WeakPolarHBondContact CA-O 3.39Å; L614-L806 HydrophobicContact CB-CB 4.25Å; L614-L806 PolarHBondContact N-O 3.37Å; L614-L806 PolarHBondContact O-N 3.12Å; I804-L806 HydrophobicContact CG2-CD1 4.19Å; I804-L806 HydrophobicContact CG2-CD2 3.67Å; I804-L806 HydrophobicContact CG2-CG 3.73Å; L806-V826 HydrophobicContact CB-CG1 3.86Å; L806-V826 HydrophobicContact CD1-CG1 4.12Å; L806-V826 HydrophobicContact CD2-CG1 4.07Å; L806-V826 HydrophobicContact CG-CG1 4.22Å; L806-F859 HydrophobicContact CD2-CD1 4.04Å
807	E	94.1	Very high	77.7	Confident	137 Å²	137	83.4 Å²	83.4	64%	0.64	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	132.7	172.9	-173	172	-177.7	0	0	110	P809	E807-P809 VanDerWaalsContact O-CD 3.28Å; E807-P809 WeakPolarHBondContact O-CD 3.35Å
808	V	95.5	Very high	80.4	Confident	4 Å²	4	82.4 Å²	82.4	2%	0.024	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	107.7	174.5	-179.8	0	0	0	0	107.7	M612 L614 R810 P811 V824	M612-V808 HydrophobicContact CB-CB 4.15Å; M612-V808 HydrophobicContact CB-CG2 4.34Å; M612-V808 HydrophobicContact CG-CB 4.39Å; M612-V808 HydrophobicContact CG-CG2 4.05Å; M612-V808 PolarHBondContact O-N 2.89Å; M612-V808 HydrophobicContact SD-CG2 4.35Å; L614-V808 HydrophobicContact CD1-CG2 4.19Å; L614-V808 HydrophobicContact CG-CG2 3.88Å; V808-R810 VanDerWaalsContact C-N 3.27Å; V808-R810 PolarHBondContact O-N 2.72Å; V808-P811 HydrophobicContact CB-CG 4.29Å; V808-P811 HydrophobicContact CG1-CB 4.39Å; V808-P811 HydrophobicContact CG1-CG 4.16Å; V808-P811 WeakPolarHBondContact O-CD 3.28Å; V808-P811 WeakPolarHBondContact O-CG 3.47Å; V808-V824 HydrophobicContact CG1-CB 3.9Å; V808-V824 HydrophobicContact CG1-CG2 4.16Å; V808-V824 HydrophobicContact CG2-CG2 3.89Å
809	P	93.7	Very high	83.1	Confident	87 Å²	87	78.4 Å²	78.4	57%	0.565	44%	0.442	S	S	*	.	S	Bend	trans	-65.8	-27.6	-171.9	24.3	-35.6	0	0	0	113.8	E807 T825	E807-P809 VanDerWaalsContact O-CD 3.28Å; E807-P809 WeakPolarHBondContact O-CD 3.35Å; P809-T825 WeakPolarHBondContact CD-O 3.37Å
810	R	92.9	Very high	86.2	Confident	208 Å²	208	82 Å²	82	79%	0.785	44%	0.444	S	S	*	.	S	Bend	trans	-137.8	80.9	177.5	-67.5	-173.7	-67.5	167.8	-1.4	109.7	V808	V808-R810 VanDerWaalsContact C-N 3.27Å; V808-R810 PolarHBondContact O-N 2.72Å
811	P	93.4	Very high	89	Confident	27 Å²	27	78.4 Å²	78.4	18%	0.175	42%	0.423	C	S	.	.			trans	-61.4	146.4	175.4	-19.9	33.8	0	0	0	110.4	M612 V808	M612-P811 HydrophobicContact CB-CB 3.9Å; M612-P811 HydrophobicContact CB-CG 3.73Å; M612-P811 HydrophobicContact SD-CB 4.38Å; V808-P811 HydrophobicContact CB-CG 4.29Å; V808-P811 HydrophobicContact CG1-CB 4.39Å; V808-P811 HydrophobicContact CG1-CG 4.16Å; V808-P811 WeakPolarHBondContact O-CD 3.28Å; V808-P811 WeakPolarHBondContact O-CG 3.47Å
812	P	92.7	Very high	91.1	Very high	32 Å²	32	75.1 Å²	75.1	21%	0.208	40%	0.402	C	S	.	.			trans	-55.9	147.1	169.3	-21.4	31.8	0	0	0	110.9	I814 I815 N822 V824	P812-I814 PolarHBondContact O-N 3.25Å; P812-I815 HydrophobicContact CB-CG1 4.24Å; P812-I815 HydrophobicContact CG-CG1 4.24Å; P812-N822 WeakPolarHBondContact CG-OD1 3.24Å; P812-V824 VanDerWaalsContact CD-CG1 3.46Å; P812-V824 HydrophobicContact CG-CG1 3.61Å
813	A	91.5	Very high	92.6	Very high	88 Å²	88	78.5 Å²	78.5	73%	0.727	40%	0.399	S	S	*	.	S	Bend	trans	-61.4	-33.4	177.7	0	0	0	0	0	112.4
814	I	93.2	Very high	93.3	Very high	58 Å²	58	74.5 Å²	74.5	30%	0.297	37%	0.374	S	S	.	.			trans	-144	137.1	177.5	-168.3	167.6	0	0	0	110.1	D606 W607 E608 P812	D606-I814 HydrophobicContact CB-CD1 3.96Å; D606-I814 HydrophobicContact CB-CG1 4.09Å; W607-I814 CarbonylContact O-C 3.55Å; W607-I814 WeakPolarHBondContact O-CA 3.45Å; E608-I814 HydrophobicContact CG-CB 4.48Å; E608-I814 HydrophobicContact CG-CD1 4.39Å; E608-I814 HydrophobicContact CG-CG1 4.18Å; P812-I814 PolarHBondContact O-N 3.25Å
815	I	95.1	Very high	93.6	Very high	3 Å²	3	75.8 Å²	75.8	2%	0.015	38%	0.383	C	S	.	.	B	Isolated β-bridge	trans	-116	110.5	168	-56.5	173.4	0	0	0	107	V599 Q601 W607 M612 P812 N822	V599-I815 HydrophobicContact CG1-CD1 4.19Å; V599-I815 HydrophobicContact CG1-CG2 4.45Å; Q601-I815 HydrophobicContact CG-CG2 4.07Å; Q601-I815 PolarHBondContact NE2-O 3.48Å; W607-I815 HydrophobicContact CB-CB 4.21Å; W607-I815 HydrophobicContact CE3-CD1 4.49Å; W607-I815 HydrophobicContact CE3-CG2 4.44Å; W607-I815 PolarHBondContact N-O 2.72Å; W607-I815 PolarHBondContact O-N 3.11Å; M612-I815 HydrophobicContact CE-CD1 3.91Å; M612-I815 HydrophobicContact SD-CD1 3.9Å; P812-I815 HydrophobicContact CB-CG1 4.24Å; P812-I815 HydrophobicContact CG-CG1 4.24Å; I815-N822 HydrophobicContact CG2-CB 4.14Å
816	R	94.1	Very high	93.8	Very high	151 Å²	151	69.4 Å²	69.4	57%	0.57	35%	0.354	S	S	*	.			trans	-72.1	153.5	-173.5	-66.8	-170.1	-175.4	111.9	1.5	112.7	Q601 D606 D818	Q601-R816 WeakPolarHBondContact CG-O 3.38Å; Q601-R816 PolarHBondContact NE2-O 3.04Å; D606-R816 VanDerWaalsContact OD1-CA 3.27Å; D606-R816 WeakPolarHBondContact OD1-CA 3.34Å; R816-D818 HydrophobicContact CB-CB 4.41Å; R816-D818 WeakPolarHBondContact CB-OD2 3.43Å; R816-D818 PolarHBondContact O-N 3.08Å
817	C	91.4	Very high	93.9	Very high	48 Å²	48	69.4 Å²	69.4	32%	0.324	36%	0.356	S	S	.	.	S	Bend	trans	-85.7	41.4	174	59.6	0	0	0	0	113	Q601 E605 D606	Q601-C817 VanDerWaalsContact CD-CA 3.5Å; Q601-C817 VanDerWaalsContact NE2-CB 3.33Å; E605-C817 WeakPolarHBondContact O-CB 3.46Å; D606-C817 PolarHBondContact OD1-N 3.35Å; D606-C817 PolarHBondContact OD1-SG 3.01Å
818	D	90.6	Very high	93.9	Very high	79 Å²	79	68.6 Å²	68.6	42%	0.422	36%	0.355	S	S	.	.	S	Bend	trans	-96	1.6	-179	53.4	14.2	0	0	0	113	R816 E820	R816-D818 HydrophobicContact CB-CB 4.41Å; R816-D818 WeakPolarHBondContact CB-OD2 3.43Å; R816-D818 PolarHBondContact O-N 3.08Å; D818-E820 HydrophobicContact CB-CG 4.46Å; D818-E820 PolarHBondContact O-N 3.35Å; D818-E820 VanDerWaalsContact O-N 3.17Å; D818-E820 WeakPolarHBondContact OD1-CB 3.41Å; D818-E820 PolarHBondContact OD1-N 3.49Å
819	N	90.8	Very high	93.9	Very high	78 Å²	78	68.4 Å²	68.4	42%	0.417	35%	0.354	S	S	.	.			trans	56.5	21.8	-172.3	-159	41.9	0	0	0	112.9	Q600 Q601 A602	Q600-N819 WeakPolarHBondContact CG-O 3.28Å; Q600-N819 VanDerWaalsContact CG-OD1 3.3Å; Q600-N819 WeakPolarHBondContact CG-OD1 3.36Å; Q600-N819 PolarHBondContact NE2-O 2.85Å; Q600-N819 PolarHBondContact NE2-OD1 2.95Å; Q601-N819 VanDerWaalsContact O-CA 3.3Å; Q601-N819 WeakPolarHBondContact O-CA 3.3Å; Q601-N819 PolarHBondContact O-N 3.32Å; A602-N819 HydrophobicContact CB-CB 4.09Å
820	E	93.9	Very high	93.9	Very high	127 Å²	127	69.1 Å²	69.1	59%	0.593	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-90.6	137.6	173.6	-72.5	-63.6	144.6	0	0	110.5	D818 N822	D818-E820 HydrophobicContact CB-CG 4.46Å; D818-E820 PolarHBondContact O-N 3.35Å; D818-E820 VanDerWaalsContact O-N 3.17Å; D818-E820 WeakPolarHBondContact OD1-CB 3.41Å; D818-E820 PolarHBondContact OD1-N 3.49Å; E820-N822 PolarHBondContact O-N 3.46Å
821	P	94.4	Very high	93.9	Very high	69 Å²	69	59.6 Å²	59.6	45%	0.448	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-63.1	117.6	178.1	-22.9	33.5	0	0	0	112.7	M598	M598-P821 HydrophobicContact CE-CB 3.72Å
822	N	95.6	Very high	93.8	Very high	50 Å²	50	66.5 Å²	66.5	27%	0.267	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	119.8	174.2	-157.4	-63.4	0	0	0	110.7	V599 P812 I815 E820	V599-N822 PolarHBondContact N-O 3.43Å; V599-N822 PolarHBondContact O-N 2.96Å; P812-N822 WeakPolarHBondContact CG-OD1 3.24Å; I815-N822 HydrophobicContact CG2-CB 4.14Å; E820-N822 PolarHBondContact O-N 3.46Å
823	R	95.8	Very high	93.9	Very high	143 Å²	143	65.7 Å²	65.7	54%	0.54	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	117	-177.4	-177.2	175.5	60.1	-179.7	-6.7	111.1	Y596 M598	Y596-R823 HydrophobicContact CD1-CG 3.43Å; Y596-R823 VanDerWaalsContact CD1-CG 3.43Å; Y596-R823 HydrophobicContact CD2-CG 4.39Å; Y596-R823 HydrophobicContact CE1-CG 4Å; Y596-R823 HydrophobicContact CG-CG 3.65Å; M598-R823 HydrophobicContact CE-CB 4.04Å; M598-R823 HydrophobicContact SD-CB 3.78Å; M598-R823 HydrophobicContact SD-CG 3.83Å
824	V	96.3	Very high	93.8	Very high	3 Å²	3	66.8 Å²	66.8	2%	0.018	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.7	172.8	-53.6	0	0	0	0	110.9	Y596 G597 V599 M612 L614 V808 P812 V826	Y596-V824 CarbonylContact C-O 3.56Å; Y596-V824 WeakPolarHBondContact CA-O 3.38Å; G597-V824 PolarHBondContact N-O 3.26Å; G597-V824 WeakPolarHBondContact O-CG2 3.41Å; G597-V824 PolarHBondContact O-N 3.47Å; V599-V824 HydrophobicContact CG2-CG1 4.25Å; V599-V824 HydrophobicContact CG2-CG2 3.91Å; M612-V824 HydrophobicContact SD-CG1 4.43Å; L614-V824 HydrophobicContact CD1-CG2 3.94Å; V808-V824 HydrophobicContact CG1-CB 3.9Å; V808-V824 HydrophobicContact CG1-CG2 4.16Å; V808-V824 HydrophobicContact CG2-CG2 3.89Å; P812-V824 VanDerWaalsContact CD-CG1 3.46Å; P812-V824 HydrophobicContact CG-CG1 3.61Å; V824-V826 PolarHBondContact O-N 3.48Å
825	T	96.5	Very high	93.6	Very high	52 Å²	52	67.2 Å²	67.2	32%	0.319	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	121.9	176.5	-56	0	0	0	0	109.8	V594 P809	V594-T825 HydrophobicContact CG1-CG2 4.21Å; P809-T825 WeakPolarHBondContact CD-O 3.37Å
826	V	95.6	Very high	93.3	Very high	5 Å²	5	68.4 Å²	68.4	3%	0.03	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-51.5	173	172.9	0	0	0	0	110.3	Y595 L614 L806 V824 F859	Y595-V826 HydrophobicContact CD1-CB 4.2Å; Y595-V826 HydrophobicContact CD1-CG1 3.92Å; Y595-V826 HydrophobicContact CD2-CB 4.48Å; Y595-V826 HydrophobicContact CE1-CG1 4.18Å; Y595-V826 HydrophobicContact CG-CB 4.09Å; Y595-V826 HydrophobicContact CG-CG1 4.33Å; Y595-V826 WeakPolarHBondContact O-CB 3.38Å; Y595-V826 PolarHBondContact O-N 2.8Å; L614-V826 HydrophobicContact CD1-CG2 3.75Å; L806-V826 HydrophobicContact CB-CG1 3.86Å; L806-V826 HydrophobicContact CD1-CG1 4.12Å; L806-V826 HydrophobicContact CD2-CG1 4.07Å; L806-V826 HydrophobicContact CG-CG1 4.22Å; V824-V826 PolarHBondContact O-N 3.48Å; V826-F859 HydrophobicContact CG1-CD1 4.36Å; V826-F859 HydrophobicContact CG1-CE1 4.07Å
827	G	94.6	Very high	93.4	Very high	9 Å²	9	62.3 Å²	62.3	9%	0.093	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163	164.2	-173.2	0	0	0	0	0	113.4	Y595	Y595-G827 PolarHBondContact N-O 2.97Å; Y595-G827 PolarHBondContact O-N 3.03Å
828	L	95.4	Very high	93.6	Very high	119 Å²	119	61.1 Å²	61.1	62%	0.623	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.2	118.2	173.1	-60.7	174.3	0	0	0	107.4	V594	V594-L828 HydrophobicContact CB-CD2 4.09Å; V594-L828 HydrophobicContact CG1-CD2 3.65Å; V594-L828 HydrophobicContact CG2-CD2 3.76Å
829	L	94.7	Very high	93.9	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	106.5	-177.1	-68.1	68.6	0	0	0	108	K592 I593 T857 F859 I861	K592-L829 WeakPolarHBondContact CA-O 3.24Å; I593-L829 HydrophobicContact CB-CB 4.16Å; I593-L829 PolarHBondContact N-O 2.95Å; I593-L829 PolarHBondContact O-N 3.47Å; L829-T857 HydrophobicContact CB-CG2 3.8Å; L829-T857 HydrophobicContact CD2-CG2 4Å; L829-T857 WeakPolarHBondContact CD2-OG1 3.38Å; L829-T857 HydrophobicContact CG-CG2 3.72Å; L829-F859 HydrophobicContact CD1-CD2 3.91Å; L829-F859 HydrophobicContact CD1-CE2 4.46Å; L829-F859 HydrophobicContact CD1-CG 4.41Å; L829-F859 HydrophobicContact CD2-CB 4.33Å; L829-F859 HydrophobicContact CG-CD2 4.1Å; L829-I861 HydrophobicContact CD2-CD1 3.94Å; L829-I861 HydrophobicContact CD2-CG1 3.91Å
830	D	93.9	Very high	94.2	Very high	101 Å²	101	56.6 Å²	56.6	54%	0.54	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	120.1	174.6	-68.1	-41.1	0	0	0	109.6	K592	K592-D830 WeakPolarHBondContact CD-OD1 3.46Å; K592-D830 WeakPolarHBondContact CE-OD1 3.47Å; K592-D830 VanDerWaalsContact CG-OD1 3.24Å; K592-D830 WeakPolarHBondContact CG-OD1 3.26Å; K592-D830 IonicContact NZ-OD1 3.82Å; K592-D830 PolarHBondContact NZ-OD1 3.42Å; K592-D830 IonicContact NZ-OD2 3.94Å
831	L	93.2	Very high	94.2	Very high	8 Å²	8	50.8 Å²	50.8	4%	0.042	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	152.1	-175.8	-61.3	175.5	0	0	0	110.7	M591 I593 P833 A853 V854 T857 F889	M591-L831 HydrophobicContact CE-CB 4.01Å; M591-L831 HydrophobicContact CE-CD1 3.79Å; M591-L831 PolarHBondContact N-O 3.02Å; M591-L831 PolarHBondContact O-N 3.35Å; M591-L831 VanDerWaalsContact O-O 3.04Å; I593-L831 HydrophobicContact CD1-CD1 3.76Å; I593-L831 HydrophobicContact CG1-CD1 4.16Å; L831-P833 WeakPolarHBondContact O-CD 3.3Å; L831-A853 HydrophobicContact CB-CB 4.5Å; L831-A853 HydrophobicContact CD1-CB 4.27Å; L831-V854 WeakPolarHBondContact CD2-O 3.15Å; L831-T857 HydrophobicContact CD2-CG2 4.17Å; L831-F889 HydrophobicContact CD1-CE1 4.04Å; L831-F889 HydrophobicContact CD1-CZ 3.64Å
832	Q	91.9	Very high	94.2	Very high	173 Å²	173	51.6 Å²	51.6	81%	0.808	25%	0.248	S	C	*	.			trans	-112.2	90.4	171	-82.4	173	10.3	0	0	108.8
833	P	93.1	Very high	94	Very high	15 Å²	15	56.4 Å²	56.4	10%	0.097	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-76.2	156.9	178.1	33.2	-36.7	0	0	0	111	M591 L831 Y835 A851 T852 A853	M591-P833 HydrophobicContact CB-CG 3.62Å; M591-P833 HydrophobicContact CE-CB 4.22Å; M591-P833 HydrophobicContact CE-CG 4.34Å; M591-P833 HydrophobicContact SD-CG 4.29Å; L831-P833 WeakPolarHBondContact O-CD 3.3Å; P833-Y835 HydrophobicContact CG-CD2 4.48Å; P833-Y835 HydrophobicContact CG-CE1 3.89Å; P833-Y835 HydrophobicContact CG-CE2 3.7Å; P833-Y835 WeakPolarHBondContact CG-OH 3.46Å; P833-A851 HydrophobicContact CB-CB 3.86Å; P833-A851 HydrophobicContact CG-CB 4.4Å; P833-T852 CarbonylContact C-O 3.53Å; P833-T852 WeakPolarHBondContact CA-O 3.35Å; P833-A853 HydrophobicContact CB-CB 4.11Å
834	R	90.7	Very high	93.9	Very high	111 Å²	111	50.9 Å²	50.9	42%	0.419	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	125.7	158.4	174.5	178.9	154.8	159.3	-5.4	108.8	E836 T852	R834-E836 IonicContact NH2-OE2 2.73Å; R834-T852 PolarHBondContact N-O 3.07Å; R834-T852 PolarHBondContact O-N 3.24Å
835	Y	88.6	Confident	93.9	Very high	66 Å²	66	55.3 Å²	55.3	26%	0.259	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	138.4	173.5	-60.8	-75.9	0	0	0	111.5	I584 G589 T590 P833 L849 K850 A851 L893	I584-Y835 HydrophobicContact CG1-CE1 4.42Å; I584-Y835 HydrophobicContact CG2-CE1 4.08Å; I584-Y835 WeakPolarHBondContact CG2-OH 3.39Å; G589-Y835 WeakPolarHBondContact O-CE2 3.48Å; T590-Y835 PolarHBondContact O-OH 2.98Å; P833-Y835 HydrophobicContact CG-CD2 4.48Å; P833-Y835 HydrophobicContact CG-CE1 3.89Å; P833-Y835 HydrophobicContact CG-CE2 3.7Å; P833-Y835 WeakPolarHBondContact CG-OH 3.46Å; Y835-L849 HydrophobicContact CD1-CD1 4.15Å; Y835-L849 HydrophobicContact CD1-CD2 4.5Å; Y835-L849 HydrophobicContact CD1-CG 4.43Å; Y835-K850 WeakPolarHBondContact CA-O 3.23Å; Y835-A851 HydrophobicContact CD1-CB 3.99Å; Y835-A851 HydrophobicContact CE1-CB 3.84Å; Y835-L893 HydrophobicContact CD1-CD1 3.97Å; Y835-L893 HydrophobicContact CE1-CD1 3.66Å
836	E	89.5	Confident	93.7	Very high	28 Å²	28	58.5 Å²	58.5	13%	0.131	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	145.8	169.7	62.9	-171.8	-175.7	0	0	109.8	R834 V838 K850	R834-E836 IonicContact NH2-OE2 2.73Å; E836-V838 HydrophobicContact CG-CG2 4.21Å; E836-K850 HydrophobicContact CG-CB 4.18Å; E836-K850 HydrophobicContact CG-CD 4.25Å; E836-K850 PolarHBondContact N-O 3.38Å; E836-K850 WeakPolarHBondContact O-CB 3.26Å; E836-K850 PolarHBondContact O-N 3.11Å; E836-K850 WeakPolarHBondContact OE1-CD 3.35Å; E836-K850 IonicContact OE1-NZ 2.78Å; E836-K850 PolarHBondContact OE1-NZ 2.9Å
837	Y	94.3	Very high	93.7	Very high	24 Å²	24	58.3 Å²	58.3	9%	0.094	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	140.6	169.7	-66.3	-82.7	0	0	0	109.7	Y848 L849 E896 I899 R936 V938 R939 M941	Y837-Y848 CarbonylContact C-O 3.57Å; Y837-Y848 WeakPolarHBondContact CA-O 3.22Å; Y837-L849 HydrophobicContact CD1-CB 4.23Å; Y837-L849 HydrophobicContact CD1-CD1 4.14Å; Y837-L849 HydrophobicContact CE1-CB 4.02Å; Y837-L849 HydrophobicContact CE1-CD1 3.8Å; Y837-L849 HydrophobicContact CE1-CG 4.44Å; Y837-L849 HydrophobicContact CE2-CD1 4.49Å; Y837-E896 HydrophobicContact CD1-CB 4.1Å; Y837-E896 HydrophobicContact CD1-CG 4.33Å; Y837-E896 HydrophobicContact CE1-CB 3.69Å; Y837-E896 HydrophobicContact CE1-CG 3.6Å; Y837-I899 HydrophobicContact CD1-CD1 3.63Å; Y837-I899 HydrophobicContact CD2-CD1 3.84Å; Y837-I899 HydrophobicContact CE1-CD1 4.13Å; Y837-I899 HydrophobicContact CE2-CD1 4.27Å; Y837-I899 HydrophobicContact CG-CD1 3.44Å; Y837-I899 VanDerWaalsContact CG-CD1 3.44Å; Y837-R936 PolarHBondContact OH-NH2 2.86Å; Y837-V938 HydrophobicContact CD2-CG1 3.38Å; Y837-V938 HydrophobicContact CE2-CG1 3.66Å; Y837-V938 HydrophobicContact CE2-CG2 4.32Å; Y837-V938 HydrophobicContact CG-CG1 4.25Å; Y837-R939 PolarHBondContact N-O 2.94Å; Y837-M941 PolarHBondContact O-N 2.58Å
838	V	95.7	Very high	93.6	Very high	23 Å²	23	62 Å²	62	14%	0.139	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	138.1	177.9	-171.8	0	0	0	0	109.4	E836 Y848 K850 M941 V943	E836-V838 HydrophobicContact CG-CG2 4.21Å; V838-Y848 PolarHBondContact N-O 2.7Å; V838-Y848 PolarHBondContact O-N 3.24Å; V838-K850 HydrophobicContact CG2-CB 4.14Å; V838-K850 HydrophobicContact CG2-CD 3.97Å; V838-M941 CarbonylContact C-O 3.57Å; V838-M941 VanDerWaalsContact CA-O 3.3Å; V838-M941 WeakPolarHBondContact CA-O 3.08Å; V838-M941 HydrophobicContact CB-CE 4.29Å; V838-M941 HydrophobicContact CG1-CE 3.59Å; V838-M941 HydrophobicContact CG2-CB 4.37Å; V838-M941 HydrophobicContact CG2-CE 3.72Å; V838-V943 HydrophobicContact CG1-CG2 4.31Å
839	T	96.9	Very high	93.3	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.006	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	144.7	172.5	-175.9	0	0	0	0	111.5	P841 Y846 I901 L940 M941 V942 V943	T839-P841 HydrophobicContact CG2-CG 4.08Å; T839-Y846 PolarHBondContact OG1-O 2.78Å; T839-I901 HydrophobicContact CG2-CD1 4.02Å; T839-I901 HydrophobicContact CG2-CG1 4.33Å; T839-I901 WeakPolarHBondContact OG1-CD1 3.29Å; T839-L940 HydrophobicContact CG2-CD1 3.99Å; T839-L940 HydrophobicContact CG2-CD2 4.39Å; T839-L940 HydrophobicContact CG2-CG 4.38Å; T839-M941 PolarHBondContact N-O 2.92Å; T839-V942 HydrophobicContact CG2-CB 4.07Å; T839-V942 HydrophobicContact CG2-CG1 4.02Å; T839-V942 HydrophobicContact CG2-CG2 3.73Å; T839-V943 PolarHBondContact O-N 2.76Å
840	V	96.9	Very high	93.1	Very high	61 Å²	61	58.9 Å²	58.9	37%	0.37	27%	0.268	S	S	.	.			trans	-125.2	77.6	174.3	-171	0	0	0	0	107.4	K842 R843 S844 V943	V840-K842 PolarHBondContact O-N 2.91Å; V840-K842 VanDerWaalsContact O-N 3.08Å; V840-R843 HydrophobicContact CB-CB 4.5Å; V840-R843 HydrophobicContact CG1-CB 4.16Å; V840-R843 HydrophobicContact CG1-CG 4.07Å; V840-R843 PolarHBondContact O-N 3.47Å; V840-S844 PolarHBondContact O-N 3.35Å; V840-V943 HydrophobicContact CG2-CB 4.35Å
841	P	95.2	Very high	93	Very high	4 Å²	4	54.1 Å²	54.1	3%	0.026	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-29	-165.4	-29.1	38.9	0	0	0	114.6	T839 R843 S844 I901 Y903 I928 V942 V943	T839-P841 HydrophobicContact CG2-CG 4.08Å; P841-R843 PolarHBondContact O-N 3.26Å; P841-S844 VanDerWaalsContact CA-O 3.32Å; P841-S844 WeakPolarHBondContact CA-O 3.46Å; P841-I901 HydrophobicContact CB-CG2 3.77Å; P841-I901 HydrophobicContact CG-CG2 3.78Å; P841-Y903 HydrophobicContact CB-CD2 3.37Å; P841-Y903 HydrophobicContact CB-CE2 3.96Å; P841-Y903 HydrophobicContact CB-CG 3.98Å; P841-Y903 HydrophobicContact CG-CD2 4.44Å; P841-I928 HydrophobicContact CB-CG2 4.22Å; P841-I928 HydrophobicContact CG-CG2 3.85Å; P841-V942 HydrophobicContact CG-CG1 4.02Å; P841-V943 WeakPolarHBondContact CD-O 3.27Å
842	K	93.3	Very high	93	Very high	87 Å²	87	54.7 Å²	54.7	38%	0.378	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-23	175.3	-168.6	173.5	-177.1	175.1	0	113.4	V840 Y903 Q945	V840-K842 PolarHBondContact O-N 2.91Å; V840-K842 VanDerWaalsContact O-N 3.08Å; K842-Y903 HydrophobicContact CB-CE1 4.18Å; K842-Y903 HydrophobicContact CB-CE2 4.44Å; K842-Y903 HydrophobicContact CG-CE1 4.27Å; K842-Q945 HydrophobicContact CD-CG 3.95Å
843	R	92.9	Very high	93.1	Very high	151 Å²	151	46.7 Å²	46.7	57%	0.57	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.3	-36.1	-178.3	-68.3	-74.4	152	173.8	-4.9	112.6	V840 P841	V840-R843 HydrophobicContact CB-CB 4.5Å; V840-R843 HydrophobicContact CG1-CB 4.16Å; V840-R843 HydrophobicContact CG1-CG 4.07Å; V840-R843 PolarHBondContact O-N 3.47Å; P841-R843 PolarHBondContact O-N 3.26Å
844	S	93.2	Very high	93.2	Very high	26 Å²	26	48.5 Å²	48.5	18%	0.182	22%	0.221	C	C	.	.			trans	-152.6	134.3	179.7	174	0	0	0	0	110.3	V840 P841 Y846 Y848	V840-S844 PolarHBondContact O-N 3.35Å; P841-S844 VanDerWaalsContact CA-O 3.32Å; P841-S844 WeakPolarHBondContact CA-O 3.46Å; S844-Y846 PolarHBondContact O-N 2.84Å; S844-Y846 PolarHBondContact OG-N 3.41Å; S844-Y848 WeakPolarHBondContact CB-OH 3.46Å; S844-Y848 PolarHBondContact OG-OH 2.85Å
845	L	95	Very high	93.4	Very high	96 Å²	96	43.2 Å²	43.2	50%	0.503	20%	0.201	S	C	.	.	S	Bend	trans	-80.1	10.3	176.5	-60.7	-179	0	0	0	113.4	I901	L845-I901 HydrophobicContact CD2-CG2 4.46Å; L845-I901 WeakPolarHBondContact O-CD1 3.34Å
846	Y	93.9	Very high	93.6	Very high	120 Å²	120	46.2 Å²	46.2	47%	0.471	22%	0.222	S	C	.	.	S	Bend	trans	-97	149.1	174.6	-65.8	-81.4	0	0	0	111.4	T839 S844 A895	T839-Y846 PolarHBondContact OG1-O 2.78Å; S844-Y846 PolarHBondContact O-N 2.84Å; S844-Y846 PolarHBondContact OG-N 3.41Å; Y846-A895 HydrophobicContact CD1-CB 4.19Å; Y846-A895 HydrophobicContact CG-CB 4.15Å
847	A	94.4	Very high	93.7	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	142.5	160.6	0	0	0	0	0	108.3	A895 E896 I899 I901 L940	A847-A895 CarbonylContact O-C 3.58Å; A847-A895 WeakPolarHBondContact O-CA 3.46Å; A847-E896 PolarHBondContact O-N 3.46Å; A847-I899 HydrophobicContact CB-CB 3.75Å; A847-I899 HydrophobicContact CB-CD1 3.83Å; A847-I899 HydrophobicContact CB-CG1 4.35Å; A847-I899 HydrophobicContact CB-CG2 3.87Å; A847-I901 HydrophobicContact CB-CD1 3.97Å; A847-I901 VanDerWaalsContact N-CD1 3.34Å; A847-L940 HydrophobicContact CB-CD1 4.09Å
848	Y	92	Very high	93.5	Very high	88 Å²	88	53.4 Å²	53.4	35%	0.345	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	134.3	-179.3	-65	-96.3	0	0	0	109.5	Y837 V838 S844 G894 A895	Y837-Y848 CarbonylContact C-O 3.57Å; Y837-Y848 WeakPolarHBondContact CA-O 3.22Å; V838-Y848 PolarHBondContact N-O 2.7Å; V838-Y848 PolarHBondContact O-N 3.24Å; S844-Y848 WeakPolarHBondContact CB-OH 3.46Å; S844-Y848 PolarHBondContact OG-OH 2.85Å; Y848-G894 CarbonylContact C-O 3.5Å; Y848-G894 VanDerWaalsContact CA-O 3.28Å; Y848-G894 WeakPolarHBondContact CA-O 3.35Å; Y848-A895 HydrophobicContact CD1-CB 4.19Å; Y848-A895 HydrophobicContact CE1-CB 3.99Å
849	L	89.7	Confident	93.3	Very high	23 Å²	23	54.5 Å²	54.5	12%	0.12	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	126.3	172.5	-179.1	63.1	0	0	0	109	Y835 Y837 L893 G894	Y835-L849 HydrophobicContact CD1-CD1 4.15Å; Y835-L849 HydrophobicContact CD1-CD2 4.5Å; Y835-L849 HydrophobicContact CD1-CG 4.43Å; Y837-L849 HydrophobicContact CD1-CB 4.23Å; Y837-L849 HydrophobicContact CD1-CD1 4.14Å; Y837-L849 HydrophobicContact CE1-CB 4.02Å; Y837-L849 HydrophobicContact CE1-CD1 3.8Å; Y837-L849 HydrophobicContact CE1-CG 4.44Å; Y837-L849 HydrophobicContact CE2-CD1 4.49Å; L849-L893 HydrophobicContact CB-CB 4.17Å; L849-L893 HydrophobicContact CD2-CB 4.13Å; L849-L893 HydrophobicContact CD2-CD1 3.87Å; L849-L893 HydrophobicContact CG-CB 4.11Å; L849-L893 HydrophobicContact CG-CD1 3.91Å; L849-L893 HydrophobicContact CG-CG 4.5Å; L849-L893 WeakPolarHBondContact O-CB 3.37Å; L849-L893 PolarHBondContact O-N 3.07Å; L849-G894 PolarHBondContact N-O 3.11Å
850	K	91	Very high	93.1	Very high	31 Å²	31	56 Å²	56	14%	0.135	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	126.6	178	-178.8	-173.4	165.7	-147	0	109.3	Y835 E836 V838 N890	Y835-K850 WeakPolarHBondContact CA-O 3.23Å; E836-K850 HydrophobicContact CG-CB 4.18Å; E836-K850 HydrophobicContact CG-CD 4.25Å; E836-K850 PolarHBondContact N-O 3.38Å; E836-K850 WeakPolarHBondContact O-CB 3.26Å; E836-K850 PolarHBondContact O-N 3.11Å; E836-K850 WeakPolarHBondContact OE1-CD 3.35Å; E836-K850 IonicContact OE1-NZ 2.78Å; E836-K850 PolarHBondContact OE1-NZ 2.9Å; V838-K850 HydrophobicContact CG2-CB 4.14Å; V838-K850 HydrophobicContact CG2-CD 3.97Å; K850-N890 WeakPolarHBondContact CE-OD1 3.35Å
851	A	91	Very high	93	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.008	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	131.1	169.2	0	0	0	0	0	109.6	M591 P833 Y835 N890 C891 L893	M591-A851 HydrophobicContact SD-CB 4.27Å; P833-A851 HydrophobicContact CB-CB 3.86Å; P833-A851 HydrophobicContact CG-CB 4.4Å; Y835-A851 HydrophobicContact CD1-CB 3.99Å; Y835-A851 HydrophobicContact CE1-CB 3.84Å; A851-N890 CarbonylContact O-C 3.53Å; A851-N890 VanDerWaalsContact O-CA 3.3Å; A851-N890 WeakPolarHBondContact O-CA 3.44Å; A851-C891 HydrophobicContact CB-CB 4.38Å; A851-C891 PolarHBondContact N-O 2.98Å; A851-C891 PolarHBondContact O-N 2.78Å; A851-L893 HydrophobicContact CB-CD1 3.54Å; A851-L893 HydrophobicContact CB-CD2 4.41Å; A851-L893 HydrophobicContact CB-CG 4.13Å
852	T	93.4	Very high	92.9	Very high	20 Å²	20	54.1 Å²	54.1	12%	0.123	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	120.1	171.4	-52.3	0	0	0	0	108.4	P833 R834 E888 F889 N890	P833-T852 CarbonylContact C-O 3.53Å; P833-T852 WeakPolarHBondContact CA-O 3.35Å; R834-T852 PolarHBondContact N-O 3.07Å; R834-T852 PolarHBondContact O-N 3.24Å; T852-E888 HydrophobicContact CG2-CG 3.7Å; T852-E888 WeakPolarHBondContact CG2-OE1 3.3Å; T852-F889 WeakPolarHBondContact CA-O 3.48Å; T852-N890 WeakPolarHBondContact CG2-OD1 3.38Å; T852-N890 PolarHBondContact OG1-OD1 3.18Å
853	A	93.7	Very high	93	Very high	5 Å²	5	53 Å²	53	4%	0.041	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	155.2	-178.9	0	0	0	0	0	111	M591 L831 P833 E888 F889	M591-A853 HydrophobicContact CE-CB 3.78Å; L831-A853 HydrophobicContact CB-CB 4.5Å; L831-A853 HydrophobicContact CD1-CB 4.27Å; P833-A853 HydrophobicContact CB-CB 4.11Å; A853-E888 CarbonylContact O-C 3.55Å; A853-E888 WeakPolarHBondContact O-CA 3.11Å; A853-F889 HydrophobicContact CB-CD1 4.45Å; A853-F889 HydrophobicContact CB-CE1 3.86Å; A853-F889 HydrophobicContact CB-CZ 3.98Å; A853-F889 PolarHBondContact N-O 3.29Å; A853-F889 WeakPolarHBondContact O-CD1 3.06Å; A853-F889 PolarHBondContact O-N 2.71Å
854	V	95.1	Very high	93.1	Very high	52 Å²	52	46.3 Å²	46.3	32%	0.315	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	131.4	167.5	-177.7	0	0	0	0	107.8	L831 N856 E888	L831-V854 WeakPolarHBondContact CD2-O 3.15Å; V854-N856 VanDerWaalsContact C-N 3.25Å; V854-N856 VanDerWaalsContact CG1-OD1 3.25Å; V854-N856 WeakPolarHBondContact CG1-OD1 3.42Å; V854-N856 PolarHBondContact O-N 3.35Å; V854-E888 HydrophobicContact CG2-CB 4.29Å; V854-E888 HydrophobicContact CG2-CG 4.41Å
855	N	95	Very high	93.2	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.26	C	S	.	.			trans	-70.2	83.1	174.7	180	11.9	0	0	0	110.2	T857 F859 V883 A884 G886 E887 F889	N855-T857 PolarHBondContact O-N 3.18Å; N855-T857 PolarHBondContact OD1-N 3.43Å; N855-T857 PolarHBondContact OD1-OG1 3.17Å; N855-F859 PolarHBondContact ND2-O 3.31Å; N855-V883 HydrophobicContact CB-CG1 3.81Å; N855-V883 PolarHBondContact ND2-O 2.95Å; N855-A884 PolarHBondContact ND2-O 2.82Å; N855-G886 PolarHBondContact O-N 3.31Å; N855-E887 PolarHBondContact N-O 3.16Å; N855-F889 HydrophobicContact CB-CD1 4.41Å; N855-F889 HydrophobicContact CB-CE1 4.12Å
856	N	93.1	Very high	93.2	Very high	130 Å²	130	44.4 Å²	44.4	70%	0.695	24%	0.237	S	C	*	.			trans	-81.3	15.9	179.1	-65.6	-30.3	0	0	0	113	V854	V854-N856 VanDerWaalsContact C-N 3.25Å; V854-N856 VanDerWaalsContact CG1-OD1 3.25Å; V854-N856 WeakPolarHBondContact CG1-OD1 3.42Å; V854-N856 PolarHBondContact O-N 3.35Å
857	T	91.8	Very high	93.3	Very high	28 Å²	28	41.1 Å²	41.1	17%	0.172	23%	0.227	C	C	.	.	S	Bend	trans	-103	163	-178.2	80.1	0	0	0	0	110.8	L829 L831 N855 F859 P885	L829-T857 HydrophobicContact CB-CG2 3.8Å; L829-T857 HydrophobicContact CD2-CG2 4Å; L829-T857 WeakPolarHBondContact CD2-OG1 3.38Å; L829-T857 HydrophobicContact CG-CG2 3.72Å; L831-T857 HydrophobicContact CD2-CG2 4.17Å; N855-T857 PolarHBondContact O-N 3.18Å; N855-T857 PolarHBondContact OD1-N 3.43Å; N855-T857 PolarHBondContact OD1-OG1 3.17Å; T857-F859 PolarHBondContact O-N 3.43Å; T857-F859 PolarHBondContact OG1-N 3.28Å; T857-P885 WeakPolarHBondContact O-CB 3.33Å
858	E	90.6	Very high	93.2	Very high	174 Å²	174	41.2 Å²	41.2	81%	0.813	23%	0.228	S	C	*	.	S	Bend	trans	-74.1	-13.1	174	65.6	-171.4	149.7	0	0	113.1
859	F	91.8	Very high	93.2	Very high	46 Å²	46	39.1 Å²	39.1	20%	0.202	22%	0.22	C	C	.	.	S	Bend	trans	-77.7	130.7	-179.1	-62.6	-76.5	0	0	0	111	L806 V826 L829 N855 T857 I861	L806-F859 HydrophobicContact CD2-CD1 4.04Å; V826-F859 HydrophobicContact CG1-CD1 4.36Å; V826-F859 HydrophobicContact CG1-CE1 4.07Å; L829-F859 HydrophobicContact CD1-CD2 3.91Å; L829-F859 HydrophobicContact CD1-CE2 4.46Å; L829-F859 HydrophobicContact CD1-CG 4.41Å; L829-F859 HydrophobicContact CD2-CB 4.33Å; L829-F859 HydrophobicContact CG-CD2 4.1Å; N855-F859 PolarHBondContact ND2-O 3.31Å; T857-F859 PolarHBondContact O-N 3.43Å; T857-F859 PolarHBondContact OG1-N 3.28Å; F859-I861 PolarHBondContact O-N 2.61Å
860	S	92.7	Very high	93.1	Very high	34 Å²	34	39 Å²	39	24%	0.238	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-76.6	117.9	159.1	-61.2	0	0	0	0	108.3	I804 L862 P885	I804-S860 VanDerWaalsContact CD1-CB 3.49Å; S860-L862 PolarHBondContact O-N 2.75Å; S860-P885 WeakPolarHBondContact OG-CD 3.3Å
861	I	93.7	Very high	92.9	Very high	2 Å²	2	41 Å²	41	1%	0.01	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-75.8	124.5	174.5	-58.2	175	0	0	0	106.7	Y580 I593 L829 F859 I880 A882 V883 F889	Y580-I861 HydrophobicContact CE1-CG2 3.87Å; Y580-I861 HydrophobicContact CE2-CG2 4.41Å; I593-I861 HydrophobicContact CD1-CD1 4.49Å; L829-I861 HydrophobicContact CD2-CD1 3.94Å; L829-I861 HydrophobicContact CD2-CG1 3.91Å; F859-I861 PolarHBondContact O-N 2.61Å; I861-I880 HydrophobicContact CD1-CD1 4.3Å; I861-I880 HydrophobicContact CG2-CD1 3.79Å; I861-I880 HydrophobicContact CG2-CG1 4.09Å; I861-I880 HydrophobicContact CG2-CG2 4Å; I861-A882 CarbonylContact O-C 3.55Å; I861-A882 VanDerWaalsContact O-CA 3.25Å; I861-A882 WeakPolarHBondContact O-CA 3.43Å; I861-V883 HydrophobicContact CB-CB 4.04Å; I861-V883 HydrophobicContact CD1-CB 4.33Å; I861-V883 PolarHBondContact N-O 2.81Å; I861-V883 PolarHBondContact O-N 2.98Å; I861-F889 HydrophobicContact CD1-CE1 4.31Å; I861-F889 HydrophobicContact CD1-CZ 4.06Å
862	L	93.9	Very high	92.6	Very high	22 Å²	22	45.9 Å²	45.9	12%	0.115	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-86.7	155.2	175	-62.8	-179.3	0	0	0	110	W576 P578 Y580 Y595 T616 I804 S860 G864	W576-L862 HydrophobicContact CH2-CD1 3.48Å; W576-L862 VanDerWaalsContact CH2-CD1 3.48Å; W576-L862 HydrophobicContact CZ2-CD1 4.21Å; W576-L862 HydrophobicContact CZ3-CD1 4.25Å; P578-L862 HydrophobicContact CB-CB 3.94Å; P578-L862 HydrophobicContact CB-CD1 4.39Å; P578-L862 HydrophobicContact CG-CB 3.83Å; P578-L862 HydrophobicContact CG-CD1 4.39Å; Y580-L862 WeakPolarHBondContact CE2-O 3.47Å; Y580-L862 PolarHBondContact OH-N 3.42Å; Y580-L862 PolarHBondContact OH-O 2.79Å; Y595-L862 VanDerWaalsContact OH-CD1 3.29Å; Y595-L862 WeakPolarHBondContact OH-CD1 3.35Å; Y595-L862 WeakPolarHBondContact OH-CG 3.33Å; T616-L862 HydrophobicContact CG2-CD1 3.44Å; T616-L862 VanDerWaalsContact CG2-CD1 3.44Å; T616-L862 HydrophobicContact CG2-CD2 4.17Å; T616-L862 HydrophobicContact CG2-CG 4.47Å; I804-L862 HydrophobicContact CD1-CD2 3.48Å; I804-L862 VanDerWaalsContact CD1-CD2 3.48Å; S860-L862 PolarHBondContact O-N 2.75Å; L862-G864 PolarHBondContact O-N 3.2Å
863	A	95.5	Very high	92.4	Very high	63 Å²	63	49.4 Å²	49.4	52%	0.521	28%	0.282	S	S	.	.	S	Bend	trans	-63.3	133	173.7	0	0	0	0	0	110.3	P578 I880 A882	P578-A863 WeakPolarHBondContact CG-O 3.38Å; A863-I880 CarbonylContact C-O 3.59Å; A863-I880 VanDerWaalsContact CA-O 3.25Å; A863-I880 WeakPolarHBondContact CA-O 3.49Å; A863-A882 HydrophobicContact CB-CB 4.44Å
864	G	94.4	Very high	92.3	Very high	12 Å²	12	54 Å²	54	12%	0.124	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.6	168.3	-179.6	0	0	0	0	0	115.6	L862 I880	L862-G864 PolarHBondContact O-N 3.2Å; G864-I880 PolarHBondContact N-O 3.33Å; G864-I880 PolarHBondContact O-N 3.09Å
865	P	95.7	Very high	91.9	Very high	80 Å²	80	55.1 Å²	55.1	52%	0.519	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	146.2	178.8	29.8	-36.1	0	0	0	111.3	Y580	Y580-P865 PolarHBondContact N-O 3.03Å
866	T	94.7	Very high	91.6	Very high	2 Å²	2	56 Å²	56	1%	0.012	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	128.8	-174.8	-59.8	0	0	0	0	111.3	Y580 I582 I868 K877 S878	Y580-T866 CarbonylContact O-C 3.56Å; Y580-T866 VanDerWaalsContact O-CA 3.3Å; Y580-T866 WeakPolarHBondContact O-CA 3.35Å; I582-T866 HydrophobicContact CB-CG2 4.1Å; I582-T866 HydrophobicContact CD1-CG2 3.51Å; I582-T866 HydrophobicContact CG1-CG2 3.44Å; I582-T866 VanDerWaalsContact CG1-CG2 3.44Å; T866-I868 HydrophobicContact CG2-CG1 4.25Å; T866-K877 CarbonylContact O-C 3.54Å; T866-K877 VanDerWaalsContact O-CA 3.32Å; T866-K877 WeakPolarHBondContact O-CA 3.28Å; T866-S878 PolarHBondContact N-O 2.59Å; T866-S878 PolarHBondContact O-N 2.79Å
867	N	95.2	Very high	91.5	Very high	50 Å²	50	57.9 Å²	57.9	27%	0.267	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	139.5	164.5	-57	-50.6	0	0	0	109.3	Y580 D581 I582 Y869 F874	Y580-N867 PolarHBondContact O-N 3.33Å; D581-N867 CarbonylContact C-O 3.58Å; D581-N867 WeakPolarHBondContact CA-O 3.34Å; D581-N867 WeakPolarHBondContact OD1-CB 3.21Å; D581-N867 PolarHBondContact OD1-ND2 3Å; I582-N867 PolarHBondContact N-O 3.03Å; N867-Y869 HydrophobicContact CB-CE2 3.72Å; N867-F874 HydrophobicContact CB-CD2 4.43Å; N867-F874 HydrophobicContact CB-CE2 4.01Å
868	I	93.3	Very high	91.5	Very high	3 Å²	3	58.1 Å²	58.1	2%	0.015	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	133	-178.7	-55.7	155.5	0	0	0	109.3	I582 I584 T866 I875 G876 S878 H892 L893	I582-I868 HydrophobicContact CB-CG1 4.5Å; I582-I868 CarbonylContact O-C 3.47Å; I582-I868 WeakPolarHBondContact O-CA 3.38Å; I584-I868 HydrophobicContact CD1-CG2 3.86Å; T866-I868 HydrophobicContact CG2-CG1 4.25Å; I868-I875 HydrophobicContact CB-CD1 4.47Å; I868-I875 HydrophobicContact CB-CG1 3.96Å; I868-I875 HydrophobicContact CG2-CD1 3.63Å; I868-I875 HydrophobicContact CG2-CG1 3.63Å; I868-I875 WeakPolarHBondContact O-CG1 3.39Å; I868-I875 PolarHBondContact O-N 3.22Å; I868-G876 PolarHBondContact N-O 3.3Å; I868-S878 VanDerWaalsContact CD1-CB 3.44Å; I868-H892 VanDerWaalsContact CD1-O 3.27Å; I868-H892 WeakPolarHBondContact CD1-O 3.42Å; I868-L893 HydrophobicContact CD1-CD2 4.45Å; I868-L893 HydrophobicContact CG2-CB 4.43Å; I868-L893 HydrophobicContact CG2-CD2 4.02Å
869	Y	92.5	Very high	91.5	Very high	44 Å²	44	57.5 Å²	57.5	17%	0.173	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	133.5	176.6	-57.7	-98.4	0	0	0	109.5	D581 I582 R583 I584 N867 T873 F874	D581-Y869 HydrophobicContact CB-CD2 4.35Å; D581-Y869 HydrophobicContact CB-CE2 3.95Å; I582-Y869 PolarHBondContact O-N 3.17Å; R583-Y869 CarbonylContact C-O 3.51Å; R583-Y869 WeakPolarHBondContact CA-O 3.27Å; R583-Y869 HydrophobicContact CG-CD2 4.27Å; R583-Y869 HydrophobicContact CG-CG 4.47Å; I584-Y869 PolarHBondContact N-O 2.68Å; N867-Y869 HydrophobicContact CB-CE2 3.72Å; Y869-T873 CarbonylContact C-O 3.59Å; Y869-T873 WeakPolarHBondContact CA-O 3.41Å; Y869-F874 HydrophobicContact CD1-CB 3.96Å; Y869-F874 HydrophobicContact CE1-CB 3.8Å; Y869-F874 HydrophobicContact CE1-CD2 4.05Å; Y869-F874 HydrophobicContact CE1-CG 4.42Å
870	A	87.8	Confident	91.5	Very high	21 Å²	21	55.6 Å²	55.6	17%	0.174	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	125.8	166.7	0	0	0	0	0	109	N872 T873 I875	A870-N872 PolarHBondContact O-N 3.07Å; A870-N872 VanDerWaalsContact O-N 3.16Å; A870-T873 PolarHBondContact N-O 2.85Å; A870-T873 WeakPolarHBondContact O-CB 3.35Å; A870-T873 PolarHBondContact O-N 3.43Å; A870-I875 HydrophobicContact CB-CD1 3.93Å; A870-I875 HydrophobicContact CB-CG2 4.01Å
871	D	85.5	Confident	91.6	Very high	71 Å²	71	60.1 Å²	60.1	38%	0.38	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.2	47.5	-177.2	-57	-40.1	0	0	0	112.1	I584 N586 T873	I584-D871 PolarHBondContact O-N 2.92Å; N586-D871 WeakPolarHBondContact CB-OD2 3.5Å; N586-D871 PolarHBondContact N-OD1 3.28Å; N586-D871 PolarHBondContact ND2-OD2 3.06Å; D871-T873 PolarHBondContact O-N 2.89Å
872	N	85.8	Confident	91.6	Very high	104 Å²	104	62.8 Å²	62.8	56%	0.556	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	2.2	-176.2	-62	-30.1	0	0	0	117.2	R583 A870	R583-N872 PolarHBondContact NH1-OD1 2.84Å; A870-N872 PolarHBondContact O-N 3.07Å; A870-N872 VanDerWaalsContact O-N 3.16Å
873	T	89.4	Confident	91.6	Very high	95 Å²	95	61.9 Å²	61.9	58%	0.583	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.9	128.8	174.1	-57.1	0	0	0	0	110.2	Y869 A870 D871 I875	Y869-T873 CarbonylContact C-O 3.59Å; Y869-T873 WeakPolarHBondContact CA-O 3.41Å; A870-T873 PolarHBondContact N-O 2.85Å; A870-T873 WeakPolarHBondContact O-CB 3.35Å; A870-T873 PolarHBondContact O-N 3.43Å; D871-T873 PolarHBondContact O-N 2.89Å; T873-I875 PolarHBondContact O-N 2.94Å
874	F	90.6	Very high	91.6	Very high	102 Å²	102	61 Å²	61	45%	0.447	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	123.1	174.7	175.6	-101.7	0	0	0	110.1	N867 Y869 G876 K877	N867-F874 HydrophobicContact CB-CD2 4.43Å; N867-F874 HydrophobicContact CB-CE2 4.01Å; Y869-F874 HydrophobicContact CD1-CB 3.96Å; Y869-F874 HydrophobicContact CE1-CB 3.8Å; Y869-F874 HydrophobicContact CE1-CD2 4.05Å; Y869-F874 HydrophobicContact CE1-CG 4.42Å; F874-G876 WeakPolarHBondContact CE2-O 3.45Å; F874-G876 WeakPolarHBondContact CZ-O 3.33Å; F874-K877 HydrophobicContact CE2-CG 4.33Å; F874-K877 HydrophobicContact CZ-CG 3.9Å
875	I	87.2	Confident	91.6	Very high	75 Å²	75	63.6 Å²	63.6	39%	0.385	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	-16.2	-177.7	62.5	173.7	0	0	0	113.6	I584 I868 A870 T873 L893	I584-I875 HydrophobicContact CD1-CD1 4.48Å; I868-I875 HydrophobicContact CB-CD1 4.47Å; I868-I875 HydrophobicContact CB-CG1 3.96Å; I868-I875 HydrophobicContact CG2-CD1 3.63Å; I868-I875 HydrophobicContact CG2-CG1 3.63Å; I868-I875 WeakPolarHBondContact O-CG1 3.39Å; I868-I875 PolarHBondContact O-N 3.22Å; A870-I875 HydrophobicContact CB-CD1 3.93Å; A870-I875 HydrophobicContact CB-CG2 4.01Å; T873-I875 PolarHBondContact O-N 2.94Å; I875-L893 WeakPolarHBondContact CD1-O 3.43Å
876	G	88.5	Confident	91.5	Very high	19 Å²	19	62.4 Å²	62.4	20%	0.196	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.4	-176.2	175.7	0	0	0	0	0	115.2	I868 F874	I868-G876 PolarHBondContact N-O 3.3Å; F874-G876 WeakPolarHBondContact CE2-O 3.45Å; F874-G876 WeakPolarHBondContact CZ-O 3.33Å
877	K	91.7	Very high	91.5	Very high	168 Å²	168	65.9 Å²	65.9	73%	0.73	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.2	150.9	172.4	-60.3	-174.1	178.2	176.9	0	109.8	T866 F874	T866-K877 CarbonylContact O-C 3.54Å; T866-K877 VanDerWaalsContact O-CA 3.32Å; T866-K877 WeakPolarHBondContact O-CA 3.28Å; F874-K877 HydrophobicContact CE2-CG 4.33Å; F874-K877 HydrophobicContact CZ-CG 3.9Å
878	S	90.7	Very high	91.5	Very high	33 Å²	33	68.4 Å²	68.4	23%	0.231	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	-176.9	177.2	-167.5	0	0	0	0	109.1	T866 I868 H892	T866-S878 PolarHBondContact N-O 2.59Å; T866-S878 PolarHBondContact O-N 2.79Å; I868-S878 VanDerWaalsContact CD1-CB 3.44Å; S878-H892 PolarHBondContact OG-O 3.29Å
879	E	92	Very high	91.5	Very high	162 Å²	162	68.3 Å²	68.3	76%	0.757	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.2	139.7	171.6	-66.3	-175	171	0	0	109
880	I	91.8	Very high	91.4	Very high	5 Å²	5	69.1 Å²	69.1	3%	0.026	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	135.6	169.1	-163.1	162.3	0	0	0	107.7	Y580 I593 I861 A863 G864 F889	Y580-I880 HydrophobicContact CD2-CG2 3.33Å; Y580-I880 HydrophobicContact CE2-CG2 3.37Å; Y580-I880 HydrophobicContact CG-CG2 4.01Å; I593-I880 HydrophobicContact CD1-CD1 4.19Å; I861-I880 HydrophobicContact CD1-CD1 4.3Å; I861-I880 HydrophobicContact CG2-CD1 3.79Å; I861-I880 HydrophobicContact CG2-CG1 4.09Å; I861-I880 HydrophobicContact CG2-CG2 4Å; A863-I880 CarbonylContact C-O 3.59Å; A863-I880 VanDerWaalsContact CA-O 3.25Å; A863-I880 WeakPolarHBondContact CA-O 3.49Å; G864-I880 PolarHBondContact N-O 3.33Å; G864-I880 PolarHBondContact O-N 3.09Å; I880-F889 HydrophobicContact CD1-CD2 4.04Å; I880-F889 HydrophobicContact CD1-CE2 3.64Å; I880-F889 HydrophobicContact CG1-CD2 4.38Å; I880-F889 HydrophobicContact CG1-CE2 4.45Å
881	R	93.9	Very high	91.4	Very high	130 Å²	130	68.5 Å²	68.5	49%	0.491	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-74.9	169.8	173.1	65.9	-179.5	-171.1	172.3	5.3	110.7	V883 E887 E888	R881-V883 HydrophobicContact CG-CG2 3.95Å; R881-V883 WeakPolarHBondContact O-CG2 3.19Å; R881-V883 PolarHBondContact O-N 3.17Å; R881-E887 IonicContact NH2-OE1 3.58Å; R881-E888 PolarHBondContact NH2-O 3.05Å
882	A	94.2	Very high	91.5	Very high	58 Å²	58	70.3 Å²	70.3	48%	0.479	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-65.1	131.2	167.2	0	0	0	0	0	110	I861 A863	I861-A882 CarbonylContact O-C 3.55Å; I861-A882 VanDerWaalsContact O-CA 3.25Å; I861-A882 WeakPolarHBondContact O-CA 3.43Å; A863-A882 HydrophobicContact CB-CB 4.44Å
883	V	94.3	Very high	91.5	Very high	2 Å²	2	65.5 Å²	65.5	1%	0.012	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-135.4	117	-178.7	-172.4	0	0	0	0	109.4	N855 I861 R881 E887 F889	N855-V883 HydrophobicContact CB-CG1 3.81Å; N855-V883 PolarHBondContact ND2-O 2.95Å; I861-V883 HydrophobicContact CB-CB 4.04Å; I861-V883 HydrophobicContact CD1-CB 4.33Å; I861-V883 PolarHBondContact N-O 2.81Å; I861-V883 PolarHBondContact O-N 2.98Å; R881-V883 HydrophobicContact CG-CG2 3.95Å; R881-V883 WeakPolarHBondContact O-CG2 3.19Å; R881-V883 PolarHBondContact O-N 3.17Å; V883-E887 HydrophobicContact CG1-CB 3.78Å; V883-E887 HydrophobicContact CG1-CG 4.2Å; V883-F889 HydrophobicContact CB-CB 4.39Å; V883-F889 HydrophobicContact CB-CD1 4.44Å; V883-F889 HydrophobicContact CB-CG 4.43Å; V883-F889 HydrophobicContact CG1-CB 3.92Å; V883-F889 HydrophobicContact CG1-CD1 3.65Å; V883-F889 HydrophobicContact CG1-CE1 4.4Å; V883-F889 HydrophobicContact CG1-CG 3.97Å; V883-F889 HydrophobicContact CG2-CB 3.5Å; V883-F889 VanDerWaalsContact CG2-CB 3.5Å; V883-F889 HydrophobicContact CG2-CD1 4.18Å; V883-F889 HydrophobicContact CG2-CD2 4.12Å; V883-F889 HydrophobicContact CG2-CG 3.7Å
884	A	93.8	Very high	91.2	Very high	46 Å²	46	62.4 Å²	62.4	38%	0.38	34%	0.341	S	S	.	.			trans	-73	158.5	175.9	0	0	0	0	0	111.7	N855 G886 E887	N855-A884 PolarHBondContact ND2-O 2.82Å; A884-G886 PolarHBondContact O-N 3.28Å; A884-E887 HydrophobicContact CB-CB 4.43Å; A884-E887 PolarHBondContact N-OE2 2.98Å; A884-E887 VanDerWaalsContact O-CB 3.28Å; A884-E887 WeakPolarHBondContact O-CB 3.41Å; A884-E887 PolarHBondContact O-N 2.83Å; A884-E887 VanDerWaalsContact O-N 3.08Å
885	P	94.1	Very high	91	Very high	65 Å²	65	60 Å²	60	42%	0.422	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	131.1	168.3	-28.7	37.6	0	0	0	111.7	T857 S860 E887	T857-P885 WeakPolarHBondContact O-CB 3.33Å; S860-P885 WeakPolarHBondContact OG-CD 3.3Å; P885-E887 VanDerWaalsContact C-N 3.3Å; P885-E887 PolarHBondContact O-N 3.03Å
886	G	94.1	Very high	90.9	Very high	55 Å²	55	58.9 Å²	58.9	57%	0.567	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.8	-5.2	-176.9	0	0	0	0	0	115.6	N855 A884	N855-G886 PolarHBondContact O-N 3.31Å; A884-G886 PolarHBondContact O-N 3.28Å
887	E	94.7	Very high	90.8	Very high	75 Å²	75	62.8 Å²	62.8	35%	0.35	35%	0.35	S	S	.	.			trans	-80.8	140.2	178.1	-170.8	-174.5	165.6	0	0	111.7	N855 R881 V883 A884 P885	N855-E887 PolarHBondContact N-O 3.16Å; R881-E887 IonicContact NH2-OE1 3.58Å; V883-E887 HydrophobicContact CG1-CB 3.78Å; V883-E887 HydrophobicContact CG1-CG 4.2Å; A884-E887 HydrophobicContact CB-CB 4.43Å; A884-E887 PolarHBondContact N-OE2 2.98Å; A884-E887 VanDerWaalsContact O-CB 3.28Å; A884-E887 WeakPolarHBondContact O-CB 3.41Å; A884-E887 PolarHBondContact O-N 2.83Å; A884-E887 VanDerWaalsContact O-N 3.08Å; P885-E887 VanDerWaalsContact C-N 3.3Å; P885-E887 PolarHBondContact O-N 3.03Å
888	E	95	Very high	90.7	Very high	104 Å²	104	55.1 Å²	55.1	49%	0.486	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	136.7	170.9	-172.9	179.7	110	0	0	110.4	T852 A853 V854 R881	T852-E888 HydrophobicContact CG2-CG 3.7Å; T852-E888 WeakPolarHBondContact CG2-OE1 3.3Å; A853-E888 CarbonylContact O-C 3.55Å; A853-E888 WeakPolarHBondContact O-CA 3.11Å; V854-E888 HydrophobicContact CG2-CB 4.29Å; V854-E888 HydrophobicContact CG2-CG 4.41Å; R881-E888 PolarHBondContact NH2-O 3.05Å
889	F	93.7	Very high	90.9	Very high	1 Å²	1	53.7 Å²	53.7	0%	0.004	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	157.7	178.5	70.4	-76.7	0	0	0	112	M591 I593 L831 T852 A853 N855 I861 I880 V883 C891	M591-F889 HydrophobicContact CE-CZ 4.42Å; I593-F889 HydrophobicContact CD1-CE2 4.03Å; I593-F889 HydrophobicContact CD1-CZ 3.82Å; L831-F889 HydrophobicContact CD1-CE1 4.04Å; L831-F889 HydrophobicContact CD1-CZ 3.64Å; T852-F889 WeakPolarHBondContact CA-O 3.48Å; A853-F889 HydrophobicContact CB-CD1 4.45Å; A853-F889 HydrophobicContact CB-CE1 3.86Å; A853-F889 HydrophobicContact CB-CZ 3.98Å; A853-F889 PolarHBondContact N-O 3.29Å; A853-F889 WeakPolarHBondContact O-CD1 3.06Å; A853-F889 PolarHBondContact O-N 2.71Å; N855-F889 HydrophobicContact CB-CD1 4.41Å; N855-F889 HydrophobicContact CB-CE1 4.12Å; I861-F889 HydrophobicContact CD1-CE1 4.31Å; I861-F889 HydrophobicContact CD1-CZ 4.06Å; I880-F889 HydrophobicContact CD1-CD2 4.04Å; I880-F889 HydrophobicContact CD1-CE2 3.64Å; I880-F889 HydrophobicContact CG1-CD2 4.38Å; I880-F889 HydrophobicContact CG1-CE2 4.45Å; V883-F889 HydrophobicContact CB-CB 4.39Å; V883-F889 HydrophobicContact CB-CD1 4.44Å; V883-F889 HydrophobicContact CB-CG 4.43Å; V883-F889 HydrophobicContact CG1-CB 3.92Å; V883-F889 HydrophobicContact CG1-CD1 3.65Å; V883-F889 HydrophobicContact CG1-CE1 4.4Å; V883-F889 HydrophobicContact CG1-CG 3.97Å; V883-F889 HydrophobicContact CG2-CB 3.5Å; V883-F889 VanDerWaalsContact CG2-CB 3.5Å; V883-F889 HydrophobicContact CG2-CD1 4.18Å; V883-F889 HydrophobicContact CG2-CD2 4.12Å; V883-F889 HydrophobicContact CG2-CG 3.7Å; F889-C891 WeakPolarHBondContact CE2-SG 3.46Å
890	N	91.4	Very high	91.1	Very high	60 Å²	60	51.1 Å²	51.1	32%	0.321	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	138.3	178.5	-60.6	-44.2	0	0	0	109.5	K850 A851 T852	K850-N890 WeakPolarHBondContact CE-OD1 3.35Å; A851-N890 CarbonylContact O-C 3.53Å; A851-N890 VanDerWaalsContact O-CA 3.3Å; A851-N890 WeakPolarHBondContact O-CA 3.44Å; T852-N890 WeakPolarHBondContact CG2-OD1 3.38Å; T852-N890 PolarHBondContact OG1-OD1 3.18Å
891	C	87.2	Confident	91.4	Very high	8 Å²	8	51.7 Å²	51.7	5%	0.054	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	126.7	167.8	-65.8	0	0	0	0	109.1	I582 A851 F889 L893	I582-C891 HydrophobicContact CD1-CB 4.14Å; A851-C891 HydrophobicContact CB-CB 4.38Å; A851-C891 PolarHBondContact N-O 2.98Å; A851-C891 PolarHBondContact O-N 2.78Å; F889-C891 WeakPolarHBondContact CE2-SG 3.46Å; C891-L893 HydrophobicContact CB-CD2 3.8Å
892	H	86.9	Confident	91.5	Very high	110 Å²	110	49.5 Å²	49.5	51%	0.509	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	115.3	173.7	-59.7	-72.9	0	0	0	108.6	I868 S878	I868-H892 VanDerWaalsContact CD1-O 3.27Å; I868-H892 WeakPolarHBondContact CD1-O 3.42Å; S878-H892 PolarHBondContact OG-O 3.29Å
893	L	85.4	Confident	91.6	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	-0.8	-165.3	-55.5	178.4	0	0	0	113.9	I582 I584 Y835 L849 A851 I868 I875 C891	I582-L893 HydrophobicContact CG2-CD2 4.44Å; I584-L893 HydrophobicContact CD1-CB 4.09Å; I584-L893 HydrophobicContact CD1-CD1 3.35Å; I584-L893 HydrophobicContact CD1-CD2 3.87Å; I584-L893 HydrophobicContact CD1-CG 3.93Å; I584-L893 HydrophobicContact CG1-CD1 4.01Å; Y835-L893 HydrophobicContact CD1-CD1 3.97Å; Y835-L893 HydrophobicContact CE1-CD1 3.66Å; L849-L893 HydrophobicContact CB-CB 4.17Å; L849-L893 HydrophobicContact CD2-CB 4.13Å; L849-L893 HydrophobicContact CD2-CD1 3.87Å; L849-L893 HydrophobicContact CG-CB 4.11Å; L849-L893 HydrophobicContact CG-CD1 3.91Å; L849-L893 HydrophobicContact CG-CG 4.5Å; L849-L893 WeakPolarHBondContact O-CB 3.37Å; L849-L893 PolarHBondContact O-N 3.07Å; A851-L893 HydrophobicContact CB-CD1 3.54Å; A851-L893 HydrophobicContact CB-CD2 4.41Å; A851-L893 HydrophobicContact CB-CG 4.13Å; I868-L893 HydrophobicContact CD1-CD2 4.45Å; I868-L893 HydrophobicContact CG2-CB 4.43Å; I868-L893 HydrophobicContact CG2-CD2 4.02Å; I875-L893 WeakPolarHBondContact CD1-O 3.43Å; C891-L893 HydrophobicContact CB-CD2 3.8Å
894	G	83.8	Confident	91.5	Very high	30 Å²	30	53 Å²	53	31%	0.309	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	116.6	175	178.7	0	0	0	0	0	113.5	Y848 L849	Y848-G894 CarbonylContact C-O 3.5Å; Y848-G894 VanDerWaalsContact CA-O 3.28Å; Y848-G894 WeakPolarHBondContact CA-O 3.35Å; L849-G894 PolarHBondContact N-O 3.11Å
895	A	87.7	Confident	91.3	Very high	53 Å²	53	56 Å²	56	44%	0.438	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	142.1	177.6	0	0	0	0	0	111	Y846 A847 Y848	Y846-A895 HydrophobicContact CD1-CB 4.19Å; Y846-A895 HydrophobicContact CG-CB 4.15Å; A847-A895 CarbonylContact O-C 3.58Å; A847-A895 WeakPolarHBondContact O-CA 3.46Å; Y848-A895 HydrophobicContact CD1-CB 4.19Å; Y848-A895 HydrophobicContact CE1-CB 3.99Å
896	E	84.3	Confident	91.2	Very high	50 Å²	50	56.9 Å²	56.9	23%	0.234	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	127	178.7	179.5	53	-109.1	0	0	110.6	Y837 A847 G898 F934	Y837-E896 HydrophobicContact CD1-CB 4.1Å; Y837-E896 HydrophobicContact CD1-CG 4.33Å; Y837-E896 HydrophobicContact CE1-CB 3.69Å; Y837-E896 HydrophobicContact CE1-CG 3.6Å; A847-E896 PolarHBondContact O-N 3.46Å; E896-G898 PolarHBondContact OE1-N 3.17Å; E896-F934 HydrophobicContact CG-CE2 3.84Å; E896-F934 HydrophobicContact CG-CZ 3.55Å; E896-F934 WeakPolarHBondContact OE1-CZ 3.37Å
897	N	86.1	Confident	91	Very high	101 Å²	101	59.8 Å²	59.8	54%	0.54	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-18.5	-178.6	-73	-41.1	0	0	0	113	I899 K900	N897-I899 PolarHBondContact O-N 3.14Å; N897-K900 WeakPolarHBondContact O-CE 3.45Å; N897-K900 PolarHBondContact O-NZ 3.32Å
898	G	90	Very high	90.8	Very high	7 Å²	7	63.6 Å²	63.6	7%	0.072	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	0.6	179.2	0	0	0	0	0	115.8	E896 T933 F934	E896-G898 PolarHBondContact OE1-N 3.17Å; G898-T933 VanDerWaalsContact C-OG1 3.25Å; G898-T933 VanDerWaalsContact CA-OG1 3.23Å; G898-T933 WeakPolarHBondContact CA-OG1 3.3Å; G898-T933 PolarHBondContact O-N 3.18Å; G898-T933 PolarHBondContact O-OG1 2.84Å; G898-F934 WeakPolarHBondContact O-CD2 3.24Å
899	I	94.4	Very high	90.5	Very high	4 Å²	4	63 Å²	63	2%	0.021	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	114.7	174.3	-56.3	172.6	0	0	0	107.4	Y837 A847 N897 R931 F934 V938 L940	Y837-I899 HydrophobicContact CD1-CD1 3.63Å; Y837-I899 HydrophobicContact CD2-CD1 3.84Å; Y837-I899 HydrophobicContact CE1-CD1 4.13Å; Y837-I899 HydrophobicContact CE2-CD1 4.27Å; Y837-I899 HydrophobicContact CG-CD1 3.44Å; Y837-I899 VanDerWaalsContact CG-CD1 3.44Å; A847-I899 HydrophobicContact CB-CB 3.75Å; A847-I899 HydrophobicContact CB-CD1 3.83Å; A847-I899 HydrophobicContact CB-CG1 4.35Å; A847-I899 HydrophobicContact CB-CG2 3.87Å; N897-I899 PolarHBondContact O-N 3.14Å; I899-R931 CarbonylContact C-O 3.53Å; I899-R931 WeakPolarHBondContact CA-O 3.26Å; I899-F934 HydrophobicContact CG1-CD2 4.43Å; I899-F934 HydrophobicContact CG1-CE2 4.02Å; I899-V938 HydrophobicContact CD1-CG1 3.72Å; I899-V938 HydrophobicContact CG1-CG1 4.41Å; I899-L940 HydrophobicContact CD1-CD1 4.24Å; I899-L940 HydrophobicContact CG2-CD1 4.43Å; I899-L940 HydrophobicContact CG2-CD2 3.85Å
900	K	96.6	Very high	90	Very high	108 Å²	108	69.6 Å²	69.6	47%	0.47	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	135.1	177.9	-57	-55.9	-173.3	-162.7	0	109.8	N897 V930 R931 T933	N897-K900 WeakPolarHBondContact O-CE 3.45Å; N897-K900 PolarHBondContact O-NZ 3.32Å; K900-V930 CarbonylContact O-C 3.43Å; K900-V930 WeakPolarHBondContact O-CA 3.49Å; K900-R931 HydrophobicContact CB-CB 4.28Å; K900-R931 PolarHBondContact N-O 2.85Å; K900-R931 PolarHBondContact O-N 2.78Å; K900-T933 HydrophobicContact CG-CG2 3.8Å
901	I	97.1	Very high	89.2	Confident	17 Å²	17	70.5 Å²	70.5	9%	0.087	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	133.8	178.9	-64.1	136.6	0	0	0	108.5	T839 P841 L845 A847 I928 E929 V930	T839-I901 HydrophobicContact CG2-CD1 4.02Å; T839-I901 HydrophobicContact CG2-CG1 4.33Å; T839-I901 WeakPolarHBondContact OG1-CD1 3.29Å; P841-I901 HydrophobicContact CB-CG2 3.77Å; P841-I901 HydrophobicContact CG-CG2 3.78Å; L845-I901 HydrophobicContact CD2-CG2 4.46Å; L845-I901 WeakPolarHBondContact O-CD1 3.34Å; A847-I901 HydrophobicContact CB-CD1 3.97Å; A847-I901 VanDerWaalsContact N-CD1 3.34Å; I901-I928 HydrophobicContact CG2-CG2 4.44Å; I901-E929 CarbonylContact C-O 3.51Å; I901-E929 WeakPolarHBondContact CA-O 3.45Å; I901-V930 HydrophobicContact CG1-CG1 4.11Å
902	L	96.2	Very high	87.8	Confident	83 Å²	83	73.8 Å²	73.8	44%	0.435	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	114.1	171.6	173	68.1	0	0	0	108.7	R904 E929	L902-R904 HydrophobicContact CD2-CG 4.33Å; L902-R904 HydrophobicContact CG-CG 4.22Å; L902-E929 HydrophobicContact CB-CB 4.2Å; L902-E929 PolarHBondContact N-O 3.17Å; L902-E929 PolarHBondContact O-N 3.07Å
903	Y	95.9	Very high	86.3	Confident	55 Å²	55	71.4 Å²	71.4	22%	0.216	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	104.1	175	-162.2	-109.9	0	0	0	109	P841 K842 Q926 I928 D944	P841-Y903 HydrophobicContact CB-CD2 3.37Å; P841-Y903 HydrophobicContact CB-CE2 3.96Å; P841-Y903 HydrophobicContact CB-CG 3.98Å; P841-Y903 HydrophobicContact CG-CD2 4.44Å; K842-Y903 HydrophobicContact CB-CE1 4.18Å; K842-Y903 HydrophobicContact CB-CE2 4.44Å; K842-Y903 HydrophobicContact CG-CE1 4.27Å; Y903-Q926 HydrophobicContact CD2-CG 4.43Å; Y903-Q926 HydrophobicContact CE1-CG 4.33Å; Y903-Q926 HydrophobicContact CE2-CG 3.6Å; Y903-Q926 WeakPolarHBondContact OH-CG 3.27Å; Y903-I928 HydrophobicContact CD2-CD1 4.18Å; Y903-I928 HydrophobicContact CD2-CG1 3.78Å; Y903-I928 HydrophobicContact CD2-CG2 4.37Å; Y903-I928 HydrophobicContact CE2-CD1 3.83Å; Y903-I928 HydrophobicContact CE2-CG1 3.78Å; Y903-D944 VanDerWaalsContact CE2-OD2 3.23Å; Y903-D944 WeakPolarHBondContact CE2-OD2 3.47Å; Y903-D944 PolarHBondContact OH-OD1 2.87Å; Y903-D944 PolarHBondContact OH-OD2 3.38Å
904	R	93.7	Very high	84.7	Confident	80 Å²	80	74.1 Å²	74.1	30%	0.302	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-74.9	160	-174.5	-61.8	-168	-177.4	165.2	10.7	111.3	L902 Q926 L927 E929 E996	L902-R904 HydrophobicContact CD2-CG 4.33Å; L902-R904 HydrophobicContact CG-CG 4.22Å; R904-Q926 PolarHBondContact O-NE2 2.96Å; R904-L927 HydrophobicContact CB-CB 4.13Å; R904-L927 HydrophobicContact CG-CB 4.3Å; R904-L927 PolarHBondContact N-O 3.47Å; R904-E929 IonicContact CZ-OE2 3.87Å; R904-E929 IonicContact NH2-OE2 3.4Å; R904-E929 PolarHBondContact NH2-OE2 3.17Å; R904-E996 IonicContact CZ-OE2 3.54Å; R904-E996 IonicContact NH1-OE2 3.88Å; R904-E996 PolarHBondContact NH1-OE2 2.92Å; R904-E996 IonicContact NH2-OE2 3.16Å; R904-E996 PolarHBondContact NH2-OE2 2.88Å
905	P	89.9	Confident	83.2	Confident	108 Å²	108	79.5 Å²	79.5	70%	0.701	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-55.3	141.4	173.6	-27	35.9	0	0	0	112.7	F907	P905-F907 WeakPolarHBondContact O-CD2 3.44Å; P905-F907 PolarHBondContact O-N 3.45Å
906	L	90.2	Very high	81.7	Confident	84 Å²	84	82.6 Å²	82.6	44%	0.44	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-68.1	122	179.3	-178.4	67.5	0	0	0	110.6	F924 Q926	L906-F924 HydrophobicContact CD1-CB 4.33Å; L906-F924 HydrophobicContact CD2-CD1 3.96Å; L906-F924 HydrophobicContact CG-CD1 4.44Å; L906-Q926 HydrophobicContact CD1-CB 3.91Å
907	F	90.4	Very high	80.8	Confident	115 Å²	115	82 Å²	82	50%	0.504	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	129.6	172.2	-65.3	-86.8	0	0	0	109.8	P905 F924 K925 L927	P905-F907 WeakPolarHBondContact O-CD2 3.44Å; P905-F907 PolarHBondContact O-N 3.45Å; F907-F924 CarbonylContact O-C 3.56Å; F907-F924 WeakPolarHBondContact O-CA 3.39Å; F907-K925 HydrophobicContact CB-CB 4.28Å; F907-K925 PolarHBondContact N-O 3.47Å; F907-K925 PolarHBondContact O-N 2.77Å; F907-L927 HydrophobicContact CE2-CD1 4.4Å
908	K	90.2	Very high	80.4	Confident	155 Å²	155	85.8 Å²	85.8	67%	0.674	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.1	137.5	172.5	64	-178.5	-180	179.2	0	110.2	M922 T923 F924	K908-M922 HydrophobicContact CB-SD 4.18Å; K908-T923 CarbonylContact C-O 3.54Å; K908-T923 VanDerWaalsContact CA-O 3.29Å; K908-T923 WeakPolarHBondContact CA-O 3.27Å; K908-F924 HydrophobicContact CB-CD1 3.98Å; K908-F924 HydrophobicContact CB-CE1 4.11Å
909	Y	89.1	Confident	80	Confident	92 Å²	92	88.6 Å²	88.6	36%	0.361	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	146.4	175.5	66.8	-86.6	0	0	0	110.8	E911 M922 T923 K1000	Y909-E911 HydrophobicContact CD2-CG 4.04Å; Y909-E911 HydrophobicContact CE2-CG 3.48Å; Y909-E911 VanDerWaalsContact CE2-CG 3.48Å; Y909-E911 WeakPolarHBondContact CE2-OE1 3.38Å; Y909-E911 PolarHBondContact OH-OE1 3.4Å; Y909-M922 VanDerWaalsContact O-SD 3.39Å; Y909-T923 HydrophobicContact CE1-CG2 3.65Å; Y909-T923 HydrophobicContact CE2-CG2 4.39Å; Y909-T923 PolarHBondContact N-O 3.36Å; Y909-T923 PolarHBondContact O-N 3.22Å; Y909-T923 VanDerWaalsContact OH-CG2 3.28Å; Y909-T923 WeakPolarHBondContact OH-CG2 3.47Å; Y909-K1000 WeakPolarHBondContact OH-CE 3.38Å; Y909-K1000 PolarHBondContact OH-NZ 3.43Å
910	R	84.3	Confident	79.5	Confident	139 Å²	139	88.4 Å²	88.4	53%	0.525	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	128.3	177.8	-163.5	-178	-157.4	173	10.4	109.6	M922	R910-M922 HydrophobicContact CB-CE 4.27Å
911	E	72.8	Confident	79	Confident	79 Å²	79	84 Å²	84	37%	0.369	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	122.7	168.6	-72	178.3	-166.3	0	0	108.2	Y909 T913 T921 T923	Y909-E911 HydrophobicContact CD2-CG 4.04Å; Y909-E911 HydrophobicContact CE2-CG 3.48Å; Y909-E911 VanDerWaalsContact CE2-CG 3.48Å; Y909-E911 WeakPolarHBondContact CE2-OE1 3.38Å; Y909-E911 PolarHBondContact OH-OE1 3.4Å; E911-T913 PolarHBondContact O-N 3.08Å; E911-T913 VanDerWaalsContact O-N 3.09Å; E911-T921 PolarHBondContact N-O 3.07Å; E911-T923 VanDerWaalsContact CD-OG1 3.26Å; E911-T923 PolarHBondContact OE1-OG1 3.07Å
912	G	59.8	Low	78.7	Confident	78 Å²	78	85.4 Å²	85.4	80%	0.804	48%	0.475	S	S	*	.			trans	-64.7	110.7	-176	0	0	0	0	0	110.9	G914	G912-G914 PolarHBondContact O-N 3.4Å
913	T	53.9	Low	78.4	Confident	59 Å²	59	81.4 Å²	81.4	36%	0.362	46%	0.455	S	S	.	.			trans	-64.5	126.5	163.7	32.8	0	0	0	0	107.9	E911 N919	E911-T913 PolarHBondContact O-N 3.08Å; E911-T913 VanDerWaalsContact O-N 3.09Å; T913-N919 VanDerWaalsContact CG2-O 3.24Å; T913-N919 WeakPolarHBondContact CG2-O 3.37Å; T913-N919 PolarHBondContact OG1-O 3.25Å; T913-N919 VanDerWaalsContact OG1-O 3.08Å
914	G	51.5	Low	78.3	Confident	60 Å²	60	80.2 Å²	80.2	62%	0.619	45%	0.451	S	S	*	.			trans	-48.9	152.6	172.2	0	0	0	0	0	110.3	G912 S916 G917	G912-G914 PolarHBondContact O-N 3.4Å; G914-S916 PolarHBondContact O-N 3.04Å; G914-G917 PolarHBondContact O-N 3.45Å; G914-G917 VanDerWaalsContact O-N 3.09Å
915	S	52.6	Low	78.4	Confident	143 Å²	143	79.9 Å²	79.9	100%	1	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	19.2	-162.1	-45.1	0	0	0	0	118.4
916	S	57.8	Low	78.7	Confident	118 Å²	118	75 Å²	75	83%	0.825	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.2	7.1	178.4	-173.7	0	0	0	0	114	G914	G914-S916 PolarHBondContact O-N 3.04Å
917	G	63.5	Low	79	Confident	38 Å²	38	71.8 Å²	71.8	39%	0.392	40%	0.402	S	S	.	.			trans	-81.8	124.7	-174.6	0	0	0	0	0	114.7	G914 N919	G914-G917 PolarHBondContact O-N 3.45Å; G914-G917 VanDerWaalsContact O-N 3.09Å; G917-N919 PolarHBondContact O-N 3.33Å
918	K	78.9	Confident	79.3	Confident	180 Å²	180	66.3 Å²	66.3	78%	0.783	38%	0.378	S	S	*	.	S	Bend	trans	-73.4	-11	172.3	-64.9	179.9	-179.9	178.3	0	113.8	I1007	K918-I1007 PolarHBondContact O-N 2.86Å
919	N	81.3	Confident	79.7	Confident	65 Å²	65	61.2 Å²	61.2	35%	0.348	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	150.6	-174.3	-60.5	-1.4	0	0	0	109.9	T913 G917 H1005	T913-N919 VanDerWaalsContact CG2-O 3.24Å; T913-N919 WeakPolarHBondContact CG2-O 3.37Å; T913-N919 PolarHBondContact OG1-O 3.25Å; T913-N919 VanDerWaalsContact OG1-O 3.08Å; G917-N919 PolarHBondContact O-N 3.33Å; N919-H1005 CarbonylContact C-O 3.5Å; N919-H1005 VanDerWaalsContact CA-O 3.27Å; N919-H1005 WeakPolarHBondContact CA-O 3.21Å
920	A	83.7	Confident	80.1	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	140.4	169.2	0	0	0	0	0	109.2	E1004 H1005 I1007	A920-E1004 WeakPolarHBondContact O-CA 3.48Å; A920-H1005 PolarHBondContact N-O 3.38Å; A920-H1005 PolarHBondContact O-N 3.02Å; A920-I1007 HydrophobicContact CB-CG1 4.47Å
921	T	87.1	Confident	80.7	Confident	17 Å²	17	56 Å²	56	10%	0.104	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	119.1	175.3	-54.3	0	0	0	0	109.2	E911 V1003 E1004	E911-T921 PolarHBondContact N-O 3.07Å; T921-V1003 WeakPolarHBondContact CA-O 3.47Å; T921-E1004 HydrophobicContact CG2-CG 4.12Å
922	M	89	Confident	81.9	Confident	45 Å²	45	52.2 Å²	52.2	22%	0.222	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	126.7	172.8	-173.9	63	64.9	0	0	109.2	K908 Y909 R910 F924 S1002 V1003	K908-M922 HydrophobicContact CB-SD 4.18Å; Y909-M922 VanDerWaalsContact O-SD 3.39Å; R910-M922 HydrophobicContact CB-CE 4.27Å; M922-F924 HydrophobicContact CB-CE2 3.89Å; M922-F924 HydrophobicContact CB-CZ 4.29Å; M922-F924 HydrophobicContact CG-CD2 4.2Å; M922-F924 HydrophobicContact CG-CE1 4.25Å; M922-F924 HydrophobicContact CG-CE2 3.48Å; M922-F924 VanDerWaalsContact CG-CE2 3.48Å; M922-F924 HydrophobicContact CG-CZ 3.52Å; M922-S1002 CarbonylContact O-C 3.53Å; M922-S1002 VanDerWaalsContact O-CA 3.29Å; M922-S1002 WeakPolarHBondContact O-CA 3.2Å; M922-V1003 PolarHBondContact N-O 2.84Å; M922-V1003 PolarHBondContact O-N 3.3Å
923	T	91.7	Very high	83.6	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	130.4	177.3	-59.5	0	0	0	0	110.1	K908 Y909 E911 L959 K1000	K908-T923 CarbonylContact C-O 3.54Å; K908-T923 VanDerWaalsContact CA-O 3.29Å; K908-T923 WeakPolarHBondContact CA-O 3.27Å; Y909-T923 HydrophobicContact CE1-CG2 3.65Å; Y909-T923 HydrophobicContact CE2-CG2 4.39Å; Y909-T923 PolarHBondContact N-O 3.36Å; Y909-T923 PolarHBondContact O-N 3.22Å; Y909-T923 VanDerWaalsContact OH-CG2 3.28Å; Y909-T923 WeakPolarHBondContact OH-CG2 3.47Å; E911-T923 VanDerWaalsContact CD-OG1 3.26Å; E911-T923 PolarHBondContact OE1-OG1 3.07Å; T923-L959 HydrophobicContact CG2-CD1 3.88Å; T923-K1000 HydrophobicContact CG2-CD 4.35Å; T923-K1000 HydrophobicContact CG2-CG 3.98Å
924	F	93.4	Very high	85.3	Confident	30 Å²	30	50.5 Å²	50.5	13%	0.132	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	134	178.9	-61.3	-94.6	0	0	0	109.1	L906 F907 K908 M922 K1000 Y1001 V1003	L906-F924 HydrophobicContact CD1-CB 4.33Å; L906-F924 HydrophobicContact CD2-CD1 3.96Å; L906-F924 HydrophobicContact CG-CD1 4.44Å; F907-F924 CarbonylContact O-C 3.56Å; F907-F924 WeakPolarHBondContact O-CA 3.39Å; K908-F924 HydrophobicContact CB-CD1 3.98Å; K908-F924 HydrophobicContact CB-CE1 4.11Å; M922-F924 HydrophobicContact CB-CE2 3.89Å; M922-F924 HydrophobicContact CB-CZ 4.29Å; M922-F924 HydrophobicContact CG-CD2 4.2Å; M922-F924 HydrophobicContact CG-CE1 4.25Å; M922-F924 HydrophobicContact CG-CE2 3.48Å; M922-F924 VanDerWaalsContact CG-CE2 3.48Å; M922-F924 HydrophobicContact CG-CZ 3.52Å; F924-K1000 CarbonylContact O-C 3.58Å; F924-K1000 WeakPolarHBondContact O-CA 3.24Å; F924-K1000 WeakPolarHBondContact O-CG 3.36Å; F924-Y1001 HydrophobicContact CB-CD1 4.35Å; F924-Y1001 HydrophobicContact CB-CD2 4.08Å; F924-Y1001 HydrophobicContact CB-CE1 3.9Å; F924-Y1001 HydrophobicContact CB-CE2 3.59Å; F924-Y1001 HydrophobicContact CB-CG 4.43Å; F924-Y1001 VanDerWaalsContact CB-CZ 3.48Å; F924-Y1001 HydrophobicContact CD1-CE2 4.49Å; F924-Y1001 AromaticContact CD2-CD2 3.87Å; F924-Y1001 HydrophobicContact CD2-CD2 3.87Å; F924-Y1001 AromaticContact CD2-CE2 3.36Å; F924-Y1001 HydrophobicContact CD2-CE2 3.36Å; F924-Y1001 HydrophobicContact CE2-CE2 4.15Å; F924-Y1001 HydrophobicContact CG-CD2 4.3Å; F924-Y1001 AromaticContact CG-CE2 3.57Å; F924-Y1001 HydrophobicContact CG-CE2 3.57Å; F924-Y1001 AromaticContact CG-CZ 3.77Å; F924-Y1001 PolarHBondContact N-O 3.48Å; F924-Y1001 PolarHBondContact O-N 3.34Å; F924-V1003 HydrophobicContact CD2-CG2 4.02Å; F924-V1003 HydrophobicContact CE2-CB 4.09Å; F924-V1003 HydrophobicContact CE2-CG2 3.64Å
925	K	95.1	Very high	87.3	Confident	72 Å²	72	54.4 Å²	54.4	31%	0.313	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	116.3	178.3	-176.1	-177.3	179.6	-179.1	0	109.9	F907 T998 L999 K1000	F907-K925 HydrophobicContact CB-CB 4.28Å; F907-K925 PolarHBondContact N-O 3.47Å; F907-K925 PolarHBondContact O-N 2.77Å; K925-T998 HydrophobicContact CD-CG2 4.38Å; K925-T998 HydrophobicContact CG-CG2 3.99Å; K925-L999 CarbonylContact C-O 3.51Å; K925-L999 WeakPolarHBondContact CA-O 3.28Å; K925-K1000 HydrophobicContact CB-CG 4.26Å
926	Q	96.1	Very high	89.2	Confident	6 Å²	6	53.2 Å²	53.2	3%	0.028	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	131.1	176.5	179.3	59.4	52.7	0	0	109.5	Y903 R904 L906 I928 L999	Y903-Q926 HydrophobicContact CD2-CG 4.43Å; Y903-Q926 HydrophobicContact CE1-CG 4.33Å; Y903-Q926 HydrophobicContact CE2-CG 3.6Å; Y903-Q926 WeakPolarHBondContact OH-CG 3.27Å; R904-Q926 PolarHBondContact O-NE2 2.96Å; L906-Q926 HydrophobicContact CD1-CB 3.91Å; Q926-I928 HydrophobicContact CG-CG1 4.21Å; Q926-L999 HydrophobicContact CB-CB 4.21Å; Q926-L999 PolarHBondContact N-O 3.3Å; Q926-L999 PolarHBondContact O-N 3.21Å
927	L	96.8	Very high	90.9	Very high	16 Å²	16	55.1 Å²	55.1	8%	0.084	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	131.1	176.1	-67.8	176.4	0	0	0	109.8	R904 F907 T998	R904-L927 HydrophobicContact CB-CB 4.13Å; R904-L927 HydrophobicContact CG-CB 4.3Å; R904-L927 PolarHBondContact N-O 3.47Å; F907-L927 HydrophobicContact CE2-CD1 4.4Å; L927-T998 HydrophobicContact CD2-CG2 4.13Å; L927-T998 WeakPolarHBondContact CD2-OG1 3.3Å
928	I	97.8	Very high	92.3	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	119.1	-179.1	-45.3	178.2	0	0	0	107.6	P841 I901 Y903 Q926 V930 V942 D944 W985 E996 L997	P841-I928 HydrophobicContact CB-CG2 4.22Å; P841-I928 HydrophobicContact CG-CG2 3.85Å; I901-I928 HydrophobicContact CG2-CG2 4.44Å; Y903-I928 HydrophobicContact CD2-CD1 4.18Å; Y903-I928 HydrophobicContact CD2-CG1 3.78Å; Y903-I928 HydrophobicContact CD2-CG2 4.37Å; Y903-I928 HydrophobicContact CE2-CD1 3.83Å; Y903-I928 HydrophobicContact CE2-CG1 3.78Å; Q926-I928 HydrophobicContact CG-CG1 4.21Å; I928-V930 HydrophobicContact CG2-CG1 4.39Å; I928-V942 HydrophobicContact CD1-CG1 4.26Å; I928-V942 HydrophobicContact CG2-CG1 4.33Å; I928-D944 HydrophobicContact CD1-CB 4.18Å; I928-W985 HydrophobicContact CD1-CZ3 4.45Å; I928-E996 CarbonylContact O-C 3.45Å; I928-E996 WeakPolarHBondContact O-CA 3.39Å; I928-L997 HydrophobicContact CB-CB 4.26Å; I928-L997 PolarHBondContact N-O 3.36Å; I928-L997 PolarHBondContact O-N 3.17Å
929	E	97.8	Very high	93	Very high	49 Å²	49	50.5 Å²	50.5	23%	0.229	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	129.1	175.5	-178.6	-172.9	133	0	0	109.1	I901 L902 R904 I994	I901-E929 CarbonylContact C-O 3.51Å; I901-E929 WeakPolarHBondContact CA-O 3.45Å; L902-E929 HydrophobicContact CB-CB 4.2Å; L902-E929 PolarHBondContact N-O 3.17Å; L902-E929 PolarHBondContact O-N 3.07Å; R904-E929 IonicContact CZ-OE2 3.87Å; R904-E929 IonicContact NH2-OE2 3.4Å; R904-E929 PolarHBondContact NH2-OE2 3.17Å; E929-I994 HydrophobicContact CG-CG2 3.67Å
930	V	97.6	Very high	93.7	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	137.8	176.4	-62.1	0	0	0	0	110	K900 I901 I928 L940 V942 L987 L989 I994 R995	K900-V930 CarbonylContact O-C 3.43Å; K900-V930 WeakPolarHBondContact O-CA 3.49Å; I901-V930 HydrophobicContact CG1-CG1 4.11Å; I928-V930 HydrophobicContact CG2-CG1 4.39Å; V930-L940 HydrophobicContact CB-CD2 3.92Å; V930-L940 HydrophobicContact CG1-CD2 3.93Å; V930-L940 HydrophobicContact CG2-CD2 4.19Å; V930-V942 HydrophobicContact CG1-CG2 3.97Å; V930-L987 HydrophobicContact CG2-CD1 3.66Å; V930-L989 HydrophobicContact CG2-CD1 3.96Å; V930-L989 HydrophobicContact CG2-CD2 4.43Å; V930-I994 CarbonylContact O-C 3.55Å; V930-I994 WeakPolarHBondContact O-CA 3.34Å; V930-R995 HydrophobicContact CG2-CB 4.05Å; V930-R995 WeakPolarHBondContact CG2-O 3.34Å; V930-R995 PolarHBondContact N-O 3.06Å; V930-R995 PolarHBondContact O-N 3.48Å
931	R	97.5	Very high	94.3	Very high	121 Å²	121	48.7 Å²	48.7	46%	0.457	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	124.7	-179.4	175.1	175.4	-177.4	-172.9	-0.7	110.7	I899 K900 T933 E993 I994	I899-R931 CarbonylContact C-O 3.53Å; I899-R931 WeakPolarHBondContact CA-O 3.26Å; K900-R931 HydrophobicContact CB-CB 4.28Å; K900-R931 PolarHBondContact N-O 2.85Å; K900-R931 PolarHBondContact O-N 2.78Å; R931-T933 HydrophobicContact CG-CG2 4.07Å; R931-E993 WeakPolarHBondContact CA-O 3.39Å; R931-I994 HydrophobicContact CB-CG1 3.97Å; R931-I994 HydrophobicContact CG-CD1 4.41Å; R931-I994 HydrophobicContact CG-CG1 3.72Å
932	N	97	Very high	94.8	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	116.5	168.6	-179.2	10.3	0	0	0	109.3	F934 R936 L989 G990 G992 E993	N932-F934 WeakPolarHBondContact OD1-CB 3.45Å; N932-F934 WeakPolarHBondContact OD1-CD2 3.48Å; N932-F934 PolarHBondContact OD1-N 2.81Å; N932-R936 PolarHBondContact ND2-O 2.95Å; N932-L989 HydrophobicContact CB-CB 3.97Å; N932-L989 HydrophobicContact CB-CD1 4.39Å; N932-L989 PolarHBondContact ND2-O 2.91Å; N932-G990 WeakPolarHBondContact CB-O 3.44Å; N932-G990 PolarHBondContact ND2-O 2.8Å; N932-G992 CarbonylContact O-C 3.57Å; N932-G992 WeakPolarHBondContact O-CA 3.45Å; N932-G992 PolarHBondContact O-N 3.13Å; N932-G992 VanDerWaalsContact O-N 3.14Å; N932-E993 PolarHBondContact N-O 3.29Å
933	T	94.9	Very high	95.2	Very high	66 Å²	66	46.4 Å²	46.4	41%	0.405	20%	0.204	S	C	.	.			trans	-100.3	2.3	176.1	71.8	0	0	0	0	113	G898 K900 R931	G898-T933 VanDerWaalsContact C-OG1 3.25Å; G898-T933 VanDerWaalsContact CA-OG1 3.23Å; G898-T933 WeakPolarHBondContact CA-OG1 3.3Å; G898-T933 PolarHBondContact O-N 3.18Å; G898-T933 PolarHBondContact O-OG1 2.84Å; K900-T933 HydrophobicContact CG-CG2 3.8Å; R931-T933 HydrophobicContact CG-CG2 4.07Å
934	F	91	Very high	95.4	Very high	34 Å²	34	46.7 Å²	46.7	15%	0.149	21%	0.205	C	C	.	.	S	Bend	trans	-76.2	157.7	171.2	-61.6	-72.4	0	0	0	111.6	E896 G898 I899 N932 R936 V938 P991 G992	E896-F934 HydrophobicContact CG-CE2 3.84Å; E896-F934 HydrophobicContact CG-CZ 3.55Å; E896-F934 WeakPolarHBondContact OE1-CZ 3.37Å; G898-F934 WeakPolarHBondContact O-CD2 3.24Å; I899-F934 HydrophobicContact CG1-CD2 4.43Å; I899-F934 HydrophobicContact CG1-CE2 4.02Å; N932-F934 WeakPolarHBondContact OD1-CB 3.45Å; N932-F934 WeakPolarHBondContact OD1-CD2 3.48Å; N932-F934 PolarHBondContact OD1-N 2.81Å; F934-R936 HydrophobicContact CB-CG 4.01Å; F934-R936 PolarHBondContact O-N 2.86Å; F934-V938 HydrophobicContact CD2-CG2 3.69Å; F934-V938 HydrophobicContact CE2-CG2 4.28Å; F934-V938 HydrophobicContact CG-CG2 4.48Å; F934-P991 WeakPolarHBondContact O-CA 3.24Å; F934-G992 PolarHBondContact O-N 3.44Å
935	D	92.5	Very high	95.4	Very high	143 Å²	143	47.8 Å²	47.8	77%	0.765	21%	0.211	S	C	*	.	S	Bend	trans	-78.9	1.4	169.6	62.9	-13.1	0	0	0	113.3	P991	D935-P991 WeakPolarHBondContact O-CG 3.12Å
936	R	92.4	Very high	95.2	Very high	118 Å²	118	44.8 Å²	44.8	45%	0.445	20%	0.199	S	C	.	.	S	Bend	trans	-120.3	159	178.4	71.1	-176.7	-177.5	-78	0.9	112.1	Y837 N932 F934	Y837-R936 PolarHBondContact OH-NH2 2.86Å; N932-R936 PolarHBondContact ND2-O 2.95Å; F934-R936 HydrophobicContact CB-CG 4.01Å; F934-R936 PolarHBondContact O-N 2.86Å
937	R	93.9	Very high	95	Very high	158 Å²	158	45.8 Å²	45.8	60%	0.596	21%	0.206	S	C	*	.			trans	-65.6	140.6	171.6	179.3	179.9	-74.2	-94.7	-5.2	110.7	D988 L989	R937-D988 WeakPolarHBondContact CD-OD1 3.32Å; R937-D988 WeakPolarHBondContact CG-OD1 3.28Å; R937-D988 IonicContact CZ-OD1 3.21Å; R937-D988 IonicContact CZ-OD2 3.66Å; R937-D988 IonicContact NE-OD1 2.82Å; R937-D988 IonicContact NH1-OD1 2.95Å; R937-D988 PolarHBondContact NH1-OD1 2.86Å; R937-D988 IonicContact NH1-OD2 3.09Å; R937-D988 PolarHBondContact NH1-OD2 2.84Å; R937-L989 CarbonylContact C-O 3.58Å; R937-L989 VanDerWaalsContact CA-O 3.31Å; R937-L989 WeakPolarHBondContact CA-O 3.35Å
938	V	92.2	Very high	94.6	Very high	5 Å²	5	50.1 Å²	50.1	3%	0.03	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	133.7	-177.2	170.3	0	0	0	0	111.2	Y837 I899 F934 L989	Y837-V938 HydrophobicContact CD2-CG1 3.38Å; Y837-V938 HydrophobicContact CE2-CG1 3.66Å; Y837-V938 HydrophobicContact CE2-CG2 4.32Å; Y837-V938 HydrophobicContact CG-CG1 4.25Å; I899-V938 HydrophobicContact CD1-CG1 3.72Å; I899-V938 HydrophobicContact CG1-CG1 4.41Å; F934-V938 HydrophobicContact CD2-CG2 3.69Å; F934-V938 HydrophobicContact CE2-CG2 4.28Å; F934-V938 HydrophobicContact CG-CG2 4.48Å; V938-L989 PolarHBondContact N-O 2.84Å; V938-L989 PolarHBondContact O-N 2.81Å
939	R	93.6	Very high	94.1	Very high	116 Å²	116	52.1 Å²	52.1	44%	0.438	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	117	170.2	-166.8	175.2	-177.9	166.1	3.4	110.5	Y837 D986 L987	Y837-R939 PolarHBondContact N-O 2.94Å; R939-D986 VanDerWaalsContact CG-OD1 3.3Å; R939-D986 WeakPolarHBondContact CG-OD1 3.4Å; R939-D986 IonicContact CZ-OD1 3.6Å; R939-D986 IonicContact CZ-OD2 3.73Å; R939-D986 IonicContact NE-OD1 3.73Å; R939-D986 PolarHBondContact NE-OD1 2.84Å; R939-D986 IonicContact NE-OD2 2.69Å; R939-D986 PolarHBondContact NE-OD2 2.89Å; R939-D986 IonicContact NH2-OD1 3.05Å; R939-D986 IonicContact NH2-OD2 3.56Å; R939-D986 PolarHBondContact NH2-OD2 3.05Å; R939-L987 CarbonylContact C-O 3.54Å; R939-L987 VanDerWaalsContact CA-O 3.28Å; R939-L987 WeakPolarHBondContact CA-O 3.36Å
940	L	96.1	Very high	93.4	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	123.1	-175.5	176.5	67	0	0	0	110.7	T839 A847 I899 V930 V942 L987 L989	T839-L940 HydrophobicContact CG2-CD1 3.99Å; T839-L940 HydrophobicContact CG2-CD2 4.39Å; T839-L940 HydrophobicContact CG2-CG 4.38Å; A847-L940 HydrophobicContact CB-CD1 4.09Å; I899-L940 HydrophobicContact CD1-CD1 4.24Å; I899-L940 HydrophobicContact CG2-CD1 4.43Å; I899-L940 HydrophobicContact CG2-CD2 3.85Å; V930-L940 HydrophobicContact CB-CD2 3.92Å; V930-L940 HydrophobicContact CG1-CD2 3.93Å; V930-L940 HydrophobicContact CG2-CD2 4.19Å; L940-V942 HydrophobicContact CD2-CG2 3.91Å; L940-V942 HydrophobicContact CG-CG2 3.99Å; L940-L987 PolarHBondContact N-O 3.1Å; L940-L987 WeakPolarHBondContact O-CB 3.12Å; L940-L987 PolarHBondContact O-N 3.29Å; L940-L989 HydrophobicContact CB-CD1 4.28Å; L940-L989 HydrophobicContact CD2-CD1 4.01Å
941	M	96.5	Very high	92.7	Very high	26 Å²	26	59.7 Å²	59.7	13%	0.128	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	113.1	168	-173.3	170.6	69.1	0	0	110	Y837 V838 T839 V943 R976 W985	Y837-M941 PolarHBondContact O-N 2.58Å; V838-M941 CarbonylContact C-O 3.57Å; V838-M941 VanDerWaalsContact CA-O 3.3Å; V838-M941 WeakPolarHBondContact CA-O 3.08Å; V838-M941 HydrophobicContact CB-CE 4.29Å; V838-M941 HydrophobicContact CG1-CE 3.59Å; V838-M941 HydrophobicContact CG2-CB 4.37Å; V838-M941 HydrophobicContact CG2-CE 3.72Å; T839-M941 PolarHBondContact N-O 2.92Å; M941-V943 HydrophobicContact CE-CG2 4.19Å; M941-V943 HydrophobicContact CG-CG2 4.04Å; M941-R976 PolarHBondContact SD-NH2 2.91Å; M941-R976 VanDerWaalsContact SD-NH2 3.4Å; M941-W985 CarbonylContact C-O 3.57Å; M941-W985 VanDerWaalsContact CA-O 3.29Å; M941-W985 WeakPolarHBondContact CA-O 3.36Å
942	V	97.8	Very high	92.1	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	131.9	172.2	-174.9	0	0	0	0	108.6	T839 P841 I928 V930 L940 E984 W985 L987 L997	T839-V942 HydrophobicContact CG2-CB 4.07Å; T839-V942 HydrophobicContact CG2-CG1 4.02Å; T839-V942 HydrophobicContact CG2-CG2 3.73Å; P841-V942 HydrophobicContact CG-CG1 4.02Å; I928-V942 HydrophobicContact CD1-CG1 4.26Å; I928-V942 HydrophobicContact CG2-CG1 4.33Å; V930-V942 HydrophobicContact CG1-CG2 3.97Å; L940-V942 HydrophobicContact CD2-CG2 3.91Å; L940-V942 HydrophobicContact CG-CG2 3.99Å; V942-E984 CarbonylContact O-C 2.87Å; V942-E984 WeakPolarHBondContact O-CA 3.5Å; V942-W985 HydrophobicContact CB-CB 4.38Å; V942-W985 HydrophobicContact CB-CE3 4.14Å; V942-W985 HydrophobicContact CG1-CE3 4.14Å; V942-W985 PolarHBondContact N-O 2.9Å; V942-W985 PolarHBondContact O-N 2.82Å; V942-L987 HydrophobicContact CG2-CD1 3.88Å; V942-L997 HydrophobicContact CB-CD1 3.78Å; V942-L997 HydrophobicContact CG1-CD1 3.77Å; V942-L997 HydrophobicContact CG2-CD1 3.8Å
943	V	97.4	Very high	91.6	Very high	14 Å²	14	67.5 Å²	67.5	9%	0.085	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	130.2	-179.2	-170.7	0	0	0	0	110	V838 T839 V840 P841 M941 N982 V983 E984	V838-V943 HydrophobicContact CG1-CG2 4.31Å; T839-V943 PolarHBondContact O-N 2.76Å; V840-V943 HydrophobicContact CG2-CB 4.35Å; P841-V943 WeakPolarHBondContact CD-O 3.27Å; M941-V943 HydrophobicContact CE-CG2 4.19Å; M941-V943 HydrophobicContact CG-CG2 4.04Å; V943-N982 HydrophobicContact CG1-CB 3.72Å; V943-V983 WeakPolarHBondContact CA-O 3.3Å; V943-E984 HydrophobicContact CG1-CG 4.33Å; V943-E984 HydrophobicContact CG2-CG 4.19Å
944	D	95.9	Very high	91.2	Very high	6 Å²	6	66.1 Å²	66.1	3%	0.032	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	156.5	172.1	-157.6	-7.2	0	0	0	111	Y903 I928 N982 V983 W985 L999	Y903-D944 VanDerWaalsContact CE2-OD2 3.23Å; Y903-D944 WeakPolarHBondContact CE2-OD2 3.47Å; Y903-D944 PolarHBondContact OH-OD1 2.87Å; Y903-D944 PolarHBondContact OH-OD2 3.38Å; I928-D944 HydrophobicContact CD1-CB 4.18Å; D944-N982 CarbonylContact O-C 3.58Å; D944-N982 WeakPolarHBondContact O-CA 3.5Å; D944-N982 WeakPolarHBondContact O-CB 2.97Å; D944-V983 PolarHBondContact N-O 2.84Å; D944-V983 PolarHBondContact O-N 2.69Å; D944-W985 HydrophobicContact CB-CH2 4.45Å; D944-W985 HydrophobicContact CB-CZ3 4.06Å; D944-L999 HydrophobicContact CB-CD2 4.01Å
945	Q	93.2	Very high	91.2	Very high	53 Å²	53	70 Å²	70	25%	0.248	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	141.6	-170.5	62.4	179.2	75.3	0	0	112.9	K842 N982	K842-Q945 HydrophobicContact CD-CG 3.95Å; Q945-N982 WeakPolarHBondContact CA-OD1 3.41Å; Q945-N982 WeakPolarHBondContact CB-OD1 3.43Å
946	V	92.2	Very high	91.1	Very high	9 Å²	9	65 Å²	65	6%	0.055	33%	0.326	C	S	.	.			trans	-107.7	132.1	163.6	179.1	0	0	0	0	107.6	V956 L958 M977 N981 V983 L999	V946-V956 HydrophobicContact CG1-CG1 3.97Å; V946-L958 HydrophobicContact CG2-CD1 4.02Å; V946-M977 HydrophobicContact CB-CE 4.27Å; V946-M977 HydrophobicContact CG2-CE 3.94Å; V946-N981 WeakPolarHBondContact CB-O 3.27Å; V946-N981 PolarHBondContact N-O 2.66Å; V946-N981 PolarHBondContact O-ND2 2.8Å; V946-V983 HydrophobicContact CG2-CG2 3.76Å; V946-L999 HydrophobicContact CG2-CD1 3.89Å; V946-L999 HydrophobicContact CG2-CD2 4.48Å
947	P	90.9	Very high	91.1	Very high	28 Å²	28	62.6 Å²	62.6	18%	0.182	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-62.2	144	-179.9	22.7	-29.8	0	0	0	111.1	V956 N981 Y1001	P947-V956 HydrophobicContact CG-CG1 3.99Å; P947-V956 HydrophobicContact CG-CG2 4.44Å; P947-V956 WeakPolarHBondContact O-CG1 3.48Å; P947-N981 PolarHBondContact O-ND2 2.82Å; P947-Y1001 HydrophobicContact CG-CD2 3.95Å; P947-Y1001 HydrophobicContact CG-CE2 3.47Å; P947-Y1001 VanDerWaalsContact CG-CE2 3.47Å
948	V	88.5	Confident	91.1	Very high	107 Å²	107	57.4 Å²	57.4	65%	0.648	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-100.9	139.1	170.2	-177.7	0	0	0	0	107.4	N981	V948-N981 HydrophobicContact CG2-CB 3.44Å; V948-N981 VanDerWaalsContact CG2-CB 3.44Å; V948-N981 VanDerWaalsContact CG2-ND2 3.31Å; V948-N981 WeakPolarHBondContact CG2-ND2 3.27Å
949	S	86.9	Confident	91.2	Very high	42 Å²	42	60.1 Å²	60.1	29%	0.294	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-73.2	132.1	175.7	-174.4	0	0	0	0	111.4	E951 I954	S949-E951 PolarHBondContact OG-N 2.9Å; S949-E951 PolarHBondContact OG-O 2.88Å; S949-I954 VanDerWaalsContact CB-O 3.22Å; S949-I954 WeakPolarHBondContact CB-O 3.41Å; S949-I954 WeakPolarHBondContact OG-CB 3.48Å; S949-I954 PolarHBondContact OG-O 2.91Å
950	A	82.8	Confident	91.3	Very high	105 Å²	105	58.3 Å²	58.3	87%	0.868	32%	0.317	S	S	*	.	S	Bend	trans	-86.5	-14.3	170	0	0	0	0	0	112.9
951	E	84.6	Confident	91.3	Very high	103 Å²	103	59 Å²	59	48%	0.481	32%	0.321	S	S	.	.	S	Bend	trans	-133.4	141.2	-174.5	-63.4	-170.6	-163.1	0	0	112.1	S949 K953 I954	S949-E951 PolarHBondContact OG-N 2.9Å; S949-E951 PolarHBondContact OG-O 2.88Å; E951-K953 PolarHBondContact O-N 3.13Å; E951-I954 HydrophobicContact CB-CD1 4.37Å; E951-I954 PolarHBondContact O-N 2.81Å
952	D	84.4	Confident	91.1	Very high	170 Å²	170	63.8 Å²	63.8	91%	0.909	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-21.7	-178.9	-65.6	-25.2	0	0	0	114
953	K	85.4	Confident	90.8	Very high	114 Å²	114	65.1 Å²	65.1	50%	0.496	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-19.2	179.1	-63.4	178.9	-175.8	168.8	0	113.5	E951 P1006 E1009	E951-K953 PolarHBondContact O-N 3.13Å; K953-P1006 HydrophobicContact CB-CG 4.08Å; K953-P1006 HydrophobicContact CD-CG 4.09Å; K953-E1009 IonicContact NZ-OE1 2.76Å; K953-E1009 PolarHBondContact NZ-OE1 3.3Å; K953-E1009 IonicContact NZ-OE2 3.64Å
954	I	87.3	Confident	90.2	Very high	37 Å²	37	71.7 Å²	71.7	19%	0.19	39%	0.387	C	S	.	.			trans	-98.3	123.1	179.5	-60.6	167.7	0	0	0	107.9	S949 E951 V1003 E1004 H1005 L1011	S949-I954 VanDerWaalsContact CB-O 3.22Å; S949-I954 WeakPolarHBondContact CB-O 3.41Å; S949-I954 WeakPolarHBondContact OG-CB 3.48Å; S949-I954 PolarHBondContact OG-O 2.91Å; E951-I954 HydrophobicContact CB-CD1 4.37Å; E951-I954 PolarHBondContact O-N 2.81Å; I954-V1003 HydrophobicContact CG2-CG1 3.69Å; I954-E1004 WeakPolarHBondContact CA-O 3.49Å; I954-H1005 HydrophobicContact CG1-CB 4.35Å; I954-L1011 HydrophobicContact CD1-CD2 3.92Å; I954-L1011 HydrophobicContact CG1-CD2 4.19Å; I954-L1011 HydrophobicContact CG2-CD2 4.19Å
955	K	90.6	Very high	89.6	Confident	116 Å²	116	77.1 Å²	77.1	50%	0.504	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	123	177	-60.4	-178.6	180	178.2	0	110	V1003 E1004	K955-V1003 CarbonylContact O-C 3.56Å; K955-V1003 WeakPolarHBondContact O-CA 3.05Å; K955-E1004 HydrophobicContact CB-CB 4.21Å; K955-E1004 PolarHBondContact N-O 2.91Å; K955-E1004 PolarHBondContact O-N 3.15Å
956	V	91.4	Very high	89.1	Confident	37 Å²	37	77.6 Å²	77.6	22%	0.224	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	124	174.9	-174.3	0	0	0	0	109.2	V946 P947 Y1001 S1002 V1003	V946-V956 HydrophobicContact CG1-CG1 3.97Å; P947-V956 HydrophobicContact CG-CG1 3.99Å; P947-V956 HydrophobicContact CG-CG2 4.44Å; P947-V956 WeakPolarHBondContact O-CG1 3.48Å; V956-Y1001 HydrophobicContact CG1-CD2 4.31Å; V956-S1002 CarbonylContact C-O 3.58Å; V956-S1002 WeakPolarHBondContact CA-O 3.4Å; V956-V1003 HydrophobicContact CG2-CG2 4.32Å
957	N	91.9	Very high	88.7	Confident	68 Å²	68	84 Å²	84	36%	0.364	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	121	178.8	-59.6	-51.5	0	0	0	110.2	L959 Y1001 S1002	N957-L959 PolarHBondContact O-N 2.87Å; N957-Y1001 CarbonylContact O-C 3.54Å; N957-Y1001 WeakPolarHBondContact O-CA 3.29Å; N957-Y1001 VanDerWaalsContact O-CB 3.3Å; N957-Y1001 WeakPolarHBondContact O-CB 3.35Å; N957-S1002 PolarHBondContact N-O 3.05Å; N957-S1002 PolarHBondContact O-N 2.86Å
958	L	94.2	Very high	88.5	Confident	49 Å²	49	90.1 Å²	90.1	26%	0.257	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	122.3	170.2	-179.3	65.1	0	0	0	109.9	V946 E960 P961 I963 M977 V983 L999	V946-L958 HydrophobicContact CG2-CD1 4.02Å; L958-E960 WeakPolarHBondContact CD1-O 3.38Å; L958-P961 WeakPolarHBondContact CD2-O 3.31Å; L958-I963 HydrophobicContact CD2-CD1 3.75Å; L958-I963 HydrophobicContact CD2-CG1 4.13Å; L958-M977 HydrophobicContact CD2-CE 3.73Å; L958-V983 HydrophobicContact CD1-CG2 4.39Å; L958-V983 HydrophobicContact CD2-CG2 4.22Å; L958-L999 HydrophobicContact CD1-CD1 3.73Å
959	L	94.3	Very high	88.5	Confident	63 Å²	63	90.3 Å²	90.3	33%	0.33	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-49.1	179.8	-57.2	179.4	0	0	0	111.5	T923 N957 K1000	T923-L959 HydrophobicContact CG2-CD1 3.88Å; N957-L959 PolarHBondContact O-N 2.87Å; L959-K1000 WeakPolarHBondContact CA-O 3.45Å; L959-K1000 HydrophobicContact CB-CB 4.24Å; L959-K1000 HydrophobicContact CB-CD 4.26Å; L959-K1000 HydrophobicContact CB-CG 4.14Å; L959-K1000 WeakPolarHBondContact CB-O 3.46Å; L959-K1000 HydrophobicContact CD1-CD 4.22Å; L959-K1000 HydrophobicContact CD1-CG 4.14Å; L959-K1000 PolarHBondContact N-O 3.04Å
960	E	94.8	Very high	88.6	Confident	77 Å²	77	90.6 Å²	90.6	36%	0.36	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	135.3	175.9	-62	170.9	-156.5	0	0	109.3	L958 T998 L999 K1000	L958-E960 WeakPolarHBondContact CD1-O 3.38Å; E960-T998 VanDerWaalsContact OE2-CG2 3.26Å; E960-T998 WeakPolarHBondContact OE2-CG2 3.4Å; E960-L999 CarbonylContact O-C 3.59Å; E960-L999 WeakPolarHBondContact O-CA 3.35Å; E960-K1000 HydrophobicContact CB-CB 3.78Å; E960-K1000 HydrophobicContact CG-CB 4.22Å; E960-K1000 HydrophobicContact CG-CD 4.48Å; E960-K1000 PolarHBondContact N-O 3.05Å; E960-K1000 PolarHBondContact O-N 3.43Å
961	P	95.6	Very high	88.7	Confident	15 Å²	15	91.4 Å²	91.4	10%	0.097	44%	0.444	C	S	.	.	S	Bend	cis	-73.2	152.5	-2.3	31.5	-34.9	0	0	0	111.9	L958 I963 I975 V983 W985	L958-P961 WeakPolarHBondContact CD2-O 3.31Å; P961-I963 HydrophobicContact CG-CD1 4.28Å; P961-I963 HydrophobicContact CG-CG1 4.2Å; P961-I963 PolarHBondContact O-N 2.83Å; P961-I963 VanDerWaalsContact O-N 3.11Å; P961-I975 HydrophobicContact CB-CD1 4.19Å; P961-I975 HydrophobicContact CB-CG2 3.76Å; P961-I975 HydrophobicContact CG-CG2 3.42Å; P961-I975 VanDerWaalsContact CG-CG2 3.42Å; P961-V983 HydrophobicContact CG-CG1 3.71Å; P961-W985 HydrophobicContact CG-CZ2 4.02Å
962	T	93	Very high	88.9	Confident	127 Å²	127	93.6 Å²	93.6	78%	0.779	46%	0.459	S	S	*	.			trans	-75.3	100.7	175	-49.6	0	0	0	0	110.4
963	I	90.6	Very high	89.3	Confident	27 Å²	27	90.7 Å²	90.7	14%	0.138	44%	0.436	C	S	.	.			trans	-97.7	118	177.7	-56.7	174.2	0	0	0	109	L958 P961 H965 P966 I975 M977 V983	L958-I963 HydrophobicContact CD2-CD1 3.75Å; L958-I963 HydrophobicContact CD2-CG1 4.13Å; P961-I963 HydrophobicContact CG-CD1 4.28Å; P961-I963 HydrophobicContact CG-CG1 4.2Å; P961-I963 PolarHBondContact O-N 2.83Å; P961-I963 VanDerWaalsContact O-N 3.11Å; I963-H965 PolarHBondContact O-N 2.88Å; I963-P966 HydrophobicContact CG2-CB 4.36Å; I963-I975 HydrophobicContact CD1-CG2 4.24Å; I963-I975 HydrophobicContact CG1-CG2 4.1Å; I963-M977 HydrophobicContact CD1-CB 4.13Å; I963-M977 HydrophobicContact CD1-CE 4.49Å; I963-V983 HydrophobicContact CD1-CG1 4.33Å; I963-V983 HydrophobicContact CD1-CG2 4.29Å
964	K	85.4	Confident	89.6	Confident	153 Å²	153	89.1 Å²	89.1	67%	0.665	44%	0.437	S	S	*	.	S	Bend	trans	-74.7	122.4	171	-62.1	-176.5	-179	-178.9	0	108.4
965	H	83.8	Confident	90	Very high	119 Å²	119	90.5 Å²	90.5	55%	0.551	44%	0.444	S	S	*	.			trans	61.3	62.9	-178.6	-56.3	-70.6	0	0	0	114	I963 E967 K968	I963-H965 PolarHBondContact O-N 2.88Å; H965-E967 VanDerWaalsContact CA-OE2 3.25Å; H965-E967 WeakPolarHBondContact CA-OE2 3.39Å; H965-E967 WeakPolarHBondContact CB-OE1 3.48Å; H965-E967 IonicContact CG-OE1 3.04Å; H965-E967 IonicContact ND1-OE1 3.25Å; H965-E967 PolarHBondContact ND1-OE1 2.75Å; H965-E967 PolarHBondContact O-N 3.04Å; H965-E967 VanDerWaalsContact O-N 3.13Å; H965-K968 HydrophobicContact CB-CB 4.28Å; H965-K968 PolarHBondContact O-N 3.18Å
966	P	83.3	Confident	90.2	Very high	63 Å²	63	85.5 Å²	85.5	41%	0.409	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-22.3	178.8	27.4	-35.7	0	0	0	113.4	I963 K968 M977	I963-P966 HydrophobicContact CG2-CB 4.36Å; P966-K968 PolarHBondContact O-N 3.18Å; P966-M977 HydrophobicContact CB-CB 4.12Å; P966-M977 HydrophobicContact CB-CG 4.47Å
967	E	83.9	Confident	90.3	Very high	143 Å²	143	84.2 Å²	84.2	67%	0.668	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-18.6	174.2	71	-75.8	177.4	0	0	114	H965	H965-E967 VanDerWaalsContact CA-OE2 3.25Å; H965-E967 WeakPolarHBondContact CA-OE2 3.39Å; H965-E967 WeakPolarHBondContact CB-OE1 3.48Å; H965-E967 IonicContact CG-OE1 3.04Å; H965-E967 IonicContact ND1-OE1 3.25Å; H965-E967 PolarHBondContact ND1-OE1 2.75Å; H965-E967 PolarHBondContact O-N 3.04Å; H965-E967 VanDerWaalsContact O-N 3.13Å
968	K	86.8	Confident	90.2	Very high	157 Å²	157	82 Å²	82	68%	0.683	40%	0.402	S	S	*	.	S	Bend	trans	-112.5	104.8	-176.2	-171	178.8	-179.7	179.9	0	110.6	H965 P966 D970	H965-K968 HydrophobicContact CB-CB 4.28Å; H965-K968 PolarHBondContact O-N 3.18Å; P966-K968 PolarHBondContact O-N 3.18Å; K968-D970 PolarHBondContact O-N 3.29Å
969	Y	88	Confident	90	Very high	111 Å²	111	88.3 Å²	88.3	44%	0.435	43%	0.428	S	S	.	.			trans	-66.7	122.1	173	-173.5	-99.9	0	0	0	111.2	K971 R976 M977 N978 E984	Y969-K971 HydrophobicContact CE1-CB 4.09Å; Y969-R976 HydrophobicContact CD2-CG 4.42Å; Y969-R976 HydrophobicContact CE2-CG 3.96Å; Y969-R976 PolarHBondContact OH-NE 3.44Å; Y969-R976 VanDerWaalsContact OH-NE 3.09Å; Y969-M977 WeakPolarHBondContact CD2-O 3.45Å; Y969-N978 HydrophobicContact CD2-CB 4.17Å; Y969-N978 HydrophobicContact CE2-CB 4.04Å; Y969-E984 PolarHBondContact OH-OE2 2.86Å
970	D	88.1	Confident	89.7	Confident	49 Å²	49	92 Å²	92	26%	0.262	44%	0.441	S	S	.	.			trans	-126.4	104	176.2	-176.8	-3.4	0	0	0	109.3	K968 N972 R973 R976	K968-D970 PolarHBondContact O-N 3.29Å; D970-N972 PolarHBondContact O-N 2.69Å; D970-N972 VanDerWaalsContact O-N 3.1Å; D970-N972 WeakPolarHBondContact OD1-CB 3.27Å; D970-N972 PolarHBondContact OD1-N 2.76Å; D970-N972 VanDerWaalsContact OD1-N 3.12Å; D970-R973 HydrophobicContact CB-CG 4.03Å; D970-R973 PolarHBondContact O-N 3.15Å; D970-R973 VanDerWaalsContact O-N 3.09Å; D970-R973 WeakPolarHBondContact OD2-CG 3.3Å; D970-R973 IonicContact OD2-NE 3Å; D970-R973 PolarHBondContact OD2-NE 3.17Å; D970-R973 VanDerWaalsContact OD2-NE 3.16Å; D970-R976 WeakPolarHBondContact O-CD 3.31Å
971	K	85.4	Confident	89.5	Confident	122 Å²	122	90.4 Å²	90.4	53%	0.53	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-22.4	-177.7	-171.3	176.3	-178.8	175.9	0	112.8	Y969 R973	Y969-K971 HydrophobicContact CE1-CB 4.09Å; K971-R973 VanDerWaalsContact C-N 3.32Å
972	N	88.6	Confident	89.5	Confident	149 Å²	149	91.6 Å²	91.6	80%	0.797	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-9.2	-177.7	-60.1	-39.9	0	0	0	112.9	D970	D970-N972 PolarHBondContact O-N 2.69Å; D970-N972 VanDerWaalsContact O-N 3.1Å; D970-N972 WeakPolarHBondContact OD1-CB 3.27Å; D970-N972 PolarHBondContact OD1-N 2.76Å; D970-N972 VanDerWaalsContact OD1-N 3.12Å
973	R	92.3	Very high	89.6	Confident	108 Å²	108	85.6 Å²	85.6	41%	0.408	40%	0.404	S	S	.	.	S	Bend	trans	-86.1	135.2	177.3	-68.8	-177.9	-179.6	-117.9	-2.6	110.8	D970 K971 I975 R976	D970-R973 HydrophobicContact CB-CG 4.03Å; D970-R973 PolarHBondContact O-N 3.15Å; D970-R973 VanDerWaalsContact O-N 3.09Å; D970-R973 WeakPolarHBondContact OD2-CG 3.3Å; D970-R973 IonicContact OD2-NE 3Å; D970-R973 PolarHBondContact OD2-NE 3.17Å; D970-R973 VanDerWaalsContact OD2-NE 3.16Å; K971-R973 VanDerWaalsContact C-N 3.32Å; R973-I975 PolarHBondContact O-N 2.96Å; R973-R976 PolarHBondContact O-NH1 3.33Å
974	P	93	Very high	89.9	Confident	82 Å²	82	85.1 Å²	85.1	53%	0.532	40%	0.401	S	S	.	.	S	Bend	trans	-68.4	-24.4	178.4	28.2	-34.9	0	0	0	112.2	W985 D986	P974-W985 CarbonylContact O-C 3.46Å; P974-W985 WeakPolarHBondContact O-CA 3.21Å; P974-D986 PolarHBondContact O-N 3.47Å
975	I	95.1	Very high	90.5	Very high	65 Å²	65	78.2 Å²	78.2	33%	0.333	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	126.3	174.9	-50.7	178.8	0	0	0	108	P961 I963 R973 V983 E984	P961-I975 HydrophobicContact CB-CD1 4.19Å; P961-I975 HydrophobicContact CB-CG2 3.76Å; P961-I975 HydrophobicContact CG-CG2 3.42Å; P961-I975 VanDerWaalsContact CG-CG2 3.42Å; I963-I975 HydrophobicContact CD1-CG2 4.24Å; I963-I975 HydrophobicContact CG1-CG2 4.1Å; R973-I975 PolarHBondContact O-N 2.96Å; I975-V983 HydrophobicContact CG2-CG1 4.27Å; I975-E984 WeakPolarHBondContact CA-O 3.31Å
976	R	94.9	Very high	91	Very high	11 Å²	11	73.8 Å²	73.8	4%	0.042	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	162.4	-174.1	61.4	-168.2	-179.8	-87.4	-11.6	111.4	M941 Y969 D970 R973 E984	M941-R976 PolarHBondContact SD-NH2 2.91Å; M941-R976 VanDerWaalsContact SD-NH2 3.4Å; Y969-R976 HydrophobicContact CD2-CG 4.42Å; Y969-R976 HydrophobicContact CE2-CG 3.96Å; Y969-R976 PolarHBondContact OH-NE 3.44Å; Y969-R976 VanDerWaalsContact OH-NE 3.09Å; D970-R976 WeakPolarHBondContact O-CD 3.31Å; R973-R976 PolarHBondContact O-NH1 3.33Å; R976-E984 HydrophobicContact CG-CB 4.01Å; R976-E984 IonicContact CZ-OE2 3.86Å; R976-E984 PolarHBondContact N-O 3.39Å; R976-E984 VanDerWaalsContact N-O 3.1Å; R976-E984 IonicContact NE-OE2 2.68Å; R976-E984 PolarHBondContact NE-OE2 2.65Å; R976-E984 IonicContact NH2-OE2 3.5Å; R976-E984 PolarHBondContact NH2-OE2 2.78Å; R976-E984 PolarHBondContact O-N 3.32Å
977	M	92.6	Very high	91.7	Very high	10 Å²	10	71.3 Å²	71.3	5%	0.049	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	128.8	174.4	-174.8	67.5	77.6	0	0	108.5	V946 L958 I963 P966 Y969 N982 V983	V946-M977 HydrophobicContact CB-CE 4.27Å; V946-M977 HydrophobicContact CG2-CE 3.94Å; L958-M977 HydrophobicContact CD2-CE 3.73Å; I963-M977 HydrophobicContact CD1-CB 4.13Å; I963-M977 HydrophobicContact CD1-CE 4.49Å; P966-M977 HydrophobicContact CB-CB 4.12Å; P966-M977 HydrophobicContact CB-CG 4.47Å; Y969-M977 WeakPolarHBondContact CD2-O 3.45Å; M977-N982 WeakPolarHBondContact CA-O 3.44Å; M977-V983 HydrophobicContact CE-CG2 3.54Å; M977-V983 HydrophobicContact SD-CG2 4.02Å
978	N	91	Very high	92.2	Very high	23 Å²	23	67.9 Å²	67.9	12%	0.123	32%	0.321	C	S	.	.			trans	-90.4	175.1	178	76.6	19.6	0	0	0	112.4	Y969 F980 N981 N982 E984	Y969-N978 HydrophobicContact CD2-CB 4.17Å; Y969-N978 HydrophobicContact CE2-CB 4.04Å; N978-F980 PolarHBondContact O-N 3.42Å; N978-F980 VanDerWaalsContact O-N 3.1Å; N978-F980 WeakPolarHBondContact OD1-CA 3.26Å; N978-F980 PolarHBondContact OD1-N 3.45Å; N978-N981 PolarHBondContact O-N 3.42Å; N978-N981 VanDerWaalsContact O-N 3.09Å; N978-N982 PolarHBondContact N-O 3.42Å; N978-N982 PolarHBondContact OD1-N 3.23Å; N978-N982 VanDerWaalsContact OD1-N 3.11Å; N978-E984 HydrophobicContact CB-CG 4.48Å; N978-E984 WeakPolarHBondContact CB-OE1 3.49Å; N978-E984 PolarHBondContact ND2-OE1 3.1Å
979	K	89.9	Confident	92.6	Very high	181 Å²	181	60.4 Å²	60.4	79%	0.787	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-16.1	-176.8	68.6	178.5	-175.1	175.2	0	114.9	N981	K979-N981 VanDerWaalsContact C-N 3.35Å
980	F	87.9	Confident	93.1	Very high	140 Å²	140	55.5 Å²	55.5	61%	0.614	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	11.7	179.5	-58.4	-71.9	0	0	0	112.3	N978 N982	N978-F980 PolarHBondContact O-N 3.42Å; N978-F980 VanDerWaalsContact O-N 3.1Å; N978-F980 WeakPolarHBondContact OD1-CA 3.26Å; N978-F980 PolarHBondContact OD1-N 3.45Å; F980-N982 VanDerWaalsContact C-N 3.27Å; F980-N982 PolarHBondContact O-N 2.94Å
981	N	90.9	Very high	93.5	Very high	44 Å²	44	56.9 Å²	56.9	24%	0.235	28%	0.283	C	S	.	.	S	Bend	trans	61.4	32.9	-175.1	-152.2	47.5	0	0	0	113.7	V946 P947 V948 N978 K979	V946-N981 WeakPolarHBondContact CB-O 3.27Å; V946-N981 PolarHBondContact N-O 2.66Å; V946-N981 PolarHBondContact O-ND2 2.8Å; P947-N981 PolarHBondContact O-ND2 2.82Å; V948-N981 HydrophobicContact CG2-CB 3.44Å; V948-N981 VanDerWaalsContact CG2-CB 3.44Å; V948-N981 VanDerWaalsContact CG2-ND2 3.31Å; V948-N981 WeakPolarHBondContact CG2-ND2 3.27Å; N978-N981 PolarHBondContact O-N 3.42Å; N978-N981 VanDerWaalsContact O-N 3.09Å; K979-N981 VanDerWaalsContact C-N 3.35Å
982	N	94.3	Very high	94	Very high	40 Å²	40	53.1 Å²	53.1	21%	0.214	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	137.3	170.6	-56.8	-30.2	0	0	0	110.7	V943 D944 Q945 M977 N978 F980	V943-N982 HydrophobicContact CG1-CB 3.72Å; D944-N982 CarbonylContact O-C 3.58Å; D944-N982 WeakPolarHBondContact O-CA 3.5Å; D944-N982 WeakPolarHBondContact O-CB 2.97Å; Q945-N982 WeakPolarHBondContact CA-OD1 3.41Å; Q945-N982 WeakPolarHBondContact CB-OD1 3.43Å; M977-N982 WeakPolarHBondContact CA-O 3.44Å; N978-N982 PolarHBondContact N-O 3.42Å; N978-N982 PolarHBondContact OD1-N 3.23Å; N978-N982 VanDerWaalsContact OD1-N 3.11Å; F980-N982 VanDerWaalsContact C-N 3.27Å; F980-N982 PolarHBondContact O-N 2.94Å
983	V	95.8	Very high	94.4	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	130.2	170.5	178.5	0	0	0	0	108.7	V943 D944 V946 L958 P961 I963 I975 M977 W985 L999	V943-V983 WeakPolarHBondContact CA-O 3.3Å; D944-V983 PolarHBondContact N-O 2.84Å; D944-V983 PolarHBondContact O-N 2.69Å; V946-V983 HydrophobicContact CG2-CG2 3.76Å; L958-V983 HydrophobicContact CD1-CG2 4.39Å; L958-V983 HydrophobicContact CD2-CG2 4.22Å; P961-V983 HydrophobicContact CG-CG1 3.71Å; I963-V983 HydrophobicContact CD1-CG1 4.33Å; I963-V983 HydrophobicContact CD1-CG2 4.29Å; I975-V983 HydrophobicContact CG2-CG1 4.27Å; M977-V983 HydrophobicContact CE-CG2 3.54Å; M977-V983 HydrophobicContact SD-CG2 4.02Å; V983-W985 HydrophobicContact CB-CH2 3.82Å; V983-W985 HydrophobicContact CB-CZ2 4.3Å; V983-W985 HydrophobicContact CB-CZ3 3.97Å; V983-W985 HydrophobicContact CG1-CD2 3.91Å; V983-W985 HydrophobicContact CG1-CE3 3.94Å; V983-W985 HydrophobicContact CG1-CH2 3.48Å; V983-W985 VanDerWaalsContact CG1-CH2 3.48Å; V983-W985 HydrophobicContact CG1-CZ2 3.49Å; V983-W985 VanDerWaalsContact CG1-CZ2 3.49Å; V983-W985 HydrophobicContact CG1-CZ3 3.72Å; V983-L999 HydrophobicContact CB-CD1 4.38Å; V983-L999 HydrophobicContact CG2-CD1 3.84Å
984	E	96.9	Very high	94.6	Very high	17 Å²	17	48.2 Å²	48.2	8%	0.079	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	122.9	175.9	-60.2	-179.9	174.6	0	0	109.6	V942 V943 Y969 I975 R976 N978	V942-E984 CarbonylContact O-C 2.87Å; V942-E984 WeakPolarHBondContact O-CA 3.5Å; V943-E984 HydrophobicContact CG1-CG 4.33Å; V943-E984 HydrophobicContact CG2-CG 4.19Å; Y969-E984 PolarHBondContact OH-OE2 2.86Å; I975-E984 WeakPolarHBondContact CA-O 3.31Å; R976-E984 HydrophobicContact CG-CB 4.01Å; R976-E984 IonicContact CZ-OE2 3.86Å; R976-E984 PolarHBondContact N-O 3.39Å; R976-E984 VanDerWaalsContact N-O 3.1Å; R976-E984 IonicContact NE-OE2 2.68Å; R976-E984 PolarHBondContact NE-OE2 2.65Å; R976-E984 IonicContact NH2-OE2 3.5Å; R976-E984 PolarHBondContact NH2-OE2 2.78Å; R976-E984 PolarHBondContact O-N 3.32Å; N978-E984 HydrophobicContact CB-CG 4.48Å; N978-E984 WeakPolarHBondContact CB-OE1 3.49Å; N978-E984 PolarHBondContact ND2-OE1 3.1Å
985	W	97.4	Very high	94.9	Very high	8 Å²	8	47.8 Å²	47.8	3%	0.03	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	112.8	168.1	-60.2	-99.5	0	0	0	109.6	I928 M941 V942 D944 P961 P974 V983 L987 L997 L999	I928-W985 HydrophobicContact CD1-CZ3 4.45Å; M941-W985 CarbonylContact C-O 3.57Å; M941-W985 VanDerWaalsContact CA-O 3.29Å; M941-W985 WeakPolarHBondContact CA-O 3.36Å; V942-W985 HydrophobicContact CB-CB 4.38Å; V942-W985 HydrophobicContact CB-CE3 4.14Å; V942-W985 HydrophobicContact CG1-CE3 4.14Å; V942-W985 PolarHBondContact N-O 2.9Å; V942-W985 PolarHBondContact O-N 2.82Å; D944-W985 HydrophobicContact CB-CH2 4.45Å; D944-W985 HydrophobicContact CB-CZ3 4.06Å; P961-W985 HydrophobicContact CG-CZ2 4.02Å; P974-W985 CarbonylContact O-C 3.46Å; P974-W985 WeakPolarHBondContact O-CA 3.21Å; V983-W985 HydrophobicContact CB-CH2 3.82Å; V983-W985 HydrophobicContact CB-CZ2 4.3Å; V983-W985 HydrophobicContact CB-CZ3 3.97Å; V983-W985 HydrophobicContact CG1-CD2 3.91Å; V983-W985 HydrophobicContact CG1-CE3 3.94Å; V983-W985 HydrophobicContact CG1-CH2 3.48Å; V983-W985 VanDerWaalsContact CG1-CH2 3.48Å; V983-W985 HydrophobicContact CG1-CZ2 3.49Å; V983-W985 VanDerWaalsContact CG1-CZ2 3.49Å; V983-W985 HydrophobicContact CG1-CZ3 3.72Å; W985-L987 HydrophobicContact CB-CD2 3.88Å; W985-L987 HydrophobicContact CB-CG 4.12Å; W985-L997 HydrophobicContact CB-CD1 4.15Å; W985-L997 HydrophobicContact CD2-CD1 3.92Å; W985-L997 HydrophobicContact CE3-CD1 4.11Å; W985-L997 HydrophobicContact CG-CD1 3.96Å; W985-L997 HydrophobicContact CG-CD2 4.24Å; W985-L999 HydrophobicContact CH2-CB 3.94Å; W985-L999 HydrophobicContact CH2-CD1 4.19Å; W985-L999 HydrophobicContact CH2-CG 4.46Å; W985-L999 HydrophobicContact CZ2-CB 4.29Å
986	D	95.8	Very high	95	Very high	27 Å²	27	49.5 Å²	49.5	14%	0.144	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	98.5	171	-175.7	0.8	0	0	0	108.9	R939 P974	R939-D986 VanDerWaalsContact CG-OD1 3.3Å; R939-D986 WeakPolarHBondContact CG-OD1 3.4Å; R939-D986 IonicContact CZ-OD1 3.6Å; R939-D986 IonicContact CZ-OD2 3.73Å; R939-D986 IonicContact NE-OD1 3.73Å; R939-D986 PolarHBondContact NE-OD1 2.84Å; R939-D986 IonicContact NE-OD2 2.69Å; R939-D986 PolarHBondContact NE-OD2 2.89Å; R939-D986 IonicContact NH2-OD1 3.05Å; R939-D986 IonicContact NH2-OD2 3.56Å; R939-D986 PolarHBondContact NH2-OD2 3.05Å; P974-D986 PolarHBondContact O-N 3.47Å
987	L	96.1	Very high	95.1	Very high	11 Å²	11	49.6 Å²	49.6	6%	0.058	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	131.8	-173	-54.3	179.1	0	0	0	110.5	V930 R939 L940 V942 W985 L989 L997	V930-L987 HydrophobicContact CG2-CD1 3.66Å; R939-L987 CarbonylContact C-O 3.54Å; R939-L987 VanDerWaalsContact CA-O 3.28Å; R939-L987 WeakPolarHBondContact CA-O 3.36Å; L940-L987 PolarHBondContact N-O 3.1Å; L940-L987 WeakPolarHBondContact O-CB 3.12Å; L940-L987 PolarHBondContact O-N 3.29Å; V942-L987 HydrophobicContact CG2-CD1 3.88Å; W985-L987 HydrophobicContact CB-CD2 3.88Å; W985-L987 HydrophobicContact CB-CG 4.12Å; L987-L989 HydrophobicContact CB-CD2 4.31Å; L987-L989 HydrophobicContact CB-CG 4.19Å; L987-L989 HydrophobicContact CD1-CD2 4.5Å; L987-L997 HydrophobicContact CD1-CD1 4.07Å; L987-L997 HydrophobicContact CD1-CD2 4Å; L987-L997 HydrophobicContact CD1-CG 4.42Å; L987-L997 HydrophobicContact CD2-CD2 3.93Å
988	D	95.1	Very high	95.3	Very high	71 Å²	71	50.6 Å²	50.6	38%	0.38	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	108.9	164.1	-168.8	6.2	0	0	0	109	R937 R995	R937-D988 WeakPolarHBondContact CD-OD1 3.32Å; R937-D988 WeakPolarHBondContact CG-OD1 3.28Å; R937-D988 IonicContact CZ-OD1 3.21Å; R937-D988 IonicContact CZ-OD2 3.66Å; R937-D988 IonicContact NE-OD1 2.82Å; R937-D988 IonicContact NH1-OD1 2.95Å; R937-D988 PolarHBondContact NH1-OD1 2.86Å; R937-D988 IonicContact NH1-OD2 3.09Å; R937-D988 PolarHBondContact NH1-OD2 2.84Å; D988-R995 PolarHBondContact O-NH1 2.88Å; D988-R995 PolarHBondContact O-NH2 3.44Å
989	L	96.5	Very high	95.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	122.2	-174.3	-61.7	174.7	0	0	0	110.3	V930 N932 R937 V938 L940 L987 E993 R995	V930-L989 HydrophobicContact CG2-CD1 3.96Å; V930-L989 HydrophobicContact CG2-CD2 4.43Å; N932-L989 HydrophobicContact CB-CB 3.97Å; N932-L989 HydrophobicContact CB-CD1 4.39Å; N932-L989 PolarHBondContact ND2-O 2.91Å; R937-L989 CarbonylContact C-O 3.58Å; R937-L989 VanDerWaalsContact CA-O 3.31Å; R937-L989 WeakPolarHBondContact CA-O 3.35Å; V938-L989 PolarHBondContact N-O 2.84Å; V938-L989 PolarHBondContact O-N 2.81Å; L940-L989 HydrophobicContact CB-CD1 4.28Å; L940-L989 HydrophobicContact CD2-CD1 4.01Å; L987-L989 HydrophobicContact CB-CD2 4.31Å; L987-L989 HydrophobicContact CB-CG 4.19Å; L987-L989 HydrophobicContact CD1-CD2 4.5Å; L989-E993 WeakPolarHBondContact CA-OE2 3.39Å; L989-E993 HydrophobicContact CD2-CG 4.45Å; L989-R995 HydrophobicContact CD2-CB 3.73Å
990	G	96.9	Very high	95.9	Very high	8 Å²	8	42.8 Å²	42.8	8%	0.082	23%	0.225	C	C	.	.			trans	-67	169.7	172.1	0	0	0	0	0	113.2	N932 G992 E993	N932-G990 WeakPolarHBondContact CB-O 3.44Å; N932-G990 PolarHBondContact ND2-O 2.8Å; G990-G992 PolarHBondContact O-N 3.28Å; G990-E993 PolarHBondContact N-OE2 3.17Å; G990-E993 VanDerWaalsContact O-CB 3.28Å; G990-E993 WeakPolarHBondContact O-CB 3.28Å; G990-E993 PolarHBondContact O-N 3.33Å; G990-E993 VanDerWaalsContact O-N 3.11Å
991	P	96.6	Very high	96.2	Very high	78 Å²	78	37.3 Å²	37.3	51%	0.506	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	128.3	174.7	-22	32.6	0	0	0	111.4	F934 D935 E993	F934-P991 WeakPolarHBondContact O-CA 3.24Å; D935-P991 WeakPolarHBondContact O-CG 3.12Å; P991-E993 PolarHBondContact O-N 3.18Å; P991-E993 VanDerWaalsContact O-N 3.15Å
992	G	95.7	Very high	96.3	Very high	43 Å²	43	35.6 Å²	35.6	44%	0.443	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.6	-2.9	-178.6	0	0	0	0	0	115.9	N932 F934 G990	N932-G992 CarbonylContact O-C 3.57Å; N932-G992 WeakPolarHBondContact O-CA 3.45Å; N932-G992 PolarHBondContact O-N 3.13Å; N932-G992 VanDerWaalsContact O-N 3.14Å; F934-G992 PolarHBondContact O-N 3.44Å; G990-G992 PolarHBondContact O-N 3.28Å
993	E	97.7	Very high	96.2	Very high	62 Å²	62	34.1 Å²	34.1	29%	0.29	18%	0.184	S	C	.	.			trans	-66.2	136.8	-173.7	-169.7	-175.9	156.1	0	0	111.7	R931 N932 L989 G990 P991 R995	R931-E993 WeakPolarHBondContact CA-O 3.39Å; N932-E993 PolarHBondContact N-O 3.29Å; L989-E993 WeakPolarHBondContact CA-OE2 3.39Å; L989-E993 HydrophobicContact CD2-CG 4.45Å; G990-E993 PolarHBondContact N-OE2 3.17Å; G990-E993 VanDerWaalsContact O-CB 3.28Å; G990-E993 WeakPolarHBondContact O-CB 3.28Å; G990-E993 PolarHBondContact O-N 3.33Å; G990-E993 VanDerWaalsContact O-N 3.11Å; P991-E993 PolarHBondContact O-N 3.18Å; P991-E993 VanDerWaalsContact O-N 3.15Å; E993-R995 IonicContact OE1-CZ 3.17Å; E993-R995 VanDerWaalsContact OE1-CZ 3.23Å; E993-R995 IonicContact OE1-NE 3.19Å; E993-R995 PolarHBondContact OE1-NE 3.05Å; E993-R995 VanDerWaalsContact OE1-NE 3.09Å; E993-R995 IonicContact OE1-NH2 3.24Å; E993-R995 PolarHBondContact OE1-NH2 3.41Å; E993-R995 IonicContact OE2-NH2 2.83Å
994	I	97.4	Very high	95.9	Very high	91 Å²	91	36.7 Å²	36.7	47%	0.467	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	132.1	171.3	-56.4	175	0	0	0	108.2	E929 V930 R931	E929-I994 HydrophobicContact CG-CG2 3.67Å; V930-I994 CarbonylContact O-C 3.55Å; V930-I994 WeakPolarHBondContact O-CA 3.34Å; R931-I994 HydrophobicContact CB-CG1 3.97Å; R931-I994 HydrophobicContact CG-CD1 4.41Å; R931-I994 HydrophobicContact CG-CG1 3.72Å
995	R	97.4	Very high	95.4	Very high	73 Å²	73	37 Å²	37	28%	0.275	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	128.9	177.4	-163.8	172.1	-71.6	172.1	0.2	110.3	V930 D988 L989 E993 L997	V930-R995 HydrophobicContact CG2-CB 4.05Å; V930-R995 WeakPolarHBondContact CG2-O 3.34Å; V930-R995 PolarHBondContact N-O 3.06Å; V930-R995 PolarHBondContact O-N 3.48Å; D988-R995 PolarHBondContact O-NH1 2.88Å; D988-R995 PolarHBondContact O-NH2 3.44Å; L989-R995 HydrophobicContact CD2-CB 3.73Å; E993-R995 IonicContact OE1-CZ 3.17Å; E993-R995 VanDerWaalsContact OE1-CZ 3.23Å; E993-R995 IonicContact OE1-NE 3.19Å; E993-R995 PolarHBondContact OE1-NE 3.05Å; E993-R995 VanDerWaalsContact OE1-NE 3.09Å; E993-R995 IonicContact OE1-NH2 3.24Å; E993-R995 PolarHBondContact OE1-NH2 3.41Å; E993-R995 IonicContact OE2-NH2 2.83Å; R995-L997 HydrophobicContact CG-CD2 4.37Å
996	E	97.5	Very high	94.7	Very high	102 Å²	102	37.7 Å²	37.7	48%	0.477	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	129.9	174.1	-167	179.1	84.5	0	0	109.4	R904 I928	R904-E996 IonicContact CZ-OE2 3.54Å; R904-E996 IonicContact NH1-OE2 3.88Å; R904-E996 PolarHBondContact NH1-OE2 2.92Å; R904-E996 IonicContact NH2-OE2 3.16Å; R904-E996 PolarHBondContact NH2-OE2 2.88Å; I928-E996 CarbonylContact O-C 3.45Å; I928-E996 WeakPolarHBondContact O-CA 3.39Å
997	L	97.3	Very high	93.8	Very high	12 Å²	12	40.3 Å²	40.3	6%	0.063	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	141.2	175.7	-47.9	174.9	0	0	0	109	I928 V942 W985 L987 R995	I928-L997 HydrophobicContact CB-CB 4.26Å; I928-L997 PolarHBondContact N-O 3.36Å; I928-L997 PolarHBondContact O-N 3.17Å; V942-L997 HydrophobicContact CB-CD1 3.78Å; V942-L997 HydrophobicContact CG1-CD1 3.77Å; V942-L997 HydrophobicContact CG2-CD1 3.8Å; W985-L997 HydrophobicContact CB-CD1 4.15Å; W985-L997 HydrophobicContact CD2-CD1 3.92Å; W985-L997 HydrophobicContact CE3-CD1 4.11Å; W985-L997 HydrophobicContact CG-CD1 3.96Å; W985-L997 HydrophobicContact CG-CD2 4.24Å; L987-L997 HydrophobicContact CD1-CD1 4.07Å; L987-L997 HydrophobicContact CD1-CD2 4Å; L987-L997 HydrophobicContact CD1-CG 4.42Å; L987-L997 HydrophobicContact CD2-CD2 3.93Å; R995-L997 HydrophobicContact CG-CD2 4.37Å
998	T	97	Very high	92.9	Very high	31 Å²	31	47.1 Å²	47.1	19%	0.19	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	124.8	174.7	-60	0	0	0	0	109.7	K925 L927 E960 K1000	K925-T998 HydrophobicContact CD-CG2 4.38Å; K925-T998 HydrophobicContact CG-CG2 3.99Å; L927-T998 HydrophobicContact CD2-CG2 4.13Å; L927-T998 WeakPolarHBondContact CD2-OG1 3.3Å; E960-T998 VanDerWaalsContact OE2-CG2 3.26Å; E960-T998 WeakPolarHBondContact OE2-CG2 3.4Å; T998-K1000 HydrophobicContact CG2-CB 4.4Å
999	L	97	Very high	91.7	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	117.5	165.4	178.6	63.5	0	0	0	108.4	K925 Q926 D944 V946 L958 E960 V983 W985 Y1001	K925-L999 CarbonylContact C-O 3.51Å; K925-L999 WeakPolarHBondContact CA-O 3.28Å; Q926-L999 HydrophobicContact CB-CB 4.21Å; Q926-L999 PolarHBondContact N-O 3.3Å; Q926-L999 PolarHBondContact O-N 3.21Å; D944-L999 HydrophobicContact CB-CD2 4.01Å; V946-L999 HydrophobicContact CG2-CD1 3.89Å; V946-L999 HydrophobicContact CG2-CD2 4.48Å; L958-L999 HydrophobicContact CD1-CD1 3.73Å; E960-L999 CarbonylContact O-C 3.59Å; E960-L999 WeakPolarHBondContact O-CA 3.35Å; V983-L999 HydrophobicContact CB-CD1 4.38Å; V983-L999 HydrophobicContact CG2-CD1 3.84Å; W985-L999 HydrophobicContact CH2-CB 3.94Å; W985-L999 HydrophobicContact CH2-CD1 4.19Å; W985-L999 HydrophobicContact CH2-CG 4.46Å; W985-L999 HydrophobicContact CZ2-CB 4.29Å; L999-Y1001 HydrophobicContact CG-CD1 4.33Å
1000	K	96.4	Very high	90.4	Very high	39 Å²	39	52.8 Å²	52.8	17%	0.17	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	127.2	-179.5	-166.5	-175.6	177.2	-179.2	0	109.7	Y909 T923 F924 K925 L959 E960 T998	Y909-K1000 WeakPolarHBondContact OH-CE 3.38Å; Y909-K1000 PolarHBondContact OH-NZ 3.43Å; T923-K1000 HydrophobicContact CG2-CD 4.35Å; T923-K1000 HydrophobicContact CG2-CG 3.98Å; F924-K1000 CarbonylContact O-C 3.58Å; F924-K1000 WeakPolarHBondContact O-CA 3.24Å; F924-K1000 WeakPolarHBondContact O-CG 3.36Å; K925-K1000 HydrophobicContact CB-CG 4.26Å; L959-K1000 WeakPolarHBondContact CA-O 3.45Å; L959-K1000 HydrophobicContact CB-CB 4.24Å; L959-K1000 HydrophobicContact CB-CD 4.26Å; L959-K1000 HydrophobicContact CB-CG 4.14Å; L959-K1000 WeakPolarHBondContact CB-O 3.46Å; L959-K1000 HydrophobicContact CD1-CD 4.22Å; L959-K1000 HydrophobicContact CD1-CG 4.14Å; L959-K1000 PolarHBondContact N-O 3.04Å; E960-K1000 HydrophobicContact CB-CB 3.78Å; E960-K1000 HydrophobicContact CG-CB 4.22Å; E960-K1000 HydrophobicContact CG-CD 4.48Å; E960-K1000 PolarHBondContact N-O 3.05Å; E960-K1000 PolarHBondContact O-N 3.43Å; T998-K1000 HydrophobicContact CG2-CB 4.4Å
1001	Y	94.9	Very high	89	Confident	25 Å²	25	54.9 Å²	54.9	10%	0.098	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	153.3	175.1	59.2	-91.8	0	0	0	110.3	F924 P947 V956 N957 L999 V1003	F924-Y1001 HydrophobicContact CB-CD1 4.35Å; F924-Y1001 HydrophobicContact CB-CD2 4.08Å; F924-Y1001 HydrophobicContact CB-CE1 3.9Å; F924-Y1001 HydrophobicContact CB-CE2 3.59Å; F924-Y1001 HydrophobicContact CB-CG 4.43Å; F924-Y1001 VanDerWaalsContact CB-CZ 3.48Å; F924-Y1001 HydrophobicContact CD1-CE2 4.49Å; F924-Y1001 AromaticContact CD2-CD2 3.87Å; F924-Y1001 HydrophobicContact CD2-CD2 3.87Å; F924-Y1001 AromaticContact CD2-CE2 3.36Å; F924-Y1001 HydrophobicContact CD2-CE2 3.36Å; F924-Y1001 HydrophobicContact CE2-CE2 4.15Å; F924-Y1001 HydrophobicContact CG-CD2 4.3Å; F924-Y1001 AromaticContact CG-CE2 3.57Å; F924-Y1001 HydrophobicContact CG-CE2 3.57Å; F924-Y1001 AromaticContact CG-CZ 3.77Å; F924-Y1001 PolarHBondContact N-O 3.48Å; F924-Y1001 PolarHBondContact O-N 3.34Å; P947-Y1001 HydrophobicContact CG-CD2 3.95Å; P947-Y1001 HydrophobicContact CG-CE2 3.47Å; P947-Y1001 VanDerWaalsContact CG-CE2 3.47Å; V956-Y1001 HydrophobicContact CG1-CD2 4.31Å; N957-Y1001 CarbonylContact O-C 3.54Å; N957-Y1001 WeakPolarHBondContact O-CA 3.29Å; N957-Y1001 VanDerWaalsContact O-CB 3.3Å; N957-Y1001 WeakPolarHBondContact O-CB 3.35Å; L999-Y1001 HydrophobicContact CG-CD1 4.33Å; Y1001-V1003 HydrophobicContact CD2-CG2 4.03Å; Y1001-V1003 HydrophobicContact CE2-CG2 4.06Å
1002	S	93.1	Very high	87.5	Confident	7 Å²	7	57 Å²	57	5%	0.049	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	146.9	172	62.5	0	0	0	0	111.4	M922 V956 N957	M922-S1002 CarbonylContact O-C 3.53Å; M922-S1002 VanDerWaalsContact O-CA 3.29Å; M922-S1002 WeakPolarHBondContact O-CA 3.2Å; V956-S1002 CarbonylContact C-O 3.58Å; V956-S1002 WeakPolarHBondContact CA-O 3.4Å; N957-S1002 PolarHBondContact N-O 3.05Å; N957-S1002 PolarHBondContact O-N 2.86Å
1003	V	91.8	Very high	85.8	Confident	10 Å²	10	59.8 Å²	59.8	6%	0.061	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	115.2	175	-176	0	0	0	0	107.5	T921 M922 F924 I954 K955 V956 Y1001 L1011	T921-V1003 WeakPolarHBondContact CA-O 3.47Å; M922-V1003 PolarHBondContact N-O 2.84Å; M922-V1003 PolarHBondContact O-N 3.3Å; F924-V1003 HydrophobicContact CD2-CG2 4.02Å; F924-V1003 HydrophobicContact CE2-CB 4.09Å; F924-V1003 HydrophobicContact CE2-CG2 3.64Å; I954-V1003 HydrophobicContact CG2-CG1 3.69Å; K955-V1003 CarbonylContact O-C 3.56Å; K955-V1003 WeakPolarHBondContact O-CA 3.05Å; V956-V1003 HydrophobicContact CG2-CG2 4.32Å; Y1001-V1003 HydrophobicContact CD2-CG2 4.03Å; Y1001-V1003 HydrophobicContact CE2-CG2 4.06Å; V1003-L1011 HydrophobicContact CB-CD1 4.4Å; V1003-L1011 HydrophobicContact CG1-CD1 3.85Å; V1003-L1011 HydrophobicContact CG1-CD2 3.91Å
1004	E	89.8	Confident	83.7	Confident	54 Å²	54	61.8 Å²	61.8	25%	0.252	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	128.4	172.4	-53.2	-178.9	175.7	0	0	109.4	A920 T921 I954 K955	A920-E1004 WeakPolarHBondContact O-CA 3.48Å; T921-E1004 HydrophobicContact CG2-CG 4.12Å; I954-E1004 WeakPolarHBondContact CA-O 3.49Å; K955-E1004 HydrophobicContact CB-CB 4.21Å; K955-E1004 PolarHBondContact N-O 2.91Å; K955-E1004 PolarHBondContact O-N 3.15Å
1005	H	85.3	Confident	81.6	Confident	22 Å²	22	61.5 Å²	61.5	10%	0.102	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	161.3	179.1	68.2	97.8	0	0	0	111.3	N919 A920 I954 E1009 L1011	N919-H1005 CarbonylContact C-O 3.5Å; N919-H1005 VanDerWaalsContact CA-O 3.27Å; N919-H1005 WeakPolarHBondContact CA-O 3.21Å; A920-H1005 PolarHBondContact N-O 3.38Å; A920-H1005 PolarHBondContact O-N 3.02Å; I954-H1005 HydrophobicContact CG1-CB 4.35Å; H1005-E1009 PolarHBondContact ND1-O 3.16Å; H1005-E1009 VanDerWaalsContact ND1-O 3.11Å; H1005-L1011 HydrophobicContact CB-CD1 4.44Å; H1005-L1011 HydrophobicContact CB-CD2 3.88Å; H1005-L1011 HydrophobicContact CB-CG 4.11Å; H1005-L1011 WeakPolarHBondContact CD2-CD1 3.31Å
1006	P	84	Confident	79	Confident	24 Å²	24	62.7 Å²	62.7	16%	0.156	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	137.3	173.7	-21.7	34.1	0	0	0	111.4	K953 N1008 E1009	K953-P1006 HydrophobicContact CB-CG 4.08Å; K953-P1006 HydrophobicContact CD-CG 4.09Å; P1006-N1008 PolarHBondContact O-N 3.33Å; P1006-N1008 VanDerWaalsContact O-N 3.1Å; P1006-E1009 HydrophobicContact CB-CB 4.31Å; P1006-E1009 HydrophobicContact CB-CG 4.25Å; P1006-E1009 PolarHBondContact O-N 3.02Å; P1006-E1009 VanDerWaalsContact O-N 3.16Å
1007	I	77.3	Confident	76.1	Confident	81 Å²	81	63.1 Å²	63.1	42%	0.415	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-19.2	-174.6	-165.5	159	0	0	0	114.4	K918 A920	K918-I1007 PolarHBondContact O-N 2.86Å; A920-I1007 HydrophobicContact CB-CG1 4.47Å
1008	N	76.6	Confident	72.9	Confident	155 Å²	155	73.1 Å²	73.1	83%	0.829	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	3.2	-178	-60.9	-14.8	0	0	0	113.2	P1006	P1006-N1008 PolarHBondContact O-N 3.33Å; P1006-N1008 VanDerWaalsContact O-N 3.1Å
1009	E	70.2	Confident	71.6	Confident	74 Å²	74	75.3 Å²	75.3	35%	0.346	41%	0.414	S	S	.	.	S	Bend	trans	-120.2	127.3	-179.1	-66.6	176.9	-169.4	0	0	108.6	K953 H1005 P1006	K953-E1009 IonicContact NZ-OE1 2.76Å; K953-E1009 PolarHBondContact NZ-OE1 3.3Å; K953-E1009 IonicContact NZ-OE2 3.64Å; H1005-E1009 PolarHBondContact ND1-O 3.16Å; H1005-E1009 VanDerWaalsContact ND1-O 3.11Å; P1006-E1009 HydrophobicContact CB-CB 4.31Å; P1006-E1009 HydrophobicContact CB-CG 4.25Å; P1006-E1009 PolarHBondContact O-N 3.02Å; P1006-E1009 VanDerWaalsContact O-N 3.16Å
1010	D	67.9	Low	70.3	Confident	115 Å²	115	79.1 Å²	79.1	62%	0.615	44%	0.435	S	S	*	.			trans	-72.4	139.9	174.9	-82.8	-14.6	0	0	0	110.7	R421	R421-D1010 IonicContact NH1-OD2 3.19Å
1011	L	68.4	Low	68.9	Low	52 Å²	52	81.3 Å²	81.3	27%	0.272	45%	0.45	S	S	.	.			trans	-80.9	121.9	171.4	-77.7	169.5	0	0	0	109.8	I954 V1003 H1005	I954-L1011 HydrophobicContact CD1-CD2 3.92Å; I954-L1011 HydrophobicContact CG1-CD2 4.19Å; I954-L1011 HydrophobicContact CG2-CD2 4.19Å; V1003-L1011 HydrophobicContact CB-CD1 4.4Å; V1003-L1011 HydrophobicContact CG1-CD1 3.85Å; V1003-L1011 HydrophobicContact CG1-CD2 3.91Å; H1005-L1011 HydrophobicContact CB-CD1 4.44Å; H1005-L1011 HydrophobicContact CB-CD2 3.88Å; H1005-L1011 HydrophobicContact CB-CG 4.11Å; H1005-L1011 WeakPolarHBondContact CD2-CD1 3.31Å
1012	D	64	Low	67.3	Low	123 Å²	123	84.6 Å²	84.6	66%	0.658	47%	0.471	S	S	*	.			trans	-107.2	137.5	163	-164.7	10.7	0	0	0	109.9
1013	V	61.8	Low	65.7	Low	102 Å²	102	89.5 Å²	89.5	62%	0.618	50%	0.497	S	S	*	.			trans	-122.1	91.5	-179.6	-176.5	0	0	0	0	108.1
1014	S	53.3	Low	64	Low	104 Å²	104	94.8 Å²	94.8	73%	0.727	53%	0.526	S	S	*	.			trans	-84.8	138.5	171.6	60.3	0	0	0	0	111
1015	V	51.8	Low	62.1	Low	84 Å²	84	97.7 Å²	97.7	51%	0.509	55%	0.546	S	S	.	.			trans	-94.3	115.5	164.3	-178.5	0	0	0	0	107	E1017	V1015-E1017 PolarHBondContact O-N 3.19Å
1016	S	44.7	Very low	60.4	Low	98 Å²	98	103.5 Å²	103.5	69%	0.685	58%	0.58	S	S	*	*			trans	-72.8	114.2	168.3	55	0	0	0	0	108.7
1017	E	35.4	Very low	58.4	Low	111 Å²	111	110.2 Å²	110.2	52%	0.519	62%	0.616	S	S	.	*			trans	-68.7	132.5	163.3	-69.1	-177.5	-173.6	0	0	108.1	Q36 S37 V1015	Q36-E1017 VanDerWaalsContact C-OE1 3.27Å; Q36-E1017 VanDerWaalsContact O-OE1 3.09Å; S37-E1017 WeakPolarHBondContact CA-OE1 3.49Å; S37-E1017 PolarHBondContact N-OE1 3.05Å; V1015-E1017 PolarHBondContact O-N 3.19Å
1018	N	29.2	Very low	56.7	Low	223 Å²	223	112.8 Å²	112.8	100%	1.193	63%	0.634	S	S	*	*			trans	-128.2	0	-171.4	-146.1	64.9	0	0	0	109.9

Retrieved 1,018 of 1,018 residues in 581.3 ms (Link to these results)

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